A0A087X859_POEFO Loading...

Cytoplasmic FMR1-interacting protein

AlphaFold DB (A0A3Q3BDV3), UniProt , Accession A0A087X859, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,252 aa.

						>A0A087X859_POEFO|A0A087X859
MTTHVTLEDALSNVDLLEELPLPDQQPCIEPPPSSIMYQANFDTNFEDRNAFVTGIARYIEQATVHSSMNEMLEEGHEYAVMLYTWRSCSRAIPQVKCNEQPNRVEIYEKTVEVLEPEVTKLMKFMYFQRKAIERFCSEVKRLCHAERRKDFVSEAYLLTLGKFINMFAVLDELKNMKCSVKNDHSAYKRAAQFLRKMADPQSIQESQNLSMFLANHNRITQCLHQQLEVIPGYEELLADIVNICVDYYENKMYLTPSEKHMLLKVMGFGLYLMDGNVSNIYKLDAKKRINLSKIDKFFKLQVVPLFGDMQIELSRYIETSAHYEENKSRWTCTQSSISPQYNLCEQMVQIRDDHIRFISELARYSNSEVVTGSGLDSQKSDEEYRELFDLALRGLQLLSKWSTHVMEVYSWKLVHPTDKFCNKDCPGTAEEYERATRYNYTSEEKFALVEVIAMIKGLQVLMGRMESVFNQAIRNTIYAALQDFAQVTLREPLRQAVRKKKNVLISVLQAIRKTVCDWEGGREPPNDPCLRGEKDPKGGFDIKVPRRAVGPSSTQLYMVRTMLESLIADKSGSKKTLRSSLDGPIVVAIEDFHKHSFFFTHLLNFSEALQQCCDLSQLWFREFFLELTMGRRIQFPIEMSMPWILTDHILETKEPSMMEYVLYPLDLYNDSGYYALTKFKKQFLYDEIEAEVNLCFDQFVYKLADQIFAYYKAMAGSVLLDKRFRAECKNYGVIIPYPPSNRYETLLKQRHVQLLGRSIDLNRLITQRISAAMYKSLDHAISRFESEDLTSIVELEWLLEINRLTHRLLSKHMTLDSFDAMFREANHNVSAPYGRITLHVFWELNFDFLPNYCYNGSTNRFVRTAIPFTQEPQRDKPANVQPYYLYGSKPLNIAYSHIYSSYRNFVGPPHFKTICRLLGYQGIAVVMEELLKIVKSLLQGTILQYVKTLIEVMPKICRLPRHEYGSPGILEFFHHQLKDIIEYAELKTDVFQSLREVGNAILFCLLIEQALSQEEVCDLLHAAPFQNILPRVYIKEGERLEVRMKRLEAKYAPLHLVPLIERLGTPQQIAIAREGDLLTKERLCCGLSMFEVILTRIRSFLQDAVWRGPPPTNGVMHVDECMEFHRLWSAMQFVYCIPVGTHEFTAEQCFGDGLNWAGCAIIVLLGQQRRFDLFDFCYHLLKVQRQDGKDEIIKNVPLKKMADRIRKYQILNNEIFAILNKYMKAVETDSSTVEHVRCFQPPIHQSLATTC
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.1	Very low	47.2	Very low	242 Å²	242	123.1 Å²	123.1	100%	1.192	67%	0.667	S	S	*	*				0	95.4	0	-73.9	177.6	-178.3	0	0	106.6
2	T	33.4	Very low	46.9	Very low	131 Å²	131	118.2 Å²	118.2	80%	0.804	65%	0.649	S	S	*	*			trans	-85.6	103.5	177.7	38.6	0	0	0	0	107.4	H4	T2-H4 PolarHBondContact O-N 3.11Å
3	T	40.1	Very low	47.4	Very low	129 Å²	129	116.4 Å²	116.4	79%	0.791	64%	0.638	S	S	*	*			trans	-68.8	117.3	173.3	37.3	0	0	0	0	108.5	V5	T3-V5 PolarHBondContact O-N 3.17Å
4	H	41.2	Very low	47.7	Very low	178 Å²	178	114.2 Å²	114.2	82%	0.824	63%	0.63	S	S	*	*			trans	-66.2	113.1	171.9	-80.7	-83.8	0	0	0	108.3	T2 T6	T2-H4 PolarHBondContact O-N 3.11Å; H4-T6 PolarHBondContact O-N 3.15Å
5	V	39.7	Very low	47.7	Very low	105 Å²	105	111.8 Å²	111.8	64%	0.636	62%	0.616	S	S	*	*			trans	-67	125.6	167.3	-178.8	0	0	0	0	107	T3 D9	T3-V5 PolarHBondContact O-N 3.17Å; V5-D9 HydrophobicContact CG1-CB 3.71Å
6	T	65.4	Low	47.7	Very low	61 Å²	61	110.6 Å²	110.6	37%	0.374	61%	0.608	S	S	.	*			trans	-73.6	159.1	179.1	65.4	0	0	0	0	110.2	H4 E8 D9 A10	H4-T6 PolarHBondContact O-N 3.15Å; T6-E8 PolarHBondContact O-N 3.32Å; T6-D9 PolarHBondContact N-OD2 3.15Å; T6-D9 PolarHBondContact O-N 3.21Å; T6-D9 PolarHBondContact OG1-N 3.43Å; T6-D9 VanDerWaalsContact OG1-N 3.14Å; T6-D9 PolarHBondContact OG1-OD2 3.42Å; T6-A10 PolarHBondContact O-N 2.95Å; T6-A10 VanDerWaalsContact O-N 3.1Å
7	L	56.3	Low	47.6	Very low	136 Å²	136	111.3 Å²	111.3	71%	0.712	61%	0.609	S	S	*	*	H	α-helix	trans	-60.1	-32.2	174.8	-180	63.3	0	0	0	111.2	A10 L11	L7-A10 PolarHBondContact O-N 2.93Å; L7-L11 HydrophobicContact CD1-CD1 4.42Å; L7-L11 HydrophobicContact CG-CD1 3.96Å; L7-L11 WeakPolarHBondContact O-CB 3.49Å; L7-L11 WeakPolarHBondContact O-CD1 3.32Å; L7-L11 WeakPolarHBondContact O-CG 3.4Å; L7-L11 PolarHBondContact O-N 3.49Å
8	E	47.7	Very low	47.3	Very low	152 Å²	152	114.2 Å²	114.2	71%	0.71	62%	0.618	S	S	*	*	H	α-helix	trans	-67.4	-42.5	177.2	-71.7	150.2	168.6	0	0	111.5	T6 A10 L11 S12	T6-E8 PolarHBondContact O-N 3.32Å; E8-A10 VanDerWaalsContact C-N 3.31Å; E8-A10 PolarHBondContact O-N 3.21Å; E8-L11 PolarHBondContact O-N 3.18Å; E8-S12 VanDerWaalsContact O-CB 3.3Å; E8-S12 WeakPolarHBondContact O-CB 3.48Å; E8-S12 PolarHBondContact O-N 3.32Å
9	D	52.8	Low	47	Very low	83 Å²	83	115 Å²	115	44%	0.444	62%	0.617	S	S	.	*	H	α-helix	trans	-65	-35	173.6	-65	-42.2	0	0	0	112.1	V5 T6 N13	V5-D9 HydrophobicContact CG1-CB 3.71Å; T6-D9 PolarHBondContact N-OD2 3.15Å; T6-D9 PolarHBondContact O-N 3.21Å; T6-D9 PolarHBondContact OG1-N 3.43Å; T6-D9 VanDerWaalsContact OG1-N 3.14Å; T6-D9 PolarHBondContact OG1-OD2 3.42Å; D9-N13 WeakPolarHBondContact O-CB 3.45Å; D9-N13 VanDerWaalsContact O-CG 3.24Å; D9-N13 PolarHBondContact O-N 3.29Å; D9-N13 VanDerWaalsContact O-N 3.11Å; D9-N13 PolarHBondContact O-ND2 3.06Å
10	A	56.1	Low	46.7	Very low	45 Å²	45	114.8 Å²	114.8	37%	0.372	62%	0.615	S	S	.	*	H	α-helix	trans	-71.3	-40.1	177.1	0	0	0	0	0	112.1	T6 L7 E8 V14	T6-A10 PolarHBondContact O-N 2.95Å; T6-A10 VanDerWaalsContact O-N 3.1Å; L7-A10 PolarHBondContact O-N 2.93Å; E8-A10 VanDerWaalsContact C-N 3.31Å; E8-A10 PolarHBondContact O-N 3.21Å; A10-V14 WeakPolarHBondContact O-CG2 3.49Å; A10-V14 PolarHBondContact O-N 3.12Å
11	L	50.2	Low	46.5	Very low	92 Å²	92	114.8 Å²	114.8	48%	0.482	62%	0.622	S	S	.	*	H	α-helix	trans	-65.5	-46.5	174	-76.5	161.4	0	0	0	110.9	L7 E8 N13 V14 D15	L7-L11 HydrophobicContact CD1-CD1 4.42Å; L7-L11 HydrophobicContact CG-CD1 3.96Å; L7-L11 WeakPolarHBondContact O-CB 3.49Å; L7-L11 WeakPolarHBondContact O-CD1 3.32Å; L7-L11 WeakPolarHBondContact O-CG 3.4Å; L7-L11 PolarHBondContact O-N 3.49Å; E8-L11 PolarHBondContact O-N 3.18Å; L11-N13 VanDerWaalsContact C-N 3.28Å; L11-N13 PolarHBondContact O-N 3.43Å; L11-V14 CarbonylContact O-C 3.56Å; L11-V14 WeakPolarHBondContact O-CA 3.17Å; L11-V14 WeakPolarHBondContact O-CB 3.13Å; L11-V14 PolarHBondContact O-N 3.47Å; L11-D15 PolarHBondContact O-N 3.24Å
12	S	44.3	Very low	47	Very low	64 Å²	64	110.5 Å²	110.5	45%	0.448	60%	0.603	S	S	.	*	H	α-helix	trans	-61.7	-35.6	179.2	-163.2	0	0	0	0	112.4	E8 D15 L16	E8-S12 VanDerWaalsContact O-CB 3.3Å; E8-S12 WeakPolarHBondContact O-CB 3.48Å; E8-S12 PolarHBondContact O-N 3.32Å; S12-D15 PolarHBondContact O-N 3.16Å; S12-L16 WeakPolarHBondContact O-CB 3.3Å; S12-L16 WeakPolarHBondContact O-CD1 3.3Å; S12-L16 PolarHBondContact O-N 2.84Å
13	N	53.2	Low	47.4	Very low	95 Å²	95	109.9 Å²	109.9	51%	0.508	60%	0.601	S	S	.	*	H	α-helix	trans	-69.2	-29	172.8	-76.4	-43	0	0	0	113.7	D9 L11 L17	D9-N13 WeakPolarHBondContact O-CB 3.45Å; D9-N13 VanDerWaalsContact O-CG 3.24Å; D9-N13 PolarHBondContact O-N 3.29Å; D9-N13 VanDerWaalsContact O-N 3.11Å; D9-N13 PolarHBondContact O-ND2 3.06Å; L11-N13 VanDerWaalsContact C-N 3.28Å; L11-N13 PolarHBondContact O-N 3.43Å; N13-L17 WeakPolarHBondContact O-CG 3.46Å; N13-L17 PolarHBondContact O-N 3.03Å
14	V	52	Low	47.9	Very low	86 Å²	86	108 Å²	108	52%	0.521	59%	0.586	S	S	.	*	H	α-helix	trans	-75.8	-40.6	173.5	172	0	0	0	0	110.3	A10 L11 L16 L17 E18	A10-V14 WeakPolarHBondContact O-CG2 3.49Å; A10-V14 PolarHBondContact O-N 3.12Å; L11-V14 CarbonylContact O-C 3.56Å; L11-V14 WeakPolarHBondContact O-CA 3.17Å; L11-V14 WeakPolarHBondContact O-CB 3.13Å; L11-V14 PolarHBondContact O-N 3.47Å; V14-L16 VanDerWaalsContact C-N 3.29Å; V14-L16 PolarHBondContact O-N 3.34Å; V14-L17 WeakPolarHBondContact O-CB 3.07Å; V14-L17 PolarHBondContact O-N 3.5Å; V14-E18 PolarHBondContact O-N 2.94Å; V14-E18 VanDerWaalsContact O-N 3.11Å
15	D	47.5	Very low	48.5	Very low	78 Å²	78	107.8 Å²	107.8	42%	0.417	59%	0.586	S	S	.	*	H	α-helix	trans	-60.8	-39.7	174.3	-59.8	-25	0	0	0	110.8	L11 S12 L17 E18 E19	L11-D15 PolarHBondContact O-N 3.24Å; S12-D15 PolarHBondContact O-N 3.16Å; D15-L17 VanDerWaalsContact C-N 3.27Å; D15-L17 PolarHBondContact O-N 2.94Å; D15-E18 WeakPolarHBondContact O-CB 3.09Å; D15-E18 PolarHBondContact O-N 3.37Å; D15-E18 VanDerWaalsContact O-N 3.1Å; D15-E19 WeakPolarHBondContact O-CG 3.34Å; D15-E19 PolarHBondContact O-N 2.68Å
16	L	46.8	Very low	49.8	Very low	93 Å²	93	104.2 Å²	104.2	49%	0.487	56%	0.562	S	S	.	*	H	α-helix	trans	-61.9	-28.5	172.9	-95.2	148	0	0	0	114	S12 V14 L20	S12-L16 WeakPolarHBondContact O-CB 3.3Å; S12-L16 WeakPolarHBondContact O-CD1 3.3Å; S12-L16 PolarHBondContact O-N 2.84Å; V14-L16 VanDerWaalsContact C-N 3.29Å; V14-L16 PolarHBondContact O-N 3.34Å; L16-L20 PolarHBondContact O-N 2.92Å
17	L	46.6	Very low	49.7	Very low	122 Å²	122	102.9 Å²	102.9	64%	0.639	55%	0.554	S	S	*	*	H	α-helix	trans	-80	-28.2	174.3	-69.9	167.5	0	0	0	112	N13 V14 D15 L20	N13-L17 WeakPolarHBondContact O-CG 3.46Å; N13-L17 PolarHBondContact O-N 3.03Å; V14-L17 WeakPolarHBondContact O-CB 3.07Å; V14-L17 PolarHBondContact O-N 3.5Å; D15-L17 VanDerWaalsContact C-N 3.27Å; D15-L17 PolarHBondContact O-N 2.94Å; L17-L20 HydrophobicContact CD2-CD1 3.99Å
18	E	42.1	Very low	50	Low	163 Å²	163	99.8 Å²	99.8	76%	0.762	54%	0.543	S	S	*	.	H	α-helix	trans	-76	-30.5	173.2	-164.7	168.6	-170	0	0	111.7	V14 D15	V14-E18 PolarHBondContact O-N 2.94Å; V14-E18 VanDerWaalsContact O-N 3.11Å; D15-E18 WeakPolarHBondContact O-CB 3.09Å; D15-E18 PolarHBondContact O-N 3.37Å; D15-E18 VanDerWaalsContact O-N 3.1Å
19	E	42.2	Very low	51.1	Low	130 Å²	130	93.3 Å²	93.3	61%	0.607	51%	0.513	S	S	*	.	S	Bend	trans	-81.3	-12	175	-72.7	-175.6	175.1	0	0	114.3	D15 P21	D15-E19 WeakPolarHBondContact O-CG 3.34Å; D15-E19 PolarHBondContact O-N 2.68Å; E19-P21 WeakPolarHBondContact O-CD 3.5Å; E19-P21 VanDerWaalsContact O-N 3.13Å
20	L	40.6	Very low	51.5	Low	110 Å²	110	90.2 Å²	90.2	58%	0.576	50%	0.496	S	S	*	.	S	Bend	trans	-66	111.5	177.3	-108.4	158.8	0	0	0	109.1	L16 L17 L22	L16-L20 PolarHBondContact O-N 2.92Å; L17-L20 HydrophobicContact CD2-CD1 3.99Å; L20-L22 PolarHBondContact O-N 3.3Å
21	P	41.6	Very low	51.6	Low	115 Å²	115	88.7 Å²	88.7	75%	0.747	48%	0.483	S	S	*	.			trans	-65.7	106.2	178.3	27	-31.8	0	0	0	107.8	E19	E19-P21 WeakPolarHBondContact O-CD 3.5Å; E19-P21 VanDerWaalsContact O-N 3.13Å
22	L	47.2	Very low	51.9	Low	152 Å²	152	86.7 Å²	86.7	80%	0.796	48%	0.475	S	S	*	.			trans	-53.9	139.2	158	-67.9	168.2	0	0	0	106.1	L20 D24	L20-L22 PolarHBondContact O-N 3.3Å; L22-D24 PolarHBondContact O-N 3.49Å
23	P	42.1	Very low	52.4	Low	119 Å²	119	87 Å²	87	77%	0.773	48%	0.475	S	S	*	.			trans	-71.7	66.3	177	30.4	-33.9	0	0	0	109	Q25	P23-Q25 PolarHBondContact O-N 2.99Å
24	D	49.9	Very low	52.3	Low	88 Å²	88	85.8 Å²	85.8	47%	0.471	47%	0.474	S	S	.	.			trans	-74.2	109.8	164.5	-169.5	-1.6	0	0	0	107	L22 Q26 H752	L22-D24 PolarHBondContact O-N 3.49Å; D24-Q26 PolarHBondContact O-N 3.49Å; D24-Q26 WeakPolarHBondContact OD1-CB 3.44Å; D24-Q26 PolarHBondContact OD1-N 2.89Å; D24-Q26 VanDerWaalsContact OD1-N 3.16Å; D24-H752 IonicContact OD2-CD2 3.24Å; D24-H752 IonicContact OD2-CE1 3.57Å; D24-H752 PolarHBondContact OD2-CE1 3.31Å; D24-H752 IonicContact OD2-NE2 3Å; D24-H752 PolarHBondContact OD2-NE2 2.79Å
25	Q	54.8	Low	51.8	Low	175 Å²	175	85.3 Å²	85.3	82%	0.818	48%	0.475	S	S	*	.			trans	-78.1	7.2	-178.9	-62.1	-176.7	-1.4	0	0	112.1	P23	P23-Q25 PolarHBondContact O-N 2.99Å
26	Q	67.4	Low	51.5	Low	30 Å²	30	89.9 Å²	89.9	14%	0.14	50%	0.498	C	S	.	.			trans	-69	127.6	177.3	-176.8	169	-45.2	0	0	111.7	D24 C28 H752	D24-Q26 PolarHBondContact O-N 3.49Å; D24-Q26 WeakPolarHBondContact OD1-CB 3.44Å; D24-Q26 PolarHBondContact OD1-N 2.89Å; D24-Q26 VanDerWaalsContact OD1-N 3.16Å; Q26-C28 PolarHBondContact O-N 3.33Å; Q26-H752 PolarHBondContact NE2-CE1 2.86Å; Q26-H752 VanDerWaalsContact NE2-CE1 3.29Å; Q26-H752 PolarHBondContact NE2-ND1 2.92Å; Q26-H752 PolarHBondContact OE1-CD2 3.45Å; Q26-H752 PolarHBondContact OE1-CE1 3.37Å; Q26-H752 VanDerWaalsContact OE1-CE1 3.28Å; Q26-H752 PolarHBondContact OE1-NE2 3.06Å; Q26-H752 VanDerWaalsContact OE1-NE2 3.13Å
27	P	63.1	Low	51.4	Low	32 Å²	32	89.9 Å²	89.9	21%	0.208	50%	0.496	C	S	.	.			trans	-64.1	131.5	170.3	-20.3	32.6	0	0	0	111.1	I29 T746 K749 Q750	P27-I29 VanDerWaalsContact C-N 3.26Å; P27-I29 HydrophobicContact CB-CG2 4.43Å; P27-I29 PolarHBondContact O-N 3.28Å; P27-T746 HydrophobicContact CB-CG2 4.26Å; P27-T746 HydrophobicContact CG-CG2 4.29Å; P27-K749 VanDerWaalsContact CD-CB 3.48Å; P27-K749 HydrophobicContact CG-CB 4.05Å; P27-K749 HydrophobicContact CG-CD 3.8Å; P27-Q750 PolarHBondContact O-NE2 3.25Å; P27-Q750 VanDerWaalsContact O-NE2 3.08Å
28	C	61.6	Low	51	Low	72 Å²	72	94.5 Å²	94.5	49%	0.486	51%	0.506	S	S	.	.			trans	-75.8	76.4	174.9	-166.5	0	0	0	0	110.3	Q26 R465	Q26-C28 PolarHBondContact O-N 3.33Å; C28-R465 PolarHBondContact SG-NH2 3.46Å
29	I	70.3	Confident	51.5	Low	15 Å²	15	90.2 Å²	90.2	8%	0.077	49%	0.486	C	S	.	.			trans	-106.2	24.1	171.8	57	159.4	0	0	0	111.5	P27 L663 Y664 L747 Q750	P27-I29 VanDerWaalsContact C-N 3.26Å; P27-I29 HydrophobicContact CB-CG2 4.43Å; P27-I29 PolarHBondContact O-N 3.28Å; I29-L663 HydrophobicContact CD1-CD1 3.7Å; I29-L663 HydrophobicContact CG1-CD1 4.13Å; I29-Y664 WeakPolarHBondContact CA-OH 3.39Å; I29-L747 HydrophobicContact CD1-CD2 3.85Å; I29-Q750 HydrophobicContact CD1-CG 4.1Å; I29-Q750 HydrophobicContact CG1-CG 4.38Å; I29-Q750 VanDerWaalsContact CG1-NE2 3.32Å
30	E	61.7	Low	51.7	Low	19 Å²	19	86.7 Å²	86.7	9%	0.089	48%	0.48	C	S	.	.	S	Bend	trans	-132.7	149.5	-179.2	-71	-177.2	-160	0	0	110.7	L663 Q750 V753 Q754	E30-L663 HydrophobicContact CG-CB 4.29Å; E30-L663 HydrophobicContact CG-CD1 3.88Å; E30-L663 WeakPolarHBondContact OE1-CD1 3.37Å; E30-Q750 PolarHBondContact OE1-OE1 3.21Å; E30-V753 WeakPolarHBondContact OE1-CA 3.36Å; E30-V753 WeakPolarHBondContact OE1-CB 3.47Å; E30-V753 WeakPolarHBondContact OE1-CG1 3.48Å; E30-V753 VanDerWaalsContact OE1-CG2 3.24Å; E30-V753 WeakPolarHBondContact OE1-CG2 3.19Å; E30-V753 VanDerWaalsContact OE2-CA 3.29Å; E30-V753 WeakPolarHBondContact OE2-CA 3.14Å; E30-Q754 PolarHBondContact OE2-N 3.39Å
31	P	58.8	Low	52.5	Low	13 Å²	13	87 Å²	87	8%	0.084	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-68.2	168.2	170.5	22.2	-24.5	0	0	0	112.5	K457 D667	P31-K457 HydrophobicContact CB-CB 4.1Å; P31-K457 HydrophobicContact CB-CD 4.32Å; P31-K457 HydrophobicContact CB-CG 4.37Å; P31-K457 HydrophobicContact CG-CD 4.17Å; P31-D667 HydrophobicContact CG-CB 3.48Å; P31-D667 VanDerWaalsContact CG-CB 3.48Å; P31-D667 VanDerWaalsContact CG-OD1 3.25Å; P31-D667 WeakPolarHBondContact CG-OD1 3.29Å; P31-D667 WeakPolarHBondContact CG-OD2 3.37Å
32	P	56.6	Low	53.5	Low	49 Å²	49	88.8 Å²	88.8	32%	0.318	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-70.5	143.7	-177.1	24.8	-17.8	0	0	0	109.8	S34 V461	P32-S34 PolarHBondContact O-N 3.02Å; P32-V461 HydrophobicContact CB-CG2 4.36Å; P32-V461 HydrophobicContact CG-CG2 4.04Å
33	P	54	Low	54.5	Low	71 Å²	71	85 Å²	85	46%	0.461	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-56	126.3	176.8	19.1	-28.5	0	0	0	109.8	S35 Q754	P33-S35 PolarHBondContact O-N 3.24Å; P33-Q754 HydrophobicContact CB-CB 4.35Å; P33-Q754 HydrophobicContact CB-CG 3.99Å
34	S	51.7	Low	55.8	Low	69 Å²	69	81.8 Å²	81.8	48%	0.483	44%	0.437	S	S	.	.			trans	-75.4	59.1	167.9	-62	0	0	0	0	109.4	P32	P32-S34 PolarHBondContact O-N 3.02Å
35	S	42.2	Very low	57	Low	76 Å²	76	79.6 Å²	79.6	53%	0.531	43%	0.425	S	S	.	.			trans	-64.6	160.2	166.4	45	0	0	0	0	109.4	P33 M37	P33-S35 PolarHBondContact O-N 3.24Å; S35-M37 VanDerWaalsContact C-N 3.26Å; S35-M37 WeakPolarHBondContact O-CG 3.11Å; S35-M37 PolarHBondContact O-N 3.41Å
36	I	39.9	Very low	58	Low	175 Å²	175	72.1 Å²	72.1	90%	0.897	39%	0.39	S	S	*	.			trans	-57.8	93	174.3	-59.5	170.2	0	0	0	107.9	Y38	I36-Y38 PolarHBondContact O-N 3.35Å
37	M	44.4	Very low	58.3	Low	92 Å²	92	78 Å²	78	45%	0.453	42%	0.417	S	S	.	.			trans	-75.3	111.1	177.2	-69.7	-115.5	-78.6	0	0	106.9	S35 Q39	S35-M37 VanDerWaalsContact C-N 3.26Å; S35-M37 WeakPolarHBondContact O-CG 3.11Å; S35-M37 PolarHBondContact O-N 3.41Å; M37-Q39 PolarHBondContact O-N 3.42Å; M37-Q39 VanDerWaalsContact O-N 3.12Å
38	Y	39.7	Very low	58.9	Low	219 Å²	219	78.7 Å²	78.7	86%	0.859	42%	0.42	S	S	*	.			trans	-74.8	98.9	169.8	-177.1	-96.5	0	0	0	108.1	I36	I36-Y38 PolarHBondContact O-N 3.35Å
39	Q	51.7	Low	59.4	Low	73 Å²	73	77 Å²	77	34%	0.341	40%	0.403	S	S	.	.			trans	-94	121.3	175.9	-79.4	176.8	-18.4	0	0	110	M37 N41 S607	M37-Q39 PolarHBondContact O-N 3.42Å; M37-Q39 VanDerWaalsContact O-N 3.12Å; Q39-N41 PolarHBondContact O-N 3.1Å; Q39-S607 PolarHBondContact NE2-OG 3.26Å
40	A	46.3	Very low	59.5	Low	56 Å²	56	81.9 Å²	81.9	46%	0.463	43%	0.429	S	S	.	.			trans	-76.3	106.3	168.8	0	0	0	0	0	109	F42	A40-F42 HydrophobicContact CB-CD2 4.33Å; A40-F42 HydrophobicContact CB-CE1 4.4Å; A40-F42 HydrophobicContact CB-CE2 3.6Å; A40-F42 HydrophobicContact CB-CZ 3.65Å; A40-F42 WeakPolarHBondContact O-CD2 3.3Å; A40-F42 PolarHBondContact O-N 3.36Å
41	N	58.7	Low	59.8	Low	116 Å²	116	84.8 Å²	84.8	62%	0.62	46%	0.456	S	S	*	.			trans	-81.1	112.6	170.3	-174.8	1.6	0	0	0	109.2	Q39 D43	Q39-N41 PolarHBondContact O-N 3.1Å; N41-D43 WeakPolarHBondContact OD1-CB 3.48Å; N41-D43 PolarHBondContact OD1-N 3.23Å
42	F	61.2	Low	60.2	Low	154 Å²	154	85.7 Å²	85.7	68%	0.675	46%	0.459	S	S	*	.			trans	-94.2	1.7	177.3	-62.8	-77.6	0	0	0	113.2	A40 T44	A40-F42 HydrophobicContact CB-CD2 4.33Å; A40-F42 HydrophobicContact CB-CE1 4.4Å; A40-F42 HydrophobicContact CB-CE2 3.6Å; A40-F42 HydrophobicContact CB-CZ 3.65Å; A40-F42 WeakPolarHBondContact O-CD2 3.3Å; A40-F42 PolarHBondContact O-N 3.36Å; F42-T44 PolarHBondContact O-N 2.95Å
43	D	68.2	Low	60	Low	73 Å²	73	89 Å²	89	39%	0.39	48%	0.478	S	S	.	.			trans	-77.4	112.6	174.4	-168.5	3.3	0	0	0	110.7	N41 N45 S554	N41-D43 WeakPolarHBondContact OD1-CB 3.48Å; N41-D43 PolarHBondContact OD1-N 3.23Å; D43-N45 VanDerWaalsContact C-N 3.31Å; D43-N45 PolarHBondContact O-N 2.84Å; D43-N45 PolarHBondContact OD1-N 3.19Å; D43-N45 VanDerWaalsContact OD1-N 3.09Å; D43-S554 WeakPolarHBondContact OD1-CB 3.48Å; D43-S554 PolarHBondContact OD1-OG 3.3Å
44	T	69	Low	60	Low	50 Å²	50	89.4 Å²	89.4	31%	0.307	48%	0.479	S	S	.	.			trans	-85.9	4.1	-179.1	59	0	0	0	0	113.3	F42 F46 E47 D48	F42-T44 PolarHBondContact O-N 2.95Å; T44-F46 PolarHBondContact O-N 3.39Å; T44-E47 WeakPolarHBondContact O-CB 3.41Å; T44-E47 VanDerWaalsContact O-CG 3.24Å; T44-E47 WeakPolarHBondContact O-CG 3.45Å; T44-E47 PolarHBondContact O-N 2.9Å; T44-D48 PolarHBondContact OG1-OD1 3.28Å
45	N	76	Confident	60.1	Low	42 Å²	42	86.7 Å²	86.7	23%	0.225	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.5	38.4	-172.5	-171.4	29.2	0	0	0	112.9	D43 E47 S67	D43-N45 VanDerWaalsContact C-N 3.31Å; D43-N45 PolarHBondContact O-N 2.84Å; D43-N45 PolarHBondContact OD1-N 3.19Å; D43-N45 VanDerWaalsContact OD1-N 3.09Å; N45-E47 PolarHBondContact O-N 3.13Å; N45-S67 PolarHBondContact ND2-OG 3Å; N45-S67 VanDerWaalsContact ND2-OG 3.13Å; N45-S67 PolarHBondContact O-OG 3.25Å
46	F	76.4	Confident	61	Low	19 Å²	19	86 Å²	86	8%	0.083	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	67	23.7	-179.1	-38.2	-63	0	0	0	116.7	T44 D48 R49 T555 Y558	T44-F46 PolarHBondContact O-N 3.39Å; F46-D48 VanDerWaalsContact C-N 3.25Å; F46-D48 PolarHBondContact O-N 3.3Å; F46-R49 HydrophobicContact CB-CB 4.41Å; F46-R49 WeakPolarHBondContact O-CB 3.2Å; F46-R49 WeakPolarHBondContact O-CD 3.38Å; F46-R49 WeakPolarHBondContact O-CG 3.35Å; F46-R49 VanDerWaalsContact O-CZ 3.31Å; F46-R49 PolarHBondContact O-N 3Å; F46-R49 VanDerWaalsContact O-N 3.13Å; F46-R49 PolarHBondContact O-NE 2.94Å; F46-T555 VanDerWaalsContact CA-CG2 3.45Å; F46-T555 HydrophobicContact CB-CG2 3.93Å; F46-T555 HydrophobicContact CD1-CG2 3.88Å; F46-T555 HydrophobicContact CG-CG2 4.42Å; F46-Y558 HydrophobicContact CD1-CD1 4.32Å; F46-Y558 HydrophobicContact CD1-CG 4.32Å; F46-Y558 AromaticContact CE1-CD1 3.86Å; F46-Y558 HydrophobicContact CE1-CD1 3.86Å; F46-Y558 HydrophobicContact CE1-CD2 4.01Å; F46-Y558 AromaticContact CE1-CG 3.46Å; F46-Y558 HydrophobicContact CE1-CG 3.46Å; F46-Y558 VanDerWaalsContact CE1-CG 3.46Å; F46-Y558 HydrophobicContact CZ-CD1 4.08Å; F46-Y558 AromaticContact CZ-CD2 3.7Å; F46-Y558 HydrophobicContact CZ-CD2 3.7Å; F46-Y558 HydrophobicContact CZ-CE2 4.22Å; F46-Y558 AromaticContact CZ-CG 3.63Å; F46-Y558 HydrophobicContact CZ-CG 3.63Å
47	E	72.6	Confident	62.2	Low	152 Å²	152	81.2 Å²	81.2	71%	0.71	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-55.6	-38.9	176.5	-80.6	178.5	-177.7	0	0	113.2	T44 N45 R49	T44-E47 WeakPolarHBondContact O-CB 3.41Å; T44-E47 VanDerWaalsContact O-CG 3.24Å; T44-E47 WeakPolarHBondContact O-CG 3.45Å; T44-E47 PolarHBondContact O-N 2.9Å; N45-E47 PolarHBondContact O-N 3.13Å; E47-R49 VanDerWaalsContact C-N 3.25Å; E47-R49 PolarHBondContact O-N 3.48Å
48	D	75.1	Confident	63.5	Low	48 Å²	48	80 Å²	80	26%	0.257	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-81	5.9	-179.3	59.6	-52.9	0	0	0	114.1	T44 F46 N50 A51 F52 T555	T44-D48 PolarHBondContact OG1-OD1 3.28Å; F46-D48 VanDerWaalsContact C-N 3.25Å; F46-D48 PolarHBondContact O-N 3.3Å; D48-N50 PolarHBondContact O-N 3.39Å; D48-A51 VanDerWaalsContact O-CB 3.3Å; D48-A51 WeakPolarHBondContact O-CB 3.5Å; D48-A51 PolarHBondContact O-N 3.32Å; D48-F52 WeakPolarHBondContact OD2-CE2 3.21Å; D48-T555 VanDerWaalsContact CG-CG2 3.46Å; D48-T555 WeakPolarHBondContact OD1-CG2 3.42Å; D48-T555 PolarHBondContact OD2-OG1 3.3Å
49	R	72.3	Confident	65.3	Low	37 Å²	37	70.4 Å²	70.4	14%	0.14	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-51.1	-32.8	179.4	65.9	-170.9	125.9	-140.9	-1.6	114.3	F46 E47 A51 F52 I60 A63 T64 S67	F46-R49 HydrophobicContact CB-CB 4.41Å; F46-R49 WeakPolarHBondContact O-CB 3.2Å; F46-R49 WeakPolarHBondContact O-CD 3.38Å; F46-R49 WeakPolarHBondContact O-CG 3.35Å; F46-R49 VanDerWaalsContact O-CZ 3.31Å; F46-R49 PolarHBondContact O-N 3Å; F46-R49 VanDerWaalsContact O-N 3.13Å; F46-R49 PolarHBondContact O-NE 2.94Å; E47-R49 VanDerWaalsContact C-N 3.25Å; E47-R49 PolarHBondContact O-N 3.48Å; R49-A51 PolarHBondContact O-N 3.37Å; R49-F52 PolarHBondContact O-N 3.12Å; R49-I60 HydrophobicContact CB-CG2 4.49Å; R49-I60 HydrophobicContact CG-CG2 4.35Å; R49-A63 PolarHBondContact NH1-O 3.07Å; R49-A63 VanDerWaalsContact NH1-O 3.11Å; R49-T64 VanDerWaalsContact NH1-CA 3.26Å; R49-S67 PolarHBondContact NH1-OG 3.49Å; R49-S67 PolarHBondContact NH2-OG 3.32Å
50	N	72.8	Confident	66.4	Low	117 Å²	117	68.2 Å²	68.2	63%	0.626	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-72.3	-15.9	-178.5	-69.2	-28.9	0	0	0	112.9	D48 F52 V53	D48-N50 PolarHBondContact O-N 3.39Å; N50-F52 VanDerWaalsContact C-N 3.28Å; N50-V53 WeakPolarHBondContact O-CG2 3.46Å
51	A	68.4	Low	67.8	Low	79 Å²	79	71 Å²	71	65%	0.653	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-72.6	-22.7	174.8	0	0	0	0	0	112.3	D48 R49 V53	D48-A51 VanDerWaalsContact O-CB 3.3Å; D48-A51 WeakPolarHBondContact O-CB 3.5Å; D48-A51 PolarHBondContact O-N 3.32Å; R49-A51 PolarHBondContact O-N 3.37Å; A51-V53 VanDerWaalsContact C-N 3.33Å; A51-V53 PolarHBondContact O-N 3.16Å
52	F	67.4	Low	68.6	Low	32 Å²	32	66.4 Å²	66.4	14%	0.14	36%	0.36	C	S	.	.			trans	-95.4	45.6	-176.7	-53.9	-76.4	0	0	0	112.8	D48 R49 N50 T54 G55 T515 T555 Q556	D48-F52 WeakPolarHBondContact OD2-CE2 3.21Å; R49-F52 PolarHBondContact O-N 3.12Å; N50-F52 VanDerWaalsContact C-N 3.28Å; F52-T54 PolarHBondContact O-N 2.89Å; F52-G55 PolarHBondContact O-N 3.28Å; F52-T515 HydrophobicContact CD1-CG2 3.77Å; F52-T515 HydrophobicContact CE1-CG2 4.14Å; F52-T515 HydrophobicContact CG-CG2 4.31Å; F52-T555 HydrophobicContact CE2-CG2 4.5Å; F52-T555 WeakPolarHBondContact CE2-OG1 3.49Å; F52-Q556 HydrophobicContact CE1-CG 3.79Å; F52-Q556 HydrophobicContact CZ-CG 3.65Å
53	V	52.8	Low	69.5	Low	119 Å²	119	59.1 Å²	59.1	72%	0.721	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-18.3	-174.1	-172.7	0	0	0	0	114.1	N50 A51 G55	N50-V53 WeakPolarHBondContact O-CG2 3.46Å; A51-V53 VanDerWaalsContact C-N 3.33Å; A51-V53 PolarHBondContact O-N 3.16Å; V53-G55 VanDerWaalsContact C-N 3.3Å; V53-G55 PolarHBondContact O-N 3.41Å
54	T	53.5	Low	70.2	Confident	80 Å²	80	58.7 Å²	58.7	49%	0.491	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-4.7	178.8	51	0	0	0	0	115	F52 K514	F52-T54 PolarHBondContact O-N 2.89Å; T54-K514 HydrophobicContact CG2-CD 4.24Å
55	G	53.2	Low	70.8	Confident	11 Å²	11	57.6 Å²	57.6	11%	0.113	32%	0.321	C	S	.	.	S	Bend	trans	-72.2	152.2	174.1	0	0	0	0	0	112.8	F52 V53 A57	F52-G55 PolarHBondContact O-N 3.28Å; V53-G55 VanDerWaalsContact C-N 3.3Å; V53-G55 PolarHBondContact O-N 3.41Å; G55-A57 PolarHBondContact O-N 3.21Å; G55-A57 VanDerWaalsContact O-N 3.09Å
56	I	62.3	Low	71.1	Confident	63 Å²	63	56 Å²	56	32%	0.323	31%	0.312	S	S	.	.			trans	-58.2	118.8	168	-64.2	162.6	0	0	0	107	R58 Y59 V508	I56-R58 HydrophobicContact CG2-CB 3.94Å; I56-R58 PolarHBondContact O-N 3.41Å; I56-Y59 HydrophobicContact CB-CD2 3.86Å; I56-Y59 HydrophobicContact CB-CE2 3.9Å; I56-Y59 HydrophobicContact CD1-CE2 3.94Å; I56-Y59 HydrophobicContact CG1-CE2 4.42Å; I56-Y59 HydrophobicContact CG2-CE2 4.48Å; I56-Y59 PolarHBondContact O-N 3.1Å; I56-V508 HydrophobicContact CD1-CG2 3.71Å
57	A	63.4	Low	71.4	Confident	74 Å²	74	55.2 Å²	55.2	61%	0.612	31%	0.309	S	S	*	.	H	α-helix	trans	-46.2	-29.4	-173	0	0	0	0	0	114.4	G55 Y59 I60 E61	G55-A57 PolarHBondContact O-N 3.21Å; G55-A57 VanDerWaalsContact O-N 3.09Å; A57-Y59 PolarHBondContact O-N 2.89Å; A57-I60 PolarHBondContact O-N 2.88Å; A57-E61 PolarHBondContact O-N 3.18Å
58	R	72.8	Confident	72.1	Confident	67 Å²	67	50.1 Å²	50.1	25%	0.253	29%	0.29	S	S	.	.	H	α-helix	trans	-52.7	-42.7	173.8	-178.5	-179.6	168.5	158.7	-0.5	114.4	I56 Q62 D151 F152	I56-R58 HydrophobicContact CG2-CB 3.94Å; I56-R58 PolarHBondContact O-N 3.41Å; R58-Q62 WeakPolarHBondContact O-CB 3.45Å; R58-Q62 PolarHBondContact O-N 3.38Å; R58-D151 IonicContact NH1-OD1 2.73Å; R58-D151 IonicContact NH1-OD2 2.95Å; R58-D151 IonicContact NH2-OD2 2.72Å; R58-F152 PolarHBondContact NH2-O 3.48Å
59	Y	76.6	Confident	72.7	Confident	16 Å²	16	47.9 Å²	47.9	6%	0.063	28%	0.278	C	S	.	.	H	α-helix	trans	-75.4	-33.3	-177	-60.3	-69	0	0	0	111.9	I56 A57 Q62 A63 F152 T562 M563 S566	I56-Y59 HydrophobicContact CB-CD2 3.86Å; I56-Y59 HydrophobicContact CB-CE2 3.9Å; I56-Y59 HydrophobicContact CD1-CE2 3.94Å; I56-Y59 HydrophobicContact CG1-CE2 4.42Å; I56-Y59 HydrophobicContact CG2-CE2 4.48Å; I56-Y59 PolarHBondContact O-N 3.1Å; A57-Y59 PolarHBondContact O-N 2.89Å; Y59-Q62 PolarHBondContact O-N 3.08Å; Y59-A63 WeakPolarHBondContact O-CB 3.39Å; Y59-A63 PolarHBondContact O-N 3.02Å; Y59-F152 HydrophobicContact CE1-CE1 4.49Å; Y59-T562 HydrophobicContact CD1-CG2 3.77Å; Y59-T562 HydrophobicContact CE1-CG2 4.12Å; Y59-M563 HydrophobicContact CD2-CG 4.01Å; Y59-M563 HydrophobicContact CE2-CG 3.89Å; Y59-M563 HydrophobicContact CG-CG 4.43Å; Y59-S566 WeakPolarHBondContact OH-CB 3.45Å; Y59-S566 PolarHBondContact OH-OG 3.36Å
60	I	74.7	Confident	73.5	Confident	27 Å²	27	48 Å²	48	14%	0.138	28%	0.281	C	S	.	.	H	α-helix	trans	-68	-42.7	175.8	-59.6	172.4	0	0	0	110	R49 A57 A63 T64 M559	R49-I60 HydrophobicContact CB-CG2 4.49Å; R49-I60 HydrophobicContact CG-CG2 4.35Å; A57-I60 PolarHBondContact O-N 2.88Å; I60-A63 PolarHBondContact O-N 2.97Å; I60-T64 PolarHBondContact O-N 2.91Å; I60-T64 PolarHBondContact O-OG1 3.13Å; I60-M559 HydrophobicContact CG1-CE 4.06Å
61	E	76	Confident	74.3	Confident	116 Å²	116	47.9 Å²	47.9	54%	0.542	28%	0.277	S	S	.	.	H	α-helix	trans	-61.5	-43.8	173.7	-170.4	-176.4	178.1	0	0	111.2	A57 T64 V65	A57-E61 PolarHBondContact O-N 3.18Å; E61-T64 WeakPolarHBondContact O-CB 3.48Å; E61-T64 PolarHBondContact O-N 3.48Å; E61-T64 VanDerWaalsContact O-N 3.16Å; E61-V65 WeakPolarHBondContact O-CG2 3.29Å; E61-V65 PolarHBondContact O-N 3.38Å
62	Q	76.7	Confident	75.5	Confident	19 Å²	19	44.9 Å²	44.9	9%	0.089	25%	0.25	C	C	.	.	H	α-helix	trans	-62.9	-42.8	176.2	-171.7	176.7	-11.2	0	0	112.2	R58 Y59 T64 V65 H66 S154	R58-Q62 WeakPolarHBondContact O-CB 3.45Å; R58-Q62 PolarHBondContact O-N 3.38Å; Y59-Q62 PolarHBondContact O-N 3.08Å; Q62-T64 VanDerWaalsContact C-N 3.26Å; Q62-T64 PolarHBondContact O-N 2.92Å; Q62-V65 PolarHBondContact O-N 3.26Å; Q62-H66 VanDerWaalsContact O-CB 3.27Å; Q62-H66 WeakPolarHBondContact O-CB 3.43Å; Q62-H66 PolarHBondContact O-N 3.47Å; Q62-S154 PolarHBondContact NE2-OG 2.85Å
63	A	78.9	Confident	76.7	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-61.4	-35.1	173.9	0	0	0	0	0	112.1	R49 Y59 I60 H66 S67 Y558	R49-A63 PolarHBondContact NH1-O 3.07Å; R49-A63 VanDerWaalsContact NH1-O 3.11Å; Y59-A63 WeakPolarHBondContact O-CB 3.39Å; Y59-A63 PolarHBondContact O-N 3.02Å; I60-A63 PolarHBondContact O-N 2.97Å; A63-H66 PolarHBondContact O-N 3.27Å; A63-S67 VanDerWaalsContact O-CB 3.22Å; A63-S67 WeakPolarHBondContact O-CB 3.3Å; A63-S67 PolarHBondContact O-N 3.38Å; A63-Y558 HydrophobicContact CB-CD1 4.36Å; A63-Y558 HydrophobicContact CB-CE1 3.81Å
64	T	82.6	Confident	78.5	Confident	63 Å²	63	45 Å²	45	39%	0.387	24%	0.243	S	C	.	.	H	α-helix	trans	-65.6	-47.4	176.4	-52.6	0	0	0	0	111.9	R49 I60 E61 Q62 H66 S68	R49-T64 VanDerWaalsContact NH1-CA 3.26Å; I60-T64 PolarHBondContact O-N 2.91Å; I60-T64 PolarHBondContact O-OG1 3.13Å; E61-T64 WeakPolarHBondContact O-CB 3.48Å; E61-T64 PolarHBondContact O-N 3.48Å; E61-T64 VanDerWaalsContact O-N 3.16Å; Q62-T64 VanDerWaalsContact C-N 3.26Å; Q62-T64 PolarHBondContact O-N 2.92Å; T64-H66 VanDerWaalsContact C-N 3.33Å; T64-S68 PolarHBondContact O-N 3.4Å
65	V	82.8	Confident	80.4	Confident	27 Å²	27	44.3 Å²	44.3	16%	0.164	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-41.6	175.9	-177.5	0	0	0	0	110.6	E61 Q62 S68 M69 Y157	E61-V65 WeakPolarHBondContact O-CG2 3.29Å; E61-V65 PolarHBondContact O-N 3.38Å; Q62-V65 PolarHBondContact O-N 3.26Å; V65-S68 PolarHBondContact O-N 3.27Å; V65-M69 HydrophobicContact CG1-CG 4.49Å; V65-M69 HydrophobicContact CG1-SD 4.44Å; V65-M69 WeakPolarHBondContact O-CG 3.35Å; V65-M69 PolarHBondContact O-N 2.8Å; V65-Y157 HydrophobicContact CG1-CE2 4.43Å; V65-Y157 WeakPolarHBondContact CG1-OH 3.45Å
66	H	82.4	Confident	82.4	Confident	9 Å²	9	43.9 Å²	43.9	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-62.1	-48.4	179.8	-169	-177.5	0	0	0	112.5	Q62 A63 T64 S68 M69 N70 Y157 T160 Y558	Q62-H66 VanDerWaalsContact O-CB 3.27Å; Q62-H66 WeakPolarHBondContact O-CB 3.43Å; Q62-H66 PolarHBondContact O-N 3.47Å; A63-H66 PolarHBondContact O-N 3.27Å; T64-H66 VanDerWaalsContact C-N 3.33Å; H66-S68 PolarHBondContact O-N 3.02Å; H66-M69 PolarHBondContact O-N 3.38Å; H66-M69 VanDerWaalsContact O-N 3.1Å; H66-N70 PolarHBondContact O-N 3.4Å; H66-Y157 HydrophobicContact CB-CD2 3.93Å; H66-Y157 HydrophobicContact CB-CE2 4.19Å; H66-Y157 AromaticContact CD2-CD2 3.93Å; H66-Y157 AromaticContact CG-CD2 3.83Å; H66-T160 PolarHBondContact NE2-OG1 3.26Å; H66-Y558 AromaticContact CE1-CE2 3.95Å; H66-Y558 AromaticContact ND1-CE2 3.58Å; H66-Y558 AromaticContact ND1-CZ 3.64Å; H66-Y558 PolarHBondContact ND1-OH 3.21Å
67	S	83.2	Confident	83.8	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-54.1	-49.4	174.6	174.8	0	0	0	0	112	N45 R49 A63 M69 N70 E71	N45-S67 PolarHBondContact ND2-OG 3Å; N45-S67 VanDerWaalsContact ND2-OG 3.13Å; N45-S67 PolarHBondContact O-OG 3.25Å; R49-S67 PolarHBondContact NH1-OG 3.49Å; R49-S67 PolarHBondContact NH2-OG 3.32Å; A63-S67 VanDerWaalsContact O-CB 3.22Å; A63-S67 WeakPolarHBondContact O-CB 3.3Å; A63-S67 PolarHBondContact O-N 3.38Å; S67-M69 VanDerWaalsContact C-N 3.27Å; S67-M69 PolarHBondContact O-N 3.2Å; S67-N70 PolarHBondContact O-N 2.96Å; S67-E71 PolarHBondContact O-N 2.92Å
68	S	86.7	Confident	85.3	Confident	44 Å²	44	46.7 Å²	46.7	31%	0.308	23%	0.229	S	C	.	.	H	α-helix	trans	-63.9	-30.1	177.8	173.6	0	0	0	0	113.3	T64 V65 H66	T64-S68 PolarHBondContact O-N 3.4Å; V65-S68 PolarHBondContact O-N 3.27Å; H66-S68 PolarHBondContact O-N 3.02Å
69	M	87.3	Confident	86.4	Confident	1 Å²	1	45 Å²	45	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-75.1	-35.9	175.3	-75.2	-163.4	68.1	0	0	112.3	V65 H66 S67 M72 L73 E139 Y157 T160 L161 F164	V65-M69 HydrophobicContact CG1-CG 4.49Å; V65-M69 HydrophobicContact CG1-SD 4.44Å; V65-M69 WeakPolarHBondContact O-CG 3.35Å; V65-M69 PolarHBondContact O-N 2.8Å; H66-M69 PolarHBondContact O-N 3.38Å; H66-M69 VanDerWaalsContact O-N 3.1Å; S67-M69 VanDerWaalsContact C-N 3.27Å; S67-M69 PolarHBondContact O-N 3.2Å; M69-M72 PolarHBondContact O-N 2.97Å; M69-L73 PolarHBondContact O-N 3.02Å; M69-E139 HydrophobicContact SD-CG 4.26Å; M69-Y157 HydrophobicContact SD-CE2 3.82Å; M69-Y157 PolarHBondContact SD-OH 3.37Å; M69-T160 HydrophobicContact CB-CG2 4.22Å; M69-L161 HydrophobicContact CE-CD2 3.55Å; M69-L161 HydrophobicContact SD-CD2 4.11Å; M69-F164 HydrophobicContact CB-CE2 3.77Å; M69-F164 HydrophobicContact CB-CZ 4.04Å; M69-F164 HydrophobicContact CE-CD1 4.28Å; M69-F164 HydrophobicContact CE-CD2 3.5Å; M69-F164 HydrophobicContact CE-CE1 4.06Å; M69-F164 HydrophobicContact CE-CE2 3.25Å; M69-F164 HydrophobicContact CE-CG 4.02Å; M69-F164 HydrophobicContact CE-CZ 3.54Å; M69-F164 HydrophobicContact CG-CE2 4.38Å; M69-F164 HydrophobicContact CG-CZ 4.38Å; M69-F164 VanDerWaalsContact O-CE2 3.27Å; M69-F164 WeakPolarHBondContact O-CE2 3.19Å; M69-F164 VanDerWaalsContact O-CZ 3.23Å; M69-F164 WeakPolarHBondContact O-CZ 3.34Å
70	N	88.1	Confident	87.3	Confident	39 Å²	39	44.4 Å²	44.4	21%	0.209	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-41.3	175.5	-71.2	-19.6	0	0	0	111.8	H66 S67 M72 L73 E74 T160	H66-N70 PolarHBondContact O-N 3.4Å; S67-N70 PolarHBondContact O-N 2.96Å; N70-M72 PolarHBondContact O-N 3.37Å; N70-L73 WeakPolarHBondContact O-CB 3.36Å; N70-L73 PolarHBondContact O-N 3.32Å; N70-E74 PolarHBondContact O-N 3.47Å; N70-E74 VanDerWaalsContact O-N 3.11Å; N70-T160 WeakPolarHBondContact OD1-CG2 3.4Å
71	E	90.3	Very high	88.3	Confident	115 Å²	115	43.4 Å²	43.4	54%	0.537	22%	0.217	S	C	.	.	H	α-helix	trans	-56.8	-37	174.8	-69.4	171.2	-172.4	0	0	112.5	S67 E74 E75	S67-E71 PolarHBondContact O-N 2.92Å; E71-E74 PolarHBondContact O-N 2.81Å; E71-E75 PolarHBondContact O-N 3.45Å
72	M	93.7	Very high	89.2	Confident	17 Å²	17	39 Å²	39	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-74.9	-26.4	178.3	-175.7	176.2	-69	0	0	112.7	M69 N70 G76 F128 A132 R135 F164	M69-M72 PolarHBondContact O-N 2.97Å; N70-M72 PolarHBondContact O-N 3.37Å; M72-G76 PolarHBondContact O-N 3.44Å; M72-F128 HydrophobicContact CG-CE2 3.8Å; M72-F128 HydrophobicContact CG-CZ 4.12Å; M72-F128 WeakPolarHBondContact O-CZ 3.24Å; M72-A132 HydrophobicContact CG-CB 4.45Å; M72-A132 HydrophobicContact SD-CB 3.85Å; M72-R135 HydrophobicContact CE-CB 4.35Å; M72-R135 HydrophobicContact CE-CG 4.22Å; M72-R135 HydrophobicContact SD-CB 4.33Å; M72-R135 HydrophobicContact SD-CG 4.35Å; M72-F164 HydrophobicContact CB-CE1 4.39Å; M72-F164 HydrophobicContact CB-CZ 3.97Å; M72-F164 HydrophobicContact CG-CE1 3.99Å; M72-F164 HydrophobicContact CG-CZ 4.09Å; M72-F164 HydrophobicContact SD-CE1 3.78Å; M72-F164 HydrophobicContact SD-CZ 4.15Å
73	L	92.5	Very high	90.1	Very high	23 Å²	23	38.2 Å²	38.2	12%	0.12	19%	0.193	C	C	.	.	H	α-helix	trans	-68.1	-41.6	170.1	-72.4	172.2	0	0	0	111.2	M69 N70 G76 H77 T160 K163 F164 M167	M69-L73 PolarHBondContact O-N 3.02Å; N70-L73 WeakPolarHBondContact O-CB 3.36Å; N70-L73 PolarHBondContact O-N 3.32Å; L73-G76 PolarHBondContact O-N 3.07Å; L73-H77 PolarHBondContact O-N 3.34Å; L73-T160 HydrophobicContact CD1-CG2 3.93Å; L73-K163 HydrophobicContact CD1-CB 3.77Å; L73-K163 HydrophobicContact CD1-CD 4.14Å; L73-K163 HydrophobicContact CD2-CB 4.09Å; L73-F164 HydrophobicContact CD1-CD2 4.08Å; L73-F164 HydrophobicContact CD1-CE2 3.94Å; L73-F164 HydrophobicContact CD2-CD1 4.47Å; L73-F164 HydrophobicContact CD2-CD2 3.57Å; L73-F164 HydrophobicContact CD2-CE2 3.74Å; L73-F164 HydrophobicContact CD2-CG 3.96Å; L73-F164 HydrophobicContact CD2-CZ 4.29Å; L73-F164 HydrophobicContact CG-CD2 3.8Å; L73-F164 HydrophobicContact CG-CE2 3.48Å; L73-F164 VanDerWaalsContact CG-CE2 3.48Å; L73-F164 HydrophobicContact CG-CZ 4.09Å; L73-M167 HydrophobicContact CD2-CB 4.13Å; L73-M167 HydrophobicContact CD2-SD 3.94Å
74	E	90.9	Very high	90.9	Very high	129 Å²	129	38.1 Å²	38.1	60%	0.603	19%	0.192	S	C	*	.	H	α-helix	trans	-63	-46.5	174.8	-64.9	-56	137.4	0	0	111	N70 E71 G76 H77 E78	N70-E74 PolarHBondContact O-N 3.47Å; N70-E74 VanDerWaalsContact O-N 3.11Å; E71-E74 PolarHBondContact O-N 2.81Å; E74-G76 VanDerWaalsContact C-N 3.27Å; E74-G76 PolarHBondContact O-N 2.65Å; E74-H77 WeakPolarHBondContact O-CB 3.29Å; E74-H77 PolarHBondContact O-N 2.96Å; E74-H77 VanDerWaalsContact O-N 3.08Å; E74-E78 PolarHBondContact O-N 3.37Å; E74-E78 VanDerWaalsContact O-N 3.07Å
75	E	93.8	Very high	91.6	Very high	67 Å²	67	35.5 Å²	35.5	31%	0.313	18%	0.176	S	C	.	.	H	α-helix	trans	-58.4	-40.2	173.9	-167.8	-172.5	171.9	0	0	111.3	E71 H77 E78 Y79 F128	E71-E75 PolarHBondContact O-N 3.45Å; E75-H77 PolarHBondContact O-N 3.07Å; E75-E78 PolarHBondContact O-N 3.23Å; E75-Y79 HydrophobicContact CG-CD2 4.38Å; E75-Y79 HydrophobicContact CG-CE2 3.83Å; E75-Y79 WeakPolarHBondContact O-CD2 3.39Å; E75-Y79 PolarHBondContact O-N 2.89Å; E75-F128 HydrophobicContact CB-CD2 4.47Å; E75-F128 HydrophobicContact CB-CE2 3.83Å; E75-F128 HydrophobicContact CB-CZ 4.48Å; E75-F128 HydrophobicContact CG-CD2 3.9Å; E75-F128 HydrophobicContact CG-CE2 3.76Å; E75-F128 WeakPolarHBondContact OE1-CD2 3.41Å
76	G	93.9	Very high	92.2	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-64.5	-37	175.1	0	0	0	0	0	113.6	M72 L73 E74 Y79 A80	M72-G76 PolarHBondContact O-N 3.44Å; L73-G76 PolarHBondContact O-N 3.07Å; E74-G76 VanDerWaalsContact C-N 3.27Å; E74-G76 PolarHBondContact O-N 2.65Å; G76-Y79 PolarHBondContact O-N 3.18Å; G76-A80 PolarHBondContact O-N 3.34Å
77	H	92.9	Very high	92.8	Very high	71 Å²	71	37 Å²	37	33%	0.329	18%	0.178	S	C	.	.	H	α-helix	trans	-64	-40.6	174.6	-174.1	75.2	0	0	0	111.5	L73 E74 E75 Y79 A80 V81 F307	L73-H77 PolarHBondContact O-N 3.34Å; E74-H77 WeakPolarHBondContact O-CB 3.29Å; E74-H77 PolarHBondContact O-N 2.96Å; E74-H77 VanDerWaalsContact O-N 3.08Å; E75-H77 PolarHBondContact O-N 3.07Å; H77-Y79 VanDerWaalsContact C-N 3.31Å; H77-Y79 PolarHBondContact O-N 3.1Å; H77-A80 WeakPolarHBondContact O-CB 3.21Å; H77-A80 PolarHBondContact O-N 3.31Å; H77-A80 VanDerWaalsContact O-N 3.1Å; H77-V81 WeakPolarHBondContact O-CG2 3.49Å; H77-V81 PolarHBondContact O-N 2.96Å; H77-F307 AromaticContact CE1-CE2 3.86Å
78	E	94.4	Very high	93.4	Very high	125 Å²	125	37.8 Å²	37.8	58%	0.584	18%	0.184	S	C	*	.	H	α-helix	trans	-59.4	-40.4	175	-64.7	-171.4	163.1	0	0	112.3	E74 E75 V81 M82	E74-E78 PolarHBondContact O-N 3.37Å; E74-E78 VanDerWaalsContact O-N 3.07Å; E75-E78 PolarHBondContact O-N 3.23Å; E78-V81 PolarHBondContact O-N 2.88Å; E78-M82 WeakPolarHBondContact O-CB 3.3Å; E78-M82 PolarHBondContact O-N 3.26Å
79	Y	96.1	Very high	93.8	Very high	31 Å²	31	37.6 Å²	37.6	12%	0.122	18%	0.182	C	C	.	.	H	α-helix	trans	-69.3	-34.7	174	-71.2	-65.1	0	0	0	112.9	E75 G76 H77 M82 L83 K124 F125 F128	E75-Y79 HydrophobicContact CG-CD2 4.38Å; E75-Y79 HydrophobicContact CG-CE2 3.83Å; E75-Y79 WeakPolarHBondContact O-CD2 3.39Å; E75-Y79 PolarHBondContact O-N 2.89Å; G76-Y79 PolarHBondContact O-N 3.18Å; H77-Y79 VanDerWaalsContact C-N 3.31Å; H77-Y79 PolarHBondContact O-N 3.1Å; Y79-M82 HydrophobicContact CD1-CE 4.03Å; Y79-M82 HydrophobicContact CD1-SD 4.12Å; Y79-M82 WeakPolarHBondContact O-CB 3.04Å; Y79-M82 PolarHBondContact O-N 3.03Å; Y79-L83 WeakPolarHBondContact O-CG 3.37Å; Y79-L83 PolarHBondContact O-N 3.27Å; Y79-K124 HydrophobicContact CE1-CB 4.27Å; Y79-K124 WeakPolarHBondContact OH-CB 3.28Å; Y79-F125 HydrophobicContact CD1-CB 3.71Å; Y79-F125 HydrophobicContact CD1-CD2 4.02Å; Y79-F125 HydrophobicContact CD1-CG 4.27Å; Y79-F125 HydrophobicContact CE1-CB 3.88Å; Y79-F125 HydrophobicContact CG-CB 4.43Å; Y79-F125 AromaticContact CG-CD2 3.9Å; Y79-F125 HydrophobicContact CG-CD2 3.9Å; Y79-F128 HydrophobicContact CD2-CB 4.07Å; Y79-F128 AromaticContact CD2-CD1 3.51Å; Y79-F128 HydrophobicContact CD2-CD1 3.51Å; Y79-F128 HydrophobicContact CD2-CD2 4.12Å; Y79-F128 AromaticContact CD2-CE1 3.97Å; Y79-F128 HydrophobicContact CD2-CE1 3.97Å; Y79-F128 HydrophobicContact CD2-CE2 4.5Å; Y79-F128 AromaticContact CD2-CG 3.61Å; Y79-F128 HydrophobicContact CD2-CG 3.61Å; Y79-F128 HydrophobicContact CD2-CZ 4.44Å; Y79-F128 HydrophobicContact CE2-CB 3.49Å; Y79-F128 VanDerWaalsContact CE2-CB 3.49Å; Y79-F128 AromaticContact CE2-CD1 3.8Å; Y79-F128 HydrophobicContact CE2-CD1 3.8Å; Y79-F128 AromaticContact CE2-CD2 3.71Å; Y79-F128 HydrophobicContact CE2-CD2 3.71Å; Y79-F128 HydrophobicContact CE2-CE2 4.41Å; Y79-F128 AromaticContact CE2-CG 3.36Å; Y79-F128 HydrophobicContact CE2-CG 3.36Å; Y79-F128 HydrophobicContact CG-CD1 4.41Å
80	A	95.2	Very high	94	Very high	4 Å²	4	38.6 Å²	38.6	3%	0.033	19%	0.189	C	C	.	.	H	α-helix	trans	-62.3	-45.3	173.4	0	0	0	0	0	110.9	G76 H77 M82 L83 Y84 V170 L171 L174 F307	G76-A80 PolarHBondContact O-N 3.34Å; H77-A80 WeakPolarHBondContact O-CB 3.21Å; H77-A80 PolarHBondContact O-N 3.31Å; H77-A80 VanDerWaalsContact O-N 3.1Å; A80-M82 VanDerWaalsContact C-N 3.34Å; A80-M82 PolarHBondContact O-N 2.97Å; A80-L83 PolarHBondContact O-N 2.9Å; A80-Y84 WeakPolarHBondContact O-CB 3.47Å; A80-Y84 PolarHBondContact O-N 3.31Å; A80-V170 HydrophobicContact CB-CG1 3.94Å; A80-L171 HydrophobicContact CB-CD2 3.96Å; A80-L174 HydrophobicContact CB-CD1 3.74Å; A80-L174 WeakPolarHBondContact O-CD1 3.47Å; A80-F307 HydrophobicContact CB-CD2 4.11Å; A80-F307 HydrophobicContact CB-CE2 3.61Å; A80-F307 HydrophobicContact CB-CZ 3.97Å
81	V	95.1	Very high	94.2	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-58.2	-46.7	172.5	170.5	0	0	0	0	111.1	H77 E78 L83 Y84 T85 F307 F680	H77-V81 WeakPolarHBondContact O-CG2 3.49Å; H77-V81 PolarHBondContact O-N 2.96Å; E78-V81 PolarHBondContact O-N 2.88Å; V81-L83 PolarHBondContact O-N 3.24Å; V81-Y84 PolarHBondContact O-N 2.91Å; V81-T85 HydrophobicContact CG1-CG2 4.42Å; V81-T85 WeakPolarHBondContact O-CB 3.21Å; V81-T85 WeakPolarHBondContact O-CG2 3.36Å; V81-T85 PolarHBondContact O-N 3.4Å; V81-T85 PolarHBondContact O-OG1 3.05Å; V81-F307 HydrophobicContact CG2-CZ 3.96Å; V81-F680 HydrophobicContact CB-CD1 4.4Å; V81-F680 HydrophobicContact CG1-CB 4.28Å; V81-F680 HydrophobicContact CG1-CD1 3.88Å; V81-F680 WeakPolarHBondContact CG1-O 3.39Å; V81-F680 HydrophobicContact CG2-CD1 3.92Å; V81-F680 HydrophobicContact CG2-CE1 4.36Å
82	M	95.6	Very high	94.3	Very high	24 Å²	24	41.5 Å²	41.5	12%	0.118	21%	0.211	C	C	.	.	H	α-helix	trans	-56.7	-48.2	177.6	-179.4	-158.2	71.8	0	0	111.4	E78 Y79 A80 W86 K121 L122 F125	E78-M82 WeakPolarHBondContact O-CB 3.3Å; E78-M82 PolarHBondContact O-N 3.26Å; Y79-M82 HydrophobicContact CD1-CE 4.03Å; Y79-M82 HydrophobicContact CD1-SD 4.12Å; Y79-M82 WeakPolarHBondContact O-CB 3.04Å; Y79-M82 PolarHBondContact O-N 3.03Å; A80-M82 VanDerWaalsContact C-N 3.34Å; A80-M82 PolarHBondContact O-N 2.97Å; M82-W86 HydrophobicContact CE-CZ3 4.38Å; M82-W86 HydrophobicContact CG-CE3 4.03Å; M82-W86 HydrophobicContact CG-CZ3 4.17Å; M82-W86 WeakPolarHBondContact O-CB 3.24Å; M82-W86 PolarHBondContact O-N 2.84Å; M82-W86 HydrophobicContact SD-CE3 4.43Å; M82-W86 HydrophobicContact SD-CZ3 4.06Å; M82-K121 HydrophobicContact SD-CB 3.64Å; M82-K121 HydrophobicContact SD-CD 4.41Å; M82-L122 HydrophobicContact CE-CD2 4.22Å; M82-F125 HydrophobicContact CE-CB 4.05Å; M82-F125 HydrophobicContact CE-CG 4.29Å
83	L	95.7	Very high	94.2	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-65.9	-48.6	-179.7	-70.5	171.1	0	0	0	111.6	Y79 A80 V81 T85 W86 F125 L171 L174 K178 V181	Y79-L83 WeakPolarHBondContact O-CG 3.37Å; Y79-L83 PolarHBondContact O-N 3.27Å; A80-L83 PolarHBondContact O-N 2.9Å; V81-L83 PolarHBondContact O-N 3.24Å; L83-T85 VanDerWaalsContact C-N 3.34Å; L83-T85 PolarHBondContact O-N 3.43Å; L83-W86 WeakPolarHBondContact O-CB 3.43Å; L83-W86 PolarHBondContact O-N 3.32Å; L83-F125 HydrophobicContact CD1-CE1 4.05Å; L83-F125 HydrophobicContact CD1-CE2 4.09Å; L83-F125 HydrophobicContact CD1-CZ 3.69Å; L83-F125 HydrophobicContact CD2-CD1 4.47Å; L83-F125 HydrophobicContact CD2-CE1 4.25Å; L83-L171 HydrophobicContact CD1-CD2 4.12Å; L83-L174 HydrophobicContact CB-CB 3.93Å; L83-L174 HydrophobicContact CB-CD1 4.37Å; L83-L174 HydrophobicContact CD1-CB 4Å; L83-K178 WeakPolarHBondContact O-CD 3.14Å; L83-K178 WeakPolarHBondContact O-CE 3.2Å; L83-K178 WeakPolarHBondContact O-CG 3.34Å; L83-V181 HydrophobicContact CD2-CG2 4.27Å
84	Y	96.5	Very high	94.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.7	-45.1	-177.8	-179.2	-107.1	0	0	0	112	A80 V81 W86 L174 M177 K178 F307 D309 E623 F680	A80-Y84 WeakPolarHBondContact O-CB 3.47Å; A80-Y84 PolarHBondContact O-N 3.31Å; V81-Y84 PolarHBondContact O-N 2.91Å; Y84-W86 VanDerWaalsContact C-N 3.28Å; Y84-W86 PolarHBondContact O-N 3.37Å; Y84-L174 HydrophobicContact CD2-CD2 3.95Å; Y84-L174 HydrophobicContact CG-CD2 4.49Å; Y84-M177 HydrophobicContact CD2-CE 4.14Å; Y84-K178 VanDerWaalsContact O-CE 3.22Å; Y84-K178 WeakPolarHBondContact O-CE 3.43Å; Y84-K178 PolarHBondContact O-NZ 3.37Å; Y84-F307 VanDerWaalsContact CB-CE1 3.42Å; Y84-F307 HydrophobicContact CD1-CD1 4.26Å; Y84-F307 AromaticContact CD1-CE1 3.86Å; Y84-F307 HydrophobicContact CD1-CE1 3.86Å; Y84-F307 AromaticContact CD2-CD1 3.82Å; Y84-F307 HydrophobicContact CD2-CD1 3.82Å; Y84-F307 HydrophobicContact CD2-CE1 4.19Å; Y84-F307 AromaticContact CG-CD1 3.68Å; Y84-F307 HydrophobicContact CG-CD1 3.68Å; Y84-F307 AromaticContact CG-CE1 3.56Å; Y84-F307 HydrophobicContact CG-CE1 3.56Å; Y84-D309 WeakPolarHBondContact CE2-OD1 3.16Å; Y84-D309 VanDerWaalsContact CZ-OD1 3.25Å; Y84-D309 PolarHBondContact OH-N 2.92Å; Y84-D309 PolarHBondContact OH-OD1 3.01Å; Y84-E623 HydrophobicContact CD1-CB 4.38Å; Y84-E623 HydrophobicContact CD1-CG 4.3Å; Y84-E623 HydrophobicContact CD2-CB 4.29Å; Y84-E623 HydrophobicContact CE1-CB 3.92Å; Y84-E623 HydrophobicContact CE1-CG 3.79Å; Y84-E623 HydrophobicContact CE2-CB 3.82Å; Y84-E623 PolarHBondContact OH-N 2.66Å; Y84-F680 HydrophobicContact CD1-CE1 4.02Å; Y84-F680 HydrophobicContact CD1-CE2 4.49Å; Y84-F680 AromaticContact CD1-CZ 3.85Å; Y84-F680 HydrophobicContact CD1-CZ 3.85Å; Y84-F680 HydrophobicContact CE1-CE1 4.37Å; Y84-F680 HydrophobicContact CE1-CE2 4.13Å; Y84-F680 AromaticContact CE1-CZ 3.72Å; Y84-F680 HydrophobicContact CE1-CZ 3.72Å
85	T	96	Very high	94	Very high	7 Å²	7	46.6 Å²	46.6	4%	0.043	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	4.6	-178.7	62.9	0	0	0	0	114	V81 L83 R87 F680 K682 F684 L685	V81-T85 HydrophobicContact CG1-CG2 4.42Å; V81-T85 WeakPolarHBondContact O-CB 3.21Å; V81-T85 WeakPolarHBondContact O-CG2 3.36Å; V81-T85 PolarHBondContact O-N 3.4Å; V81-T85 PolarHBondContact O-OG1 3.05Å; L83-T85 VanDerWaalsContact C-N 3.34Å; L83-T85 PolarHBondContact O-N 3.43Å; T85-R87 PolarHBondContact O-N 3.09Å; T85-F680 HydrophobicContact CG2-CB 4.39Å; T85-F680 HydrophobicContact CG2-CD1 4.32Å; T85-F680 HydrophobicContact CG2-CG 4.25Å; T85-K682 HydrophobicContact CG2-CG 4.06Å; T85-K682 WeakPolarHBondContact OG1-CE 3.48Å; T85-F684 WeakPolarHBondContact O-CZ 3.28Å; T85-L685 HydrophobicContact CG2-CD1 3.86Å
86	W	96.2	Very high	93.8	Very high	14 Å²	14	45 Å²	45	5%	0.053	24%	0.236	C	C	.	.			trans	-75	109.7	177.1	-161.6	-61.4	0	0	0	110.9	M82 L83 Y84 E118 L122 K178 V181 D184	M82-W86 HydrophobicContact CE-CZ3 4.38Å; M82-W86 HydrophobicContact CG-CE3 4.03Å; M82-W86 HydrophobicContact CG-CZ3 4.17Å; M82-W86 WeakPolarHBondContact O-CB 3.24Å; M82-W86 PolarHBondContact O-N 2.84Å; M82-W86 HydrophobicContact SD-CE3 4.43Å; M82-W86 HydrophobicContact SD-CZ3 4.06Å; L83-W86 WeakPolarHBondContact O-CB 3.43Å; L83-W86 PolarHBondContact O-N 3.32Å; Y84-W86 VanDerWaalsContact C-N 3.28Å; Y84-W86 PolarHBondContact O-N 3.37Å; W86-E118 HydrophobicContact CH2-CB 3.71Å; W86-E118 WeakPolarHBondContact CH2-O 3.29Å; W86-E118 HydrophobicContact CZ2-CB 3.85Å; W86-L122 HydrophobicContact CE3-CD2 4.13Å; W86-L122 HydrophobicContact CH2-CD1 3.84Å; W86-L122 HydrophobicContact CH2-CD2 3.6Å; W86-L122 HydrophobicContact CH2-CG 3.51Å; W86-L122 HydrophobicContact CZ2-CD1 4.1Å; W86-L122 HydrophobicContact CZ2-CD2 4.35Å; W86-L122 HydrophobicContact CZ2-CG 4.27Å; W86-L122 HydrophobicContact CZ3-CD2 3.47Å; W86-L122 VanDerWaalsContact CZ3-CD2 3.47Å; W86-L122 HydrophobicContact CZ3-CG 3.89Å; W86-K178 PolarHBondContact O-NZ 3.14Å; W86-V181 HydrophobicContact CB-CG2 4Å; W86-V181 HydrophobicContact CD2-CG2 3.69Å; W86-V181 HydrophobicContact CE3-CG2 4.18Å; W86-V181 HydrophobicContact CG-CG2 3.58Å; W86-D184 PolarHBondContact NE1-OD2 2.9Å
87	R	95.3	Very high	93.5	Very high	55 Å²	55	54.2 Å²	54.2	21%	0.208	28%	0.276	C	S	.	.			trans	-99.9	150.2	167.8	-67.3	-168.5	179.4	169.9	18.8	110.6	T85 C89 E623 I634 E688	T85-R87 PolarHBondContact O-N 3.09Å; R87-C89 PolarHBondContact O-N 2.83Å; R87-E623 IonicContact CZ-OE1 2.73Å; R87-E623 IonicContact CZ-OE2 2.72Å; R87-E623 IonicContact NE-OE1 2.83Å; R87-E623 PolarHBondContact NE-OE1 3.46Å; R87-E623 IonicContact NE-OE2 3.65Å; R87-E623 PolarHBondContact NE-OE2 3.38Å; R87-E623 IonicContact NH2-OE1 3.58Å; R87-E623 PolarHBondContact NH2-OE1 3.3Å; R87-E623 IonicContact NH2-OE2 3.5Å; R87-I634 PolarHBondContact NH1-O 3.04Å; R87-E688 IonicContact CZ-OE1 3.59Å; R87-E688 IonicContact CZ-OE2 2.77Å; R87-E688 IonicContact NH1-OE1 3.57Å; R87-E688 PolarHBondContact NH1-OE1 2.94Å; R87-E688 IonicContact NH1-OE2 3.16Å; R87-E688 IonicContact NH2-OE1 3.64Å; R87-E688 PolarHBondContact NH2-OE1 2.65Å; R87-E688 IonicContact NH2-OE2 2.79Å; R87-E688 PolarHBondContact NH2-OE2 3.09Å
88	S	95.1	Very high	93.2	Very high	19 Å²	19	54 Å²	54	13%	0.133	28%	0.281	C	S	.	.			trans	-68.9	116.7	-172.9	-176	0	0	0	0	112.7	S90 R91 S180 D184	S88-S90 PolarHBondContact OG-OG 2.77Å; S88-R91 PolarHBondContact OG-N 3.18Å; S88-S180 WeakPolarHBondContact CB-OG 3.34Å; S88-D184 PolarHBondContact OG-OD1 3.32Å
89	C	94.5	Very high	92.7	Very high	40 Å²	40	54 Å²	54	27%	0.27	29%	0.285	S	S	.	.	S	Bend	trans	-73	-37.8	171.1	-68.8	0	0	0	0	111.3	R87 R91 A92 I93 L115 D184	R87-C89 PolarHBondContact O-N 2.83Å; C89-R91 PolarHBondContact O-N 3.5Å; C89-A92 WeakPolarHBondContact O-CB 3.41Å; C89-A92 PolarHBondContact O-N 3.11Å; C89-I93 WeakPolarHBondContact O-CG1 3.43Å; C89-I93 PolarHBondContact O-N 2.96Å; C89-L115 HydrophobicContact CB-CD2 3.5Å; C89-L115 VanDerWaalsContact CB-CD2 3.5Å; C89-D184 PolarHBondContact N-OD1 3.28Å; C89-D184 PolarHBondContact N-OD2 3.45Å
90	S	91.8	Very high	92.2	Very high	22 Å²	22	61 Å²	61	15%	0.154	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-23.7	-178.4	56.2	0	0	0	0	114.2	S88 A92 I93 D184	S88-S90 PolarHBondContact OG-OG 2.77Å; S90-A92 VanDerWaalsContact C-N 3.32Å; S90-I93 PolarHBondContact O-N 3.38Å; S90-D184 WeakPolarHBondContact CB-OD1 3.21Å; S90-D184 PolarHBondContact N-OD1 2.94Å; S90-D184 PolarHBondContact OG-OD1 3.32Å
91	R	92	Very high	91.8	Very high	127 Å²	127	62.7 Å²	62.7	48%	0.479	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-27.8	171	-71.2	178.5	-169.2	-85.4	3.9	113.2	S88 C89 M630	S88-R91 PolarHBondContact OG-N 3.18Å; C89-R91 PolarHBondContact O-N 3.5Å; R91-M630 VanDerWaalsContact CZ-C 3.45Å; R91-M630 PolarHBondContact NH1-O 3.22Å; R91-M630 PolarHBondContact NH2-O 2.91Å
92	A	92.7	Very high	91.4	Very high	88 Å²	88	68.6 Å²	68.6	73%	0.727	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-18.1	176.6	0	0	0	0	0	112.8	C89 S90	C89-A92 WeakPolarHBondContact O-CB 3.41Å; C89-A92 PolarHBondContact O-N 3.11Å; S90-A92 VanDerWaalsContact C-N 3.32Å
93	I	92.8	Very high	91.2	Very high	34 Å²	34	70.5 Å²	70.5	17%	0.174	38%	0.376	C	S	.	.	S	Bend	trans	-80.6	131.1	-178.5	-63.7	174.7	0	0	0	110.2	C89 S90 Q95 I107 T111 L115	C89-I93 WeakPolarHBondContact O-CG1 3.43Å; C89-I93 PolarHBondContact O-N 2.96Å; S90-I93 PolarHBondContact O-N 3.38Å; I93-Q95 PolarHBondContact O-N 3.16Å; I93-I107 HydrophobicContact CG2-CG2 4.32Å; I93-T111 HydrophobicContact CD1-CG2 3.9Å; I93-T111 WeakPolarHBondContact CG2-OG1 3.48Å; I93-L115 HydrophobicContact CD1-CD1 3.91Å; I93-L115 HydrophobicContact CD1-CG 4.27Å
94	P	90.6	Very high	90.9	Very high	81 Å²	81	72.6 Å²	72.6	53%	0.526	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-63.9	125.3	176.5	26.5	-34.2	0	0	0	110.7	I107	P94-I107 HydrophobicContact CB-CD1 4.38Å; P94-I107 HydrophobicContact CG-CD1 4.12Å; P94-I107 HydrophobicContact CG-CG1 4.05Å; P94-I107 HydrophobicContact CG-CG2 4.33Å; P94-I107 WeakPolarHBondContact O-CG2 3.33Å
95	Q	88	Confident	90.7	Very high	160 Å²	160	76 Å²	76	75%	0.748	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-75	136.5	-179.4	-64.8	-174.9	-0.7	0	0	111.5	I93 K97	I93-Q95 PolarHBondContact O-N 3.16Å; Q95-K97 PolarHBondContact O-N 3.35Å
96	V	88.8	Confident	90.4	Very high	33 Å²	33	81.7 Å²	81.7	20%	0.2	43%	0.431	C	S	.	.			trans	-73.2	110	171.6	179.3	0	0	0	0	109	C98 Q101 R104 I107 Y108	V96-C98 VanDerWaalsContact CG1-O 3.3Å; V96-C98 WeakPolarHBondContact CG1-O 3.41Å; V96-Q101 VanDerWaalsContact CA-OE1 3.29Å; V96-Q101 HydrophobicContact CG1-CB 4.42Å; V96-R104 HydrophobicContact CG1-CB 4.3Å; V96-R104 HydrophobicContact CG1-CG 3.85Å; V96-R104 HydrophobicContact CG2-CG 4.24Å; V96-I107 HydrophobicContact CG2-CB 4.42Å; V96-I107 HydrophobicContact CG2-CD1 4.34Å; V96-I107 HydrophobicContact CG2-CG2 4.07Å; V96-Y108 HydrophobicContact CG2-CE1 4.21Å; V96-Y108 HydrophobicContact CG2-CE2 3.97Å
97	K	87.4	Confident	90.3	Very high	196 Å²	196	81.8 Å²	81.8	85%	0.852	43%	0.432	S	S	*	.			trans	-77.7	-36.5	-173.9	-68.3	-175	179.6	179.5	0	113	Q95	Q95-K97 PolarHBondContact O-N 3.35Å
98	C	87	Confident	90.2	Very high	65 Å²	65	80.6 Å²	80.6	44%	0.439	43%	0.428	S	S	.	.	S	Bend	trans	-146.9	164.7	-179.8	65.3	0	0	0	0	110.9	V96 E100 Q101	V96-C98 VanDerWaalsContact CG1-O 3.3Å; V96-C98 WeakPolarHBondContact CG1-O 3.41Å; C98-E100 PolarHBondContact O-N 3.05Å; C98-Q101 WeakPolarHBondContact O-CB 3.49Å; C98-Q101 PolarHBondContact O-N 3.01Å
99	N	83.8	Confident	90	Very high	125 Å²	125	84.6 Å²	84.6	67%	0.668	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-22.8	-178	-76.7	-28.3	0	0	0	113.7	Q101 R104	N99-Q101 VanDerWaalsContact C-N 3.35Å; N99-R104 VanDerWaalsContact CB-NH1 3.28Å; N99-R104 PolarHBondContact O-NH1 3.39Å; N99-R104 PolarHBondContact OD1-NH1 2.92Å; N99-R104 VanDerWaalsContact OD1-NH1 3.1Å; N99-R104 PolarHBondContact OD1-NH2 2.98Å
100	E	85.3	Confident	90	Very high	179 Å²	179	88.5 Å²	88.5	84%	0.836	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	4.6	-175.3	-63.3	168	176	0	0	113.2	C98	C98-E100 PolarHBondContact O-N 3.05Å
101	Q	88.3	Confident	90.1	Very high	39 Å²	39	87.8 Å²	87.8	18%	0.182	45%	0.451	C	S	.	.			trans	-64.7	127	-177.5	-178.9	171.2	-17.4	0	0	111.5	V96 C98 N99 N103 R104	V96-Q101 VanDerWaalsContact CA-OE1 3.29Å; V96-Q101 HydrophobicContact CG1-CB 4.42Å; C98-Q101 WeakPolarHBondContact O-CB 3.49Å; C98-Q101 PolarHBondContact O-N 3.01Å; N99-Q101 VanDerWaalsContact C-N 3.35Å; Q101-N103 WeakPolarHBondContact CG-OD1 3.13Å; Q101-N103 PolarHBondContact NE2-OD1 3.01Å; Q101-N103 PolarHBondContact O-N 3.38Å; Q101-R104 HydrophobicContact CB-CB 4.3Å; Q101-R104 WeakPolarHBondContact O-CB 3.43Å; Q101-R104 PolarHBondContact O-N 2.65Å; Q101-R104 VanDerWaalsContact O-N 3.16Å
102	P	86.8	Confident	90.2	Very high	132 Å²	132	81.8 Å²	81.8	86%	0.857	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-45.5	-172.1	-26	33.6	0	0	0	114.3	R104	P102-R104 PolarHBondContact O-N 3.43Å
103	N	91.6	Very high	90.2	Very high	64 Å²	64	83 Å²	83	34%	0.342	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	17.4	-178.8	63.5	-17.7	0	0	0	113.4	Q101 V105 E106 I107	Q101-N103 WeakPolarHBondContact CG-OD1 3.13Å; Q101-N103 PolarHBondContact NE2-OD1 3.01Å; Q101-N103 PolarHBondContact O-N 3.38Å; N103-V105 VanDerWaalsContact C-N 3.34Å; N103-V105 PolarHBondContact O-N 2.95Å; N103-E106 PolarHBondContact O-N 3.26Å; N103-I107 VanDerWaalsContact O-CG1 3.24Å; N103-I107 WeakPolarHBondContact O-CG1 3.17Å; N103-I107 PolarHBondContact O-N 2.91Å
104	R	89.7	Confident	90.3	Very high	45 Å²	45	85.3 Å²	85.3	17%	0.17	44%	0.435	C	S	.	.	H	α-helix	trans	-58.1	-43.2	-177.6	173.1	178.1	173.9	-178.9	12.3	113	V96 N99 Q101 P102 Y108 F194	V96-R104 HydrophobicContact CG1-CB 4.3Å; V96-R104 HydrophobicContact CG1-CG 3.85Å; V96-R104 HydrophobicContact CG2-CG 4.24Å; N99-R104 VanDerWaalsContact CB-NH1 3.28Å; N99-R104 PolarHBondContact O-NH1 3.39Å; N99-R104 PolarHBondContact OD1-NH1 2.92Å; N99-R104 VanDerWaalsContact OD1-NH1 3.1Å; N99-R104 PolarHBondContact OD1-NH2 2.98Å; Q101-R104 HydrophobicContact CB-CB 4.3Å; Q101-R104 WeakPolarHBondContact O-CB 3.43Å; Q101-R104 PolarHBondContact O-N 2.65Å; Q101-R104 VanDerWaalsContact O-N 3.16Å; P102-R104 PolarHBondContact O-N 3.43Å; R104-Y108 HydrophobicContact CG-CD2 3.94Å; R104-Y108 HydrophobicContact CG-CE2 3.72Å; R104-Y108 WeakPolarHBondContact O-CD2 3.47Å; R104-Y108 PolarHBondContact O-N 2.73Å; R104-F194 HydrophobicContact CG-CE1 4.44Å; R104-F194 HydrophobicContact CG-CZ 4.39Å
105	V	90.3	Very high	90.6	Very high	71 Å²	71	81.4 Å²	81.4	43%	0.43	41%	0.41	S	S	.	.	H	α-helix	trans	-67.3	-48.7	-178.9	-179.2	0	0	0	0	109.9	N103 I107 Y108 E109 F194 L195	N103-V105 VanDerWaalsContact C-N 3.34Å; N103-V105 PolarHBondContact O-N 2.95Å; V105-I107 VanDerWaalsContact C-N 3.33Å; V105-I107 PolarHBondContact O-N 3.49Å; V105-Y108 PolarHBondContact O-N 2.72Å; V105-Y108 VanDerWaalsContact O-N 3.1Å; V105-E109 HydrophobicContact CG1-CG 4.39Å; V105-E109 WeakPolarHBondContact O-CG 3.32Å; V105-E109 PolarHBondContact O-N 2.61Å; V105-F194 HydrophobicContact CG2-CE1 4.27Å; V105-L195 HydrophobicContact CG1-CD2 4.17Å
106	E	91.7	Very high	90.8	Very high	127 Å²	127	77.3 Å²	77.3	59%	0.593	39%	0.39	S	S	*	.	H	α-helix	trans	-57	-44.5	177.8	-61.9	172.8	175.2	0	0	112	N103 Y108 E109 K110	N103-E106 PolarHBondContact O-N 3.26Å; E106-Y108 VanDerWaalsContact C-N 3.33Å; E106-Y108 PolarHBondContact O-N 3.2Å; E106-E109 PolarHBondContact O-N 2.97Å; E106-K110 WeakPolarHBondContact O-CB 3.3Å; E106-K110 WeakPolarHBondContact O-CG 3.46Å; E106-K110 PolarHBondContact O-N 2.79Å
107	I	92.8	Very high	91.1	Very high	15 Å²	15	79 Å²	79	8%	0.077	40%	0.402	C	S	.	.	H	α-helix	trans	-58.8	-46.1	176.8	-70.9	169.4	0	0	0	110.4	I93 P94 V96 N103 V105 K110 T111	I93-I107 HydrophobicContact CG2-CG2 4.32Å; P94-I107 HydrophobicContact CB-CD1 4.38Å; P94-I107 HydrophobicContact CG-CD1 4.12Å; P94-I107 HydrophobicContact CG-CG1 4.05Å; P94-I107 HydrophobicContact CG-CG2 4.33Å; P94-I107 WeakPolarHBondContact O-CG2 3.33Å; V96-I107 HydrophobicContact CG2-CB 4.42Å; V96-I107 HydrophobicContact CG2-CD1 4.34Å; V96-I107 HydrophobicContact CG2-CG2 4.07Å; N103-I107 VanDerWaalsContact O-CG1 3.24Å; N103-I107 WeakPolarHBondContact O-CG1 3.17Å; N103-I107 PolarHBondContact O-N 2.91Å; V105-I107 VanDerWaalsContact C-N 3.33Å; V105-I107 PolarHBondContact O-N 3.49Å; I107-K110 PolarHBondContact O-N 3.44Å; I107-T111 VanDerWaalsContact O-CB 3.29Å; I107-T111 WeakPolarHBondContact O-CB 3.33Å; I107-T111 PolarHBondContact O-N 3.37Å; I107-T111 PolarHBondContact O-OG1 3.07Å
108	Y	92.5	Very high	91.4	Very high	30 Å²	30	72 Å²	72	12%	0.118	37%	0.373	C	S	.	.	H	α-helix	trans	-69.9	-35.9	-179.8	-73.2	-46.9	0	0	0	112.7	V96 R104 V105 E106 T111 V112 A191 F194	V96-Y108 HydrophobicContact CG2-CE1 4.21Å; V96-Y108 HydrophobicContact CG2-CE2 3.97Å; R104-Y108 HydrophobicContact CG-CD2 3.94Å; R104-Y108 HydrophobicContact CG-CE2 3.72Å; R104-Y108 WeakPolarHBondContact O-CD2 3.47Å; R104-Y108 PolarHBondContact O-N 2.73Å; V105-Y108 PolarHBondContact O-N 2.72Å; V105-Y108 VanDerWaalsContact O-N 3.1Å; E106-Y108 VanDerWaalsContact C-N 3.33Å; E106-Y108 PolarHBondContact O-N 3.2Å; Y108-T111 WeakPolarHBondContact O-CB 3.27Å; Y108-T111 PolarHBondContact O-N 2.89Å; Y108-V112 WeakPolarHBondContact O-CG2 3.38Å; Y108-V112 PolarHBondContact O-N 3.4Å; Y108-A191 HydrophobicContact CD1-CB 3.46Å; Y108-A191 VanDerWaalsContact CD1-CB 3.46Å; Y108-A191 HydrophobicContact CE1-CB 4.27Å; Y108-A191 HydrophobicContact CG-CB 4.1Å; Y108-F194 HydrophobicContact CD2-CB 4.26Å; Y108-F194 AromaticContact CD2-CD1 3.31Å; Y108-F194 HydrophobicContact CD2-CD1 3.31Å; Y108-F194 AromaticContact CD2-CE1 3.76Å; Y108-F194 HydrophobicContact CD2-CE1 3.76Å; Y108-F194 AromaticContact CD2-CG 3.83Å; Y108-F194 HydrophobicContact CD2-CG 3.83Å; Y108-F194 HydrophobicContact CE2-CB 4.41Å; Y108-F194 AromaticContact CE2-CD1 3.88Å; Y108-F194 HydrophobicContact CE2-CD1 3.88Å; Y108-F194 HydrophobicContact CE2-CD2 4.48Å; Y108-F194 HydrophobicContact CE2-CE1 4.27Å; Y108-F194 AromaticContact CE2-CG 3.98Å; Y108-F194 HydrophobicContact CE2-CG 3.98Å; Y108-F194 HydrophobicContact CG-CD1 4.11Å
109	E	92.6	Very high	91.7	Very high	103 Å²	103	69.5 Å²	69.5	48%	0.481	36%	0.355	S	S	.	.	H	α-helix	trans	-61.6	-48.1	174.6	-74.3	178.1	167.1	0	0	110.6	V105 E106 T111 V112 E113 L195	V105-E109 HydrophobicContact CG1-CG 4.39Å; V105-E109 WeakPolarHBondContact O-CG 3.32Å; V105-E109 PolarHBondContact O-N 2.61Å; E106-E109 PolarHBondContact O-N 2.97Å; E109-T111 PolarHBondContact O-N 3.14Å; E109-V112 PolarHBondContact O-N 3.4Å; E109-E113 WeakPolarHBondContact O-CB 3.26Å; E109-E113 PolarHBondContact O-N 3.29Å; E109-L195 HydrophobicContact CB-CD1 4.39Å; E109-L195 HydrophobicContact CG-CD1 3.85Å; E109-L195 HydrophobicContact CG-CD2 3.85Å
110	K	93.8	Very high	92.2	Very high	122 Å²	122	66.9 Å²	66.9	53%	0.53	34%	0.344	S	S	.	.	H	α-helix	trans	-66.9	-34.5	175.7	-65	-54.5	-178.3	-176.9	0	113.2	E106 I107 V112 E113 V114	E106-K110 WeakPolarHBondContact O-CB 3.3Å; E106-K110 WeakPolarHBondContact O-CG 3.46Å; E106-K110 PolarHBondContact O-N 2.79Å; I107-K110 PolarHBondContact O-N 3.44Å; K110-V112 VanDerWaalsContact C-N 3.34Å; K110-V112 PolarHBondContact O-N 3.45Å; K110-E113 WeakPolarHBondContact CD-OE2 3.31Å; K110-E113 WeakPolarHBondContact CE-OE2 3.46Å; K110-E113 IonicContact NZ-OE1 3.8Å; K110-E113 IonicContact NZ-OE2 2.82Å; K110-E113 PolarHBondContact NZ-OE2 3.42Å; K110-E113 PolarHBondContact O-N 3.09Å; K110-V114 WeakPolarHBondContact O-CG2 3.39Å; K110-V114 PolarHBondContact O-N 3.46Å
111	T	93.9	Very high	92.7	Very high	7 Å²	7	62.3 Å²	62.3	4%	0.043	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-44.7	174.1	-61.9	0	0	0	0	110.9	I93 I107 Y108 E109 L115 A191	I93-T111 HydrophobicContact CD1-CG2 3.9Å; I93-T111 WeakPolarHBondContact CG2-OG1 3.48Å; I107-T111 VanDerWaalsContact O-CB 3.29Å; I107-T111 WeakPolarHBondContact O-CB 3.33Å; I107-T111 PolarHBondContact O-N 3.37Å; I107-T111 PolarHBondContact O-OG1 3.07Å; Y108-T111 WeakPolarHBondContact O-CB 3.27Å; Y108-T111 PolarHBondContact O-N 2.89Å; E109-T111 PolarHBondContact O-N 3.14Å; T111-L115 HydrophobicContact CG2-CD1 3.78Å; T111-L115 VanDerWaalsContact O-CB 3.3Å; T111-L115 WeakPolarHBondContact O-CB 3.34Å; T111-L115 WeakPolarHBondContact O-CG 3.41Å; T111-L115 PolarHBondContact O-N 3.46Å; T111-A191 HydrophobicContact CG2-CB 3.71Å
112	V	93.3	Very high	93	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.006	31%	0.313	C	S	.	.	H	α-helix	trans	-66.7	-47.4	176.3	169.8	0	0	0	0	110.6	Y108 E109 K110 V114 L115 E116 Y188 A191 A192 L195 K197	Y108-V112 WeakPolarHBondContact O-CG2 3.38Å; Y108-V112 PolarHBondContact O-N 3.4Å; E109-V112 PolarHBondContact O-N 3.4Å; K110-V112 VanDerWaalsContact C-N 3.34Å; K110-V112 PolarHBondContact O-N 3.45Å; V112-V114 VanDerWaalsContact C-N 3.29Å; V112-V114 PolarHBondContact O-N 2.84Å; V112-L115 PolarHBondContact O-N 2.9Å; V112-E116 WeakPolarHBondContact O-CB 3.44Å; V112-E116 PolarHBondContact O-N 3.06Å; V112-Y188 HydrophobicContact CB-CE2 4.44Å; V112-Y188 HydrophobicContact CG1-CE2 4Å; V112-Y188 HydrophobicContact CG2-CD2 4.41Å; V112-Y188 HydrophobicContact CG2-CE2 4.35Å; V112-A191 HydrophobicContact CG2-CB 3.72Å; V112-A192 HydrophobicContact CG2-CB 4.16Å; V112-L195 HydrophobicContact CG2-CD1 4Å; V112-K197 HydrophobicContact CG1-CD 3.79Å
113	E	94.1	Very high	93.2	Very high	115 Å²	115	55.4 Å²	55.4	54%	0.537	28%	0.278	S	S	.	.	H	α-helix	trans	-54.1	-43	179.2	-173.1	-178.9	160	0	0	112.8	E109 K110	E109-E113 WeakPolarHBondContact O-CB 3.26Å; E109-E113 PolarHBondContact O-N 3.29Å; K110-E113 WeakPolarHBondContact CD-OE2 3.31Å; K110-E113 WeakPolarHBondContact CE-OE2 3.46Å; K110-E113 IonicContact NZ-OE1 3.8Å; K110-E113 IonicContact NZ-OE2 2.82Å; K110-E113 PolarHBondContact NZ-OE2 3.42Å; K110-E113 PolarHBondContact O-N 3.09Å
114	V	94.9	Very high	93.4	Very high	81 Å²	81	58.1 Å²	58.1	49%	0.491	29%	0.287	S	S	.	.	H	α-helix	trans	-77	-42.9	-179.6	174.3	0	0	0	0	112.4	K110 V112	K110-V114 WeakPolarHBondContact O-CG2 3.39Å; K110-V114 PolarHBondContact O-N 3.46Å; V112-V114 VanDerWaalsContact C-N 3.29Å; V112-V114 PolarHBondContact O-N 2.84Å
115	L	95.5	Very high	93.7	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-89.7	-19.7	-171	-68	174.6	0	0	0	114.4	C89 I93 T111 V112 E118 V119 D184 A187 Y188	C89-L115 HydrophobicContact CB-CD2 3.5Å; C89-L115 VanDerWaalsContact CB-CD2 3.5Å; I93-L115 HydrophobicContact CD1-CD1 3.91Å; I93-L115 HydrophobicContact CD1-CG 4.27Å; T111-L115 HydrophobicContact CG2-CD1 3.78Å; T111-L115 VanDerWaalsContact O-CB 3.3Å; T111-L115 WeakPolarHBondContact O-CB 3.34Å; T111-L115 WeakPolarHBondContact O-CG 3.41Å; T111-L115 PolarHBondContact O-N 3.46Å; V112-L115 PolarHBondContact O-N 2.9Å; L115-E118 PolarHBondContact O-N 3.4Å; L115-V119 WeakPolarHBondContact O-CG2 3.33Å; L115-V119 PolarHBondContact O-N 2.98Å; L115-D184 HydrophobicContact CD2-CB 4.08Å; L115-A187 HydrophobicContact CD1-CB 4.14Å; L115-Y188 HydrophobicContact CB-CD2 3.99Å; L115-Y188 HydrophobicContact CB-CG 4.35Å
116	E	93	Very high	93.9	Very high	73 Å²	73	53.5 Å²	53.5	34%	0.341	26%	0.262	S	S	.	.	H	α-helix	trans	-58.1	-45.9	-178.9	-175.6	167.4	-167.4	0	0	113	V112 E118 V119 T120 Y188 K197	V112-E116 WeakPolarHBondContact O-CB 3.44Å; V112-E116 PolarHBondContact O-N 3.06Å; E116-E118 VanDerWaalsContact C-N 3.31Å; E116-E118 PolarHBondContact O-N 3.16Å; E116-V119 PolarHBondContact O-N 3.43Å; E116-T120 PolarHBondContact O-N 3.19Å; E116-T120 VanDerWaalsContact O-N 3.08Å; E116-T120 PolarHBondContact O-OG1 2.92Å; E116-Y188 HydrophobicContact CB-CE2 3.77Å; E116-Y188 HydrophobicContact CG-CE2 4.25Å; E116-K197 IonicContact OE2-NZ 2.98Å; E116-K197 PolarHBondContact OE2-NZ 2.85Å
117	P	95.1	Very high	94	Very high	70 Å²	70	51.4 Å²	51.4	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-63	-36.8	174.7	-21.6	34.4	0	0	0	112.9	T120 K121	P117-T120 WeakPolarHBondContact O-CB 3.17Å; P117-T120 PolarHBondContact O-N 2.88Å; P117-K121 PolarHBondContact O-N 3.31Å
118	E	94.4	Very high	94.2	Very high	48 Å²	48	51 Å²	51	22%	0.224	25%	0.247	C	C	.	.	H	α-helix	trans	-70.9	-43.9	180	-61.2	-52.1	134	0	0	111.3	W86 L115 E116 T120 K121 L122	W86-E118 HydrophobicContact CH2-CB 3.71Å; W86-E118 WeakPolarHBondContact CH2-O 3.29Å; W86-E118 HydrophobicContact CZ2-CB 3.85Å; L115-E118 PolarHBondContact O-N 3.4Å; E116-E118 VanDerWaalsContact C-N 3.31Å; E116-E118 PolarHBondContact O-N 3.16Å; E118-T120 PolarHBondContact O-N 2.98Å; E118-K121 WeakPolarHBondContact O-CA 3.41Å; E118-K121 WeakPolarHBondContact O-CB 3.48Å; E118-K121 PolarHBondContact O-N 3.45Å; E118-K121 IonicContact OE1-NZ 2.98Å; E118-K121 PolarHBondContact OE1-NZ 3.09Å; E118-K121 WeakPolarHBondContact OE2-CD 3.42Å; E118-K121 WeakPolarHBondContact OE2-CE 3.05Å; E118-K121 IonicContact OE2-NZ 2.92Å; E118-K121 PolarHBondContact OE2-NZ 3.26Å; E118-L122 PolarHBondContact O-N 3.4Å
119	V	93.5	Very high	94.3	Very high	12 Å²	12	50.2 Å²	50.2	7%	0.073	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-33.9	174	172.2	0	0	0	0	111.3	L115 E116 K121 L122 M123 Y188 L210	L115-V119 WeakPolarHBondContact O-CG2 3.33Å; L115-V119 PolarHBondContact O-N 2.98Å; E116-V119 PolarHBondContact O-N 3.43Å; V119-K121 VanDerWaalsContact C-N 3.28Å; V119-K121 PolarHBondContact O-N 3.26Å; V119-L122 WeakPolarHBondContact O-CB 3.46Å; V119-L122 PolarHBondContact O-N 3.36Å; V119-L122 VanDerWaalsContact O-N 3.13Å; V119-M123 HydrophobicContact CG1-CG 4.48Å; V119-M123 WeakPolarHBondContact O-CG 3.47Å; V119-M123 PolarHBondContact O-N 3Å; V119-Y188 HydrophobicContact CB-CD1 4.28Å; V119-Y188 HydrophobicContact CB-CE1 4.42Å; V119-Y188 HydrophobicContact CG1-CD1 4.12Å; V119-Y188 HydrophobicContact CG1-CE1 4.08Å; V119-Y188 HydrophobicContact CG2-CD1 3.75Å; V119-Y188 HydrophobicContact CG2-CD2 4.4Å; V119-Y188 HydrophobicContact CG2-CE1 4.37Å; V119-Y188 HydrophobicContact CG2-CG 3.76Å; V119-L210 HydrophobicContact CG1-CD2 4.02Å
120	T	93.7	Very high	94.3	Very high	70 Å²	70	51.5 Å²	51.5	43%	0.429	25%	0.245	S	C	.	.	H	α-helix	trans	-60.1	-37.9	173.1	-57.2	0	0	0	0	111.9	E116 P117 E118 M123 K124	E116-T120 PolarHBondContact O-N 3.19Å; E116-T120 VanDerWaalsContact O-N 3.08Å; E116-T120 PolarHBondContact O-OG1 2.92Å; P117-T120 WeakPolarHBondContact O-CB 3.17Å; P117-T120 PolarHBondContact O-N 2.88Å; E118-T120 PolarHBondContact O-N 2.98Å; T120-M123 WeakPolarHBondContact O-CB 3.27Å; T120-M123 PolarHBondContact O-N 3.14Å; T120-K124 WeakPolarHBondContact O-CG 3.39Å; T120-K124 PolarHBondContact O-N 2.89Å
121	K	94.9	Very high	94.3	Very high	83 Å²	83	51.5 Å²	51.5	36%	0.361	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-39.9	174.3	-57.1	176.6	-168	160.1	0	111.6	M82 P117 E118 V119 M123 K124 F125	M82-K121 HydrophobicContact SD-CB 3.64Å; M82-K121 HydrophobicContact SD-CD 4.41Å; P117-K121 PolarHBondContact O-N 3.31Å; E118-K121 WeakPolarHBondContact O-CA 3.41Å; E118-K121 WeakPolarHBondContact O-CB 3.48Å; E118-K121 PolarHBondContact O-N 3.45Å; E118-K121 IonicContact OE1-NZ 2.98Å; E118-K121 PolarHBondContact OE1-NZ 3.09Å; E118-K121 WeakPolarHBondContact OE2-CD 3.42Å; E118-K121 WeakPolarHBondContact OE2-CE 3.05Å; E118-K121 IonicContact OE2-NZ 2.92Å; E118-K121 PolarHBondContact OE2-NZ 3.26Å; V119-K121 VanDerWaalsContact C-N 3.28Å; V119-K121 PolarHBondContact O-N 3.26Å; K121-M123 VanDerWaalsContact C-N 3.33Å; K121-M123 PolarHBondContact O-N 3.29Å; K121-K124 PolarHBondContact O-N 3.28Å; K121-F125 PolarHBondContact O-N 3.08Å
122	L	94.4	Very high	94.4	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-37.1	175.5	-60.5	178.8	0	0	0	112.7	M82 W86 E118 V119 F125 M126 V181 H185 L210 L214	M82-L122 HydrophobicContact CE-CD2 4.22Å; W86-L122 HydrophobicContact CE3-CD2 4.13Å; W86-L122 HydrophobicContact CH2-CD1 3.84Å; W86-L122 HydrophobicContact CH2-CD2 3.6Å; W86-L122 HydrophobicContact CH2-CG 3.51Å; W86-L122 HydrophobicContact CZ2-CD1 4.1Å; W86-L122 HydrophobicContact CZ2-CD2 4.35Å; W86-L122 HydrophobicContact CZ2-CG 4.27Å; W86-L122 HydrophobicContact CZ3-CD2 3.47Å; W86-L122 VanDerWaalsContact CZ3-CD2 3.47Å; W86-L122 HydrophobicContact CZ3-CG 3.89Å; E118-L122 PolarHBondContact O-N 3.4Å; V119-L122 WeakPolarHBondContact O-CB 3.46Å; V119-L122 PolarHBondContact O-N 3.36Å; V119-L122 VanDerWaalsContact O-N 3.13Å; L122-F125 PolarHBondContact O-N 3.4Å; L122-M126 PolarHBondContact O-N 3.44Å; L122-V181 HydrophobicContact CD1-CG1 3.72Å; L122-V181 HydrophobicContact CD2-CG1 3.44Å; L122-V181 VanDerWaalsContact CD2-CG1 3.44Å; L122-V181 HydrophobicContact CD2-CG2 4.5Å; L122-V181 HydrophobicContact CG-CG1 4.22Å; L122-H185 HydrophobicContact CD1-CB 4.28Å; L122-L210 HydrophobicContact CB-CD1 4.19Å; L122-L210 HydrophobicContact CB-CD2 4.06Å; L122-L214 HydrophobicContact CD1-CD1 4.31Å
123	M	92.2	Very high	94.4	Very high	25 Å²	25	51.1 Å²	51.1	12%	0.123	24%	0.243	C	C	.	.	H	α-helix	trans	-62.4	-48.5	172.8	-71.5	-64.4	-73.7	0	0	110.8	V119 T120 K121 F125 M126 Y127 E206 L210	V119-M123 HydrophobicContact CG1-CG 4.48Å; V119-M123 WeakPolarHBondContact O-CG 3.47Å; V119-M123 PolarHBondContact O-N 3Å; T120-M123 WeakPolarHBondContact O-CB 3.27Å; T120-M123 PolarHBondContact O-N 3.14Å; K121-M123 VanDerWaalsContact C-N 3.33Å; K121-M123 PolarHBondContact O-N 3.29Å; M123-F125 VanDerWaalsContact C-N 3.32Å; M123-F125 PolarHBondContact O-N 2.94Å; M123-M126 HydrophobicContact CE-CE 4.08Å; M123-M126 PolarHBondContact O-N 3.43Å; M123-M126 HydrophobicContact SD-CE 4Å; M123-Y127 HydrophobicContact CB-CE2 4.29Å; M123-Y127 HydrophobicContact CE-CE2 4.07Å; M123-Y127 VanDerWaalsContact CE-OH 3.3Å; M123-Y127 WeakPolarHBondContact CE-OH 3.5Å; M123-Y127 WeakPolarHBondContact O-CD2 3.38Å; M123-Y127 PolarHBondContact O-N 3.19Å; M123-E206 HydrophobicContact CE-CB 3.5Å; M123-E206 HydrophobicContact CE-CG 3.84Å; M123-L210 HydrophobicContact CG-CD2 4.02Å; M123-L210 HydrophobicContact SD-CB 3.76Å; M123-L210 HydrophobicContact SD-CD1 4.47Å; M123-L210 HydrophobicContact SD-CD2 3.61Å; M123-L210 HydrophobicContact SD-CG 4.13Å
124	K	95.1	Very high	94.4	Very high	122 Å²	122	49.9 Å²	49.9	53%	0.53	24%	0.237	S	C	.	.	H	α-helix	trans	-58	-43.1	175	-70.7	180	178.8	-176.8	0	111.9	Y79 T120 K121 Y127 F128	Y79-K124 HydrophobicContact CE1-CB 4.27Å; Y79-K124 WeakPolarHBondContact OH-CB 3.28Å; T120-K124 WeakPolarHBondContact O-CG 3.39Å; T120-K124 PolarHBondContact O-N 2.89Å; K121-K124 PolarHBondContact O-N 3.28Å; K124-Y127 PolarHBondContact O-N 2.61Å; K124-F128 WeakPolarHBondContact O-CB 3.22Å; K124-F128 PolarHBondContact O-N 3.02Å
125	F	96.4	Very high	94.3	Very high	1 Å²	1	51 Å²	51	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-60.2	-46	174.5	171.2	-122.4	0	0	0	112.7	Y79 M82 L83 K121 L122 M123 Y127 F128 Q129 L171 K175 F213 I220	Y79-F125 HydrophobicContact CD1-CB 3.71Å; Y79-F125 HydrophobicContact CD1-CD2 4.02Å; Y79-F125 HydrophobicContact CD1-CG 4.27Å; Y79-F125 HydrophobicContact CE1-CB 3.88Å; Y79-F125 HydrophobicContact CG-CB 4.43Å; Y79-F125 AromaticContact CG-CD2 3.9Å; Y79-F125 HydrophobicContact CG-CD2 3.9Å; M82-F125 HydrophobicContact CE-CB 4.05Å; M82-F125 HydrophobicContact CE-CG 4.29Å; L83-F125 HydrophobicContact CD1-CE1 4.05Å; L83-F125 HydrophobicContact CD1-CE2 4.09Å; L83-F125 HydrophobicContact CD1-CZ 3.69Å; L83-F125 HydrophobicContact CD2-CD1 4.47Å; L83-F125 HydrophobicContact CD2-CE1 4.25Å; K121-F125 PolarHBondContact O-N 3.08Å; L122-F125 PolarHBondContact O-N 3.4Å; M123-F125 VanDerWaalsContact C-N 3.32Å; M123-F125 PolarHBondContact O-N 2.94Å; F125-Y127 VanDerWaalsContact C-N 3.3Å; F125-Y127 PolarHBondContact O-N 2.81Å; F125-F128 PolarHBondContact O-N 3.2Å; F125-Q129 WeakPolarHBondContact O-CG 3.42Å; F125-Q129 PolarHBondContact O-N 3.45Å; F125-L171 HydrophobicContact CE2-CB 4.32Å; F125-L171 HydrophobicContact CE2-CD1 4.26Å; F125-L171 HydrophobicContact CE2-CD2 3.98Å; F125-L171 HydrophobicContact CE2-CG 4.42Å; F125-L171 HydrophobicContact CZ-CB 4.43Å; F125-K175 HydrophobicContact CE1-CD 4.44Å; F125-F213 AromaticContact CD1-CE1 3.83Å; F125-F213 HydrophobicContact CD1-CE1 3.83Å; F125-F213 HydrophobicContact CD1-CZ 4.27Å; F125-F213 AromaticContact CE1-CE1 3.57Å; F125-F213 HydrophobicContact CE1-CE1 3.57Å; F125-F213 AromaticContact CE1-CZ 3.68Å; F125-F213 HydrophobicContact CE1-CZ 3.68Å; F125-F213 HydrophobicContact CZ-CE1 4.49Å; F125-F213 HydrophobicContact CZ-CZ 4.18Å; F125-I220 HydrophobicContact CZ-CD1 3.91Å
126	M	94.4	Very high	94.3	Very high	17 Å²	17	51 Å²	51	8%	0.084	23%	0.232	C	C	.	.	H	α-helix	trans	-59.4	-40.7	176.9	-178.9	-172.3	65.4	0	0	111.7	L122 M123 Q129 R130 N209 L210 F213	L122-M126 PolarHBondContact O-N 3.44Å; M123-M126 HydrophobicContact CE-CE 4.08Å; M123-M126 PolarHBondContact O-N 3.43Å; M123-M126 HydrophobicContact SD-CE 4Å; M126-Q129 WeakPolarHBondContact O-CG 2.99Å; M126-Q129 PolarHBondContact O-NE2 3.29Å; M126-R130 PolarHBondContact O-N 2.92Å; M126-N209 HydrophobicContact CE-CB 4.37Å; M126-N209 HydrophobicContact SD-CB 4.18Å; M126-L210 HydrophobicContact CB-CD1 4.22Å; M126-L210 HydrophobicContact SD-CB 4.2Å; M126-L210 HydrophobicContact SD-CD1 4.23Å; M126-F213 HydrophobicContact CB-CD1 4.14Å; M126-F213 HydrophobicContact CB-CE1 4.33Å; M126-F213 HydrophobicContact CG-CB 4.3Å; M126-F213 HydrophobicContact CG-CD1 4.1Å; M126-F213 HydrophobicContact CG-CG 4.06Å; M126-F213 HydrophobicContact SD-CB 4.16Å
127	Y	94	Very high	94.3	Very high	83 Å²	83	47.8 Å²	47.8	33%	0.325	22%	0.218	S	C	.	.	H	α-helix	trans	-71.1	-41.3	175.8	-63.7	-49	0	0	0	112.5	M123 K124 F125 R130 K131 E206	M123-Y127 HydrophobicContact CB-CE2 4.29Å; M123-Y127 HydrophobicContact CE-CE2 4.07Å; M123-Y127 VanDerWaalsContact CE-OH 3.3Å; M123-Y127 WeakPolarHBondContact CE-OH 3.5Å; M123-Y127 WeakPolarHBondContact O-CD2 3.38Å; M123-Y127 PolarHBondContact O-N 3.19Å; K124-Y127 PolarHBondContact O-N 2.61Å; F125-Y127 VanDerWaalsContact C-N 3.3Å; F125-Y127 PolarHBondContact O-N 2.81Å; Y127-R130 PolarHBondContact O-N 3.02Å; Y127-K131 WeakPolarHBondContact O-CB 3.27Å; Y127-K131 PolarHBondContact O-N 3.25Å; Y127-E206 WeakPolarHBondContact OH-CG 3.25Å; Y127-E206 PolarHBondContact OH-OE1 2.85Å
128	F	96.3	Very high	94.2	Very high	6 Å²	6	48 Å²	48	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-57.2	-55.5	177.8	169	-98	0	0	0	111.1	M72 E75 Y79 K124 F125 R130 K131 A132 M167 L171	M72-F128 HydrophobicContact CG-CE2 3.8Å; M72-F128 HydrophobicContact CG-CZ 4.12Å; M72-F128 WeakPolarHBondContact O-CZ 3.24Å; E75-F128 HydrophobicContact CB-CD2 4.47Å; E75-F128 HydrophobicContact CB-CE2 3.83Å; E75-F128 HydrophobicContact CB-CZ 4.48Å; E75-F128 HydrophobicContact CG-CD2 3.9Å; E75-F128 HydrophobicContact CG-CE2 3.76Å; E75-F128 WeakPolarHBondContact OE1-CD2 3.41Å; Y79-F128 HydrophobicContact CD2-CB 4.07Å; Y79-F128 AromaticContact CD2-CD1 3.51Å; Y79-F128 HydrophobicContact CD2-CD1 3.51Å; Y79-F128 HydrophobicContact CD2-CD2 4.12Å; Y79-F128 AromaticContact CD2-CE1 3.97Å; Y79-F128 HydrophobicContact CD2-CE1 3.97Å; Y79-F128 HydrophobicContact CD2-CE2 4.5Å; Y79-F128 AromaticContact CD2-CG 3.61Å; Y79-F128 HydrophobicContact CD2-CG 3.61Å; Y79-F128 HydrophobicContact CD2-CZ 4.44Å; Y79-F128 HydrophobicContact CE2-CB 3.49Å; Y79-F128 VanDerWaalsContact CE2-CB 3.49Å; Y79-F128 AromaticContact CE2-CD1 3.8Å; Y79-F128 HydrophobicContact CE2-CD1 3.8Å; Y79-F128 AromaticContact CE2-CD2 3.71Å; Y79-F128 HydrophobicContact CE2-CD2 3.71Å; Y79-F128 HydrophobicContact CE2-CE2 4.41Å; Y79-F128 AromaticContact CE2-CG 3.36Å; Y79-F128 HydrophobicContact CE2-CG 3.36Å; Y79-F128 HydrophobicContact CG-CD1 4.41Å; K124-F128 WeakPolarHBondContact O-CB 3.22Å; K124-F128 PolarHBondContact O-N 3.02Å; F125-F128 PolarHBondContact O-N 3.2Å; F128-R130 PolarHBondContact O-N 2.93Å; F128-K131 PolarHBondContact O-N 3.27Å; F128-K131 VanDerWaalsContact O-N 3.14Å; F128-A132 HydrophobicContact CE1-CB 4.36Å; F128-A132 HydrophobicContact CZ-CB 4.25Å; F128-A132 WeakPolarHBondContact O-CB 3.28Å; F128-A132 PolarHBondContact O-N 2.97Å; F128-M167 HydrophobicContact CE1-CE 4.43Å; F128-M167 HydrophobicContact CE1-SD 4.44Å; F128-M167 HydrophobicContact CZ-CE 4.3Å; F128-M167 HydrophobicContact CZ-SD 4.17Å; F128-L171 HydrophobicContact CE1-CD1 3.96Å
129	Q	94.3	Very high	94	Very high	15 Å²	15	46.3 Å²	46.3	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-35.7	-177.6	66.6	75.3	32	0	0	111.7	F125 M126 A132 I133 F213 I220	F125-Q129 WeakPolarHBondContact O-CG 3.42Å; F125-Q129 PolarHBondContact O-N 3.45Å; M126-Q129 WeakPolarHBondContact O-CG 2.99Å; M126-Q129 PolarHBondContact O-NE2 3.29Å; Q129-A132 PolarHBondContact O-N 3.3Å; Q129-I133 VanDerWaalsContact O-CG1 3.26Å; Q129-I133 WeakPolarHBondContact O-CG1 3.43Å; Q129-I133 PolarHBondContact O-N 2.76Å; Q129-F213 HydrophobicContact CG-CE2 4Å; Q129-F213 HydrophobicContact CG-CZ 3.88Å; Q129-I220 HydrophobicContact CB-CD1 4.26Å; Q129-I220 HydrophobicContact CG-CD1 4.41Å; Q129-I220 HydrophobicContact CG-CG1 4.41Å
130	R	92.8	Very high	93.9	Very high	130 Å²	130	45.7 Å²	45.7	49%	0.491	21%	0.21	S	C	.	.	H	α-helix	trans	-66.1	-48.7	177.9	-163.6	-177.5	84.4	-159.9	-0.1	110.8	M126 Y127 F128 A132 I133 E134	M126-R130 PolarHBondContact O-N 2.92Å; Y127-R130 PolarHBondContact O-N 3.02Å; F128-R130 PolarHBondContact O-N 2.93Å; R130-A132 VanDerWaalsContact C-N 3.31Å; R130-A132 PolarHBondContact O-N 2.63Å; R130-I133 PolarHBondContact O-N 3.49Å; R130-E134 WeakPolarHBondContact CG-OE1 3.27Å; R130-E134 IonicContact NE-OE1 2.68Å; R130-E134 PolarHBondContact NE-OE1 2.85Å; R130-E134 WeakPolarHBondContact O-CB 3.45Å; R130-E134 VanDerWaalsContact O-CG 3.29Å; R130-E134 WeakPolarHBondContact O-CG 3.23Å; R130-E134 PolarHBondContact O-N 3.27Å
131	K	94.6	Very high	93.8	Very high	122 Å²	122	49.1 Å²	49.1	53%	0.53	22%	0.218	S	C	.	.	H	α-helix	trans	-61	-40.4	176.2	-177.6	-174	174.4	-166.2	0	111.4	Y127 F128 R135	Y127-K131 WeakPolarHBondContact O-CB 3.27Å; Y127-K131 PolarHBondContact O-N 3.25Å; F128-K131 PolarHBondContact O-N 3.27Å; F128-K131 VanDerWaalsContact O-N 3.14Å; K131-R135 WeakPolarHBondContact O-CB 3.4Å; K131-R135 PolarHBondContact O-N 3.13Å
132	A	94.9	Very high	93.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.2	-45.1	179.7	0	0	0	0	0	111.9	M72 F128 Q129 R130 R135 F136 M167 F168	M72-A132 HydrophobicContact CG-CB 4.45Å; M72-A132 HydrophobicContact SD-CB 3.85Å; F128-A132 HydrophobicContact CE1-CB 4.36Å; F128-A132 HydrophobicContact CZ-CB 4.25Å; F128-A132 WeakPolarHBondContact O-CB 3.28Å; F128-A132 PolarHBondContact O-N 2.97Å; Q129-A132 PolarHBondContact O-N 3.3Å; R130-A132 VanDerWaalsContact C-N 3.31Å; R130-A132 PolarHBondContact O-N 2.63Å; A132-R135 PolarHBondContact O-N 3.06Å; A132-F136 VanDerWaalsContact O-CB 3.27Å; A132-F136 WeakPolarHBondContact O-CB 3.4Å; A132-F136 PolarHBondContact O-N 2.77Å; A132-M167 HydrophobicContact CB-CE 4.18Å; A132-F168 HydrophobicContact CB-CE1 3.86Å; A132-F168 HydrophobicContact CB-CZ 4.2Å
133	I	94.9	Very high	93.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.8	-49.2	174.1	-67	170.1	0	0	0	110.2	Q129 R130 R135 F136 C137 F168 I220 C223 L224 Q227	Q129-I133 VanDerWaalsContact O-CG1 3.26Å; Q129-I133 WeakPolarHBondContact O-CG1 3.43Å; Q129-I133 PolarHBondContact O-N 2.76Å; R130-I133 PolarHBondContact O-N 3.49Å; I133-R135 VanDerWaalsContact C-N 3.32Å; I133-R135 PolarHBondContact O-N 2.66Å; I133-F136 PolarHBondContact O-N 3.18Å; I133-C137 VanDerWaalsContact O-CB 3.31Å; I133-C137 WeakPolarHBondContact O-CB 3.43Å; I133-C137 PolarHBondContact O-N 2.96Å; I133-C137 PolarHBondContact O-SG 3.09Å; I133-F168 HydrophobicContact CG1-CD1 4.11Å; I133-F168 HydrophobicContact CG1-CE1 3.65Å; I133-F168 HydrophobicContact CG1-CZ 4.03Å; I133-I220 HydrophobicContact CD1-CG2 4Å; I133-C223 HydrophobicContact CD1-CB 4.06Å; I133-L224 HydrophobicContact CG2-CD1 4.15Å; I133-Q227 HydrophobicContact CG2-CG 4.46Å
134	E	93.4	Very high	93	Very high	89 Å²	89	48.9 Å²	48.9	42%	0.416	22%	0.216	S	C	.	.	H	α-helix	trans	-58.6	-43.9	179.3	-74.9	169.8	-165.8	0	0	111.6	R130 S138	R130-E134 WeakPolarHBondContact CG-OE1 3.27Å; R130-E134 IonicContact NE-OE1 2.68Å; R130-E134 PolarHBondContact NE-OE1 2.85Å; R130-E134 WeakPolarHBondContact O-CB 3.45Å; R130-E134 VanDerWaalsContact O-CG 3.29Å; R130-E134 WeakPolarHBondContact O-CG 3.23Å; R130-E134 PolarHBondContact O-N 3.27Å; E134-S138 WeakPolarHBondContact O-CB 3.4Å; E134-S138 PolarHBondContact O-N 3.29Å
135	R	93.4	Very high	92.7	Very high	103 Å²	103	48.4 Å²	48.4	39%	0.389	22%	0.215	S	C	.	.	H	α-helix	trans	-64.7	-46.8	177.9	-177.6	60.7	171.1	-148.9	-4.8	111.7	M72 K131 A132 I133 S138 E139	M72-R135 HydrophobicContact CE-CB 4.35Å; M72-R135 HydrophobicContact CE-CG 4.22Å; M72-R135 HydrophobicContact SD-CB 4.33Å; M72-R135 HydrophobicContact SD-CG 4.35Å; K131-R135 WeakPolarHBondContact O-CB 3.4Å; K131-R135 PolarHBondContact O-N 3.13Å; A132-R135 PolarHBondContact O-N 3.06Å; I133-R135 VanDerWaalsContact C-N 3.32Å; I133-R135 PolarHBondContact O-N 2.66Å; R135-S138 PolarHBondContact O-N 3.49Å; R135-E139 PolarHBondContact O-N 2.95Å; R135-E139 VanDerWaalsContact O-N 3.09Å
136	F	94.4	Very high	91.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-50.8	177.6	177.1	-98.5	0	0	0	111.3	A132 I133 S138 E139 V140 L161 F164 I165 F168 L224 L228	A132-F136 VanDerWaalsContact O-CB 3.27Å; A132-F136 WeakPolarHBondContact O-CB 3.4Å; A132-F136 PolarHBondContact O-N 2.77Å; I133-F136 PolarHBondContact O-N 3.18Å; F136-S138 VanDerWaalsContact C-N 3.34Å; F136-S138 PolarHBondContact O-N 2.95Å; F136-E139 WeakPolarHBondContact O-CB 3.47Å; F136-E139 PolarHBondContact O-N 3.43Å; F136-V140 HydrophobicContact CD1-CG2 4.11Å; F136-V140 HydrophobicContact CE1-CG2 3.75Å; F136-V140 HydrophobicContact CE2-CG2 4.41Å; F136-V140 HydrophobicContact CZ-CG2 3.91Å; F136-V140 WeakPolarHBondContact O-CG2 3.36Å; F136-V140 PolarHBondContact O-N 3.48Å; F136-L161 HydrophobicContact CD2-CD2 4.01Å; F136-L161 HydrophobicContact CE2-CB 4.13Å; F136-L161 HydrophobicContact CE2-CD2 3.86Å; F136-F164 HydrophobicContact CB-CD1 4.45Å; F136-F164 HydrophobicContact CD2-CB 3.67Å; F136-F164 HydrophobicContact CD2-CD1 4.25Å; F136-F164 HydrophobicContact CD2-CG 4.06Å; F136-F164 HydrophobicContact CE2-CB 3.85Å; F136-I165 HydrophobicContact CE1-CG1 4.41Å; F136-I165 HydrophobicContact CE2-CG1 4.18Å; F136-I165 HydrophobicContact CZ-CD1 4.08Å; F136-I165 HydrophobicContact CZ-CG1 3.64Å; F136-F168 HydrophobicContact CB-CE2 4.05Å; F136-F168 HydrophobicContact CB-CZ 4.06Å; F136-F168 HydrophobicContact CD1-CE2 4.05Å; F136-F168 HydrophobicContact CD2-CE2 4.38Å; F136-F168 AromaticContact CG-CE2 3.9Å; F136-F168 HydrophobicContact CG-CE2 3.9Å; F136-F168 HydrophobicContact CG-CZ 4.42Å; F136-L224 HydrophobicContact CD1-CD1 3.8Å; F136-L224 HydrophobicContact CE1-CD1 4.07Å; F136-L228 HydrophobicContact CE1-CD1 4.48Å; F136-L228 HydrophobicContact CE1-CD2 4.15Å
137	C	93.6	Very high	90.9	Very high	7 Å²	7	58.3 Å²	58.3	5%	0.047	27%	0.274	C	S	.	.	H	α-helix	trans	-63.5	-37.1	178.6	-69.3	0	0	0	0	112.5	I133 E139 V140 K141 Q227 I231	I133-C137 VanDerWaalsContact O-CB 3.31Å; I133-C137 WeakPolarHBondContact O-CB 3.43Å; I133-C137 PolarHBondContact O-N 2.96Å; I133-C137 PolarHBondContact O-SG 3.09Å; C137-E139 PolarHBondContact O-N 3.47Å; C137-V140 PolarHBondContact O-N 3Å; C137-K141 VanDerWaalsContact O-CB 3.32Å; C137-K141 WeakPolarHBondContact O-CB 3.38Å; C137-K141 PolarHBondContact O-N 3.47Å; C137-Q227 HydrophobicContact CB-CB 4.29Å; C137-I231 HydrophobicContact CB-CD1 4.24Å; C137-I231 VanDerWaalsContact O-CD1 3.3Å; C137-I231 WeakPolarHBondContact O-CD1 3.37Å
138	S	91.9	Very high	90.1	Very high	73 Å²	73	58 Å²	58	51%	0.51	27%	0.272	S	S	.	.	H	α-helix	trans	-60.2	-39	172.9	-178.4	0	0	0	0	111.3	E134 R135 F136 K141 R142	E134-S138 WeakPolarHBondContact O-CB 3.4Å; E134-S138 PolarHBondContact O-N 3.29Å; R135-S138 PolarHBondContact O-N 3.49Å; F136-S138 VanDerWaalsContact C-N 3.34Å; F136-S138 PolarHBondContact O-N 2.95Å; S138-K141 PolarHBondContact O-N 2.91Å; S138-R142 WeakPolarHBondContact O-CB 3.24Å; S138-R142 PolarHBondContact O-N 3.01Å
139	E	91	Very high	89	Confident	13 Å²	13	62.4 Å²	62.4	6%	0.061	29%	0.289	C	S	.	.	H	α-helix	trans	-73.3	-41.1	179.2	-170.1	57.4	-161.6	0	0	112.1	M69 R135 F136 C137 K141 R142 L143 Y157 L161	M69-E139 HydrophobicContact SD-CG 4.26Å; R135-E139 PolarHBondContact O-N 2.95Å; R135-E139 VanDerWaalsContact O-N 3.09Å; F136-E139 WeakPolarHBondContact O-CB 3.47Å; F136-E139 PolarHBondContact O-N 3.43Å; C137-E139 PolarHBondContact O-N 3.47Å; E139-K141 VanDerWaalsContact C-N 3.31Å; E139-K141 PolarHBondContact O-N 2.88Å; E139-R142 VanDerWaalsContact CD-NE 3.32Å; E139-R142 WeakPolarHBondContact O-CB 3.44Å; E139-R142 PolarHBondContact O-N 2.91Å; E139-R142 VanDerWaalsContact O-N 3.16Å; E139-R142 IonicContact OE1-CZ 2.84Å; E139-R142 IonicContact OE1-NE 3.56Å; E139-R142 PolarHBondContact OE1-NE 3.34Å; E139-R142 IonicContact OE1-NH2 3.37Å; E139-R142 PolarHBondContact OE1-NH2 3.11Å; E139-R142 IonicContact OE2-CZ 3.54Å; E139-R142 IonicContact OE2-NE 3.49Å; E139-R142 PolarHBondContact OE2-NE 3.21Å; E139-L143 HydrophobicContact CG-CD1 4.36Å; E139-L143 WeakPolarHBondContact O-CG 3.36Å; E139-L143 PolarHBondContact O-N 3.03Å; E139-Y157 HydrophobicContact CG-CE1 4.44Å; E139-Y157 WeakPolarHBondContact CG-OH 3.44Å; E139-Y157 PolarHBondContact OE1-OH 3.13Å; E139-L161 HydrophobicContact CG-CD2 4.4Å
140	V	92	Very high	88.1	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-56.2	-47.3	169.7	173.6	0	0	0	0	110.2	F136 C137 R142 L143 C144 L228 I231 L237	F136-V140 HydrophobicContact CD1-CG2 4.11Å; F136-V140 HydrophobicContact CE1-CG2 3.75Å; F136-V140 HydrophobicContact CE2-CG2 4.41Å; F136-V140 HydrophobicContact CZ-CG2 3.91Å; F136-V140 WeakPolarHBondContact O-CG2 3.36Å; F136-V140 PolarHBondContact O-N 3.48Å; C137-V140 PolarHBondContact O-N 3Å; V140-R142 VanDerWaalsContact C-N 3.31Å; V140-R142 PolarHBondContact O-N 2.89Å; V140-L143 PolarHBondContact O-N 3.24Å; V140-C144 VanDerWaalsContact O-CB 3.24Å; V140-C144 WeakPolarHBondContact O-CB 3.29Å; V140-C144 PolarHBondContact O-N 3.31Å; V140-C144 PolarHBondContact O-SG 2.97Å; V140-L228 HydrophobicContact CB-CD2 4.28Å; V140-L228 HydrophobicContact CG1-CD2 4.01Å; V140-L228 HydrophobicContact CG2-CD2 4.1Å; V140-I231 HydrophobicContact CB-CD1 4.32Å; V140-I231 HydrophobicContact CG1-CD1 4.15Å; V140-L237 HydrophobicContact CB-CD2 4.13Å; V140-L237 HydrophobicContact CG1-CD2 4.01Å; V140-L237 HydrophobicContact CG2-CD2 3.97Å
141	K	91.3	Very high	87.3	Confident	141 Å²	141	63.3 Å²	63.3	61%	0.613	30%	0.298	S	S	*	.	H	α-helix	trans	-59.7	-40.3	177.2	-172.8	176.4	179.9	177.5	0	112.4	C137 S138 E139 H145 I231	C137-K141 VanDerWaalsContact O-CB 3.32Å; C137-K141 WeakPolarHBondContact O-CB 3.38Å; C137-K141 PolarHBondContact O-N 3.47Å; S138-K141 PolarHBondContact O-N 2.91Å; E139-K141 VanDerWaalsContact C-N 3.31Å; E139-K141 PolarHBondContact O-N 2.88Å; K141-H145 PolarHBondContact O-N 3.07Å; K141-I231 HydrophobicContact CB-CD1 3.94Å; K141-I231 HydrophobicContact CB-CG1 4.22Å; K141-I231 HydrophobicContact CB-CG2 4.25Å; K141-I231 HydrophobicContact CG-CG2 4.43Å
142	R	88.6	Confident	86.7	Confident	86 Å²	86	58.8 Å²	58.8	33%	0.325	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-45.1	177.3	-168.7	-174.1	75.8	94.3	1.2	111.6	S138 E139 V140	S138-R142 WeakPolarHBondContact O-CB 3.24Å; S138-R142 PolarHBondContact O-N 3.01Å; E139-R142 VanDerWaalsContact CD-NE 3.32Å; E139-R142 WeakPolarHBondContact O-CB 3.44Å; E139-R142 PolarHBondContact O-N 2.91Å; E139-R142 VanDerWaalsContact O-N 3.16Å; E139-R142 IonicContact OE1-CZ 2.84Å; E139-R142 IonicContact OE1-NE 3.56Å; E139-R142 PolarHBondContact OE1-NE 3.34Å; E139-R142 IonicContact OE1-NH2 3.37Å; E139-R142 PolarHBondContact OE1-NH2 3.11Å; E139-R142 IonicContact OE2-CZ 3.54Å; E139-R142 IonicContact OE2-NE 3.49Å; E139-R142 PolarHBondContact OE2-NE 3.21Å; V140-R142 VanDerWaalsContact C-N 3.31Å; V140-R142 PolarHBondContact O-N 2.89Å
143	L	87.6	Confident	86.1	Confident	11 Å²	11	60.3 Å²	60.3	6%	0.058	29%	0.287	C	S	.	.	H	α-helix	trans	-76.2	-29.4	-178.3	-64.3	175	0	0	0	113	E139 V140 H145 R148 R149 V153 Y157 L161 L237	E139-L143 HydrophobicContact CG-CD1 4.36Å; E139-L143 WeakPolarHBondContact O-CG 3.36Å; E139-L143 PolarHBondContact O-N 3.03Å; V140-L143 PolarHBondContact O-N 3.24Å; L143-H145 VanDerWaalsContact C-N 3.34Å; L143-H145 PolarHBondContact O-N 3.18Å; L143-R148 CarbonylContact O-C 3.54Å; L143-R149 PolarHBondContact O-N 2.99Å; L143-V153 HydrophobicContact CD2-CG2 4.07Å; L143-Y157 HydrophobicContact CD1-CE1 3.99Å; L143-L161 HydrophobicContact CD1-CD1 3.82Å; L143-L237 HydrophobicContact CB-CD1 4.39Å; L143-L237 HydrophobicContact CB-CD2 4.03Å; L143-L237 HydrophobicContact CD1-CD1 4.18Å; L143-L237 HydrophobicContact CD1-CD2 3.95Å
144	C	87.8	Confident	85.7	Confident	8 Å²	8	60.3 Å²	60.3	5%	0.054	29%	0.287	C	S	.	.	H	α-helix	trans	-81.6	-6.4	179.6	-71.7	0	0	0	0	114.7	V140 R149 I231 G233	V140-C144 VanDerWaalsContact O-CB 3.24Å; V140-C144 WeakPolarHBondContact O-CB 3.29Å; V140-C144 PolarHBondContact O-N 3.31Å; V140-C144 PolarHBondContact O-SG 2.97Å; C144-R149 PolarHBondContact O-NE 2.89Å; C144-R149 PolarHBondContact O-NH2 3.1Å; C144-R149 VanDerWaalsContact O-NH2 3.08Å; C144-I231 HydrophobicContact CB-CG2 4.2Å; C144-G233 PolarHBondContact SG-O 2.88Å
145	H	88.3	Confident	85.5	Confident	111 Å²	111	58.5 Å²	58.5	51%	0.514	28%	0.279	S	S	.	.	S	Bend	trans	-53.3	142.3	177.1	-175.3	-97	0	0	0	111.6	K141 L143 E147 R148 R149	K141-H145 PolarHBondContact O-N 3.07Å; L143-H145 VanDerWaalsContact C-N 3.34Å; L143-H145 PolarHBondContact O-N 3.18Å; H145-E147 PolarHBondContact ND1-N 3.01Å; H145-E147 PolarHBondContact O-N 3.31Å; H145-R148 HydrophobicContact CB-CB 4.02Å; H145-R148 CarbonylContact O-C 3.37Å; H145-R148 PolarHBondContact O-N 3.08Å; H145-R149 WeakPolarHBondContact O-CB 3.46Å; H145-R149 PolarHBondContact O-N 3.41Å
146	A	78.2	Confident	85.1	Confident	74 Å²	74	55.3 Å²	55.3	61%	0.612	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-34.6	-168.9	0	0	0	0	0	114.6
147	E	75.5	Confident	84.8	Confident	152 Å²	152	55.4 Å²	55.4	71%	0.71	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-36.9	173.9	-66.6	-167.4	153.9	0	0	112.9	H145 K150	H145-E147 PolarHBondContact ND1-N 3.01Å; H145-E147 PolarHBondContact O-N 3.31Å; E147-K150 PolarHBondContact O-N 3.25Å
148	R	77.1	Confident	84.6	Confident	76 Å²	76	55.5 Å²	55.5	29%	0.287	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-77.6	-23.8	-176.9	-152.7	72.4	178.7	179.8	-13.2	113.1	L143 H145 K150 D151	L143-R148 CarbonylContact O-C 3.54Å; H145-R148 HydrophobicContact CB-CB 4.02Å; H145-R148 CarbonylContact O-C 3.37Å; H145-R148 PolarHBondContact O-N 3.08Å; R148-K150 PolarHBondContact O-N 3.18Å; R148-D151 WeakPolarHBondContact CD-OD2 3.3Å; R148-D151 IonicContact CZ-OD2 3.9Å; R148-D151 IonicContact NE-OD2 3.21Å; R148-D151 IonicContact NH1-OD2 2.65Å; R148-D151 PolarHBondContact NH1-OD2 3.32Å; R148-D151 VanDerWaalsContact O-CB 3.28Å; R148-D151 WeakPolarHBondContact O-CB 3.48Å; R148-D151 PolarHBondContact O-N 3.23Å
149	R	74.3	Confident	84.5	Confident	99 Å²	99	53.8 Å²	53.8	37%	0.374	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-60.9	-27.4	174.8	-171.8	-179.2	-60.2	-165.1	3.5	112.5	L143 C144 H145 P232	L143-R149 PolarHBondContact O-N 2.99Å; C144-R149 PolarHBondContact O-NE 2.89Å; C144-R149 PolarHBondContact O-NH2 3.1Å; C144-R149 VanDerWaalsContact O-NH2 3.08Å; H145-R149 WeakPolarHBondContact O-CB 3.46Å; H145-R149 PolarHBondContact O-N 3.41Å; R149-P232 PolarHBondContact NH2-O 3.07Å
150	K	74.6	Confident	84.5	Confident	125 Å²	125	53.4 Å²	53.4	54%	0.543	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-89.2	-7	178	-50.9	177.7	-178.3	171	0	112.5	E147 R148 S572 G573	E147-K150 PolarHBondContact O-N 3.25Å; R148-K150 PolarHBondContact O-N 3.18Å; K150-S572 CarbonylContact O-C 3.57Å; K150-S572 VanDerWaalsContact O-CA 3.26Å; K150-S572 WeakPolarHBondContact O-CA 3.09Å; K150-G573 PolarHBondContact O-N 2.95Å
151	D	76.1	Confident	84.6	Confident	40 Å²	40	53.4 Å²	53.4	21%	0.214	26%	0.259	C	S	.	.	S	Bend	trans	-83.1	152.7	-179.4	-90.6	-14	0	0	0	111.6	R58 R148	R58-D151 IonicContact NH1-OD1 2.73Å; R58-D151 IonicContact NH1-OD2 2.95Å; R58-D151 IonicContact NH2-OD2 2.72Å; R148-D151 WeakPolarHBondContact CD-OD2 3.3Å; R148-D151 IonicContact CZ-OD2 3.9Å; R148-D151 IonicContact NE-OD2 3.21Å; R148-D151 IonicContact NH1-OD2 2.65Å; R148-D151 PolarHBondContact NH1-OD2 3.32Å; R148-D151 VanDerWaalsContact O-CB 3.28Å; R148-D151 WeakPolarHBondContact O-CB 3.48Å; R148-D151 PolarHBondContact O-N 3.23Å
152	F	81.4	Confident	84.6	Confident	26 Å²	26	46.7 Å²	46.7	11%	0.114	23%	0.23	C	C	.	.			trans	-64.9	135.5	173.4	170.3	-102.2	0	0	0	112.1	R58 Y59 T562 E565 A569	R58-F152 PolarHBondContact NH2-O 3.48Å; Y59-F152 HydrophobicContact CE1-CE1 4.49Å; F152-T562 HydrophobicContact CE1-CG2 4.21Å; F152-E565 HydrophobicContact CE2-CB 4.25Å; F152-E565 HydrophobicContact CE2-CG 3.82Å; F152-E565 VanDerWaalsContact CE2-OE1 3.31Å; F152-E565 WeakPolarHBondContact CE2-OE1 3.41Å; F152-E565 HydrophobicContact CZ-CB 3.83Å; F152-E565 VanDerWaalsContact CZ-CD 3.48Å; F152-E565 HydrophobicContact CZ-CG 3.77Å; F152-E565 WeakPolarHBondContact CZ-OE1 3.41Å; F152-A569 HydrophobicContact CD2-CB 3.56Å; F152-A569 HydrophobicContact CE2-CB 3.93Å
153	V	83.3	Confident	84.8	Confident	32 Å²	32	47.1 Å²	47.1	19%	0.194	23%	0.234	C	C	.	.			trans	-126.3	132.9	170.8	-174.1	0	0	0	0	106.9	L143 Y157 L158	L143-V153 HydrophobicContact CD2-CG2 4.07Å; V153-Y157 HydrophobicContact CG1-CD1 3.8Å; V153-L158 HydrophobicContact CB-CD1 4.33Å; V153-L158 HydrophobicContact CB-CG 4.44Å; V153-L158 HydrophobicContact CG1-CD1 4.26Å; V153-L158 HydrophobicContact CG1-CD2 3.96Å; V153-L158 HydrophobicContact CG1-CG 3.85Å
154	S	86.2	Confident	85.2	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.231	C	C	.	.			trans	-71.4	143.3	-176.8	63.9	0	0	0	0	111.8	Q62 A156 Y157 L158 E565	Q62-S154 PolarHBondContact NE2-OG 2.85Å; S154-A156 VanDerWaalsContact C-N 3.31Å; S154-A156 PolarHBondContact O-N 3.49Å; S154-Y157 WeakPolarHBondContact O-CB 3.45Å; S154-Y157 PolarHBondContact O-N 2.79Å; S154-Y157 WeakPolarHBondContact OG-CB 3.21Å; S154-Y157 PolarHBondContact OG-N 2.91Å; S154-L158 PolarHBondContact O-N 3.4Å; S154-L158 VanDerWaalsContact O-N 3.09Å; S154-E565 WeakPolarHBondContact CA-OE1 3.18Å
155	E	88.1	Confident	85.4	Confident	51 Å²	51	46.3 Å²	46.3	24%	0.238	23%	0.229	C	C	.	.	H	α-helix	trans	-52.5	-46.1	174.5	-77.8	168.5	-157.3	0	0	112.3	Y157 L158 L159 I244 Y248 E565 H594	E155-Y157 PolarHBondContact O-N 3.46Å; E155-L158 PolarHBondContact O-N 2.97Å; E155-L158 VanDerWaalsContact O-N 3.12Å; E155-L159 PolarHBondContact O-N 3.2Å; E155-I244 HydrophobicContact CB-CD1 4.5Å; E155-I244 HydrophobicContact CG-CD1 4.02Å; E155-Y248 WeakPolarHBondContact OE2-CE1 3.48Å; E155-Y248 PolarHBondContact OE2-OH 2.96Å; E155-E565 VanDerWaalsContact CG-OE1 3.31Å; E155-E565 WeakPolarHBondContact CG-OE1 3.27Å; E155-E565 PolarHBondContact N-OE1 3.19Å; E155-E565 PolarHBondContact N-OE2 3.1Å; E155-H594 IonicContact OE2-CE1 2.68Å
156	A	86.4	Confident	85.7	Confident	37 Å²	37	41.5 Å²	41.5	31%	0.306	21%	0.207	S	C	.	.	H	α-helix	trans	-58.3	-35.7	179	0	0	0	0	0	112.6	S154 T160 Y558	S154-A156 VanDerWaalsContact C-N 3.31Å; S154-A156 PolarHBondContact O-N 3.49Å; A156-T160 PolarHBondContact O-N 3.48Å; A156-T160 VanDerWaalsContact O-N 3.09Å; A156-T160 PolarHBondContact O-OG1 2.85Å; A156-T160 VanDerWaalsContact O-OG1 3.13Å; A156-Y558 HydrophobicContact CB-CE2 4.16Å
157	Y	87.4	Confident	86.5	Confident	1 Å²	1	38.6 Å²	38.6	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-75.9	-37.7	178.3	-170	-124.5	0	0	0	112.2	V65 H66 M69 E139 L143 V153 S154 E155 L159 T160 L161	V65-Y157 HydrophobicContact CG1-CE2 4.43Å; V65-Y157 WeakPolarHBondContact CG1-OH 3.45Å; H66-Y157 HydrophobicContact CB-CD2 3.93Å; H66-Y157 HydrophobicContact CB-CE2 4.19Å; H66-Y157 AromaticContact CD2-CD2 3.93Å; H66-Y157 AromaticContact CG-CD2 3.83Å; M69-Y157 HydrophobicContact SD-CE2 3.82Å; M69-Y157 PolarHBondContact SD-OH 3.37Å; E139-Y157 HydrophobicContact CG-CE1 4.44Å; E139-Y157 WeakPolarHBondContact CG-OH 3.44Å; E139-Y157 PolarHBondContact OE1-OH 3.13Å; L143-Y157 HydrophobicContact CD1-CE1 3.99Å; V153-Y157 HydrophobicContact CG1-CD1 3.8Å; S154-Y157 WeakPolarHBondContact O-CB 3.45Å; S154-Y157 PolarHBondContact O-N 2.79Å; S154-Y157 WeakPolarHBondContact OG-CB 3.21Å; S154-Y157 PolarHBondContact OG-N 2.91Å; E155-Y157 PolarHBondContact O-N 3.46Å; Y157-L159 VanDerWaalsContact C-N 3.3Å; Y157-L159 PolarHBondContact O-N 3.29Å; Y157-T160 PolarHBondContact O-N 2.99Å; Y157-L161 HydrophobicContact CD1-CD1 4.47Å; Y157-L161 HydrophobicContact CE1-CD1 4.39Å; Y157-L161 WeakPolarHBondContact O-CG 3.42Å; Y157-L161 PolarHBondContact O-N 3.44Å
158	L	89.8	Confident	87.4	Confident	10 Å²	10	31.4 Å²	31.4	5%	0.052	15%	0.147	C	C	.	.	H	α-helix	trans	-63.7	-38.1	173.5	-69.4	168	0	0	0	111.2	V153 S154 E155 L161 G162 L237 I241 I244	V153-L158 HydrophobicContact CB-CD1 4.33Å; V153-L158 HydrophobicContact CB-CG 4.44Å; V153-L158 HydrophobicContact CG1-CD1 4.26Å; V153-L158 HydrophobicContact CG1-CD2 3.96Å; V153-L158 HydrophobicContact CG1-CG 3.85Å; S154-L158 PolarHBondContact O-N 3.4Å; S154-L158 VanDerWaalsContact O-N 3.09Å; E155-L158 PolarHBondContact O-N 2.97Å; E155-L158 VanDerWaalsContact O-N 3.12Å; L158-L161 HydrophobicContact CD2-CD1 4.43Å; L158-L161 PolarHBondContact O-N 3.08Å; L158-G162 PolarHBondContact O-N 3.32Å; L158-L237 HydrophobicContact CD2-CD1 3.7Å; L158-I241 HydrophobicContact CB-CG1 4.32Å; L158-I241 HydrophobicContact CD2-CG1 3.92Å; L158-I244 HydrophobicContact CB-CD1 3.74Å; L158-I244 HydrophobicContact CD1-CD1 3.17Å; L158-I244 HydrophobicContact CG-CD1 4.05Å
159	L	90.6	Very high	88.2	Confident	36 Å²	36	27.9 Å²	27.9	19%	0.188	14%	0.135	C	C	.	.	H	α-helix	trans	-63.6	-41.4	171.5	-75.1	178.1	0	0	0	112.6	E155 Y157 L161 G162 K163 I244 Y248 L263	E155-L159 PolarHBondContact O-N 3.2Å; Y157-L159 VanDerWaalsContact C-N 3.3Å; Y157-L159 PolarHBondContact O-N 3.29Å; L159-L161 VanDerWaalsContact C-N 3.35Å; L159-L161 PolarHBondContact O-N 3.19Å; L159-G162 CarbonylContact O-C 3.4Å; L159-G162 WeakPolarHBondContact O-CA 3.16Å; L159-G162 PolarHBondContact O-N 3.27Å; L159-G162 VanDerWaalsContact O-N 3.08Å; L159-K163 WeakPolarHBondContact O-CG 3.47Å; L159-K163 PolarHBondContact O-N 3.44Å; L159-I244 HydrophobicContact CD2-CG2 4.14Å; L159-I244 HydrophobicContact CG-CG2 4.3Å; L159-Y248 HydrophobicContact CD1-CD2 3.95Å; L159-Y248 HydrophobicContact CD1-CE2 3.46Å; L159-Y248 VanDerWaalsContact CD1-CE2 3.46Å; L159-Y248 HydrophobicContact CD2-CD2 4.48Å; L159-Y248 HydrophobicContact CG-CE2 4.44Å; L159-L263 HydrophobicContact CD2-CD2 3.95Å
160	T	91	Very high	89.1	Confident	5 Å²	5	23.7 Å²	23.7	3%	0.031	12%	0.12	C	C	.	.	H	α-helix	trans	-61.4	-43.8	174.6	-64.3	0	0	0	0	111.2	H66 M69 N70 L73 A156 Y157 G162 K163 F164	H66-T160 PolarHBondContact NE2-OG1 3.26Å; M69-T160 HydrophobicContact CB-CG2 4.22Å; N70-T160 WeakPolarHBondContact OD1-CG2 3.4Å; L73-T160 HydrophobicContact CD1-CG2 3.93Å; A156-T160 PolarHBondContact O-N 3.48Å; A156-T160 VanDerWaalsContact O-N 3.09Å; A156-T160 PolarHBondContact O-OG1 2.85Å; A156-T160 VanDerWaalsContact O-OG1 3.13Å; Y157-T160 PolarHBondContact O-N 2.99Å; T160-G162 VanDerWaalsContact C-N 3.27Å; T160-G162 PolarHBondContact O-N 3.1Å; T160-K163 WeakPolarHBondContact O-CB 3.27Å; T160-K163 PolarHBondContact O-N 3.49Å; T160-K163 VanDerWaalsContact O-N 3.08Å; T160-F164 HydrophobicContact CG2-CD2 4.31Å; T160-F164 HydrophobicContact CG2-CE2 4.19Å; T160-F164 WeakPolarHBondContact O-CD2 3.43Å; T160-F164 PolarHBondContact O-N 3.28Å
161	L	92.3	Very high	90.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60.2	-37.5	171.6	-65.3	176.9	0	0	0	112.1	M69 F136 E139 L143 Y157 L158 L159 F164 I165 L237 I241	M69-L161 HydrophobicContact CE-CD2 3.55Å; M69-L161 HydrophobicContact SD-CD2 4.11Å; F136-L161 HydrophobicContact CD2-CD2 4.01Å; F136-L161 HydrophobicContact CE2-CB 4.13Å; F136-L161 HydrophobicContact CE2-CD2 3.86Å; E139-L161 HydrophobicContact CG-CD2 4.4Å; L143-L161 HydrophobicContact CD1-CD1 3.82Å; Y157-L161 HydrophobicContact CD1-CD1 4.47Å; Y157-L161 HydrophobicContact CE1-CD1 4.39Å; Y157-L161 WeakPolarHBondContact O-CG 3.42Å; Y157-L161 PolarHBondContact O-N 3.44Å; L158-L161 HydrophobicContact CD2-CD1 4.43Å; L158-L161 PolarHBondContact O-N 3.08Å; L159-L161 VanDerWaalsContact C-N 3.35Å; L159-L161 PolarHBondContact O-N 3.19Å; L161-F164 WeakPolarHBondContact O-CB 3.42Å; L161-F164 PolarHBondContact O-N 2.91Å; L161-I165 WeakPolarHBondContact O-CG1 3.41Å; L161-I165 PolarHBondContact O-N 3.41Å; L161-I165 VanDerWaalsContact O-N 3.14Å; L161-L237 HydrophobicContact CD1-CD2 4.36Å; L161-I241 HydrophobicContact CB-CD1 3.65Å; L161-I241 HydrophobicContact CB-CG1 4.47Å; L161-I241 HydrophobicContact CD1-CD1 4.4Å
162	G	92.7	Very high	91	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.01	8%	0.084	C	C	.	.	H	α-helix	trans	-58.6	-47	169.7	0	0	0	0	0	112.8	L158 L159 T160 F164 I165 N166 V266	L158-G162 PolarHBondContact O-N 3.32Å; L159-G162 CarbonylContact O-C 3.4Å; L159-G162 WeakPolarHBondContact O-CA 3.16Å; L159-G162 PolarHBondContact O-N 3.27Å; L159-G162 VanDerWaalsContact O-N 3.08Å; T160-G162 VanDerWaalsContact C-N 3.27Å; T160-G162 PolarHBondContact O-N 3.1Å; G162-F164 VanDerWaalsContact C-N 3.25Å; G162-F164 PolarHBondContact O-N 3.29Å; G162-I165 WeakPolarHBondContact O-CB 3.41Å; G162-I165 PolarHBondContact O-N 3.47Å; G162-I165 VanDerWaalsContact O-N 3.09Å; G162-N166 PolarHBondContact O-N 3.17Å; G162-V266 VanDerWaalsContact O-CG2 3.27Å; G162-V266 WeakPolarHBondContact O-CG2 3.44Å
163	K	92.9	Very high	91.4	Very high	95 Å²	95	16.9 Å²	16.9	41%	0.413	9%	0.09	S	C	.	.	H	α-helix	trans	-59.5	-35.1	175.7	-68.2	178.6	-177.6	-177.5	0	112	L73 L159 T160 N166 M167 M262	L73-K163 HydrophobicContact CD1-CB 3.77Å; L73-K163 HydrophobicContact CD1-CD 4.14Å; L73-K163 HydrophobicContact CD2-CB 4.09Å; L159-K163 WeakPolarHBondContact O-CG 3.47Å; L159-K163 PolarHBondContact O-N 3.44Å; T160-K163 WeakPolarHBondContact O-CB 3.27Å; T160-K163 PolarHBondContact O-N 3.49Å; T160-K163 VanDerWaalsContact O-N 3.08Å; K163-N166 PolarHBondContact O-N 2.96Å; K163-M167 WeakPolarHBondContact O-CB 3.47Å; K163-M167 PolarHBondContact O-N 2.94Å; K163-M262 HydrophobicContact CG-CE 4.34Å; K163-M262 HydrophobicContact CG-CG 4.36Å; K163-M262 HydrophobicContact CG-SD 4.28Å
164	F	94.5	Very high	91.9	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.9	-45.7	172.6	-92.3	-97.7	0	0	0	112.3	M69 M72 L73 F136 T160 L161 G162 N166 M167 F168	M69-F164 HydrophobicContact CB-CE2 3.77Å; M69-F164 HydrophobicContact CB-CZ 4.04Å; M69-F164 HydrophobicContact CE-CD1 4.28Å; M69-F164 HydrophobicContact CE-CD2 3.5Å; M69-F164 HydrophobicContact CE-CE1 4.06Å; M69-F164 HydrophobicContact CE-CE2 3.25Å; M69-F164 HydrophobicContact CE-CG 4.02Å; M69-F164 HydrophobicContact CE-CZ 3.54Å; M69-F164 HydrophobicContact CG-CE2 4.38Å; M69-F164 HydrophobicContact CG-CZ 4.38Å; M69-F164 VanDerWaalsContact O-CE2 3.27Å; M69-F164 WeakPolarHBondContact O-CE2 3.19Å; M69-F164 VanDerWaalsContact O-CZ 3.23Å; M69-F164 WeakPolarHBondContact O-CZ 3.34Å; M72-F164 HydrophobicContact CB-CE1 4.39Å; M72-F164 HydrophobicContact CB-CZ 3.97Å; M72-F164 HydrophobicContact CG-CE1 3.99Å; M72-F164 HydrophobicContact CG-CZ 4.09Å; M72-F164 HydrophobicContact SD-CE1 3.78Å; M72-F164 HydrophobicContact SD-CZ 4.15Å; L73-F164 HydrophobicContact CD1-CD2 4.08Å; L73-F164 HydrophobicContact CD1-CE2 3.94Å; L73-F164 HydrophobicContact CD2-CD1 4.47Å; L73-F164 HydrophobicContact CD2-CD2 3.57Å; L73-F164 HydrophobicContact CD2-CE2 3.74Å; L73-F164 HydrophobicContact CD2-CG 3.96Å; L73-F164 HydrophobicContact CD2-CZ 4.29Å; L73-F164 HydrophobicContact CG-CD2 3.8Å; L73-F164 HydrophobicContact CG-CE2 3.48Å; L73-F164 VanDerWaalsContact CG-CE2 3.48Å; L73-F164 HydrophobicContact CG-CZ 4.09Å; F136-F164 HydrophobicContact CB-CD1 4.45Å; F136-F164 HydrophobicContact CD2-CB 3.67Å; F136-F164 HydrophobicContact CD2-CD1 4.25Å; F136-F164 HydrophobicContact CD2-CG 4.06Å; F136-F164 HydrophobicContact CE2-CB 3.85Å; T160-F164 HydrophobicContact CG2-CD2 4.31Å; T160-F164 HydrophobicContact CG2-CE2 4.19Å; T160-F164 WeakPolarHBondContact O-CD2 3.43Å; T160-F164 PolarHBondContact O-N 3.28Å; L161-F164 WeakPolarHBondContact O-CB 3.42Å; L161-F164 PolarHBondContact O-N 2.91Å; G162-F164 VanDerWaalsContact C-N 3.25Å; G162-F164 PolarHBondContact O-N 3.29Å; F164-N166 VanDerWaalsContact C-N 3.29Å; F164-N166 PolarHBondContact O-N 2.93Å; F164-M167 HydrophobicContact CD1-CE 3.79Å; F164-M167 HydrophobicContact CE1-CE 4.06Å; F164-M167 WeakPolarHBondContact O-CB 3.48Å; F164-M167 PolarHBondContact O-N 3.22Å; F164-M167 VanDerWaalsContact O-N 3.13Å; F164-F168 HydrophobicContact CB-CE2 4.25Å; F164-F168 HydrophobicContact CD1-CE2 4.3Å; F164-F168 HydrophobicContact CD1-CZ 4.14Å; F164-F168 WeakPolarHBondContact O-CD2 3.43Å; F164-F168 WeakPolarHBondContact O-CG 3.5Å; F164-F168 PolarHBondContact O-N 3.35Å
165	I	92.9	Very high	92.3	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-56.6	-47.4	175.9	-66.5	165.1	0	0	0	109.5	F136 L161 G162 F168 A169 L238 I241 F269 L273	F136-I165 HydrophobicContact CE1-CG1 4.41Å; F136-I165 HydrophobicContact CE2-CG1 4.18Å; F136-I165 HydrophobicContact CZ-CD1 4.08Å; F136-I165 HydrophobicContact CZ-CG1 3.64Å; L161-I165 WeakPolarHBondContact O-CG1 3.41Å; L161-I165 PolarHBondContact O-N 3.41Å; L161-I165 VanDerWaalsContact O-N 3.14Å; G162-I165 WeakPolarHBondContact O-CB 3.41Å; G162-I165 PolarHBondContact O-N 3.47Å; G162-I165 VanDerWaalsContact O-N 3.09Å; I165-F168 PolarHBondContact O-N 3.21Å; I165-A169 PolarHBondContact O-N 3.46Å; I165-L238 HydrophobicContact CD1-CD2 3.58Å; I165-I241 HydrophobicContact CD1-CD1 4.02Å; I165-F269 HydrophobicContact CG2-CB 4.18Å; I165-F269 HydrophobicContact CG2-CD1 3.33Å; I165-F269 HydrophobicContact CG2-CE1 4.06Å; I165-F269 HydrophobicContact CG2-CG 4.1Å; I165-F269 VanDerWaalsContact O-CD1 3.23Å; I165-F269 WeakPolarHBondContact O-CD1 3.21Å; I165-F269 WeakPolarHBondContact O-CE1 3.37Å; I165-L273 HydrophobicContact CG2-CD1 3.87Å
166	N	93.4	Very high	92.4	Very high	11 Å²	11	14.7 Å²	14.7	6%	0.059	8%	0.078	C	C	.	.	H	α-helix	trans	-64.2	-39.7	175.1	178	82.8	0	0	0	113.1	G162 K163 F164 F168 A169 V170 M262 K265 V266	G162-N166 PolarHBondContact O-N 3.17Å; K163-N166 PolarHBondContact O-N 2.96Å; F164-N166 VanDerWaalsContact C-N 3.29Å; F164-N166 PolarHBondContact O-N 2.93Å; N166-F168 VanDerWaalsContact C-N 3.3Å; N166-F168 PolarHBondContact O-N 3Å; N166-A169 WeakPolarHBondContact O-CB 3.32Å; N166-A169 PolarHBondContact O-N 2.64Å; N166-A169 VanDerWaalsContact O-N 3.16Å; N166-V170 WeakPolarHBondContact O-CG2 3.17Å; N166-V170 PolarHBondContact O-N 3.3Å; N166-M262 HydrophobicContact CB-CE 4.38Å; N166-M262 HydrophobicContact CB-SD 3.46Å; N166-M262 WeakPolarHBondContact CB-SD 3.33Å; N166-M262 WeakPolarHBondContact ND2-CE 3.46Å; N166-K265 WeakPolarHBondContact OD1-CB 3.37Å; N166-K265 WeakPolarHBondContact OD1-CD 3.41Å; N166-K265 WeakPolarHBondContact OD1-CE 3.44Å; N166-V266 HydrophobicContact CB-CG2 4.16Å
167	M	95.8	Very high	92.5	Very high	13 Å²	13	14 Å²	14	6%	0.064	7%	0.068	C	C	.	.	H	α-helix	trans	-58.1	-43.3	176.7	-179.8	-168.1	72.1	0	0	111.1	L73 F128 A132 K163 F164 A169 V170 L171	L73-M167 HydrophobicContact CD2-CB 4.13Å; L73-M167 HydrophobicContact CD2-SD 3.94Å; F128-M167 HydrophobicContact CE1-CE 4.43Å; F128-M167 HydrophobicContact CE1-SD 4.44Å; F128-M167 HydrophobicContact CZ-CE 4.3Å; F128-M167 HydrophobicContact CZ-SD 4.17Å; A132-M167 HydrophobicContact CB-CE 4.18Å; K163-M167 WeakPolarHBondContact O-CB 3.47Å; K163-M167 PolarHBondContact O-N 2.94Å; F164-M167 HydrophobicContact CD1-CE 3.79Å; F164-M167 HydrophobicContact CE1-CE 4.06Å; F164-M167 WeakPolarHBondContact O-CB 3.48Å; F164-M167 PolarHBondContact O-N 3.22Å; F164-M167 VanDerWaalsContact O-N 3.13Å; M167-A169 PolarHBondContact O-N 2.89Å; M167-V170 PolarHBondContact O-N 3.33Å; M167-L171 HydrophobicContact CG-CD1 3.9Å; M167-L171 HydrophobicContact CG-CG 4.4Å; M167-L171 WeakPolarHBondContact O-CB 3.36Å; M167-L171 VanDerWaalsContact O-CG 3.29Å; M167-L171 WeakPolarHBondContact O-CG 3.27Å; M167-L171 PolarHBondContact O-N 3.47Å
168	F	95.4	Very high	92.7	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.6	-42.5	175.8	-62.7	-53.3	0	0	0	112	A132 I133 F136 F164 I165 N166 L171 D172 I220 L224 F269	A132-F168 HydrophobicContact CB-CE1 3.86Å; A132-F168 HydrophobicContact CB-CZ 4.2Å; I133-F168 HydrophobicContact CG1-CD1 4.11Å; I133-F168 HydrophobicContact CG1-CE1 3.65Å; I133-F168 HydrophobicContact CG1-CZ 4.03Å; F136-F168 HydrophobicContact CB-CE2 4.05Å; F136-F168 HydrophobicContact CB-CZ 4.06Å; F136-F168 HydrophobicContact CD1-CE2 4.05Å; F136-F168 HydrophobicContact CD2-CE2 4.38Å; F136-F168 AromaticContact CG-CE2 3.9Å; F136-F168 HydrophobicContact CG-CE2 3.9Å; F136-F168 HydrophobicContact CG-CZ 4.42Å; F164-F168 HydrophobicContact CB-CE2 4.25Å; F164-F168 HydrophobicContact CD1-CE2 4.3Å; F164-F168 HydrophobicContact CD1-CZ 4.14Å; F164-F168 WeakPolarHBondContact O-CD2 3.43Å; F164-F168 WeakPolarHBondContact O-CG 3.5Å; F164-F168 PolarHBondContact O-N 3.35Å; I165-F168 PolarHBondContact O-N 3.21Å; N166-F168 VanDerWaalsContact C-N 3.3Å; N166-F168 PolarHBondContact O-N 3Å; F168-L171 PolarHBondContact O-N 3.42Å; F168-D172 WeakPolarHBondContact O-CB 3.36Å; F168-D172 PolarHBondContact O-N 3.11Å; F168-I220 HydrophobicContact CB-CG2 4.14Å; F168-I220 HydrophobicContact CD1-CG2 3.96Å; F168-I220 HydrophobicContact CG-CG2 4.43Å; F168-L224 HydrophobicContact CB-CD2 4.17Å; F168-L224 HydrophobicContact CD2-CD1 4.3Å; F168-L224 HydrophobicContact CD2-CD2 3.66Å; F168-L224 HydrophobicContact CE2-CD1 4.19Å; F168-L224 HydrophobicContact CE2-CD2 4.37Å; F168-L224 HydrophobicContact CG-CD2 4.12Å; F168-F269 HydrophobicContact CB-CE1 4.46Å
169	A	92.3	Very high	92.8	Very high	3 Å²	3	17.1 Å²	17.1	3%	0.025	9%	0.089	C	C	.	.	H	α-helix	trans	-60.6	-47.5	175.3	0	0	0	0	0	112	I165 N166 M167 L171 D172 E173 F269	I165-A169 PolarHBondContact O-N 3.46Å; N166-A169 WeakPolarHBondContact O-CB 3.32Å; N166-A169 PolarHBondContact O-N 2.64Å; N166-A169 VanDerWaalsContact O-N 3.16Å; M167-A169 PolarHBondContact O-N 2.89Å; A169-L171 PolarHBondContact O-N 2.98Å; A169-D172 PolarHBondContact O-N 3.44Å; A169-E173 WeakPolarHBondContact O-CB 3.42Å; A169-E173 WeakPolarHBondContact O-CG 3.33Å; A169-E173 PolarHBondContact O-N 3.33Å; A169-F269 HydrophobicContact CB-CD1 3.71Å; A169-F269 HydrophobicContact CB-CE1 3.86Å; A169-F269 HydrophobicContact CB-CG 4.13Å; A169-F269 HydrophobicContact CB-CZ 4.34Å
170	V	93.9	Very high	92.9	Very high	10 Å²	10	15.5 Å²	15.5	6%	0.061	8%	0.081	C	C	.	.	H	α-helix	trans	-58.2	-50	177.8	169.9	0	0	0	0	110.9	A80 N166 M167 D172 L174 L306 F307	A80-V170 HydrophobicContact CB-CG1 3.94Å; N166-V170 WeakPolarHBondContact O-CG2 3.17Å; N166-V170 PolarHBondContact O-N 3.3Å; M167-V170 PolarHBondContact O-N 3.33Å; V170-D172 PolarHBondContact O-N 2.93Å; V170-L174 HydrophobicContact CG1-CD1 3.7Å; V170-L174 HydrophobicContact CG1-CG 4.33Å; V170-L174 VanDerWaalsContact O-CB 3.32Å; V170-L174 WeakPolarHBondContact O-CB 3.14Å; V170-L174 WeakPolarHBondContact O-CG 3.28Å; V170-L174 PolarHBondContact O-N 2.89Å; V170-L306 HydrophobicContact CG2-CD1 3.57Å; V170-L306 HydrophobicContact CG2-CG 4.11Å; V170-F307 HydrophobicContact CG1-CB 4.03Å; V170-F307 HydrophobicContact CG1-CD2 3.8Å; V170-F307 HydrophobicContact CG1-CG 4.15Å
171	L	95.5	Very high	93	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-66	-37.4	-177.8	-68.9	173.8	0	0	0	112.6	A80 L83 F125 F128 M167 F168 A169 K175 I220	A80-L171 HydrophobicContact CB-CD2 3.96Å; L83-L171 HydrophobicContact CD1-CD2 4.12Å; F125-L171 HydrophobicContact CE2-CB 4.32Å; F125-L171 HydrophobicContact CE2-CD1 4.26Å; F125-L171 HydrophobicContact CE2-CD2 3.98Å; F125-L171 HydrophobicContact CE2-CG 4.42Å; F125-L171 HydrophobicContact CZ-CB 4.43Å; F128-L171 HydrophobicContact CE1-CD1 3.96Å; M167-L171 HydrophobicContact CG-CD1 3.9Å; M167-L171 HydrophobicContact CG-CG 4.4Å; M167-L171 WeakPolarHBondContact O-CB 3.36Å; M167-L171 VanDerWaalsContact O-CG 3.29Å; M167-L171 WeakPolarHBondContact O-CG 3.27Å; M167-L171 PolarHBondContact O-N 3.47Å; F168-L171 PolarHBondContact O-N 3.42Å; A169-L171 PolarHBondContact O-N 2.98Å; L171-K175 WeakPolarHBondContact O-CB 3.42Å; L171-K175 PolarHBondContact O-N 3.41Å; L171-I220 HydrophobicContact CB-CD1 3.98Å
172	D	94.2	Very high	93	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-71.6	-43.8	179.9	-148.1	22.7	0	0	0	111.1	F168 A169 V170 K175 N176 N218 R219 I220 T221	F168-D172 WeakPolarHBondContact O-CB 3.36Å; F168-D172 PolarHBondContact O-N 3.11Å; A169-D172 PolarHBondContact O-N 3.44Å; V170-D172 PolarHBondContact O-N 2.93Å; D172-K175 PolarHBondContact O-N 3.46Å; D172-N176 VanDerWaalsContact O-CB 3.26Å; D172-N176 WeakPolarHBondContact O-CB 3.41Å; D172-N176 PolarHBondContact O-N 3.18Å; D172-N176 PolarHBondContact O-ND2 3.34Å; D172-N218 WeakPolarHBondContact OD2-CA 3.28Å; D172-R219 PolarHBondContact OD1-N 3.41Å; D172-I220 HydrophobicContact CB-CB 3.91Å; D172-I220 HydrophobicContact CB-CD1 4.33Å; D172-I220 HydrophobicContact CB-CG1 4.44Å; D172-I220 WeakPolarHBondContact OD1-CB 3.41Å; D172-I220 PolarHBondContact OD1-N 2.94Å; D172-I220 VanDerWaalsContact OD1-N 3.11Å; D172-T221 WeakPolarHBondContact OD2-CB 3.41Å; D172-T221 PolarHBondContact OD2-N 2.84Å; D172-T221 PolarHBondContact OD2-OG1 3.41Å
173	E	91.3	Very high	93	Very high	48 Å²	48	23 Å²	23	22%	0.224	12%	0.117	C	C	.	.	H	α-helix	trans	-66.9	-41.9	177.9	-67.8	-58.2	161.1	0	0	112.2	A169 K175 N176 M177 L306 M310	A169-E173 WeakPolarHBondContact O-CB 3.42Å; A169-E173 WeakPolarHBondContact O-CG 3.33Å; A169-E173 PolarHBondContact O-N 3.33Å; E173-K175 VanDerWaalsContact C-N 3.31Å; E173-K175 PolarHBondContact O-N 2.93Å; E173-N176 WeakPolarHBondContact O-CB 3.43Å; E173-N176 PolarHBondContact O-N 2.75Å; E173-M177 WeakPolarHBondContact O-CG 3.35Å; E173-M177 PolarHBondContact O-N 3.21Å; E173-L306 HydrophobicContact CB-CD2 3.85Å; E173-L306 HydrophobicContact CG-CD2 3.86Å; E173-M310 HydrophobicContact CB-CE 3.86Å; E173-M310 HydrophobicContact CB-SD 4.08Å
174	L	93.8	Very high	93.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.7	-39.6	173.1	-72	175.4	0	0	0	111.8	A80 L83 Y84 V170 M177 K178 F307 M310	A80-L174 HydrophobicContact CB-CD1 3.74Å; A80-L174 WeakPolarHBondContact O-CD1 3.47Å; L83-L174 HydrophobicContact CB-CB 3.93Å; L83-L174 HydrophobicContact CB-CD1 4.37Å; L83-L174 HydrophobicContact CD1-CB 4Å; Y84-L174 HydrophobicContact CD2-CD2 3.95Å; Y84-L174 HydrophobicContact CG-CD2 4.49Å; V170-L174 HydrophobicContact CG1-CD1 3.7Å; V170-L174 HydrophobicContact CG1-CG 4.33Å; V170-L174 VanDerWaalsContact O-CB 3.32Å; V170-L174 WeakPolarHBondContact O-CB 3.14Å; V170-L174 WeakPolarHBondContact O-CG 3.28Å; V170-L174 PolarHBondContact O-N 2.89Å; L174-M177 HydrophobicContact CD2-CE 3.32Å; L174-M177 WeakPolarHBondContact O-CG 3.21Å; L174-K178 WeakPolarHBondContact O-CB 3.25Å; L174-K178 WeakPolarHBondContact O-CG 3.16Å; L174-K178 PolarHBondContact O-N 2.98Å; L174-F307 HydrophobicContact CD1-CB 4.41Å; L174-F307 HydrophobicContact CD1-CD1 4.08Å; L174-F307 HydrophobicContact CD1-CD2 4.5Å; L174-F307 HydrophobicContact CD1-CG 4.07Å; L174-F307 HydrophobicContact CD2-CB 4.4Å; L174-F307 HydrophobicContact CD2-CD1 4.19Å; L174-M310 HydrophobicContact CD2-CE 3.53Å; L174-M310 HydrophobicContact CD2-SD 4.26Å; L174-M310 HydrophobicContact CG-CE 3.74Å
175	K	94.4	Very high	93.1	Very high	16 Å²	16	18.8 Å²	18.8	7%	0.07	10%	0.098	C	C	.	.	H	α-helix	trans	-66.7	-41.4	174.7	177.2	-165.8	150.9	-67.2	0	111.3	F125 L171 D172 E173 F213 N216 I220	F125-K175 HydrophobicContact CE1-CD 4.44Å; L171-K175 WeakPolarHBondContact O-CB 3.42Å; L171-K175 PolarHBondContact O-N 3.41Å; D172-K175 PolarHBondContact O-N 3.46Å; E173-K175 VanDerWaalsContact C-N 3.31Å; E173-K175 PolarHBondContact O-N 2.93Å; K175-F213 HydrophobicContact CD-CE1 3.95Å; K175-F213 HydrophobicContact CD-CE2 4.15Å; K175-F213 HydrophobicContact CD-CZ 3.64Å; K175-F213 WeakPolarHBondContact CE-O 3.41Å; K175-N216 PolarHBondContact NZ-O 2.96Å; K175-I220 HydrophobicContact CD-CD1 4.49Å
176	N	90.3	Very high	93	Very high	21 Å²	21	21 Å²	21	11%	0.112	11%	0.114	C	C	.	.	H	α-helix	trans	-63.1	-41.9	-178.1	-79.8	-20.2	0	0	0	112	D172 E173 H217 N218	D172-N176 VanDerWaalsContact O-CB 3.26Å; D172-N176 WeakPolarHBondContact O-CB 3.41Å; D172-N176 PolarHBondContact O-N 3.18Å; D172-N176 PolarHBondContact O-ND2 3.34Å; E173-N176 WeakPolarHBondContact O-CB 3.43Å; E173-N176 PolarHBondContact O-N 2.75Å; N176-H217 WeakPolarHBondContact CB-CE1 3.43Å; N176-H217 PolarHBondContact OD1-ND1 3.22Å; N176-N218 PolarHBondContact ND2-OD1 3.36Å; N176-N218 PolarHBondContact OD1-N 3.08Å
177	M	87.4	Confident	93	Very high	21 Å²	21	21.4 Å²	21.4	10%	0.103	12%	0.119	C	C	.	.	H	α-helix	trans	-76.5	-32	-179	67.7	101.6	166.2	0	0	112.9	Y84 E173 L174 C179 M310 F624 E627	Y84-M177 HydrophobicContact CD2-CE 4.14Å; E173-M177 WeakPolarHBondContact O-CG 3.35Å; E173-M177 PolarHBondContact O-N 3.21Å; L174-M177 HydrophobicContact CD2-CE 3.32Å; L174-M177 WeakPolarHBondContact O-CG 3.21Å; M177-C179 PolarHBondContact O-N 2.84Å; M177-M310 HydrophobicContact CE-SD 4.43Å; M177-M310 HydrophobicContact CG-SD 4.11Å; M177-F624 HydrophobicContact CB-CD2 4.13Å; M177-F624 HydrophobicContact CB-CE2 4.09Å; M177-F624 HydrophobicContact CE-CB 4.4Å; M177-F624 HydrophobicContact CE-CD2 4.39Å; M177-F624 HydrophobicContact CG-CD2 4.05Å; M177-F624 HydrophobicContact CG-CE2 4.45Å; M177-F624 HydrophobicContact SD-CB 4.46Å; M177-F624 HydrophobicContact SD-CD2 3.78Å; M177-E627 WeakPolarHBondContact O-CG 3.33Å; M177-E627 HydrophobicContact SD-CB 4.41Å; M177-E627 HydrophobicContact SD-CG 4.34Å
178	K	92	Very high	92.8	Very high	6 Å²	6	21.7 Å²	21.7	3%	0.026	12%	0.119	C	C	.	.			trans	-77.2	82.4	-175.4	-72.6	-72.8	173.9	171.9	0	113.9	L83 Y84 W86 L174 S180 V181 E627	L83-K178 WeakPolarHBondContact O-CD 3.14Å; L83-K178 WeakPolarHBondContact O-CE 3.2Å; L83-K178 WeakPolarHBondContact O-CG 3.34Å; Y84-K178 VanDerWaalsContact O-CE 3.22Å; Y84-K178 WeakPolarHBondContact O-CE 3.43Å; Y84-K178 PolarHBondContact O-NZ 3.37Å; W86-K178 PolarHBondContact O-NZ 3.14Å; L174-K178 WeakPolarHBondContact O-CB 3.25Å; L174-K178 WeakPolarHBondContact O-CG 3.16Å; L174-K178 PolarHBondContact O-N 2.98Å; K178-S180 PolarHBondContact O-N 2.8Å; K178-V181 HydrophobicContact CB-CB 4.28Å; K178-V181 HydrophobicContact CB-CG2 3.85Å; K178-V181 PolarHBondContact O-N 2.7Å; K178-E627 HydrophobicContact CD-CG 4.21Å
179	C	91.4	Very high	92.6	Very high	71 Å²	71	23.3 Å²	23.3	48%	0.48	13%	0.126	S	C	.	.	H	α-helix	trans	-62.1	-33.9	167.9	-65.9	0	0	0	0	111.9	M177 V181 K182 N183 E627	M177-C179 PolarHBondContact O-N 2.84Å; C179-V181 VanDerWaalsContact C-N 3.32Å; C179-V181 PolarHBondContact O-N 3.18Å; C179-K182 PolarHBondContact O-N 2.83Å; C179-N183 WeakPolarHBondContact O-CB 3.23Å; C179-N183 VanDerWaalsContact O-CG 3.26Å; C179-N183 PolarHBondContact O-N 3.34Å; C179-N183 PolarHBondContact O-ND2 3.41Å; C179-E627 WeakPolarHBondContact CA-OE1 3.28Å; C179-E627 WeakPolarHBondContact CB-OE1 3.31Å; C179-E627 PolarHBondContact N-OE1 2.88Å
180	S	93.5	Very high	92.5	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-50.7	-47	175.7	-68	0	0	0	0	112.8	S88 K178 K182 N183 D184 E627	S88-S180 WeakPolarHBondContact CB-OG 3.34Å; K178-S180 PolarHBondContact O-N 2.8Å; S180-K182 PolarHBondContact O-N 3.08Å; S180-N183 PolarHBondContact O-N 3.03Å; S180-D184 WeakPolarHBondContact O-CB 3.36Å; S180-D184 PolarHBondContact O-N 3.08Å; S180-E627 WeakPolarHBondContact CB-OE2 3.26Å; S180-E627 PolarHBondContact N-OE1 3.12Å; S180-E627 VanDerWaalsContact OG-CD 3.27Å; S180-E627 PolarHBondContact OG-OE1 3.38Å; S180-E627 VanDerWaalsContact OG-OE1 3.09Å; S180-E627 PolarHBondContact OG-OE2 3.44Å
181	V	93.3	Very high	92.3	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.024	15%	0.15	C	C	.	.	H	α-helix	trans	-59.9	-46.5	179	169.5	0	0	0	0	111.6	L83 W86 L122 K178 C179 H185 L214	L83-V181 HydrophobicContact CD2-CG2 4.27Å; W86-V181 HydrophobicContact CB-CG2 4Å; W86-V181 HydrophobicContact CD2-CG2 3.69Å; W86-V181 HydrophobicContact CE3-CG2 4.18Å; W86-V181 HydrophobicContact CG-CG2 3.58Å; L122-V181 HydrophobicContact CD1-CG1 3.72Å; L122-V181 HydrophobicContact CD2-CG1 3.44Å; L122-V181 VanDerWaalsContact CD2-CG1 3.44Å; L122-V181 HydrophobicContact CD2-CG2 4.5Å; L122-V181 HydrophobicContact CG-CG1 4.22Å; K178-V181 HydrophobicContact CB-CB 4.28Å; K178-V181 HydrophobicContact CB-CG2 3.85Å; K178-V181 PolarHBondContact O-N 2.7Å; C179-V181 VanDerWaalsContact C-N 3.32Å; C179-V181 PolarHBondContact O-N 3.18Å; V181-H185 PolarHBondContact O-N 3.38Å; V181-L214 HydrophobicContact CG1-CD1 4.25Å; V181-L214 HydrophobicContact CG1-CD2 3.78Å
182	K	91.9	Very high	92	Very high	94 Å²	94	30 Å²	30	41%	0.409	15%	0.15	S	C	.	.	H	α-helix	trans	-64.5	-41.6	179	179.7	-178.3	175.2	-178.2	0	111.7	C179 S180 S186	C179-K182 PolarHBondContact O-N 2.83Å; S180-K182 PolarHBondContact O-N 3.08Å; K182-S186 WeakPolarHBondContact O-CB 3.31Å; K182-S186 PolarHBondContact O-N 3.13Å; K182-S186 VanDerWaalsContact O-N 3.1Å; K182-S186 PolarHBondContact O-OG 3.27Å
183	N	93	Very high	91.7	Very high	66 Å²	66	35.7 Å²	35.7	35%	0.353	18%	0.176	S	C	.	.	H	α-helix	trans	-70.1	-41.7	-177.7	-69.6	-21.2	0	0	0	111.8	C179 S180 S186 A187	C179-N183 WeakPolarHBondContact O-CB 3.23Å; C179-N183 VanDerWaalsContact O-CG 3.26Å; C179-N183 PolarHBondContact O-N 3.34Å; C179-N183 PolarHBondContact O-ND2 3.41Å; S180-N183 PolarHBondContact O-N 3.03Å; N183-S186 WeakPolarHBondContact O-CB 3.47Å; N183-S186 PolarHBondContact O-N 2.91Å; N183-A187 PolarHBondContact O-N 3.4Å
184	D	94.8	Very high	91.5	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.011	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-45.9	178.1	-69.9	-7.4	0	0	0	111.2	W86 S88 C89 S90 L115 S180 S186 A187 Y188	W86-D184 PolarHBondContact NE1-OD2 2.9Å; S88-D184 PolarHBondContact OG-OD1 3.32Å; C89-D184 PolarHBondContact N-OD1 3.28Å; C89-D184 PolarHBondContact N-OD2 3.45Å; S90-D184 WeakPolarHBondContact CB-OD1 3.21Å; S90-D184 PolarHBondContact N-OD1 2.94Å; S90-D184 PolarHBondContact OG-OD1 3.32Å; L115-D184 HydrophobicContact CD2-CB 4.08Å; S180-D184 WeakPolarHBondContact O-CB 3.36Å; S180-D184 PolarHBondContact O-N 3.08Å; D184-S186 VanDerWaalsContact C-N 3.28Å; D184-S186 PolarHBondContact O-N 3.42Å; D184-A187 PolarHBondContact O-N 3.09Å; D184-Y188 PolarHBondContact O-N 3.38Å
185	H	93.4	Very high	91.3	Very high	3 Å²	3	39.4 Å²	39.4	1%	0.014	19%	0.194	C	C	.	.	H	α-helix	trans	-60.5	-38.4	173.2	175.7	-116.9	0	0	0	112.3	L122 V181 Y188 K189 S211 L214	L122-H185 HydrophobicContact CD1-CB 4.28Å; V181-H185 PolarHBondContact O-N 3.38Å; H185-Y188 PolarHBondContact O-N 3.32Å; H185-K189 WeakPolarHBondContact O-CB 3.43Å; H185-K189 PolarHBondContact O-N 3.43Å; H185-S211 PolarHBondContact CE1-OG 2.91Å; H185-S211 VanDerWaalsContact CE1-OG 3.31Å; H185-L214 HydrophobicContact CB-CD1 3.81Å
186	S	91.9	Very high	90.7	Very high	49 Å²	49	49.3 Å²	49.3	34%	0.343	23%	0.231	S	C	.	.	H	α-helix	trans	-67.6	-37.5	178.2	-59	0	0	0	0	112.4	K182 N183 D184 R190	K182-S186 WeakPolarHBondContact O-CB 3.31Å; K182-S186 PolarHBondContact O-N 3.13Å; K182-S186 VanDerWaalsContact O-N 3.1Å; K182-S186 PolarHBondContact O-OG 3.27Å; N183-S186 WeakPolarHBondContact O-CB 3.47Å; N183-S186 PolarHBondContact O-N 2.91Å; D184-S186 VanDerWaalsContact C-N 3.28Å; D184-S186 PolarHBondContact O-N 3.42Å; S186-R190 WeakPolarHBondContact O-CB 3.36Å; S186-R190 PolarHBondContact O-N 2.94Å; S186-R190 VanDerWaalsContact O-N 3.12Å
187	A	92.6	Very high	89.9	Confident	18 Å²	18	53.9 Å²	53.9	15%	0.149	25%	0.25	C	C	.	.	H	α-helix	trans	-65.7	-45.9	174.4	0	0	0	0	0	111.3	L115 N183 D184 R190 A191	L115-A187 HydrophobicContact CD1-CB 4.14Å; N183-A187 PolarHBondContact O-N 3.4Å; D184-A187 PolarHBondContact O-N 3.09Å; A187-R190 PolarHBondContact O-N 3.34Å; A187-A191 PolarHBondContact O-N 3.03Å; A187-A191 VanDerWaalsContact O-N 3.07Å
188	Y	93.4	Very high	88.8	Confident	20 Å²	20	54.9 Å²	54.9	8%	0.078	26%	0.255	C	S	.	.	H	α-helix	trans	-57	-51.1	173.3	170.9	-100.6	0	0	0	112	V112 L115 E116 V119 D184 H185 R190 A191 A192 M198	V112-Y188 HydrophobicContact CB-CE2 4.44Å; V112-Y188 HydrophobicContact CG1-CE2 4Å; V112-Y188 HydrophobicContact CG2-CD2 4.41Å; V112-Y188 HydrophobicContact CG2-CE2 4.35Å; L115-Y188 HydrophobicContact CB-CD2 3.99Å; L115-Y188 HydrophobicContact CB-CG 4.35Å; E116-Y188 HydrophobicContact CB-CE2 3.77Å; E116-Y188 HydrophobicContact CG-CE2 4.25Å; V119-Y188 HydrophobicContact CB-CD1 4.28Å; V119-Y188 HydrophobicContact CB-CE1 4.42Å; V119-Y188 HydrophobicContact CG1-CD1 4.12Å; V119-Y188 HydrophobicContact CG1-CE1 4.08Å; V119-Y188 HydrophobicContact CG2-CD1 3.75Å; V119-Y188 HydrophobicContact CG2-CD2 4.4Å; V119-Y188 HydrophobicContact CG2-CE1 4.37Å; V119-Y188 HydrophobicContact CG2-CG 3.76Å; D184-Y188 PolarHBondContact O-N 3.38Å; H185-Y188 PolarHBondContact O-N 3.32Å; Y188-R190 VanDerWaalsContact C-N 3.29Å; Y188-R190 PolarHBondContact O-N 3.01Å; Y188-A191 PolarHBondContact O-N 3.17Å; Y188-A191 VanDerWaalsContact O-N 3.13Å; Y188-A192 HydrophobicContact CE1-CB 4.44Å; Y188-A192 HydrophobicContact CE2-CB 4.48Å; Y188-A192 WeakPolarHBondContact O-CB 3.14Å; Y188-A192 PolarHBondContact O-N 3.18Å; Y188-M198 HydrophobicContact CE1-CE 3.65Å
189	K	90.9	Very high	87.1	Confident	33 Å²	33	58.5 Å²	58.5	14%	0.143	29%	0.285	C	S	.	.	H	α-helix	trans	-57.7	-42.3	-179.2	-172.7	174.6	-173.1	174.7	0	111.5	H185 Q193 S211	H185-K189 WeakPolarHBondContact O-CB 3.43Å; H185-K189 PolarHBondContact O-N 3.43Å; K189-Q193 VanDerWaalsContact O-CB 3.3Å; K189-Q193 WeakPolarHBondContact O-CB 3.44Å; K189-Q193 WeakPolarHBondContact O-CG 3.33Å; K189-Q193 PolarHBondContact O-N 3.44Å; K189-S211 PolarHBondContact NZ-OG 3.26Å
190	R	89.7	Confident	86.5	Confident	156 Å²	156	60.3 Å²	60.3	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-63.5	-43.8	177.3	-167.5	-174.1	-57.8	144.4	3.6	112	S186 A187 Y188 F194	S186-R190 WeakPolarHBondContact O-CB 3.36Å; S186-R190 PolarHBondContact O-N 2.94Å; S186-R190 VanDerWaalsContact O-N 3.12Å; A187-R190 PolarHBondContact O-N 3.34Å; Y188-R190 VanDerWaalsContact C-N 3.29Å; Y188-R190 PolarHBondContact O-N 3.01Å; R190-F194 WeakPolarHBondContact O-CB 3.31Å; R190-F194 PolarHBondContact O-N 3.44Å; R190-F194 VanDerWaalsContact O-N 3.16Å
191	A	90.3	Very high	85.9	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-67.3	-47.6	179	0	0	0	0	0	112.1	Y108 T111 V112 A187 Y188 Q193 F194 L195	Y108-A191 HydrophobicContact CD1-CB 3.46Å; Y108-A191 VanDerWaalsContact CD1-CB 3.46Å; Y108-A191 HydrophobicContact CE1-CB 4.27Å; Y108-A191 HydrophobicContact CG-CB 4.1Å; T111-A191 HydrophobicContact CG2-CB 3.71Å; V112-A191 HydrophobicContact CG2-CB 3.72Å; A187-A191 PolarHBondContact O-N 3.03Å; A187-A191 VanDerWaalsContact O-N 3.07Å; Y188-A191 PolarHBondContact O-N 3.17Å; Y188-A191 VanDerWaalsContact O-N 3.13Å; A191-Q193 PolarHBondContact O-N 3.11Å; A191-F194 PolarHBondContact O-N 2.65Å; A191-L195 WeakPolarHBondContact O-CG 3.26Å; A191-L195 PolarHBondContact O-N 2.98Å
192	A	88.6	Confident	85.4	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-64.1	-38	-179.7	0	0	0	0	0	112.7	V112 Y188 R196 K197 M198	V112-A192 HydrophobicContact CG2-CB 4.16Å; Y188-A192 HydrophobicContact CE1-CB 4.44Å; Y188-A192 HydrophobicContact CE2-CB 4.48Å; Y188-A192 WeakPolarHBondContact O-CB 3.14Å; Y188-A192 PolarHBondContact O-N 3.18Å; A192-R196 PolarHBondContact O-N 3.23Å; A192-K197 PolarHBondContact O-N 3.27Å; A192-K197 VanDerWaalsContact O-N 3.12Å; A192-M198 HydrophobicContact CB-CE 4.32Å; A192-M198 HydrophobicContact CB-CG 4.45Å
193	Q	87.9	Confident	84.8	Confident	118 Å²	118	69.3 Å²	69.3	55%	0.551	35%	0.347	S	S	*	.	H	α-helix	trans	-65.5	-41.6	173.6	-76	176.3	-10.5	0	0	112	K189 A191 R196	K189-Q193 VanDerWaalsContact O-CB 3.3Å; K189-Q193 WeakPolarHBondContact O-CB 3.44Å; K189-Q193 WeakPolarHBondContact O-CG 3.33Å; K189-Q193 PolarHBondContact O-N 3.44Å; A191-Q193 PolarHBondContact O-N 3.11Å; Q193-R196 PolarHBondContact O-N 2.98Å
194	F	87.9	Confident	84.3	Confident	80 Å²	80	70.6 Å²	70.6	35%	0.351	35%	0.353	S	S	.	.	H	α-helix	trans	-64.1	-42.9	177.9	-179.8	-98.7	0	0	0	112.2	R104 V105 Y108 R190 A191 R196	R104-F194 HydrophobicContact CG-CE1 4.44Å; R104-F194 HydrophobicContact CG-CZ 4.39Å; V105-F194 HydrophobicContact CG2-CE1 4.27Å; Y108-F194 HydrophobicContact CD2-CB 4.26Å; Y108-F194 AromaticContact CD2-CD1 3.31Å; Y108-F194 HydrophobicContact CD2-CD1 3.31Å; Y108-F194 AromaticContact CD2-CE1 3.76Å; Y108-F194 HydrophobicContact CD2-CE1 3.76Å; Y108-F194 AromaticContact CD2-CG 3.83Å; Y108-F194 HydrophobicContact CD2-CG 3.83Å; Y108-F194 HydrophobicContact CE2-CB 4.41Å; Y108-F194 AromaticContact CE2-CD1 3.88Å; Y108-F194 HydrophobicContact CE2-CD1 3.88Å; Y108-F194 HydrophobicContact CE2-CD2 4.48Å; Y108-F194 HydrophobicContact CE2-CE1 4.27Å; Y108-F194 AromaticContact CE2-CG 3.98Å; Y108-F194 HydrophobicContact CE2-CG 3.98Å; Y108-F194 HydrophobicContact CG-CD1 4.11Å; R190-F194 WeakPolarHBondContact O-CB 3.31Å; R190-F194 PolarHBondContact O-N 3.44Å; R190-F194 VanDerWaalsContact O-N 3.16Å; A191-F194 PolarHBondContact O-N 2.65Å; F194-R196 PolarHBondContact O-N 2.96Å
195	L	87.7	Confident	83.9	Confident	47 Å²	47	75.7 Å²	75.7	25%	0.246	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-1.9	177.7	-64.1	174.3	0	0	0	114	V105 E109 V112 A191 K197	V105-L195 HydrophobicContact CG1-CD2 4.17Å; E109-L195 HydrophobicContact CB-CD1 4.39Å; E109-L195 HydrophobicContact CG-CD1 3.85Å; E109-L195 HydrophobicContact CG-CD2 3.85Å; V112-L195 HydrophobicContact CG2-CD1 4Å; A191-L195 WeakPolarHBondContact O-CG 3.26Å; A191-L195 PolarHBondContact O-N 2.98Å; L195-K197 PolarHBondContact O-N 3.16Å
196	R	82.4	Confident	83.5	Confident	223 Å²	223	78.2 Å²	78.2	84%	0.842	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	32.6	-177.4	-55.2	179.8	179.6	-179.8	-0.7	113.5	A192 Q193 F194	A192-R196 PolarHBondContact O-N 3.23Å; Q193-R196 PolarHBondContact O-N 2.98Å; F194-R196 PolarHBondContact O-N 2.96Å
197	K	74.3	Confident	83.2	Confident	117 Å²	117	76.3 Å²	76.3	51%	0.509	38%	0.376	S	S	.	.			trans	-78.4	-19.1	-176.1	-142.1	-175.6	178.1	-163.3	0	113	V112 E116 A192 L195	V112-K197 HydrophobicContact CG1-CD 3.79Å; E116-K197 IonicContact OE2-NZ 2.98Å; E116-K197 PolarHBondContact OE2-NZ 2.85Å; A192-K197 PolarHBondContact O-N 3.27Å; A192-K197 VanDerWaalsContact O-N 3.12Å; L195-K197 PolarHBondContact O-N 3.16Å
198	M	63.4	Low	83	Confident	43 Å²	43	79.7 Å²	79.7	21%	0.212	39%	0.388	C	S	.	.			trans	-93.4	94.2	177.3	-67	-163	168.9	0	0	111.2	Y188 A192 I204	Y188-M198 HydrophobicContact CE1-CE 3.65Å; A192-M198 HydrophobicContact CB-CE 4.32Å; A192-M198 HydrophobicContact CB-CG 4.45Å; M198-I204 HydrophobicContact CB-CG1 4.37Å
199	A	56.8	Low	82.8	Confident	81 Å²	81	82.1 Å²	82.1	67%	0.669	40%	0.402	S	S	*	.			trans	-102.4	-23.3	-179.1	0	0	0	0	0	113.8
200	D	77.8	Confident	82.9	Confident	110 Å²	110	80.6 Å²	80.6	59%	0.588	40%	0.396	S	S	*	.			trans	-88.8	131.5	-173.1	-60.1	-38.5	0	0	0	112.5	Q202 S203 I204	D200-Q202 PolarHBondContact O-N 3.36Å; D200-S203 PolarHBondContact O-N 2.82Å; D200-S203 VanDerWaalsContact O-N 3.11Å; D200-I204 WeakPolarHBondContact O-CG1 3.43Å; D200-I204 PolarHBondContact O-N 3.03Å; D200-I204 VanDerWaalsContact O-N 3.15Å
201	P	81.4	Confident	82.9	Confident	107 Å²	107	74.4 Å²	74.4	70%	0.695	38%	0.376	S	S	*	.	H	α-helix	trans	-55.9	-34.9	179.7	-26.9	34.1	0	0	0	114.1	Q205	P201-Q205 PolarHBondContact O-N 3.46Å; P201-Q205 VanDerWaalsContact O-N 3.15Å
202	Q	83.4	Confident	82.9	Confident	141 Å²	141	79 Å²	79	66%	0.659	40%	0.399	S	S	*	.	H	α-helix	trans	-68.3	-43.5	178.3	-177	166.1	-10.9	0	0	112	D200 I204 Q205 E206	D200-Q202 PolarHBondContact O-N 3.36Å; Q202-I204 VanDerWaalsContact C-N 3.31Å; Q202-I204 PolarHBondContact O-N 2.89Å; Q202-Q205 PolarHBondContact O-N 3.28Å; Q202-E206 PolarHBondContact NE2-OE1 3.25Å; Q202-E206 WeakPolarHBondContact O-CB 3.34Å; Q202-E206 WeakPolarHBondContact O-CG 3.49Å; Q202-E206 PolarHBondContact O-N 3.39Å
203	S	80.3	Confident	83.1	Confident	42 Å²	42	79.6 Å²	79.6	29%	0.294	40%	0.402	S	S	.	.	H	α-helix	trans	-63.5	-37.6	177.7	-174.8	0	0	0	0	111.9	D200 E206 S207	D200-S203 PolarHBondContact O-N 2.82Å; D200-S203 VanDerWaalsContact O-N 3.11Å; S203-E206 PolarHBondContact O-N 2.72Å; S203-S207 PolarHBondContact O-N 2.98Å
204	I	82.3	Confident	83.3	Confident	92 Å²	92	74.8 Å²	74.8	47%	0.472	38%	0.38	S	S	.	.	H	α-helix	trans	-64.4	-46.6	176	-64.4	169.9	0	0	0	110.9	M198 D200 Q202 E206 S207 Q208	M198-I204 HydrophobicContact CB-CG1 4.37Å; D200-I204 WeakPolarHBondContact O-CG1 3.43Å; D200-I204 PolarHBondContact O-N 3.03Å; D200-I204 VanDerWaalsContact O-N 3.15Å; Q202-I204 VanDerWaalsContact C-N 3.31Å; Q202-I204 PolarHBondContact O-N 2.89Å; I204-E206 VanDerWaalsContact C-N 3.33Å; I204-E206 PolarHBondContact O-N 3.34Å; I204-S207 PolarHBondContact O-N 2.85Å; I204-Q208 PolarHBondContact O-N 3.34Å
205	Q	84.9	Confident	83.4	Confident	109 Å²	109	73.5 Å²	73.5	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-63.7	-40.6	177.8	-175.5	62.1	30.6	0	0	111.8	P201 Q202 Q208 N209	P201-Q205 PolarHBondContact O-N 3.46Å; P201-Q205 VanDerWaalsContact O-N 3.15Å; Q202-Q205 PolarHBondContact O-N 3.28Å; Q205-Q208 PolarHBondContact O-N 3.13Å; Q205-N209 PolarHBondContact NE2-OD1 2.96Å; Q205-N209 VanDerWaalsContact O-CG 3.29Å; Q205-N209 PolarHBondContact O-N 3.03Å; Q205-N209 PolarHBondContact O-ND2 3.09Å
206	E	85.8	Confident	83.4	Confident	56 Å²	56	74 Å²	74	26%	0.262	39%	0.387	S	S	.	.	H	α-helix	trans	-61.4	-48.4	176.7	-87.4	-178.9	-167.3	0	0	112.5	M123 Y127 Q202 S203 I204 Q208 N209 L210	M123-E206 HydrophobicContact CE-CB 3.5Å; M123-E206 HydrophobicContact CE-CG 3.84Å; Y127-E206 WeakPolarHBondContact OH-CG 3.25Å; Y127-E206 PolarHBondContact OH-OE1 2.85Å; Q202-E206 PolarHBondContact NE2-OE1 3.25Å; Q202-E206 WeakPolarHBondContact O-CB 3.34Å; Q202-E206 WeakPolarHBondContact O-CG 3.49Å; Q202-E206 PolarHBondContact O-N 3.39Å; S203-E206 PolarHBondContact O-N 2.72Å; I204-E206 VanDerWaalsContact C-N 3.33Å; I204-E206 PolarHBondContact O-N 3.34Å; E206-Q208 VanDerWaalsContact C-N 3.26Å; E206-Q208 PolarHBondContact O-N 2.89Å; E206-N209 PolarHBondContact O-N 3.49Å; E206-L210 PolarHBondContact O-N 2.71Å
207	S	86.3	Confident	83.7	Confident	10 Å²	10	68.7 Å²	68.7	7%	0.07	37%	0.371	C	S	.	.	H	α-helix	trans	-60.6	-37	174.5	-179.2	0	0	0	0	112.1	S203 I204 L210 S211	S203-S207 PolarHBondContact O-N 2.98Å; I204-S207 PolarHBondContact O-N 2.85Å; S207-L210 PolarHBondContact O-N 3.16Å; S207-S211 PolarHBondContact O-N 2.8Å; S207-S211 PolarHBondContact O-OG 3.32Å
208	Q	87.7	Confident	84.4	Confident	88 Å²	88	65.5 Å²	65.5	41%	0.411	36%	0.36	S	S	.	.	H	α-helix	trans	-67.7	-42.1	177.1	-171.9	60.7	15.8	0	0	112.3	I204 Q205 E206 L210 S211 M212	I204-Q208 PolarHBondContact O-N 3.34Å; Q205-Q208 PolarHBondContact O-N 3.13Å; E206-Q208 VanDerWaalsContact C-N 3.26Å; E206-Q208 PolarHBondContact O-N 2.89Å; Q208-L210 VanDerWaalsContact C-N 3.34Å; Q208-L210 PolarHBondContact O-N 2.77Å; Q208-S211 WeakPolarHBondContact O-CB 3.47Å; Q208-S211 PolarHBondContact O-N 3.21Å; Q208-M212 WeakPolarHBondContact O-CG 3.41Å; Q208-M212 PolarHBondContact O-N 3.35Å
209	N	90.1	Very high	85.8	Confident	71 Å²	71	67.7 Å²	67.7	38%	0.38	37%	0.366	S	S	.	.	H	α-helix	trans	-61	-43.3	175.2	-71.1	-23.8	0	0	0	111.5	M126 Q205 E206 M212 F213	M126-N209 HydrophobicContact CE-CB 4.37Å; M126-N209 HydrophobicContact SD-CB 4.18Å; Q205-N209 PolarHBondContact NE2-OD1 2.96Å; Q205-N209 VanDerWaalsContact O-CG 3.29Å; Q205-N209 PolarHBondContact O-N 3.03Å; Q205-N209 PolarHBondContact O-ND2 3.09Å; E206-N209 PolarHBondContact O-N 3.49Å; N209-M212 PolarHBondContact O-N 2.91Å; N209-F213 WeakPolarHBondContact O-CB 3.43Å; N209-F213 PolarHBondContact O-N 3.45Å
210	L	91.4	Very high	87.5	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-42.1	177.2	-177	61.3	0	0	0	111.8	V119 L122 M123 M126 E206 S207 Q208 M212 F213 L214	V119-L210 HydrophobicContact CG1-CD2 4.02Å; L122-L210 HydrophobicContact CB-CD1 4.19Å; L122-L210 HydrophobicContact CB-CD2 4.06Å; M123-L210 HydrophobicContact CG-CD2 4.02Å; M123-L210 HydrophobicContact SD-CB 3.76Å; M123-L210 HydrophobicContact SD-CD1 4.47Å; M123-L210 HydrophobicContact SD-CD2 3.61Å; M123-L210 HydrophobicContact SD-CG 4.13Å; M126-L210 HydrophobicContact CB-CD1 4.22Å; M126-L210 HydrophobicContact SD-CB 4.2Å; M126-L210 HydrophobicContact SD-CD1 4.23Å; E206-L210 PolarHBondContact O-N 2.71Å; S207-L210 PolarHBondContact O-N 3.16Å; Q208-L210 VanDerWaalsContact C-N 3.34Å; Q208-L210 PolarHBondContact O-N 2.77Å; L210-M212 VanDerWaalsContact C-N 3.32Å; L210-M212 PolarHBondContact O-N 3.41Å; L210-F213 HydrophobicContact CD1-CD1 4.22Å; L210-F213 PolarHBondContact O-N 2.87Å; L210-L214 HydrophobicContact CD1-CD1 4.01Å; L210-L214 HydrophobicContact CD1-CD2 4.47Å; L210-L214 HydrophobicContact CD1-CG 3.99Å; L210-L214 HydrophobicContact CG-CD1 3.99Å; L210-L214 HydrophobicContact CG-CG 4.35Å; L210-L214 WeakPolarHBondContact O-CG 3.42Å; L210-L214 PolarHBondContact O-N 3.09Å
211	S	90.8	Very high	88.2	Confident	26 Å²	26	59.1 Å²	59.1	18%	0.182	31%	0.309	C	S	.	.	H	α-helix	trans	-56	-46	173.3	-74.4	0	0	0	0	111.9	H185 K189 S207 Q208 A215	H185-S211 PolarHBondContact CE1-OG 2.91Å; H185-S211 VanDerWaalsContact CE1-OG 3.31Å; K189-S211 PolarHBondContact NZ-OG 3.26Å; S207-S211 PolarHBondContact O-N 2.8Å; S207-S211 PolarHBondContact O-OG 3.32Å; Q208-S211 WeakPolarHBondContact O-CB 3.47Å; Q208-S211 PolarHBondContact O-N 3.21Å; S211-A215 WeakPolarHBondContact O-CB 3.42Å; S211-A215 PolarHBondContact O-N 3.32Å
212	M	90.4	Very high	88.5	Confident	98 Å²	98	58 Å²	58	48%	0.483	30%	0.295	S	S	.	.	H	α-helix	trans	-67	-38.9	178.6	-69.1	-59.5	-64.3	0	0	112	Q208 N209 L210 A215 N216	Q208-M212 WeakPolarHBondContact O-CG 3.41Å; Q208-M212 PolarHBondContact O-N 3.35Å; N209-M212 PolarHBondContact O-N 2.91Å; L210-M212 VanDerWaalsContact C-N 3.32Å; L210-M212 PolarHBondContact O-N 3.41Å; M212-A215 PolarHBondContact O-N 2.81Å; M212-N216 VanDerWaalsContact O-CG 3.31Å; M212-N216 PolarHBondContact O-N 2.92Å; M212-N216 PolarHBondContact O-ND2 3.16Å
213	F	92.8	Very high	88.9	Confident	11 Å²	11	52.4 Å²	52.4	5%	0.048	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-47.1	177.6	174.1	-110.5	0	0	0	112.3	F125 M126 Q129 K175 N209 L210 R219 I220	F125-F213 AromaticContact CD1-CE1 3.83Å; F125-F213 HydrophobicContact CD1-CE1 3.83Å; F125-F213 HydrophobicContact CD1-CZ 4.27Å; F125-F213 AromaticContact CE1-CE1 3.57Å; F125-F213 HydrophobicContact CE1-CE1 3.57Å; F125-F213 AromaticContact CE1-CZ 3.68Å; F125-F213 HydrophobicContact CE1-CZ 3.68Å; F125-F213 HydrophobicContact CZ-CE1 4.49Å; F125-F213 HydrophobicContact CZ-CZ 4.18Å; M126-F213 HydrophobicContact CB-CD1 4.14Å; M126-F213 HydrophobicContact CB-CE1 4.33Å; M126-F213 HydrophobicContact CG-CB 4.3Å; M126-F213 HydrophobicContact CG-CD1 4.1Å; M126-F213 HydrophobicContact CG-CG 4.06Å; M126-F213 HydrophobicContact SD-CB 4.16Å; Q129-F213 HydrophobicContact CG-CE2 4Å; Q129-F213 HydrophobicContact CG-CZ 3.88Å; K175-F213 HydrophobicContact CD-CE1 3.95Å; K175-F213 HydrophobicContact CD-CE2 4.15Å; K175-F213 HydrophobicContact CD-CZ 3.64Å; K175-F213 WeakPolarHBondContact CE-O 3.41Å; N209-F213 WeakPolarHBondContact O-CB 3.43Å; N209-F213 PolarHBondContact O-N 3.45Å; L210-F213 HydrophobicContact CD1-CD1 4.22Å; L210-F213 PolarHBondContact O-N 2.87Å; F213-R219 HydrophobicContact CD2-CB 4.44Å; F213-R219 HydrophobicContact CD2-CG 3.88Å; F213-R219 HydrophobicContact CE2-CG 4.28Å; F213-I220 HydrophobicContact CE2-CG1 4.06Å; F213-I220 HydrophobicContact CZ-CD1 4.33Å; F213-I220 HydrophobicContact CZ-CG1 4.26Å
214	L	91.8	Very high	89.6	Confident	18 Å²	18	50.4 Å²	50.4	9%	0.094	26%	0.257	C	S	.	.	H	α-helix	trans	-73.1	-26.5	-180	-63.2	177.8	0	0	0	113	L122 V181 H185 L210	L122-L214 HydrophobicContact CD1-CD1 4.31Å; V181-L214 HydrophobicContact CG1-CD1 4.25Å; V181-L214 HydrophobicContact CG1-CD2 3.78Å; H185-L214 HydrophobicContact CB-CD1 3.81Å; L210-L214 HydrophobicContact CD1-CD1 4.01Å; L210-L214 HydrophobicContact CD1-CD2 4.47Å; L210-L214 HydrophobicContact CD1-CG 3.99Å; L210-L214 HydrophobicContact CG-CD1 3.99Å; L210-L214 HydrophobicContact CG-CG 4.35Å; L210-L214 WeakPolarHBondContact O-CG 3.42Å; L210-L214 PolarHBondContact O-N 3.09Å
215	A	89.3	Confident	89.9	Confident	53 Å²	53	47.6 Å²	47.6	44%	0.438	24%	0.241	S	C	.	.	H	α-helix	trans	-76.7	-30.6	179.2	0	0	0	0	0	113.6	S211 M212	S211-A215 WeakPolarHBondContact O-CB 3.42Å; S211-A215 PolarHBondContact O-N 3.32Å; M212-A215 PolarHBondContact O-N 2.81Å
216	N	89.3	Confident	90.1	Very high	58 Å²	58	47.6 Å²	47.6	31%	0.31	24%	0.242	S	C	.	.	S	Bend	trans	-85.2	123.3	-176.3	-70.7	-40.6	0	0	0	111.4	K175 M212 R219	K175-N216 PolarHBondContact NZ-O 2.96Å; M212-N216 VanDerWaalsContact O-CG 3.31Å; M212-N216 PolarHBondContact O-N 2.92Å; M212-N216 PolarHBondContact O-ND2 3.16Å; N216-R219 HydrophobicContact CB-CB 4.04Å; N216-R219 HydrophobicContact CB-CG 4.29Å
217	H	87.7	Confident	90.4	Very high	110 Å²	110	47.8 Å²	47.8	51%	0.509	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	147	173.7	-156.8	79.2	0	0	0	110.8	N176 R219 Q222	N176-H217 WeakPolarHBondContact CB-CE1 3.43Å; N176-H217 PolarHBondContact OD1-ND1 3.22Å; H217-R219 PolarHBondContact O-N 3.35Å; H217-Q222 PolarHBondContact O-NE2 3.01Å
218	N	89.7	Confident	90.7	Very high	50 Å²	50	47.4 Å²	47.4	27%	0.267	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	31	-177.9	-62.7	-22.4	0	0	0	114.6	D172 N176 I220 Q222	D172-N218 WeakPolarHBondContact OD2-CA 3.28Å; N176-N218 PolarHBondContact ND2-OD1 3.36Å; N176-N218 PolarHBondContact OD1-N 3.08Å; N218-I220 PolarHBondContact O-N 3.5Å; N218-Q222 WeakPolarHBondContact O-CB 3.01Å; N218-Q222 WeakPolarHBondContact O-CG 3.45Å; N218-Q222 PolarHBondContact O-N 3.49Å
219	R	91.3	Very high	90.8	Very high	90 Å²	90	45 Å²	45	34%	0.34	23%	0.229	S	C	.	.	H	α-helix	trans	-68.4	-36.5	-170.1	-177.5	57	-179.1	176.1	3.7	112.2	D172 F213 N216 H217 C223	D172-R219 PolarHBondContact OD1-N 3.41Å; F213-R219 HydrophobicContact CD2-CB 4.44Å; F213-R219 HydrophobicContact CD2-CG 3.88Å; F213-R219 HydrophobicContact CE2-CG 4.28Å; N216-R219 HydrophobicContact CB-CB 4.04Å; N216-R219 HydrophobicContact CB-CG 4.29Å; H217-R219 PolarHBondContact O-N 3.35Å; R219-C223 WeakPolarHBondContact O-CB 3.27Å; R219-C223 PolarHBondContact O-N 2.89Å; R219-C223 VanDerWaalsContact O-N 3.08Å
220	I	93.6	Very high	91	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-69.4	-48	-179.7	-59	178.1	0	0	0	108.6	F125 Q129 I133 F168 L171 D172 K175 F213 N218 Q222 C223 L224	F125-I220 HydrophobicContact CZ-CD1 3.91Å; Q129-I220 HydrophobicContact CB-CD1 4.26Å; Q129-I220 HydrophobicContact CG-CD1 4.41Å; Q129-I220 HydrophobicContact CG-CG1 4.41Å; I133-I220 HydrophobicContact CD1-CG2 4Å; F168-I220 HydrophobicContact CB-CG2 4.14Å; F168-I220 HydrophobicContact CD1-CG2 3.96Å; F168-I220 HydrophobicContact CG-CG2 4.43Å; L171-I220 HydrophobicContact CB-CD1 3.98Å; D172-I220 HydrophobicContact CB-CB 3.91Å; D172-I220 HydrophobicContact CB-CD1 4.33Å; D172-I220 HydrophobicContact CB-CG1 4.44Å; D172-I220 WeakPolarHBondContact OD1-CB 3.41Å; D172-I220 PolarHBondContact OD1-N 2.94Å; D172-I220 VanDerWaalsContact OD1-N 3.11Å; K175-I220 HydrophobicContact CD-CD1 4.49Å; F213-I220 HydrophobicContact CE2-CG1 4.06Å; F213-I220 HydrophobicContact CZ-CD1 4.33Å; F213-I220 HydrophobicContact CZ-CG1 4.26Å; N218-I220 PolarHBondContact O-N 3.5Å; I220-Q222 PolarHBondContact O-N 3.21Å; I220-C223 PolarHBondContact O-N 2.87Å; I220-L224 WeakPolarHBondContact O-CB 3.38Å; I220-L224 PolarHBondContact O-N 2.69Å
221	T	91.7	Very high	91	Very high	10 Å²	10	48 Å²	48	6%	0.061	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-45.9	178.1	-59	0	0	0	0	112	D172 C223 L224 H225 F269 Y272	D172-T221 WeakPolarHBondContact OD2-CB 3.41Å; D172-T221 PolarHBondContact OD2-N 2.84Å; D172-T221 PolarHBondContact OD2-OG1 3.41Å; T221-C223 PolarHBondContact O-N 3.06Å; T221-L224 PolarHBondContact O-N 2.98Å; T221-H225 WeakPolarHBondContact O-CB 3.4Å; T221-H225 PolarHBondContact O-N 2.89Å; T221-F269 HydrophobicContact CG2-CE2 3.82Å; T221-F269 HydrophobicContact CG2-CZ 3.79Å; T221-Y272 HydrophobicContact CG2-CE1 3.71Å
222	Q	88.8	Confident	90.8	Very high	85 Å²	85	51.9 Å²	51.9	40%	0.397	27%	0.273	S	S	.	.	H	α-helix	trans	-61.8	-42.5	177	-74.3	170.3	9.6	0	0	112.4	H217 N218 I220 H225 Q226	H217-Q222 PolarHBondContact O-NE2 3.01Å; N218-Q222 WeakPolarHBondContact O-CB 3.01Å; N218-Q222 WeakPolarHBondContact O-CG 3.45Å; N218-Q222 PolarHBondContact O-N 3.49Å; I220-Q222 PolarHBondContact O-N 3.21Å; Q222-H225 PolarHBondContact O-N 3.44Å; Q222-Q226 WeakPolarHBondContact O-CB 3.4Å; Q222-Q226 VanDerWaalsContact O-CG 3.27Å; Q222-Q226 WeakPolarHBondContact O-CG 3.47Å; Q222-Q226 PolarHBondContact O-N 2.92Å
223	C	91.9	Very high	90.7	Very high	22 Å²	22	47.7 Å²	47.7	15%	0.149	25%	0.254	C	S	.	.	H	α-helix	trans	-66.8	-40.1	179.1	-169.6	0	0	0	0	111.4	I133 R219 I220 T221 Q227	I133-C223 HydrophobicContact CD1-CB 4.06Å; R219-C223 WeakPolarHBondContact O-CB 3.27Å; R219-C223 PolarHBondContact O-N 2.89Å; R219-C223 VanDerWaalsContact O-N 3.08Å; I220-C223 PolarHBondContact O-N 2.87Å; T221-C223 PolarHBondContact O-N 3.06Å; C223-Q227 WeakPolarHBondContact O-CG 3.22Å; C223-Q227 PolarHBondContact O-N 2.8Å; C223-Q227 VanDerWaalsContact O-N 3.09Å
224	L	93.4	Very high	90.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-48.8	173.8	-178.9	63.5	0	0	0	111.1	I133 F136 F168 I220 T221 Q226 Q227 L228 F269 L273	I133-L224 HydrophobicContact CG2-CD1 4.15Å; F136-L224 HydrophobicContact CD1-CD1 3.8Å; F136-L224 HydrophobicContact CE1-CD1 4.07Å; F168-L224 HydrophobicContact CB-CD2 4.17Å; F168-L224 HydrophobicContact CD2-CD1 4.3Å; F168-L224 HydrophobicContact CD2-CD2 3.66Å; F168-L224 HydrophobicContact CE2-CD1 4.19Å; F168-L224 HydrophobicContact CE2-CD2 4.37Å; F168-L224 HydrophobicContact CG-CD2 4.12Å; I220-L224 WeakPolarHBondContact O-CB 3.38Å; I220-L224 PolarHBondContact O-N 2.69Å; T221-L224 PolarHBondContact O-N 2.98Å; L224-Q226 PolarHBondContact O-N 3.13Å; L224-Q227 PolarHBondContact O-N 3.41Å; L224-L228 HydrophobicContact CD1-CD1 3.89Å; L224-L228 HydrophobicContact CD1-CG 4.13Å; L224-L228 HydrophobicContact CG-CD1 3.81Å; L224-L228 HydrophobicContact CG-CG 4.41Å; L224-L228 WeakPolarHBondContact O-CB 3.44Å; L224-L228 VanDerWaalsContact O-CG 3.3Å; L224-L228 WeakPolarHBondContact O-CG 3.46Å; L224-L228 PolarHBondContact O-N 3.01Å; L224-F269 HydrophobicContact CD2-CE1 4.46Å; L224-L273 HydrophobicContact CD2-CD1 3.85Å; L224-L273 HydrophobicContact CD2-CD2 4.22Å
225	H	88.8	Confident	90.6	Very high	33 Å²	33	48 Å²	48	15%	0.153	26%	0.255	C	S	.	.	H	α-helix	trans	-58.8	-47.1	178.9	-156.9	-81.1	0	0	0	111.9	T221 Q222 Q227 L228 E229	T221-H225 WeakPolarHBondContact O-CB 3.4Å; T221-H225 PolarHBondContact O-N 2.89Å; Q222-H225 PolarHBondContact O-N 3.44Å; H225-Q227 PolarHBondContact O-N 3.38Å; H225-L228 PolarHBondContact O-N 3.09Å; H225-E229 IonicContact CE1-OE1 3.32Å; H225-E229 PolarHBondContact CE1-OE1 2.99Å; H225-E229 IonicContact CE1-OE2 2.81Å; H225-E229 IonicContact ND1-OE1 3.71Å; H225-E229 IonicContact ND1-OE2 3.59Å; H225-E229 PolarHBondContact ND1-OE2 3.44Å; H225-E229 WeakPolarHBondContact O-CG 3.48Å; H225-E229 PolarHBondContact O-N 3.14Å
226	Q	89.1	Confident	90.6	Very high	110 Å²	110	48 Å²	48	51%	0.514	25%	0.246	S	C	.	.	H	α-helix	trans	-60.6	-40.8	178	-74.3	173.5	0.2	0	0	112.8	Q222 L224 V230	Q222-Q226 WeakPolarHBondContact O-CB 3.4Å; Q222-Q226 VanDerWaalsContact O-CG 3.27Å; Q222-Q226 WeakPolarHBondContact O-CG 3.47Å; Q222-Q226 PolarHBondContact O-N 2.92Å; L224-Q226 PolarHBondContact O-N 3.13Å; Q226-V230 VanDerWaalsContact O-CG2 3.29Å; Q226-V230 WeakPolarHBondContact O-CG2 3.09Å
227	Q	93.1	Very high	90.7	Very high	59 Å²	59	45.7 Å²	45.7	28%	0.276	23%	0.234	S	C	.	.	H	α-helix	trans	-75.9	-30.9	179.5	-70.1	-167.6	25.7	0	0	112.8	I133 C137 C223 L224 H225	I133-Q227 HydrophobicContact CG2-CG 4.46Å; C137-Q227 HydrophobicContact CB-CB 4.29Å; C223-Q227 WeakPolarHBondContact O-CG 3.22Å; C223-Q227 PolarHBondContact O-N 2.8Å; C223-Q227 VanDerWaalsContact O-N 3.09Å; L224-Q227 PolarHBondContact O-N 3.41Å; H225-Q227 PolarHBondContact O-N 3.38Å
228	L	92.9	Very high	91	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-72.9	-44.9	177.3	-73.9	175.1	0	0	0	112.4	F136 V140 L224 H225 V230 I231 Y234 L273	F136-L228 HydrophobicContact CE1-CD1 4.48Å; F136-L228 HydrophobicContact CE1-CD2 4.15Å; V140-L228 HydrophobicContact CB-CD2 4.28Å; V140-L228 HydrophobicContact CG1-CD2 4.01Å; V140-L228 HydrophobicContact CG2-CD2 4.1Å; L224-L228 HydrophobicContact CD1-CD1 3.89Å; L224-L228 HydrophobicContact CD1-CG 4.13Å; L224-L228 HydrophobicContact CG-CD1 3.81Å; L224-L228 HydrophobicContact CG-CG 4.41Å; L224-L228 WeakPolarHBondContact O-CB 3.44Å; L224-L228 VanDerWaalsContact O-CG 3.3Å; L224-L228 WeakPolarHBondContact O-CG 3.46Å; L224-L228 PolarHBondContact O-N 3.01Å; H225-L228 PolarHBondContact O-N 3.09Å; L228-V230 PolarHBondContact O-N 3.27Å; L228-V230 VanDerWaalsContact O-N 3.14Å; L228-I231 WeakPolarHBondContact O-CB 3.42Å; L228-I231 PolarHBondContact O-N 3.13Å; L228-Y234 HydrophobicContact CB-CD2 3.86Å; L228-Y234 HydrophobicContact CB-CE2 4.13Å; L228-Y234 HydrophobicContact CB-CG 4.24Å; L228-Y234 HydrophobicContact CD2-CD2 4.49Å; L228-Y234 VanDerWaalsContact O-CD1 3.27Å; L228-Y234 WeakPolarHBondContact O-CD1 3.35Å; L228-L273 HydrophobicContact CD1-CD1 4.37Å
229	E	89.9	Confident	91.1	Very high	39 Å²	39	38.1 Å²	38.1	18%	0.182	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-23.4	-178.8	-76.3	-174.3	134.2	0	0	113.4	H225 I231 Y234 N277 V278	H225-E229 IonicContact CE1-OE1 3.32Å; H225-E229 PolarHBondContact CE1-OE1 2.99Å; H225-E229 IonicContact CE1-OE2 2.81Å; H225-E229 IonicContact ND1-OE1 3.71Å; H225-E229 IonicContact ND1-OE2 3.59Å; H225-E229 PolarHBondContact ND1-OE2 3.44Å; H225-E229 WeakPolarHBondContact O-CG 3.48Å; H225-E229 PolarHBondContact O-N 3.14Å; E229-I231 PolarHBondContact O-N 3.08Å; E229-Y234 HydrophobicContact CG-CE1 4.33Å; E229-N277 PolarHBondContact OE1-N 3.3Å; E229-V278 HydrophobicContact CB-CG2 4.11Å; E229-V278 HydrophobicContact CG-CG2 4.25Å
230	V	92.6	Very high	91.1	Very high	121 Å²	121	35.3 Å²	35.3	73%	0.733	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-20.9	174.4	174.8	0	0	0	0	111.9	Q226 L228 P232	Q226-V230 VanDerWaalsContact O-CG2 3.29Å; Q226-V230 WeakPolarHBondContact O-CG2 3.09Å; L228-V230 PolarHBondContact O-N 3.27Å; L228-V230 VanDerWaalsContact O-N 3.14Å; V230-P232 WeakPolarHBondContact O-CD 3.42Å
231	I	91.7	Very high	91.1	Very high	13 Å²	13	35.5 Å²	35.5	7%	0.067	19%	0.19	C	C	.	.	S	Bend	trans	-89.9	117.2	-177	-59	166.5	0	0	0	109.4	C137 V140 K141 C144 L228 E229 G233 Y234	C137-I231 HydrophobicContact CB-CD1 4.24Å; C137-I231 VanDerWaalsContact O-CD1 3.3Å; C137-I231 WeakPolarHBondContact O-CD1 3.37Å; V140-I231 HydrophobicContact CB-CD1 4.32Å; V140-I231 HydrophobicContact CG1-CD1 4.15Å; K141-I231 HydrophobicContact CB-CD1 3.94Å; K141-I231 HydrophobicContact CB-CG1 4.22Å; K141-I231 HydrophobicContact CB-CG2 4.25Å; K141-I231 HydrophobicContact CG-CG2 4.43Å; C144-I231 HydrophobicContact CB-CG2 4.2Å; L228-I231 WeakPolarHBondContact O-CB 3.42Å; L228-I231 PolarHBondContact O-N 3.13Å; E229-I231 PolarHBondContact O-N 3.08Å; I231-G233 PolarHBondContact O-N 3.41Å; I231-G233 VanDerWaalsContact O-N 3.17Å; I231-Y234 WeakPolarHBondContact O-CD1 3.36Å; I231-Y234 PolarHBondContact O-N 3.16Å
232	P	88.1	Confident	91.2	Very high	108 Å²	108	35 Å²	35	70%	0.701	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	117.8	-178.6	25.7	-32.9	0	0	0	111.8	R149 V230	R149-P232 PolarHBondContact NH2-O 3.07Å; V230-P232 WeakPolarHBondContact O-CD 3.42Å
233	G	87.1	Confident	91.4	Very high	9 Å²	9	33.4 Å²	33.4	9%	0.093	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	30.1	179.1	0	0	0	0	0	114.8	C144 I231 E235 E236	C144-G233 PolarHBondContact SG-O 2.88Å; I231-G233 PolarHBondContact O-N 3.41Å; I231-G233 VanDerWaalsContact O-N 3.17Å; G233-E235 WeakPolarHBondContact CA-OE1 3.2Å; G233-E235 WeakPolarHBondContact CA-OE2 3.32Å; G233-E235 PolarHBondContact O-N 3.1Å; G233-E236 PolarHBondContact O-N 2.77Å
234	Y	92.4	Very high	91.4	Very high	1 Å²	1	33.6 Å²	33.6	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-60.5	-33.8	170.3	78.3	-83.5	0	0	0	111.7	L228 E229 I231 E236 L237 L238 L273	L228-Y234 HydrophobicContact CB-CD2 3.86Å; L228-Y234 HydrophobicContact CB-CE2 4.13Å; L228-Y234 HydrophobicContact CB-CG 4.24Å; L228-Y234 HydrophobicContact CD2-CD2 4.49Å; L228-Y234 VanDerWaalsContact O-CD1 3.27Å; L228-Y234 WeakPolarHBondContact O-CD1 3.35Å; E229-Y234 HydrophobicContact CG-CE1 4.33Å; I231-Y234 WeakPolarHBondContact O-CD1 3.36Å; I231-Y234 PolarHBondContact O-N 3.16Å; Y234-E236 PolarHBondContact O-N 3.39Å; Y234-L237 PolarHBondContact O-N 2.83Å; Y234-L237 VanDerWaalsContact O-N 3.1Å; Y234-L238 HydrophobicContact CD2-CD1 3.7Å; Y234-L238 HydrophobicContact CD2-CG 4.33Å; Y234-L238 HydrophobicContact CE2-CD1 3.83Å; Y234-L238 PolarHBondContact O-N 3.45Å; Y234-L238 VanDerWaalsContact O-N 3.13Å; Y234-L273 WeakPolarHBondContact CE2-O 3.46Å; Y234-L273 PolarHBondContact OH-O 2.85Å
235	E	90.6	Very high	91.4	Very high	34 Å²	34	33.7 Å²	33.7	16%	0.159	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-26.9	-179.5	72	-74.9	176.5	0	0	112.7	G233 A239 S279 L284	G233-E235 WeakPolarHBondContact CA-OE1 3.2Å; G233-E235 WeakPolarHBondContact CA-OE2 3.32Å; G233-E235 PolarHBondContact O-N 3.1Å; E235-A239 WeakPolarHBondContact O-CB 3.38Å; E235-A239 PolarHBondContact O-N 3.5Å; E235-S279 WeakPolarHBondContact CB-OG 3.31Å; E235-L284 HydrophobicContact CG-CD1 4.4Å
236	E	90.1	Very high	91.6	Very high	53 Å²	53	32.6 Å²	32.6	25%	0.248	18%	0.177	C	C	.	.	H	α-helix	trans	-69.1	-39.9	175	-71.5	-67.7	164.2	0	0	111.8	G233 Y234 A239 D240 R289	G233-E236 PolarHBondContact O-N 2.77Å; Y234-E236 PolarHBondContact O-N 3.39Å; E236-A239 PolarHBondContact O-N 3.21Å; E236-D240 PolarHBondContact O-N 3.24Å; E236-D240 VanDerWaalsContact O-N 3.16Å; E236-R289 PolarHBondContact O-NH2 3.42Å; E236-R289 IonicContact OE2-CZ 2.7Å; E236-R289 IonicContact OE2-NE 3.34Å; E236-R289 PolarHBondContact OE2-NE 2.93Å; E236-R289 IonicContact OE2-NH2 3.68Å; E236-R289 PolarHBondContact OE2-NH2 3.12Å
237	L	91.1	Very high	91.7	Very high	10 Å²	10	30.8 Å²	30.8	5%	0.052	17%	0.171	C	C	.	.	H	α-helix	trans	-70.9	-42.9	176.5	-179.9	66.2	0	0	0	110.8	V140 L143 L158 L161 Y234 A239 D240 I241	V140-L237 HydrophobicContact CB-CD2 4.13Å; V140-L237 HydrophobicContact CG1-CD2 4.01Å; V140-L237 HydrophobicContact CG2-CD2 3.97Å; L143-L237 HydrophobicContact CB-CD1 4.39Å; L143-L237 HydrophobicContact CB-CD2 4.03Å; L143-L237 HydrophobicContact CD1-CD1 4.18Å; L143-L237 HydrophobicContact CD1-CD2 3.95Å; L158-L237 HydrophobicContact CD2-CD1 3.7Å; L161-L237 HydrophobicContact CD1-CD2 4.36Å; Y234-L237 PolarHBondContact O-N 2.83Å; Y234-L237 VanDerWaalsContact O-N 3.1Å; L237-A239 VanDerWaalsContact C-N 3.28Å; L237-A239 PolarHBondContact O-N 2.91Å; L237-D240 WeakPolarHBondContact O-CB 3.38Å; L237-D240 PolarHBondContact O-N 2.98Å; L237-I241 WeakPolarHBondContact O-CG1 3.2Å; L237-I241 PolarHBondContact O-N 3.47Å; L237-I241 VanDerWaalsContact O-N 3.08Å
238	L	92.5	Very high	91.7	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-61	-39	175.2	-64.6	-174.5	0	0	0	111.6	I165 Y234 D240 I241 V242 L273 M274	I165-L238 HydrophobicContact CD1-CD2 3.58Å; Y234-L238 HydrophobicContact CD2-CD1 3.7Å; Y234-L238 HydrophobicContact CD2-CG 4.33Å; Y234-L238 HydrophobicContact CE2-CD1 3.83Å; Y234-L238 PolarHBondContact O-N 3.45Å; Y234-L238 VanDerWaalsContact O-N 3.13Å; L238-D240 VanDerWaalsContact C-N 3.27Å; L238-D240 PolarHBondContact O-N 2.95Å; L238-I241 HydrophobicContact CD2-CD1 4.22Å; L238-I241 PolarHBondContact O-N 3.16Å; L238-V242 WeakPolarHBondContact O-CG2 3.33Å; L238-V242 PolarHBondContact O-N 3.37Å; L238-L273 HydrophobicContact CD1-CB 3.97Å; L238-M274 HydrophobicContact CB-CG 3.53Å; L238-M274 HydrophobicContact CB-SD 3.7Å; L238-M274 HydrophobicContact CD1-CG 3.79Å; L238-M274 HydrophobicContact CG-CG 4.32Å
239	A	92.1	Very high	91.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-33.5	173.8	0	0	0	0	0	112.6	E235 E236 L237 N243 M274 R289 I290	E235-A239 WeakPolarHBondContact O-CB 3.38Å; E235-A239 PolarHBondContact O-N 3.5Å; E236-A239 PolarHBondContact O-N 3.21Å; L237-A239 VanDerWaalsContact C-N 3.28Å; L237-A239 PolarHBondContact O-N 2.91Å; A239-N243 VanDerWaalsContact O-CB 3.27Å; A239-N243 WeakPolarHBondContact O-CB 3.23Å; A239-N243 PolarHBondContact O-N 3.47Å; A239-N243 PolarHBondContact O-ND2 3.37Å; A239-M274 HydrophobicContact CB-CE 3.67Å; A239-M274 HydrophobicContact CB-SD 4.4Å; A239-R289 HydrophobicContact CB-CG 4.21Å; A239-R289 VanDerWaalsContact CB-CZ 3.49Å; A239-I290 HydrophobicContact CB-CG2 3.76Å
240	D	90.9	Very high	91.9	Very high	32 Å²	32	32.1 Å²	32.1	17%	0.171	18%	0.175	C	C	.	.	H	α-helix	trans	-67.8	-42.7	173.5	-72.2	-20.6	0	0	0	112.2	E236 L237 L238 N243 I244 R289 K571	E236-D240 PolarHBondContact O-N 3.24Å; E236-D240 VanDerWaalsContact O-N 3.16Å; L237-D240 WeakPolarHBondContact O-CB 3.38Å; L237-D240 PolarHBondContact O-N 2.98Å; L238-D240 VanDerWaalsContact C-N 3.27Å; L238-D240 PolarHBondContact O-N 2.95Å; D240-N243 PolarHBondContact O-N 2.9Å; D240-I244 WeakPolarHBondContact O-CG1 3.2Å; D240-I244 PolarHBondContact O-N 3.5Å; D240-R289 VanDerWaalsContact CG-NH2 3.32Å; D240-R289 IonicContact OD1-CZ 3.21Å; D240-R289 VanDerWaalsContact OD1-CZ 3.27Å; D240-R289 IonicContact OD1-NH1 3.46Å; D240-R289 PolarHBondContact OD1-NH1 3.34Å; D240-R289 VanDerWaalsContact OD1-NH1 3.12Å; D240-R289 IonicContact OD1-NH2 3.18Å; D240-R289 PolarHBondContact OD1-NH2 2.75Å; D240-R289 IonicContact OD2-NH2 3.76Å; D240-K571 IonicContact OD1-NZ 3.63Å; D240-K571 PolarHBondContact OD1-NZ 3.39Å; D240-K571 IonicContact OD2-NZ 3.14Å; D240-K571 PolarHBondContact OD2-NZ 3.49Å
241	I	93.8	Very high	91.8	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.015	16%	0.162	C	C	.	.	H	α-helix	trans	-61.1	-48.4	175.8	-62.5	170.4	0	0	0	110.3	L158 L161 I165 L237 L238 I244 C245 V266	L158-I241 HydrophobicContact CB-CG1 4.32Å; L158-I241 HydrophobicContact CD2-CG1 3.92Å; L161-I241 HydrophobicContact CB-CD1 3.65Å; L161-I241 HydrophobicContact CB-CG1 4.47Å; L161-I241 HydrophobicContact CD1-CD1 4.4Å; I165-I241 HydrophobicContact CD1-CD1 4.02Å; L237-I241 WeakPolarHBondContact O-CG1 3.2Å; L237-I241 PolarHBondContact O-N 3.47Å; L237-I241 VanDerWaalsContact O-N 3.08Å; L238-I241 HydrophobicContact CD2-CD1 4.22Å; L238-I241 PolarHBondContact O-N 3.16Å; I241-I244 PolarHBondContact O-N 3.22Å; I241-C245 PolarHBondContact O-N 2.96Å; I241-C245 PolarHBondContact O-SG 3.4Å; I241-V266 HydrophobicContact CG2-CG1 3.68Å
242	V	94.4	Very high	91.8	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-44.5	179.6	171.8	0	0	0	0	111.1	L238 I244 C245 V246 M274 I295	L238-V242 WeakPolarHBondContact O-CG2 3.33Å; L238-V242 PolarHBondContact O-N 3.37Å; V242-I244 PolarHBondContact O-N 2.89Å; V242-C245 PolarHBondContact O-N 3.27Å; V242-V246 HydrophobicContact CG1-CG2 4.44Å; V242-V246 WeakPolarHBondContact O-CG2 3.33Å; V242-V246 PolarHBondContact O-N 3Å; V242-M274 HydrophobicContact CG2-SD 4.25Å; V242-I295 HydrophobicContact CG1-CD1 3.73Å
243	N	92.8	Very high	92	Very high	51 Å²	51	32.9 Å²	32.9	27%	0.273	16%	0.162	S	C	.	.	H	α-helix	trans	-64.2	-38.5	180	-75.9	-18.3	0	0	0	112.7	A239 D240 C245 V246 D247 R289	A239-N243 VanDerWaalsContact O-CB 3.27Å; A239-N243 WeakPolarHBondContact O-CB 3.23Å; A239-N243 PolarHBondContact O-N 3.47Å; A239-N243 PolarHBondContact O-ND2 3.37Å; D240-N243 PolarHBondContact O-N 2.9Å; N243-C245 VanDerWaalsContact C-N 3.35Å; N243-V246 PolarHBondContact O-N 3.2Å; N243-D247 PolarHBondContact O-N 2.99Å; N243-R289 PolarHBondContact ND2-NH1 2.9Å; N243-R289 PolarHBondContact ND2-O 3.25Å
244	I	91.5	Very high	92.3	Very high	26 Å²	26	34.5 Å²	34.5	13%	0.133	17%	0.166	C	C	.	.	H	α-helix	trans	-64.5	-42.4	173.9	-74.5	170.4	0	0	0	110.6	E155 L158 L159 D240 I241 V242 V246 D247 Y248	E155-I244 HydrophobicContact CB-CD1 4.5Å; E155-I244 HydrophobicContact CG-CD1 4.02Å; L158-I244 HydrophobicContact CB-CD1 3.74Å; L158-I244 HydrophobicContact CD1-CD1 3.17Å; L158-I244 HydrophobicContact CG-CD1 4.05Å; L159-I244 HydrophobicContact CD2-CG2 4.14Å; L159-I244 HydrophobicContact CG-CG2 4.3Å; D240-I244 WeakPolarHBondContact O-CG1 3.2Å; D240-I244 PolarHBondContact O-N 3.5Å; I241-I244 PolarHBondContact O-N 3.22Å; V242-I244 PolarHBondContact O-N 2.89Å; I244-V246 VanDerWaalsContact C-N 3.27Å; I244-V246 PolarHBondContact O-N 2.87Å; I244-D247 PolarHBondContact O-N 3.25Å; I244-Y248 HydrophobicContact CG2-CD1 3.83Å; I244-Y248 HydrophobicContact CG2-CE1 3.81Å; I244-Y248 HydrophobicContact CG2-CG 4.37Å; I244-Y248 WeakPolarHBondContact O-CB 3.46Å; I244-Y248 VanDerWaalsContact O-CD1 3.28Å; I244-Y248 WeakPolarHBondContact O-CD1 3.26Å; I244-Y248 PolarHBondContact O-N 3.41Å
245	C	93.8	Very high	92.3	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.007	17%	0.166	C	C	.	.	H	α-helix	trans	-60.9	-40.9	176.3	-64	0	0	0	0	111.2	I241 V242 N243 Y248 Y249 L263 M267	I241-C245 PolarHBondContact O-N 2.96Å; I241-C245 PolarHBondContact O-SG 3.4Å; V242-C245 PolarHBondContact O-N 3.27Å; N243-C245 VanDerWaalsContact C-N 3.35Å; C245-Y248 PolarHBondContact O-N 3.24Å; C245-Y249 WeakPolarHBondContact O-CB 3.37Å; C245-Y249 PolarHBondContact O-N 3.5Å; C245-L263 HydrophobicContact CB-CB 4.34Å; C245-L263 HydrophobicContact CB-CD2 4.17Å; C245-M267 HydrophobicContact CB-CE 3.89Å; C245-M267 HydrophobicContact CB-CG 3.99Å; C245-M267 WeakPolarHBondContact O-CE 3.44Å
246	V	93.8	Very high	92.5	Very high	10 Å²	10	33 Å²	33	6%	0.061	16%	0.159	C	C	.	.	H	α-helix	trans	-62.3	-46.2	177.2	166.4	0	0	0	0	110.7	V242 N243 I244 Y249 E250 M267 K294 I295 F298	V242-V246 HydrophobicContact CG1-CG2 4.44Å; V242-V246 WeakPolarHBondContact O-CG2 3.33Å; V242-V246 PolarHBondContact O-N 3Å; N243-V246 PolarHBondContact O-N 3.2Å; I244-V246 VanDerWaalsContact C-N 3.27Å; I244-V246 PolarHBondContact O-N 2.87Å; V246-Y249 PolarHBondContact O-N 3.37Å; V246-E250 VanDerWaalsContact O-CB 3.31Å; V246-E250 WeakPolarHBondContact O-CB 3.34Å; V246-E250 PolarHBondContact O-N 3.43Å; V246-M267 HydrophobicContact CG2-CE 4.12Å; V246-M267 HydrophobicContact CG2-CG 4.21Å; V246-M267 HydrophobicContact CG2-SD 3.8Å; V246-K294 HydrophobicContact CG1-CB 4.28Å; V246-K294 HydrophobicContact CG1-CD 3.96Å; V246-I295 HydrophobicContact CG2-CD1 4.01Å; V246-I295 HydrophobicContact CG2-CG1 3.67Å; V246-F298 HydrophobicContact CG1-CE2 4.09Å
247	D	91.5	Very high	92.6	Very high	73 Å²	73	31 Å²	31	39%	0.39	15%	0.15	S	C	.	.	H	α-helix	trans	-63.2	-45.1	177.8	-172.8	75.7	0	0	0	111.7	N243 I244 Y249 E250 N251	N243-D247 PolarHBondContact O-N 2.99Å; I244-D247 PolarHBondContact O-N 3.25Å; D247-Y249 VanDerWaalsContact C-N 3.34Å; D247-Y249 PolarHBondContact O-N 3.35Å; D247-E250 PolarHBondContact O-N 3.11Å; D247-N251 VanDerWaalsContact O-CB 3.31Å; D247-N251 WeakPolarHBondContact O-CB 3.36Å; D247-N251 PolarHBondContact O-N 2.79Å; D247-N251 PolarHBondContact O-ND2 3.05Å; D247-N251 PolarHBondContact OD1-ND2 3.24Å; D247-N251 PolarHBondContact OD2-ND2 3.16Å; D247-N251 VanDerWaalsContact OD2-ND2 3.15Å
248	Y	92.8	Very high	92.6	Very high	8 Å²	8	34.1 Å²	34.1	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-39.1	179.6	-85.4	41.1	0	0	0	111.9	E155 L159 I244 C245 K252 M253 F598	E155-Y248 WeakPolarHBondContact OE2-CE1 3.48Å; E155-Y248 PolarHBondContact OE2-OH 2.96Å; L159-Y248 HydrophobicContact CD1-CD2 3.95Å; L159-Y248 HydrophobicContact CD1-CE2 3.46Å; L159-Y248 VanDerWaalsContact CD1-CE2 3.46Å; L159-Y248 HydrophobicContact CD2-CD2 4.48Å; L159-Y248 HydrophobicContact CG-CE2 4.44Å; I244-Y248 HydrophobicContact CG2-CD1 3.83Å; I244-Y248 HydrophobicContact CG2-CE1 3.81Å; I244-Y248 HydrophobicContact CG2-CG 4.37Å; I244-Y248 WeakPolarHBondContact O-CB 3.46Å; I244-Y248 VanDerWaalsContact O-CD1 3.28Å; I244-Y248 WeakPolarHBondContact O-CD1 3.26Å; I244-Y248 PolarHBondContact O-N 3.41Å; C245-Y248 PolarHBondContact O-N 3.24Å; Y248-K252 CarbonylContact O-C 3.55Å; Y248-K252 PolarHBondContact O-N 3.39Å; Y248-K252 VanDerWaalsContact O-N 3.09Å; Y248-M253 HydrophobicContact CD1-CB 4.15Å; Y248-M253 HydrophobicContact CD1-CG 4.41Å; Y248-M253 HydrophobicContact CD2-CB 3.64Å; Y248-M253 WeakPolarHBondContact CD2-O 3.4Å; Y248-M253 HydrophobicContact CE2-CB 4.1Å; Y248-M253 HydrophobicContact CG-CB 3.66Å; Y248-M253 HydrophobicContact CG-CG 4.37Å; Y248-M253 PolarHBondContact O-N 3.09Å; Y248-F598 HydrophobicContact CD2-CE2 4.38Å; Y248-F598 HydrophobicContact CD2-CZ 4.44Å; Y248-F598 HydrophobicContact CE2-CD2 4.48Å; Y248-F598 AromaticContact CE2-CE2 3.62Å; Y248-F598 HydrophobicContact CE2-CE2 3.62Å; Y248-F598 HydrophobicContact CE2-CZ 4.1Å
249	Y	92.9	Very high	92.6	Very high	32 Å²	32	36.7 Å²	36.7	13%	0.125	19%	0.185	C	C	.	.	H	α-helix	trans	-69	-43.1	177	-170.8	-95	0	0	0	111.9	C245 V246 D247 K252 Y254 K260 L264 M267 F298	C245-Y249 WeakPolarHBondContact O-CB 3.37Å; C245-Y249 PolarHBondContact O-N 3.5Å; V246-Y249 PolarHBondContact O-N 3.37Å; D247-Y249 VanDerWaalsContact C-N 3.34Å; D247-Y249 PolarHBondContact O-N 3.35Å; Y249-K252 PolarHBondContact O-N 2.63Å; Y249-Y254 HydrophobicContact CD2-CE1 4.25Å; Y249-K260 HydrophobicContact CD2-CG 4.33Å; Y249-K260 HydrophobicContact CE2-CD 4.49Å; Y249-K260 HydrophobicContact CE2-CG 3.81Å; Y249-L264 HydrophobicContact CD2-CD2 3.99Å; Y249-L264 HydrophobicContact CD2-CG 4.18Å; Y249-L264 HydrophobicContact CE1-CD2 4.38Å; Y249-L264 HydrophobicContact CE2-CD1 3.9Å; Y249-L264 HydrophobicContact CE2-CD2 3.83Å; Y249-L264 HydrophobicContact CE2-CG 3.9Å; Y249-L264 HydrophobicContact CG-CD2 4.34Å; Y249-M267 HydrophobicContact CG-CE 4.34Å; Y249-F298 HydrophobicContact CD1-CB 4.36Å; Y249-F298 AromaticContact CD1-CD1 3.76Å; Y249-F298 HydrophobicContact CD1-CD1 3.76Å; Y249-F298 AromaticContact CD1-CD2 3.64Å; Y249-F298 HydrophobicContact CD1-CD2 3.64Å; Y249-F298 AromaticContact CD1-CE1 3.86Å; Y249-F298 HydrophobicContact CD1-CE1 3.86Å; Y249-F298 AromaticContact CD1-CE2 3.72Å; Y249-F298 HydrophobicContact CD1-CE2 3.72Å; Y249-F298 AromaticContact CD1-CG 3.66Å; Y249-F298 HydrophobicContact CD1-CG 3.66Å; Y249-F298 AromaticContact CD1-CZ 3.85Å; Y249-F298 HydrophobicContact CD1-CZ 3.85Å; Y249-F298 HydrophobicContact CE1-CB 4.05Å; Y249-F298 AromaticContact CE1-CD1 3.63Å; Y249-F298 HydrophobicContact CE1-CD1 3.63Å; Y249-F298 HydrophobicContact CE1-CD2 4.17Å; Y249-F298 HydrophobicContact CE1-CE1 4.07Å; Y249-F298 AromaticContact CE1-CG 3.7Å; Y249-F298 HydrophobicContact CE1-CG 3.7Å; Y249-F298 HydrophobicContact CG-CD2 4.42Å; Y249-F298 HydrophobicContact CG-CE2 4.48Å
250	E	92.9	Very high	92.6	Very high	87 Å²	87	37.5 Å²	37.5	41%	0.407	19%	0.189	S	C	.	.	H	α-helix	trans	-65.3	-42.2	179.8	-171.8	171.9	-152.2	0	0	112.3	V246 D247 K294 F298	V246-E250 VanDerWaalsContact O-CB 3.31Å; V246-E250 WeakPolarHBondContact O-CB 3.34Å; V246-E250 PolarHBondContact O-N 3.43Å; D247-E250 PolarHBondContact O-N 3.11Å; E250-K294 WeakPolarHBondContact OE1-CE 3.14Å; E250-K294 IonicContact OE1-NZ 3.99Å; E250-K294 PolarHBondContact OE1-NZ 2.74Å; E250-K294 IonicContact OE2-NZ 3.72Å; E250-K294 PolarHBondContact OE2-NZ 3.24Å; E250-F298 HydrophobicContact CB-CZ 4.09Å
251	N	91.6	Very high	92.7	Very high	86 Å²	86	36.4 Å²	36.4	46%	0.46	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	3.9	-177.1	-63.4	-40.5	0	0	0	113.9	D247 M253	D247-N251 VanDerWaalsContact O-CB 3.31Å; D247-N251 WeakPolarHBondContact O-CB 3.36Å; D247-N251 PolarHBondContact O-N 2.79Å; D247-N251 PolarHBondContact O-ND2 3.05Å; D247-N251 PolarHBondContact OD1-ND2 3.24Å; D247-N251 PolarHBondContact OD2-ND2 3.16Å; D247-N251 VanDerWaalsContact OD2-ND2 3.15Å; N251-M253 VanDerWaalsContact C-N 3.35Å; N251-M253 HydrophobicContact CB-CG 4.06Å; N251-M253 PolarHBondContact O-N 2.93Å
252	K	92.1	Very high	92.7	Very high	146 Å²	146	38.2 Å²	38.2	64%	0.635	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	40.1	-178.2	-54	-179.8	179.7	179.8	0	114.1	Y248 Y249 Y254	Y248-K252 CarbonylContact O-C 3.55Å; Y248-K252 PolarHBondContact O-N 3.39Å; Y248-K252 VanDerWaalsContact O-N 3.09Å; Y249-K252 PolarHBondContact O-N 2.63Å; K252-Y254 HydrophobicContact CB-CE1 4.38Å; K252-Y254 PolarHBondContact O-N 2.92Å
253	M	91.6	Very high	92.7	Very high	27 Å²	27	38.6 Å²	38.6	13%	0.133	19%	0.194	C	C	.	.			trans	-83	60.8	174.2	-55.5	-59.9	-66.4	0	0	110.6	Y248 N251 F598	Y248-M253 HydrophobicContact CD1-CB 4.15Å; Y248-M253 HydrophobicContact CD1-CG 4.41Å; Y248-M253 HydrophobicContact CD2-CB 3.64Å; Y248-M253 WeakPolarHBondContact CD2-O 3.4Å; Y248-M253 HydrophobicContact CE2-CB 4.1Å; Y248-M253 HydrophobicContact CG-CB 3.66Å; Y248-M253 HydrophobicContact CG-CG 4.37Å; Y248-M253 PolarHBondContact O-N 3.09Å; N251-M253 VanDerWaalsContact C-N 3.35Å; N251-M253 HydrophobicContact CB-CG 4.06Å; N251-M253 PolarHBondContact O-N 2.93Å; M253-F598 VanDerWaalsContact C-CE1 3.41Å; M253-F598 HydrophobicContact CB-CE1 4.2Å; M253-F598 HydrophobicContact CB-CZ 4.17Å; M253-F598 HydrophobicContact CE-CB 3.55Å; M253-F598 HydrophobicContact CE-CD1 3.78Å; M253-F598 HydrophobicContact CE-CD2 3.82Å; M253-F598 HydrophobicContact CE-CE1 4.45Å; M253-F598 HydrophobicContact CE-CE2 4.49Å; M253-F598 HydrophobicContact CE-CG 3.42Å; M253-F598 VanDerWaalsContact CE-CG 3.42Å; M253-F598 WeakPolarHBondContact O-CZ 3.46Å
254	Y	93.6	Very high	92.7	Very high	43 Å²	43	36.2 Å²	36.2	17%	0.169	18%	0.181	C	C	.	.			trans	-156.7	155.9	174.8	54.9	-96.1	0	0	0	108.6	Y249 K252 K260 L263	Y249-Y254 HydrophobicContact CD2-CE1 4.25Å; K252-Y254 HydrophobicContact CB-CE1 4.38Å; K252-Y254 PolarHBondContact O-N 2.92Å; Y254-K260 HydrophobicContact CD2-CB 3.71Å; Y254-K260 HydrophobicContact CD2-CG 4.19Å; Y254-K260 HydrophobicContact CE1-CG 4.31Å; Y254-K260 HydrophobicContact CE2-CB 3.8Å; Y254-K260 HydrophobicContact CE2-CD 4.04Å; Y254-K260 HydrophobicContact CE2-CG 3.78Å; Y254-K260 HydrophobicContact CG-CB 4.15Å; Y254-L263 HydrophobicContact CD1-CD1 3.9Å
255	L	93	Very high	92.8	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	18%	0.178	C	C	.	.			trans	-115.7	-50.2	175.8	-174.1	64.4	0	0	0	111.8	E259 L393 L396 Q397 S400 F599 H602 A609	L255-E259 PolarHBondContact N-OE2 2.91Å; L255-L393 HydrophobicContact CD1-CD1 4.11Å; L255-L396 HydrophobicContact CD1-CB 3.94Å; L255-L396 HydrophobicContact CD2-CB 4.38Å; L255-L396 HydrophobicContact CD2-CD1 4.09Å; L255-Q397 HydrophobicContact CD1-CG 3.8Å; L255-S400 WeakPolarHBondContact O-CB 3.37Å; L255-S400 PolarHBondContact O-OG 3.26Å; L255-F599 HydrophobicContact CB-CD1 4.44Å; L255-F599 HydrophobicContact CB-CE1 4.46Å; L255-H602 HydrophobicContact CD2-CB 3.44Å; L255-H602 VanDerWaalsContact CD2-CB 3.44Å; L255-A609 HydrophobicContact CD2-CB 4.2Å
256	T	93.7	Very high	92.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	-90.4	157.6	-172.4	74.7	0	0	0	0	112.4	S258 E259 K260 Q612	T256-S258 PolarHBondContact O-N 3.1Å; T256-S258 PolarHBondContact OG1-OG 3.02Å; T256-E259 PolarHBondContact N-OE2 3.35Å; T256-E259 PolarHBondContact O-N 3.3Å; T256-E259 WeakPolarHBondContact OG1-CG 3.46Å; T256-E259 PolarHBondContact OG1-N 3.2Å; T256-K260 PolarHBondContact O-N 2.7Å; T256-K260 VanDerWaalsContact O-N 3.14Å; T256-Q612 HydrophobicContact CG2-CB 3.79Å
257	P	92.9	Very high	92.9	Very high	11 Å²	11	35.3 Å²	35.3	7%	0.071	18%	0.175	C	C	.	.	H	α-helix	trans	-57	-40.3	175.2	-25.2	34.8	0	0	0	112.3	E259 K260 H261 S400 T404	P257-E259 PolarHBondContact O-N 3.34Å; P257-K260 WeakPolarHBondContact O-CB 3.39Å; P257-K260 PolarHBondContact O-N 2.99Å; P257-H261 VanDerWaalsContact O-CG 3.26Å; P257-H261 PolarHBondContact O-N 2.76Å; P257-H261 PolarHBondContact O-ND1 3.34Å; P257-S400 WeakPolarHBondContact CD-OG 3.34Å; P257-T404 WeakPolarHBondContact CB-OG1 3.39Å; P257-T404 WeakPolarHBondContact CG-OG1 3.34Å
258	S	90.4	Very high	93	Very high	77 Å²	77	31.9 Å²	31.9	54%	0.538	16%	0.157	S	C	.	.	H	α-helix	trans	-63.3	-38.8	179.9	73.6	0	0	0	0	113	T256 M262	T256-S258 PolarHBondContact O-N 3.1Å; T256-S258 PolarHBondContact OG1-OG 3.02Å; S258-M262 VanDerWaalsContact O-CB 3.3Å; S258-M262 WeakPolarHBondContact O-CB 3.48Å; S258-M262 PolarHBondContact O-N 3.25Å
259	E	91.9	Very high	93	Very high	55 Å²	55	31.7 Å²	31.7	26%	0.257	16%	0.156	S	C	.	.	H	α-helix	trans	-65.4	-46	174.6	-72.4	172	160.9	0	0	110.9	L255 T256 P257 H261 M262 L263 H602	L255-E259 PolarHBondContact N-OE2 2.91Å; T256-E259 PolarHBondContact N-OE2 3.35Å; T256-E259 PolarHBondContact O-N 3.3Å; T256-E259 WeakPolarHBondContact OG1-CG 3.46Å; T256-E259 PolarHBondContact OG1-N 3.2Å; P257-E259 PolarHBondContact O-N 3.34Å; E259-H261 VanDerWaalsContact C-N 3.35Å; E259-H261 PolarHBondContact O-N 3.12Å; E259-M262 WeakPolarHBondContact O-CB 3.43Å; E259-M262 PolarHBondContact O-N 3.25Å; E259-L263 WeakPolarHBondContact O-CG 3.11Å; E259-L263 PolarHBondContact O-N 3.3Å; E259-H602 IonicContact OE1-CD2 3.65Å; E259-H602 IonicContact OE1-CE1 2.77Å; E259-H602 IonicContact OE1-NE2 2.72Å; E259-H602 PolarHBondContact OE1-NE2 3.17Å; E259-H602 IonicContact OE2-NE2 3.65Å
260	K	93.3	Very high	93.1	Very high	17 Å²	17	30.2 Å²	30.2	7%	0.074	15%	0.151	C	C	.	.	H	α-helix	trans	-55.7	-50.1	175.8	-177.6	-166	176.7	-163.5	0	111.1	Y249 Y254 T256 P257 M262 L263 T404 E408	Y249-K260 HydrophobicContact CD2-CG 4.33Å; Y249-K260 HydrophobicContact CE2-CD 4.49Å; Y249-K260 HydrophobicContact CE2-CG 3.81Å; Y254-K260 HydrophobicContact CD2-CB 3.71Å; Y254-K260 HydrophobicContact CD2-CG 4.19Å; Y254-K260 HydrophobicContact CE1-CG 4.31Å; Y254-K260 HydrophobicContact CE2-CB 3.8Å; Y254-K260 HydrophobicContact CE2-CD 4.04Å; Y254-K260 HydrophobicContact CE2-CG 3.78Å; Y254-K260 HydrophobicContact CG-CB 4.15Å; T256-K260 PolarHBondContact O-N 2.7Å; T256-K260 VanDerWaalsContact O-N 3.14Å; P257-K260 WeakPolarHBondContact O-CB 3.39Å; P257-K260 PolarHBondContact O-N 2.99Å; K260-M262 VanDerWaalsContact C-N 3.34Å; K260-L263 PolarHBondContact O-N 3.23Å; K260-T404 HydrophobicContact CD-CG2 3.82Å; K260-T404 VanDerWaalsContact NZ-CG2 3.26Å; K260-E408 IonicContact NZ-OE1 3.27Å; K260-E408 PolarHBondContact NZ-OE1 2.86Å; K260-E408 IonicContact NZ-OE2 3.72Å
261	H	93.1	Very high	93.1	Very high	8 Å²	8	26.1 Å²	26.1	4%	0.037	13%	0.132	C	C	.	.	H	α-helix	trans	-69.1	-32.1	-178.7	-61	157.1	0	0	0	112.3	P257 E259 L263 L264 K265 V304 E408	P257-H261 VanDerWaalsContact O-CG 3.26Å; P257-H261 PolarHBondContact O-N 2.76Å; P257-H261 PolarHBondContact O-ND1 3.34Å; E259-H261 VanDerWaalsContact C-N 3.35Å; E259-H261 PolarHBondContact O-N 3.12Å; H261-L263 PolarHBondContact O-N 2.85Å; H261-L264 PolarHBondContact O-N 3.44Å; H261-K265 WeakPolarHBondContact O-CG 3.48Å; H261-K265 PolarHBondContact O-N 3.34Å; H261-K265 VanDerWaalsContact O-N 3.08Å; H261-V304 HydrophobicContact CB-CB 4.18Å; H261-V304 HydrophobicContact CB-CG1 4.36Å; H261-E408 IonicContact CD2-OE1 2.71Å; H261-E408 IonicContact NE2-OE1 3.05Å; H261-E408 PolarHBondContact NE2-OE1 2.72Å
262	M	93.7	Very high	93.2	Very high	41 Å²	41	24.8 Å²	24.8	20%	0.202	12%	0.12	C	C	.	.	H	α-helix	trans	-57.8	-46.6	173.8	-179.6	65.9	69.3	0	0	111.5	K163 N166 S258 E259 K260 L264 K265 V266	K163-M262 HydrophobicContact CG-CE 4.34Å; K163-M262 HydrophobicContact CG-CG 4.36Å; K163-M262 HydrophobicContact CG-SD 4.28Å; N166-M262 HydrophobicContact CB-CE 4.38Å; N166-M262 HydrophobicContact CB-SD 3.46Å; N166-M262 WeakPolarHBondContact CB-SD 3.33Å; N166-M262 WeakPolarHBondContact ND2-CE 3.46Å; S258-M262 VanDerWaalsContact O-CB 3.3Å; S258-M262 WeakPolarHBondContact O-CB 3.48Å; S258-M262 PolarHBondContact O-N 3.25Å; E259-M262 WeakPolarHBondContact O-CB 3.43Å; E259-M262 PolarHBondContact O-N 3.25Å; K260-M262 VanDerWaalsContact C-N 3.34Å; M262-L264 VanDerWaalsContact C-N 3.27Å; M262-L264 PolarHBondContact O-N 3.43Å; M262-K265 PolarHBondContact O-N 3.38Å; M262-V266 HydrophobicContact CG-CG2 4.25Å; M262-V266 VanDerWaalsContact O-CG2 3.3Å; M262-V266 WeakPolarHBondContact O-CG2 3.22Å; M262-V266 PolarHBondContact O-N 3.24Å; M262-V266 HydrophobicContact SD-CG2 4.01Å
263	L	94.4	Very high	93.2	Very high	10 Å²	10	17.9 Å²	17.9	5%	0.052	9%	0.09	C	C	.	.	H	α-helix	trans	-56.1	-43.9	-179.7	-60.3	175.7	0	0	0	111.5	L159 C245 Y254 E259 K260 H261 V266 M267	L159-L263 HydrophobicContact CD2-CD2 3.95Å; C245-L263 HydrophobicContact CB-CB 4.34Å; C245-L263 HydrophobicContact CB-CD2 4.17Å; Y254-L263 HydrophobicContact CD1-CD1 3.9Å; E259-L263 WeakPolarHBondContact O-CG 3.11Å; E259-L263 PolarHBondContact O-N 3.3Å; K260-L263 PolarHBondContact O-N 3.23Å; H261-L263 PolarHBondContact O-N 2.85Å; L263-V266 PolarHBondContact O-N 2.79Å; L263-M267 HydrophobicContact CB-CE 4.21Å; L263-M267 VanDerWaalsContact O-CG 3.29Å; L263-M267 WeakPolarHBondContact O-CG 3.3Å; L263-M267 PolarHBondContact O-N 3.14Å
264	L	93.3	Very high	93.3	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-68.2	-41.4	179.6	-63.1	174.6	0	0	0	112.5	Y249 H261 M262 V266 M267 G268 F298 F299 L301 V304 L314	Y249-L264 HydrophobicContact CD2-CD2 3.99Å; Y249-L264 HydrophobicContact CD2-CG 4.18Å; Y249-L264 HydrophobicContact CE1-CD2 4.38Å; Y249-L264 HydrophobicContact CE2-CD1 3.9Å; Y249-L264 HydrophobicContact CE2-CD2 3.83Å; Y249-L264 HydrophobicContact CE2-CG 3.9Å; Y249-L264 HydrophobicContact CG-CD2 4.34Å; H261-L264 PolarHBondContact O-N 3.44Å; M262-L264 VanDerWaalsContact C-N 3.27Å; M262-L264 PolarHBondContact O-N 3.43Å; L264-V266 VanDerWaalsContact C-N 3.34Å; L264-V266 PolarHBondContact O-N 3.19Å; L264-M267 HydrophobicContact CD2-CE 4.26Å; L264-M267 HydrophobicContact CD2-SD 4.26Å; L264-M267 WeakPolarHBondContact O-CB 3.25Å; L264-M267 PolarHBondContact O-N 3.28Å; L264-G268 PolarHBondContact O-N 3.08Å; L264-F298 HydrophobicContact CD2-CB 4.03Å; L264-F299 HydrophobicContact CB-CE1 4.46Å; L264-F299 HydrophobicContact CD2-CD1 4.4Å; L264-F299 HydrophobicContact CD2-CE1 4.26Å; L264-L301 HydrophobicContact CD1-CD2 3.76Å; L264-V304 HydrophobicContact CD1-CG1 4.28Å; L264-L314 HydrophobicContact CB-CD1 3.79Å; L264-L314 HydrophobicContact CB-CD2 4.32Å; L264-L314 HydrophobicContact CD1-CD1 4.12Å; L264-L314 HydrophobicContact CG-CD1 4.45Å
265	K	93.1	Very high	93.2	Very high	17 Å²	17	14.7 Å²	14.7	7%	0.074	8%	0.077	C	C	.	.	H	α-helix	trans	-62.5	-41.8	175.9	-70.9	-177.3	-67.4	-164	0	111.8	N166 H261 M262 G268 F269 V304 P305 L306 I312 L314	N166-K265 WeakPolarHBondContact OD1-CB 3.37Å; N166-K265 WeakPolarHBondContact OD1-CD 3.41Å; N166-K265 WeakPolarHBondContact OD1-CE 3.44Å; H261-K265 WeakPolarHBondContact O-CG 3.48Å; H261-K265 PolarHBondContact O-N 3.34Å; H261-K265 VanDerWaalsContact O-N 3.08Å; M262-K265 PolarHBondContact O-N 3.38Å; K265-G268 PolarHBondContact O-N 3.37Å; K265-F269 PolarHBondContact O-N 3.08Å; K265-V304 HydrophobicContact CD-CG2 4.25Å; K265-V304 HydrophobicContact CG-CG2 3.88Å; K265-P305 PolarHBondContact NZ-O 3Å; K265-L306 HydrophobicContact CD-CD1 3.96Å; K265-I312 HydrophobicContact CD-CG2 4.12Å; K265-I312 HydrophobicContact CG-CG2 4.11Å; K265-L314 HydrophobicContact CG-CD2 4.44Å
266	V	94.9	Very high	93	Very high	2 Å²	2	14.8 Å²	14.8	1%	0.012	8%	0.078	C	C	.	.	H	α-helix	trans	-66.2	-39.4	176.6	176	0	0	0	0	111.5	G162 N166 I241 M262 L263 L264 G270	G162-V266 VanDerWaalsContact O-CG2 3.27Å; G162-V266 WeakPolarHBondContact O-CG2 3.44Å; N166-V266 HydrophobicContact CB-CG2 4.16Å; I241-V266 HydrophobicContact CG2-CG1 3.68Å; M262-V266 HydrophobicContact CG-CG2 4.25Å; M262-V266 VanDerWaalsContact O-CG2 3.3Å; M262-V266 WeakPolarHBondContact O-CG2 3.22Å; M262-V266 PolarHBondContact O-N 3.24Å; M262-V266 HydrophobicContact SD-CG2 4.01Å; L263-V266 PolarHBondContact O-N 2.79Å; L264-V266 VanDerWaalsContact C-N 3.34Å; L264-V266 PolarHBondContact O-N 3.19Å; V266-G270 VanDerWaalsContact O-CA 3.29Å; V266-G270 WeakPolarHBondContact O-CA 3.38Å; V266-G270 PolarHBondContact O-N 2.87Å
267	M	94.7	Very high	92.6	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-58.5	-48.7	172.6	-69.8	175.3	-146.5	0	0	111.3	C245 V246 Y249 L263 L264 L271 I295 F298 F299	C245-M267 HydrophobicContact CB-CE 3.89Å; C245-M267 HydrophobicContact CB-CG 3.99Å; C245-M267 WeakPolarHBondContact O-CE 3.44Å; V246-M267 HydrophobicContact CG2-CE 4.12Å; V246-M267 HydrophobicContact CG2-CG 4.21Å; V246-M267 HydrophobicContact CG2-SD 3.8Å; Y249-M267 HydrophobicContact CG-CE 4.34Å; L263-M267 HydrophobicContact CB-CE 4.21Å; L263-M267 VanDerWaalsContact O-CG 3.29Å; L263-M267 WeakPolarHBondContact O-CG 3.3Å; L263-M267 PolarHBondContact O-N 3.14Å; L264-M267 HydrophobicContact CD2-CE 4.26Å; L264-M267 HydrophobicContact CD2-SD 4.26Å; L264-M267 WeakPolarHBondContact O-CB 3.25Å; L264-M267 PolarHBondContact O-N 3.28Å; M267-L271 WeakPolarHBondContact O-CB 3.48Å; M267-L271 VanDerWaalsContact O-CG 3.29Å; M267-L271 WeakPolarHBondContact O-CG 3.24Å; M267-L271 PolarHBondContact O-N 2.79Å; M267-I295 HydrophobicContact CB-CG2 4.37Å; M267-I295 HydrophobicContact SD-CG1 4.28Å; M267-F298 HydrophobicContact CE-CD2 4.35Å; M267-F298 HydrophobicContact SD-CD2 4.16Å; M267-F299 HydrophobicContact CB-CE1 4.16Å; M267-F299 HydrophobicContact CB-CZ 3.99Å
268	G	92.5	Very high	92.3	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.1	-55.6	-174.8	0	0	0	0	0	111.8	L264 K265 G270 L271 Y272 Y317	L264-G268 PolarHBondContact O-N 3.08Å; K265-G268 PolarHBondContact O-N 3.37Å; G268-G270 VanDerWaalsContact C-N 3.32Å; G268-G270 PolarHBondContact O-N 3.47Å; G268-L271 PolarHBondContact O-N 3.38Å; G268-Y272 PolarHBondContact O-N 3.01Å; G268-Y317 WeakPolarHBondContact O-CB 3.34Å
269	F	94.1	Very high	92.3	Very high	5 Å²	5	22.7 Å²	22.7	2%	0.022	12%	0.118	C	C	.	.	H	α-helix	trans	-71.5	-29.1	-178.9	-165	-134.6	0	0	0	112.5	I165 F168 A169 T221 L224 K265 Y272 L273 Y317	I165-F269 HydrophobicContact CG2-CB 4.18Å; I165-F269 HydrophobicContact CG2-CD1 3.33Å; I165-F269 HydrophobicContact CG2-CE1 4.06Å; I165-F269 HydrophobicContact CG2-CG 4.1Å; I165-F269 VanDerWaalsContact O-CD1 3.23Å; I165-F269 WeakPolarHBondContact O-CD1 3.21Å; I165-F269 WeakPolarHBondContact O-CE1 3.37Å; F168-F269 HydrophobicContact CB-CE1 4.46Å; A169-F269 HydrophobicContact CB-CD1 3.71Å; A169-F269 HydrophobicContact CB-CE1 3.86Å; A169-F269 HydrophobicContact CB-CG 4.13Å; A169-F269 HydrophobicContact CB-CZ 4.34Å; T221-F269 HydrophobicContact CG2-CE2 3.82Å; T221-F269 HydrophobicContact CG2-CZ 3.79Å; L224-F269 HydrophobicContact CD2-CE1 4.46Å; K265-F269 PolarHBondContact O-N 3.08Å; F269-Y272 AromaticContact CD2-CD1 3.78Å; F269-Y272 HydrophobicContact CD2-CD1 3.78Å; F269-Y272 HydrophobicContact CD2-CG 4.29Å; F269-Y272 AromaticContact CE2-CD1 3.61Å; F269-Y272 HydrophobicContact CE2-CD1 3.61Å; F269-Y272 HydrophobicContact CE2-CE1 4.07Å; F269-Y272 WeakPolarHBondContact O-CB 3.22Å; F269-Y272 PolarHBondContact O-N 3.43Å; F269-L273 HydrophobicContact CD1-CD1 4.19Å; F269-L273 HydrophobicContact CE1-CD1 3.99Å; F269-L273 HydrophobicContact CE1-CG 4.4Å; F269-L273 HydrophobicContact CE2-CD2 4.34Å; F269-L273 HydrophobicContact CE2-CG 4.39Å; F269-L273 HydrophobicContact CZ-CD1 4.34Å; F269-L273 HydrophobicContact CZ-CD2 4.13Å; F269-L273 HydrophobicContact CZ-CG 4.3Å; F269-L273 WeakPolarHBondContact O-CG 3.29Å; F269-L273 PolarHBondContact O-N 3.39Å; F269-Y317 HydrophobicContact CB-CD1 4.35Å; F269-Y317 HydrophobicContact CB-CE1 3.99Å; F269-Y317 HydrophobicContact CB-CE2 4.41Å; F269-Y317 AromaticContact CD2-CD1 3.96Å; F269-Y317 HydrophobicContact CD2-CD1 3.96Å; F269-Y317 AromaticContact CD2-CE1 3.57Å; F269-Y317 HydrophobicContact CD2-CE1 3.57Å; F269-Y317 HydrophobicContact CE2-CE1 4.43Å; F269-Y317 HydrophobicContact CG-CE1 4.11Å
270	G	93.7	Very high	92.3	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.01	11%	0.111	C	C	.	.	H	α-helix	trans	-62.1	-46.3	171.5	0	0	0	0	0	112.4	V266 G268 Y272 L273 M274	V266-G270 VanDerWaalsContact O-CA 3.29Å; V266-G270 WeakPolarHBondContact O-CA 3.38Å; V266-G270 PolarHBondContact O-N 2.87Å; G268-G270 VanDerWaalsContact C-N 3.32Å; G268-G270 PolarHBondContact O-N 3.47Å; G270-Y272 VanDerWaalsContact C-N 3.33Å; G270-Y272 PolarHBondContact O-N 3.33Å; G270-L273 PolarHBondContact O-N 3.34Å; G270-M274 WeakPolarHBondContact O-CB 3.25Å; G270-M274 WeakPolarHBondContact O-CG 3.33Å; G270-M274 PolarHBondContact O-N 3.48Å
271	L	93.8	Very high	92.3	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-62.4	-40.9	173.8	-72.7	179.8	0	0	0	112	M267 G268 L273 M274 D275 I281 I290 L292 I295 I318 W331	M267-L271 WeakPolarHBondContact O-CB 3.48Å; M267-L271 VanDerWaalsContact O-CG 3.29Å; M267-L271 WeakPolarHBondContact O-CG 3.24Å; M267-L271 PolarHBondContact O-N 2.79Å; G268-L271 PolarHBondContact O-N 3.38Å; L271-L273 PolarHBondContact O-N 3.13Å; L271-M274 PolarHBondContact O-N 2.89Å; L271-D275 PolarHBondContact O-N 3.43Å; L271-D275 VanDerWaalsContact O-N 3.11Å; L271-I281 HydrophobicContact CD2-CG2 4.19Å; L271-I290 HydrophobicContact CD2-CD1 3.83Å; L271-L292 HydrophobicContact CD1-CD2 4Å; L271-L292 HydrophobicContact CD2-CD2 3.76Å; L271-I295 HydrophobicContact CD1-CD1 3.8Å; L271-I295 HydrophobicContact CD1-CG2 3.95Å; L271-I295 HydrophobicContact CD2-CD1 4.32Å; L271-I295 HydrophobicContact CG-CD1 4.29Å; L271-I318 HydrophobicContact CB-CD1 4.46Å; L271-I318 HydrophobicContact CD1-CD1 3.81Å; L271-W331 HydrophobicContact CD1-CH2 4.18Å
272	Y	93.7	Very high	92.3	Very high	58 Å²	58	20.9 Å²	20.9	23%	0.227	11%	0.11	C	C	.	.	H	α-helix	trans	-58.8	-46.5	176.1	178.1	-94.7	0	0	0	112.1	T221 G268 F269 G270 M274 D275 T320	T221-Y272 HydrophobicContact CG2-CE1 3.71Å; G268-Y272 PolarHBondContact O-N 3.01Å; F269-Y272 AromaticContact CD2-CD1 3.78Å; F269-Y272 HydrophobicContact CD2-CD1 3.78Å; F269-Y272 HydrophobicContact CD2-CG 4.29Å; F269-Y272 AromaticContact CE2-CD1 3.61Å; F269-Y272 HydrophobicContact CE2-CD1 3.61Å; F269-Y272 HydrophobicContact CE2-CE1 4.07Å; F269-Y272 WeakPolarHBondContact O-CB 3.22Å; F269-Y272 PolarHBondContact O-N 3.43Å; G270-Y272 VanDerWaalsContact C-N 3.33Å; G270-Y272 PolarHBondContact O-N 3.33Å; Y272-M274 VanDerWaalsContact C-N 3.31Å; Y272-M274 PolarHBondContact O-N 2.85Å; Y272-D275 PolarHBondContact O-N 3.13Å; Y272-T320 WeakPolarHBondContact CE2-O 3.33Å
273	L	92.6	Very high	92.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-70.3	-25.6	178	-67	174.9	0	0	0	113.6	I165 L224 L228 Y234 L238 F269 G270 L271	I165-L273 HydrophobicContact CG2-CD1 3.87Å; L224-L273 HydrophobicContact CD2-CD1 3.85Å; L224-L273 HydrophobicContact CD2-CD2 4.22Å; L228-L273 HydrophobicContact CD1-CD1 4.37Å; Y234-L273 WeakPolarHBondContact CE2-O 3.46Å; Y234-L273 PolarHBondContact OH-O 2.85Å; L238-L273 HydrophobicContact CD1-CB 3.97Å; F269-L273 HydrophobicContact CD1-CD1 4.19Å; F269-L273 HydrophobicContact CE1-CD1 3.99Å; F269-L273 HydrophobicContact CE1-CG 4.4Å; F269-L273 HydrophobicContact CE2-CD2 4.34Å; F269-L273 HydrophobicContact CE2-CG 4.39Å; F269-L273 HydrophobicContact CZ-CD1 4.34Å; F269-L273 HydrophobicContact CZ-CD2 4.13Å; F269-L273 HydrophobicContact CZ-CG 4.3Å; F269-L273 WeakPolarHBondContact O-CG 3.29Å; F269-L273 PolarHBondContact O-N 3.39Å; G270-L273 PolarHBondContact O-N 3.34Å; L271-L273 PolarHBondContact O-N 3.13Å
274	M	92.9	Very high	92	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-79.5	-19.9	176.8	-73.2	171.9	63.2	0	0	113.3	L238 A239 V242 G270 L271 Y272 S279 I281 L284 I290	L238-M274 HydrophobicContact CB-CG 3.53Å; L238-M274 HydrophobicContact CB-SD 3.7Å; L238-M274 HydrophobicContact CD1-CG 3.79Å; L238-M274 HydrophobicContact CG-CG 4.32Å; A239-M274 HydrophobicContact CB-CE 3.67Å; A239-M274 HydrophobicContact CB-SD 4.4Å; V242-M274 HydrophobicContact CG2-SD 4.25Å; G270-M274 WeakPolarHBondContact O-CB 3.25Å; G270-M274 WeakPolarHBondContact O-CG 3.33Å; G270-M274 PolarHBondContact O-N 3.48Å; L271-M274 PolarHBondContact O-N 2.89Å; Y272-M274 VanDerWaalsContact C-N 3.31Å; Y272-M274 PolarHBondContact O-N 2.85Å; M274-S279 CarbonylContact O-C 3.6Å; M274-S279 WeakPolarHBondContact O-CB 3.41Å; M274-S279 PolarHBondContact O-OG 3.48Å; M274-I281 HydrophobicContact CB-CG2 3.64Å; M274-L284 HydrophobicContact CE-CD1 3.43Å; M274-L284 VanDerWaalsContact CE-CD1 3.43Å; M274-I290 HydrophobicContact CE-CD1 4.26Å; M274-I290 HydrophobicContact CE-CG2 4.17Å
275	D	92.3	Very high	91.9	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.016	14%	0.135	C	C	.	.	S	Bend	trans	-100.6	83.1	-177.1	-158.3	43.9	0	0	0	111.1	L271 Y272 I281 S321 A322 H323	L271-D275 PolarHBondContact O-N 3.43Å; L271-D275 VanDerWaalsContact O-N 3.11Å; Y272-D275 PolarHBondContact O-N 3.13Å; D275-I281 HydrophobicContact CB-CD1 4.12Å; D275-I281 HydrophobicContact CB-CG1 4.1Å; D275-I281 HydrophobicContact CB-CG2 3.85Å; D275-I281 PolarHBondContact OD1-N 2.96Å; D275-S321 WeakPolarHBondContact OD2-CB 3.47Å; D275-S321 PolarHBondContact OD2-OG 3.06Å; D275-A322 WeakPolarHBondContact O-CB 3.42Å; D275-A322 PolarHBondContact OD2-N 3.12Å; D275-H323 VanDerWaalsContact CG-ND1 3.31Å; D275-H323 IonicContact OD1-CE1 3.16Å; D275-H323 IonicContact OD1-CG 3.4Å; D275-H323 IonicContact OD1-ND1 2.89Å; D275-H323 PolarHBondContact OD1-ND1 3.26Å; D275-H323 IonicContact OD2-CG 3.98Å; D275-H323 PolarHBondContact OD2-N 2.7Å; D275-H323 IonicContact OD2-ND1 2.77Å; D275-H323 PolarHBondContact OD2-ND1 2.95Å
276	G	88	Confident	91.8	Very high	4 Å²	4	29.9 Å²	29.9	4%	0.041	16%	0.164	C	C	.	.	S	Bend	trans	-133.6	-158.1	-172.8	0	0	0	0	0	113.1	V278 S279 H323	G276-V278 VanDerWaalsContact C-N 3.34Å; G276-S279 PolarHBondContact N-O 3.47Å; G276-H323 PolarHBondContact O-CE1 2.82Å
277	N	85.3	Confident	91.7	Very high	151 Å²	151	37.6 Å²	37.6	81%	0.807	20%	0.197	S	C	*	.	S	Bend	trans	-74.3	-28.7	-179.7	-64.8	-50.4	0	0	0	112.4	E229	E229-N277 PolarHBondContact OE1-N 3.3Å
278	V	87.4	Confident	91.5	Very high	95 Å²	95	46.6 Å²	46.6	58%	0.576	24%	0.236	S	C	*	.	S	Bend	trans	-94.1	-32.6	-174.7	-177.1	0	0	0	0	112.4	E229 G276	E229-V278 HydrophobicContact CB-CG2 4.11Å; E229-V278 HydrophobicContact CG-CG2 4.25Å; G276-V278 VanDerWaalsContact C-N 3.34Å
279	S	88.9	Confident	91.4	Very high	9 Å²	9	48.7 Å²	48.7	6%	0.063	24%	0.244	C	C	.	.			trans	-127.2	149.4	-174	168.4	0	0	0	0	111.1	E235 M274 G276	E235-S279 WeakPolarHBondContact CB-OG 3.31Å; M274-S279 CarbonylContact O-C 3.6Å; M274-S279 WeakPolarHBondContact O-CB 3.41Å; M274-S279 PolarHBondContact O-OG 3.48Å; G276-S279 PolarHBondContact N-O 3.47Å
280	N	92.3	Very high	91.3	Very high	22 Å²	22	48.7 Å²	48.7	12%	0.118	25%	0.245	C	C	.	.			trans	-136.2	121	-179.2	177.1	-66.7	0	0	0	109.7	Y282 K283 L284 H323	N280-Y282 VanDerWaalsContact C-N 3.32Å; N280-Y282 PolarHBondContact O-N 3.23Å; N280-Y282 WeakPolarHBondContact OD1-CB 3.42Å; N280-Y282 PolarHBondContact OD1-N 3.38Å; N280-K283 HydrophobicContact CB-CB 4.38Å; N280-K283 HydrophobicContact CB-CD 4.14Å; N280-K283 HydrophobicContact CB-CG 4.26Å; N280-K283 PolarHBondContact O-N 2.91Å; N280-K283 PolarHBondContact OD1-N 3.37Å; N280-L284 PolarHBondContact O-N 3.32Å; N280-H323 PolarHBondContact ND2-CD2 3.32Å; N280-H323 PolarHBondContact ND2-CE1 3.31Å; N280-H323 PolarHBondContact ND2-ND1 2.99Å; N280-H323 PolarHBondContact ND2-NE2 2.68Å
281	I	93.5	Very high	91.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-32.4	-173.1	59.8	177.1	0	0	0	112.8	L271 M274 D275 L284 D285 I290	L271-I281 HydrophobicContact CD2-CG2 4.19Å; M274-I281 HydrophobicContact CB-CG2 3.64Å; D275-I281 HydrophobicContact CB-CD1 4.12Å; D275-I281 HydrophobicContact CB-CG1 4.1Å; D275-I281 HydrophobicContact CB-CG2 3.85Å; D275-I281 PolarHBondContact OD1-N 2.96Å; I281-L284 WeakPolarHBondContact O-CB 3.49Å; I281-L284 PolarHBondContact O-N 2.94Å; I281-D285 WeakPolarHBondContact O-CB 3.41Å; I281-D285 PolarHBondContact O-N 3.01Å; I281-I290 HydrophobicContact CB-CD1 4.06Å; I281-I290 HydrophobicContact CG2-CD1 4.43Å
282	Y	92.7	Very high	91.2	Very high	20 Å²	20	52 Å²	52	8%	0.078	26%	0.262	C	S	.	.	H	α-helix	trans	-70.3	-34.4	179.6	-53.7	-82.1	0	0	0	111.9	N280 D285 A286 L292 H323 N327 R330 W331	N280-Y282 VanDerWaalsContact C-N 3.32Å; N280-Y282 PolarHBondContact O-N 3.23Å; N280-Y282 WeakPolarHBondContact OD1-CB 3.42Å; N280-Y282 PolarHBondContact OD1-N 3.38Å; Y282-D285 PolarHBondContact O-N 3.16Å; Y282-A286 WeakPolarHBondContact O-CB 3.35Å; Y282-A286 PolarHBondContact O-N 3.1Å; Y282-L292 HydrophobicContact CD1-CD1 3.9Å; Y282-L292 HydrophobicContact CE1-CD1 4.27Å; Y282-H323 HydrophobicContact CD2-CB 4.13Å; Y282-H323 HydrophobicContact CE2-CB 3.86Å; Y282-N327 HydrophobicContact CD1-CB 3.77Å; Y282-N327 HydrophobicContact CD2-CB 4.26Å; Y282-N327 HydrophobicContact CE1-CB 3.28Å; Y282-N327 HydrophobicContact CE2-CB 3.86Å; Y282-N327 HydrophobicContact CG-CB 4.21Å; Y282-R330 HydrophobicContact CE1-CB 4.5Å; Y282-W331 HydrophobicContact CE1-CZ2 4.5Å; Y282-W331 AromaticContact CE1-NE1 3.63Å; Y282-W331 AromaticContact CZ-NE1 3.81Å; Y282-W331 PolarHBondContact OH-NE1 3.04Å; Y282-W331 VanDerWaalsContact OH-NE1 3.15Å
283	K	91.7	Very high	91.1	Very high	142 Å²	142	53.4 Å²	53.4	62%	0.617	28%	0.28	S	S	*	.	H	α-helix	trans	-69.3	-35.3	171.6	-67.9	-179.7	-174.1	167.3	0	111.8	N280 A286 K287	N280-K283 HydrophobicContact CB-CB 4.38Å; N280-K283 HydrophobicContact CB-CD 4.14Å; N280-K283 HydrophobicContact CB-CG 4.26Å; N280-K283 PolarHBondContact O-N 2.91Å; N280-K283 PolarHBondContact OD1-N 3.37Å; K283-A286 PolarHBondContact O-N 2.98Å; K283-K287 WeakPolarHBondContact O-CG 3.32Å; K283-K287 PolarHBondContact O-N 3.32Å
284	L	90.6	Very high	91.1	Very high	11 Å²	11	56.7 Å²	56.7	6%	0.058	30%	0.295	C	S	.	.	H	α-helix	trans	-67.4	-40.5	174.4	-67.4	173.5	0	0	0	111.4	E235 M274 N280 I281 K287 K288 R289 I290	E235-L284 HydrophobicContact CG-CD1 4.4Å; M274-L284 HydrophobicContact CE-CD1 3.43Å; M274-L284 VanDerWaalsContact CE-CD1 3.43Å; N280-L284 PolarHBondContact O-N 3.32Å; I281-L284 WeakPolarHBondContact O-CB 3.49Å; I281-L284 PolarHBondContact O-N 2.94Å; L284-K287 CarbonylContact O-C 3.46Å; L284-K287 PolarHBondContact O-N 3.19Å; L284-K288 PolarHBondContact O-N 3.44Å; L284-R289 HydrophobicContact CB-CB 4.24Å; L284-R289 HydrophobicContact CD2-CB 4.38Å; L284-R289 HydrophobicContact CD2-CG 4.26Å; L284-R289 VanDerWaalsContact O-CB 3.31Å; L284-R289 WeakPolarHBondContact O-CB 3.31Å; L284-R289 PolarHBondContact O-N 3.06Å; L284-I290 HydrophobicContact CB-CD1 4.11Å; L284-I290 HydrophobicContact CB-CG1 4.07Å
285	D	92.1	Very high	91	Very high	22 Å²	22	56.7 Å²	56.7	12%	0.118	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-42.2	173.2	-173.9	70.8	0	0	0	112.1	I281 Y282 K287 K288 I290 L292 R330	I281-D285 WeakPolarHBondContact O-CB 3.41Å; I281-D285 PolarHBondContact O-N 3.01Å; Y282-D285 PolarHBondContact O-N 3.16Å; D285-K287 PolarHBondContact O-N 3.25Å; D285-K288 WeakPolarHBondContact O-CA 3.48Å; D285-K288 PolarHBondContact O-N 2.67Å; D285-I290 HydrophobicContact CB-CG1 4.31Å; D285-L292 HydrophobicContact CB-CD1 3.62Å; D285-L292 HydrophobicContact CB-CG 3.79Å; D285-L292 PolarHBondContact OD1-N 2.87Å; D285-R330 IonicContact OD2-CZ 3.75Å; D285-R330 IonicContact OD2-NH2 3.37Å; D285-R330 PolarHBondContact OD2-NH2 3.23Å
286	A	91	Very high	91	Very high	82 Å²	82	57.1 Å²	57.1	68%	0.678	30%	0.297	S	S	*	.	H	α-helix	trans	-60.9	-32.2	174.4	0	0	0	0	0	112.8	Y282 K283 K288	Y282-A286 WeakPolarHBondContact O-CB 3.35Å; Y282-A286 PolarHBondContact O-N 3.1Å; K283-A286 PolarHBondContact O-N 2.98Å; A286-K288 PolarHBondContact O-N 3.26Å
287	K	91.4	Very high	91	Very high	163 Å²	163	64 Å²	64	71%	0.709	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	1.7	172	-67.5	174.9	-175.8	177.3	0	113.4	K283 L284 D285 R289	K283-K287 WeakPolarHBondContact O-CG 3.32Å; K283-K287 PolarHBondContact O-N 3.32Å; L284-K287 CarbonylContact O-C 3.46Å; L284-K287 PolarHBondContact O-N 3.19Å; D285-K287 PolarHBondContact O-N 3.25Å; K287-R289 PolarHBondContact O-N 2.77Å
288	K	91	Very high	91.2	Very high	189 Å²	189	58.1 Å²	58.1	82%	0.822	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	28.8	-173.1	-55.7	-177.3	178	-177.7	0	113.2	L284 D285 A286	L284-K288 PolarHBondContact O-N 3.44Å; D285-K288 WeakPolarHBondContact O-CA 3.48Å; D285-K288 PolarHBondContact O-N 2.67Å; A286-K288 PolarHBondContact O-N 3.26Å
289	R	90.1	Very high	91.2	Very high	44 Å²	44	53.6 Å²	53.6	17%	0.166	27%	0.266	C	S	.	.	S	Bend	trans	-78.1	-33.7	-179.8	-179.5	55.6	178.5	94.2	-3.9	112.3	E236 A239 D240 N243 L284 K287	E236-R289 PolarHBondContact O-NH2 3.42Å; E236-R289 IonicContact OE2-CZ 2.7Å; E236-R289 IonicContact OE2-NE 3.34Å; E236-R289 PolarHBondContact OE2-NE 2.93Å; E236-R289 IonicContact OE2-NH2 3.68Å; E236-R289 PolarHBondContact OE2-NH2 3.12Å; A239-R289 HydrophobicContact CB-CG 4.21Å; A239-R289 VanDerWaalsContact CB-CZ 3.49Å; D240-R289 VanDerWaalsContact CG-NH2 3.32Å; D240-R289 IonicContact OD1-CZ 3.21Å; D240-R289 VanDerWaalsContact OD1-CZ 3.27Å; D240-R289 IonicContact OD1-NH1 3.46Å; D240-R289 PolarHBondContact OD1-NH1 3.34Å; D240-R289 VanDerWaalsContact OD1-NH1 3.12Å; D240-R289 IonicContact OD1-NH2 3.18Å; D240-R289 PolarHBondContact OD1-NH2 2.75Å; D240-R289 IonicContact OD2-NH2 3.76Å; N243-R289 PolarHBondContact ND2-NH1 2.9Å; N243-R289 PolarHBondContact ND2-O 3.25Å; L284-R289 HydrophobicContact CB-CB 4.24Å; L284-R289 HydrophobicContact CD2-CB 4.38Å; L284-R289 HydrophobicContact CD2-CG 4.26Å; L284-R289 VanDerWaalsContact O-CB 3.31Å; L284-R289 WeakPolarHBondContact O-CB 3.31Å; L284-R289 PolarHBondContact O-N 3.06Å; K287-R289 PolarHBondContact O-N 2.77Å
290	I	92.8	Very high	90.5	Very high	6 Å²	6	58.5 Å²	58.5	3%	0.031	29%	0.286	C	S	.	.	S	Bend	trans	-130.6	165.9	171.2	59.1	177.9	0	0	0	107.9	A239 L271 M274 I281 L284 D285 L292	A239-I290 HydrophobicContact CB-CG2 3.76Å; L271-I290 HydrophobicContact CD2-CD1 3.83Å; M274-I290 HydrophobicContact CE-CD1 4.26Å; M274-I290 HydrophobicContact CE-CG2 4.17Å; I281-I290 HydrophobicContact CB-CD1 4.06Å; I281-I290 HydrophobicContact CG2-CD1 4.43Å; L284-I290 HydrophobicContact CB-CD1 4.11Å; L284-I290 HydrophobicContact CB-CG1 4.07Å; D285-I290 HydrophobicContact CB-CG1 4.31Å; I290-L292 HydrophobicContact CD1-CD2 3.71Å; I290-L292 HydrophobicContact CD1-CG 4.26Å; I290-L292 HydrophobicContact CG1-CD2 4.34Å; I290-L292 HydrophobicContact CG1-CG 4.48Å
291	N	92.6	Very high	89.4	Confident	66 Å²	66	57.5 Å²	57.5	35%	0.353	28%	0.281	S	S	.	.			trans	-123.4	93.4	177.9	-172.3	-27.4	0	0	0	110.3	S293 K294	N291-S293 VanDerWaalsContact C-N 3.26Å; N291-S293 PolarHBondContact O-N 3.13Å; N291-S293 WeakPolarHBondContact OD1-CB 3.28Å; N291-S293 PolarHBondContact OD1-N 3.38Å; N291-K294 HydrophobicContact CB-CB 4.48Å; N291-K294 PolarHBondContact O-N 3.43Å; N291-K294 PolarHBondContact OD1-N 2.97Å; N291-K294 VanDerWaalsContact OD1-N 3.11Å
292	L	92.5	Very high	88.4	Confident	6 Å²	6	58 Å²	58	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-29.3	-178.3	-61.8	177.9	0	0	0	112	L271 Y282 D285 I290 K294 I295 D296 W331	L271-L292 HydrophobicContact CD1-CD2 4Å; L271-L292 HydrophobicContact CD2-CD2 3.76Å; Y282-L292 HydrophobicContact CD1-CD1 3.9Å; Y282-L292 HydrophobicContact CE1-CD1 4.27Å; D285-L292 HydrophobicContact CB-CD1 3.62Å; D285-L292 HydrophobicContact CB-CG 3.79Å; D285-L292 PolarHBondContact OD1-N 2.87Å; I290-L292 HydrophobicContact CD1-CD2 3.71Å; I290-L292 HydrophobicContact CD1-CG 4.26Å; I290-L292 HydrophobicContact CG1-CD2 4.34Å; I290-L292 HydrophobicContact CG1-CG 4.48Å; L292-K294 PolarHBondContact O-N 2.82Å; L292-I295 PolarHBondContact O-N 2.72Å; L292-D296 WeakPolarHBondContact O-CB 3.4Å; L292-D296 PolarHBondContact O-N 3.08Å; L292-W331 HydrophobicContact CB-CH2 4.09Å; L292-W331 HydrophobicContact CB-CZ2 4.38Å; L292-W331 HydrophobicContact CD1-CZ2 4.27Å; L292-W331 HydrophobicContact CD2-CH2 3.94Å; L292-W331 HydrophobicContact CD2-CZ2 4.18Å; L292-W331 HydrophobicContact CG-CH2 4.44Å
293	S	91.4	Very high	88.2	Confident	87 Å²	87	57 Å²	57	61%	0.608	28%	0.279	S	S	*	.	H	α-helix	trans	-65.8	-36.1	179.3	178.5	0	0	0	0	112.9	N291 K297	N291-S293 VanDerWaalsContact C-N 3.26Å; N291-S293 PolarHBondContact O-N 3.13Å; N291-S293 WeakPolarHBondContact OD1-CB 3.28Å; N291-S293 PolarHBondContact OD1-N 3.38Å; S293-K297 PolarHBondContact O-N 3.08Å
294	K	91.9	Very high	88	Confident	68 Å²	68	50.3 Å²	50.3	30%	0.296	25%	0.25	S	C	.	.	H	α-helix	trans	-66.4	-45.5	173.4	-77.8	-172.7	177.8	-170.6	0	111.2	V246 E250 N291 L292 K297 F298	V246-K294 HydrophobicContact CG1-CB 4.28Å; V246-K294 HydrophobicContact CG1-CD 3.96Å; E250-K294 WeakPolarHBondContact OE1-CE 3.14Å; E250-K294 IonicContact OE1-NZ 3.99Å; E250-K294 PolarHBondContact OE1-NZ 2.74Å; E250-K294 IonicContact OE2-NZ 3.72Å; E250-K294 PolarHBondContact OE2-NZ 3.24Å; N291-K294 HydrophobicContact CB-CB 4.48Å; N291-K294 PolarHBondContact O-N 3.43Å; N291-K294 PolarHBondContact OD1-N 2.97Å; N291-K294 VanDerWaalsContact OD1-N 3.11Å; L292-K294 PolarHBondContact O-N 2.82Å; K294-K297 WeakPolarHBondContact O-CB 3.47Å; K294-K297 PolarHBondContact O-N 2.67Å; K294-F298 HydrophobicContact CB-CE2 4.34Å; K294-F298 HydrophobicContact CB-CZ 4.44Å; K294-F298 WeakPolarHBondContact O-CD2 3.3Å; K294-F298 VanDerWaalsContact O-CG 3.25Å; K294-F298 WeakPolarHBondContact O-CG 3.45Å; K294-F298 PolarHBondContact O-N 3.39Å
295	I	92.4	Very high	88.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64	-44.4	-179.4	-59.3	172.6	0	0	0	110.4	V242 V246 M267 L271 L292 K297 F298 F299	V242-I295 HydrophobicContact CG1-CD1 3.73Å; V246-I295 HydrophobicContact CG2-CD1 4.01Å; V246-I295 HydrophobicContact CG2-CG1 3.67Å; M267-I295 HydrophobicContact CB-CG2 4.37Å; M267-I295 HydrophobicContact SD-CG1 4.28Å; L271-I295 HydrophobicContact CD1-CD1 3.8Å; L271-I295 HydrophobicContact CD1-CG2 3.95Å; L271-I295 HydrophobicContact CD2-CD1 4.32Å; L271-I295 HydrophobicContact CG-CD1 4.29Å; L292-I295 PolarHBondContact O-N 2.72Å; I295-K297 VanDerWaalsContact C-N 3.29Å; I295-K297 PolarHBondContact O-N 2.95Å; I295-F298 PolarHBondContact O-N 3.33Å; I295-F299 HydrophobicContact CG2-CD1 4.13Å; I295-F299 HydrophobicContact CG2-CD2 4.12Å; I295-F299 HydrophobicContact CG2-CE1 3.83Å; I295-F299 HydrophobicContact CG2-CE2 3.83Å; I295-F299 HydrophobicContact CG2-CG 4.26Å; I295-F299 HydrophobicContact CG2-CZ 3.68Å; I295-F299 WeakPolarHBondContact O-CB 3.41Å; I295-F299 WeakPolarHBondContact O-CG 3.32Å; I295-F299 PolarHBondContact O-N 3.43Å
296	D	90.4	Very high	88.1	Confident	12 Å²	12	50.7 Å²	50.7	6%	0.064	25%	0.253	C	S	.	.	H	α-helix	trans	-55.6	-43.5	173.9	-178.5	62.2	0	0	0	111.9	L292 F298 F299 K300 W331 T332 C333	L292-D296 WeakPolarHBondContact O-CB 3.4Å; L292-D296 PolarHBondContact O-N 3.08Å; D296-F298 PolarHBondContact O-N 3.19Å; D296-F299 PolarHBondContact O-N 3.05Å; D296-K300 PolarHBondContact O-N 3.44Å; D296-W331 HydrophobicContact CB-CE3 3.7Å; D296-W331 HydrophobicContact CB-CZ3 3.83Å; D296-W331 WeakPolarHBondContact OD1-CA 3.41Å; D296-T332 PolarHBondContact OD1-N 2.82Å; D296-T332 PolarHBondContact OD2-N 3.02Å; D296-T332 PolarHBondContact OD2-OG1 2.91Å; D296-C333 WeakPolarHBondContact OD1-CB 3.47Å; D296-C333 PolarHBondContact OD1-N 3.19Å; D296-C333 PolarHBondContact OD1-SG 3.43Å; D296-C333 VanDerWaalsContact OD1-SG 3.32Å
297	K	89	Confident	88.2	Confident	149 Å²	149	47.8 Å²	47.8	65%	0.648	23%	0.226	S	C	*	.	H	α-helix	trans	-64.3	-39.5	176	-173.8	-177.5	177.1	-174.7	0	112.1	S293 K294 I295 K300	S293-K297 PolarHBondContact O-N 3.08Å; K294-K297 WeakPolarHBondContact O-CB 3.47Å; K294-K297 PolarHBondContact O-N 2.67Å; I295-K297 VanDerWaalsContact C-N 3.29Å; I295-K297 PolarHBondContact O-N 2.95Å; K297-K300 WeakPolarHBondContact O-CB 3.35Å; K297-K300 PolarHBondContact O-N 3.05Å
298	F	89.3	Confident	88.2	Confident	28 Å²	28	40.4 Å²	40.4	12%	0.123	20%	0.196	C	C	.	.	H	α-helix	trans	-69.7	-37.5	178	-60.1	-23.4	0	0	0	111.8	V246 Y249 E250 L264 M267 K294 I295 D296 K300 L301	V246-F298 HydrophobicContact CG1-CE2 4.09Å; Y249-F298 HydrophobicContact CD1-CB 4.36Å; Y249-F298 AromaticContact CD1-CD1 3.76Å; Y249-F298 HydrophobicContact CD1-CD1 3.76Å; Y249-F298 AromaticContact CD1-CD2 3.64Å; Y249-F298 HydrophobicContact CD1-CD2 3.64Å; Y249-F298 AromaticContact CD1-CE1 3.86Å; Y249-F298 HydrophobicContact CD1-CE1 3.86Å; Y249-F298 AromaticContact CD1-CE2 3.72Å; Y249-F298 HydrophobicContact CD1-CE2 3.72Å; Y249-F298 AromaticContact CD1-CG 3.66Å; Y249-F298 HydrophobicContact CD1-CG 3.66Å; Y249-F298 AromaticContact CD1-CZ 3.85Å; Y249-F298 HydrophobicContact CD1-CZ 3.85Å; Y249-F298 HydrophobicContact CE1-CB 4.05Å; Y249-F298 AromaticContact CE1-CD1 3.63Å; Y249-F298 HydrophobicContact CE1-CD1 3.63Å; Y249-F298 HydrophobicContact CE1-CD2 4.17Å; Y249-F298 HydrophobicContact CE1-CE1 4.07Å; Y249-F298 AromaticContact CE1-CG 3.7Å; Y249-F298 HydrophobicContact CE1-CG 3.7Å; Y249-F298 HydrophobicContact CG-CD2 4.42Å; Y249-F298 HydrophobicContact CG-CE2 4.48Å; E250-F298 HydrophobicContact CB-CZ 4.09Å; L264-F298 HydrophobicContact CD2-CB 4.03Å; M267-F298 HydrophobicContact CE-CD2 4.35Å; M267-F298 HydrophobicContact SD-CD2 4.16Å; K294-F298 HydrophobicContact CB-CE2 4.34Å; K294-F298 HydrophobicContact CB-CZ 4.44Å; K294-F298 WeakPolarHBondContact O-CD2 3.3Å; K294-F298 VanDerWaalsContact O-CG 3.25Å; K294-F298 WeakPolarHBondContact O-CG 3.45Å; K294-F298 PolarHBondContact O-N 3.39Å; I295-F298 PolarHBondContact O-N 3.33Å; D296-F298 PolarHBondContact O-N 3.19Å; F298-K300 PolarHBondContact O-N 3.2Å; F298-L301 WeakPolarHBondContact O-CB 3.27Å; F298-L301 PolarHBondContact O-N 3.36Å
299	F	87.3	Confident	88.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-0.9	179	-73.7	9.9	0	0	0	114	L264 M267 I295 D296 L301 L314 I318 C333	L264-F299 HydrophobicContact CB-CE1 4.46Å; L264-F299 HydrophobicContact CD2-CD1 4.4Å; L264-F299 HydrophobicContact CD2-CE1 4.26Å; M267-F299 HydrophobicContact CB-CE1 4.16Å; M267-F299 HydrophobicContact CB-CZ 3.99Å; I295-F299 HydrophobicContact CG2-CD1 4.13Å; I295-F299 HydrophobicContact CG2-CD2 4.12Å; I295-F299 HydrophobicContact CG2-CE1 3.83Å; I295-F299 HydrophobicContact CG2-CE2 3.83Å; I295-F299 HydrophobicContact CG2-CG 4.26Å; I295-F299 HydrophobicContact CG2-CZ 3.68Å; I295-F299 WeakPolarHBondContact O-CB 3.41Å; I295-F299 WeakPolarHBondContact O-CG 3.32Å; I295-F299 PolarHBondContact O-N 3.43Å; D296-F299 PolarHBondContact O-N 3.05Å; F299-L301 CarbonylContact C-O 3.59Å; F299-L301 CarbonylContact O-C 3.03Å; F299-L301 VanDerWaalsContact O-C 3.26Å; F299-L301 PolarHBondContact O-N 2.68Å; F299-L301 VanDerWaalsContact O-O 3.12Å; F299-L314 HydrophobicContact CD1-CB 4.08Å; F299-L314 HydrophobicContact CD1-CD1 3.9Å; F299-L314 HydrophobicContact CD2-CB 3.96Å; F299-L314 HydrophobicContact CE1-CB 4.23Å; F299-L314 HydrophobicContact CE1-CD1 4.06Å; F299-L314 HydrophobicContact CE2-CB 4.1Å; F299-L314 HydrophobicContact CG-CB 3.95Å; F299-L314 HydrophobicContact CZ-CB 4.24Å; F299-I318 HydrophobicContact CD2-CG1 4.19Å; F299-I318 HydrophobicContact CE2-CD1 4.2Å; F299-I318 HydrophobicContact CE2-CG1 4.16Å; F299-C333 HydrophobicContact CB-CB 3.72Å
300	K	74.4	Confident	88.4	Confident	111 Å²	111	29.7 Å²	29.7	48%	0.483	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.4	159.7	-69.4	-170.4	174.8	-171.6	0	111.9	D296 K297 F298 Q302 T332	D296-K300 PolarHBondContact O-N 3.44Å; K297-K300 WeakPolarHBondContact O-CB 3.35Å; K297-K300 PolarHBondContact O-N 3.05Å; F298-K300 PolarHBondContact O-N 3.2Å; K300-Q302 PolarHBondContact O-N 3.01Å; K300-T332 WeakPolarHBondContact CE-OG1 3.24Å
301	L	69.3	Low	88.4	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.01	16%	0.155	C	C	.	.	S	Bend	trans	-74.8	100.4	154.2	-178.7	68.6	0	0	0	107.2	L264 F298 F299 V304 L314 Y342 E408	L264-L301 HydrophobicContact CD1-CD2 3.76Å; F298-L301 WeakPolarHBondContact O-CB 3.27Å; F298-L301 PolarHBondContact O-N 3.36Å; F299-L301 CarbonylContact C-O 3.59Å; F299-L301 CarbonylContact O-C 3.03Å; F299-L301 VanDerWaalsContact O-C 3.26Å; F299-L301 PolarHBondContact O-N 2.68Å; F299-L301 VanDerWaalsContact O-O 3.12Å; L301-V304 HydrophobicContact CD2-CG1 4.3Å; L301-L314 WeakPolarHBondContact O-CD1 3.38Å; L301-Y342 HydrophobicContact CD1-CE1 4.04Å; L301-E408 HydrophobicContact CD1-CB 4.44Å; L301-E408 HydrophobicContact CD1-CG 4.13Å; L301-E408 WeakPolarHBondContact CD2-OE1 3.21Å
302	Q	72.3	Confident	88.2	Confident	10 Å²	10	27.8 Å²	27.8	5%	0.047	14%	0.14	C	C	.	.			trans	-78.7	-34.8	-166.9	-68.9	173	-31.6	0	0	114.1	K300 E313 L314 Y342	K300-Q302 PolarHBondContact O-N 3.01Å; Q302-E313 CarbonylContact O-C 3.59Å; Q302-E313 WeakPolarHBondContact O-CA 3.27Å; Q302-L314 PolarHBondContact O-N 3.12Å; Q302-Y342 PolarHBondContact N-OH 2.96Å
303	V	87.6	Confident	88	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.1	-164.8	-165.8	0	0	0	0	111.1	Q311 E313 Y342 V415	V303-Q311 HydrophobicContact CG1-CB 3.91Å; V303-E313 HydrophobicContact CG2-CG 4.37Å; V303-Y342 PolarHBondContact N-OH 3.1Å; V303-V415 HydrophobicContact CB-CG2 4.26Å; V303-V415 HydrophobicContact CG1-CG1 3.99Å; V303-V415 HydrophobicContact CG1-CG2 3.76Å; V303-V415 HydrophobicContact CG2-CG2 3.52Å
304	V	89.1	Confident	87.9	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	157.6	174.5	-64.2	0	0	0	0	111.3	H261 L264 K265 L301 L306 I312 L314	H261-V304 HydrophobicContact CB-CB 4.18Å; H261-V304 HydrophobicContact CB-CG1 4.36Å; L264-V304 HydrophobicContact CD1-CG1 4.28Å; K265-V304 HydrophobicContact CD-CG2 4.25Å; K265-V304 HydrophobicContact CG-CG2 3.88Å; L301-V304 HydrophobicContact CD2-CG1 4.3Å; V304-L306 PolarHBondContact O-N 2.72Å; V304-I312 HydrophobicContact CG2-CG2 3.7Å; V304-I312 PolarHBondContact N-O 3.25Å; V304-I312 VanDerWaalsContact N-O 3.14Å; V304-I312 WeakPolarHBondContact O-CG2 3.38Å; V304-I312 PolarHBondContact O-N 2.99Å; V304-L314 HydrophobicContact CG1-CD1 4.33Å; V304-L314 HydrophobicContact CG2-CD1 4.34Å; V304-L314 HydrophobicContact CG2-CD2 3.91Å; V304-L314 HydrophobicContact CG2-CG 4.19Å
305	P	92.3	Very high	87.8	Confident	31 Å²	31	23.3 Å²	23.3	20%	0.201	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	126.8	172.7	-20.4	30.9	0	0	0	112.6	K265 S411	K265-P305 PolarHBondContact NZ-O 3Å; P305-S411 WeakPolarHBondContact CD-OG 3.46Å; P305-S411 WeakPolarHBondContact CG-OG 3.49Å
306	L	91.7	Very high	87.6	Confident	10 Å²	10	29.6 Å²	29.6	5%	0.052	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-59.9	169.8	-174.7	55.5	0	0	0	109.9	V170 E173 K265 V304 M310 I312	V170-L306 HydrophobicContact CG2-CD1 3.57Å; V170-L306 HydrophobicContact CG2-CG 4.11Å; E173-L306 HydrophobicContact CB-CD2 3.85Å; E173-L306 HydrophobicContact CG-CD2 3.86Å; K265-L306 HydrophobicContact CD-CD1 3.96Å; V304-L306 PolarHBondContact O-N 2.72Å; L306-M310 HydrophobicContact CB-CE 4.38Å; L306-M310 WeakPolarHBondContact CB-O 3.41Å; L306-M310 HydrophobicContact CD2-CE 3.69Å; L306-M310 HydrophobicContact CG-CE 4Å; L306-M310 PolarHBondContact N-O 2.86Å; L306-I312 HydrophobicContact CB-CB 4.02Å; L306-I312 HydrophobicContact CB-CG2 3.98Å; L306-I312 HydrophobicContact CD1-CG2 4.36Å; L306-I312 HydrophobicContact CD2-CB 4.26Å
307	F	93.4	Very high	87.6	Confident	21 Å²	21	29.7 Å²	29.7	9%	0.092	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	126.6	175.1	-165.7	-82.9	0	0	0	110.7	H77 A80 V81 Y84 V170 L174 M310 F680	H77-F307 AromaticContact CE1-CE2 3.86Å; A80-F307 HydrophobicContact CB-CD2 4.11Å; A80-F307 HydrophobicContact CB-CE2 3.61Å; A80-F307 HydrophobicContact CB-CZ 3.97Å; V81-F307 HydrophobicContact CG2-CZ 3.96Å; Y84-F307 VanDerWaalsContact CB-CE1 3.42Å; Y84-F307 HydrophobicContact CD1-CD1 4.26Å; Y84-F307 AromaticContact CD1-CE1 3.86Å; Y84-F307 HydrophobicContact CD1-CE1 3.86Å; Y84-F307 AromaticContact CD2-CD1 3.82Å; Y84-F307 HydrophobicContact CD2-CD1 3.82Å; Y84-F307 HydrophobicContact CD2-CE1 4.19Å; Y84-F307 AromaticContact CG-CD1 3.68Å; Y84-F307 HydrophobicContact CG-CD1 3.68Å; Y84-F307 AromaticContact CG-CE1 3.56Å; Y84-F307 HydrophobicContact CG-CE1 3.56Å; V170-F307 HydrophobicContact CG1-CB 4.03Å; V170-F307 HydrophobicContact CG1-CD2 3.8Å; V170-F307 HydrophobicContact CG1-CG 4.15Å; L174-F307 HydrophobicContact CD1-CB 4.41Å; L174-F307 HydrophobicContact CD1-CD1 4.08Å; L174-F307 HydrophobicContact CD1-CD2 4.5Å; L174-F307 HydrophobicContact CD1-CG 4.07Å; L174-F307 HydrophobicContact CD2-CB 4.4Å; L174-F307 HydrophobicContact CD2-CD1 4.19Å; F307-M310 HydrophobicContact CB-CE 4.35Å; F307-M310 PolarHBondContact N-O 2.68Å; F307-M310 VanDerWaalsContact N-O 3.13Å; F307-M310 VanDerWaalsContact O-CB 3.24Å; F307-M310 WeakPolarHBondContact O-CB 3.3Å; F307-M310 PolarHBondContact O-N 2.77Å; F307-F680 AromaticContact CE1-CE1 3.92Å; F307-F680 HydrophobicContact CE1-CE1 3.92Å; F307-F680 HydrophobicContact CZ-CE1 4.07Å
308	G	91.9	Very high	87.7	Confident	9 Å²	9	22.6 Å²	22.6	9%	0.093	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	-137.1	-176	0	0	0	0	0	112.5	M310	G308-M310 VanDerWaalsContact C-N 3.26Å; G308-M310 PolarHBondContact O-N 3.25Å
309	D	92.1	Very high	87.7	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-5.5	170.7	62.1	-45.4	0	0	0	114	Y84 Q311 L414 F621 R622 E623 F624 F625	Y84-D309 WeakPolarHBondContact CE2-OD1 3.16Å; Y84-D309 VanDerWaalsContact CZ-OD1 3.25Å; Y84-D309 PolarHBondContact OH-N 2.92Å; Y84-D309 PolarHBondContact OH-OD1 3.01Å; D309-Q311 PolarHBondContact O-N 2.68Å; D309-Q311 PolarHBondContact O-NE2 2.71Å; D309-L414 HydrophobicContact CB-CD1 4.42Å; D309-F621 WeakPolarHBondContact CB-O 3.21Å; D309-R622 WeakPolarHBondContact OD2-CA 3.47Å; D309-E623 PolarHBondContact OD1-N 3.05Å; D309-F624 WeakPolarHBondContact OD1-CB 3.46Å; D309-F624 PolarHBondContact OD1-N 3.28Å; D309-F624 WeakPolarHBondContact OD2-CB 3.39Å; D309-F624 PolarHBondContact OD2-N 3.2Å; D309-F624 VanDerWaalsContact OD2-N 3.1Å; D309-F625 HydrophobicContact CB-CD2 4.4Å; D309-F625 VanDerWaalsContact OD2-CD2 3.25Å; D309-F625 WeakPolarHBondContact OD2-CD2 3.5Å; D309-F625 PolarHBondContact OD2-N 3.16Å
310	M	92.5	Very high	87.7	Confident	8 Å²	8	28.6 Å²	28.6	4%	0.039	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	115.3	173.9	-168.8	177.7	62.6	0	0	109.9	E173 L174 M177 L306 F307 G308 F624	E173-M310 HydrophobicContact CB-CE 3.86Å; E173-M310 HydrophobicContact CB-SD 4.08Å; L174-M310 HydrophobicContact CD2-CE 3.53Å; L174-M310 HydrophobicContact CD2-SD 4.26Å; L174-M310 HydrophobicContact CG-CE 3.74Å; M177-M310 HydrophobicContact CE-SD 4.43Å; M177-M310 HydrophobicContact CG-SD 4.11Å; L306-M310 HydrophobicContact CB-CE 4.38Å; L306-M310 WeakPolarHBondContact CB-O 3.41Å; L306-M310 HydrophobicContact CD2-CE 3.69Å; L306-M310 HydrophobicContact CG-CE 4Å; L306-M310 PolarHBondContact N-O 2.86Å; F307-M310 HydrophobicContact CB-CE 4.35Å; F307-M310 PolarHBondContact N-O 2.68Å; F307-M310 VanDerWaalsContact N-O 3.13Å; F307-M310 VanDerWaalsContact O-CB 3.24Å; F307-M310 WeakPolarHBondContact O-CB 3.3Å; F307-M310 PolarHBondContact O-N 2.77Å; G308-M310 VanDerWaalsContact C-N 3.26Å; G308-M310 PolarHBondContact O-N 3.25Å; M310-F624 HydrophobicContact CB-CB 4.11Å; M310-F624 HydrophobicContact CB-CD2 4.14Å; M310-F624 HydrophobicContact CB-CG 4.07Å; M310-F624 HydrophobicContact CG-CD2 3.88Å; M310-F624 HydrophobicContact CG-CE2 4.1Å; M310-F624 HydrophobicContact CG-CG 4.25Å; M310-F624 HydrophobicContact SD-CD2 4.14Å; M310-F624 HydrophobicContact SD-CE2 4.39Å
311	Q	91.9	Very high	88.5	Confident	24 Å²	24	23.8 Å²	23.8	11%	0.112	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	159	-179.6	-48.3	-50.6	-47.5	0	0	110.7	V303 D309 S411 L414 V415	V303-Q311 HydrophobicContact CG1-CB 3.91Å; D309-Q311 PolarHBondContact O-N 2.68Å; D309-Q311 PolarHBondContact O-NE2 2.71Å; Q311-S411 VanDerWaalsContact OE1-CB 3.25Å; Q311-S411 PolarHBondContact OE1-OG 2.92Å; Q311-L414 HydrophobicContact CG-CB 3.99Å; Q311-L414 HydrophobicContact CG-CD1 3.99Å; Q311-V415 HydrophobicContact CB-CG1 3.53Å; Q311-V415 HydrophobicContact CG-CG1 4Å
312	I	89.1	Confident	89.5	Confident	8 Å²	8	27 Å²	27	4%	0.041	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.9	169.8	-174.7	62.7	0	0	0	110.3	K265 V304 L306 Y317	K265-I312 HydrophobicContact CD-CG2 4.12Å; K265-I312 HydrophobicContact CG-CG2 4.11Å; V304-I312 HydrophobicContact CG2-CG2 3.7Å; V304-I312 PolarHBondContact N-O 3.25Å; V304-I312 VanDerWaalsContact N-O 3.14Å; V304-I312 WeakPolarHBondContact O-CG2 3.38Å; V304-I312 PolarHBondContact O-N 2.99Å; L306-I312 HydrophobicContact CB-CB 4.02Å; L306-I312 HydrophobicContact CB-CG2 3.98Å; L306-I312 HydrophobicContact CD1-CG2 4.36Å; L306-I312 HydrophobicContact CD2-CB 4.26Å; I312-Y317 HydrophobicContact CD1-CE2 4.15Å; I312-Y317 HydrophobicContact CG1-CD2 4.49Å; I312-Y317 HydrophobicContact CG1-CE2 3.65Å
313	E	89.2	Confident	90.4	Very high	67 Å²	67	28.8 Å²	28.8	31%	0.313	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	117.9	168.2	-152.4	-169.3	155.2	0	0	108.5	Q302 V303 S315 R316	Q302-E313 CarbonylContact O-C 3.59Å; Q302-E313 WeakPolarHBondContact O-CA 3.27Å; V303-E313 HydrophobicContact CG2-CG 4.37Å; E313-S315 VanDerWaalsContact C-N 3.29Å; E313-S315 WeakPolarHBondContact CG-OG 3.18Å; E313-S315 PolarHBondContact O-N 3.44Å; E313-S315 PolarHBondContact OE1-OG 3.24Å; E313-R316 HydrophobicContact CB-CB 4.37Å; E313-R316 WeakPolarHBondContact O-CB 3.24Å; E313-R316 PolarHBondContact O-N 3.34Å; E313-R316 VanDerWaalsContact O-N 3.11Å
314	L	89.6	Confident	90.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68	-30.8	-172.9	-65.3	173.9	0	0	0	112.3	L264 K265 F299 L301 Q302 V304 R316 Y317	L264-L314 HydrophobicContact CB-CD1 3.79Å; L264-L314 HydrophobicContact CB-CD2 4.32Å; L264-L314 HydrophobicContact CD1-CD1 4.12Å; L264-L314 HydrophobicContact CG-CD1 4.45Å; K265-L314 HydrophobicContact CG-CD2 4.44Å; F299-L314 HydrophobicContact CD1-CB 4.08Å; F299-L314 HydrophobicContact CD1-CD1 3.9Å; F299-L314 HydrophobicContact CD2-CB 3.96Å; F299-L314 HydrophobicContact CE1-CB 4.23Å; F299-L314 HydrophobicContact CE1-CD1 4.06Å; F299-L314 HydrophobicContact CE2-CB 4.1Å; F299-L314 HydrophobicContact CG-CB 3.95Å; F299-L314 HydrophobicContact CZ-CB 4.24Å; L301-L314 WeakPolarHBondContact O-CD1 3.38Å; Q302-L314 PolarHBondContact O-N 3.12Å; V304-L314 HydrophobicContact CG1-CD1 4.33Å; V304-L314 HydrophobicContact CG2-CD1 4.34Å; V304-L314 HydrophobicContact CG2-CD2 3.91Å; V304-L314 HydrophobicContact CG2-CG 4.19Å; L314-R316 PolarHBondContact O-N 2.52Å; L314-Y317 PolarHBondContact O-N 3.4Å
315	S	88.1	Confident	90.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.1	-32.7	171.6	48.5	0	0	0	0	112.4	E313 Y317 I318 E319	E313-S315 VanDerWaalsContact C-N 3.29Å; E313-S315 WeakPolarHBondContact CG-OG 3.18Å; E313-S315 PolarHBondContact O-N 3.44Å; E313-S315 PolarHBondContact OE1-OG 3.24Å; S315-Y317 VanDerWaalsContact C-N 3.27Å; S315-Y317 PolarHBondContact O-N 2.84Å; S315-I318 WeakPolarHBondContact O-CA 3.41Å; S315-I318 WeakPolarHBondContact O-CB 3.34Å; S315-I318 PolarHBondContact O-N 3.06Å; S315-E319 WeakPolarHBondContact O-CG 3.29Å; S315-E319 PolarHBondContact O-N 3.13Å
316	R	89.4	Confident	90.6	Very high	131 Å²	131	42.2 Å²	42.2	49%	0.494	21%	0.211	S	C	.	.	H	α-helix	trans	-57.9	-37.6	-178.5	-173.5	-178.1	174.5	92.9	-3.5	112.5	E313 L314 I318 E319 T320	E313-R316 HydrophobicContact CB-CB 4.37Å; E313-R316 WeakPolarHBondContact O-CB 3.24Å; E313-R316 PolarHBondContact O-N 3.34Å; E313-R316 VanDerWaalsContact O-N 3.11Å; L314-R316 PolarHBondContact O-N 2.52Å; R316-I318 PolarHBondContact O-N 3.49Å; R316-E319 PolarHBondContact O-N 3.32Å; R316-T320 HydrophobicContact CG-CG2 4.33Å; R316-T320 WeakPolarHBondContact O-CB 3.32Å; R316-T320 WeakPolarHBondContact O-CG2 3.19Å; R316-T320 PolarHBondContact O-N 2.99Å; R316-T320 PolarHBondContact O-OG1 3.04Å
317	Y	90.4	Very high	90.5	Very high	14 Å²	14	43.6 Å²	43.6	6%	0.055	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-31.6	176.4	-70	-56.8	0	0	0	112.6	G268 F269 I312 L314 S315	G268-Y317 WeakPolarHBondContact O-CB 3.34Å; F269-Y317 HydrophobicContact CB-CD1 4.35Å; F269-Y317 HydrophobicContact CB-CE1 3.99Å; F269-Y317 HydrophobicContact CB-CE2 4.41Å; F269-Y317 AromaticContact CD2-CD1 3.96Å; F269-Y317 HydrophobicContact CD2-CD1 3.96Å; F269-Y317 AromaticContact CD2-CE1 3.57Å; F269-Y317 HydrophobicContact CD2-CE1 3.57Å; F269-Y317 HydrophobicContact CE2-CE1 4.43Å; F269-Y317 HydrophobicContact CG-CE1 4.11Å; I312-Y317 HydrophobicContact CD1-CE2 4.15Å; I312-Y317 HydrophobicContact CG1-CD2 4.49Å; I312-Y317 HydrophobicContact CG1-CE2 3.65Å; L314-Y317 PolarHBondContact O-N 3.4Å; S315-Y317 VanDerWaalsContact C-N 3.27Å; S315-Y317 PolarHBondContact O-N 2.84Å
318	I	90.6	Very high	90.1	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-78.1	-47.1	177.2	-54.1	-54	0	0	0	110	L271 F299 S315 R316 T320 S321 Y324 W331	L271-I318 HydrophobicContact CB-CD1 4.46Å; L271-I318 HydrophobicContact CD1-CD1 3.81Å; F299-I318 HydrophobicContact CD2-CG1 4.19Å; F299-I318 HydrophobicContact CE2-CD1 4.2Å; F299-I318 HydrophobicContact CE2-CG1 4.16Å; S315-I318 WeakPolarHBondContact O-CA 3.41Å; S315-I318 WeakPolarHBondContact O-CB 3.34Å; S315-I318 PolarHBondContact O-N 3.06Å; R316-I318 PolarHBondContact O-N 3.49Å; I318-T320 PolarHBondContact O-N 3.45Å; I318-S321 WeakPolarHBondContact O-CB 3.45Å; I318-S321 PolarHBondContact O-N 3.34Å; I318-S321 VanDerWaalsContact O-N 3.14Å; I318-S321 PolarHBondContact O-OG 3.35Å; I318-Y324 HydrophobicContact CG2-CD2 3.81Å; I318-Y324 HydrophobicContact CG2-CE2 4.01Å; I318-Y324 VanDerWaalsContact O-CB 3.28Å; I318-Y324 WeakPolarHBondContact O-CB 3.31Å; I318-Y324 WeakPolarHBondContact O-CD2 3.34Å; I318-W331 HydrophobicContact CD1-CH2 3.71Å; I318-W331 HydrophobicContact CD1-CZ2 4Å; I318-W331 HydrophobicContact CD1-CZ3 4.13Å; I318-W331 HydrophobicContact CG1-CE3 4.46Å; I318-W331 HydrophobicContact CG1-CH2 4.26Å; I318-W331 HydrophobicContact CG1-CZ3 4.23Å; I318-W331 HydrophobicContact CG2-CD2 3.55Å; I318-W331 HydrophobicContact CG2-CE3 4.09Å; I318-W331 HydrophobicContact CG2-CG 3.84Å; I318-W331 HydrophobicContact CG2-CH2 4.3Å; I318-W331 HydrophobicContact CG2-CZ2 3.78Å; I318-W331 HydrophobicContact CG2-CZ3 4.44Å
319	E	89.2	Confident	89.9	Confident	82 Å²	82	52.2 Å²	52.2	38%	0.383	27%	0.268	S	S	.	.	H	α-helix	trans	-62.9	-30.5	-178.5	-69.3	176.7	-175.2	0	0	113.3	S315 R316 Y324 T334	S315-E319 WeakPolarHBondContact O-CG 3.29Å; S315-E319 PolarHBondContact O-N 3.13Å; R316-E319 PolarHBondContact O-N 3.32Å; E319-Y324 HydrophobicContact CB-CE1 4.3Å; E319-Y324 HydrophobicContact CG-CE1 4.14Å; E319-Y324 WeakPolarHBondContact O-CD1 3.48Å; E319-T334 HydrophobicContact CG-CG2 3.83Å
320	T	88.4	Confident	89.5	Confident	72 Å²	72	59 Å²	59	44%	0.442	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	2.4	179.6	58.4	0	0	0	0	113.8	Y272 R316 I318	Y272-T320 WeakPolarHBondContact CE2-O 3.33Å; R316-T320 HydrophobicContact CG-CG2 4.33Å; R316-T320 WeakPolarHBondContact O-CB 3.32Å; R316-T320 WeakPolarHBondContact O-CG2 3.19Å; R316-T320 PolarHBondContact O-N 2.99Å; R316-T320 PolarHBondContact O-OG1 3.04Å; I318-T320 PolarHBondContact O-N 3.45Å
321	S	89.9	Confident	89.3	Confident	10 Å²	10	58.8 Å²	58.8	7%	0.07	29%	0.293	C	S	.	.	S	Bend	trans	-71	151.5	178.3	99.4	0	0	0	0	111.6	D275 I318 H323 Y324	D275-S321 WeakPolarHBondContact OD2-CB 3.47Å; D275-S321 PolarHBondContact OD2-OG 3.06Å; I318-S321 WeakPolarHBondContact O-CB 3.45Å; I318-S321 PolarHBondContact O-N 3.34Å; I318-S321 VanDerWaalsContact O-N 3.14Å; I318-S321 PolarHBondContact O-OG 3.35Å; S321-H323 VanDerWaalsContact C-N 3.26Å; S321-H323 PolarHBondContact O-N 3.4Å; S321-H323 VanDerWaalsContact O-N 3.17Å; S321-Y324 PolarHBondContact O-N 3.1Å
322	A	89.8	Confident	89	Confident	69 Å²	69	60.6 Å²	60.6	57%	0.57	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-33.5	-170.7	0	0	0	0	0	114	D275	D275-A322 WeakPolarHBondContact O-CB 3.42Å; D275-A322 PolarHBondContact OD2-N 3.12Å
323	H	92.9	Very high	88.6	Confident	48 Å²	48	60.3 Å²	60.3	22%	0.222	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	18.4	-174.8	-51.9	99.9	0	0	0	114.1	D275 G276 N280 Y282 S321 N327	D275-H323 VanDerWaalsContact CG-ND1 3.31Å; D275-H323 IonicContact OD1-CE1 3.16Å; D275-H323 IonicContact OD1-CG 3.4Å; D275-H323 IonicContact OD1-ND1 2.89Å; D275-H323 PolarHBondContact OD1-ND1 3.26Å; D275-H323 IonicContact OD2-CG 3.98Å; D275-H323 PolarHBondContact OD2-N 2.7Å; D275-H323 IonicContact OD2-ND1 2.77Å; D275-H323 PolarHBondContact OD2-ND1 2.95Å; G276-H323 PolarHBondContact O-CE1 2.82Å; N280-H323 PolarHBondContact ND2-CD2 3.32Å; N280-H323 PolarHBondContact ND2-CE1 3.31Å; N280-H323 PolarHBondContact ND2-ND1 2.99Å; N280-H323 PolarHBondContact ND2-NE2 2.68Å; Y282-H323 HydrophobicContact CD2-CB 4.13Å; Y282-H323 HydrophobicContact CE2-CB 3.86Å; S321-H323 VanDerWaalsContact C-N 3.26Å; S321-H323 PolarHBondContact O-N 3.4Å; S321-H323 VanDerWaalsContact O-N 3.17Å; H323-N327 PolarHBondContact O-ND2 3.05Å
324	Y	91.8	Very high	88.2	Confident	20 Å²	20	58.5 Å²	58.5	8%	0.078	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-47.5	-176.8	172.7	-109.3	0	0	0	113.9	I318 E319 S321 E326 N327 K328 W331 T334	I318-Y324 HydrophobicContact CG2-CD2 3.81Å; I318-Y324 HydrophobicContact CG2-CE2 4.01Å; I318-Y324 VanDerWaalsContact O-CB 3.28Å; I318-Y324 WeakPolarHBondContact O-CB 3.31Å; I318-Y324 WeakPolarHBondContact O-CD2 3.34Å; E319-Y324 HydrophobicContact CB-CE1 4.3Å; E319-Y324 HydrophobicContact CG-CE1 4.14Å; E319-Y324 WeakPolarHBondContact O-CD1 3.48Å; S321-Y324 PolarHBondContact O-N 3.1Å; Y324-E326 VanDerWaalsContact C-N 3.25Å; Y324-E326 PolarHBondContact O-N 3.49Å; Y324-N327 CarbonylContact O-C 3.51Å; Y324-N327 WeakPolarHBondContact O-CA 3.47Å; Y324-N327 PolarHBondContact O-N 3.33Å; Y324-K328 HydrophobicContact CD1-CG 4.26Å; Y324-K328 HydrophobicContact CE1-CD 4.24Å; Y324-K328 HydrophobicContact CE1-CG 3.77Å; Y324-K328 HydrophobicContact CE2-CG 4.24Å; Y324-K328 PolarHBondContact O-N 3.37Å; Y324-W331 AromaticContact CE2-CD1 3.86Å; Y324-W331 HydrophobicContact CE2-CG 4.43Å; Y324-T334 HydrophobicContact CE2-CG2 4.11Å; Y324-T334 PolarHBondContact OH-OG1 3.29Å
325	E	89.6	Confident	87.4	Confident	132 Å²	132	64.8 Å²	64.8	62%	0.617	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-54.6	-39.7	-174	-78.2	-65.1	149.1	0	0	113.1	N327 K328	E325-N327 VanDerWaalsContact C-N 3.26Å; E325-N327 PolarHBondContact O-N 3.21Å; E325-K328 WeakPolarHBondContact OE1-CE 3.39Å; E325-K328 IonicContact OE1-NZ 3.77Å; E325-K328 PolarHBondContact OE1-NZ 3.3Å; E325-K328 WeakPolarHBondContact OE2-CE 3.5Å; E325-K328 IonicContact OE2-NZ 2.83Å; E325-K328 PolarHBondContact OE2-NZ 3.2Å
326	E	90.3	Very high	85.9	Confident	160 Å²	160	70.3 Å²	70.3	75%	0.748	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-73.1	-19	178.7	-61	176.8	177.2	0	0	112.9	Y324	Y324-E326 VanDerWaalsContact C-N 3.25Å; Y324-E326 PolarHBondContact O-N 3.49Å
327	N	89.6	Confident	84.4	Confident	39 Å²	39	68.2 Å²	68.2	21%	0.209	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-125.3	20.3	-168.5	-64.8	-79.4	0	0	0	113.5	Y282 H323 Y324 E325 S329 R330	Y282-N327 HydrophobicContact CD1-CB 3.77Å; Y282-N327 HydrophobicContact CD2-CB 4.26Å; Y282-N327 HydrophobicContact CE1-CB 3.28Å; Y282-N327 HydrophobicContact CE2-CB 3.86Å; Y282-N327 HydrophobicContact CG-CB 4.21Å; H323-N327 PolarHBondContact O-ND2 3.05Å; Y324-N327 CarbonylContact O-C 3.51Å; Y324-N327 WeakPolarHBondContact O-CA 3.47Å; Y324-N327 PolarHBondContact O-N 3.33Å; E325-N327 VanDerWaalsContact C-N 3.26Å; E325-N327 PolarHBondContact O-N 3.21Å; N327-S329 PolarHBondContact O-N 3.18Å; N327-S329 VanDerWaalsContact O-N 3.11Å; N327-R330 HydrophobicContact CB-CG 4.44Å; N327-R330 WeakPolarHBondContact O-CB 3.5Å; N327-R330 PolarHBondContact O-N 3.49Å
328	K	86.8	Confident	82.9	Confident	91 Å²	91	74.2 Å²	74.2	40%	0.396	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-50.5	-36.6	179.9	-78	179.9	162.4	168.5	0	114.2	Y324 E325 R330 W331	Y324-K328 HydrophobicContact CD1-CG 4.26Å; Y324-K328 HydrophobicContact CE1-CD 4.24Å; Y324-K328 HydrophobicContact CE1-CG 3.77Å; Y324-K328 HydrophobicContact CE2-CG 4.24Å; Y324-K328 PolarHBondContact O-N 3.37Å; E325-K328 WeakPolarHBondContact OE1-CE 3.39Å; E325-K328 IonicContact OE1-NZ 3.77Å; E325-K328 PolarHBondContact OE1-NZ 3.3Å; E325-K328 WeakPolarHBondContact OE2-CE 3.5Å; E325-K328 IonicContact OE2-NZ 2.83Å; E325-K328 PolarHBondContact OE2-NZ 3.2Å; K328-R330 PolarHBondContact O-N 3.28Å; K328-R330 VanDerWaalsContact O-N 3.13Å; K328-W331 PolarHBondContact O-N 2.73Å
329	S	86.8	Confident	81.3	Confident	120 Å²	120	75.1 Å²	75.1	84%	0.839	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-66.3	-12.2	-178.3	58.8	0	0	0	0	114.6	N327	N327-S329 PolarHBondContact O-N 3.18Å; N327-S329 VanDerWaalsContact O-N 3.11Å
330	R	84.4	Confident	79.8	Confident	142 Å²	142	75.7 Å²	75.7	54%	0.536	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-82.3	-14	179.1	-62.1	-72.1	-77.8	-169.9	-5.1	113.5	Y282 D285 N327 K328	Y282-R330 HydrophobicContact CE1-CB 4.5Å; D285-R330 IonicContact OD2-CZ 3.75Å; D285-R330 IonicContact OD2-NH2 3.37Å; D285-R330 PolarHBondContact OD2-NH2 3.23Å; N327-R330 HydrophobicContact CB-CG 4.44Å; N327-R330 WeakPolarHBondContact O-CB 3.5Å; N327-R330 PolarHBondContact O-N 3.49Å; K328-R330 PolarHBondContact O-N 3.28Å; K328-R330 VanDerWaalsContact O-N 3.13Å
331	W	87.4	Confident	78.6	Confident	4 Å²	4	75 Å²	75	2%	0.015	41%	0.412	C	S	.	.			trans	-115.4	129.6	-170.6	-61.1	105	0	0	0	111.4	L271 Y282 L292 D296 I318 Y324 K328 T334	L271-W331 HydrophobicContact CD1-CH2 4.18Å; Y282-W331 HydrophobicContact CE1-CZ2 4.5Å; Y282-W331 AromaticContact CE1-NE1 3.63Å; Y282-W331 AromaticContact CZ-NE1 3.81Å; Y282-W331 PolarHBondContact OH-NE1 3.04Å; Y282-W331 VanDerWaalsContact OH-NE1 3.15Å; L292-W331 HydrophobicContact CB-CH2 4.09Å; L292-W331 HydrophobicContact CB-CZ2 4.38Å; L292-W331 HydrophobicContact CD1-CZ2 4.27Å; L292-W331 HydrophobicContact CD2-CH2 3.94Å; L292-W331 HydrophobicContact CD2-CZ2 4.18Å; L292-W331 HydrophobicContact CG-CH2 4.44Å; D296-W331 HydrophobicContact CB-CE3 3.7Å; D296-W331 HydrophobicContact CB-CZ3 3.83Å; D296-W331 WeakPolarHBondContact OD1-CA 3.41Å; I318-W331 HydrophobicContact CD1-CH2 3.71Å; I318-W331 HydrophobicContact CD1-CZ2 4Å; I318-W331 HydrophobicContact CD1-CZ3 4.13Å; I318-W331 HydrophobicContact CG1-CE3 4.46Å; I318-W331 HydrophobicContact CG1-CH2 4.26Å; I318-W331 HydrophobicContact CG1-CZ3 4.23Å; I318-W331 HydrophobicContact CG2-CD2 3.55Å; I318-W331 HydrophobicContact CG2-CE3 4.09Å; I318-W331 HydrophobicContact CG2-CG 3.84Å; I318-W331 HydrophobicContact CG2-CH2 4.3Å; I318-W331 HydrophobicContact CG2-CZ2 3.78Å; I318-W331 HydrophobicContact CG2-CZ3 4.44Å; Y324-W331 AromaticContact CE2-CD1 3.86Å; Y324-W331 HydrophobicContact CE2-CG 4.43Å; K328-W331 PolarHBondContact O-N 2.73Å; W331-T334 HydrophobicContact CB-CG2 4.27Å
332	T	85.9	Confident	77.6	Confident	62 Å²	62	75 Å²	75	38%	0.38	41%	0.41	S	S	.	.	S	Bend	trans	-105.3	-22.2	172.3	67.6	0	0	0	0	112	D296 K300 T334 Q335	D296-T332 PolarHBondContact OD1-N 2.82Å; D296-T332 PolarHBondContact OD2-N 3.02Å; D296-T332 PolarHBondContact OD2-OG1 2.91Å; K300-T332 WeakPolarHBondContact CE-OG1 3.24Å; T332-T334 PolarHBondContact O-N 3.24Å; T332-Q335 PolarHBondContact O-N 3.1Å; T332-Q335 VanDerWaalsContact O-N 3.14Å
333	C	81.3	Confident	76.9	Confident	3 Å²	3	74.5 Å²	74.5	2%	0.02	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-22.4	178.8	67.7	0	0	0	0	113.9	D296 F299 Q335	D296-C333 WeakPolarHBondContact OD1-CB 3.47Å; D296-C333 PolarHBondContact OD1-N 3.19Å; D296-C333 PolarHBondContact OD1-SG 3.43Å; D296-C333 VanDerWaalsContact OD1-SG 3.32Å; F299-C333 HydrophobicContact CB-CB 3.72Å; C333-Q335 VanDerWaalsContact C-N 3.26Å; C333-Q335 PolarHBondContact O-N 3.15Å
334	T	79.7	Confident	76.1	Confident	29 Å²	29	72.4 Å²	72.4	18%	0.178	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-1.6	176.7	62.2	0	0	0	0	113.1	E319 Y324 W331 T332	E319-T334 HydrophobicContact CG-CG2 3.83Å; Y324-T334 HydrophobicContact CE2-CG2 4.11Å; Y324-T334 PolarHBondContact OH-OG1 3.29Å; W331-T334 HydrophobicContact CB-CG2 4.27Å; T332-T334 PolarHBondContact O-N 3.24Å
335	Q	73	Confident	75.5	Confident	131 Å²	131	74 Å²	74	61%	0.612	40%	0.402	S	S	*	.	S	Bend	trans	-93.9	116.4	172.9	-62.4	-177.9	3.2	0	0	109	T332 C333 S337	T332-Q335 PolarHBondContact O-N 3.1Å; T332-Q335 VanDerWaalsContact O-N 3.14Å; C333-Q335 VanDerWaalsContact C-N 3.26Å; C333-Q335 PolarHBondContact O-N 3.15Å; Q335-S337 VanDerWaalsContact C-N 3.33Å; Q335-S337 PolarHBondContact O-N 3.35Å
336	S	57.9	Low	75.1	Confident	117 Å²	117	74 Å²	74	82%	0.818	40%	0.402	S	S	*	.			trans	-71.7	83.9	-179.3	22	0	0	0	0	111.4
337	S	57.3	Low	74.7	Confident	87 Å²	87	68.2 Å²	68.2	61%	0.608	38%	0.375	S	S	*	.			trans	-108.4	135.2	163.7	54.8	0	0	0	0	109.2	Q335 S339	Q335-S337 VanDerWaalsContact C-N 3.33Å; Q335-S337 PolarHBondContact O-N 3.35Å; S337-S339 PolarHBondContact O-N 3.01Å
338	I	57.7	Low	74.7	Confident	140 Å²	140	66.7 Å²	66.7	72%	0.718	37%	0.367	S	S	*	.			trans	-65.7	109.7	179	-60.9	168.6	0	0	0	107.5
339	S	58.8	Low	74.8	Confident	20 Å²	20	66.7 Å²	66.7	14%	0.14	37%	0.374	C	S	.	.			trans	-67.5	136.5	177.4	179.4	0	0	0	0	110.1	S337 Q341 Y342	S337-S339 PolarHBondContact O-N 3.01Å; S339-Q341 PolarHBondContact O-N 3.19Å; S339-Q341 WeakPolarHBondContact OG-CB 3.41Å; S339-Q341 PolarHBondContact OG-N 2.68Å; S339-Y342 PolarHBondContact O-N 3.14Å; S339-Y342 VanDerWaalsContact O-N 3.1Å
340	P	56.6	Low	75	Confident	93 Å²	93	65.8 Å²	65.8	60%	0.604	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-60.5	-16.5	173.2	26.1	-34.1	0	0	0	112.3	Y342 N343	P340-Y342 PolarHBondContact O-N 2.74Å; P340-N343 PolarHBondContact O-N 3.23Å; P340-N343 VanDerWaalsContact O-N 3.16Å
341	Q	62.6	Low	75.4	Confident	58 Å²	58	59.1 Å²	59.1	27%	0.271	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-64.3	-22	175.7	-168.9	168.9	-11.4	0	0	113.5	S339 Q347 E408	S339-Q341 PolarHBondContact O-N 3.19Å; S339-Q341 WeakPolarHBondContact OG-CB 3.41Å; S339-Q341 PolarHBondContact OG-N 2.68Å; Q341-Q347 PolarHBondContact O-NE2 3.04Å; Q341-E408 PolarHBondContact NE2-OE2 3.29Å
342	Y	69.3	Low	75.7	Confident	10 Å²	10	64 Å²	64	4%	0.039	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-92.2	-4.9	176.9	-58.2	-63.8	0	0	0	113.6	L301 Q302 V303 S339 P340 L344 W412	L301-Y342 HydrophobicContact CD1-CE1 4.04Å; Q302-Y342 PolarHBondContact N-OH 2.96Å; V303-Y342 PolarHBondContact N-OH 3.1Å; S339-Y342 PolarHBondContact O-N 3.14Å; S339-Y342 VanDerWaalsContact O-N 3.1Å; P340-Y342 PolarHBondContact O-N 2.74Å; Y342-L344 PolarHBondContact O-N 3.39Å; Y342-W412 HydrophobicContact CD1-CB 3.73Å; Y342-W412 AromaticContact CD1-CG 3.82Å; Y342-W412 HydrophobicContact CD1-CG 3.82Å; Y342-W412 AromaticContact CD2-CD1 3.8Å; Y342-W412 HydrophobicContact CD2-CD2 4.34Å; Y342-W412 HydrophobicContact CD2-CG 4.09Å; Y342-W412 AromaticContact CD2-NE1 3.84Å; Y342-W412 HydrophobicContact CE1-CB 3.6Å; Y342-W412 AromaticContact CE1-CD1 3.72Å; Y342-W412 AromaticContact CE1-CG 3.77Å; Y342-W412 HydrophobicContact CE1-CG 3.77Å; Y342-W412 AromaticContact CE2-CD1 3.36Å; Y342-W412 HydrophobicContact CE2-CG 4.02Å; Y342-W412 AromaticContact CE2-NE1 3.59Å; Y342-W412 HydrophobicContact CG-CB 4.36Å; Y342-W412 HydrophobicContact CG-CD2 4.26Å; Y342-W412 AromaticContact CG-CG 3.98Å; Y342-W412 HydrophobicContact CG-CG 3.98Å; Y342-W412 AromaticContact CZ-CD1 3.3Å; Y342-W412 AromaticContact CZ-CG 3.84Å
343	N	75.6	Confident	76.1	Confident	59 Å²	59	65 Å²	65	32%	0.316	35%	0.353	S	S	.	.			trans	-85.4	92.6	173.7	-171.3	-18.8	0	0	0	109.6	P340 C345 E346	P340-N343 PolarHBondContact O-N 3.23Å; P340-N343 VanDerWaalsContact O-N 3.16Å; N343-C345 VanDerWaalsContact C-N 3.26Å; N343-C345 PolarHBondContact O-N 3.01Å; N343-C345 WeakPolarHBondContact OD1-CB 3.39Å; N343-C345 PolarHBondContact OD1-N 3.01Å; N343-E346 PolarHBondContact ND2-OE1 3.49Å; N343-E346 PolarHBondContact O-N 3.41Å; N343-E346 PolarHBondContact OD1-N 2.76Å
344	L	76.5	Confident	76.6	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-60.9	-37.1	-179.9	-171.7	64.1	0	0	0	111.8	Y342 E346 Q347 M348 I351 A448 L449 V452	Y342-L344 PolarHBondContact O-N 3.39Å; L344-E346 VanDerWaalsContact C-N 3.33Å; L344-E346 PolarHBondContact O-N 3.3Å; L344-Q347 CarbonylContact O-C 3.53Å; L344-Q347 WeakPolarHBondContact O-CA 3.34Å; L344-Q347 PolarHBondContact O-N 3.46Å; L344-M348 HydrophobicContact CD1-SD 4.43Å; L344-M348 HydrophobicContact CG-SD 4.1Å; L344-M348 WeakPolarHBondContact O-CG 3.43Å; L344-M348 PolarHBondContact O-N 3.17Å; L344-I351 HydrophobicContact CD1-CD1 4.44Å; L344-A448 HydrophobicContact CD2-CB 3.72Å; L344-A448 HydrophobicContact CG-CB 4.08Å; L344-L449 HydrophobicContact CD2-CB 4.43Å; L344-L449 HydrophobicContact CD2-CD2 3.67Å; L344-L449 HydrophobicContact CD2-CG 3.77Å; L344-V452 HydrophobicContact CD1-CG2 4.32Å
345	C	77.8	Confident	77.3	Confident	53 Å²	53	67 Å²	67	36%	0.358	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-38	-175.2	-62	0	0	0	0	112.9	N343 Q347	N343-C345 VanDerWaalsContact C-N 3.26Å; N343-C345 PolarHBondContact O-N 3.01Å; N343-C345 WeakPolarHBondContact OD1-CB 3.39Å; N343-C345 PolarHBondContact OD1-N 3.01Å; C345-Q347 VanDerWaalsContact C-N 3.3Å
346	E	81.7	Confident	78.2	Confident	131 Å²	131	65.6 Å²	65.6	61%	0.612	36%	0.356	S	S	*	.	H	α-helix	trans	-69.6	-29.6	175.2	-73.1	-179.9	-170.9	0	0	112.4	N343 L344	N343-E346 PolarHBondContact ND2-OE1 3.49Å; N343-E346 PolarHBondContact O-N 3.41Å; N343-E346 PolarHBondContact OD1-N 2.76Å; L344-E346 VanDerWaalsContact C-N 3.33Å; L344-E346 PolarHBondContact O-N 3.3Å
347	Q	82.7	Confident	79.9	Confident	40 Å²	40	68.7 Å²	68.7	19%	0.187	35%	0.35	C	S	.	.	H	α-helix	trans	-83.5	-19.4	-179.4	-63.1	-175.2	36.9	0	0	113.3	Q341 L344 C345 V349 Q350 I351 H405	Q341-Q347 PolarHBondContact O-NE2 3.04Å; L344-Q347 CarbonylContact O-C 3.53Å; L344-Q347 WeakPolarHBondContact O-CA 3.34Å; L344-Q347 PolarHBondContact O-N 3.46Å; C345-Q347 VanDerWaalsContact C-N 3.3Å; Q347-V349 PolarHBondContact O-N 3.27Å; Q347-Q350 PolarHBondContact O-N 3.39Å; Q347-Q350 VanDerWaalsContact O-N 3.15Å; Q347-I351 HydrophobicContact CB-CD1 4.42Å; Q347-I351 WeakPolarHBondContact O-CG1 3.26Å; Q347-I351 PolarHBondContact O-N 3.34Å; Q347-H405 PolarHBondContact OE1-CE1 2.91Å; Q347-H405 PolarHBondContact OE1-ND1 3.47Å; Q347-H405 PolarHBondContact OE1-NE2 3.38Å
348	M	88.6	Confident	81.7	Confident	7 Å²	7	65.1 Å²	65.1	3%	0.034	32%	0.324	C	S	.	.	H	α-helix	trans	-55.4	-36.2	-179.4	-73.7	-52.3	-67.5	0	0	113.2	L344 I351 R352 A448 E451 V452 M455	L344-M348 HydrophobicContact CD1-SD 4.43Å; L344-M348 HydrophobicContact CG-SD 4.1Å; L344-M348 WeakPolarHBondContact O-CG 3.43Å; L344-M348 PolarHBondContact O-N 3.17Å; M348-I351 PolarHBondContact O-N 3.17Å; M348-R352 WeakPolarHBondContact O-CB 3.37Å; M348-R352 VanDerWaalsContact O-CG 3.26Å; M348-R352 WeakPolarHBondContact O-CG 3.43Å; M348-R352 PolarHBondContact O-N 2.7Å; M348-A448 HydrophobicContact CE-CB 4.45Å; M348-A448 HydrophobicContact CG-CB 3.82Å; M348-A448 HydrophobicContact SD-CB 3.85Å; M348-E451 HydrophobicContact CE-CB 3.59Å; M348-E451 HydrophobicContact CE-CG 4.33Å; M348-E451 WeakPolarHBondContact CE-OE2 3.38Å; M348-V452 HydrophobicContact CE-CG2 3.93Å; M348-V452 HydrophobicContact SD-CG2 3.46Å; M348-V452 WeakPolarHBondContact SD-CG2 3.39Å; M348-M455 HydrophobicContact CE-CE 3.95Å
349	V	90	Very high	83.2	Confident	90 Å²	90	60.1 Å²	60.1	55%	0.545	30%	0.298	S	S	.	.	H	α-helix	trans	-60.6	-49.9	179.5	-177.8	0	0	0	0	110.4	Q347 I351 R352 D353	Q347-V349 PolarHBondContact O-N 3.27Å; V349-I351 PolarHBondContact O-N 3.22Å; V349-R352 PolarHBondContact O-N 3.14Å; V349-D353 PolarHBondContact O-N 2.87Å
350	Q	90.9	Very high	84.7	Confident	102 Å²	102	62.4 Å²	62.4	48%	0.477	31%	0.314	S	S	.	.	H	α-helix	trans	-65.9	-39.9	179.3	-173.8	64.1	51.8	0	0	111.8	Q347 D353 D354	Q347-Q350 PolarHBondContact O-N 3.39Å; Q347-Q350 VanDerWaalsContact O-N 3.15Å; Q350-D353 PolarHBondContact O-N 3.38Å; Q350-D354 PolarHBondContact NE2-OD1 3.11Å; Q350-D354 WeakPolarHBondContact O-CB 3.3Å; Q350-D354 PolarHBondContact O-N 3.23Å
351	I	93.3	Very high	86.3	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-62.4	-45.9	179.3	-67.4	172.3	0	0	0	110.4	L344 Q347 M348 V349 D354 H355 W402 V452 M455	L344-I351 HydrophobicContact CD1-CD1 4.44Å; Q347-I351 HydrophobicContact CB-CD1 4.42Å; Q347-I351 WeakPolarHBondContact O-CG1 3.26Å; Q347-I351 PolarHBondContact O-N 3.34Å; M348-I351 PolarHBondContact O-N 3.17Å; V349-I351 PolarHBondContact O-N 3.22Å; I351-D354 PolarHBondContact O-N 3.47Å; I351-H355 VanDerWaalsContact O-CB 3.29Å; I351-H355 WeakPolarHBondContact O-CB 3.13Å; I351-H355 PolarHBondContact O-N 2.83Å; I351-W402 HydrophobicContact CG2-CD2 4.36Å; I351-W402 HydrophobicContact CG2-CG 4.36Å; I351-W402 HydrophobicContact CG2-CZ2 4.38Å; I351-V452 HydrophobicContact CD1-CG2 4.01Å; I351-V452 HydrophobicContact CG2-CG2 4.39Å; I351-M455 HydrophobicContact CB-CE 4.48Å; I351-M455 HydrophobicContact CG2-CE 3.37Å; I351-M455 HydrophobicContact CG2-SD 3.96Å
352	R	93.1	Very high	87.6	Confident	106 Å²	106	57.8 Å²	57.8	40%	0.4	29%	0.285	S	S	.	.	H	α-helix	trans	-63.2	-42.5	178	-70.9	173.2	-175.7	165.7	2.4	111.7	M348 V349 H355 I356 E451 M455	M348-R352 WeakPolarHBondContact O-CB 3.37Å; M348-R352 VanDerWaalsContact O-CG 3.26Å; M348-R352 WeakPolarHBondContact O-CG 3.43Å; M348-R352 PolarHBondContact O-N 2.7Å; V349-R352 PolarHBondContact O-N 3.14Å; R352-H355 PolarHBondContact O-N 2.95Å; R352-I356 VanDerWaalsContact O-CG1 3.28Å; R352-I356 WeakPolarHBondContact O-CG1 3.36Å; R352-I356 PolarHBondContact O-N 2.79Å; R352-E451 IonicContact CZ-OE1 3.87Å; R352-E451 IonicContact CZ-OE2 3.57Å; R352-E451 IonicContact NE-OE2 3.56Å; R352-E451 PolarHBondContact NE-OE2 3.26Å; R352-E451 IonicContact NH2-OE1 2.85Å; R352-E451 PolarHBondContact NH2-OE1 2.77Å; R352-E451 IonicContact NH2-OE2 2.72Å; R352-E451 PolarHBondContact NH2-OE2 2.78Å; R352-M455 HydrophobicContact CG-CE 4.43Å; R352-M455 HydrophobicContact CG-SD 4.42Å
353	D	93.2	Very high	88.3	Confident	84 Å²	84	59.2 Å²	59.2	45%	0.449	30%	0.299	S	S	.	.	H	α-helix	trans	-64.6	-44.3	177.4	-76.5	-12.3	0	0	0	112.2	V349 Q350 H355 R357	V349-D353 PolarHBondContact O-N 2.87Å; Q350-D353 PolarHBondContact O-N 3.38Å; D353-H355 VanDerWaalsContact C-N 3.34Å; D353-R357 WeakPolarHBondContact O-CB 3.29Å; D353-R357 PolarHBondContact O-N 2.85Å
354	D	93.3	Very high	88.7	Confident	29 Å²	29	65.2 Å²	65.2	16%	0.155	32%	0.317	C	S	.	.	H	α-helix	trans	-61.3	-44.1	176	-71.5	-14.8	0	0	0	110.5	Q350 I351 R357 F358 L398 K401 W402	Q350-D354 PolarHBondContact NE2-OD1 3.11Å; Q350-D354 WeakPolarHBondContact O-CB 3.3Å; Q350-D354 PolarHBondContact O-N 3.23Å; I351-D354 PolarHBondContact O-N 3.47Å; D354-R357 PolarHBondContact O-N 3.43Å; D354-F358 WeakPolarHBondContact O-CB 3.4Å; D354-F358 PolarHBondContact O-N 3.3Å; D354-L398 HydrophobicContact CB-CD1 3.86Å; D354-K401 IonicContact OD2-NZ 3Å; D354-K401 PolarHBondContact OD2-NZ 3.25Å; D354-W402 HydrophobicContact CB-CZ2 4.42Å
355	H	93.6	Very high	89	Confident	44 Å²	44	67.6 Å²	67.6	20%	0.204	33%	0.326	C	S	.	.	H	α-helix	trans	-60.8	-50.8	178.3	175.5	-89.9	0	0	0	111.9	I351 R352 D353 R357 F358 I359 W402 M455	I351-H355 VanDerWaalsContact O-CB 3.29Å; I351-H355 WeakPolarHBondContact O-CB 3.13Å; I351-H355 PolarHBondContact O-N 2.83Å; R352-H355 PolarHBondContact O-N 2.95Å; D353-H355 VanDerWaalsContact C-N 3.34Å; H355-R357 VanDerWaalsContact C-N 3.35Å; H355-R357 PolarHBondContact O-N 3.32Å; H355-F358 PolarHBondContact O-N 3.34Å; H355-I359 WeakPolarHBondContact CD2-CD1 3.37Å; H355-I359 WeakPolarHBondContact CE1-CD1 3.32Å; H355-I359 WeakPolarHBondContact NE2-CD1 3.37Å; H355-I359 WeakPolarHBondContact O-CB 3.36Å; H355-I359 PolarHBondContact O-N 3.04Å; H355-W402 HydrophobicContact CB-CH2 3.65Å; H355-W402 HydrophobicContact CB-CZ2 3.81Å; H355-W402 AromaticContact CD2-CH2 3.64Å; H355-M455 HydrophobicContact CB-SD 3.82Å; H355-M455 VanDerWaalsContact CD2-CG 3.49Å; H355-M455 WeakPolarHBondContact CD2-CG 3.46Å
356	I	92	Very high	88.9	Confident	101 Å²	101	66.8 Å²	66.8	52%	0.518	32%	0.321	S	S	.	.	H	α-helix	trans	-60.3	-46.3	179.2	-68.7	165.6	0	0	0	110.4	R352 S360	R352-I356 VanDerWaalsContact O-CG1 3.28Å; R352-I356 WeakPolarHBondContact O-CG1 3.36Å; R352-I356 PolarHBondContact O-N 2.79Å; I356-S360 VanDerWaalsContact O-CB 3.22Å; I356-S360 WeakPolarHBondContact O-CB 3.34Å; I356-S360 PolarHBondContact O-N 3.05Å; I356-S360 VanDerWaalsContact O-N 3.11Å; I356-S360 PolarHBondContact O-OG 3.01Å
357	R	93.4	Very high	88.4	Confident	182 Å²	182	65.5 Å²	65.5	69%	0.687	32%	0.318	S	S	*	.	H	α-helix	trans	-62.8	-49.6	-178.5	-175.3	179.8	-67.8	169.2	1.4	111.5	D353 D354 H355 E361	D353-R357 WeakPolarHBondContact O-CB 3.29Å; D353-R357 PolarHBondContact O-N 2.85Å; D354-R357 PolarHBondContact O-N 3.43Å; H355-R357 VanDerWaalsContact C-N 3.35Å; H355-R357 PolarHBondContact O-N 3.32Å; R357-E361 PolarHBondContact O-N 3.39Å
358	F	94.2	Very high	87.7	Confident	13 Å²	13	66 Å²	66	6%	0.057	33%	0.326	C	S	.	.	H	α-helix	trans	-68.7	-46.2	-175.3	-174.7	-100.4	0	0	0	112.4	D354 H355 S360 E361 L362 L391 R394 L398 L459 M463	D354-F358 WeakPolarHBondContact O-CB 3.4Å; D354-F358 PolarHBondContact O-N 3.3Å; H355-F358 PolarHBondContact O-N 3.34Å; F358-S360 VanDerWaalsContact C-N 3.32Å; F358-S360 PolarHBondContact O-N 3.08Å; F358-E361 WeakPolarHBondContact O-CB 3.45Å; F358-E361 PolarHBondContact O-N 3.26Å; F358-E361 VanDerWaalsContact O-N 3.17Å; F358-L362 HydrophobicContact CE1-CB 4.48Å; F358-L362 HydrophobicContact CE1-CD2 4.17Å; F358-L362 WeakPolarHBondContact O-CB 3.4Å; F358-L362 PolarHBondContact O-N 3.31Å; F358-L391 HydrophobicContact CE2-CD2 3.99Å; F358-L391 HydrophobicContact CZ-CD2 4.5Å; F358-L391 WeakPolarHBondContact CZ-O 3.45Å; F358-R394 HydrophobicContact CE2-CB 3.89Å; F358-L398 HydrophobicContact CB-CD2 3.76Å; F358-L398 HydrophobicContact CD1-CD2 4.14Å; F358-L398 HydrophobicContact CG-CD2 3.91Å; F358-L459 HydrophobicContact CD1-CD1 3.91Å; F358-L459 HydrophobicContact CD1-CD2 3.99Å; F358-L459 HydrophobicContact CE1-CD1 3.86Å; F358-L459 HydrophobicContact CE1-CD2 4.21Å; F358-M463 HydrophobicContact CE1-SD 3.94Å; F358-M463 HydrophobicContact CZ-SD 4.19Å
359	I	90.7	Very high	86.5	Confident	35 Å²	35	67.7 Å²	67.7	18%	0.179	33%	0.334	C	S	.	.	H	α-helix	trans	-66.4	-36.5	180	-75	164.4	0	0	0	111.6	H355 E361 L362 A363 L459 L462	H355-I359 WeakPolarHBondContact CD2-CD1 3.37Å; H355-I359 WeakPolarHBondContact CE1-CD1 3.32Å; H355-I359 WeakPolarHBondContact NE2-CD1 3.37Å; H355-I359 WeakPolarHBondContact O-CB 3.36Å; H355-I359 PolarHBondContact O-N 3.04Å; I359-E361 VanDerWaalsContact C-N 3.28Å; I359-E361 PolarHBondContact O-N 2.94Å; I359-L362 PolarHBondContact O-N 2.92Å; I359-A363 WeakPolarHBondContact O-CB 3.45Å; I359-A363 PolarHBondContact O-N 3.4Å; I359-L459 HydrophobicContact CD1-CD1 4.35Å; I359-L459 HydrophobicContact CG1-CD1 3.88Å; I359-L462 HydrophobicContact CD1-CD1 4.3Å; I359-L462 HydrophobicContact CG1-CD1 4.09Å; I359-L462 HydrophobicContact CG2-CD1 4.05Å
360	S	89.4	Confident	85	Confident	68 Å²	68	68.8 Å²	68.8	48%	0.476	34%	0.341	S	S	.	.	H	α-helix	trans	-62.5	-37.5	174.9	-60	0	0	0	0	111.9	I356 F358 R364	I356-S360 VanDerWaalsContact O-CB 3.22Å; I356-S360 WeakPolarHBondContact O-CB 3.34Å; I356-S360 PolarHBondContact O-N 3.05Å; I356-S360 VanDerWaalsContact O-N 3.11Å; I356-S360 PolarHBondContact O-OG 3.01Å; F358-S360 VanDerWaalsContact C-N 3.32Å; F358-S360 PolarHBondContact O-N 3.08Å; S360-R364 WeakPolarHBondContact O-CG 3.35Å
361	E	91.3	Very high	83.3	Confident	48 Å²	48	69 Å²	69	22%	0.224	35%	0.349	C	S	.	.	H	α-helix	trans	-68.5	-52.7	174.2	-168.6	179.5	169.6	0	0	110.5	R357 F358 I359 A363 R364 Y365 L391 R394	R357-E361 PolarHBondContact O-N 3.39Å; F358-E361 WeakPolarHBondContact O-CB 3.45Å; F358-E361 PolarHBondContact O-N 3.26Å; F358-E361 VanDerWaalsContact O-N 3.17Å; I359-E361 VanDerWaalsContact C-N 3.28Å; I359-E361 PolarHBondContact O-N 2.94Å; E361-A363 VanDerWaalsContact C-N 3.35Å; E361-A363 PolarHBondContact O-N 3.1Å; E361-R364 WeakPolarHBondContact O-CB 3.47Å; E361-R364 PolarHBondContact O-N 2.79Å; E361-R364 VanDerWaalsContact O-N 3.1Å; E361-Y365 HydrophobicContact CG-CE2 3.97Å; E361-Y365 VanDerWaalsContact O-CD2 3.25Å; E361-Y365 WeakPolarHBondContact O-CD2 3.44Å; E361-L391 HydrophobicContact CG-CD2 4.05Å; E361-R394 IonicContact OE1-CZ 2.71Å; E361-R394 IonicContact OE1-NH1 2.7Å; E361-R394 PolarHBondContact OE1-NH1 3.38Å; E361-R394 IonicContact OE1-NH2 2.85Å; E361-R394 PolarHBondContact OE1-NH2 3.46Å; E361-R394 IonicContact OE2-CZ 3.18Å; E361-R394 IonicContact OE2-NH1 3.9Å; E361-R394 PolarHBondContact OE2-NH1 2.87Å; E361-R394 IonicContact OE2-NH2 3.34Å
362	L	88.7	Confident	81.3	Confident	5 Å²	5	73 Å²	73	3%	0.026	37%	0.373	C	S	.	.	H	α-helix	trans	-56.9	-43.8	-179.8	-178.9	63.7	0	0	0	112.8	F358 I359 R364 Y365 S366 L459 L462 M463 M466 F470	F358-L362 HydrophobicContact CE1-CB 4.48Å; F358-L362 HydrophobicContact CE1-CD2 4.17Å; F358-L362 WeakPolarHBondContact O-CB 3.4Å; F358-L362 PolarHBondContact O-N 3.31Å; I359-L362 PolarHBondContact O-N 2.92Å; L362-R364 PolarHBondContact O-N 3.35Å; L362-Y365 PolarHBondContact O-N 2.95Å; L362-S366 PolarHBondContact O-N 3.37Å; L362-L459 HydrophobicContact CD2-CD1 4.03Å; L362-L462 HydrophobicContact CD2-CB 4Å; L362-M463 HydrophobicContact CD1-SD 4.44Å; L362-M463 HydrophobicContact CD2-SD 3.81Å; L362-M466 HydrophobicContact CD1-CG 4.42Å; L362-F470 HydrophobicContact CD1-CZ 3.72Å
363	A	84.2	Confident	79.2	Confident	41 Å²	41	71.2 Å²	71.2	34%	0.339	39%	0.388	S	S	.	.	H	α-helix	trans	-63.8	-29.3	-179.8	0	0	0	0	0	112.7	I359 E361 N367	I359-A363 WeakPolarHBondContact O-CB 3.45Å; I359-A363 PolarHBondContact O-N 3.4Å; E361-A363 VanDerWaalsContact C-N 3.35Å; E361-A363 PolarHBondContact O-N 3.1Å; A363-N367 WeakPolarHBondContact O-CB 3.15Å; A363-N367 VanDerWaalsContact O-CG 3.25Å; A363-N367 PolarHBondContact O-N 3.49Å; A363-N367 PolarHBondContact O-ND2 2.83Å; A363-N367 VanDerWaalsContact O-ND2 3.13Å
364	R	85.1	Confident	76.8	Confident	185 Å²	185	72.5 Å²	72.5	70%	0.698	40%	0.403	S	S	*	.	H	α-helix	trans	-66.2	-42.9	175.1	-71.2	169.9	62.3	-161.1	-5	111.4	S360 E361 L362 S368	S360-R364 WeakPolarHBondContact O-CG 3.35Å; E361-R364 WeakPolarHBondContact O-CB 3.47Å; E361-R364 PolarHBondContact O-N 2.79Å; E361-R364 VanDerWaalsContact O-N 3.1Å; L362-R364 PolarHBondContact O-N 3.35Å; R364-S368 PolarHBondContact O-N 3.11Å; R364-S368 PolarHBondContact O-OG 2.7Å
365	Y	81.4	Confident	74.2	Confident	53 Å²	53	73.7 Å²	73.7	21%	0.208	42%	0.423	C	S	.	.	H	α-helix	trans	-68.3	-42.5	177.3	-69.6	-84	0	0	0	111.3	E361 L362 N367 S368 E369 E387 L388 L391	E361-Y365 HydrophobicContact CG-CE2 3.97Å; E361-Y365 VanDerWaalsContact O-CD2 3.25Å; E361-Y365 WeakPolarHBondContact O-CD2 3.44Å; L362-Y365 PolarHBondContact O-N 2.95Å; Y365-N367 PolarHBondContact O-N 3.27Å; Y365-S368 WeakPolarHBondContact CA-OG 3.26Å; Y365-S368 PolarHBondContact O-N 2.71Å; Y365-S368 PolarHBondContact O-OG 3.41Å; Y365-E369 VanDerWaalsContact O-CG 3.31Å; Y365-E369 WeakPolarHBondContact O-CG 3.1Å; Y365-E369 PolarHBondContact O-N 3.37Å; Y365-E387 PolarHBondContact OH-OE2 2.92Å; Y365-L388 HydrophobicContact CD1-CD2 4.12Å; Y365-L388 HydrophobicContact CG-CD2 4.33Å; Y365-L391 HydrophobicContact CD1-CD1 4.38Å; Y365-L391 HydrophobicContact CD2-CD1 3.4Å; Y365-L391 HydrophobicContact CE1-CD1 4.4Å; Y365-L391 HydrophobicContact CE2-CD1 3.45Å; Y365-L391 VanDerWaalsContact CE2-CD1 3.45Å; Y365-L391 HydrophobicContact CG-CD1 3.91Å
366	S	76.4	Confident	71.7	Confident	36 Å²	36	79.2 Å²	79.2	25%	0.252	45%	0.453	S	S	.	.	H	α-helix	trans	-59.3	-47.6	174.9	-177.3	0	0	0	0	112.3	L362 S368 E369 V370 M466	L362-S366 PolarHBondContact O-N 3.37Å; S366-S368 PolarHBondContact O-N 3.25Å; S366-E369 PolarHBondContact O-N 3.03Å; S366-V370 WeakPolarHBondContact O-CG2 3.21Å; S366-V370 PolarHBondContact O-N 2.92Å; S366-M466 VanDerWaalsContact CB-SD 3.55Å
367	N	71.4	Confident	69.4	Low	105 Å²	105	82 Å²	82	56%	0.561	47%	0.469	S	S	*	.	H	α-helix	trans	-65.9	-36.3	178.1	-72.9	-31.1	0	0	0	112.7	A363 Y365 V370 V371	A363-N367 WeakPolarHBondContact O-CB 3.15Å; A363-N367 VanDerWaalsContact O-CG 3.25Å; A363-N367 PolarHBondContact O-N 3.49Å; A363-N367 PolarHBondContact O-ND2 2.83Å; A363-N367 VanDerWaalsContact O-ND2 3.13Å; Y365-N367 PolarHBondContact O-N 3.27Å; N367-V370 PolarHBondContact O-N 2.81Å; N367-V371 WeakPolarHBondContact O-CB 3.44Å; N367-V371 WeakPolarHBondContact O-CG2 3.28Å; N367-V371 PolarHBondContact O-N 3.04Å
368	S	67.1	Low	67.6	Low	49 Å²	49	78.3 Å²	78.3	34%	0.343	47%	0.471	S	S	.	.	H	α-helix	trans	-64	-44.8	174.9	56	0	0	0	0	111.1	R364 Y365 S366 V370 V371 T372	R364-S368 PolarHBondContact O-N 3.11Å; R364-S368 PolarHBondContact O-OG 2.7Å; Y365-S368 WeakPolarHBondContact CA-OG 3.26Å; Y365-S368 PolarHBondContact O-N 2.71Å; Y365-S368 PolarHBondContact O-OG 3.41Å; S366-S368 PolarHBondContact O-N 3.25Å; S368-V370 PolarHBondContact O-N 3Å; S368-V371 PolarHBondContact O-N 3.46Å; S368-T372 WeakPolarHBondContact O-CB 3.23Å; S368-T372 WeakPolarHBondContact O-CG2 3.28Å; S368-T372 PolarHBondContact O-N 3.22Å; S368-T372 PolarHBondContact O-OG1 3.29Å
369	E	64.4	Low	66.3	Low	44 Å²	44	86.4 Å²	86.4	21%	0.206	51%	0.509	C	S	.	.	H	α-helix	trans	-58.8	-44.9	176.6	-66.4	-57.4	131.6	0	0	112.2	Y365 S366 V371 T372 G373 K380 V469	Y365-E369 VanDerWaalsContact O-CG 3.31Å; Y365-E369 WeakPolarHBondContact O-CG 3.1Å; Y365-E369 PolarHBondContact O-N 3.37Å; S366-E369 PolarHBondContact O-N 3.03Å; E369-V371 VanDerWaalsContact C-N 3.31Å; E369-V371 PolarHBondContact O-N 2.91Å; E369-T372 PolarHBondContact O-N 3.36Å; E369-G373 PolarHBondContact O-N 3.29Å; E369-K380 WeakPolarHBondContact OE1-CE 3.25Å; E369-K380 IonicContact OE1-NZ 2.82Å; E369-K380 PolarHBondContact OE1-NZ 3.4Å; E369-K380 IonicContact OE2-NZ 3.87Å; E369-K380 PolarHBondContact OE2-NZ 3.47Å; E369-V469 HydrophobicContact CG-CG1 4.3Å; E369-V469 HydrophobicContact CG-CG2 4.47Å
370	V	58.9	Low	65.7	Low	113 Å²	113	87.3 Å²	87.3	69%	0.685	51%	0.512	S	S	*	.	H	α-helix	trans	-66.3	-34.1	-179.6	175	0	0	0	0	111.8	S366 N367 S368	S366-V370 WeakPolarHBondContact O-CG2 3.21Å; S366-V370 PolarHBondContact O-N 2.92Å; N367-V370 PolarHBondContact O-N 2.81Å; S368-V370 PolarHBondContact O-N 3Å
371	V	53.7	Low	65.6	Low	106 Å²	106	86.7 Å²	86.7	64%	0.642	51%	0.507	S	S	*	.	H	α-helix	trans	-80.5	-38	179.2	174.4	0	0	0	0	111.7	N367 S368 E369 S374	N367-V371 WeakPolarHBondContact O-CB 3.44Å; N367-V371 WeakPolarHBondContact O-CG2 3.28Å; N367-V371 PolarHBondContact O-N 3.04Å; S368-V371 PolarHBondContact O-N 3.46Å; E369-V371 VanDerWaalsContact C-N 3.31Å; E369-V371 PolarHBondContact O-N 2.91Å; V371-S374 PolarHBondContact O-OG 3.16Å; V371-S374 VanDerWaalsContact O-OG 3.08Å
372	T	52.7	Low	65.4	Low	86 Å²	86	87.8 Å²	87.8	53%	0.528	52%	0.515	S	S	.	.	H	α-helix	trans	-86.4	-16.4	-178.3	59.3	0	0	0	0	114	S368 E369 S374 G375	S368-T372 WeakPolarHBondContact O-CB 3.23Å; S368-T372 WeakPolarHBondContact O-CG2 3.28Å; S368-T372 PolarHBondContact O-N 3.22Å; S368-T372 PolarHBondContact O-OG1 3.29Å; E369-T372 PolarHBondContact O-N 3.36Å; T372-S374 PolarHBondContact O-N 3.01Å; T372-G375 PolarHBondContact O-N 3.34Å
373	G	48.7	Very low	65.4	Low	69 Å²	69	95 Å²	95	71%	0.711	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-4.8	174.4	0	0	0	0	0	115.2	E369	E369-G373 PolarHBondContact O-N 3.29Å
374	S	42.5	Very low	65.6	Low	110 Å²	110	97.5 Å²	97.5	77%	0.769	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-1.7	170.3	59.4	0	0	0	0	114.3	V371 T372	V371-S374 PolarHBondContact O-OG 3.16Å; V371-S374 VanDerWaalsContact O-OG 3.08Å; T372-S374 PolarHBondContact O-N 3.01Å
375	G	39	Very low	65.8	Low	55 Å²	55	90.1 Å²	90.1	57%	0.567	53%	0.525	S	S	*	.	S	Bend	trans	-111.5	115.2	179.6	0	0	0	0	0	113.1	T372	T372-G375 PolarHBondContact O-N 3.34Å
376	L	41.4	Very low	66.3	Low	159 Å²	159	94.3 Å²	94.3	83%	0.832	54%	0.541	S	S	*	.			trans	-50.8	139.2	171	-71.6	124.7	0	0	0	113.6
377	D	42.9	Very low	67	Low	160 Å²	160	97 Å²	97	86%	0.856	55%	0.549	S	S	*	.			trans	60.4	46.2	147.8	-64.5	-24.9	0	0	0	120.4
378	S	55.6	Low	68	Low	104 Å²	104	92.4 Å²	92.4	73%	0.727	52%	0.524	S	S	*	.			trans	-119.3	106.9	157	67.3	0	0	0	0	111.4	K380	S378-K380 PolarHBondContact O-N 3.1Å
379	Q	67.2	Low	69.2	Low	184 Å²	184	90.9 Å²	90.9	86%	0.86	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-55.2	132.1	165.5	-74.1	-175.4	-19.7	0	0	109
380	K	78.3	Confident	70.6	Confident	54 Å²	54	91.9 Å²	91.9	24%	0.235	52%	0.518	C	S	.	.	P	Polyproline II helix	trans	-67.1	156.9	177.8	-58.4	-179.8	-171.8	170.1	0	110.3	E369 S378 E384 Y385	E369-K380 WeakPolarHBondContact OE1-CE 3.25Å; E369-K380 IonicContact OE1-NZ 2.82Å; E369-K380 PolarHBondContact OE1-NZ 3.4Å; E369-K380 IonicContact OE2-NZ 3.87Å; E369-K380 PolarHBondContact OE2-NZ 3.47Å; S378-K380 PolarHBondContact O-N 3.1Å; K380-E384 HydrophobicContact CB-CB 4.18Å; K380-E384 WeakPolarHBondContact CB-OE2 3.37Å; K380-Y385 HydrophobicContact CB-CD1 4.34Å; K380-Y385 HydrophobicContact CB-CD2 4.19Å; K380-Y385 HydrophobicContact CB-CE1 3.94Å; K380-Y385 HydrophobicContact CB-CE2 3.76Å; K380-Y385 HydrophobicContact CB-CG 4.47Å; K380-Y385 HydrophobicContact CD-CD1 4.37Å; K380-Y385 HydrophobicContact CD-CE1 3.92Å; K380-Y385 HydrophobicContact CG-CE1 4.26Å; K380-Y385 VanDerWaalsContact O-CE2 3.29Å; K380-Y385 WeakPolarHBondContact O-CE2 3.34Å
381	S	86.4	Confident	72.3	Confident	54 Å²	54	86.5 Å²	86.5	38%	0.378	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-69.9	158.2	174.5	64.2	0	0	0	0	111.9	E383 E384 Y385	S381-E383 PolarHBondContact O-N 2.87Å; S381-E384 PolarHBondContact N-OE2 3.48Å; S381-E384 PolarHBondContact O-N 3.46Å; S381-E384 VanDerWaalsContact OG-CG 3.31Å; S381-E384 WeakPolarHBondContact OG-CG 3.28Å; S381-E384 PolarHBondContact OG-N 3.35Å; S381-E384 PolarHBondContact OG-OE2 3.37Å; S381-Y385 WeakPolarHBondContact O-CD2 3.14Å; S381-Y385 PolarHBondContact O-N 2.99Å; S381-Y385 VanDerWaalsContact O-N 3.13Å
382	D	87.3	Confident	74.2	Confident	72 Å²	72	81.4 Å²	81.4	39%	0.385	46%	0.455	S	S	.	.	H	α-helix	trans	-57.8	-31.1	174.4	-74.8	-6.6	0	0	0	112	R386 R547	D382-R386 VanDerWaalsContact O-CB 3.29Å; D382-R386 WeakPolarHBondContact O-CB 3.43Å; D382-R386 PolarHBondContact O-N 3.43Å; D382-R547 IonicContact OD1-NE 3.75Å; D382-R547 PolarHBondContact OD1-NE 3.34Å; D382-R547 IonicContact OD2-CZ 2.76Å; D382-R547 VanDerWaalsContact OD2-CZ 3.25Å; D382-R547 IonicContact OD2-NE 3.76Å; D382-R547 PolarHBondContact OD2-NE 3.46Å; D382-R547 IonicContact OD2-NH2 3.61Å; D382-R547 PolarHBondContact OD2-NH2 2.66Å
383	E	89.3	Confident	76.2	Confident	156 Å²	156	78.4 Å²	78.4	73%	0.729	44%	0.436	S	S	*	.	H	α-helix	trans	-68.8	-47.2	178.1	-69.7	-179.7	176.2	0	0	111.6	S381 Y385 R386 E387	S381-E383 PolarHBondContact O-N 2.87Å; E383-Y385 PolarHBondContact O-N 2.7Å; E383-R386 WeakPolarHBondContact O-CB 3.48Å; E383-R386 PolarHBondContact O-N 3.36Å; E383-R386 VanDerWaalsContact O-N 3.15Å; E383-E387 PolarHBondContact O-N 3.24Å
384	E	87.8	Confident	78.4	Confident	94 Å²	94	79.9 Å²	79.9	44%	0.439	42%	0.42	S	S	.	.	H	α-helix	trans	-63.4	-40.9	177.4	-70.8	163.4	143.8	0	0	111.9	K380 S381 R386 E387 L388	K380-E384 HydrophobicContact CB-CB 4.18Å; K380-E384 WeakPolarHBondContact CB-OE2 3.37Å; S381-E384 PolarHBondContact N-OE2 3.48Å; S381-E384 PolarHBondContact O-N 3.46Å; S381-E384 VanDerWaalsContact OG-CG 3.31Å; S381-E384 WeakPolarHBondContact OG-CG 3.28Å; S381-E384 PolarHBondContact OG-N 3.35Å; S381-E384 PolarHBondContact OG-OE2 3.37Å; E384-R386 VanDerWaalsContact C-N 3.3Å; E384-R386 PolarHBondContact O-N 2.86Å; E384-E387 PolarHBondContact O-N 3.49Å; E384-L388 PolarHBondContact O-N 3.39Å
385	Y	89.9	Confident	80.8	Confident	29 Å²	29	74.6 Å²	74.6	11%	0.114	38%	0.383	C	S	.	.	H	α-helix	trans	-63.8	-38.2	174.1	-73.9	-50	0	0	0	112	K380 S381 E383 L388 F389 A473 N476 T477	K380-Y385 HydrophobicContact CB-CD1 4.34Å; K380-Y385 HydrophobicContact CB-CD2 4.19Å; K380-Y385 HydrophobicContact CB-CE1 3.94Å; K380-Y385 HydrophobicContact CB-CE2 3.76Å; K380-Y385 HydrophobicContact CB-CG 4.47Å; K380-Y385 HydrophobicContact CD-CD1 4.37Å; K380-Y385 HydrophobicContact CD-CE1 3.92Å; K380-Y385 HydrophobicContact CG-CE1 4.26Å; K380-Y385 VanDerWaalsContact O-CE2 3.29Å; K380-Y385 WeakPolarHBondContact O-CE2 3.34Å; S381-Y385 WeakPolarHBondContact O-CD2 3.14Å; S381-Y385 PolarHBondContact O-N 2.99Å; S381-Y385 VanDerWaalsContact O-N 3.13Å; E383-Y385 PolarHBondContact O-N 2.7Å; Y385-L388 PolarHBondContact O-N 3.4Å; Y385-F389 PolarHBondContact O-N 2.81Å; Y385-A473 HydrophobicContact CD1-CB 3.76Å; Y385-N476 HydrophobicContact CD2-CB 4.08Å; Y385-N476 HydrophobicContact CE2-CB 4.38Å; Y385-N476 HydrophobicContact CG-CB 4.23Å; Y385-T477 VanDerWaalsContact C-OG1 3.3Å; Y385-T477 PolarHBondContact O-OG1 2.87Å
386	R	91.3	Very high	83.5	Confident	142 Å²	142	72 Å²	72	54%	0.536	36%	0.356	S	S	.	.	H	α-helix	trans	-66.2	-39.7	176.8	-174.7	175.2	-176.8	149.1	2.9	112.4	D382 E383 E384 L388 F389 D390 T477	D382-R386 VanDerWaalsContact O-CB 3.29Å; D382-R386 WeakPolarHBondContact O-CB 3.43Å; D382-R386 PolarHBondContact O-N 3.43Å; E383-R386 WeakPolarHBondContact O-CB 3.48Å; E383-R386 PolarHBondContact O-N 3.36Å; E383-R386 VanDerWaalsContact O-N 3.15Å; E384-R386 VanDerWaalsContact C-N 3.3Å; E384-R386 PolarHBondContact O-N 2.86Å; R386-L388 VanDerWaalsContact C-N 3.33Å; R386-L388 PolarHBondContact O-N 3.47Å; R386-F389 WeakPolarHBondContact O-CB 3.32Å; R386-F389 PolarHBondContact O-N 2.87Å; R386-D390 PolarHBondContact O-N 2.86Å; R386-T477 HydrophobicContact CB-CG2 4.31Å; R386-T477 HydrophobicContact CG-CG2 4.36Å; R386-T477 PolarHBondContact N-OG1 2.67Å
387	E	91.8	Very high	86.1	Confident	93 Å²	93	68.1 Å²	68.1	44%	0.435	33%	0.334	S	S	.	.	H	α-helix	trans	-61.4	-41.7	175.3	-72.7	-175.6	162.6	0	0	111.9	Y365 E383 E384 D390 L391	Y365-E387 PolarHBondContact OH-OE2 2.92Å; E383-E387 PolarHBondContact O-N 3.24Å; E384-E387 PolarHBondContact O-N 3.49Å; E387-D390 PolarHBondContact O-N 3.24Å; E387-L391 WeakPolarHBondContact O-CB 3.11Å; E387-L391 WeakPolarHBondContact O-CG 3.31Å; E387-L391 PolarHBondContact O-N 3.46Å
388	L	90.8	Very high	88.5	Confident	7 Å²	7	61.5 Å²	61.5	4%	0.037	30%	0.298	C	S	.	.	H	α-helix	trans	-66.3	-38.7	174.9	-70.5	171.4	0	0	0	112.5	Y365 E384 Y385 R386 L391 A392 V469 A473	Y365-L388 HydrophobicContact CD1-CD2 4.12Å; Y365-L388 HydrophobicContact CG-CD2 4.33Å; E384-L388 PolarHBondContact O-N 3.39Å; Y385-L388 PolarHBondContact O-N 3.4Å; R386-L388 VanDerWaalsContact C-N 3.33Å; R386-L388 PolarHBondContact O-N 3.47Å; L388-L391 HydrophobicContact CD2-CD1 4.39Å; L388-L391 PolarHBondContact O-N 3.46Å; L388-A392 PolarHBondContact O-N 3.04Å; L388-V469 HydrophobicContact CD1-CG1 3.98Å; L388-A473 HydrophobicContact CB-CB 3.62Å; L388-A473 HydrophobicContact CD1-CB 4Å; L388-A473 HydrophobicContact CG-CB 4.49Å
389	F	93.8	Very high	90.4	Very high	17 Å²	17	56.5 Å²	56.5	8%	0.075	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-46.5	171.9	170.2	-83.4	0	0	0	111.4	Y385 R386 L391 A392 L393 I474 T477 I478 F600 L603	Y385-F389 PolarHBondContact O-N 2.81Å; R386-F389 WeakPolarHBondContact O-CB 3.32Å; R386-F389 PolarHBondContact O-N 2.87Å; F389-L391 VanDerWaalsContact C-N 3.32Å; F389-L391 PolarHBondContact O-N 3.47Å; F389-A392 PolarHBondContact O-N 2.82Å; F389-L393 PolarHBondContact O-N 2.96Å; F389-L393 VanDerWaalsContact O-N 3.08Å; F389-I474 HydrophobicContact CD2-CB 4.35Å; F389-I474 HydrophobicContact CD2-CG1 4.03Å; F389-I474 HydrophobicContact CD2-CG2 4.31Å; F389-T477 HydrophobicContact CB-CG2 4.1Å; F389-T477 HydrophobicContact CD1-CG2 4.37Å; F389-T477 HydrophobicContact CD2-CG2 4.2Å; F389-T477 HydrophobicContact CG-CG2 3.98Å; F389-I478 HydrophobicContact CD2-CG1 4.47Å; F389-I478 HydrophobicContact CE2-CD1 4.19Å; F389-I478 HydrophobicContact CE2-CG1 3.88Å; F389-F600 HydrophobicContact CE2-CD1 4.24Å; F389-F600 HydrophobicContact CE2-CE1 4.21Å; F389-F600 HydrophobicContact CZ-CD1 4.04Å; F389-F600 AromaticContact CZ-CE1 3.79Å; F389-F600 HydrophobicContact CZ-CE1 3.79Å; F389-L603 HydrophobicContact CD2-CD1 3.92Å; F389-L603 HydrophobicContact CE1-CD1 4.07Å; F389-L603 HydrophobicContact CE2-CB 4.46Å; F389-L603 HydrophobicContact CE2-CD1 3.2Å; F389-L603 HydrophobicContact CE2-CG 4.42Å; F389-L603 HydrophobicContact CZ-CD1 3.27Å
390	D	93.3	Very high	91.8	Very high	65 Å²	65	48 Å²	48	35%	0.348	22%	0.224	S	C	.	.	H	α-helix	trans	-66.8	-34.6	179.2	-72.7	-24.7	0	0	0	111.5	R386 E387 R394	R386-D390 PolarHBondContact O-N 2.86Å; E387-D390 PolarHBondContact O-N 3.24Å; D390-R394 VanDerWaalsContact O-CB 3.27Å; D390-R394 WeakPolarHBondContact O-CB 3.4Å; D390-R394 WeakPolarHBondContact O-CG 3.29Å; D390-R394 PolarHBondContact O-N 3.35Å; D390-R394 PolarHBondContact O-NE 2.85Å
391	L	93.7	Very high	92.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.1	-45.4	172.4	-80	165.5	0	0	0	112.4	F358 E361 Y365 E387 L388 F389 L393 R394 G395 F470	F358-L391 HydrophobicContact CE2-CD2 3.99Å; F358-L391 HydrophobicContact CZ-CD2 4.5Å; F358-L391 WeakPolarHBondContact CZ-O 3.45Å; E361-L391 HydrophobicContact CG-CD2 4.05Å; Y365-L391 HydrophobicContact CD1-CD1 4.38Å; Y365-L391 HydrophobicContact CD2-CD1 3.4Å; Y365-L391 HydrophobicContact CE1-CD1 4.4Å; Y365-L391 HydrophobicContact CE2-CD1 3.45Å; Y365-L391 VanDerWaalsContact CE2-CD1 3.45Å; Y365-L391 HydrophobicContact CG-CD1 3.91Å; E387-L391 WeakPolarHBondContact O-CB 3.11Å; E387-L391 WeakPolarHBondContact O-CG 3.31Å; E387-L391 PolarHBondContact O-N 3.46Å; L388-L391 HydrophobicContact CD2-CD1 4.39Å; L388-L391 PolarHBondContact O-N 3.46Å; F389-L391 VanDerWaalsContact C-N 3.32Å; F389-L391 PolarHBondContact O-N 3.47Å; L391-L393 VanDerWaalsContact C-N 3.35Å; L391-L393 PolarHBondContact O-N 2.71Å; L391-R394 VanDerWaalsContact CD2-NH2 3.29Å; L391-R394 PolarHBondContact O-N 2.97Å; L391-G395 PolarHBondContact O-N 3.24Å; L391-F470 HydrophobicContact CB-CE1 4.3Å
392	A	94.2	Very high	92.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.9	-48.4	177.5	0	0	0	0	0	111.1	L388 F389 G395 L396 F470 I474 L603 F606	L388-A392 PolarHBondContact O-N 3.04Å; F389-A392 PolarHBondContact O-N 2.82Å; A392-G395 PolarHBondContact O-N 3.26Å; A392-L396 WeakPolarHBondContact O-CG 3.24Å; A392-L396 PolarHBondContact O-N 2.7Å; A392-L396 VanDerWaalsContact O-N 3.09Å; A392-F470 HydrophobicContact CB-CB 4.41Å; A392-F470 HydrophobicContact CB-CD1 3.76Å; A392-F470 HydrophobicContact CB-CD2 4.48Å; A392-F470 HydrophobicContact CB-CE1 4.06Å; A392-F470 HydrophobicContact CB-CG 4Å; A392-I474 HydrophobicContact CB-CD1 3.96Å; A392-I474 HydrophobicContact CB-CG1 4.47Å; A392-L603 HydrophobicContact CB-CD2 4.23Å; A392-F606 HydrophobicContact CB-CD2 4.35Å; A392-F606 HydrophobicContact CB-CE2 3.94Å
393	L	94.6	Very high	93.2	Very high	23 Å²	23	43.4 Å²	43.4	12%	0.12	19%	0.194	C	C	.	.	H	α-helix	trans	-64.9	-46.2	178.5	-177.2	58.4	0	0	0	112.3	L255 F389 L391 G395 L396 Q397 F599 L603	L255-L393 HydrophobicContact CD1-CD1 4.11Å; F389-L393 PolarHBondContact O-N 2.96Å; F389-L393 VanDerWaalsContact O-N 3.08Å; L391-L393 VanDerWaalsContact C-N 3.35Å; L391-L393 PolarHBondContact O-N 2.71Å; L393-G395 VanDerWaalsContact C-N 3.3Å; L393-G395 PolarHBondContact O-N 2.61Å; L393-L396 PolarHBondContact O-N 3.46Å; L393-Q397 HydrophobicContact CD1-CG 4.3Å; L393-Q397 WeakPolarHBondContact O-CB 3.39Å; L393-Q397 VanDerWaalsContact O-CG 3.3Å; L393-Q397 WeakPolarHBondContact O-CG 3.34Å; L393-Q397 PolarHBondContact O-N 3.01Å; L393-F599 HydrophobicContact CD1-CB 4.01Å; L393-F599 HydrophobicContact CD1-CD1 4.02Å; L393-F599 HydrophobicContact CD1-CD2 4.48Å; L393-F599 HydrophobicContact CD1-CG 3.92Å; L393-F599 HydrophobicContact CD2-CB 4.39Å; L393-F599 HydrophobicContact CD2-CD2 4.1Å; L393-F599 HydrophobicContact CD2-CG 4.27Å; L393-L603 HydrophobicContact CB-CD1 4.15Å; L393-L603 HydrophobicContact CB-CD2 4.15Å; L393-L603 HydrophobicContact CD1-CD1 4.31Å; L393-L603 HydrophobicContact CD1-CD2 4.39Å
394	R	94.6	Very high	93.3	Very high	99 Å²	99	36.1 Å²	36.1	37%	0.374	16%	0.16	S	C	.	.	H	α-helix	trans	-59.2	-41.1	177	-78.8	-172.8	-70.2	156.3	-6.4	111.7	F358 E361 D390 L391 Q397 L398	F358-R394 HydrophobicContact CE2-CB 3.89Å; E361-R394 IonicContact OE1-CZ 2.71Å; E361-R394 IonicContact OE1-NH1 2.7Å; E361-R394 PolarHBondContact OE1-NH1 3.38Å; E361-R394 IonicContact OE1-NH2 2.85Å; E361-R394 PolarHBondContact OE1-NH2 3.46Å; E361-R394 IonicContact OE2-CZ 3.18Å; E361-R394 IonicContact OE2-NH1 3.9Å; E361-R394 PolarHBondContact OE2-NH1 2.87Å; E361-R394 IonicContact OE2-NH2 3.34Å; D390-R394 VanDerWaalsContact O-CB 3.27Å; D390-R394 WeakPolarHBondContact O-CB 3.4Å; D390-R394 WeakPolarHBondContact O-CG 3.29Å; D390-R394 PolarHBondContact O-N 3.35Å; D390-R394 PolarHBondContact O-NE 2.85Å; L391-R394 VanDerWaalsContact CD2-NH2 3.29Å; L391-R394 PolarHBondContact O-N 2.97Å; R394-Q397 PolarHBondContact O-N 2.83Å; R394-L398 WeakPolarHBondContact O-CB 3.4Å; R394-L398 PolarHBondContact O-N 3.17Å
395	G	94.4	Very high	93.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.7	-46.6	177.8	0	0	0	0	0	112.7	L391 A392 L393 Q397 L398 L399	L391-G395 PolarHBondContact O-N 3.24Å; A392-G395 PolarHBondContact O-N 3.26Å; L393-G395 VanDerWaalsContact C-N 3.3Å; L393-G395 PolarHBondContact O-N 2.61Å; G395-Q397 PolarHBondContact O-N 3.16Å; G395-L398 PolarHBondContact O-N 2.84Å; G395-L399 WeakPolarHBondContact O-CG 3.27Å; G395-L399 PolarHBondContact O-N 3.29Å
396	L	95.4	Very high	93.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.1	-42.5	175.8	-68.2	175.2	0	0	0	112.2	L255 A392 L393 L398 L399 S400 L603 F606 A609 L610	L255-L396 HydrophobicContact CD1-CB 3.94Å; L255-L396 HydrophobicContact CD2-CB 4.38Å; L255-L396 HydrophobicContact CD2-CD1 4.09Å; A392-L396 WeakPolarHBondContact O-CG 3.24Å; A392-L396 PolarHBondContact O-N 2.7Å; A392-L396 VanDerWaalsContact O-N 3.09Å; L393-L396 PolarHBondContact O-N 3.46Å; L396-L398 VanDerWaalsContact C-N 3.32Å; L396-L398 PolarHBondContact O-N 3.33Å; L396-L399 PolarHBondContact O-N 3.38Å; L396-S400 VanDerWaalsContact O-CB 3.25Å; L396-S400 WeakPolarHBondContact O-CB 3.21Å; L396-S400 PolarHBondContact O-N 3.43Å; L396-L603 HydrophobicContact CD1-CD2 3.94Å; L396-F606 HydrophobicContact CD1-CD2 3.78Å; L396-F606 HydrophobicContact CD1-CE2 3.78Å; L396-F606 HydrophobicContact CD2-CE2 4.01Å; L396-F606 HydrophobicContact CD2-CZ 4.44Å; L396-F606 HydrophobicContact CG-CD2 4.33Å; L396-F606 HydrophobicContact CG-CE2 3.83Å; L396-A609 HydrophobicContact CD1-CB 4.13Å; L396-L610 HydrophobicContact CD2-CB 3.94Å; L396-L610 HydrophobicContact CD2-CD1 3.8Å
397	Q	94.6	Very high	93.5	Very high	78 Å²	78	25.3 Å²	25.3	36%	0.364	12%	0.117	S	C	.	.	H	α-helix	trans	-63.1	-38.6	176.2	-73.2	175.3	-12.4	0	0	112.2	L255 L393 R394 G395 K401	L255-Q397 HydrophobicContact CD1-CG 3.8Å; L393-Q397 HydrophobicContact CD1-CG 4.3Å; L393-Q397 WeakPolarHBondContact O-CB 3.39Å; L393-Q397 VanDerWaalsContact O-CG 3.3Å; L393-Q397 WeakPolarHBondContact O-CG 3.34Å; L393-Q397 PolarHBondContact O-N 3.01Å; R394-Q397 PolarHBondContact O-N 2.83Å; G395-Q397 PolarHBondContact O-N 3.16Å; Q397-K401 WeakPolarHBondContact O-CB 3.43Å; Q397-K401 PolarHBondContact O-N 3.04Å
398	L	94.8	Very high	93.4	Very high	20 Å²	20	21 Å²	21	11%	0.105	10%	0.097	C	C	.	.	H	α-helix	trans	-68.3	-47.2	178.7	-173	63.5	0	0	0	111.5	D354 F358 R394 G395 L396 S400 K401 W402 L459	D354-L398 HydrophobicContact CB-CD1 3.86Å; F358-L398 HydrophobicContact CB-CD2 3.76Å; F358-L398 HydrophobicContact CD1-CD2 4.14Å; F358-L398 HydrophobicContact CG-CD2 3.91Å; R394-L398 WeakPolarHBondContact O-CB 3.4Å; R394-L398 PolarHBondContact O-N 3.17Å; G395-L398 PolarHBondContact O-N 2.84Å; L396-L398 VanDerWaalsContact C-N 3.32Å; L396-L398 PolarHBondContact O-N 3.33Å; L398-S400 VanDerWaalsContact C-N 3.35Å; L398-S400 PolarHBondContact O-N 3.25Å; L398-K401 WeakPolarHBondContact O-CB 3.45Å; L398-K401 PolarHBondContact O-N 2.58Å; L398-W402 HydrophobicContact CD1-CH2 4.49Å; L398-W402 HydrophobicContact CD1-CZ2 3.61Å; L398-W402 HydrophobicContact CD2-CH2 3.57Å; L398-W402 HydrophobicContact CD2-CZ2 3.45Å; L398-W402 VanDerWaalsContact CD2-CZ2 3.45Å; L398-W402 HydrophobicContact CD2-CZ3 4.44Å; L398-W402 HydrophobicContact CG-CD2 4.21Å; L398-W402 HydrophobicContact CG-CH2 3.78Å; L398-W402 HydrophobicContact CG-CZ2 3.37Å; L398-W402 HydrophobicContact CG-CZ3 4.36Å; L398-W402 PolarHBondContact O-N 2.81Å; L398-W402 VanDerWaalsContact O-N 3.08Å; L398-L459 HydrophobicContact CD2-CD2 4.22Å
399	L	95.3	Very high	93.4	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-57.7	-47.8	174	-73.2	167.3	0	0	0	111.3	G395 L396 K401 W402 S403 I456 L459 M463 L610 C613	G395-L399 WeakPolarHBondContact O-CG 3.27Å; G395-L399 PolarHBondContact O-N 3.29Å; L396-L399 PolarHBondContact O-N 3.38Å; L399-K401 VanDerWaalsContact C-N 3.34Å; L399-K401 PolarHBondContact O-N 2.96Å; L399-W402 HydrophobicContact CD2-CE3 4.33Å; L399-W402 HydrophobicContact CD2-CZ3 4.44Å; L399-W402 PolarHBondContact O-N 3.03Å; L399-S403 PolarHBondContact O-N 2.58Å; L399-S403 PolarHBondContact O-OG 2.99Å; L399-S403 VanDerWaalsContact O-OG 3.1Å; L399-I456 HydrophobicContact CD2-CB 4.44Å; L399-I456 HydrophobicContact CD2-CG2 4.19Å; L399-I456 WeakPolarHBondContact CD2-O 3.43Å; L399-L459 HydrophobicContact CD1-CD2 4.43Å; L399-L459 HydrophobicContact CD1-CG 4.31Å; L399-L459 HydrophobicContact CD2-CB 3.86Å; L399-L459 HydrophobicContact CD2-CD2 3.79Å; L399-L459 HydrophobicContact CD2-CG 3.88Å; L399-L459 HydrophobicContact CG-CD2 3.85Å; L399-L459 HydrophobicContact CG-CG 4.15Å; L399-M463 HydrophobicContact CD1-CG 4.22Å; L399-L610 HydrophobicContact CD1-CD1 3.47Å; L399-L610 VanDerWaalsContact CD1-CD1 3.47Å; L399-C613 HydrophobicContact CB-CB 4.22Å
400	S	95.4	Very high	93.4	Very high	6 Å²	6	20.5 Å²	20.5	4%	0.042	10%	0.095	C	C	.	.	H	α-helix	trans	-58.5	-43.8	176.8	-179.6	0	0	0	0	112.5	L255 P257 L396 L398 W402 T404	L255-S400 WeakPolarHBondContact O-CB 3.37Å; L255-S400 PolarHBondContact O-OG 3.26Å; P257-S400 WeakPolarHBondContact CD-OG 3.34Å; L396-S400 VanDerWaalsContact O-CB 3.25Å; L396-S400 WeakPolarHBondContact O-CB 3.21Å; L396-S400 PolarHBondContact O-N 3.43Å; L398-S400 VanDerWaalsContact C-N 3.35Å; L398-S400 PolarHBondContact O-N 3.25Å; S400-W402 VanDerWaalsContact C-N 3.34Å; S400-W402 PolarHBondContact O-N 2.89Å; S400-T404 WeakPolarHBondContact O-CB 3.43Å; S400-T404 PolarHBondContact O-N 3.38Å; S400-T404 PolarHBondContact O-OG1 3.32Å
401	K	92.5	Very high	93.3	Very high	82 Å²	82	17.4 Å²	17.4	36%	0.357	8%	0.079	S	C	.	.	H	α-helix	trans	-58.4	-46	176.3	179.9	-173.4	172.1	-165.8	0	111.2	D354 Q397 L398 L399 T404 H405	D354-K401 IonicContact OD2-NZ 3Å; D354-K401 PolarHBondContact OD2-NZ 3.25Å; Q397-K401 WeakPolarHBondContact O-CB 3.43Å; Q397-K401 PolarHBondContact O-N 3.04Å; L398-K401 WeakPolarHBondContact O-CB 3.45Å; L398-K401 PolarHBondContact O-N 2.58Å; L399-K401 VanDerWaalsContact C-N 3.34Å; L399-K401 PolarHBondContact O-N 2.96Å; K401-T404 WeakPolarHBondContact O-CB 3Å; K401-H405 PolarHBondContact O-CD2 3.25Å; K401-H405 PolarHBondContact O-N 3.32Å; K401-H405 VanDerWaalsContact O-N 3.12Å
402	W	94.5	Very high	93.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-67.9	-47.9	-179.9	-60.8	-19	0	0	0	112.5	I351 D354 H355 L398 L399 S400 T404 H405 V406 V452 M455 I456 L459	I351-W402 HydrophobicContact CG2-CD2 4.36Å; I351-W402 HydrophobicContact CG2-CG 4.36Å; I351-W402 HydrophobicContact CG2-CZ2 4.38Å; D354-W402 HydrophobicContact CB-CZ2 4.42Å; H355-W402 HydrophobicContact CB-CH2 3.65Å; H355-W402 HydrophobicContact CB-CZ2 3.81Å; H355-W402 AromaticContact CD2-CH2 3.64Å; L398-W402 HydrophobicContact CD1-CH2 4.49Å; L398-W402 HydrophobicContact CD1-CZ2 3.61Å; L398-W402 HydrophobicContact CD2-CH2 3.57Å; L398-W402 HydrophobicContact CD2-CZ2 3.45Å; L398-W402 VanDerWaalsContact CD2-CZ2 3.45Å; L398-W402 HydrophobicContact CD2-CZ3 4.44Å; L398-W402 HydrophobicContact CG-CD2 4.21Å; L398-W402 HydrophobicContact CG-CH2 3.78Å; L398-W402 HydrophobicContact CG-CZ2 3.37Å; L398-W402 HydrophobicContact CG-CZ3 4.36Å; L398-W402 PolarHBondContact O-N 2.81Å; L398-W402 VanDerWaalsContact O-N 3.08Å; L399-W402 HydrophobicContact CD2-CE3 4.33Å; L399-W402 HydrophobicContact CD2-CZ3 4.44Å; L399-W402 PolarHBondContact O-N 3.03Å; S400-W402 VanDerWaalsContact C-N 3.34Å; S400-W402 PolarHBondContact O-N 2.89Å; W402-T404 VanDerWaalsContact C-N 3.25Å; W402-T404 PolarHBondContact O-N 3.47Å; W402-H405 WeakPolarHBondContact O-CB 3.34Å; W402-H405 PolarHBondContact O-N 3.22Å; W402-V406 PolarHBondContact O-N 3.24Å; W402-V406 VanDerWaalsContact O-N 3.11Å; W402-V452 HydrophobicContact CB-CG1 3.99Å; W402-M455 HydrophobicContact CE3-CB 4.31Å; W402-M455 HydrophobicContact CZ3-CB 4.09Å; W402-I456 HydrophobicContact CB-CD1 3.85Å; W402-I456 HydrophobicContact CB-CG1 3.6Å; W402-I456 HydrophobicContact CE3-CG1 4.03Å; W402-L459 HydrophobicContact CH2-CD2 3.94Å; W402-L459 HydrophobicContact CZ3-CB 4.27Å; W402-L459 HydrophobicContact CZ3-CD2 3.65Å
403	S	94.5	Very high	93	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.9	-39.5	176.8	-56.4	0	0	0	0	111.5	L399 H405 V406 M407 C613	L399-S403 PolarHBondContact O-N 2.58Å; L399-S403 PolarHBondContact O-OG 2.99Å; L399-S403 VanDerWaalsContact O-OG 3.1Å; S403-H405 VanDerWaalsContact C-N 3.34Å; S403-H405 PolarHBondContact O-N 3.42Å; S403-V406 PolarHBondContact O-N 2.84Å; S403-M407 WeakPolarHBondContact O-CG 3.21Å; S403-M407 PolarHBondContact O-N 3.26Å; S403-C613 VanDerWaalsContact CB-O 3.24Å; S403-C613 WeakPolarHBondContact CB-O 3.46Å; S403-C613 PolarHBondContact OG-O 3.16Å
404	T	91.9	Very high	92.8	Very high	4 Å²	4	19.1 Å²	19.1	3%	0.025	8%	0.084	C	C	.	.	H	α-helix	trans	-58.8	-44.1	174.1	-63.4	0	0	0	0	111.7	P257 K260 S400 K401 W402 M407 E408	P257-T404 WeakPolarHBondContact CB-OG1 3.39Å; P257-T404 WeakPolarHBondContact CG-OG1 3.34Å; K260-T404 HydrophobicContact CD-CG2 3.82Å; K260-T404 VanDerWaalsContact NZ-CG2 3.26Å; S400-T404 WeakPolarHBondContact O-CB 3.43Å; S400-T404 PolarHBondContact O-N 3.38Å; S400-T404 PolarHBondContact O-OG1 3.32Å; K401-T404 WeakPolarHBondContact O-CB 3Å; W402-T404 VanDerWaalsContact C-N 3.25Å; W402-T404 PolarHBondContact O-N 3.47Å; T404-M407 PolarHBondContact O-N 3.35Å; T404-E408 VanDerWaalsContact CG2-CD 3.43Å; T404-E408 HydrophobicContact CG2-CG 4.11Å; T404-E408 WeakPolarHBondContact CG2-OE1 3.35Å; T404-E408 VanDerWaalsContact O-CB 3.27Å; T404-E408 WeakPolarHBondContact O-CB 3.45Å; T404-E408 WeakPolarHBondContact O-CG 3.24Å; T404-E408 PolarHBondContact O-N 3.02Å
405	H	89.6	Confident	92.6	Very high	23 Å²	23	17 Å²	17	11%	0.106	8%	0.082	C	C	.	.	H	α-helix	trans	-63.4	-43.9	177.6	-72.4	-48.6	0	0	0	112.5	Q347 K401 W402 S403 E408 V409	Q347-H405 PolarHBondContact OE1-CE1 2.91Å; Q347-H405 PolarHBondContact OE1-ND1 3.47Å; Q347-H405 PolarHBondContact OE1-NE2 3.38Å; K401-H405 PolarHBondContact O-CD2 3.25Å; K401-H405 PolarHBondContact O-N 3.32Å; K401-H405 VanDerWaalsContact O-N 3.12Å; W402-H405 WeakPolarHBondContact O-CB 3.34Å; W402-H405 PolarHBondContact O-N 3.22Å; S403-H405 VanDerWaalsContact C-N 3.34Å; S403-H405 PolarHBondContact O-N 3.42Å; H405-E408 PolarHBondContact O-N 2.78Å; H405-V409 WeakPolarHBondContact O-CG2 3.48Å; H405-V409 PolarHBondContact O-N 2.95Å
406	V	92.8	Very high	92.4	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.006	10%	0.096	C	C	.	.	H	α-helix	trans	-61	-48	177.6	-179.4	0	0	0	0	110.4	W402 S403 Y410 L449 V452 I453 I456 L616	W402-V406 PolarHBondContact O-N 3.24Å; W402-V406 VanDerWaalsContact O-N 3.11Å; S403-V406 PolarHBondContact O-N 2.84Å; V406-Y410 WeakPolarHBondContact O-CB 3.31Å; V406-Y410 PolarHBondContact O-N 2.86Å; V406-L449 HydrophobicContact CG1-CD2 4Å; V406-V452 HydrophobicContact CG2-CB 4.05Å; V406-V452 HydrophobicContact CG2-CG1 3.5Å; V406-I453 HydrophobicContact CG1-CD1 4.49Å; V406-I453 HydrophobicContact CG1-CG1 4.34Å; V406-I456 HydrophobicContact CG2-CD1 4.18Å; V406-L616 HydrophobicContact CB-CD2 4.2Å; V406-L616 HydrophobicContact CG1-CD2 4.11Å
407	M	91.7	Very high	92.1	Very high	14 Å²	14	21.6 Å²	21.6	7%	0.069	11%	0.106	C	C	.	.	H	α-helix	trans	-67.8	-40.2	-179.4	-66.2	-56.1	87.9	0	0	112.8	S403 T404 Y410 S411 L616 L619	S403-M407 WeakPolarHBondContact O-CG 3.21Å; S403-M407 PolarHBondContact O-N 3.26Å; T404-M407 PolarHBondContact O-N 3.35Å; M407-Y410 PolarHBondContact O-N 3.4Å; M407-S411 WeakPolarHBondContact O-CB 3.32Å; M407-S411 PolarHBondContact O-N 3.01Å; M407-S411 PolarHBondContact O-OG 3.2Å; M407-L616 HydrophobicContact CE-CD2 3.6Å; M407-L616 HydrophobicContact SD-CD2 4.43Å; M407-L619 HydrophobicContact CE-CD1 3.98Å; M407-L619 HydrophobicContact CE-CD2 3.54Å; M407-L619 HydrophobicContact CE-CG 3.68Å
408	E	90	Very high	91.9	Very high	3 Å²	3	18.4 Å²	18.4	1%	0.014	9%	0.093	C	C	.	.	H	α-helix	trans	-64.6	-41	177.9	-75.7	173.2	-176	0	0	111.9	K260 H261 L301 Q341 T404 H405 W412	K260-E408 IonicContact NZ-OE1 3.27Å; K260-E408 PolarHBondContact NZ-OE1 2.86Å; K260-E408 IonicContact NZ-OE2 3.72Å; H261-E408 IonicContact CD2-OE1 2.71Å; H261-E408 IonicContact NE2-OE1 3.05Å; H261-E408 PolarHBondContact NE2-OE1 2.72Å; L301-E408 HydrophobicContact CD1-CB 4.44Å; L301-E408 HydrophobicContact CD1-CG 4.13Å; L301-E408 WeakPolarHBondContact CD2-OE1 3.21Å; Q341-E408 PolarHBondContact NE2-OE2 3.29Å; T404-E408 VanDerWaalsContact CG2-CD 3.43Å; T404-E408 HydrophobicContact CG2-CG 4.11Å; T404-E408 WeakPolarHBondContact CG2-OE1 3.35Å; T404-E408 VanDerWaalsContact O-CB 3.27Å; T404-E408 WeakPolarHBondContact O-CB 3.45Å; T404-E408 WeakPolarHBondContact O-CG 3.24Å; T404-E408 PolarHBondContact O-N 3.02Å; H405-E408 PolarHBondContact O-N 2.78Å; E408-W412 WeakPolarHBondContact O-CB 3.35Å; E408-W412 PolarHBondContact O-N 3.31Å
409	V	90.4	Very high	91.6	Very high	6 Å²	6	20.2 Å²	20.2	4%	0.036	10%	0.102	C	C	.	.	H	α-helix	trans	-64.2	-45.1	174.4	170.9	0	0	0	0	110.7	H405 W412 K413 Y441	H405-V409 WeakPolarHBondContact O-CG2 3.48Å; H405-V409 PolarHBondContact O-N 2.95Å; V409-W412 PolarHBondContact O-N 3.35Å; V409-K413 WeakPolarHBondContact O-CG 3.47Å; V409-K413 PolarHBondContact O-N 3.48Å; V409-K413 VanDerWaalsContact O-N 3.13Å; V409-Y441 HydrophobicContact CG1-CE1 4.36Å
410	Y	92.1	Very high	91.3	Very high	6 Å²	6	26.2 Å²	26.2	2%	0.024	13%	0.128	C	C	.	.	H	α-helix	trans	-60.8	-50.8	176.6	174.3	-115.5	0	0	0	112.4	V406 M407 W412 K413 L414 L619 M642	V406-Y410 WeakPolarHBondContact O-CB 3.31Å; V406-Y410 PolarHBondContact O-N 2.86Å; M407-Y410 PolarHBondContact O-N 3.4Å; Y410-W412 VanDerWaalsContact C-N 3.31Å; Y410-W412 PolarHBondContact O-N 3.19Å; Y410-K413 PolarHBondContact O-N 2.93Å; Y410-L414 HydrophobicContact CD1-CD1 4.19Å; Y410-L414 HydrophobicContact CD2-CG 4.33Å; Y410-L414 HydrophobicContact CE1-CD1 3.6Å; Y410-L414 HydrophobicContact CE1-CG 4.33Å; Y410-L414 HydrophobicContact CE2-CD1 4.03Å; Y410-L414 HydrophobicContact CE2-CD2 3.9Å; Y410-L414 HydrophobicContact CE2-CG 3.92Å; Y410-L414 PolarHBondContact O-N 3.08Å; Y410-L619 HydrophobicContact CD1-CD2 3.69Å; Y410-L619 HydrophobicContact CD2-CD2 3.78Å; Y410-L619 HydrophobicContact CE1-CD2 4.05Å; Y410-L619 HydrophobicContact CE2-CD2 4.16Å; Y410-L619 HydrophobicContact CG-CD2 3.52Å; Y410-M642 HydrophobicContact CD2-CE 4.46Å; Y410-M642 HydrophobicContact CD2-CG 4.23Å; Y410-M642 HydrophobicContact CE2-CG 3.66Å; Y410-M642 HydrophobicContact CE2-SD 4.34Å
411	S	91.6	Very high	90.8	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.007	16%	0.16	C	C	.	.	H	α-helix	trans	-55.4	-45	176.8	-76.1	0	0	0	0	112.4	P305 Q311 M407 K413 L414 V415	P305-S411 WeakPolarHBondContact CD-OG 3.46Å; P305-S411 WeakPolarHBondContact CG-OG 3.49Å; Q311-S411 VanDerWaalsContact OE1-CB 3.25Å; Q311-S411 PolarHBondContact OE1-OG 2.92Å; M407-S411 WeakPolarHBondContact O-CB 3.32Å; M407-S411 PolarHBondContact O-N 3.01Å; M407-S411 PolarHBondContact O-OG 3.2Å; S411-K413 VanDerWaalsContact C-N 3.34Å; S411-K413 PolarHBondContact O-N 3.47Å; S411-L414 PolarHBondContact O-N 3.3Å; S411-V415 PolarHBondContact O-N 3.01Å
412	W	90.3	Very high	90.4	Very high	35 Å²	35	35 Å²	35	13%	0.133	18%	0.178	C	C	.	.	H	α-helix	trans	-64	-40.3	-179.7	-174.5	86.9	0	0	0	112.2	Y342 E408 V409 Y410 V415 H416	Y342-W412 HydrophobicContact CD1-CB 3.73Å; Y342-W412 AromaticContact CD1-CG 3.82Å; Y342-W412 HydrophobicContact CD1-CG 3.82Å; Y342-W412 AromaticContact CD2-CD1 3.8Å; Y342-W412 HydrophobicContact CD2-CD2 4.34Å; Y342-W412 HydrophobicContact CD2-CG 4.09Å; Y342-W412 AromaticContact CD2-NE1 3.84Å; Y342-W412 HydrophobicContact CE1-CB 3.6Å; Y342-W412 AromaticContact CE1-CD1 3.72Å; Y342-W412 AromaticContact CE1-CG 3.77Å; Y342-W412 HydrophobicContact CE1-CG 3.77Å; Y342-W412 AromaticContact CE2-CD1 3.36Å; Y342-W412 HydrophobicContact CE2-CG 4.02Å; Y342-W412 AromaticContact CE2-NE1 3.59Å; Y342-W412 HydrophobicContact CG-CB 4.36Å; Y342-W412 HydrophobicContact CG-CD2 4.26Å; Y342-W412 AromaticContact CG-CG 3.98Å; Y342-W412 HydrophobicContact CG-CG 3.98Å; Y342-W412 AromaticContact CZ-CD1 3.3Å; Y342-W412 AromaticContact CZ-CG 3.84Å; E408-W412 WeakPolarHBondContact O-CB 3.35Å; E408-W412 PolarHBondContact O-N 3.31Å; V409-W412 PolarHBondContact O-N 3.35Å; Y410-W412 VanDerWaalsContact C-N 3.31Å; Y410-W412 PolarHBondContact O-N 3.19Å; W412-V415 WeakPolarHBondContact O-CG2 3.32Å; W412-V415 PolarHBondContact O-N 3.37Å; W412-H416 AromaticContact CD1-CE1 3.68Å; W412-H416 AromaticContact CD1-ND1 3.6Å; W412-H416 AromaticContact CD2-ND1 3.66Å; W412-H416 AromaticContact CE2-CE1 3.76Å; W412-H416 AromaticContact CE2-CG 3.95Å; W412-H416 AromaticContact CE2-ND1 3.37Å; W412-H416 HydrophobicContact CE3-CB 4.5Å; W412-H416 AromaticContact CG-ND1 3.82Å; W412-H416 HydrophobicContact CH2-CB 4.24Å; W412-H416 HydrophobicContact CZ2-CB 4.33Å; W412-H416 AromaticContact CZ2-CG 3.98Å; W412-H416 AromaticContact CZ2-ND1 3.88Å; W412-H416 HydrophobicContact CZ3-CB 4.32Å; W412-H416 AromaticContact NE1-CE1 3.3Å; W412-H416 PolarHBondContact NE1-CE1 3.24Å; W412-H416 VanDerWaalsContact NE1-CE1 3.3Å; W412-H416 AromaticContact NE1-ND1 3.35Å; W412-H416 PolarHBondContact NE1-ND1 2.88Å; W412-H416 WeakPolarHBondContact O-CB 3.37Å; W412-H416 PolarHBondContact O-N 3.45Å; W412-H416 VanDerWaalsContact O-N 3.14Å; W412-H416 PolarHBondContact O-ND1 2.83Å
413	K	90.8	Very high	90.1	Very high	19 Å²	19	36.8 Å²	36.8	8%	0.083	19%	0.188	C	C	.	.	H	α-helix	trans	-68.7	-32.6	178.2	-66.1	-80.3	-177.2	163.1	0	112.3	V409 Y410 S411 V415 H416 N440 Y441 E445	V409-K413 WeakPolarHBondContact O-CG 3.47Å; V409-K413 PolarHBondContact O-N 3.48Å; V409-K413 VanDerWaalsContact O-N 3.13Å; Y410-K413 PolarHBondContact O-N 2.93Å; S411-K413 VanDerWaalsContact C-N 3.34Å; S411-K413 PolarHBondContact O-N 3.47Å; K413-V415 PolarHBondContact O-N 2.94Å; K413-H416 CarbonylContact O-C 3.58Å; K413-H416 PolarHBondContact O-N 2.86Å; K413-N440 HydrophobicContact CD-CB 4.14Å; K413-N440 WeakPolarHBondContact CD-O 3.36Å; K413-N440 PolarHBondContact NZ-O 3.05Å; K413-N440 PolarHBondContact O-ND2 3.49Å; K413-Y441 HydrophobicContact CD-CE1 4.42Å; K413-Y441 HydrophobicContact CG-CE1 3.92Å; K413-E445 IonicContact NZ-OE1 3.96Å; K413-E445 PolarHBondContact NZ-OE1 3.04Å; K413-E445 IonicContact NZ-OE2 3.17Å
414	L	92.4	Very high	89.9	Confident	5 Å²	5	46 Å²	46	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-63.7	-38	176.9	-74.8	-176.4	0	0	0	113.3	D309 Q311 Y410 S411 Y433 A436 T437 F625	D309-L414 HydrophobicContact CB-CD1 4.42Å; Q311-L414 HydrophobicContact CG-CB 3.99Å; Q311-L414 HydrophobicContact CG-CD1 3.99Å; Y410-L414 HydrophobicContact CD1-CD1 4.19Å; Y410-L414 HydrophobicContact CD2-CG 4.33Å; Y410-L414 HydrophobicContact CE1-CD1 3.6Å; Y410-L414 HydrophobicContact CE1-CG 4.33Å; Y410-L414 HydrophobicContact CE2-CD1 4.03Å; Y410-L414 HydrophobicContact CE2-CD2 3.9Å; Y410-L414 HydrophobicContact CE2-CG 3.92Å; Y410-L414 PolarHBondContact O-N 3.08Å; S411-L414 PolarHBondContact O-N 3.3Å; L414-Y433 HydrophobicContact CD2-CE2 4.12Å; L414-A436 HydrophobicContact CD2-CB 4.17Å; L414-T437 HydrophobicContact CD2-CG2 4.11Å; L414-F625 HydrophobicContact CB-CE2 4.34Å; L414-F625 HydrophobicContact CB-CZ 4.39Å; L414-F625 HydrophobicContact CD1-CE2 4.32Å; L414-F625 HydrophobicContact CD2-CE2 3.84Å; L414-F625 HydrophobicContact CD2-CZ 4.27Å; L414-F625 HydrophobicContact CG-CE2 4.39Å
415	V	89.9	Confident	89.7	Confident	55 Å²	55	52.2 Å²	52.2	33%	0.333	26%	0.261	S	S	.	.	H	α-helix	trans	-89.1	-16.2	179.5	-55.2	0	0	0	0	113.4	V303 Q311 S411 W412 K413 P417	V303-V415 HydrophobicContact CB-CG2 4.26Å; V303-V415 HydrophobicContact CG1-CG1 3.99Å; V303-V415 HydrophobicContact CG1-CG2 3.76Å; V303-V415 HydrophobicContact CG2-CG2 3.52Å; Q311-V415 HydrophobicContact CB-CG1 3.53Å; Q311-V415 HydrophobicContact CG-CG1 4Å; S411-V415 PolarHBondContact O-N 3.01Å; W412-V415 WeakPolarHBondContact O-CG2 3.32Å; W412-V415 PolarHBondContact O-N 3.37Å; K413-V415 PolarHBondContact O-N 2.94Å; V415-P417 WeakPolarHBondContact O-CD 3.17Å
416	H	88.9	Confident	89.8	Confident	60 Å²	60	51.3 Å²	51.3	28%	0.278	26%	0.257	S	S	.	.	S	Bend	trans	-114	70	175	-59.6	96.4	0	0	0	110.9	W412 K413 N440	W412-H416 AromaticContact CD1-CE1 3.68Å; W412-H416 AromaticContact CD1-ND1 3.6Å; W412-H416 AromaticContact CD2-ND1 3.66Å; W412-H416 AromaticContact CE2-CE1 3.76Å; W412-H416 AromaticContact CE2-CG 3.95Å; W412-H416 AromaticContact CE2-ND1 3.37Å; W412-H416 HydrophobicContact CE3-CB 4.5Å; W412-H416 AromaticContact CG-ND1 3.82Å; W412-H416 HydrophobicContact CH2-CB 4.24Å; W412-H416 HydrophobicContact CZ2-CB 4.33Å; W412-H416 AromaticContact CZ2-CG 3.98Å; W412-H416 AromaticContact CZ2-ND1 3.88Å; W412-H416 HydrophobicContact CZ3-CB 4.32Å; W412-H416 AromaticContact NE1-CE1 3.3Å; W412-H416 PolarHBondContact NE1-CE1 3.24Å; W412-H416 VanDerWaalsContact NE1-CE1 3.3Å; W412-H416 AromaticContact NE1-ND1 3.35Å; W412-H416 PolarHBondContact NE1-ND1 2.88Å; W412-H416 WeakPolarHBondContact O-CB 3.37Å; W412-H416 PolarHBondContact O-N 3.45Å; W412-H416 VanDerWaalsContact O-N 3.14Å; W412-H416 PolarHBondContact O-ND1 2.83Å; K413-H416 CarbonylContact O-C 3.58Å; K413-H416 PolarHBondContact O-N 2.86Å; H416-N440 PolarHBondContact O-ND2 3.19Å
417	P	90.1	Very high	89.7	Confident	35 Å²	35	53.7 Å²	53.7	23%	0.227	27%	0.273	C	S	.	.			trans	-62.1	139.8	177.1	26.9	-34	0	0	0	110.4	V415 E432 R435 A436	V415-P417 WeakPolarHBondContact O-CD 3.17Å; P417-E432 HydrophobicContact CG-CG 4.3Å; P417-R435 HydrophobicContact CB-CB 3.93Å; P417-A436 HydrophobicContact CB-CB 4.22Å
418	T	90	Very high	89.4	Confident	12 Å²	12	56.4 Å²	56.4	7%	0.074	31%	0.305	C	S	.	.			trans	-69.2	171.1	178.7	-155.5	0	0	0	0	111.7	N423 C426 R435	T418-N423 HydrophobicContact CG2-CB 4.24Å; T418-C426 HydrophobicContact CG2-CB 4.11Å; T418-R435 HydrophobicContact CG2-CB 4.46Å; T418-R435 PolarHBondContact N-O 3.16Å; T418-R435 WeakPolarHBondContact O-CB 3.38Å; T418-R435 WeakPolarHBondContact O-CD 3.3Å; T418-R435 PolarHBondContact O-NH1 3.42Å
419	D	88.9	Confident	89.5	Confident	57 Å²	57	62.9 Å²	62.9	31%	0.305	34%	0.344	S	S	.	.			trans	-144	179.4	173.9	67.6	20.9	0	0	0	111	F421 C422 N423	D419-F421 PolarHBondContact O-N 3.04Å; D419-F421 VanDerWaalsContact O-N 3.16Å; D419-F421 WeakPolarHBondContact OD1-CA 3.18Å; D419-F421 WeakPolarHBondContact OD1-CB 3.3Å; D419-F421 PolarHBondContact OD1-N 2.89Å; D419-F421 WeakPolarHBondContact OD2-CD2 3.45Å; D419-C422 PolarHBondContact O-N 3.3Å; D419-C422 PolarHBondContact OD1-N 3.27Å; D419-N423 PolarHBondContact O-N 2.98Å
420	K	88.2	Confident	89.5	Confident	126 Å²	126	63.2 Å²	63.2	55%	0.548	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.8	178.8	66.3	-178.8	-179.7	-178.5	0	114.5	N423	K420-N423 WeakPolarHBondContact CA-O 3.39Å
421	F	86.3	Confident	89.5	Confident	164 Å²	164	64.6 Å²	64.6	72%	0.719	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-40.5	-179.2	-56.9	-75	0	0	0	110.4	D419	D419-F421 PolarHBondContact O-N 3.04Å; D419-F421 VanDerWaalsContact O-N 3.16Å; D419-F421 WeakPolarHBondContact OD1-CA 3.18Å; D419-F421 WeakPolarHBondContact OD1-CB 3.3Å; D419-F421 PolarHBondContact OD1-N 2.89Å; D419-F421 WeakPolarHBondContact OD2-CD2 3.45Å
422	C	83.3	Confident	89.6	Confident	108 Å²	108	69.2 Å²	69.2	73%	0.73	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-38.9	175.9	-67.2	0	0	0	0	112.7	D419	D419-C422 PolarHBondContact O-N 3.3Å; D419-C422 PolarHBondContact OD1-N 3.27Å
423	N	88	Confident	89.8	Confident	39 Å²	39	67.7 Å²	67.7	21%	0.209	37%	0.37	C	S	.	.			trans	-128.5	115.2	177.5	-174.2	-10.2	0	0	0	110.9	T418 D419 K420 D425 C426 Y439	T418-N423 HydrophobicContact CG2-CB 4.24Å; D419-N423 PolarHBondContact O-N 2.98Å; K420-N423 WeakPolarHBondContact CA-O 3.39Å; N423-D425 PolarHBondContact O-N 3.25Å; N423-D425 PolarHBondContact OD1-N 2.81Å; N423-C426 HydrophobicContact CB-CB 4.11Å; N423-C426 WeakPolarHBondContact O-CB 3.35Å; N423-C426 PolarHBondContact O-N 3.43Å; N423-Y439 PolarHBondContact ND2-O 3.15Å
424	K	89.5	Confident	90	Very high	194 Å²	194	67.9 Å²	67.9	84%	0.843	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-26	-178.7	-66.2	-177.1	-178.5	175.7	0	113.5	C426	K424-C426 VanDerWaalsContact C-N 3.29Å
425	D	89.5	Confident	90	Very high	133 Å²	133	70.6 Å²	70.6	71%	0.711	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-8.1	-179.4	-59.4	-34.6	0	0	0	112.1	N423 P427	N423-D425 PolarHBondContact O-N 3.25Å; N423-D425 PolarHBondContact OD1-N 2.81Å; D425-P427 VanDerWaalsContact O-CD 3.3Å; D425-P427 WeakPolarHBondContact O-CD 3.28Å
426	C	90.6	Very high	90.1	Very high	4 Å²	4	68 Å²	68	3%	0.027	37%	0.366	C	S	.	.	S	Bend	trans	-80	116.5	178.1	-178.1	0	0	0	0	111.3	T418 N423 K424 Y439	T418-C426 HydrophobicContact CG2-CB 4.11Å; N423-C426 HydrophobicContact CB-CB 4.11Å; N423-C426 WeakPolarHBondContact O-CB 3.35Å; N423-C426 PolarHBondContact O-N 3.43Å; K424-C426 VanDerWaalsContact C-N 3.29Å; C426-Y439 HydrophobicContact CB-CD1 4.43Å; C426-Y439 HydrophobicContact CB-CG 4.2Å
427	P	91.4	Very high	90.4	Very high	51 Å²	51	65.1 Å²	65.1	33%	0.331	35%	0.352	S	S	.	.			trans	-65.1	143.5	175.6	-19.2	32.5	0	0	0	111.9	D425 T429 A430	D425-P427 VanDerWaalsContact O-CD 3.3Å; D425-P427 WeakPolarHBondContact O-CD 3.28Å; P427-T429 PolarHBondContact O-N 3.44Å; P427-T429 VanDerWaalsContact O-N 3.16Å; P427-A430 HydrophobicContact CB-CB 4.44Å; P427-A430 WeakPolarHBondContact O-CB 3.4Å; P427-A430 PolarHBondContact O-N 3.01Å
428	G	86	Confident	90.5	Very high	72 Å²	72	67.2 Å²	67.2	74%	0.742	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-13.8	174.1	0	0	0	0	0	114.3
429	T	90.2	Very high	90.7	Very high	138 Å²	138	68.6 Å²	68.6	85%	0.847	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-3.5	178.3	53.6	0	0	0	0	113.6	P427	P427-T429 PolarHBondContact O-N 3.44Å; P427-T429 VanDerWaalsContact O-N 3.16Å
430	A	90.9	Very high	90.9	Very high	13 Å²	13	66.7 Å²	66.7	11%	0.107	35%	0.35	C	S	.	.			trans	-64.6	136.6	-177.8	0	0	0	0	0	111	P427 R435 Y439	P427-A430 HydrophobicContact CB-CB 4.44Å; P427-A430 WeakPolarHBondContact O-CB 3.4Å; P427-A430 PolarHBondContact O-N 3.01Å; A430-R435 HydrophobicContact CB-CG 3.69Å; A430-R435 PolarHBondContact O-NE 3.34Å; A430-Y439 HydrophobicContact CB-CD2 4.44Å; A430-Y439 HydrophobicContact CB-CE2 4.16Å
431	E	93.4	Very high	91.1	Very high	36 Å²	36	61.2 Å²	61.2	17%	0.168	33%	0.325	C	S	.	.			trans	-68.5	158.2	179.1	65.7	-169	132.6	0	0	111.4	Y433 E434 R435 R633 M640	E431-Y433 VanDerWaalsContact C-N 3.34Å; E431-Y433 PolarHBondContact O-N 3.38Å; E431-E434 HydrophobicContact CG-CB 3.98Å; E431-E434 PolarHBondContact O-N 3.26Å; E431-R435 WeakPolarHBondContact O-CG 3.34Å; E431-R435 PolarHBondContact O-N 3.48Å; E431-R633 IonicContact OE1-CZ 3.41Å; E431-R633 VanDerWaalsContact OE1-CZ 3.29Å; E431-R633 IonicContact OE1-NE 3.9Å; E431-R633 PolarHBondContact OE1-NE 3.15Å; E431-R633 VanDerWaalsContact OE1-NE 3.16Å; E431-R633 IonicContact OE1-NH2 3.64Å; E431-R633 PolarHBondContact OE1-NH2 3.36Å; E431-R633 IonicContact OE2-NE 3.68Å; E431-R633 PolarHBondContact OE2-NE 3.03Å; E431-M640 HydrophobicContact CG-CE 4.08Å; E431-M640 HydrophobicContact CG-SD 4.27Å; E431-M640 WeakPolarHBondContact OE1-CE 3.22Å
432	E	93	Very high	91.4	Very high	98 Å²	98	57.3 Å²	57.3	46%	0.458	32%	0.315	S	S	.	.	H	α-helix	trans	-58.7	-43.4	-171.1	-172.6	169.9	-157.7	0	0	113	P417 E434 R435 A436 F625	P417-E432 HydrophobicContact CG-CG 4.3Å; E432-E434 PolarHBondContact O-N 3.2Å; E432-R435 CarbonylContact O-C 3.1Å; E432-R435 PolarHBondContact O-N 3.42Å; E432-A436 WeakPolarHBondContact O-CB 3.41Å; E432-A436 PolarHBondContact O-N 3.35Å; E432-F625 HydrophobicContact CG-CE1 4.39Å
433	Y	94.6	Very high	91.9	Very high	3 Å²	3	54.4 Å²	54.4	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-64.9	-38.4	178.4	-171.1	-114.9	0	0	0	112.7	L414 E431 R435 A436 T437 R622 F625 F636 M640	L414-Y433 HydrophobicContact CD2-CE2 4.12Å; E431-Y433 VanDerWaalsContact C-N 3.34Å; E431-Y433 PolarHBondContact O-N 3.38Å; Y433-R435 VanDerWaalsContact C-N 3.31Å; Y433-R435 PolarHBondContact O-N 3.11Å; Y433-A436 WeakPolarHBondContact O-CB 3.39Å; Y433-A436 PolarHBondContact O-N 2.89Å; Y433-A436 VanDerWaalsContact O-N 3.14Å; Y433-T437 HydrophobicContact CD2-CG2 4.28Å; Y433-T437 HydrophobicContact CE1-CG2 4.27Å; Y433-T437 HydrophobicContact CE2-CG2 3.79Å; Y433-T437 PolarHBondContact O-N 3.04Å; Y433-T437 PolarHBondContact O-OG1 2.91Å; Y433-T437 VanDerWaalsContact O-OG1 3.08Å; Y433-R622 HydrophobicContact CE1-CB 4.33Å; Y433-R622 HydrophobicContact CE2-CB 4.14Å; Y433-R622 WeakPolarHBondContact OH-CD 3.43Å; Y433-F625 HydrophobicContact CD2-CB 3.72Å; Y433-F625 AromaticContact CD2-CD1 3.85Å; Y433-F625 HydrophobicContact CD2-CD1 3.85Å; Y433-F625 AromaticContact CD2-CD2 3.39Å; Y433-F625 HydrophobicContact CD2-CD2 3.39Å; Y433-F625 HydrophobicContact CD2-CE1 4.31Å; Y433-F625 AromaticContact CD2-CE2 3.92Å; Y433-F625 HydrophobicContact CD2-CE2 3.92Å; Y433-F625 AromaticContact CD2-CG 3.36Å; Y433-F625 HydrophobicContact CD2-CG 3.36Å; Y433-F625 HydrophobicContact CD2-CZ 4.34Å; Y433-F625 HydrophobicContact CE2-CB 4.36Å; Y433-F625 AromaticContact CE2-CD2 3.68Å; Y433-F625 HydrophobicContact CE2-CD2 3.68Å; Y433-F625 HydrophobicContact CE2-CE2 4.2Å; Y433-F625 HydrophobicContact CE2-CG 4.08Å; Y433-F625 HydrophobicContact CG-CB 4.06Å; Y433-F625 HydrophobicContact CG-CD1 4.37Å; Y433-F625 HydrophobicContact CG-CD2 4.47Å; Y433-F625 HydrophobicContact CG-CG 4.06Å; Y433-F636 HydrophobicContact CD1-CB 4.3Å; Y433-F636 AromaticContact CD1-CD1 3.91Å; Y433-F636 HydrophobicContact CD1-CD1 3.91Å; Y433-F636 AromaticContact CD1-CD2 3.65Å; Y433-F636 HydrophobicContact CD1-CD2 3.65Å; Y433-F636 HydrophobicContact CD1-CE1 4.09Å; Y433-F636 AromaticContact CD1-CE2 3.81Å; Y433-F636 HydrophobicContact CD1-CE2 3.81Å; Y433-F636 AromaticContact CD1-CG 3.69Å; Y433-F636 HydrophobicContact CD1-CG 3.69Å; Y433-F636 HydrophobicContact CD1-CZ 4.04Å; Y433-F636 HydrophobicContact CE1-CB 4.38Å; Y433-F636 AromaticContact CE1-CD2 3.9Å; Y433-F636 HydrophobicContact CE1-CD2 3.9Å; Y433-F636 HydrophobicContact CE1-CE2 4.33Å; Y433-F636 HydrophobicContact CE1-CG 4.11Å; Y433-F636 HydrophobicContact CG-CD2 4.34Å; Y433-F636 HydrophobicContact CG-CE1 4.32Å; Y433-F636 HydrophobicContact CG-CE2 4.03Å; Y433-F636 HydrophobicContact CG-CZ 4.03Å; Y433-M640 HydrophobicContact CD1-CB 4.01Å; Y433-M640 HydrophobicContact CD1-SD 4.39Å; Y433-M640 HydrophobicContact CE1-CB 4.02Å; Y433-M640 WeakPolarHBondContact CE1-O 3.45Å
434	E	94.1	Very high	92.1	Very high	22 Å²	22	58.4 Å²	58.4	10%	0.103	31%	0.314	C	S	.	.	H	α-helix	trans	-65.3	-36.7	175.8	-166.6	175.7	-153	0	0	112	E431 E432 A436 R438 Y439 M640	E431-E434 HydrophobicContact CG-CB 3.98Å; E431-E434 PolarHBondContact O-N 3.26Å; E432-E434 PolarHBondContact O-N 3.2Å; E434-A436 VanDerWaalsContact C-N 3.33Å; E434-R438 HydrophobicContact CG-CB 4.04Å; E434-R438 PolarHBondContact O-N 2.92Å; E434-R438 WeakPolarHBondContact OE1-CD 3.29Å; E434-R438 IonicContact OE1-CZ 2.71Å; E434-R438 IonicContact OE1-NH1 2.91Å; E434-R438 PolarHBondContact OE1-NH1 3.27Å; E434-Y439 HydrophobicContact CG-CD2 3.82Å; E434-Y439 HydrophobicContact CG-CE2 3.6Å; E434-Y439 PolarHBondContact O-N 2.97Å; E434-M640 HydrophobicContact CB-CE 3.65Å; E434-M640 HydrophobicContact CB-CG 4.11Å; E434-M640 HydrophobicContact CB-SD 3.76Å; E434-M640 HydrophobicContact CG-CE 3.7Å; E434-M640 HydrophobicContact CG-CG 3.98Å; E434-M640 HydrophobicContact CG-SD 4.16Å
435	R	92.6	Very high	92.2	Very high	63 Å²	63	50.7 Å²	50.7	24%	0.238	28%	0.281	C	S	.	.	H	α-helix	trans	-72.4	-26.3	173.6	-65.8	-171.5	-65.5	114.4	0.8	112.9	P417 T418 A430 E431 E432 Y433 N440	P417-R435 HydrophobicContact CB-CB 3.93Å; T418-R435 HydrophobicContact CG2-CB 4.46Å; T418-R435 PolarHBondContact N-O 3.16Å; T418-R435 WeakPolarHBondContact O-CB 3.38Å; T418-R435 WeakPolarHBondContact O-CD 3.3Å; T418-R435 PolarHBondContact O-NH1 3.42Å; A430-R435 HydrophobicContact CB-CG 3.69Å; A430-R435 PolarHBondContact O-NE 3.34Å; E431-R435 WeakPolarHBondContact O-CG 3.34Å; E431-R435 PolarHBondContact O-N 3.48Å; E432-R435 CarbonylContact O-C 3.1Å; E432-R435 PolarHBondContact O-N 3.42Å; Y433-R435 VanDerWaalsContact C-N 3.31Å; Y433-R435 PolarHBondContact O-N 3.11Å; R435-N440 WeakPolarHBondContact O-CB 3.35Å
436	A	92.9	Very high	92.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-78.5	-33.8	176.5	0	0	0	0	0	112.5	L414 P417 E432 Y433 E434 N440	L414-A436 HydrophobicContact CD2-CB 4.17Å; P417-A436 HydrophobicContact CB-CB 4.22Å; E432-A436 WeakPolarHBondContact O-CB 3.41Å; E432-A436 PolarHBondContact O-N 3.35Å; Y433-A436 WeakPolarHBondContact O-CB 3.39Å; Y433-A436 PolarHBondContact O-N 2.89Å; Y433-A436 VanDerWaalsContact O-N 3.14Å; E434-A436 VanDerWaalsContact C-N 3.33Å; A436-N440 WeakPolarHBondContact O-CB 3.29Å; A436-N440 PolarHBondContact O-ND2 3.24Å
437	T	94.4	Very high	92.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-89.8	-179.6	63.2	0	0	0	0	112	L414 Y433 Y439 N440 Y441 M640 M642	L414-T437 HydrophobicContact CD2-CG2 4.11Å; Y433-T437 HydrophobicContact CD2-CG2 4.28Å; Y433-T437 HydrophobicContact CE1-CG2 4.27Å; Y433-T437 HydrophobicContact CE2-CG2 3.79Å; Y433-T437 PolarHBondContact O-N 3.04Å; Y433-T437 PolarHBondContact O-OG1 2.91Å; Y433-T437 VanDerWaalsContact O-OG1 3.08Å; T437-Y439 VanDerWaalsContact C-N 3.32Å; T437-Y439 PolarHBondContact O-N 3.43Å; T437-Y439 VanDerWaalsContact O-N 3.09Å; T437-N440 PolarHBondContact O-N 3.38Å; T437-Y441 WeakPolarHBondContact O-CD2 3.18Å; T437-M640 PolarHBondContact OG1-O 3.26Å; T437-M642 HydrophobicContact CG2-CG 4.27Å; T437-M642 HydrophobicContact CG2-SD 3.94Å
438	R	93.4	Very high	92.7	Very high	78 Å²	78	44.2 Å²	44.2	29%	0.294	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43.4	-50.5	-169.4	-176	-172	-174.1	160.7	16.4	114.3	E434 E639 I645	E434-R438 HydrophobicContact CG-CB 4.04Å; E434-R438 PolarHBondContact O-N 2.92Å; E434-R438 WeakPolarHBondContact OE1-CD 3.29Å; E434-R438 IonicContact OE1-CZ 2.71Å; E434-R438 IonicContact OE1-NH1 2.91Å; E434-R438 PolarHBondContact OE1-NH1 3.27Å; R438-E639 IonicContact CZ-OE2 3.18Å; R438-E639 IonicContact NH1-OE1 3.59Å; R438-E639 IonicContact NH1-OE2 3.88Å; R438-E639 PolarHBondContact NH1-OE2 2.95Å; R438-E639 IonicContact NH2-OE2 3.11Å; R438-E639 PolarHBondContact NH2-OE2 3.49Å; R438-E639 VanDerWaalsContact NH2-OE2 3.11Å; R438-I645 HydrophobicContact CB-CD1 4.23Å
439	Y	92.9	Very high	93.2	Very high	42 Å²	42	41.1 Å²	41.1	17%	0.165	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-8.7	-174.9	-65.5	-66.8	0	0	0	114.1	N423 C426 A430 E434 T437	N423-Y439 PolarHBondContact ND2-O 3.15Å; C426-Y439 HydrophobicContact CB-CD1 4.43Å; C426-Y439 HydrophobicContact CB-CG 4.2Å; A430-Y439 HydrophobicContact CB-CD2 4.44Å; A430-Y439 HydrophobicContact CB-CE2 4.16Å; E434-Y439 HydrophobicContact CG-CD2 3.82Å; E434-Y439 HydrophobicContact CG-CE2 3.6Å; E434-Y439 PolarHBondContact O-N 2.97Å; T437-Y439 VanDerWaalsContact C-N 3.32Å; T437-Y439 PolarHBondContact O-N 3.43Å; T437-Y439 VanDerWaalsContact O-N 3.09Å
440	N	93.4	Very high	93.4	Very high	17 Å²	17	34.6 Å²	34.6	9%	0.091	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-3.4	-173	-142.5	0.1	0	0	0	113.9	K413 H416 R435 A436 T437	K413-N440 HydrophobicContact CD-CB 4.14Å; K413-N440 WeakPolarHBondContact CD-O 3.36Å; K413-N440 PolarHBondContact NZ-O 3.05Å; K413-N440 PolarHBondContact O-ND2 3.49Å; H416-N440 PolarHBondContact O-ND2 3.19Å; R435-N440 WeakPolarHBondContact O-CB 3.35Å; A436-N440 WeakPolarHBondContact O-CB 3.29Å; A436-N440 PolarHBondContact O-ND2 3.24Å; T437-N440 PolarHBondContact O-N 3.38Å
441	Y	92.5	Very high	93.6	Very high	10 Å²	10	35 Å²	35	4%	0.039	17%	0.168	C	C	.	.			trans	-118.3	125.4	178.3	-59.8	-85	0	0	0	111.3	V409 K413 T437 E445 K446 L449 M642	V409-Y441 HydrophobicContact CG1-CE1 4.36Å; K413-Y441 HydrophobicContact CD-CE1 4.42Å; K413-Y441 HydrophobicContact CG-CE1 3.92Å; T437-Y441 WeakPolarHBondContact O-CD2 3.18Å; Y441-E445 HydrophobicContact CD1-CB 4.33Å; Y441-K446 VanDerWaalsContact O-CE 3.22Å; Y441-K446 WeakPolarHBondContact O-CE 3.29Å; Y441-L449 HydrophobicContact CD1-CD1 3.81Å; Y441-L449 HydrophobicContact CE1-CD1 3.69Å; Y441-M642 HydrophobicContact CD2-CE 4.16Å; Y441-M642 HydrophobicContact CD2-SD 4.4Å; Y441-M642 HydrophobicContact CE1-CE 4.49Å; Y441-M642 HydrophobicContact CE2-CE 3.54Å; Y441-M642 HydrophobicContact CE2-SD 3.74Å
442	T	92.1	Very high	93.6	Very high	83 Å²	83	33.3 Å²	33.3	51%	0.509	16%	0.16	S	C	.	.			trans	-70	166.5	167.9	62.1	0	0	0	0	111.2	E444 E445 K446	T442-E444 VanDerWaalsContact C-N 3.32Å; T442-E444 PolarHBondContact O-N 2.9Å; T442-E445 WeakPolarHBondContact CB-OE2 3.2Å; T442-E445 WeakPolarHBondContact CG2-OE2 3.47Å; T442-E445 PolarHBondContact N-OE2 2.86Å; T442-E445 PolarHBondContact O-N 3.4Å; T442-E445 VanDerWaalsContact OG1-CG 3.31Å; T442-E445 WeakPolarHBondContact OG1-CG 3.43Å; T442-E445 PolarHBondContact OG1-N 2.61Å; T442-E445 PolarHBondContact OG1-OE2 2.74Å; T442-K446 WeakPolarHBondContact O-CG 3.49Å; T442-K446 PolarHBondContact O-N 2.85Å; T442-K446 VanDerWaalsContact O-N 3.14Å
443	S	93.6	Very high	93.7	Very high	46 Å²	46	28.7 Å²	28.7	32%	0.322	14%	0.138	S	C	.	.	H	α-helix	trans	-57.1	-44.9	177.3	-174	0	0	0	0	112.3	K446 F447 H649	S443-K446 PolarHBondContact O-N 2.95Å; S443-F447 VanDerWaalsContact O-CD2 3.26Å; S443-F447 WeakPolarHBondContact O-CD2 3.41Å; S443-F447 WeakPolarHBondContact O-CG 3.48Å; S443-F447 PolarHBondContact O-N 3.4Å; S443-F447 VanDerWaalsContact O-N 3.15Å; S443-F447 WeakPolarHBondContact OG-CE2 3.4Å; S443-H649 PolarHBondContact OG-CE1 2.95Å; S443-H649 VanDerWaalsContact OG-CE1 3.25Å; S443-H649 PolarHBondContact OG-NE2 3.11Å
444	E	92.1	Very high	93.7	Very high	124 Å²	124	28.7 Å²	28.7	58%	0.579	14%	0.139	S	C	*	.	H	α-helix	trans	-66.4	-40.7	-179.4	-58.7	-54.6	134.4	0	0	112.2	T442 K446 F447 A448	T442-E444 VanDerWaalsContact C-N 3.32Å; T442-E444 PolarHBondContact O-N 2.9Å; E444-K446 VanDerWaalsContact C-N 3.34Å; E444-K446 PolarHBondContact O-N 3.44Å; E444-F447 PolarHBondContact O-N 2.84Å; E444-A448 WeakPolarHBondContact O-CB 3.25Å; E444-A448 PolarHBondContact O-N 3.1Å
445	E	92.3	Very high	93.6	Very high	32 Å²	32	28.2 Å²	28.2	15%	0.15	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-40.5	176.5	-75.4	168.1	126.1	0	0	111.6	K413 Y441 T442 A448 L449	K413-E445 IonicContact NZ-OE1 3.96Å; K413-E445 PolarHBondContact NZ-OE1 3.04Å; K413-E445 IonicContact NZ-OE2 3.17Å; Y441-E445 HydrophobicContact CD1-CB 4.33Å; T442-E445 WeakPolarHBondContact CB-OE2 3.2Å; T442-E445 WeakPolarHBondContact CG2-OE2 3.47Å; T442-E445 PolarHBondContact N-OE2 2.86Å; T442-E445 PolarHBondContact O-N 3.4Å; T442-E445 VanDerWaalsContact OG1-CG 3.31Å; T442-E445 WeakPolarHBondContact OG1-CG 3.43Å; T442-E445 PolarHBondContact OG1-N 2.61Å; T442-E445 PolarHBondContact OG1-OE2 2.74Å; E445-A448 PolarHBondContact O-N 3.03Å; E445-L449 WeakPolarHBondContact O-CB 3.16Å; E445-L449 VanDerWaalsContact O-CG 3.29Å; E445-L449 WeakPolarHBondContact O-CG 3.5Å; E445-L449 PolarHBondContact O-N 3.32Å
446	K	94.3	Very high	93.7	Very high	32 Å²	32	25.2 Å²	25.2	14%	0.139	13%	0.125	C	C	.	.	H	α-helix	trans	-62.9	-46	176.7	-65.9	175.7	-155.7	177.1	0	111.2	Y441 T442 S443 E444 L449 V450 I645 L646 H649	Y441-K446 VanDerWaalsContact O-CE 3.22Å; Y441-K446 WeakPolarHBondContact O-CE 3.29Å; T442-K446 WeakPolarHBondContact O-CG 3.49Å; T442-K446 PolarHBondContact O-N 2.85Å; T442-K446 VanDerWaalsContact O-N 3.14Å; S443-K446 PolarHBondContact O-N 2.95Å; E444-K446 VanDerWaalsContact C-N 3.34Å; E444-K446 PolarHBondContact O-N 3.44Å; K446-L449 PolarHBondContact O-N 3.28Å; K446-V450 WeakPolarHBondContact O-CG2 3.49Å; K446-V450 PolarHBondContact O-N 3.41Å; K446-I645 HydrophobicContact CD-CG2 4.23Å; K446-L646 HydrophobicContact CB-CD2 4.03Å; K446-L646 HydrophobicContact CG-CD2 4.25Å; K446-H649 HydrophobicContact CD-CB 3.96Å
447	F	94.9	Very high	93.6	Very high	15 Å²	15	25.3 Å²	25.3	7%	0.066	13%	0.126	C	C	.	.	H	α-helix	trans	-62.7	-45.2	177.2	-69.2	-37.7	0	0	0	112.2	S443 E444 L449 V450 E451 H649 I650 T653 E655 M658	S443-F447 VanDerWaalsContact O-CD2 3.26Å; S443-F447 WeakPolarHBondContact O-CD2 3.41Å; S443-F447 WeakPolarHBondContact O-CG 3.48Å; S443-F447 PolarHBondContact O-N 3.4Å; S443-F447 VanDerWaalsContact O-N 3.15Å; S443-F447 WeakPolarHBondContact OG-CE2 3.4Å; E444-F447 PolarHBondContact O-N 2.84Å; F447-L449 VanDerWaalsContact C-N 3.33Å; F447-L449 PolarHBondContact O-N 3.11Å; F447-V450 PolarHBondContact O-N 2.96Å; F447-E451 PolarHBondContact O-N 3.46Å; F447-H649 AromaticContact CD1-CD2 3.84Å; F447-H649 AromaticContact CE1-CD2 3.38Å; F447-H649 WeakPolarHBondContact CE1-CD2 3.32Å; F447-H649 AromaticContact CE1-NE2 3.62Å; F447-H649 AromaticContact CE2-NE2 3.77Å; F447-H649 AromaticContact CZ-CD2 3.68Å; F447-H649 AromaticContact CZ-NE2 3.4Å; F447-H649 WeakPolarHBondContact CZ-NE2 3.28Å; F447-I650 HydrophobicContact CD1-CG1 4.39Å; F447-I650 HydrophobicContact CE1-CG1 4.17Å; F447-T653 HydrophobicContact CZ-CG2 4.19Å; F447-T653 WeakPolarHBondContact CZ-OG1 3.44Å; F447-E655 HydrophobicContact CE1-CB 4.03Å; F447-E655 HydrophobicContact CE1-CG 4.28Å; F447-E655 HydrophobicContact CE2-CG 4.32Å; F447-E655 HydrophobicContact CZ-CB 3.75Å; F447-E655 HydrophobicContact CZ-CG 3.97Å; F447-M658 HydrophobicContact CB-CE 3.67Å; F447-M658 HydrophobicContact CB-CG 4.43Å; F447-M658 HydrophobicContact CB-SD 4.16Å; F447-M658 HydrophobicContact CD1-CB 4.28Å; F447-M658 HydrophobicContact CD1-CG 3.57Å; F447-M658 HydrophobicContact CD1-SD 4.21Å; F447-M658 HydrophobicContact CE1-CB 4.35Å; F447-M658 HydrophobicContact CE1-CG 3.96Å; F447-M658 HydrophobicContact CG-CE 4.2Å; F447-M658 HydrophobicContact CG-CG 4.08Å; F447-M658 HydrophobicContact CG-SD 4.44Å
448	A	94	Very high	93.4	Very high	5 Å²	5	26.1 Å²	26.1	4%	0.041	13%	0.134	C	C	.	.	H	α-helix	trans	-59.8	-41.9	176.1	0	0	0	0	0	112	L344 M348 E444 E445 E451 V452	L344-A448 HydrophobicContact CD2-CB 3.72Å; L344-A448 HydrophobicContact CG-CB 4.08Å; M348-A448 HydrophobicContact CE-CB 4.45Å; M348-A448 HydrophobicContact CG-CB 3.82Å; M348-A448 HydrophobicContact SD-CB 3.85Å; E444-A448 WeakPolarHBondContact O-CB 3.25Å; E444-A448 PolarHBondContact O-N 3.1Å; E445-A448 PolarHBondContact O-N 3.03Å; A448-E451 PolarHBondContact O-N 2.78Å; A448-V452 WeakPolarHBondContact O-CG2 3.5Å; A448-V452 PolarHBondContact O-N 2.8Å; A448-V452 VanDerWaalsContact O-N 3.07Å
449	L	94.7	Very high	93.3	Very high	6 Å²	6	22.4 Å²	22.4	3%	0.031	12%	0.12	C	C	.	.	H	α-helix	trans	-60.7	-46.4	174.7	-76	168.9	0	0	0	111.5	L344 V406 Y441 E445 K446 F447 E451 V452 I453 L646	L344-L449 HydrophobicContact CD2-CB 4.43Å; L344-L449 HydrophobicContact CD2-CD2 3.67Å; L344-L449 HydrophobicContact CD2-CG 3.77Å; V406-L449 HydrophobicContact CG1-CD2 4Å; Y441-L449 HydrophobicContact CD1-CD1 3.81Å; Y441-L449 HydrophobicContact CE1-CD1 3.69Å; E445-L449 WeakPolarHBondContact O-CB 3.16Å; E445-L449 VanDerWaalsContact O-CG 3.29Å; E445-L449 WeakPolarHBondContact O-CG 3.5Å; E445-L449 PolarHBondContact O-N 3.32Å; K446-L449 PolarHBondContact O-N 3.28Å; F447-L449 VanDerWaalsContact C-N 3.33Å; F447-L449 PolarHBondContact O-N 3.11Å; L449-E451 VanDerWaalsContact C-N 3.34Å; L449-E451 PolarHBondContact O-N 2.84Å; L449-V452 PolarHBondContact O-N 3.33Å; L449-I453 WeakPolarHBondContact O-CB 3.34Å; L449-I453 WeakPolarHBondContact O-CD1 3.45Å; L449-I453 WeakPolarHBondContact O-CG1 3.43Å; L449-I453 PolarHBondContact O-N 3.12Å; L449-L646 HydrophobicContact CB-CD2 4.21Å; L449-L646 HydrophobicContact CD1-CD2 4.29Å
450	V	95.6	Very high	93.2	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-61.6	-42.8	178.6	173.8	0	0	0	0	111.6	K446 F447 V452 I453 A454 L646 I650 P665	K446-V450 WeakPolarHBondContact O-CG2 3.49Å; K446-V450 PolarHBondContact O-N 3.41Å; F447-V450 PolarHBondContact O-N 2.96Å; V450-V452 PolarHBondContact O-N 2.9Å; V450-I453 PolarHBondContact O-N 3.44Å; V450-A454 WeakPolarHBondContact O-CB 3.28Å; V450-A454 PolarHBondContact O-N 3.43Å; V450-L646 HydrophobicContact CG2-CB 3.83Å; V450-L646 HydrophobicContact CG2-CD2 4.23Å; V450-L646 HydrophobicContact CG2-CG 4.4Å; V450-I650 HydrophobicContact CB-CD1 4.35Å; V450-I650 HydrophobicContact CG1-CD1 3.81Å; V450-I650 HydrophobicContact CG2-CD1 4.11Å; V450-P665 HydrophobicContact CB-CG 4.12Å; V450-P665 HydrophobicContact CG1-CG 3.54Å; V450-P665 HydrophobicContact CG2-CG 3.6Å
451	E	94.1	Very high	92.8	Very high	23 Å²	23	21.4 Å²	21.4	11%	0.107	12%	0.117	C	C	.	.	H	α-helix	trans	-58.5	-46.3	175.7	-77.6	-172.7	-138.2	0	0	112.1	M348 R352 F447 A448 L449 A454 M455 M658	M348-E451 HydrophobicContact CE-CB 3.59Å; M348-E451 HydrophobicContact CE-CG 4.33Å; M348-E451 WeakPolarHBondContact CE-OE2 3.38Å; R352-E451 IonicContact CZ-OE1 3.87Å; R352-E451 IonicContact CZ-OE2 3.57Å; R352-E451 IonicContact NE-OE2 3.56Å; R352-E451 PolarHBondContact NE-OE2 3.26Å; R352-E451 IonicContact NH2-OE1 2.85Å; R352-E451 PolarHBondContact NH2-OE1 2.77Å; R352-E451 IonicContact NH2-OE2 2.72Å; R352-E451 PolarHBondContact NH2-OE2 2.78Å; F447-E451 PolarHBondContact O-N 3.46Å; A448-E451 PolarHBondContact O-N 2.78Å; L449-E451 VanDerWaalsContact C-N 3.34Å; L449-E451 PolarHBondContact O-N 2.84Å; E451-A454 PolarHBondContact O-N 3.4Å; E451-M455 HydrophobicContact CB-CE 4.26Å; E451-M455 WeakPolarHBondContact O-CB 3.46Å; E451-M455 WeakPolarHBondContact O-CE 3.21Å; E451-M455 WeakPolarHBondContact O-CG 3.14Å; E451-M455 PolarHBondContact O-N 3.07Å; E451-M658 HydrophobicContact CG-CE 3.68Å; E451-M658 HydrophobicContact CG-SD 3.93Å; E451-M658 WeakPolarHBondContact OE1-CE 3.27Å
452	V	95.3	Very high	92.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.5	-42.4	179.5	-179.6	0	0	0	0	111.2	L344 M348 I351 W402 V406 A448 L449 V450 A454 M455 I456	L344-V452 HydrophobicContact CD1-CG2 4.32Å; M348-V452 HydrophobicContact CE-CG2 3.93Å; M348-V452 HydrophobicContact SD-CG2 3.46Å; M348-V452 WeakPolarHBondContact SD-CG2 3.39Å; I351-V452 HydrophobicContact CD1-CG2 4.01Å; I351-V452 HydrophobicContact CG2-CG2 4.39Å; W402-V452 HydrophobicContact CB-CG1 3.99Å; V406-V452 HydrophobicContact CG2-CB 4.05Å; V406-V452 HydrophobicContact CG2-CG1 3.5Å; A448-V452 WeakPolarHBondContact O-CG2 3.5Å; A448-V452 PolarHBondContact O-N 2.8Å; A448-V452 VanDerWaalsContact O-N 3.07Å; L449-V452 PolarHBondContact O-N 3.33Å; V450-V452 PolarHBondContact O-N 2.9Å; V452-A454 VanDerWaalsContact C-N 3.29Å; V452-A454 PolarHBondContact O-N 3.16Å; V452-M455 HydrophobicContact CG2-CE 4.09Å; V452-M455 PolarHBondContact O-N 2.9Å; V452-I456 HydrophobicContact CG1-CD1 3.9Å; V452-I456 HydrophobicContact CG1-CG1 4.39Å; V452-I456 WeakPolarHBondContact O-CD1 3.42Å; V452-I456 VanDerWaalsContact O-CG1 3.24Å; V452-I456 WeakPolarHBondContact O-CG1 3.45Å; V452-I456 PolarHBondContact O-N 3.24Å
453	I	94.9	Very high	92.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60	-42.8	176.9	-68	168.1	0	0	0	110.7	V406 L449 V450 I456 K457 L616 L619 L646 L668	V406-I453 HydrophobicContact CG1-CD1 4.49Å; V406-I453 HydrophobicContact CG1-CG1 4.34Å; L449-I453 WeakPolarHBondContact O-CB 3.34Å; L449-I453 WeakPolarHBondContact O-CD1 3.45Å; L449-I453 WeakPolarHBondContact O-CG1 3.43Å; L449-I453 PolarHBondContact O-N 3.12Å; V450-I453 PolarHBondContact O-N 3.44Å; I453-I456 PolarHBondContact O-N 3.46Å; I453-K457 HydrophobicContact CG2-CD 4.07Å; I453-K457 WeakPolarHBondContact O-CB 3.43Å; I453-K457 WeakPolarHBondContact O-CG 3.43Å; I453-K457 PolarHBondContact O-N 3.32Å; I453-L616 HydrophobicContact CB-CD1 4.37Å; I453-L616 HydrophobicContact CG1-CD1 3.98Å; I453-L616 HydrophobicContact CG2-CD1 4.03Å; I453-L619 HydrophobicContact CD1-CD1 4.44Å; I453-L646 HydrophobicContact CD1-CD1 3.86Å; I453-L668 HydrophobicContact CD1-CD1 4.14Å; I453-L668 HydrophobicContact CG2-CD2 4.03Å
454	A	93.1	Very high	91.9	Very high	4 Å²	4	19 Å²	19	3%	0.033	11%	0.105	C	C	.	.	H	α-helix	trans	-69.3	-37.3	177	0	0	0	0	0	113.5	V450 E451 V452 I456 G458 Y661 Y664	V450-A454 WeakPolarHBondContact O-CB 3.28Å; V450-A454 PolarHBondContact O-N 3.43Å; E451-A454 PolarHBondContact O-N 3.4Å; V452-A454 VanDerWaalsContact C-N 3.29Å; V452-A454 PolarHBondContact O-N 3.16Å; A454-I456 VanDerWaalsContact C-N 3.35Å; A454-G458 WeakPolarHBondContact O-CA 3.29Å; A454-G458 PolarHBondContact O-N 2.9Å; A454-Y661 HydrophobicContact CB-CD1 3.34Å; A454-Y661 HydrophobicContact CB-CE1 3.9Å; A454-Y661 HydrophobicContact CB-CG 4.45Å; A454-Y664 HydrophobicContact CB-CD1 4.26Å; A454-Y664 HydrophobicContact CB-CD2 3.31Å; A454-Y664 HydrophobicContact CB-CE2 3.74Å; A454-Y664 HydrophobicContact CB-CG 3.6Å
455	M	93.8	Very high	91.4	Very high	12 Å²	12	21.1 Å²	21.1	6%	0.059	11%	0.107	C	C	.	.	H	α-helix	trans	-63.8	-40.3	173.3	-75.6	-173.3	-75.3	0	0	111.5	M348 I351 R352 H355 W402 E451 V452 L459	M348-M455 HydrophobicContact CE-CE 3.95Å; I351-M455 HydrophobicContact CB-CE 4.48Å; I351-M455 HydrophobicContact CG2-CE 3.37Å; I351-M455 HydrophobicContact CG2-SD 3.96Å; R352-M455 HydrophobicContact CG-CE 4.43Å; R352-M455 HydrophobicContact CG-SD 4.42Å; H355-M455 HydrophobicContact CB-SD 3.82Å; H355-M455 VanDerWaalsContact CD2-CG 3.49Å; H355-M455 WeakPolarHBondContact CD2-CG 3.46Å; W402-M455 HydrophobicContact CE3-CB 4.31Å; W402-M455 HydrophobicContact CZ3-CB 4.09Å; E451-M455 HydrophobicContact CB-CE 4.26Å; E451-M455 WeakPolarHBondContact O-CB 3.46Å; E451-M455 WeakPolarHBondContact O-CE 3.21Å; E451-M455 WeakPolarHBondContact O-CG 3.14Å; E451-M455 PolarHBondContact O-N 3.07Å; V452-M455 HydrophobicContact CG2-CE 4.09Å; V452-M455 PolarHBondContact O-N 2.9Å; M455-L459 VanDerWaalsContact O-CB 3.23Å; M455-L459 WeakPolarHBondContact O-CB 3.29Å; M455-L459 PolarHBondContact O-N 3.41Å
456	I	94.3	Very high	90.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.9	-57.3	173.9	-68.3	162	0	0	0	109.8	L399 W402 V406 V452 I453 A454 G458 L459 Q460 C614 L616	L399-I456 HydrophobicContact CD2-CB 4.44Å; L399-I456 HydrophobicContact CD2-CG2 4.19Å; L399-I456 WeakPolarHBondContact CD2-O 3.43Å; W402-I456 HydrophobicContact CB-CD1 3.85Å; W402-I456 HydrophobicContact CB-CG1 3.6Å; W402-I456 HydrophobicContact CE3-CG1 4.03Å; V406-I456 HydrophobicContact CG2-CD1 4.18Å; V452-I456 HydrophobicContact CG1-CD1 3.9Å; V452-I456 HydrophobicContact CG1-CG1 4.39Å; V452-I456 WeakPolarHBondContact O-CD1 3.42Å; V452-I456 VanDerWaalsContact O-CG1 3.24Å; V452-I456 WeakPolarHBondContact O-CG1 3.45Å; V452-I456 PolarHBondContact O-N 3.24Å; I453-I456 PolarHBondContact O-N 3.46Å; A454-I456 VanDerWaalsContact C-N 3.35Å; I456-G458 PolarHBondContact O-N 3.18Å; I456-L459 PolarHBondContact O-N 2.89Å; I456-Q460 WeakPolarHBondContact O-CB 3.24Å; I456-Q460 PolarHBondContact O-N 3.47Å; I456-C614 HydrophobicContact CG2-CB 3.81Å; I456-L616 HydrophobicContact CD1-CD1 4.24Å
457	K	91	Very high	90.4	Very high	1 Å²	1	21.3 Å²	21.3	0%	0.004	11%	0.109	C	C	.	.	H	α-helix	trans	-65.8	-40	-175.3	-76.5	-177.3	-180	-66.3	0	112.5	P31 I453 Q460 V461 Y664 D667 D671	P31-K457 HydrophobicContact CB-CB 4.1Å; P31-K457 HydrophobicContact CB-CD 4.32Å; P31-K457 HydrophobicContact CB-CG 4.37Å; P31-K457 HydrophobicContact CG-CD 4.17Å; I453-K457 HydrophobicContact CG2-CD 4.07Å; I453-K457 WeakPolarHBondContact O-CB 3.43Å; I453-K457 WeakPolarHBondContact O-CG 3.43Å; I453-K457 PolarHBondContact O-N 3.32Å; K457-Q460 WeakPolarHBondContact O-CB 3.49Å; K457-Q460 PolarHBondContact O-N 3.02Å; K457-V461 WeakPolarHBondContact O-CG2 3.12Å; K457-V461 PolarHBondContact O-N 2.9Å; K457-V461 VanDerWaalsContact O-N 3.11Å; K457-Y664 HydrophobicContact CB-CD1 3.69Å; K457-Y664 HydrophobicContact CB-CE1 4.15Å; K457-Y664 HydrophobicContact CD-CD1 4.3Å; K457-D667 HydrophobicContact CD-CB 4.25Å; K457-D667 WeakPolarHBondContact CD-OD2 3.2Å; K457-D667 WeakPolarHBondContact CE-OD2 3.2Å; K457-D667 IonicContact NZ-OD2 3.95Å; K457-D667 PolarHBondContact NZ-OD2 3.1Å; K457-D671 IonicContact NZ-OD1 2.85Å; K457-D671 PolarHBondContact NZ-OD1 2.84Å; K457-D671 IonicContact NZ-OD2 2.7Å; K457-D671 PolarHBondContact NZ-OD2 3.19Å
458	G	89.3	Confident	89.8	Confident	17 Å²	17	24.3 Å²	24.3	18%	0.175	13%	0.132	C	C	.	.	H	α-helix	trans	-63.5	-44.3	175.1	0	0	0	0	0	112.5	A454 I456 V461 L462	A454-G458 WeakPolarHBondContact O-CA 3.29Å; A454-G458 PolarHBondContact O-N 2.9Å; I456-G458 PolarHBondContact O-N 3.18Å; G458-V461 WeakPolarHBondContact O-CB 3.25Å; G458-V461 PolarHBondContact O-N 3.49Å; G458-L462 PolarHBondContact O-N 2.78Å
459	L	91.5	Very high	89.5	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-69.5	-34.9	175.5	178.6	59.4	0	0	0	112	F358 I359 L362 L398 L399 W402 M455 I456 V461 L462 M463	F358-L459 HydrophobicContact CD1-CD1 3.91Å; F358-L459 HydrophobicContact CD1-CD2 3.99Å; F358-L459 HydrophobicContact CE1-CD1 3.86Å; F358-L459 HydrophobicContact CE1-CD2 4.21Å; I359-L459 HydrophobicContact CD1-CD1 4.35Å; I359-L459 HydrophobicContact CG1-CD1 3.88Å; L362-L459 HydrophobicContact CD2-CD1 4.03Å; L398-L459 HydrophobicContact CD2-CD2 4.22Å; L399-L459 HydrophobicContact CD1-CD2 4.43Å; L399-L459 HydrophobicContact CD1-CG 4.31Å; L399-L459 HydrophobicContact CD2-CB 3.86Å; L399-L459 HydrophobicContact CD2-CD2 3.79Å; L399-L459 HydrophobicContact CD2-CG 3.88Å; L399-L459 HydrophobicContact CG-CD2 3.85Å; L399-L459 HydrophobicContact CG-CG 4.15Å; W402-L459 HydrophobicContact CH2-CD2 3.94Å; W402-L459 HydrophobicContact CZ3-CB 4.27Å; W402-L459 HydrophobicContact CZ3-CD2 3.65Å; M455-L459 VanDerWaalsContact O-CB 3.23Å; M455-L459 WeakPolarHBondContact O-CB 3.29Å; M455-L459 PolarHBondContact O-N 3.41Å; I456-L459 PolarHBondContact O-N 2.89Å; L459-V461 VanDerWaalsContact C-N 3.3Å; L459-V461 PolarHBondContact O-N 3.02Å; L459-L462 HydrophobicContact CD1-CB 4.49Å; L459-L462 PolarHBondContact O-N 3.28Å; L459-L462 VanDerWaalsContact O-N 3.15Å; L459-M463 HydrophobicContact CD1-CG 3.96Å; L459-M463 HydrophobicContact CD1-SD 4.36Å; L459-M463 HydrophobicContact CG-CG 4.1Å; L459-M463 WeakPolarHBondContact O-CB 3.21Å; L459-M463 VanDerWaalsContact O-CG 3.28Å; L459-M463 WeakPolarHBondContact O-CG 3.37Å; L459-M463 PolarHBondContact O-N 3.07Å
460	Q	90.6	Very high	89.2	Confident	28 Å²	28	25.4 Å²	25.4	13%	0.131	14%	0.138	C	C	.	.	H	α-helix	trans	-57.3	-42	173.5	-173.7	-175.7	9.1	0	0	111.7	I456 K457 M463 G464 L610 C614	I456-Q460 WeakPolarHBondContact O-CB 3.24Å; I456-Q460 PolarHBondContact O-N 3.47Å; K457-Q460 WeakPolarHBondContact O-CB 3.49Å; K457-Q460 PolarHBondContact O-N 3.02Å; Q460-M463 PolarHBondContact O-N 2.81Å; Q460-G464 PolarHBondContact O-N 3.31Å; Q460-L610 HydrophobicContact CG-CD1 4.35Å; Q460-L610 HydrophobicContact CG-CD2 4.41Å; Q460-L610 HydrophobicContact CG-CG 4.17Å; Q460-C614 HydrophobicContact CG-CB 4.31Å
461	V	85.8	Confident	88.8	Confident	10 Å²	10	26.4 Å²	26.4	6%	0.061	14%	0.143	C	C	.	.	H	α-helix	trans	-58.1	-49.8	173.4	176.6	0	0	0	0	111	P32 K457 G458 L459 M463 G464 R465	P32-V461 HydrophobicContact CB-CG2 4.36Å; P32-V461 HydrophobicContact CG-CG2 4.04Å; K457-V461 WeakPolarHBondContact O-CG2 3.12Å; K457-V461 PolarHBondContact O-N 2.9Å; K457-V461 VanDerWaalsContact O-N 3.11Å; G458-V461 WeakPolarHBondContact O-CB 3.25Å; G458-V461 PolarHBondContact O-N 3.49Å; L459-V461 VanDerWaalsContact C-N 3.3Å; L459-V461 PolarHBondContact O-N 3.02Å; V461-M463 PolarHBondContact O-N 3.3Å; V461-G464 PolarHBondContact O-N 2.8Å; V461-R465 WeakPolarHBondContact O-CG 3.11Å; V461-R465 PolarHBondContact O-N 3.33Å
462	L	85.3	Confident	88.5	Confident	60 Å²	60	29.2 Å²	29.2	31%	0.314	16%	0.156	S	C	.	.	H	α-helix	trans	-64.8	-41.6	-176.7	-64.7	175.9	0	0	0	111.9	I359 L362 G458 L459 R465 M466	I359-L462 HydrophobicContact CD1-CD1 4.3Å; I359-L462 HydrophobicContact CG1-CD1 4.09Å; I359-L462 HydrophobicContact CG2-CD1 4.05Å; L362-L462 HydrophobicContact CD2-CB 4Å; G458-L462 PolarHBondContact O-N 2.78Å; L459-L462 HydrophobicContact CD1-CB 4.49Å; L459-L462 PolarHBondContact O-N 3.28Å; L459-L462 VanDerWaalsContact O-N 3.15Å; L462-R465 PolarHBondContact O-N 3.41Å; L462-M466 PolarHBondContact O-N 3.08Å
463	M	87	Confident	88.2	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66	-39.9	176.4	-66.6	-64.2	-70.8	0	0	111.6	F358 L362 L399 L459 Q460 V461 M466 E467 F470 F606 L610	F358-M463 HydrophobicContact CE1-SD 3.94Å; F358-M463 HydrophobicContact CZ-SD 4.19Å; L362-M463 HydrophobicContact CD1-SD 4.44Å; L362-M463 HydrophobicContact CD2-SD 3.81Å; L399-M463 HydrophobicContact CD1-CG 4.22Å; L459-M463 HydrophobicContact CD1-CG 3.96Å; L459-M463 HydrophobicContact CD1-SD 4.36Å; L459-M463 HydrophobicContact CG-CG 4.1Å; L459-M463 WeakPolarHBondContact O-CB 3.21Å; L459-M463 VanDerWaalsContact O-CG 3.28Å; L459-M463 WeakPolarHBondContact O-CG 3.37Å; L459-M463 PolarHBondContact O-N 3.07Å; Q460-M463 PolarHBondContact O-N 2.81Å; V461-M463 PolarHBondContact O-N 3.3Å; M463-M466 PolarHBondContact O-N 2.99Å; M463-E467 PolarHBondContact O-N 2.73Å; M463-F470 HydrophobicContact CE-CE2 3.7Å; M463-F470 HydrophobicContact CE-CZ 4.01Å; M463-F470 HydrophobicContact SD-CE2 3.91Å; M463-F470 HydrophobicContact SD-CZ 4.13Å; M463-F606 HydrophobicContact CB-CZ 4.22Å; M463-F606 HydrophobicContact CE-CE2 3.99Å; M463-F606 HydrophobicContact CE-CZ 3.69Å; M463-L610 HydrophobicContact CB-CD1 3.88Å; M463-L610 HydrophobicContact CB-CD2 4.04Å; M463-L610 HydrophobicContact CG-CD1 4.46Å
464	G	85.3	Confident	88.1	Confident	29 Å²	29	29.2 Å²	29.2	30%	0.299	16%	0.156	S	C	.	.	H	α-helix	trans	-64.9	-40.8	175.5	0	0	0	0	0	112.9	Q460 V461 M466 E467	Q460-G464 PolarHBondContact O-N 3.31Å; V461-G464 PolarHBondContact O-N 2.8Å; G464-M466 PolarHBondContact O-N 3.14Å; G464-E467 WeakPolarHBondContact O-CB 3.22Å; G464-E467 PolarHBondContact O-N 3.28Å
465	R	82.2	Confident	88	Confident	169 Å²	169	32.6 Å²	32.6	64%	0.638	17%	0.168	S	C	*	.	H	α-helix	trans	-62.1	-26.6	174.2	-73.2	-179.8	-173.1	178.8	4.7	113.4	C28 V461 L462	C28-R465 PolarHBondContact SG-NH2 3.46Å; V461-R465 WeakPolarHBondContact O-CG 3.11Å; V461-R465 PolarHBondContact O-N 3.33Å; L462-R465 PolarHBondContact O-N 3.41Å
466	M	81.8	Confident	87.9	Confident	18 Å²	18	33 Å²	33	9%	0.089	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	4.8	177.7	-67.2	-88.6	72.6	0	0	113	L362 S366 L462 M463 G464 S468 V469 F470	L362-M466 HydrophobicContact CD1-CG 4.42Å; S366-M466 VanDerWaalsContact CB-SD 3.55Å; L462-M466 PolarHBondContact O-N 3.08Å; M463-M466 PolarHBondContact O-N 2.99Å; G464-M466 PolarHBondContact O-N 3.14Å; M466-S468 VanDerWaalsContact C-N 3.35Å; M466-S468 PolarHBondContact O-N 2.89Å; M466-V469 HydrophobicContact CE-CB 4.34Å; M466-V469 HydrophobicContact CE-CG2 3.82Å; M466-V469 PolarHBondContact O-N 3.27Å; M466-F470 HydrophobicContact CB-CD2 3.69Å; M466-F470 HydrophobicContact CB-CE2 3.39Å; M466-F470 HydrophobicContact CB-CG 4.46Å; M466-F470 HydrophobicContact CB-CZ 3.93Å; M466-F470 HydrophobicContact CG-CE2 4.42Å; M466-F470 VanDerWaalsContact O-CD2 3.29Å; M466-F470 WeakPolarHBondContact O-CD2 3.41Å; M466-F470 WeakPolarHBondContact O-CG 3.43Å; M466-F470 PolarHBondContact O-N 3.49Å
467	E	84.6	Confident	87.9	Confident	49 Å²	49	34 Å²	34	23%	0.229	18%	0.177	C	C	.	.	H	α-helix	trans	-56.3	-44.8	-173.9	176	172.2	174.5	0	0	112.7	M463 G464 V469 F470 N471 F606 S607	M463-E467 PolarHBondContact O-N 2.73Å; G464-E467 WeakPolarHBondContact O-CB 3.22Å; G464-E467 PolarHBondContact O-N 3.28Å; E467-V469 PolarHBondContact O-N 3.01Å; E467-F470 PolarHBondContact O-N 2.82Å; E467-N471 VanDerWaalsContact CG-ND2 3.31Å; E467-N471 WeakPolarHBondContact CG-ND2 3.41Å; E467-N471 WeakPolarHBondContact O-CB 3.39Å; E467-N471 VanDerWaalsContact O-CG 3.28Å; E467-N471 PolarHBondContact O-N 3.3Å; E467-N471 PolarHBondContact O-ND2 3.09Å; E467-N471 PolarHBondContact OE1-ND2 3.2Å; E467-F606 HydrophobicContact CB-CD1 4.43Å; E467-F606 HydrophobicContact CB-CE1 4.49Å; E467-F606 HydrophobicContact CG-CD1 4.12Å; E467-S607 VanDerWaalsContact OE1-CB 3.29Å; E467-S607 WeakPolarHBondContact OE1-CB 3.25Å; E467-S607 PolarHBondContact OE2-OG 2.65Å
468	S	82.9	Confident	88.1	Confident	79 Å²	79	33.9 Å²	33.9	55%	0.552	18%	0.176	S	C	*	.	H	α-helix	trans	-58.8	-47.8	179	-178.8	0	0	0	0	111.7	M466 N471 Q472	M466-S468 VanDerWaalsContact C-N 3.35Å; M466-S468 PolarHBondContact O-N 2.89Å; S468-N471 PolarHBondContact O-N 3.33Å; S468-Q472 PolarHBondContact O-N 3.5Å; S468-Q472 VanDerWaalsContact O-N 3.12Å
469	V	85.8	Confident	88.4	Confident	32 Å²	32	33.7 Å²	33.7	19%	0.194	17%	0.171	C	C	.	.	H	α-helix	trans	-64.3	-44.7	178.4	-179.7	0	0	0	0	111.1	E369 L388 M466 E467 Q472 A473	E369-V469 HydrophobicContact CG-CG1 4.3Å; E369-V469 HydrophobicContact CG-CG2 4.47Å; L388-V469 HydrophobicContact CD1-CG1 3.98Å; M466-V469 HydrophobicContact CE-CB 4.34Å; M466-V469 HydrophobicContact CE-CG2 3.82Å; M466-V469 PolarHBondContact O-N 3.27Å; E467-V469 PolarHBondContact O-N 3.01Å; V469-Q472 PolarHBondContact O-N 3.16Å; V469-A473 WeakPolarHBondContact O-CB 3.27Å; V469-A473 PolarHBondContact O-N 3.46Å
470	F	88.8	Confident	88.5	Confident	1 Å²	1	34 Å²	34	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-47.2	177.2	-72.2	-41.3	0	0	0	111.9	L362 L391 A392 M463 M466 E467 Q472 A473 I474 F606	L362-F470 HydrophobicContact CD1-CZ 3.72Å; L391-F470 HydrophobicContact CB-CE1 4.3Å; A392-F470 HydrophobicContact CB-CB 4.41Å; A392-F470 HydrophobicContact CB-CD1 3.76Å; A392-F470 HydrophobicContact CB-CD2 4.48Å; A392-F470 HydrophobicContact CB-CE1 4.06Å; A392-F470 HydrophobicContact CB-CG 4Å; M463-F470 HydrophobicContact CE-CE2 3.7Å; M463-F470 HydrophobicContact CE-CZ 4.01Å; M463-F470 HydrophobicContact SD-CE2 3.91Å; M463-F470 HydrophobicContact SD-CZ 4.13Å; M466-F470 HydrophobicContact CB-CD2 3.69Å; M466-F470 HydrophobicContact CB-CE2 3.39Å; M466-F470 HydrophobicContact CB-CG 4.46Å; M466-F470 HydrophobicContact CB-CZ 3.93Å; M466-F470 HydrophobicContact CG-CE2 4.42Å; M466-F470 VanDerWaalsContact O-CD2 3.29Å; M466-F470 WeakPolarHBondContact O-CD2 3.41Å; M466-F470 WeakPolarHBondContact O-CG 3.43Å; M466-F470 PolarHBondContact O-N 3.49Å; E467-F470 PolarHBondContact O-N 2.82Å; F470-Q472 VanDerWaalsContact C-N 3.28Å; F470-Q472 PolarHBondContact O-N 3.18Å; F470-A473 PolarHBondContact O-N 2.94Å; F470-I474 HydrophobicContact CB-CD1 4.08Å; F470-I474 VanDerWaalsContact O-CB 3.22Å; F470-I474 WeakPolarHBondContact O-CB 3.38Å; F470-I474 WeakPolarHBondContact O-CD1 3.46Å; F470-I474 WeakPolarHBondContact O-CG1 3.48Å; F470-I474 PolarHBondContact O-N 3.26Å; F470-F606 AromaticContact CD2-CE1 3.98Å; F470-F606 HydrophobicContact CD2-CE1 3.98Å; F470-F606 HydrophobicContact CD2-CE2 4.25Å; F470-F606 AromaticContact CD2-CZ 3.7Å; F470-F606 HydrophobicContact CD2-CZ 3.7Å; F470-F606 HydrophobicContact CE2-CZ 4.11Å
471	N	87.6	Confident	88.6	Confident	22 Å²	22	34.4 Å²	34.4	12%	0.118	18%	0.181	C	C	.	.	H	α-helix	trans	-58.3	-41.4	179.9	-84.7	-25.9	0	0	0	111.9	E467 S468 R475	E467-N471 VanDerWaalsContact CG-ND2 3.31Å; E467-N471 WeakPolarHBondContact CG-ND2 3.41Å; E467-N471 WeakPolarHBondContact O-CB 3.39Å; E467-N471 VanDerWaalsContact O-CG 3.28Å; E467-N471 PolarHBondContact O-N 3.3Å; E467-N471 PolarHBondContact O-ND2 3.09Å; E467-N471 PolarHBondContact OE1-ND2 3.2Å; S468-N471 PolarHBondContact O-N 3.33Å; N471-R475 WeakPolarHBondContact O-CB 3.39Å; N471-R475 WeakPolarHBondContact O-CG 3.34Å; N471-R475 PolarHBondContact O-N 3.41Å; N471-R475 VanDerWaalsContact O-N 3.16Å
472	Q	87.1	Confident	89	Confident	82 Å²	82	34.2 Å²	34.2	38%	0.383	18%	0.18	S	C	.	.	H	α-helix	trans	-66	-48.5	175.3	-174.9	65.7	1.5	0	0	111.8	S468 V469 F470 N476	S468-Q472 PolarHBondContact O-N 3.5Å; S468-Q472 VanDerWaalsContact O-N 3.12Å; V469-Q472 PolarHBondContact O-N 3.16Å; F470-Q472 VanDerWaalsContact C-N 3.28Å; F470-Q472 PolarHBondContact O-N 3.18Å; Q472-N476 PolarHBondContact NE2-ND2 2.72Å; Q472-N476 PolarHBondContact O-N 3.26Å; Q472-N476 PolarHBondContact O-ND2 2.86Å
473	A	89.8	Confident	89.5	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-47.3	-180	0	0	0	0	0	112	Y385 L388 V469 F470 R475 N476 T477	Y385-A473 HydrophobicContact CD1-CB 3.76Å; L388-A473 HydrophobicContact CB-CB 3.62Å; L388-A473 HydrophobicContact CD1-CB 4Å; L388-A473 HydrophobicContact CG-CB 4.49Å; V469-A473 WeakPolarHBondContact O-CB 3.27Å; V469-A473 PolarHBondContact O-N 3.46Å; F470-A473 PolarHBondContact O-N 2.94Å; A473-R475 PolarHBondContact O-N 3.21Å; A473-N476 PolarHBondContact O-N 3.16Å; A473-T477 PolarHBondContact O-N 3.18Å; A473-T477 PolarHBondContact O-OG1 3.18Å; A473-T477 VanDerWaalsContact O-OG1 3.07Å
474	I	92.4	Very high	89.8	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.7	-48	179.9	-71	164.3	0	0	0	110.9	F389 A392 F470 N476 T477 I478 L603 L604 F606	F389-I474 HydrophobicContact CD2-CB 4.35Å; F389-I474 HydrophobicContact CD2-CG1 4.03Å; F389-I474 HydrophobicContact CD2-CG2 4.31Å; A392-I474 HydrophobicContact CB-CD1 3.96Å; A392-I474 HydrophobicContact CB-CG1 4.47Å; F470-I474 HydrophobicContact CB-CD1 4.08Å; F470-I474 VanDerWaalsContact O-CB 3.22Å; F470-I474 WeakPolarHBondContact O-CB 3.38Å; F470-I474 WeakPolarHBondContact O-CD1 3.46Å; F470-I474 WeakPolarHBondContact O-CG1 3.48Å; F470-I474 PolarHBondContact O-N 3.26Å; I474-N476 PolarHBondContact O-N 2.89Å; I474-T477 PolarHBondContact O-N 2.69Å; I474-I478 HydrophobicContact CG2-CD1 3.5Å; I474-I478 VanDerWaalsContact CG2-CD1 3.5Å; I474-I478 HydrophobicContact CG2-CG1 4.27Å; I474-I478 WeakPolarHBondContact O-CB 3.48Å; I474-I478 VanDerWaalsContact O-CG1 3.25Å; I474-I478 WeakPolarHBondContact O-CG1 3.34Å; I474-I478 PolarHBondContact O-N 3.02Å; I474-L603 HydrophobicContact CD1-CB 4.15Å; I474-L603 HydrophobicContact CD1-CD2 4.21Å; I474-L603 HydrophobicContact CG1-CB 4.45Å; I474-L603 HydrophobicContact CG2-CB 3.78Å; I474-L604 HydrophobicContact CG2-CD2 4.38Å; I474-F606 HydrophobicContact CD1-CB 4.5Å; I474-F606 HydrophobicContact CD1-CD2 4.23Å
475	R	91.7	Very high	90.2	Very high	75 Å²	75	33.2 Å²	33.2	28%	0.283	17%	0.167	S	C	.	.	H	α-helix	trans	-63	-42.5	-179.8	-71.9	174.2	-168.2	124.5	8.3	112	N471 A473 Y479 L604	N471-R475 WeakPolarHBondContact O-CB 3.39Å; N471-R475 WeakPolarHBondContact O-CG 3.34Å; N471-R475 PolarHBondContact O-N 3.41Å; N471-R475 VanDerWaalsContact O-N 3.16Å; A473-R475 PolarHBondContact O-N 3.21Å; R475-Y479 VanDerWaalsContact O-CB 3.25Å; R475-Y479 WeakPolarHBondContact O-CB 3.49Å; R475-Y479 PolarHBondContact O-N 3.12Å; R475-L604 HydrophobicContact CG-CD2 4Å
476	N	92.1	Very high	90.7	Very high	20 Å²	20	25.2 Å²	25.2	11%	0.107	14%	0.137	C	C	.	.	H	α-helix	trans	-64.2	-47.9	176.6	-77.7	-70.6	0	0	0	111.9	Y385 Q472 A473 I474 Y479 A480 R548 A549	Y385-N476 HydrophobicContact CD2-CB 4.08Å; Y385-N476 HydrophobicContact CE2-CB 4.38Å; Y385-N476 HydrophobicContact CG-CB 4.23Å; Q472-N476 PolarHBondContact NE2-ND2 2.72Å; Q472-N476 PolarHBondContact O-N 3.26Å; Q472-N476 PolarHBondContact O-ND2 2.86Å; A473-N476 PolarHBondContact O-N 3.16Å; I474-N476 PolarHBondContact O-N 2.89Å; N476-Y479 PolarHBondContact O-N 3.19Å; N476-A480 VanDerWaalsContact O-CB 3.29Å; N476-A480 WeakPolarHBondContact O-CB 3.31Å; N476-A480 PolarHBondContact O-N 3.37Å; N476-R548 VanDerWaalsContact OD1-C 3.29Å; N476-R548 PolarHBondContact OD1-O 3.29Å; N476-A549 WeakPolarHBondContact ND2-CB 3.34Å; N476-A549 WeakPolarHBondContact OD1-CA 3.41Å; N476-A549 PolarHBondContact OD1-N 3.32Å
477	T	94.6	Very high	91.2	Very high	21 Å²	21	24.4 Å²	24.4	13%	0.129	13%	0.133	C	C	.	.	H	α-helix	trans	-64.3	-43.4	-179.6	-56.7	0	0	0	0	112	Y385 R386 F389 A473 I474 A480 A481	Y385-T477 VanDerWaalsContact C-OG1 3.3Å; Y385-T477 PolarHBondContact O-OG1 2.87Å; R386-T477 HydrophobicContact CB-CG2 4.31Å; R386-T477 HydrophobicContact CG-CG2 4.36Å; R386-T477 PolarHBondContact N-OG1 2.67Å; F389-T477 HydrophobicContact CB-CG2 4.1Å; F389-T477 HydrophobicContact CD1-CG2 4.37Å; F389-T477 HydrophobicContact CD2-CG2 4.2Å; F389-T477 HydrophobicContact CG-CG2 3.98Å; A473-T477 PolarHBondContact O-N 3.18Å; A473-T477 PolarHBondContact O-OG1 3.18Å; A473-T477 VanDerWaalsContact O-OG1 3.07Å; I474-T477 PolarHBondContact O-N 2.69Å; T477-A480 PolarHBondContact O-N 2.58Å; T477-A481 VanDerWaalsContact O-CB 3.25Å; T477-A481 WeakPolarHBondContact O-CB 3.44Å; T477-A481 PolarHBondContact O-N 3.02Å
478	I	94.9	Very high	91.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.8	-44	178	-70.1	174.5	0	0	0	110.7	F389 I474 L482 P552 F600 L604	F389-I478 HydrophobicContact CD2-CG1 4.47Å; F389-I478 HydrophobicContact CE2-CD1 4.19Å; F389-I478 HydrophobicContact CE2-CG1 3.88Å; I474-I478 HydrophobicContact CG2-CD1 3.5Å; I474-I478 VanDerWaalsContact CG2-CD1 3.5Å; I474-I478 HydrophobicContact CG2-CG1 4.27Å; I474-I478 WeakPolarHBondContact O-CB 3.48Å; I474-I478 VanDerWaalsContact O-CG1 3.25Å; I474-I478 WeakPolarHBondContact O-CG1 3.34Å; I474-I478 PolarHBondContact O-N 3.02Å; I478-L482 VanDerWaalsContact O-CB 3.28Å; I478-L482 WeakPolarHBondContact O-CB 3.07Å; I478-L482 PolarHBondContact O-N 3.47Å; I478-P552 HydrophobicContact CG2-CG 4.24Å; I478-F600 HydrophobicContact CB-CD2 4.47Å; I478-F600 HydrophobicContact CD1-CB 3.89Å; I478-F600 HydrophobicContact CD1-CD1 4.04Å; I478-F600 HydrophobicContact CD1-CG 3.89Å; I478-F600 HydrophobicContact CG1-CB 4.42Å; I478-F600 HydrophobicContact CG1-CD1 3.84Å; I478-F600 HydrophobicContact CG1-CD2 4.15Å; I478-F600 HydrophobicContact CG1-CE1 4.1Å; I478-F600 HydrophobicContact CG1-CE2 4.39Å; I478-F600 HydrophobicContact CG1-CG 3.88Å; I478-F600 HydrophobicContact CG1-CZ 4.36Å; I478-F600 HydrophobicContact CG2-CD2 3.71Å; I478-F600 HydrophobicContact CG2-CE2 4.06Å; I478-F600 HydrophobicContact CG2-CG 4.16Å; I478-L604 HydrophobicContact CD1-CD1 4.23Å; I478-L604 HydrophobicContact CD1-CD2 3.85Å; I478-L604 HydrophobicContact CD1-CG 3.67Å
479	Y	94.4	Very high	91.9	Very high	13 Å²	13	24.2 Å²	24.2	5%	0.051	13%	0.132	C	C	.	.	H	α-helix	trans	-61.2	-50.6	176.9	-175.4	-92.9	0	0	0	111.5	R475 N476 A481 L482 Q483 D518 P546 R548 V550	R475-Y479 VanDerWaalsContact O-CB 3.25Å; R475-Y479 WeakPolarHBondContact O-CB 3.49Å; R475-Y479 PolarHBondContact O-N 3.12Å; N476-Y479 PolarHBondContact O-N 3.19Å; Y479-A481 PolarHBondContact O-N 3.1Å; Y479-L482 PolarHBondContact O-N 2.81Å; Y479-Q483 HydrophobicContact CD1-CG 3.93Å; Y479-Q483 HydrophobicContact CD2-CG 4.29Å; Y479-Q483 HydrophobicContact CE1-CB 4.5Å; Y479-Q483 HydrophobicContact CE1-CG 3.54Å; Y479-Q483 HydrophobicContact CE2-CG 3.93Å; Y479-Q483 HydrophobicContact CG-CG 4.3Å; Y479-Q483 WeakPolarHBondContact O-CB 3.31Å; Y479-Q483 WeakPolarHBondContact O-CG 3.34Å; Y479-Q483 PolarHBondContact O-N 3.39Å; Y479-D518 VanDerWaalsContact OH-CB 3.3Å; Y479-D518 WeakPolarHBondContact OH-CB 3.43Å; Y479-D518 PolarHBondContact OH-OD2 3.33Å; Y479-P546 HydrophobicContact CE1-CB 4.4Å; Y479-P546 HydrophobicContact CE1-CG 4.34Å; Y479-P546 WeakPolarHBondContact CE1-O 3.29Å; Y479-R548 VanDerWaalsContact CB-O 3.32Å; Y479-R548 WeakPolarHBondContact CB-O 3.43Å; Y479-R548 HydrophobicContact CD1-CB 3.95Å; Y479-R548 HydrophobicContact CD2-CB 4.15Å; Y479-R548 HydrophobicContact CE1-CB 3.77Å; Y479-R548 HydrophobicContact CE1-CG 3.86Å; Y479-R548 HydrophobicContact CE2-CB 3.99Å; Y479-R548 HydrophobicContact CE2-CG 4.26Å; Y479-R548 HydrophobicContact CG-CB 4.12Å; Y479-R548 WeakPolarHBondContact OH-CD 3.49Å; Y479-V550 WeakPolarHBondContact CB-O 3.36Å; Y479-V550 HydrophobicContact CD2-CG1 4.23Å; Y479-V550 VanDerWaalsContact CD2-O 3.28Å; Y479-V550 WeakPolarHBondContact CD2-O 3.48Å; Y479-V550 HydrophobicContact CE2-CG1 4.44Å
480	A	93.4	Very high	92.1	Very high	7 Å²	7	22.8 Å²	22.8	6%	0.058	12%	0.123	C	C	.	.	H	α-helix	trans	-56.8	-50.3	178.2	0	0	0	0	0	111.1	N476 T477 L482 Q483 D484	N476-A480 VanDerWaalsContact O-CB 3.29Å; N476-A480 WeakPolarHBondContact O-CB 3.31Å; N476-A480 PolarHBondContact O-N 3.37Å; T477-A480 PolarHBondContact O-N 2.58Å; A480-L482 VanDerWaalsContact C-N 3.35Å; A480-L482 PolarHBondContact O-N 3.34Å; A480-Q483 PolarHBondContact O-N 3.36Å; A480-D484 VanDerWaalsContact O-CB 3.24Å; A480-D484 WeakPolarHBondContact O-CB 3.26Å; A480-D484 PolarHBondContact O-N 3.08Å
481	A	93.8	Very high	92.2	Very high	36 Å²	36	23.6 Å²	23.6	30%	0.298	13%	0.126	S	C	.	.	H	α-helix	trans	-60	-42.6	178.7	0	0	0	0	0	112.4	T477 Y479 F485 F600	T477-A481 VanDerWaalsContact O-CB 3.25Å; T477-A481 WeakPolarHBondContact O-CB 3.44Å; T477-A481 PolarHBondContact O-N 3.02Å; Y479-A481 PolarHBondContact O-N 3.1Å; A481-F485 WeakPolarHBondContact O-CB 3.44Å; A481-F485 PolarHBondContact O-N 3.2Å; A481-F485 VanDerWaalsContact O-N 3.1Å; A481-F600 HydrophobicContact CB-CZ 4.41Å
482	L	94.5	Very high	92.2	Very high	5 Å²	5	25.9 Å²	25.9	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-67.5	-45.3	179	-178.9	65.2	0	0	0	111.9	I478 Y479 A480 A486 V516 P552 V560 F593	I478-L482 VanDerWaalsContact O-CB 3.28Å; I478-L482 WeakPolarHBondContact O-CB 3.07Å; I478-L482 PolarHBondContact O-N 3.47Å; Y479-L482 PolarHBondContact O-N 2.81Å; A480-L482 VanDerWaalsContact C-N 3.35Å; A480-L482 PolarHBondContact O-N 3.34Å; L482-A486 VanDerWaalsContact O-CB 3.25Å; L482-A486 WeakPolarHBondContact O-CB 3.47Å; L482-A486 PolarHBondContact O-N 2.96Å; L482-V516 HydrophobicContact CD1-CG2 4.18Å; L482-V516 HydrophobicContact CD2-CB 4.14Å; L482-V516 HydrophobicContact CD2-CG1 4.27Å; L482-V516 HydrophobicContact CG-CB 4.39Å; L482-V516 HydrophobicContact CG-CG2 4.35Å; L482-P552 HydrophobicContact CD2-CB 3.71Å; L482-P552 HydrophobicContact CD2-CG 3.92Å; L482-V560 HydrophobicContact CD1-CG1 4.31Å; L482-F593 HydrophobicContact CD1-CE1 4.39Å; L482-F593 HydrophobicContact CD1-CZ 3.73Å
483	Q	94.4	Very high	92.2	Very high	6 Å²	6	22.2 Å²	22.2	3%	0.028	12%	0.12	C	C	.	.	H	α-helix	trans	-72.1	-42.6	-178.6	-64.8	-54.6	-33.8	0	0	112.1	Y479 A480 F485 A486 Q487 V516 V545	Y479-Q483 HydrophobicContact CD1-CG 3.93Å; Y479-Q483 HydrophobicContact CD2-CG 4.29Å; Y479-Q483 HydrophobicContact CE1-CB 4.5Å; Y479-Q483 HydrophobicContact CE1-CG 3.54Å; Y479-Q483 HydrophobicContact CE2-CG 3.93Å; Y479-Q483 HydrophobicContact CG-CG 4.3Å; Y479-Q483 WeakPolarHBondContact O-CB 3.31Å; Y479-Q483 WeakPolarHBondContact O-CG 3.34Å; Y479-Q483 PolarHBondContact O-N 3.39Å; A480-Q483 PolarHBondContact O-N 3.36Å; Q483-F485 VanDerWaalsContact C-N 3.28Å; Q483-F485 PolarHBondContact O-N 3.37Å; Q483-A486 PolarHBondContact O-N 3.26Å; Q483-Q487 VanDerWaalsContact O-CB 3.23Å; Q483-Q487 WeakPolarHBondContact O-CB 3.37Å; Q483-Q487 WeakPolarHBondContact O-CG 3.5Å; Q483-Q487 PolarHBondContact O-N 3.48Å; Q483-V516 PolarHBondContact NE2-O 3.11Å; Q483-V516 PolarHBondContact OE1-O 2.82Å; Q483-V545 HydrophobicContact CB-CG1 3.36Å; Q483-V545 HydrophobicContact CG-CG1 4.39Å
484	D	93.6	Very high	92.1	Very high	52 Å²	52	22.2 Å²	22.2	28%	0.278	12%	0.12	S	C	.	.	I	π-helix	trans	-61.3	-42.1	176.3	-68.4	-12.2	0	0	0	110.2	A480 V488 T489 V545 R547	A480-D484 VanDerWaalsContact O-CB 3.24Å; A480-D484 WeakPolarHBondContact O-CB 3.26Å; A480-D484 PolarHBondContact O-N 3.08Å; D484-V488 WeakPolarHBondContact O-CA 3.35Å; D484-V488 VanDerWaalsContact O-CB 3.29Å; D484-V488 WeakPolarHBondContact O-CB 3.47Å; D484-V488 PolarHBondContact O-N 3.14Å; D484-T489 PolarHBondContact O-N 2.98Å; D484-T489 PolarHBondContact O-OG1 3.31Å; D484-V545 WeakPolarHBondContact OD1-CG1 3.19Å; D484-R547 IonicContact OD1-CZ 2.83Å; D484-R547 IonicContact OD1-NH1 3.7Å; D484-R547 PolarHBondContact OD1-NH1 3.33Å; D484-R547 IonicContact OD1-NH2 3.53Å; D484-R547 PolarHBondContact OD1-NH2 3.13Å; D484-R547 IonicContact OD2-CZ 3.71Å; D484-R547 IonicContact OD2-NH1 2.79Å; D484-R547 IonicContact OD2-NH2 3.5Å; D484-R547 PolarHBondContact OD2-NH2 3.47Å
485	F	94.1	Very high	92	Very high	11 Å²	11	23.1 Å²	23.1	5%	0.048	12%	0.123	C	C	.	.	I	π-helix	trans	-63.8	-51.3	175.4	-176.5	-97.1	0	0	0	112	A481 Q483 T489 L490 L564 I590 F593	A481-F485 WeakPolarHBondContact O-CB 3.44Å; A481-F485 PolarHBondContact O-N 3.2Å; A481-F485 VanDerWaalsContact O-N 3.1Å; Q483-F485 VanDerWaalsContact C-N 3.28Å; Q483-F485 PolarHBondContact O-N 3.37Å; F485-T489 HydrophobicContact CD2-CG2 3.93Å; F485-T489 HydrophobicContact CE2-CG2 4.07Å; F485-T489 WeakPolarHBondContact O-CB 3.47Å; F485-T489 PolarHBondContact O-N 3.32Å; F485-L490 HydrophobicContact CD1-CD1 4.38Å; F485-L490 HydrophobicContact CD1-CG 4.22Å; F485-L490 HydrophobicContact CE1-CD1 4.04Å; F485-L490 HydrophobicContact CE1-CD2 3.76Å; F485-L490 HydrophobicContact CE1-CG 3.9Å; F485-L490 HydrophobicContact CE2-CD2 4.5Å; F485-L490 HydrophobicContact CZ-CD2 3.76Å; F485-L490 HydrophobicContact CZ-CG 4.33Å; F485-L490 WeakPolarHBondContact O-CG 3.24Å; F485-L490 PolarHBondContact O-N 2.93Å; F485-L564 HydrophobicContact CD1-CD1 4.5Å; F485-L564 HydrophobicContact CE1-CD1 3.59Å; F485-L564 HydrophobicContact CE1-CD2 3.77Å; F485-L564 HydrophobicContact CE1-CG 4.33Å; F485-L564 HydrophobicContact CZ-CD1 4.04Å; F485-L564 HydrophobicContact CZ-CD2 3.96Å; F485-I590 HydrophobicContact CZ-CG1 4.11Å; F485-F593 HydrophobicContact CB-CD2 3.75Å; F485-F593 HydrophobicContact CB-CE2 3.81Å; F485-F593 HydrophobicContact CB-CG 4.3Å; F485-F593 HydrophobicContact CB-CZ 4.4Å; F485-F593 AromaticContact CD1-CD1 3.82Å; F485-F593 HydrophobicContact CD1-CD1 3.82Å; F485-F593 HydrophobicContact CD1-CD2 4.19Å; F485-F593 AromaticContact CD1-CE1 3.99Å; F485-F593 HydrophobicContact CD1-CE1 3.99Å; F485-F593 HydrophobicContact CD1-CE2 4.35Å; F485-F593 AromaticContact CD1-CG 3.92Å; F485-F593 HydrophobicContact CD1-CG 3.92Å; F485-F593 HydrophobicContact CD1-CZ 4.26Å; F485-F593 HydrophobicContact CD2-CB 3.64Å; F485-F593 HydrophobicContact CD2-CD1 4.35Å; F485-F593 AromaticContact CD2-CD2 3.87Å; F485-F593 HydrophobicContact CD2-CD2 3.87Å; F485-F593 AromaticContact CD2-CG 3.68Å; F485-F593 HydrophobicContact CD2-CG 3.68Å; F485-F593 HydrophobicContact CE1-CB 4.5Å; F485-F593 AromaticContact CE1-CD1 3.83Å; F485-F593 HydrophobicContact CE1-CD1 3.83Å; F485-F593 HydrophobicContact CE1-CE1 4.28Å; F485-F593 HydrophobicContact CE1-CG 4.13Å; F485-F593 HydrophobicContact CE2-CB 3.52Å; F485-F593 HydrophobicContact CE2-CD1 4.36Å; F485-F593 AromaticContact CE2-CG 3.9Å; F485-F593 HydrophobicContact CE2-CG 3.9Å; F485-F593 HydrophobicContact CG-CB 4.19Å; F485-F593 HydrophobicContact CG-CD1 4.09Å; F485-F593 AromaticContact CG-CD2 3.66Å; F485-F593 HydrophobicContact CG-CD2 3.66Å; F485-F593 HydrophobicContact CG-CE1 4.43Å; F485-F593 HydrophobicContact CG-CE2 4.05Å; F485-F593 AromaticContact CG-CG 3.69Å; F485-F593 HydrophobicContact CG-CG 3.69Å; F485-F593 HydrophobicContact CG-CZ 4.42Å; F485-F593 HydrophobicContact CZ-CB 3.98Å; F485-F593 HydrophobicContact CZ-CD1 4.1Å; F485-F593 HydrophobicContact CZ-CG 4.11Å
486	A	92.5	Very high	91.7	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.008	11%	0.113	C	C	.	.	I	π-helix	trans	-72.1	-41	-174.3	0	0	0	0	0	113.6	L482 Q483 R513 V516	L482-A486 VanDerWaalsContact O-CB 3.25Å; L482-A486 WeakPolarHBondContact O-CB 3.47Å; L482-A486 PolarHBondContact O-N 2.96Å; Q483-A486 PolarHBondContact O-N 3.26Å; A486-R513 WeakPolarHBondContact O-CG 3.45Å; A486-V516 HydrophobicContact CB-CG2 3.87Å
487	Q	91.6	Very high	91.4	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	11%	0.109	C	C	.	.	I	π-helix	trans	-85.9	-35.2	-175.7	-61.8	-171.4	30.3	0	0	113.1	Q483 R491 C517 D518 W519 V545	Q483-Q487 VanDerWaalsContact O-CB 3.23Å; Q483-Q487 WeakPolarHBondContact O-CB 3.37Å; Q483-Q487 WeakPolarHBondContact O-CG 3.5Å; Q483-Q487 PolarHBondContact O-N 3.48Å; Q487-R491 WeakPolarHBondContact O-CD 3.26Å; Q487-R491 WeakPolarHBondContact O-CG 3.43Å; Q487-C517 HydrophobicContact CG-CB 4.12Å; Q487-D518 PolarHBondContact NE2-O 3.39Å; Q487-W519 HydrophobicContact CB-CH2 3.89Å; Q487-W519 HydrophobicContact CB-CZ3 3.73Å; Q487-W519 HydrophobicContact CG-CE3 4.06Å; Q487-W519 HydrophobicContact CG-CH2 3.81Å; Q487-W519 HydrophobicContact CG-CZ2 4.31Å; Q487-W519 HydrophobicContact CG-CZ3 3.68Å; Q487-V545 HydrophobicContact CB-CG2 4.33Å
488	V	91.3	Very high	91	Very high	63 Å²	63	20.1 Å²	20.1	38%	0.382	11%	0.113	S	C	.	.	I	π-helix	trans	-108.5	-57.7	-173.9	-174.2	0	0	0	0	111.3	D484 L490 R491 V545	D484-V488 WeakPolarHBondContact O-CA 3.35Å; D484-V488 VanDerWaalsContact O-CB 3.29Å; D484-V488 WeakPolarHBondContact O-CB 3.47Å; D484-V488 PolarHBondContact O-N 3.14Å; V488-L490 PolarHBondContact O-N 3.44Å; V488-R491 VanDerWaalsContact O-CB 3.26Å; V488-R491 WeakPolarHBondContact O-CB 3.09Å; V488-R491 VanDerWaalsContact O-CG 3.28Å; V488-R491 WeakPolarHBondContact O-CG 3.42Å; V488-R491 PolarHBondContact O-N 3.42Å; V488-R491 VanDerWaalsContact O-N 3.11Å; V488-V545 HydrophobicContact CG2-CG2 3.73Å
489	T	91.1	Very high	90.7	Very high	61 Å²	61	26.8 Å²	26.8	37%	0.374	14%	0.138	S	C	.	.	I	π-helix	trans	-64.2	-38.6	-173.8	-53.6	0	0	0	0	112.6	D484 F485 R491 P493 A589	D484-T489 PolarHBondContact O-N 2.98Å; D484-T489 PolarHBondContact O-OG1 3.31Å; F485-T489 HydrophobicContact CD2-CG2 3.93Å; F485-T489 HydrophobicContact CE2-CG2 4.07Å; F485-T489 WeakPolarHBondContact O-CB 3.47Å; F485-T489 PolarHBondContact O-N 3.32Å; T489-R491 PolarHBondContact O-N 3.09Å; T489-P493 WeakPolarHBondContact O-CD 3.35Å; T489-A589 HydrophobicContact CG2-CB 4.17Å
490	L	90.8	Very high	90.2	Very high	1 Å²	1	30 Å²	30	1%	0.005	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-3.8	177.7	-66.5	-173.2	0	0	0	114.6	F485 V488 P493 L494 L509 I512	F485-L490 HydrophobicContact CD1-CD1 4.38Å; F485-L490 HydrophobicContact CD1-CG 4.22Å; F485-L490 HydrophobicContact CE1-CD1 4.04Å; F485-L490 HydrophobicContact CE1-CD2 3.76Å; F485-L490 HydrophobicContact CE1-CG 3.9Å; F485-L490 HydrophobicContact CE2-CD2 4.5Å; F485-L490 HydrophobicContact CZ-CD2 3.76Å; F485-L490 HydrophobicContact CZ-CG 4.33Å; F485-L490 WeakPolarHBondContact O-CG 3.24Å; F485-L490 PolarHBondContact O-N 2.93Å; V488-L490 PolarHBondContact O-N 3.44Å; L490-P493 HydrophobicContact CD2-CG 4.42Å; L490-P493 WeakPolarHBondContact O-CD 3.45Å; L490-L494 VanDerWaalsContact O-CB 3.22Å; L490-L494 WeakPolarHBondContact O-CB 3.49Å; L490-L494 PolarHBondContact O-N 2.93Å; L490-L494 VanDerWaalsContact O-N 3.13Å; L490-L509 HydrophobicContact CD1-CD2 4.39Å; L490-L509 HydrophobicContact CD2-CD2 3.93Å; L490-I512 HydrophobicContact CD1-CB 4.34Å; L490-I512 HydrophobicContact CD1-CG2 3.7Å
491	R	90.1	Very high	89.8	Confident	18 Å²	18	37.9 Å²	37.9	7%	0.068	19%	0.185	C	C	.	.	H	α-helix	trans	-63.2	-48.2	175.6	-66.8	177.8	70.3	-127.8	-10	112.3	Q487 V488 T489 L494 R495 D528 C530 D536 F541	Q487-R491 WeakPolarHBondContact O-CD 3.26Å; Q487-R491 WeakPolarHBondContact O-CG 3.43Å; V488-R491 VanDerWaalsContact O-CB 3.26Å; V488-R491 WeakPolarHBondContact O-CB 3.09Å; V488-R491 VanDerWaalsContact O-CG 3.28Å; V488-R491 WeakPolarHBondContact O-CG 3.42Å; V488-R491 PolarHBondContact O-N 3.42Å; V488-R491 VanDerWaalsContact O-N 3.11Å; T489-R491 PolarHBondContact O-N 3.09Å; R491-L494 PolarHBondContact O-N 3.2Å; R491-R495 VanDerWaalsContact O-CB 3.32Å; R491-R495 WeakPolarHBondContact O-CB 3.28Å; R491-R495 PolarHBondContact O-N 3.41Å; R491-D528 IonicContact CZ-OD1 2.78Å; R491-D528 IonicContact NE-OD1 3.59Å; R491-D528 IonicContact NE-OD2 2.71Å; R491-D528 PolarHBondContact NE-OD2 2.97Å; R491-D528 IonicContact NH2-OD1 3.95Å; R491-D528 PolarHBondContact NH2-OD1 3.15Å; R491-C530 HydrophobicContact CB-CB 4.35Å; R491-C530 PolarHBondContact NH2-SG 3.21Å; R491-D536 IonicContact CZ-OD1 2.66Å; R491-D536 IonicContact CZ-OD2 2.67Å; R491-D536 IonicContact NH1-OD1 3.24Å; R491-D536 IonicContact NH1-OD2 2.72Å; R491-D536 PolarHBondContact NH1-OD2 3.15Å; R491-D536 IonicContact NH2-OD1 3.43Å; R491-D536 PolarHBondContact NH2-OD1 2.87Å; R491-D536 IonicContact NH2-OD2 2.72Å; R491-F541 PolarHBondContact NH1-O 2.95Å
492	E	87.8	Confident	89.3	Confident	71 Å²	71	39.8 Å²	39.8	33%	0.332	19%	0.187	S	C	.	.	H	α-helix	trans	-65.3	-47.6	-178	176.1	60.4	-157.7	0	0	112.6	L494 R495 Q496 I586	E492-L494 VanDerWaalsContact C-N 3.31Å; E492-L494 PolarHBondContact O-N 3.37Å; E492-R495 VanDerWaalsContact CD-NH2 3.27Å; E492-R495 PolarHBondContact O-N 3.33Å; E492-R495 IonicContact OE1-CZ 2.68Å; E492-R495 IonicContact OE1-NE 3.32Å; E492-R495 IonicContact OE1-NH2 3.01Å; E492-R495 PolarHBondContact OE1-NH2 2.76Å; E492-R495 IonicContact OE2-CZ 2.69Å; E492-R495 VanDerWaalsContact OE2-CZ 3.24Å; E492-R495 IonicContact OE2-NE 3.27Å; E492-R495 PolarHBondContact OE2-NE 3.43Å; E492-R495 IonicContact OE2-NH2 2.95Å; E492-R495 PolarHBondContact OE2-NH2 2.9Å; E492-Q496 WeakPolarHBondContact O-CG 3.34Å; E492-Q496 PolarHBondContact O-N 3.23Å; E492-Q496 PolarHBondContact OE1-NE2 3.46Å; E492-I586 HydrophobicContact CG-CD1 4.34Å
493	P	87.8	Confident	88.8	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.032	22%	0.216	C	C	.	.	H	α-helix	trans	-56.3	-43.1	171.9	-22.5	30.4	0	0	0	113.1	T489 L490 Q496 A497 L509 I586	T489-P493 WeakPolarHBondContact O-CD 3.35Å; L490-P493 HydrophobicContact CD2-CG 4.42Å; L490-P493 WeakPolarHBondContact O-CD 3.45Å; P493-Q496 PolarHBondContact O-N 3.19Å; P493-A497 WeakPolarHBondContact O-CB 3.42Å; P493-A497 PolarHBondContact O-N 3.18Å; P493-L509 HydrophobicContact CB-CD1 3.82Å; P493-L509 HydrophobicContact CB-CD2 4.46Å; P493-I586 HydrophobicContact CB-CD1 4.29Å; P493-I586 HydrophobicContact CB-CG2 3.86Å; P493-I586 HydrophobicContact CG-CB 4.33Å; P493-I586 HydrophobicContact CG-CD1 4.08Å; P493-I586 HydrophobicContact CG-CG1 4.01Å; P493-I586 HydrophobicContact CG-CG2 3.47Å; P493-I586 VanDerWaalsContact CG-CG2 3.47Å
494	L	88	Confident	88.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.5	-44.9	179.7	-177.1	62.6	0	0	0	111.3	L490 R491 E492 Q496 A497 V498 I506 L509 Q510 L531	L490-L494 VanDerWaalsContact O-CB 3.22Å; L490-L494 WeakPolarHBondContact O-CB 3.49Å; L490-L494 PolarHBondContact O-N 2.93Å; L490-L494 VanDerWaalsContact O-N 3.13Å; R491-L494 PolarHBondContact O-N 3.2Å; E492-L494 VanDerWaalsContact C-N 3.31Å; E492-L494 PolarHBondContact O-N 3.37Å; L494-Q496 VanDerWaalsContact C-N 3.31Å; L494-Q496 PolarHBondContact O-N 3.38Å; L494-A497 WeakPolarHBondContact O-CB 3.49Å; L494-A497 PolarHBondContact O-N 2.88Å; L494-A497 VanDerWaalsContact O-N 3.13Å; L494-V498 HydrophobicContact CD1-CG2 4.36Å; L494-V498 HydrophobicContact CG-CG2 4.48Å; L494-V498 WeakPolarHBondContact O-CG2 3.4Å; L494-V498 PolarHBondContact O-N 2.53Å; L494-I506 HydrophobicContact CD1-CG2 4.2Å; L494-L509 HydrophobicContact CB-CD1 4.22Å; L494-L509 HydrophobicContact CD1-CB 4.08Å; L494-L509 HydrophobicContact CD1-CD1 4.42Å; L494-Q510 HydrophobicContact CD1-CG 4Å; L494-L531 HydrophobicContact CD2-CD2 3.86Å
495	R	89.1	Confident	87.6	Confident	18 Å²	18	47 Å²	47	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-55.9	-46.6	175.5	-176.1	-172.9	75.7	97.4	-4.8	111.4	R491 E492 V498 R499 C530 E534	R491-R495 VanDerWaalsContact O-CB 3.32Å; R491-R495 WeakPolarHBondContact O-CB 3.28Å; R491-R495 PolarHBondContact O-N 3.41Å; E492-R495 VanDerWaalsContact CD-NH2 3.27Å; E492-R495 PolarHBondContact O-N 3.33Å; E492-R495 IonicContact OE1-CZ 2.68Å; E492-R495 IonicContact OE1-NE 3.32Å; E492-R495 IonicContact OE1-NH2 3.01Å; E492-R495 PolarHBondContact OE1-NH2 2.76Å; E492-R495 IonicContact OE2-CZ 2.69Å; E492-R495 VanDerWaalsContact OE2-CZ 3.24Å; E492-R495 IonicContact OE2-NE 3.27Å; E492-R495 PolarHBondContact OE2-NE 3.43Å; E492-R495 IonicContact OE2-NH2 2.95Å; E492-R495 PolarHBondContact OE2-NH2 2.9Å; R495-V498 PolarHBondContact O-N 2.98Å; R495-R499 VanDerWaalsContact O-CB 3.24Å; R495-R499 WeakPolarHBondContact O-CB 3.1Å; R495-R499 PolarHBondContact O-N 3.14Å; R495-C530 HydrophobicContact CB-CB 3.9Å; R495-C530 HydrophobicContact CG-CB 4.38Å; R495-E534 WeakPolarHBondContact CD-O 3.48Å
496	Q	85.1	Confident	87.2	Confident	17 Å²	17	47.7 Å²	47.7	8%	0.079	23%	0.233	C	C	.	.	H	α-helix	trans	-65.2	-40.3	177.5	-68.9	-160.9	15.3	0	0	112.4	E492 P493 L494 R499 K500 D583	E492-Q496 WeakPolarHBondContact O-CG 3.34Å; E492-Q496 PolarHBondContact O-N 3.23Å; E492-Q496 PolarHBondContact OE1-NE2 3.46Å; P493-Q496 PolarHBondContact O-N 3.19Å; L494-Q496 VanDerWaalsContact C-N 3.31Å; L494-Q496 PolarHBondContact O-N 3.38Å; Q496-R499 PolarHBondContact O-N 2.86Å; Q496-K500 WeakPolarHBondContact O-CB 3.43Å; Q496-K500 WeakPolarHBondContact O-CG 3.44Å; Q496-K500 PolarHBondContact O-N 3.34Å; Q496-D583 VanDerWaalsContact CD-OD2 3.26Å; Q496-D583 PolarHBondContact NE2-OD2 3.37Å; Q496-D583 PolarHBondContact OE1-OD1 2.65Å; Q496-D583 PolarHBondContact OE1-OD2 3.12Å
497	A	86.4	Confident	86.9	Confident	3 Å²	3	50 Å²	50	3%	0.025	25%	0.249	C	C	.	.	H	α-helix	trans	-63.4	-44.2	177.6	0	0	0	0	0	111.5	P493 L494 K501 K502 L505 I506 L509	P493-A497 WeakPolarHBondContact O-CB 3.42Å; P493-A497 PolarHBondContact O-N 3.18Å; L494-A497 WeakPolarHBondContact O-CB 3.49Å; L494-A497 PolarHBondContact O-N 2.88Å; L494-A497 VanDerWaalsContact O-N 3.13Å; A497-K501 PolarHBondContact O-N 3.28Å; A497-K502 HydrophobicContact CB-CB 4.34Å; A497-K502 PolarHBondContact O-N 3.2Å; A497-L505 HydrophobicContact CB-CB 4.21Å; A497-L505 HydrophobicContact CB-CD2 3.84Å; A497-I506 HydrophobicContact CB-CG1 3.68Å; A497-L509 HydrophobicContact CB-CD1 4.48Å
498	V	87.3	Confident	86.7	Confident	34 Å²	34	50 Å²	50	21%	0.206	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-50.5	174.8	174.8	0	0	0	0	110.7	L494 R495 K500 K501 I506	L494-V498 HydrophobicContact CD1-CG2 4.36Å; L494-V498 HydrophobicContact CG-CG2 4.48Å; L494-V498 WeakPolarHBondContact O-CG2 3.4Å; L494-V498 PolarHBondContact O-N 2.53Å; R495-V498 PolarHBondContact O-N 2.98Å; V498-K500 PolarHBondContact O-N 2.57Å; V498-K501 PolarHBondContact O-N 3.19Å; V498-K501 VanDerWaalsContact O-N 3.09Å; V498-I506 HydrophobicContact CB-CD1 4.43Å; V498-I506 HydrophobicContact CG2-CD1 3.98Å; V498-I506 HydrophobicContact CG2-CG1 4.09Å
499	R	86.8	Confident	86.5	Confident	139 Å²	139	47 Å²	47	53%	0.525	23%	0.23	S	C	.	.	H	α-helix	trans	-60.2	-43	179.4	-171.5	-176.7	71.7	162.6	-1.1	112.8	R495 Q496 K501	R495-R499 VanDerWaalsContact O-CB 3.24Å; R495-R499 WeakPolarHBondContact O-CB 3.1Å; R495-R499 PolarHBondContact O-N 3.14Å; Q496-R499 PolarHBondContact O-N 2.86Å; R499-K501 VanDerWaalsContact C-N 3.28Å; R499-K501 PolarHBondContact O-N 3.06Å
500	K	84.6	Confident	86.3	Confident	81 Å²	81	47.2 Å²	47.2	35%	0.352	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	4.7	179.3	-64.8	171.3	177.3	164.3	0	112.5	Q496 V498 K502 D583	Q496-K500 WeakPolarHBondContact O-CB 3.43Å; Q496-K500 WeakPolarHBondContact O-CG 3.44Å; Q496-K500 PolarHBondContact O-N 3.34Å; V498-K500 PolarHBondContact O-N 2.57Å; K500-K502 VanDerWaalsContact C-N 3.33Å; K500-K502 HydrophobicContact CB-CG 3.93Å; K500-K502 PolarHBondContact O-N 3.11Å; K500-D583 IonicContact NZ-OD1 3.57Å; K500-D583 PolarHBondContact NZ-OD1 3.44Å; K500-D583 IonicContact NZ-OD2 3.12Å
501	K	84.6	Confident	86.1	Confident	172 Å²	172	47.4 Å²	47.4	75%	0.748	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	43.6	-177.7	-60.9	-174.5	179.1	-177.4	0	114.2	A497 V498 R499 N503	A497-K501 PolarHBondContact O-N 3.28Å; V498-K501 PolarHBondContact O-N 3.19Å; V498-K501 VanDerWaalsContact O-N 3.09Å; R499-K501 VanDerWaalsContact C-N 3.28Å; R499-K501 PolarHBondContact O-N 3.06Å; K501-N503 PolarHBondContact O-N 3.37Å
502	K	83.8	Confident	86.1	Confident	76 Å²	76	46.5 Å²	46.5	33%	0.33	23%	0.225	S	C	.	.			trans	-90.4	73.6	-179.4	-62.9	-68.5	-176.7	168.5	0	111	A497 K500 V504 L505 I506	A497-K502 HydrophobicContact CB-CB 4.34Å; A497-K502 PolarHBondContact O-N 3.2Å; K500-K502 VanDerWaalsContact C-N 3.33Å; K500-K502 HydrophobicContact CB-CG 3.93Å; K500-K502 PolarHBondContact O-N 3.11Å; K502-V504 VanDerWaalsContact C-N 3.33Å; K502-V504 PolarHBondContact O-N 3.14Å; K502-L505 HydrophobicContact CB-CB 3.95Å; K502-L505 WeakPolarHBondContact O-CB 3.44Å; K502-L505 PolarHBondContact O-N 3.46Å; K502-I506 WeakPolarHBondContact O-CG1 3.22Å; K502-I506 PolarHBondContact O-N 3.48Å
503	N	83.1	Confident	86.1	Confident	119 Å²	119	43.3 Å²	43.3	64%	0.636	21%	0.21	S	C	*	.	H	α-helix	trans	-53.3	-40	-170.8	-63.6	-16.4	0	0	0	115.1	K501 L505 I506 S507	K501-N503 PolarHBondContact O-N 3.37Å; N503-L505 VanDerWaalsContact C-N 3.34Å; N503-L505 PolarHBondContact O-N 3.39Å; N503-I506 PolarHBondContact O-N 3.16Å; N503-S507 PolarHBondContact O-N 3Å
504	V	81.8	Confident	86.1	Confident	89 Å²	89	49.2 Å²	49.2	54%	0.539	24%	0.235	S	C	.	.	H	α-helix	trans	-63.1	-43.3	177.1	-179.1	0	0	0	0	110.9	K502 S507 V508 L578	K502-V504 VanDerWaalsContact C-N 3.33Å; K502-V504 PolarHBondContact O-N 3.14Å; V504-S507 PolarHBondContact O-N 3.47Å; V504-S507 PolarHBondContact O-OG 3.33Å; V504-V508 PolarHBondContact O-N 3.39Å; V504-V508 VanDerWaalsContact O-N 3.16Å; V504-L578 HydrophobicContact CB-CD2 4.44Å; V504-L578 HydrophobicContact CG1-CD2 3.93Å
505	L	82.8	Confident	86	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.037	24%	0.237	C	C	.	.	H	α-helix	trans	-70.3	-37.4	-178.4	-143.3	139.9	0	0	0	111.2	A497 K502 N503 L509 L567 L578 L582	A497-L505 HydrophobicContact CB-CB 4.21Å; A497-L505 HydrophobicContact CB-CD2 3.84Å; K502-L505 HydrophobicContact CB-CB 3.95Å; K502-L505 WeakPolarHBondContact O-CB 3.44Å; K502-L505 PolarHBondContact O-N 3.46Å; N503-L505 VanDerWaalsContact C-N 3.34Å; N503-L505 PolarHBondContact O-N 3.39Å; L505-L509 HydrophobicContact CD2-CD1 3.61Å; L505-L509 HydrophobicContact CD2-CG 4.25Å; L505-L509 WeakPolarHBondContact O-CB 3.36Å; L505-L509 VanDerWaalsContact O-CG 3.28Å; L505-L509 WeakPolarHBondContact O-CG 3.19Å; L505-L509 PolarHBondContact O-N 3.32Å; L505-L509 VanDerWaalsContact O-N 3.11Å; L505-L567 HydrophobicContact CG-CD2 4.18Å; L505-L578 HydrophobicContact CD1-CD2 4.42Å; L505-L582 HydrophobicContact CD1-CD2 4.13Å; L505-L582 HydrophobicContact CD1-CG 4.17Å; L505-L582 HydrophobicContact CD2-CD2 3.67Å; L505-L582 HydrophobicContact CG-CD2 4.47Å
506	I	85.2	Confident	86.1	Confident	26 Å²	26	49 Å²	49	13%	0.133	24%	0.236	C	C	.	.	H	α-helix	trans	-59.3	-46.9	170.2	-61.3	168.5	0	0	0	110.3	L494 A497 V498 K502 N503 V508 L509 Q510	L494-I506 HydrophobicContact CD1-CG2 4.2Å; A497-I506 HydrophobicContact CB-CG1 3.68Å; V498-I506 HydrophobicContact CB-CD1 4.43Å; V498-I506 HydrophobicContact CG2-CD1 3.98Å; V498-I506 HydrophobicContact CG2-CG1 4.09Å; K502-I506 WeakPolarHBondContact O-CG1 3.22Å; K502-I506 PolarHBondContact O-N 3.48Å; N503-I506 PolarHBondContact O-N 3.16Å; I506-V508 PolarHBondContact O-N 2.86Å; I506-L509 PolarHBondContact O-N 2.86Å; I506-Q510 HydrophobicContact CG2-CG 4.19Å; I506-Q510 VanDerWaalsContact O-CB 3.32Å; I506-Q510 WeakPolarHBondContact O-CB 3.4Å; I506-Q510 WeakPolarHBondContact O-CG 3.45Å; I506-Q510 PolarHBondContact O-N 2.94Å
507	S	86	Confident	86.4	Confident	49 Å²	49	49.2 Å²	49.2	34%	0.343	24%	0.239	S	C	.	.	H	α-helix	trans	-62.4	-41.8	-176.5	71	0	0	0	0	113	N503 V504 A511	N503-S507 PolarHBondContact O-N 3Å; V504-S507 PolarHBondContact O-N 3.47Å; V504-S507 PolarHBondContact O-OG 3.33Å; S507-A511 VanDerWaalsContact O-CB 3.25Å; S507-A511 WeakPolarHBondContact O-CB 3.42Å; S507-A511 PolarHBondContact O-N 3.47Å
508	V	86.3	Confident	86.6	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-69.7	-47.2	178.4	179.1	0	0	0	0	111	I56 V504 I506 Q510 A511 I512 M563 L567	I56-V508 HydrophobicContact CD1-CG2 3.71Å; V504-V508 PolarHBondContact O-N 3.39Å; V504-V508 VanDerWaalsContact O-N 3.16Å; I506-V508 PolarHBondContact O-N 2.86Å; V508-Q510 VanDerWaalsContact C-N 3.34Å; V508-Q510 PolarHBondContact O-N 2.72Å; V508-A511 WeakPolarHBondContact O-CB 3.29Å; V508-A511 PolarHBondContact O-N 2.69Å; V508-I512 HydrophobicContact CG1-CD1 4.25Å; V508-I512 WeakPolarHBondContact O-CG1 3.14Å; V508-I512 PolarHBondContact O-N 3.17Å; V508-M563 HydrophobicContact CG1-CB 3.94Å; V508-M563 HydrophobicContact CG1-CG 4.38Å; V508-L567 HydrophobicContact CB-CD2 4.17Å; V508-L567 HydrophobicContact CG1-CD1 4.18Å; V508-L567 HydrophobicContact CG1-CD2 3.95Å; V508-L567 HydrophobicContact CG1-CG 4.02Å
509	L	87.8	Confident	86.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.1	-39.4	179.6	-70.7	176.5	0	0	0	112.4	L490 P493 L494 A497 L505 I506 R513 L567	L490-L509 HydrophobicContact CD1-CD2 4.39Å; L490-L509 HydrophobicContact CD2-CD2 3.93Å; P493-L509 HydrophobicContact CB-CD1 3.82Å; P493-L509 HydrophobicContact CB-CD2 4.46Å; L494-L509 HydrophobicContact CB-CD1 4.22Å; L494-L509 HydrophobicContact CD1-CB 4.08Å; L494-L509 HydrophobicContact CD1-CD1 4.42Å; A497-L509 HydrophobicContact CB-CD1 4.48Å; L505-L509 HydrophobicContact CD2-CD1 3.61Å; L505-L509 HydrophobicContact CD2-CG 4.25Å; L505-L509 WeakPolarHBondContact O-CB 3.36Å; L505-L509 VanDerWaalsContact O-CG 3.28Å; L505-L509 WeakPolarHBondContact O-CG 3.19Å; L505-L509 PolarHBondContact O-N 3.32Å; L505-L509 VanDerWaalsContact O-N 3.11Å; I506-L509 PolarHBondContact O-N 2.86Å; L509-R513 PolarHBondContact O-N 3.14Å; L509-R513 VanDerWaalsContact O-N 3.13Å; L509-L567 HydrophobicContact CD2-CD1 3.76Å; L509-L567 HydrophobicContact CG-CD1 4.44Å
510	Q	86.6	Confident	86.8	Confident	66 Å²	66	50.2 Å²	50.2	31%	0.308	25%	0.248	S	C	.	.	H	α-helix	trans	-70.7	-35.4	174.3	-73.9	-175.9	-19.4	0	0	112.3	L494 I506 V508 I512 R513 K514	L494-Q510 HydrophobicContact CD1-CG 4Å; I506-Q510 HydrophobicContact CG2-CG 4.19Å; I506-Q510 VanDerWaalsContact O-CB 3.32Å; I506-Q510 WeakPolarHBondContact O-CB 3.4Å; I506-Q510 WeakPolarHBondContact O-CG 3.45Å; I506-Q510 PolarHBondContact O-N 2.94Å; V508-Q510 VanDerWaalsContact C-N 3.34Å; V508-Q510 PolarHBondContact O-N 2.72Å; Q510-I512 VanDerWaalsContact C-N 3.34Å; Q510-R513 PolarHBondContact O-N 3.44Å; Q510-K514 WeakPolarHBondContact O-CB 3.29Å; Q510-K514 VanDerWaalsContact O-CG 3.28Å; Q510-K514 WeakPolarHBondContact O-CG 3.44Å; Q510-K514 PolarHBondContact O-N 3.22Å
511	A	87.3	Confident	86.5	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.033	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-43.2	174.5	0	0	0	0	0	111.1	S507 V508 K514 T515 M563	S507-A511 VanDerWaalsContact O-CB 3.25Å; S507-A511 WeakPolarHBondContact O-CB 3.42Å; S507-A511 PolarHBondContact O-N 3.47Å; V508-A511 WeakPolarHBondContact O-CB 3.29Å; V508-A511 PolarHBondContact O-N 2.69Å; A511-K514 PolarHBondContact O-N 2.78Å; A511-T515 WeakPolarHBondContact O-CB 3.39Å; A511-T515 PolarHBondContact O-N 3.28Å; A511-T515 VanDerWaalsContact O-N 3.08Å; A511-T515 PolarHBondContact O-OG1 3.13Å; A511-M563 HydrophobicContact CB-SD 3.73Å
512	I	89.4	Confident	86.4	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.1	-55.1	173	-67.3	164.4	0	0	0	110.2	L490 V508 Q510 K514 T515 V516 V560 M563 L564 L567	L490-I512 HydrophobicContact CD1-CB 4.34Å; L490-I512 HydrophobicContact CD1-CG2 3.7Å; V508-I512 HydrophobicContact CG1-CD1 4.25Å; V508-I512 WeakPolarHBondContact O-CG1 3.14Å; V508-I512 PolarHBondContact O-N 3.17Å; Q510-I512 VanDerWaalsContact C-N 3.34Å; I512-K514 VanDerWaalsContact C-N 3.33Å; I512-K514 PolarHBondContact O-N 3.46Å; I512-T515 WeakPolarHBondContact O-CB 3.45Å; I512-T515 PolarHBondContact O-N 3.17Å; I512-V516 WeakPolarHBondContact O-CG2 3.37Å; I512-V516 PolarHBondContact O-N 3.05Å; I512-V560 HydrophobicContact CG2-CG1 4.22Å; I512-V560 HydrophobicContact CG2-CG2 4.18Å; I512-M563 HydrophobicContact CB-CE 4.46Å; I512-M563 HydrophobicContact CD1-CB 3.86Å; I512-M563 HydrophobicContact CG1-CB 3.73Å; I512-M563 HydrophobicContact CG1-CE 3.71Å; I512-M563 HydrophobicContact CG1-CG 4.46Å; I512-M563 HydrophobicContact CG1-SD 3.95Å; I512-L564 HydrophobicContact CD1-CD2 3.57Å; I512-L564 HydrophobicContact CD1-CG 3.9Å; I512-L567 HydrophobicContact CD1-CD1 4.44Å
513	R	89.4	Confident	86.4	Confident	4 Å²	4	51 Å²	51	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-57.7	-43	-178.7	-73.2	177.2	62.6	157	-3.1	112.6	A486 L509 Q510 T515 C517 W519 E524	A486-R513 WeakPolarHBondContact O-CG 3.45Å; L509-R513 PolarHBondContact O-N 3.14Å; L509-R513 VanDerWaalsContact O-N 3.13Å; Q510-R513 PolarHBondContact O-N 3.44Å; R513-T515 VanDerWaalsContact C-N 3.27Å; R513-T515 PolarHBondContact O-N 3.31Å; R513-C517 VanDerWaalsContact CA-SG 3.58Å; R513-C517 WeakPolarHBondContact O-CB 3.29Å; R513-C517 PolarHBondContact O-N 3.33Å; R513-C517 PolarHBondContact O-SG 2.88Å; R513-C517 VanDerWaalsContact O-SG 3.32Å; R513-W519 VanDerWaalsContact NH2-CH2 3.26Å; R513-E524 IonicContact CZ-OE1 3.06Å; R513-E524 IonicContact NE-OE1 2.79Å; R513-E524 PolarHBondContact NE-OE1 3.18Å; R513-E524 IonicContact NH2-OE1 3.22Å; R513-E524 PolarHBondContact NH2-OE1 3.45Å
514	K	86.6	Confident	86.5	Confident	128 Å²	128	48.4 Å²	48.4	56%	0.557	27%	0.267	S	S	*	.	H	α-helix	trans	-66.8	-25.6	177.5	-72.7	176.7	-178.4	-178.8	0	114	T54 Q510 A511 I512	T54-K514 HydrophobicContact CG2-CD 4.24Å; Q510-K514 WeakPolarHBondContact O-CB 3.29Å; Q510-K514 VanDerWaalsContact O-CG 3.28Å; Q510-K514 WeakPolarHBondContact O-CG 3.44Å; Q510-K514 PolarHBondContact O-N 3.22Å; A511-K514 PolarHBondContact O-N 2.78Å; I512-K514 VanDerWaalsContact C-N 3.33Å; I512-K514 PolarHBondContact O-N 3.46Å
515	T	87.1	Confident	86.8	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.043	25%	0.249	C	C	.	.	H	α-helix	trans	-79.9	-35.4	-177.3	-56.7	0	0	0	0	111.9	F52 A511 I512 R513 Q556 M559	F52-T515 HydrophobicContact CD1-CG2 3.77Å; F52-T515 HydrophobicContact CE1-CG2 4.14Å; F52-T515 HydrophobicContact CG-CG2 4.31Å; A511-T515 WeakPolarHBondContact O-CB 3.39Å; A511-T515 PolarHBondContact O-N 3.28Å; A511-T515 VanDerWaalsContact O-N 3.08Å; A511-T515 PolarHBondContact O-OG1 3.13Å; I512-T515 WeakPolarHBondContact O-CB 3.45Å; I512-T515 PolarHBondContact O-N 3.17Å; R513-T515 VanDerWaalsContact C-N 3.27Å; R513-T515 PolarHBondContact O-N 3.31Å; T515-Q556 HydrophobicContact CG2-CG 4.17Å; T515-Q556 PolarHBondContact O-NE2 3.09Å; T515-Q556 VanDerWaalsContact O-NE2 3.08Å; T515-M559 HydrophobicContact CG2-CB 4.47Å
516	V	89.9	Confident	86.6	Confident	8 Å²	8	50.7 Å²	50.7	5%	0.048	28%	0.284	C	S	.	.	H	α-helix	trans	-128.7	-17.1	-169.3	-61.4	0	0	0	0	116.6	L482 Q483 A486 I512 D518 Q556 V560	L482-V516 HydrophobicContact CD1-CG2 4.18Å; L482-V516 HydrophobicContact CD2-CB 4.14Å; L482-V516 HydrophobicContact CD2-CG1 4.27Å; L482-V516 HydrophobicContact CG-CB 4.39Å; L482-V516 HydrophobicContact CG-CG2 4.35Å; Q483-V516 PolarHBondContact NE2-O 3.11Å; Q483-V516 PolarHBondContact OE1-O 2.82Å; A486-V516 HydrophobicContact CB-CG2 3.87Å; I512-V516 WeakPolarHBondContact O-CG2 3.37Å; I512-V516 PolarHBondContact O-N 3.05Å; V516-D518 PolarHBondContact O-N 2.94Å; V516-D518 VanDerWaalsContact O-N 3.14Å; V516-Q556 HydrophobicContact CG1-CB 3.84Å; V516-Q556 HydrophobicContact CG1-CG 4.07Å; V516-V560 HydrophobicContact CB-CG2 4.3Å; V516-V560 HydrophobicContact CG1-CG2 3.4Å; V516-V560 HydrophobicContact CG2-CG2 3.9Å
517	C	91.5	Very high	86.5	Confident	21 Å²	21	53.9 Å²	53.9	14%	0.142	30%	0.301	C	S	.	.			trans	-68.5	115	-177.4	-70.3	0	0	0	0	111.5	Q487 R513 W519	Q487-C517 HydrophobicContact CG-CB 4.12Å; R513-C517 VanDerWaalsContact CA-SG 3.58Å; R513-C517 WeakPolarHBondContact O-CB 3.29Å; R513-C517 PolarHBondContact O-N 3.33Å; R513-C517 PolarHBondContact O-SG 2.88Å; R513-C517 VanDerWaalsContact O-SG 3.32Å; C517-W519 HydrophobicContact CB-CD2 4.39Å; C517-W519 HydrophobicContact CB-CZ2 3.81Å
518	D	91.9	Very high	86.4	Confident	51 Å²	51	51.6 Å²	51.6	27%	0.273	29%	0.285	S	S	.	.			trans	-99.2	96.2	167.8	-178.6	30.2	0	0	0	109.2	Y479 Q487 V516 P546 R548	Y479-D518 VanDerWaalsContact OH-CB 3.3Å; Y479-D518 WeakPolarHBondContact OH-CB 3.43Å; Y479-D518 PolarHBondContact OH-OD2 3.33Å; Q487-D518 PolarHBondContact NE2-O 3.39Å; V516-D518 PolarHBondContact O-N 2.94Å; V516-D518 VanDerWaalsContact O-N 3.14Å; D518-P546 WeakPolarHBondContact O-CG 3.4Å; D518-R548 IonicContact OD2-CZ 3.87Å; D518-R548 IonicContact OD2-NE 3.58Å; D518-R548 PolarHBondContact OD2-NE 3.4Å; D518-R548 IonicContact OD2-NH2 3.22Å; D518-R548 PolarHBondContact OD2-NH2 2.94Å
519	W	90.4	Very high	86.3	Confident	26 Å²	26	52 Å²	52	10%	0.098	29%	0.288	C	S	.	.			trans	-77.8	135.6	-178.2	-57.6	99.8	0	0	0	110.5	Q487 R513 C517 G521 G522 R523 E524 P525 I543	Q487-W519 HydrophobicContact CB-CH2 3.89Å; Q487-W519 HydrophobicContact CB-CZ3 3.73Å; Q487-W519 HydrophobicContact CG-CE3 4.06Å; Q487-W519 HydrophobicContact CG-CH2 3.81Å; Q487-W519 HydrophobicContact CG-CZ2 4.31Å; Q487-W519 HydrophobicContact CG-CZ3 3.68Å; R513-W519 VanDerWaalsContact NH2-CH2 3.26Å; C517-W519 HydrophobicContact CB-CD2 4.39Å; C517-W519 HydrophobicContact CB-CZ2 3.81Å; W519-G521 PolarHBondContact O-N 3.26Å; W519-G521 VanDerWaalsContact O-N 3.12Å; W519-G522 WeakPolarHBondContact O-CA 3.42Å; W519-G522 PolarHBondContact O-N 3.22Å; W519-R523 WeakPolarHBondContact CB-O 3.15Å; W519-E524 HydrophobicContact CH2-CG 4.44Å; W519-E524 HydrophobicContact CZ2-CB 4.21Å; W519-E524 HydrophobicContact CZ2-CG 3.75Å; W519-P525 VanDerWaalsContact CE3-CD 3.48Å; W519-P525 HydrophobicContact CE3-CG 4.04Å; W519-P525 HydrophobicContact CZ3-CG 4.1Å; W519-I543 HydrophobicContact CE3-CG2 4.42Å; W519-I543 HydrophobicContact CZ3-CD1 4.17Å; W519-I543 HydrophobicContact CZ3-CG2 3.99Å
520	E	86.2	Confident	86.1	Confident	120 Å²	120	52.2 Å²	52.2	56%	0.561	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-39.7	178	-174.7	72	-173	0	0	112.7	G522 P546	E520-G522 VanDerWaalsContact C-N 3.28Å; E520-G522 PolarHBondContact O-N 2.86Å; E520-P546 WeakPolarHBondContact OE2-CB 3.49Å
521	G	78.6	Confident	86	Confident	71 Å²	71	51.3 Å²	51.3	73%	0.732	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	8	177.3	0	0	0	0	0	115.2	W519 R523	W519-G521 PolarHBondContact O-N 3.26Å; W519-G521 VanDerWaalsContact O-N 3.12Å; G521-R523 PolarHBondContact O-N 3.13Å; G521-R523 VanDerWaalsContact O-N 3.12Å
522	G	82.6	Confident	85.8	Confident	61 Å²	61	58.2 Å²	58.2	63%	0.629	31%	0.311	S	S	*	.	S	Bend	trans	68.8	0.1	-176.6	0	0	0	0	0	115.5	W519 E520	W519-G522 WeakPolarHBondContact O-CA 3.42Å; W519-G522 PolarHBondContact O-N 3.22Å; E520-G522 VanDerWaalsContact C-N 3.28Å; E520-G522 PolarHBondContact O-N 2.86Å
523	R	84.6	Confident	85.4	Confident	214 Å²	214	58.8 Å²	58.8	81%	0.808	32%	0.317	S	S	*	.	S	Bend	trans	-143.5	149	179.6	-62.4	-175.8	-177.6	-177.6	1	110.8	W519 G521	W519-R523 WeakPolarHBondContact CB-O 3.15Å; G521-R523 PolarHBondContact O-N 3.13Å; G521-R523 VanDerWaalsContact O-N 3.12Å
524	E	85.4	Confident	85.3	Confident	63 Å²	63	63.7 Å²	63.7	29%	0.294	34%	0.34	S	S	.	.			trans	-62.2	133.7	176	-177.9	168.1	-130.9	0	0	111	R513 W519 P526 L531	R513-E524 IonicContact CZ-OE1 3.06Å; R513-E524 IonicContact NE-OE1 2.79Å; R513-E524 PolarHBondContact NE-OE1 3.18Å; R513-E524 IonicContact NH2-OE1 3.22Å; R513-E524 PolarHBondContact NH2-OE1 3.45Å; W519-E524 HydrophobicContact CH2-CG 4.44Å; W519-E524 HydrophobicContact CZ2-CB 4.21Å; W519-E524 HydrophobicContact CZ2-CG 3.75Å; E524-P526 WeakPolarHBondContact O-CD 3.5Å; E524-P526 VanDerWaalsContact O-N 3.1Å; E524-L531 HydrophobicContact CG-CD1 4.49Å
525	P	86.5	Confident	85.2	Confident	27 Å²	27	65 Å²	65	18%	0.175	35%	0.346	C	S	.	.			trans	-60.7	109.7	-179	-23.4	32.7	0	0	0	112	W519 N527 D528 F541	W519-P525 VanDerWaalsContact CE3-CD 3.48Å; W519-P525 HydrophobicContact CE3-CG 4.04Å; W519-P525 HydrophobicContact CZ3-CG 4.1Å; P525-N527 WeakPolarHBondContact CB-OD1 3.4Å; P525-N527 PolarHBondContact O-N 3.49Å; P525-D528 PolarHBondContact O-N 3.24Å; P525-F541 HydrophobicContact CB-CZ 4.47Å
526	P	78.4	Confident	85.2	Confident	117 Å²	117	67.5 Å²	67.5	76%	0.76	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-15.7	-175.8	30.4	-34.6	0	0	0	112.7	E524	E524-P526 WeakPolarHBondContact O-CD 3.5Å; E524-P526 VanDerWaalsContact O-N 3.1Å
527	N	83.6	Confident	85	Confident	94 Å²	94	70.8 Å²	70.8	50%	0.503	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-4.4	-179.7	58.5	-26.4	0	0	0	113.9	P525 P529 R532	P525-N527 WeakPolarHBondContact CB-OD1 3.4Å; P525-N527 PolarHBondContact O-N 3.49Å; N527-P529 WeakPolarHBondContact O-CD 3.28Å; N527-R532 PolarHBondContact O-NH2 2.88Å
528	D	84.2	Confident	84	Confident	1 Å²	1	80.8 Å²	80.8	1%	0.005	42%	0.422	C	S	.	.			trans	-58.6	118.1	-179.2	-175.7	0.5	0	0	0	111.3	R491 P525 C530 L531 F541	R491-D528 IonicContact CZ-OD1 2.78Å; R491-D528 IonicContact NE-OD1 3.59Å; R491-D528 IonicContact NE-OD2 2.71Å; R491-D528 PolarHBondContact NE-OD2 2.97Å; R491-D528 IonicContact NH2-OD1 3.95Å; R491-D528 PolarHBondContact NH2-OD1 3.15Å; P525-D528 PolarHBondContact O-N 3.24Å; D528-C530 PolarHBondContact O-N 3.04Å; D528-C530 VanDerWaalsContact OD1-CB 3.29Å; D528-C530 WeakPolarHBondContact OD1-CB 3.49Å; D528-C530 PolarHBondContact OD1-N 3.39Å; D528-L531 HydrophobicContact CB-CD1 4.15Å; D528-L531 HydrophobicContact CB-CG 4.16Å; D528-L531 PolarHBondContact O-N 3.47Å; D528-F541 HydrophobicContact CB-CE1 4.03Å; D528-F541 HydrophobicContact CB-CZ 4.18Å
529	P	84.4	Confident	82.8	Confident	10 Å²	10	82.3 Å²	82.3	7%	0.065	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-60.9	-26.3	177.5	24.8	-33.8	0	0	0	112.5	N527 L531 R532 G533 E534 D536 F541	N527-P529 WeakPolarHBondContact O-CD 3.28Å; P529-L531 VanDerWaalsContact C-N 3.3Å; P529-L531 PolarHBondContact O-N 3.23Å; P529-R532 PolarHBondContact O-N 3.3Å; P529-R532 VanDerWaalsContact O-N 3.08Å; P529-G533 PolarHBondContact O-N 3.46Å; P529-E534 CarbonylContact C-O 3.6Å; P529-E534 HydrophobicContact CB-CB 4.05Å; P529-E534 PolarHBondContact O-N 3.05Å; P529-D536 WeakPolarHBondContact CG-OD1 3.49Å; P529-F541 HydrophobicContact CG-CB 4.39Å; P529-F541 HydrophobicContact CG-CD2 4.44Å; P529-F541 HydrophobicContact CG-CG 4.42Å
530	C	83.1	Confident	82	Confident	3 Å²	3	83.1 Å²	83.1	2%	0.02	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-63.6	-33.7	178.4	-66.7	0	0	0	0	112.9	R491 R495 D528 R532 G533	R491-C530 HydrophobicContact CB-CB 4.35Å; R491-C530 PolarHBondContact NH2-SG 3.21Å; R495-C530 HydrophobicContact CB-CB 3.9Å; R495-C530 HydrophobicContact CG-CB 4.38Å; D528-C530 PolarHBondContact O-N 3.04Å; D528-C530 VanDerWaalsContact OD1-CB 3.29Å; D528-C530 WeakPolarHBondContact OD1-CB 3.49Å; D528-C530 PolarHBondContact OD1-N 3.39Å; C530-R532 PolarHBondContact O-N 3.25Å; C530-G533 PolarHBondContact O-N 3.28Å; C530-G533 VanDerWaalsContact O-N 3.08Å
531	L	83.9	Confident	81.9	Confident	47 Å²	47	79.4 Å²	79.4	25%	0.246	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-65.5	-23.7	176.2	-67.6	175.6	0	0	0	112.4	L494 E524 D528 P529	L494-L531 HydrophobicContact CD2-CD2 3.86Å; E524-L531 HydrophobicContact CG-CD1 4.49Å; D528-L531 HydrophobicContact CB-CD1 4.15Å; D528-L531 HydrophobicContact CB-CG 4.16Å; D528-L531 PolarHBondContact O-N 3.47Å; P529-L531 VanDerWaalsContact C-N 3.3Å; P529-L531 PolarHBondContact O-N 3.23Å
532	R	83.9	Confident	82	Confident	150 Å²	150	83.2 Å²	83.2	57%	0.566	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-95.6	-3.8	175.4	-68.7	178.7	-82.8	173	-4.2	113.4	N527 P529 C530 E534	N527-R532 PolarHBondContact O-NH2 2.88Å; P529-R532 PolarHBondContact O-N 3.3Å; P529-R532 VanDerWaalsContact O-N 3.08Å; C530-R532 PolarHBondContact O-N 3.25Å; R532-E534 VanDerWaalsContact C-N 3.33Å; R532-E534 HydrophobicContact CB-CG 4.37Å
533	G	81.8	Confident	82.2	Confident	11 Å²	11	81.3 Å²	81.3	11%	0.113	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	10.3	-176.8	0	0	0	0	0	114.6	P529 C530	P529-G533 PolarHBondContact O-N 3.46Å; C530-G533 PolarHBondContact O-N 3.28Å; C530-G533 VanDerWaalsContact O-N 3.08Å
534	E	86.9	Confident	82.3	Confident	107 Å²	107	78.7 Å²	78.7	50%	0.5	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-89.4	153.9	-179.7	-64.8	177.3	-178.3	0	0	111.2	R495 P529 R532	R495-E534 WeakPolarHBondContact CD-O 3.48Å; P529-E534 CarbonylContact C-O 3.6Å; P529-E534 HydrophobicContact CB-CB 4.05Å; P529-E534 PolarHBondContact O-N 3.05Å; R532-E534 VanDerWaalsContact C-N 3.33Å; R532-E534 HydrophobicContact CB-CG 4.37Å
535	K	84.9	Confident	82.6	Confident	155 Å²	155	76.8 Å²	76.8	67%	0.674	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-74.1	155.6	173.5	-79.2	-174	174.2	-171.5	0	110.5
536	D	87.1	Confident	82.8	Confident	61 Å²	61	75.8 Å²	75.8	33%	0.326	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-58.3	147.4	170.3	-70.4	-7.5	0	0	0	111.3	R491 P529 F541	R491-D536 IonicContact CZ-OD1 2.66Å; R491-D536 IonicContact CZ-OD2 2.67Å; R491-D536 IonicContact NH1-OD1 3.24Å; R491-D536 IonicContact NH1-OD2 2.72Å; R491-D536 PolarHBondContact NH1-OD2 3.15Å; R491-D536 IonicContact NH2-OD1 3.43Å; R491-D536 PolarHBondContact NH2-OD1 2.87Å; R491-D536 IonicContact NH2-OD2 2.72Å; P529-D536 WeakPolarHBondContact CG-OD1 3.49Å; D536-F541 HydrophobicContact CB-CB 4.37Å
537	P	84.1	Confident	83.3	Confident	77 Å²	77	74.5 Å²	74.5	50%	0.5	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-63.5	165.7	177.1	27.8	-34	0	0	0	111	G539 G540	P537-G539 PolarHBondContact O-N 3.26Å; P537-G540 WeakPolarHBondContact CG-O 3.33Å; P537-G540 PolarHBondContact O-N 3.38Å
538	K	70.8	Confident	83.6	Confident	231 Å²	231	75.9 Å²	75.9	100%	1.004	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-19.3	-176.7	-72.5	-174	178.5	-178.8	0	114.6
539	G	66.4	Low	83.7	Confident	82 Å²	82	77.7 Å²	77.7	85%	0.845	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	6.2	174.5	0	0	0	0	0	115.6	P537	P537-G539 PolarHBondContact O-N 3.26Å
540	G	74.9	Confident	83.9	Confident	43 Å²	43	80.9 Å²	80.9	44%	0.443	42%	0.419	S	S	.	.			trans	79.8	161.9	-174.6	0	0	0	0	0	113.8	P537	P537-G540 WeakPolarHBondContact CG-O 3.33Å; P537-G540 PolarHBondContact O-N 3.38Å
541	F	82.9	Confident	84.1	Confident	43 Å²	43	81.6 Å²	81.6	19%	0.189	43%	0.427	C	S	.	.			trans	-115.3	110.5	167.5	-174.6	-90.2	0	0	0	107.7	R491 P525 D528 P529 D536 I543	R491-F541 PolarHBondContact NH1-O 2.95Å; P525-F541 HydrophobicContact CB-CZ 4.47Å; D528-F541 HydrophobicContact CB-CE1 4.03Å; D528-F541 HydrophobicContact CB-CZ 4.18Å; P529-F541 HydrophobicContact CG-CB 4.39Å; P529-F541 HydrophobicContact CG-CD2 4.44Å; P529-F541 HydrophobicContact CG-CG 4.42Å; D536-F541 HydrophobicContact CB-CB 4.37Å; F541-I543 HydrophobicContact CD1-CD1 4.43Å; F541-I543 HydrophobicContact CD1-CG1 4Å; F541-I543 HydrophobicContact CE1-CD1 4.14Å; F541-I543 HydrophobicContact CE1-CG1 3.81Å
542	D	81.8	Confident	84.4	Confident	151 Å²	151	80.1 Å²	80.1	81%	0.807	42%	0.42	S	S	*	.			trans	-94.3	135.4	-174	-170.6	25.1	0	0	0	111.5
543	I	86.4	Confident	84.6	Confident	21 Å²	21	74.9 Å²	74.9	11%	0.108	41%	0.407	C	S	.	.			trans	-121.6	113.9	175.5	-59.2	-173.5	0	0	0	107	W519 F541 V545	W519-I543 HydrophobicContact CE3-CG2 4.42Å; W519-I543 HydrophobicContact CZ3-CD1 4.17Å; W519-I543 HydrophobicContact CZ3-CG2 3.99Å; F541-I543 HydrophobicContact CD1-CD1 4.43Å; F541-I543 HydrophobicContact CD1-CG1 4Å; F541-I543 HydrophobicContact CE1-CD1 4.14Å; F541-I543 HydrophobicContact CE1-CG1 3.81Å; I543-V545 HydrophobicContact CG2-CG2 4.5Å; I543-V545 PolarHBondContact O-N 2.89Å
544	K	87	Confident	84.8	Confident	159 Å²	159	75.6 Å²	75.6	69%	0.691	41%	0.41	S	S	*	.			trans	-75.6	109.7	172.1	-170.4	-179.4	179.4	-170.4	0	109.4
545	V	91.2	Very high	84.7	Confident	22 Å²	22	70.5 Å²	70.5	13%	0.133	39%	0.386	C	S	.	.			trans	-85.7	131.5	177.9	-173.9	0	0	0	0	109.6	Q483 D484 Q487 V488 I543	Q483-V545 HydrophobicContact CB-CG1 3.36Å; Q483-V545 HydrophobicContact CG-CG1 4.39Å; D484-V545 WeakPolarHBondContact OD1-CG1 3.19Å; Q487-V545 HydrophobicContact CB-CG2 4.33Å; V488-V545 HydrophobicContact CG2-CG2 3.73Å; I543-V545 HydrophobicContact CG2-CG2 4.5Å; I543-V545 PolarHBondContact O-N 2.89Å
546	P	91.3	Very high	84.8	Confident	7 Å²	7	65.4 Å²	65.4	5%	0.045	37%	0.365	C	S	.	.			trans	-63.9	159.9	174.8	20.3	-28.8	0	0	0	112.3	Y479 D518 E520	Y479-P546 HydrophobicContact CE1-CB 4.4Å; Y479-P546 HydrophobicContact CE1-CG 4.34Å; Y479-P546 WeakPolarHBondContact CE1-O 3.29Å; D518-P546 WeakPolarHBondContact O-CG 3.4Å; E520-P546 WeakPolarHBondContact OE2-CB 3.49Å
547	R	89.8	Confident	85	Confident	90 Å²	90	62.7 Å²	62.7	34%	0.34	35%	0.35	S	S	.	.			trans	-119.4	123.7	166.3	-63.7	-61.4	-178.2	-126.5	12.2	109.2	D382 D484	D382-R547 IonicContact OD1-NE 3.75Å; D382-R547 PolarHBondContact OD1-NE 3.34Å; D382-R547 IonicContact OD2-CZ 2.76Å; D382-R547 VanDerWaalsContact OD2-CZ 3.25Å; D382-R547 IonicContact OD2-NE 3.76Å; D382-R547 PolarHBondContact OD2-NE 3.46Å; D382-R547 IonicContact OD2-NH2 3.61Å; D382-R547 PolarHBondContact OD2-NH2 2.66Å; D484-R547 IonicContact OD1-CZ 2.83Å; D484-R547 IonicContact OD1-NH1 3.7Å; D484-R547 PolarHBondContact OD1-NH1 3.33Å; D484-R547 IonicContact OD1-NH2 3.53Å; D484-R547 PolarHBondContact OD1-NH2 3.13Å; D484-R547 IonicContact OD2-CZ 3.71Å; D484-R547 IonicContact OD2-NH1 2.79Å; D484-R547 IonicContact OD2-NH2 3.5Å; D484-R547 PolarHBondContact OD2-NH2 3.47Å
548	R	89	Confident	85.1	Confident	123 Å²	123	60.1 Å²	60.1	46%	0.464	33%	0.331	S	S	.	.			trans	-134.6	145.3	179.2	-62.9	-172	-177.1	-83.8	1.9	110.1	N476 Y479 D518 V550	N476-R548 VanDerWaalsContact OD1-C 3.29Å; N476-R548 PolarHBondContact OD1-O 3.29Å; Y479-R548 VanDerWaalsContact CB-O 3.32Å; Y479-R548 WeakPolarHBondContact CB-O 3.43Å; Y479-R548 HydrophobicContact CD1-CB 3.95Å; Y479-R548 HydrophobicContact CD2-CB 4.15Å; Y479-R548 HydrophobicContact CE1-CB 3.77Å; Y479-R548 HydrophobicContact CE1-CG 3.86Å; Y479-R548 HydrophobicContact CE2-CB 3.99Å; Y479-R548 HydrophobicContact CE2-CG 4.26Å; Y479-R548 HydrophobicContact CG-CB 4.12Å; Y479-R548 WeakPolarHBondContact OH-CD 3.49Å; D518-R548 IonicContact OD2-CZ 3.87Å; D518-R548 IonicContact OD2-NE 3.58Å; D518-R548 PolarHBondContact OD2-NE 3.4Å; D518-R548 IonicContact OD2-NH2 3.22Å; D518-R548 PolarHBondContact OD2-NH2 2.94Å; R548-V550 HydrophobicContact CB-CG1 4.01Å; R548-V550 PolarHBondContact O-N 3.28Å; R548-V550 VanDerWaalsContact O-N 3.08Å
549	A	86.7	Confident	85.9	Confident	39 Å²	39	49.4 Å²	49.4	32%	0.322	28%	0.284	S	S	.	.	S	Bend	trans	-85.4	49.4	176.5	0	0	0	0	0	112.4	N476	N476-A549 WeakPolarHBondContact ND2-CB 3.34Å; N476-A549 WeakPolarHBondContact OD1-CA 3.41Å; N476-A549 PolarHBondContact OD1-N 3.32Å
550	V	88.2	Confident	87	Confident	77 Å²	77	45.5 Å²	45.5	47%	0.467	24%	0.244	S	C	.	.			trans	-142.1	131.3	-179.6	67.9	0	0	0	0	111.6	Y479 R548	Y479-V550 WeakPolarHBondContact CB-O 3.36Å; Y479-V550 HydrophobicContact CD2-CG1 4.23Å; Y479-V550 VanDerWaalsContact CD2-O 3.28Å; Y479-V550 WeakPolarHBondContact CD2-O 3.48Å; Y479-V550 HydrophobicContact CE2-CG1 4.44Å; R548-V550 HydrophobicContact CB-CG1 4.01Å; R548-V550 PolarHBondContact O-N 3.28Å; R548-V550 VanDerWaalsContact O-N 3.08Å
551	G	88.1	Confident	87.7	Confident	18 Å²	18	45.1 Å²	45.1	19%	0.186	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-75	164.8	174.5	0	0	0	0	0	112.8
552	P	90.3	Very high	88	Confident	16 Å²	16	43.2 Å²	43.2	10%	0.104	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-64.9	154.2	166.3	30.7	-36	0	0	0	111	I478 L482 Q556 L557	I478-P552 HydrophobicContact CG2-CG 4.24Å; L482-P552 HydrophobicContact CD2-CB 3.71Å; L482-P552 HydrophobicContact CD2-CG 3.92Å; P552-Q556 HydrophobicContact CB-CB 3.99Å; P552-L557 HydrophobicContact CB-CB 4.45Å; P552-L557 HydrophobicContact CG-CB 4.08Å; P552-L557 HydrophobicContact CG-CD1 4.35Å
553	S	87.5	Confident	88.3	Confident	40 Å²	40	36 Å²	36	28%	0.28	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-63	158.9	165.9	54.2	0	0	0	0	111.7	T555 Q556 L557	S553-T555 VanDerWaalsContact C-N 3.26Å; S553-T555 PolarHBondContact O-N 3.5Å; S553-T555 PolarHBondContact OG-OG1 3.46Å; S553-Q556 PolarHBondContact O-N 3.45Å; S553-Q556 WeakPolarHBondContact OG-CB 3.3Å; S553-Q556 VanDerWaalsContact OG-CD 3.24Å; S553-Q556 WeakPolarHBondContact OG-CG 2.99Å; S553-Q556 PolarHBondContact OG-N 2.89Å; S553-Q556 PolarHBondContact OG-OE1 3.29Å; S553-L557 PolarHBondContact O-N 2.91Å
554	S	85.3	Confident	88.5	Confident	25 Å²	25	35 Å²	35	18%	0.175	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-34.9	179.7	63.3	0	0	0	0	112.2	D43 Y558	D43-S554 WeakPolarHBondContact OD1-CB 3.48Å; D43-S554 PolarHBondContact OD1-OG 3.3Å; S554-Y558 VanDerWaalsContact O-CB 3.25Å; S554-Y558 WeakPolarHBondContact O-CB 3.19Å; S554-Y558 PolarHBondContact O-N 3.49Å
555	T	85.1	Confident	88.6	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.006	15%	0.148	C	C	.	.	H	α-helix	trans	-61	-52	169.8	46.1	0	0	0	0	113.1	F46 D48 F52 S553 L557 Y558 M559	F46-T555 VanDerWaalsContact CA-CG2 3.45Å; F46-T555 HydrophobicContact CB-CG2 3.93Å; F46-T555 HydrophobicContact CD1-CG2 3.88Å; F46-T555 HydrophobicContact CG-CG2 4.42Å; D48-T555 VanDerWaalsContact CG-CG2 3.46Å; D48-T555 WeakPolarHBondContact OD1-CG2 3.42Å; D48-T555 PolarHBondContact OD2-OG1 3.3Å; F52-T555 HydrophobicContact CE2-CG2 4.5Å; F52-T555 WeakPolarHBondContact CE2-OG1 3.49Å; S553-T555 VanDerWaalsContact C-N 3.26Å; S553-T555 PolarHBondContact O-N 3.5Å; S553-T555 PolarHBondContact OG-OG1 3.46Å; T555-L557 VanDerWaalsContact C-N 3.33Å; T555-L557 PolarHBondContact O-N 3.46Å; T555-Y558 PolarHBondContact O-N 3.19Å; T555-M559 VanDerWaalsContact O-CB 3.28Å; T555-M559 WeakPolarHBondContact O-CB 3.4Å; T555-M559 WeakPolarHBondContact O-CG 3.4Å; T555-M559 PolarHBondContact O-N 3.28Å
556	Q	87.9	Confident	88.4	Confident	47 Å²	47	27.4 Å²	27.4	22%	0.22	14%	0.144	C	C	.	.	H	α-helix	trans	-57.4	-48.8	-179.7	-79.8	172.6	-43.7	0	0	110.8	F52 T515 V516 P552 S553 M559 V560	F52-Q556 HydrophobicContact CE1-CG 3.79Å; F52-Q556 HydrophobicContact CZ-CG 3.65Å; T515-Q556 HydrophobicContact CG2-CG 4.17Å; T515-Q556 PolarHBondContact O-NE2 3.09Å; T515-Q556 VanDerWaalsContact O-NE2 3.08Å; V516-Q556 HydrophobicContact CG1-CB 3.84Å; V516-Q556 HydrophobicContact CG1-CG 4.07Å; P552-Q556 HydrophobicContact CB-CB 3.99Å; S553-Q556 PolarHBondContact O-N 3.45Å; S553-Q556 WeakPolarHBondContact OG-CB 3.3Å; S553-Q556 VanDerWaalsContact OG-CD 3.24Å; S553-Q556 WeakPolarHBondContact OG-CG 2.99Å; S553-Q556 PolarHBondContact OG-N 2.89Å; S553-Q556 PolarHBondContact OG-OE1 3.29Å; Q556-M559 PolarHBondContact O-N 3.08Å; Q556-V560 WeakPolarHBondContact O-CB 3.25Å; Q556-V560 VanDerWaalsContact O-CG2 3.27Å; Q556-V560 WeakPolarHBondContact O-CG2 3.44Å; Q556-V560 PolarHBondContact O-N 3.4Å
557	L	90.1	Very high	88.2	Confident	5 Å²	5	27.1 Å²	27.1	3%	0.026	14%	0.142	C	C	.	.	H	α-helix	trans	-64.5	-44.6	-179.4	-173.6	59.9	0	0	0	111.6	P552 S553 T555 R561 F600	P552-L557 HydrophobicContact CB-CB 4.45Å; P552-L557 HydrophobicContact CG-CB 4.08Å; P552-L557 HydrophobicContact CG-CD1 4.35Å; S553-L557 PolarHBondContact O-N 2.91Å; T555-L557 VanDerWaalsContact C-N 3.33Å; T555-L557 PolarHBondContact O-N 3.46Å; L557-R561 HydrophobicContact CD1-CG 4.17Å; L557-R561 HydrophobicContact CG-CG 4.49Å; L557-R561 WeakPolarHBondContact O-CB 3.46Å; L557-R561 WeakPolarHBondContact O-CG 3.35Å; L557-R561 PolarHBondContact O-N 3.3Å; L557-F600 HydrophobicContact CD1-CD2 4.14Å; L557-F600 HydrophobicContact CD2-CB 3.83Å
558	Y	87.4	Confident	88	Confident	22 Å²	22	23.8 Å²	23.8	9%	0.086	13%	0.13	C	C	.	.	H	α-helix	trans	-61.4	-45.9	176.7	177	-97.6	0	0	0	112.4	F46 A63 H66 A156 S554 T555 R561 T562	F46-Y558 HydrophobicContact CD1-CD1 4.32Å; F46-Y558 HydrophobicContact CD1-CG 4.32Å; F46-Y558 AromaticContact CE1-CD1 3.86Å; F46-Y558 HydrophobicContact CE1-CD1 3.86Å; F46-Y558 HydrophobicContact CE1-CD2 4.01Å; F46-Y558 AromaticContact CE1-CG 3.46Å; F46-Y558 HydrophobicContact CE1-CG 3.46Å; F46-Y558 VanDerWaalsContact CE1-CG 3.46Å; F46-Y558 HydrophobicContact CZ-CD1 4.08Å; F46-Y558 AromaticContact CZ-CD2 3.7Å; F46-Y558 HydrophobicContact CZ-CD2 3.7Å; F46-Y558 HydrophobicContact CZ-CE2 4.22Å; F46-Y558 AromaticContact CZ-CG 3.63Å; F46-Y558 HydrophobicContact CZ-CG 3.63Å; A63-Y558 HydrophobicContact CB-CD1 4.36Å; A63-Y558 HydrophobicContact CB-CE1 3.81Å; H66-Y558 AromaticContact CE1-CE2 3.95Å; H66-Y558 AromaticContact ND1-CE2 3.58Å; H66-Y558 AromaticContact ND1-CZ 3.64Å; H66-Y558 PolarHBondContact ND1-OH 3.21Å; A156-Y558 HydrophobicContact CB-CE2 4.16Å; S554-Y558 VanDerWaalsContact O-CB 3.25Å; S554-Y558 WeakPolarHBondContact O-CB 3.19Å; S554-Y558 PolarHBondContact O-N 3.49Å; T555-Y558 PolarHBondContact O-N 3.19Å; Y558-R561 PolarHBondContact O-N 2.81Å; Y558-T562 VanDerWaalsContact O-CB 3.23Å; Y558-T562 WeakPolarHBondContact O-CB 3.38Å; Y558-T562 PolarHBondContact O-N 3.09Å; Y558-T562 PolarHBondContact O-OG1 2.84Å
559	M	86.1	Confident	87.7	Confident	7 Å²	7	18.9 Å²	18.9	3%	0.034	12%	0.116	C	C	.	.	H	α-helix	trans	-65.6	-44.6	-179	-71	-66.2	-73	0	0	111.3	I60 T515 T555 Q556 M563	I60-M559 HydrophobicContact CG1-CE 4.06Å; T515-M559 HydrophobicContact CG2-CB 4.47Å; T555-M559 VanDerWaalsContact O-CB 3.28Å; T555-M559 WeakPolarHBondContact O-CB 3.4Å; T555-M559 WeakPolarHBondContact O-CG 3.4Å; T555-M559 PolarHBondContact O-N 3.28Å; Q556-M559 PolarHBondContact O-N 3.08Å; M559-M563 HydrophobicContact CB-CE 4.13Å; M559-M563 VanDerWaalsContact O-CB 3.31Å; M559-M563 WeakPolarHBondContact O-CB 3.34Å; M559-M563 VanDerWaalsContact O-CE 3.28Å; M559-M563 WeakPolarHBondContact O-CE 3.08Å; M559-M563 VanDerWaalsContact O-CG 3.26Å; M559-M563 WeakPolarHBondContact O-CG 3.24Å; M559-M563 PolarHBondContact O-N 3.25Å
560	V	90	Very high	86.7	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.7	-50.9	176.2	170.1	0	0	0	0	110.8	L482 I512 V516 Q556 T562 M563 L564 F593	L482-V560 HydrophobicContact CD1-CG1 4.31Å; I512-V560 HydrophobicContact CG2-CG1 4.22Å; I512-V560 HydrophobicContact CG2-CG2 4.18Å; V516-V560 HydrophobicContact CB-CG2 4.3Å; V516-V560 HydrophobicContact CG1-CG2 3.4Å; V516-V560 HydrophobicContact CG2-CG2 3.9Å; Q556-V560 WeakPolarHBondContact O-CB 3.25Å; Q556-V560 VanDerWaalsContact O-CG2 3.27Å; Q556-V560 WeakPolarHBondContact O-CG2 3.44Å; Q556-V560 PolarHBondContact O-N 3.4Å; V560-T562 PolarHBondContact O-N 2.84Å; V560-M563 PolarHBondContact O-N 3.48Å; V560-L564 HydrophobicContact CG1-CD1 3.71Å; V560-L564 HydrophobicContact CG1-CG 4.27Å; V560-L564 WeakPolarHBondContact O-CB 3.25Å; V560-L564 VanDerWaalsContact O-CG 3.25Å; V560-L564 WeakPolarHBondContact O-CG 3.38Å; V560-L564 PolarHBondContact O-N 3.11Å; V560-F593 HydrophobicContact CG1-CE1 4.28Å
561	R	90.7	Very high	85.2	Confident	35 Å²	35	23.9 Å²	23.9	13%	0.132	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-48.7	180	-71.9	175.6	57.1	68.1	7.3	111.5	L557 Y558 M563 L564 E565 H594 S597 F598	L557-R561 HydrophobicContact CD1-CG 4.17Å; L557-R561 HydrophobicContact CG-CG 4.49Å; L557-R561 WeakPolarHBondContact O-CB 3.46Å; L557-R561 WeakPolarHBondContact O-CG 3.35Å; L557-R561 PolarHBondContact O-N 3.3Å; Y558-R561 PolarHBondContact O-N 2.81Å; R561-M563 PolarHBondContact O-N 2.98Å; R561-L564 PolarHBondContact O-N 3.38Å; R561-E565 VanDerWaalsContact O-CB 3.29Å; R561-E565 WeakPolarHBondContact O-CB 3.38Å; R561-E565 PolarHBondContact O-N 3.39Å; R561-H594 PolarHBondContact NH1-O 3.34Å; R561-S597 PolarHBondContact NH1-O 3.04Å; R561-S597 PolarHBondContact NH1-OG 3.3Å; R561-F598 VanDerWaalsContact NH1-N 3.14Å
562	T	88.6	Confident	83.2	Confident	3 Å²	3	24.7 Å²	24.7	2%	0.018	13%	0.133	C	C	.	.	H	α-helix	trans	-62.3	-40.2	-179.8	-56.1	0	0	0	0	112.4	Y59 F152 Y558 V560 S566	Y59-T562 HydrophobicContact CD1-CG2 3.77Å; Y59-T562 HydrophobicContact CE1-CG2 4.12Å; F152-T562 HydrophobicContact CE1-CG2 4.21Å; Y558-T562 VanDerWaalsContact O-CB 3.23Å; Y558-T562 WeakPolarHBondContact O-CB 3.38Å; Y558-T562 PolarHBondContact O-N 3.09Å; Y558-T562 PolarHBondContact O-OG1 2.84Å; V560-T562 PolarHBondContact O-N 2.84Å; T562-S566 PolarHBondContact O-N 2.97Å; T562-S566 VanDerWaalsContact O-N 3.16Å
563	M	88	Confident	81.1	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-68	-43.1	176.3	-76.1	-171.7	-76.3	0	0	111.7	Y59 V508 A511 I512 M559 V560 R561 S566 L567	Y59-M563 HydrophobicContact CD2-CG 4.01Å; Y59-M563 HydrophobicContact CE2-CG 3.89Å; Y59-M563 HydrophobicContact CG-CG 4.43Å; V508-M563 HydrophobicContact CG1-CB 3.94Å; V508-M563 HydrophobicContact CG1-CG 4.38Å; A511-M563 HydrophobicContact CB-SD 3.73Å; I512-M563 HydrophobicContact CB-CE 4.46Å; I512-M563 HydrophobicContact CD1-CB 3.86Å; I512-M563 HydrophobicContact CG1-CB 3.73Å; I512-M563 HydrophobicContact CG1-CE 3.71Å; I512-M563 HydrophobicContact CG1-CG 4.46Å; I512-M563 HydrophobicContact CG1-SD 3.95Å; M559-M563 HydrophobicContact CB-CE 4.13Å; M559-M563 VanDerWaalsContact O-CB 3.31Å; M559-M563 WeakPolarHBondContact O-CB 3.34Å; M559-M563 VanDerWaalsContact O-CE 3.28Å; M559-M563 WeakPolarHBondContact O-CE 3.08Å; M559-M563 VanDerWaalsContact O-CG 3.26Å; M559-M563 WeakPolarHBondContact O-CG 3.24Å; M559-M563 PolarHBondContact O-N 3.25Å; V560-M563 PolarHBondContact O-N 3.48Å; R561-M563 PolarHBondContact O-N 2.98Å; M563-S566 PolarHBondContact O-N 3.45Å; M563-S566 PolarHBondContact O-OG 3.34Å; M563-L567 PolarHBondContact O-N 3.4Å
564	L	89.9	Confident	79.3	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.5	-43.3	176.2	-71.5	174.8	0	0	0	112	F485 I512 V560 R561 S566 L567 I568 I590 F593	F485-L564 HydrophobicContact CD1-CD1 4.5Å; F485-L564 HydrophobicContact CE1-CD1 3.59Å; F485-L564 HydrophobicContact CE1-CD2 3.77Å; F485-L564 HydrophobicContact CE1-CG 4.33Å; F485-L564 HydrophobicContact CZ-CD1 4.04Å; F485-L564 HydrophobicContact CZ-CD2 3.96Å; I512-L564 HydrophobicContact CD1-CD2 3.57Å; I512-L564 HydrophobicContact CD1-CG 3.9Å; V560-L564 HydrophobicContact CG1-CD1 3.71Å; V560-L564 HydrophobicContact CG1-CG 4.27Å; V560-L564 WeakPolarHBondContact O-CB 3.25Å; V560-L564 VanDerWaalsContact O-CG 3.25Å; V560-L564 WeakPolarHBondContact O-CG 3.38Å; V560-L564 PolarHBondContact O-N 3.11Å; R561-L564 PolarHBondContact O-N 3.38Å; L564-S566 VanDerWaalsContact C-N 3.26Å; L564-S566 PolarHBondContact O-N 2.65Å; L564-L567 HydrophobicContact CD2-CD1 4.26Å; L564-L567 WeakPolarHBondContact O-CB 3.42Å; L564-L567 PolarHBondContact O-N 2.73Å; L564-I568 PolarHBondContact O-N 3.49Å; L564-I590 HydrophobicContact CB-CG2 3.97Å; L564-I590 HydrophobicContact CD2-CG1 4.46Å; L564-I590 HydrophobicContact CD2-CG2 3.93Å; L564-I590 HydrophobicContact CG-CG2 4.43Å; L564-F593 HydrophobicContact CD1-CD1 3.61Å; L564-F593 HydrophobicContact CD1-CE1 3.89Å
565	E	89.8	Confident	77.6	Confident	13 Å²	13	37.6 Å²	37.6	6%	0.061	20%	0.202	C	C	.	.	H	α-helix	trans	-56	-42.7	175.7	-164.6	-164.3	140.6	0	0	110.8	F152 S154 E155 R561 L567 I568 A569	F152-E565 HydrophobicContact CE2-CB 4.25Å; F152-E565 HydrophobicContact CE2-CG 3.82Å; F152-E565 VanDerWaalsContact CE2-OE1 3.31Å; F152-E565 WeakPolarHBondContact CE2-OE1 3.41Å; F152-E565 HydrophobicContact CZ-CB 3.83Å; F152-E565 VanDerWaalsContact CZ-CD 3.48Å; F152-E565 HydrophobicContact CZ-CG 3.77Å; F152-E565 WeakPolarHBondContact CZ-OE1 3.41Å; S154-E565 WeakPolarHBondContact CA-OE1 3.18Å; E155-E565 VanDerWaalsContact CG-OE1 3.31Å; E155-E565 WeakPolarHBondContact CG-OE1 3.27Å; E155-E565 PolarHBondContact N-OE1 3.19Å; E155-E565 PolarHBondContact N-OE2 3.1Å; R561-E565 VanDerWaalsContact O-CB 3.29Å; R561-E565 WeakPolarHBondContact O-CB 3.38Å; R561-E565 PolarHBondContact O-N 3.39Å; E565-L567 PolarHBondContact O-N 2.68Å; E565-I568 VanDerWaalsContact O-CG1 3.31Å; E565-I568 WeakPolarHBondContact O-CG1 3.27Å; E565-I568 PolarHBondContact O-N 3.48Å; E565-I568 VanDerWaalsContact O-N 3.16Å; E565-A569 WeakPolarHBondContact O-CB 3.43Å; E565-A569 PolarHBondContact O-N 2.9Å
566	S	86.8	Confident	76.6	Confident	8 Å²	8	44.6 Å²	44.6	6%	0.056	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-23.4	177.3	79.3	0	0	0	0	114.3	Y59 T562 M563 L564	Y59-S566 WeakPolarHBondContact OH-CB 3.45Å; Y59-S566 PolarHBondContact OH-OG 3.36Å; T562-S566 PolarHBondContact O-N 2.97Å; T562-S566 VanDerWaalsContact O-N 3.16Å; M563-S566 PolarHBondContact O-N 3.45Å; M563-S566 PolarHBondContact O-OG 3.34Å; L564-S566 VanDerWaalsContact C-N 3.26Å; L564-S566 PolarHBondContact O-N 2.65Å
567	L	86	Confident	75.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-76.8	-32.7	175.6	-65.8	174.6	0	0	0	112.2	L505 V508 L509 I512 M563 L564 E565 L578 R579 L582 I590	L505-L567 HydrophobicContact CG-CD2 4.18Å; V508-L567 HydrophobicContact CB-CD2 4.17Å; V508-L567 HydrophobicContact CG1-CD1 4.18Å; V508-L567 HydrophobicContact CG1-CD2 3.95Å; V508-L567 HydrophobicContact CG1-CG 4.02Å; L509-L567 HydrophobicContact CD2-CD1 3.76Å; L509-L567 HydrophobicContact CG-CD1 4.44Å; I512-L567 HydrophobicContact CD1-CD1 4.44Å; M563-L567 PolarHBondContact O-N 3.4Å; L564-L567 HydrophobicContact CD2-CD1 4.26Å; L564-L567 WeakPolarHBondContact O-CB 3.42Å; L564-L567 PolarHBondContact O-N 2.73Å; E565-L567 PolarHBondContact O-N 2.68Å; L567-L578 HydrophobicContact CD2-CD1 4.39Å; L567-R579 VanDerWaalsContact O-CA 3.32Å; L567-R579 WeakPolarHBondContact O-CA 3.49Å; L567-R579 PolarHBondContact O-N 2.92Å; L567-R579 VanDerWaalsContact O-N 3.1Å; L567-L582 HydrophobicContact CB-CD1 4.19Å; L567-I590 HydrophobicContact CD1-CD1 4.39Å
568	I	87	Confident	75.2	Confident	20 Å²	20	45.7 Å²	45.7	10%	0.103	24%	0.241	C	C	.	.	H	α-helix	trans	-97.6	-7.2	-177.4	60.1	173.2	0	0	0	113.4	L564 E565 R579 V587 I590 E591 H594	L564-I568 PolarHBondContact O-N 3.49Å; E565-I568 VanDerWaalsContact O-CG1 3.31Å; E565-I568 WeakPolarHBondContact O-CG1 3.27Å; E565-I568 PolarHBondContact O-N 3.48Å; E565-I568 VanDerWaalsContact O-N 3.16Å; I568-R579 WeakPolarHBondContact O-CD 3.38Å; I568-R579 PolarHBondContact O-NH1 3.5Å; I568-V587 HydrophobicContact CG2-CG1 4.31Å; I568-I590 HydrophobicContact CD1-CG2 4.48Å; I568-I590 HydrophobicContact CG2-CB 3.9Å; I568-I590 HydrophobicContact CG2-CG2 3.52Å; I568-E591 HydrophobicContact CB-CG 4.47Å; I568-E591 HydrophobicContact CD1-CG 3.89Å; I568-E591 HydrophobicContact CG2-CG 4.28Å; I568-H594 HydrophobicContact CD1-CB 4.47Å
569	A	82.1	Confident	74.9	Confident	20 Å²	20	47.8 Å²	47.8	17%	0.165	25%	0.249	C	C	.	.			trans	-65.4	137.4	179.1	0	0	0	0	0	113.7	F152 E565	F152-A569 HydrophobicContact CD2-CB 3.56Å; F152-A569 HydrophobicContact CE2-CB 3.93Å; E565-A569 WeakPolarHBondContact O-CB 3.43Å; E565-A569 PolarHBondContact O-N 2.9Å
570	D	65.1	Low	74.6	Confident	121 Å²	121	51 Å²	51	65%	0.647	27%	0.272	S	S	*	.	S	Bend	trans	-83.4	-10	177.7	-74	-37.4	0	0	0	113.8	T577 R579	D570-T577 VanDerWaalsContact O-CG2 3.28Å; D570-T577 WeakPolarHBondContact O-CG2 3.49Å; D570-R579 WeakPolarHBondContact OD1-CD 3.28Å; D570-R579 IonicContact OD1-NE 3.7Å
571	K	57	Low	73.9	Confident	101 Å²	101	52.3 Å²	52.3	44%	0.439	28%	0.281	S	S	.	.			trans	-102.9	117.2	178.7	-70.8	-178.8	179.5	174.7	0	111	D240	D240-K571 IonicContact OD1-NZ 3.63Å; D240-K571 PolarHBondContact OD1-NZ 3.39Å; D240-K571 IonicContact OD2-NZ 3.14Å; D240-K571 PolarHBondContact OD2-NZ 3.49Å
572	S	47.5	Very low	73.4	Confident	35 Å²	35	51.6 Å²	51.6	25%	0.245	28%	0.28	C	S	.	.			trans	-144.6	147.3	167.1	79.4	0	0	0	0	110.4	K150 S574 K576 T577	K150-S572 CarbonylContact O-C 3.57Å; K150-S572 VanDerWaalsContact O-CA 3.26Å; K150-S572 WeakPolarHBondContact O-CA 3.09Å; S572-S574 PolarHBondContact O-N 3.46Å; S572-S574 PolarHBondContact OG-O 2.95Å; S572-S574 PolarHBondContact OG-OG 3.21Å; S572-K576 PolarHBondContact OG-O 3.42Å; S572-T577 WeakPolarHBondContact OG-CA 3.15Å
573	G	44.9	Very low	72.9	Confident	47 Å²	47	54.5 Å²	54.5	49%	0.485	30%	0.295	S	S	.	.	S	Bend	trans	-56.8	-9.5	178.7	0	0	0	0	0	116.5	K150	K150-G573 PolarHBondContact O-N 2.95Å
574	S	49.9	Very low	72.4	Confident	76 Å²	76	56.8 Å²	56.8	53%	0.531	32%	0.319	S	S	.	.	S	Bend	trans	-108.5	154.4	-176.7	45.4	0	0	0	0	113.8	S572 K576	S572-S574 PolarHBondContact O-N 3.46Å; S572-S574 PolarHBondContact OG-O 2.95Å; S572-S574 PolarHBondContact OG-OG 3.21Å; S574-K576 PolarHBondContact O-N 2.9Å; S574-K576 PolarHBondContact OG-O 3.32Å
575	K	48.8	Very low	72.2	Confident	228 Å²	228	61.9 Å²	61.9	99%	0.991	35%	0.352	S	S	*	.	S	Bend	trans	-57	-7.6	171.6	-81.7	-176.4	175.1	179.4	0	114.9
576	K	64.7	Low	71.9	Confident	148 Å²	148	62 Å²	62	64%	0.643	35%	0.353	S	S	*	.	S	Bend	trans	-131.8	124.8	174	-72.1	-173.3	176.9	-177.3	0	108.9	S572 S574	S572-K576 PolarHBondContact OG-O 3.42Å; S574-K576 PolarHBondContact O-N 2.9Å; S574-K576 PolarHBondContact OG-O 3.32Å
577	T	73.5	Confident	71.8	Confident	30 Å²	30	62.1 Å²	62.1	18%	0.184	35%	0.353	C	S	.	.			trans	-82	160.3	174.5	56	0	0	0	0	111.4	D570 S572 R579 S580	D570-T577 VanDerWaalsContact O-CG2 3.28Å; D570-T577 WeakPolarHBondContact O-CG2 3.49Å; S572-T577 WeakPolarHBondContact OG-CA 3.15Å; T577-R579 VanDerWaalsContact C-N 3.25Å; T577-R579 PolarHBondContact O-N 3.03Å; T577-S580 PolarHBondContact N-OG 2.97Å; T577-S580 PolarHBondContact O-N 3.33Å; T577-S580 PolarHBondContact O-OG 3.22Å; T577-S580 WeakPolarHBondContact OG1-CB 3.31Å; T577-S580 PolarHBondContact OG1-N 2.89Å
578	L	76.4	Confident	71.9	Confident	45 Å²	45	65.6 Å²	65.6	24%	0.236	37%	0.374	C	S	.	.	S	Bend	trans	-61.1	-38.6	172.5	-68	174.4	0	0	0	110.9	V504 L505 L567 S580 S581	V504-L578 HydrophobicContact CB-CD2 4.44Å; V504-L578 HydrophobicContact CG1-CD2 3.93Å; L505-L578 HydrophobicContact CD1-CD2 4.42Å; L567-L578 HydrophobicContact CD2-CD1 4.39Å; L578-S580 VanDerWaalsContact C-N 3.34Å; L578-S580 PolarHBondContact O-N 3.49Å; L578-S581 WeakPolarHBondContact O-CB 3.38Å; L578-S581 PolarHBondContact O-N 3.31Å
579	R	81	Confident	71.9	Confident	67 Å²	67	66.1 Å²	66.1	25%	0.253	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-53.1	-46.7	172.5	-169.8	-171.9	-177.2	78.6	3.4	112.8	L567 I568 D570 T577 S581 L582 V587 E591	L567-R579 VanDerWaalsContact O-CA 3.32Å; L567-R579 WeakPolarHBondContact O-CA 3.49Å; L567-R579 PolarHBondContact O-N 2.92Å; L567-R579 VanDerWaalsContact O-N 3.1Å; I568-R579 WeakPolarHBondContact O-CD 3.38Å; I568-R579 PolarHBondContact O-NH1 3.5Å; D570-R579 WeakPolarHBondContact OD1-CD 3.28Å; D570-R579 IonicContact OD1-NE 3.7Å; T577-R579 VanDerWaalsContact C-N 3.25Å; T577-R579 PolarHBondContact O-N 3.03Å; R579-S581 PolarHBondContact O-N 3.32Å; R579-L582 PolarHBondContact O-N 3.44Å; R579-V587 VanDerWaalsContact CZ-CG1 3.43Å; R579-V587 VanDerWaalsContact NH1-CG1 3.29Å; R579-E591 IonicContact CZ-OE1 3.38Å; R579-E591 IonicContact NH1-OE1 3.28Å; R579-E591 PolarHBondContact NH1-OE1 3.23Å; R579-E591 IonicContact NH2-OE1 3.37Å; R579-E591 PolarHBondContact NH2-OE1 2.71Å
580	S	78.4	Confident	72.3	Confident	74 Å²	74	65.3 Å²	65.3	52%	0.517	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-63.9	-12.6	179.4	72.2	0	0	0	0	114.6	T577 L578	T577-S580 PolarHBondContact N-OG 2.97Å; T577-S580 PolarHBondContact O-N 3.33Å; T577-S580 PolarHBondContact O-OG 3.22Å; T577-S580 WeakPolarHBondContact OG1-CB 3.31Å; T577-S580 PolarHBondContact OG1-N 2.89Å; L578-S580 VanDerWaalsContact C-N 3.34Å; L578-S580 PolarHBondContact O-N 3.49Å
581	S	74.9	Confident	73.4	Confident	28 Å²	28	61.7 Å²	61.7	20%	0.196	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-97.4	-3.8	177.8	-62.2	0	0	0	0	113.6	L578 R579	L578-S581 WeakPolarHBondContact O-CB 3.38Å; L578-S581 PolarHBondContact O-N 3.31Å; R579-S581 PolarHBondContact O-N 3.32Å
582	L	80.4	Confident	75	Confident	19 Å²	19	60.5 Å²	60.5	10%	0.099	35%	0.352	C	S	.	.	S	Bend	trans	-101	147.1	176.5	-69.3	172.7	0	0	0	110.7	L505 L567 R579 I586 V587 I590	L505-L582 HydrophobicContact CD1-CD2 4.13Å; L505-L582 HydrophobicContact CD1-CG 4.17Å; L505-L582 HydrophobicContact CD2-CD2 3.67Å; L505-L582 HydrophobicContact CG-CD2 4.47Å; L567-L582 HydrophobicContact CB-CD1 4.19Å; R579-L582 PolarHBondContact O-N 3.44Å; L582-I586 HydrophobicContact CD2-CG2 3.96Å; L582-V587 HydrophobicContact CB-CG2 3.6Å; L582-V587 HydrophobicContact CD1-CG2 4.31Å; L582-I590 HydrophobicContact CD1-CD1 4.05Å
583	D	78.2	Confident	77.1	Confident	64 Å²	64	59.8 Å²	59.8	34%	0.342	35%	0.345	S	S	.	.			trans	-80.6	150.7	175.4	-64.9	-3.4	0	0	0	110.1	Q496 K500 I586 V587	Q496-D583 VanDerWaalsContact CD-OD2 3.26Å; Q496-D583 PolarHBondContact NE2-OD2 3.37Å; Q496-D583 PolarHBondContact OE1-OD1 2.65Å; Q496-D583 PolarHBondContact OE1-OD2 3.12Å; K500-D583 IonicContact NZ-OD1 3.57Å; K500-D583 PolarHBondContact NZ-OD1 3.44Å; K500-D583 IonicContact NZ-OD2 3.12Å; D583-I586 HydrophobicContact CB-CD1 4.27Å; D583-I586 WeakPolarHBondContact O-CB 3.33Å; D583-I586 PolarHBondContact O-N 3.5Å; D583-I586 VanDerWaalsContact O-N 3.07Å; D583-V587 PolarHBondContact O-N 3.21Å
584	G	78.4	Confident	79.4	Confident	49 Å²	49	58.1 Å²	58.1	51%	0.505	32%	0.324	S	S	.	.	H	α-helix	trans	-50.2	-49.7	-172	0	0	0	0	0	116.2	I586 V587 V588	G584-I586 VanDerWaalsContact C-N 3.26Å; G584-I586 PolarHBondContact O-N 3.33Å; G584-V587 PolarHBondContact O-N 3.02Å; G584-V588 PolarHBondContact O-N 2.78Å; G584-V588 VanDerWaalsContact O-N 3.16Å
585	P	85.3	Confident	81.2	Confident	106 Å²	106	59.7 Å²	59.7	69%	0.688	32%	0.322	S	S	*	.	H	α-helix	trans	-62	-31	179.8	-25.2	35.1	0	0	0	114.1	A589	P585-A589 PolarHBondContact O-N 3.21Å; P585-A589 VanDerWaalsContact O-N 3.09Å
586	I	84.2	Confident	83.1	Confident	16 Å²	16	54 Å²	54	8%	0.082	30%	0.298	C	S	.	.	H	α-helix	trans	-70.2	-41.9	177.8	-67.8	167.1	0	0	0	110.3	E492 P493 L582 D583 G584 V588 A589 I590	E492-I586 HydrophobicContact CG-CD1 4.34Å; P493-I586 HydrophobicContact CB-CD1 4.29Å; P493-I586 HydrophobicContact CB-CG2 3.86Å; P493-I586 HydrophobicContact CG-CB 4.33Å; P493-I586 HydrophobicContact CG-CD1 4.08Å; P493-I586 HydrophobicContact CG-CG1 4.01Å; P493-I586 HydrophobicContact CG-CG2 3.47Å; P493-I586 VanDerWaalsContact CG-CG2 3.47Å; L582-I586 HydrophobicContact CD2-CG2 3.96Å; D583-I586 HydrophobicContact CB-CD1 4.27Å; D583-I586 WeakPolarHBondContact O-CB 3.33Å; D583-I586 PolarHBondContact O-N 3.5Å; D583-I586 VanDerWaalsContact O-N 3.07Å; G584-I586 VanDerWaalsContact C-N 3.26Å; G584-I586 PolarHBondContact O-N 3.33Å; I586-V588 VanDerWaalsContact C-N 3.33Å; I586-V588 PolarHBondContact O-N 3.3Å; I586-A589 PolarHBondContact O-N 3.12Å; I586-I590 HydrophobicContact CG2-CD1 3.85Å; I586-I590 HydrophobicContact CG2-CG1 4.49Å; I586-I590 WeakPolarHBondContact O-CG1 3.43Å; I586-I590 PolarHBondContact O-N 3.03Å
587	V	83.8	Confident	84.5	Confident	11 Å²	11	47 Å²	47	7%	0.067	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-45	178.3	175.6	0	0	0	0	110.3	I568 R579 L582 D583 G584 A589 I590 E591	I568-V587 HydrophobicContact CG2-CG1 4.31Å; R579-V587 VanDerWaalsContact CZ-CG1 3.43Å; R579-V587 VanDerWaalsContact NH1-CG1 3.29Å; L582-V587 HydrophobicContact CB-CG2 3.6Å; L582-V587 HydrophobicContact CD1-CG2 4.31Å; D583-V587 PolarHBondContact O-N 3.21Å; G584-V587 PolarHBondContact O-N 3.02Å; V587-A589 PolarHBondContact O-N 2.71Å; V587-I590 PolarHBondContact O-N 3.5Å; V587-E591 HydrophobicContact CG1-CG 4.43Å; V587-E591 WeakPolarHBondContact CG1-OE1 3.32Å; V587-E591 WeakPolarHBondContact O-CB 3.27Å; V587-E591 WeakPolarHBondContact O-CG 3.46Å; V587-E591 PolarHBondContact O-N 3.07Å
588	V	88.4	Confident	85.4	Confident	72 Å²	72	47 Å²	47	44%	0.436	27%	0.265	S	S	.	.	H	α-helix	trans	-60.8	-45.5	176.1	176.5	0	0	0	0	111.2	G584 I586 I590 E591 D592	G584-V588 PolarHBondContact O-N 2.78Å; G584-V588 VanDerWaalsContact O-N 3.16Å; I586-V588 VanDerWaalsContact C-N 3.33Å; I586-V588 PolarHBondContact O-N 3.3Å; V588-I590 VanDerWaalsContact C-N 3.31Å; V588-I590 PolarHBondContact O-N 2.86Å; V588-E591 PolarHBondContact O-N 3.21Å; V588-D592 WeakPolarHBondContact O-CB 3.27Å; V588-D592 VanDerWaalsContact O-CG 3.26Å; V588-D592 PolarHBondContact O-N 2.63Å
589	A	87.5	Confident	86.2	Confident	32 Å²	32	45.9 Å²	45.9	26%	0.264	26%	0.258	S	S	.	.	H	α-helix	trans	-61.2	-37.7	178	0	0	0	0	0	113.1	T489 P585 I586 V587 F593	T489-A589 HydrophobicContact CG2-CB 4.17Å; P585-A589 PolarHBondContact O-N 3.21Å; P585-A589 VanDerWaalsContact O-N 3.09Å; I586-A589 PolarHBondContact O-N 3.12Å; V587-A589 PolarHBondContact O-N 2.71Å; A589-F593 PolarHBondContact O-N 3.3Å; A589-F593 VanDerWaalsContact O-N 3.14Å
590	I	89.9	Confident	86.8	Confident	2 Å²	2	43 Å²	43	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-69.8	-44.1	175.4	-64.5	165.7	0	0	0	110.7	F485 L564 L567 I568 L582 I586 V587 V588 D592 F593 H594	F485-I590 HydrophobicContact CZ-CG1 4.11Å; L564-I590 HydrophobicContact CB-CG2 3.97Å; L564-I590 HydrophobicContact CD2-CG1 4.46Å; L564-I590 HydrophobicContact CD2-CG2 3.93Å; L564-I590 HydrophobicContact CG-CG2 4.43Å; L567-I590 HydrophobicContact CD1-CD1 4.39Å; I568-I590 HydrophobicContact CD1-CG2 4.48Å; I568-I590 HydrophobicContact CG2-CB 3.9Å; I568-I590 HydrophobicContact CG2-CG2 3.52Å; L582-I590 HydrophobicContact CD1-CD1 4.05Å; I586-I590 HydrophobicContact CG2-CD1 3.85Å; I586-I590 HydrophobicContact CG2-CG1 4.49Å; I586-I590 WeakPolarHBondContact O-CG1 3.43Å; I586-I590 PolarHBondContact O-N 3.03Å; V587-I590 PolarHBondContact O-N 3.5Å; V588-I590 VanDerWaalsContact C-N 3.31Å; V588-I590 PolarHBondContact O-N 2.86Å; I590-D592 VanDerWaalsContact C-N 3.35Å; I590-F593 PolarHBondContact O-N 3.45Å; I590-H594 WeakPolarHBondContact O-CB 3.42Å; I590-H594 PolarHBondContact O-N 3.18Å
591	E	88.8	Confident	87.4	Confident	46 Å²	46	42.5 Å²	42.5	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-43.3	176.9	-76.8	175.5	-176.9	0	0	111.8	I568 R579 V587 V588 H594 K595	I568-E591 HydrophobicContact CB-CG 4.47Å; I568-E591 HydrophobicContact CD1-CG 3.89Å; I568-E591 HydrophobicContact CG2-CG 4.28Å; R579-E591 IonicContact CZ-OE1 3.38Å; R579-E591 IonicContact NH1-OE1 3.28Å; R579-E591 PolarHBondContact NH1-OE1 3.23Å; R579-E591 IonicContact NH2-OE1 3.37Å; R579-E591 PolarHBondContact NH2-OE1 2.71Å; V587-E591 HydrophobicContact CG1-CG 4.43Å; V587-E591 WeakPolarHBondContact CG1-OE1 3.32Å; V587-E591 WeakPolarHBondContact O-CB 3.27Å; V587-E591 WeakPolarHBondContact O-CG 3.46Å; V587-E591 PolarHBondContact O-N 3.07Å; V588-E591 PolarHBondContact O-N 3.21Å; E591-H594 PolarHBondContact O-N 3.34Å; E591-K595 WeakPolarHBondContact O-CB 3.21Å; E591-K595 VanDerWaalsContact O-CG 3.31Å; E591-K595 WeakPolarHBondContact O-CG 2.97Å; E591-K595 PolarHBondContact O-N 2.81Å
592	D	89.6	Confident	88.1	Confident	76 Å²	76	42.7 Å²	42.7	41%	0.406	24%	0.239	S	C	.	.	H	α-helix	trans	-63.4	-49.5	178.5	-72.2	-19.2	0	0	0	110.6	V588 I590 H594 K595 H596	V588-D592 WeakPolarHBondContact O-CB 3.27Å; V588-D592 VanDerWaalsContact O-CG 3.26Å; V588-D592 PolarHBondContact O-N 2.63Å; I590-D592 VanDerWaalsContact C-N 3.35Å; D592-H594 VanDerWaalsContact C-N 3.33Å; D592-H594 PolarHBondContact O-N 3.33Å; D592-K595 PolarHBondContact O-N 2.88Å; D592-H596 PolarHBondContact O-N 3.13Å; D592-H596 PolarHBondContact O-ND1 3.17Å
593	F	92.9	Very high	88.7	Confident	19 Å²	19	41.8 Å²	41.8	8%	0.083	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-40.7	176.4	-178.1	-94.6	0	0	0	112	L482 F485 V560 L564 A589 I590 K595 H596 S597 F600	L482-F593 HydrophobicContact CD1-CE1 4.39Å; L482-F593 HydrophobicContact CD1-CZ 3.73Å; F485-F593 HydrophobicContact CB-CD2 3.75Å; F485-F593 HydrophobicContact CB-CE2 3.81Å; F485-F593 HydrophobicContact CB-CG 4.3Å; F485-F593 HydrophobicContact CB-CZ 4.4Å; F485-F593 AromaticContact CD1-CD1 3.82Å; F485-F593 HydrophobicContact CD1-CD1 3.82Å; F485-F593 HydrophobicContact CD1-CD2 4.19Å; F485-F593 AromaticContact CD1-CE1 3.99Å; F485-F593 HydrophobicContact CD1-CE1 3.99Å; F485-F593 HydrophobicContact CD1-CE2 4.35Å; F485-F593 AromaticContact CD1-CG 3.92Å; F485-F593 HydrophobicContact CD1-CG 3.92Å; F485-F593 HydrophobicContact CD1-CZ 4.26Å; F485-F593 HydrophobicContact CD2-CB 3.64Å; F485-F593 HydrophobicContact CD2-CD1 4.35Å; F485-F593 AromaticContact CD2-CD2 3.87Å; F485-F593 HydrophobicContact CD2-CD2 3.87Å; F485-F593 AromaticContact CD2-CG 3.68Å; F485-F593 HydrophobicContact CD2-CG 3.68Å; F485-F593 HydrophobicContact CE1-CB 4.5Å; F485-F593 AromaticContact CE1-CD1 3.83Å; F485-F593 HydrophobicContact CE1-CD1 3.83Å; F485-F593 HydrophobicContact CE1-CE1 4.28Å; F485-F593 HydrophobicContact CE1-CG 4.13Å; F485-F593 HydrophobicContact CE2-CB 3.52Å; F485-F593 HydrophobicContact CE2-CD1 4.36Å; F485-F593 AromaticContact CE2-CG 3.9Å; F485-F593 HydrophobicContact CE2-CG 3.9Å; F485-F593 HydrophobicContact CG-CB 4.19Å; F485-F593 HydrophobicContact CG-CD1 4.09Å; F485-F593 AromaticContact CG-CD2 3.66Å; F485-F593 HydrophobicContact CG-CD2 3.66Å; F485-F593 HydrophobicContact CG-CE1 4.43Å; F485-F593 HydrophobicContact CG-CE2 4.05Å; F485-F593 AromaticContact CG-CG 3.69Å; F485-F593 HydrophobicContact CG-CG 3.69Å; F485-F593 HydrophobicContact CG-CZ 4.42Å; F485-F593 HydrophobicContact CZ-CB 3.98Å; F485-F593 HydrophobicContact CZ-CD1 4.1Å; F485-F593 HydrophobicContact CZ-CG 4.11Å; V560-F593 HydrophobicContact CG1-CE1 4.28Å; L564-F593 HydrophobicContact CD1-CD1 3.61Å; L564-F593 HydrophobicContact CD1-CE1 3.89Å; A589-F593 PolarHBondContact O-N 3.3Å; A589-F593 VanDerWaalsContact O-N 3.14Å; I590-F593 PolarHBondContact O-N 3.45Å; F593-K595 VanDerWaalsContact C-N 3.34Å; F593-K595 PolarHBondContact O-N 2.83Å; F593-H596 PolarHBondContact O-N 3.1Å; F593-S597 VanDerWaalsContact O-CB 3.27Å; F593-S597 WeakPolarHBondContact O-CB 3.39Å; F593-S597 PolarHBondContact O-N 3.03Å; F593-S597 PolarHBondContact O-OG 3.21Å; F593-F600 HydrophobicContact CE2-CE2 4.48Å
594	H	91.4	Very high	89.3	Confident	12 Å²	12	40.2 Å²	40.2	6%	0.056	23%	0.226	C	C	.	.	H	α-helix	trans	-64.1	-37.4	177.6	-173.4	-103.3	0	0	0	112.2	E155 R561 I568 I590 E591 D592 S597	E155-H594 IonicContact OE2-CE1 2.68Å; R561-H594 PolarHBondContact NH1-O 3.34Å; I568-H594 HydrophobicContact CD1-CB 4.47Å; I590-H594 WeakPolarHBondContact O-CB 3.42Å; I590-H594 PolarHBondContact O-N 3.18Å; E591-H594 PolarHBondContact O-N 3.34Å; D592-H594 VanDerWaalsContact C-N 3.33Å; D592-H594 PolarHBondContact O-N 3.33Å; H594-S597 PolarHBondContact O-OG 3.38Å
595	K	88.9	Confident	89.8	Confident	110 Å²	110	39.9 Å²	39.9	48%	0.478	21%	0.213	S	C	.	.	H	α-helix	trans	-69.7	-48.1	175.3	-74.9	174.1	-177.8	175.5	0	112.1	E591 D592 F593 S597 F598	E591-K595 WeakPolarHBondContact O-CB 3.21Å; E591-K595 VanDerWaalsContact O-CG 3.31Å; E591-K595 WeakPolarHBondContact O-CG 2.97Å; E591-K595 PolarHBondContact O-N 2.81Å; D592-K595 PolarHBondContact O-N 2.88Å; F593-K595 VanDerWaalsContact C-N 3.34Å; F593-K595 PolarHBondContact O-N 2.83Å; K595-S597 PolarHBondContact O-N 3Å; K595-F598 WeakPolarHBondContact O-CB 3.34Å; K595-F598 PolarHBondContact O-N 3.48Å
596	H	88.5	Confident	90	Very high	108 Å²	108	34.9 Å²	34.9	50%	0.5	18%	0.18	S	C	.	.	H	α-helix	trans	-65	-40.3	-179.3	-70.5	88.6	0	0	0	112.2	D592 F593 F598 F600	D592-H596 PolarHBondContact O-N 3.13Å; D592-H596 PolarHBondContact O-ND1 3.17Å; F593-H596 PolarHBondContact O-N 3.1Å; H596-F598 PolarHBondContact O-N 3.45Å; H596-F598 VanDerWaalsContact O-N 3.08Å; H596-F600 WeakPolarHBondContact O-CE1 3.23Å
597	S	93.1	Very high	90.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-1.7	179.8	60	0	0	0	0	114.6	R561 F593 H594 K595 F600	R561-S597 PolarHBondContact NH1-O 3.04Å; R561-S597 PolarHBondContact NH1-OG 3.3Å; F593-S597 VanDerWaalsContact O-CB 3.27Å; F593-S597 WeakPolarHBondContact O-CB 3.39Å; F593-S597 PolarHBondContact O-N 3.03Å; F593-S597 PolarHBondContact O-OG 3.21Å; H594-S597 PolarHBondContact O-OG 3.38Å; K595-S597 PolarHBondContact O-N 3Å; S597-F600 VanDerWaalsContact CB-CD2 3.5Å; S597-F600 VanDerWaalsContact CB-CE2 3.47Å
598	F	92.6	Very high	90.2	Very high	30 Å²	30	37.7 Å²	37.7	13%	0.132	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-42.6	175.7	177	-98.9	0	0	0	111.8	Y248 M253 R561 K595 H596 F600	Y248-F598 HydrophobicContact CD2-CE2 4.38Å; Y248-F598 HydrophobicContact CD2-CZ 4.44Å; Y248-F598 HydrophobicContact CE2-CD2 4.48Å; Y248-F598 AromaticContact CE2-CE2 3.62Å; Y248-F598 HydrophobicContact CE2-CE2 3.62Å; Y248-F598 HydrophobicContact CE2-CZ 4.1Å; M253-F598 VanDerWaalsContact C-CE1 3.41Å; M253-F598 HydrophobicContact CB-CE1 4.2Å; M253-F598 HydrophobicContact CB-CZ 4.17Å; M253-F598 HydrophobicContact CE-CB 3.55Å; M253-F598 HydrophobicContact CE-CD1 3.78Å; M253-F598 HydrophobicContact CE-CD2 3.82Å; M253-F598 HydrophobicContact CE-CE1 4.45Å; M253-F598 HydrophobicContact CE-CE2 4.49Å; M253-F598 HydrophobicContact CE-CG 3.42Å; M253-F598 VanDerWaalsContact CE-CG 3.42Å; M253-F598 WeakPolarHBondContact O-CZ 3.46Å; R561-F598 VanDerWaalsContact NH1-N 3.14Å; K595-F598 WeakPolarHBondContact O-CB 3.34Å; K595-F598 PolarHBondContact O-N 3.48Å; H596-F598 PolarHBondContact O-N 3.45Å; H596-F598 VanDerWaalsContact O-N 3.08Å; F598-F600 VanDerWaalsContact C-N 3.32Å; F598-F600 PolarHBondContact O-N 2.99Å
599	F	93.7	Very high	90.3	Very high	22 Å²	22	34.4 Å²	34.4	10%	0.096	17%	0.174	C	C	.	.	S	Bend	trans	-84.7	-2.6	-177.3	-60.2	-72.6	0	0	0	113.8	L255 L393 T601 H602 L603	L255-F599 HydrophobicContact CB-CD1 4.44Å; L255-F599 HydrophobicContact CB-CE1 4.46Å; L393-F599 HydrophobicContact CD1-CB 4.01Å; L393-F599 HydrophobicContact CD1-CD1 4.02Å; L393-F599 HydrophobicContact CD1-CD2 4.48Å; L393-F599 HydrophobicContact CD1-CG 3.92Å; L393-F599 HydrophobicContact CD2-CB 4.39Å; L393-F599 HydrophobicContact CD2-CD2 4.1Å; L393-F599 HydrophobicContact CD2-CG 4.27Å; F599-T601 VanDerWaalsContact C-N 3.35Å; F599-T601 PolarHBondContact O-N 3.49Å; F599-H602 PolarHBondContact O-N 3.22Å; F599-L603 HydrophobicContact CB-CD1 4.29Å; F599-L603 WeakPolarHBondContact O-CG 3.49Å; F599-L603 PolarHBondContact O-N 3.17Å
600	F	93.8	Very high	90.5	Very high	8 Å²	8	33.3 Å²	33.3	4%	0.035	16%	0.164	C	C	.	.	H	α-helix	trans	-62.5	-40.7	-174.4	-73.9	2.6	0	0	0	112.2	F389 I478 A481 L557 F593 H596 S597 F598 H602 L603 L604	F389-F600 HydrophobicContact CE2-CD1 4.24Å; F389-F600 HydrophobicContact CE2-CE1 4.21Å; F389-F600 HydrophobicContact CZ-CD1 4.04Å; F389-F600 AromaticContact CZ-CE1 3.79Å; F389-F600 HydrophobicContact CZ-CE1 3.79Å; I478-F600 HydrophobicContact CB-CD2 4.47Å; I478-F600 HydrophobicContact CD1-CB 3.89Å; I478-F600 HydrophobicContact CD1-CD1 4.04Å; I478-F600 HydrophobicContact CD1-CG 3.89Å; I478-F600 HydrophobicContact CG1-CB 4.42Å; I478-F600 HydrophobicContact CG1-CD1 3.84Å; I478-F600 HydrophobicContact CG1-CD2 4.15Å; I478-F600 HydrophobicContact CG1-CE1 4.1Å; I478-F600 HydrophobicContact CG1-CE2 4.39Å; I478-F600 HydrophobicContact CG1-CG 3.88Å; I478-F600 HydrophobicContact CG1-CZ 4.36Å; I478-F600 HydrophobicContact CG2-CD2 3.71Å; I478-F600 HydrophobicContact CG2-CE2 4.06Å; I478-F600 HydrophobicContact CG2-CG 4.16Å; A481-F600 HydrophobicContact CB-CZ 4.41Å; L557-F600 HydrophobicContact CD1-CD2 4.14Å; L557-F600 HydrophobicContact CD2-CB 3.83Å; F593-F600 HydrophobicContact CE2-CE2 4.48Å; H596-F600 WeakPolarHBondContact O-CE1 3.23Å; S597-F600 VanDerWaalsContact CB-CD2 3.5Å; S597-F600 VanDerWaalsContact CB-CE2 3.47Å; F598-F600 VanDerWaalsContact C-N 3.32Å; F598-F600 PolarHBondContact O-N 2.99Å; F600-H602 PolarHBondContact O-N 3.45Å; F600-L603 PolarHBondContact O-N 3.08Å; F600-L604 WeakPolarHBondContact O-CB 3.5Å; F600-L604 VanDerWaalsContact O-CG 3.24Å; F600-L604 WeakPolarHBondContact O-CG 3.18Å; F600-L604 PolarHBondContact O-N 3.09Å
601	T	90.6	Very high	90.4	Very high	62 Å²	62	35.7 Å²	35.7	38%	0.38	18%	0.175	S	C	.	.	H	α-helix	trans	-61.8	-44.7	177	-51	0	0	0	0	111.4	F599 L603 L604 N605	F599-T601 VanDerWaalsContact C-N 3.35Å; F599-T601 PolarHBondContact O-N 3.49Å; T601-L603 VanDerWaalsContact C-N 3.35Å; T601-L603 PolarHBondContact O-N 2.92Å; T601-L604 PolarHBondContact O-N 2.93Å; T601-N605 PolarHBondContact O-N 3.3Å; T601-N605 VanDerWaalsContact O-N 3.1Å
602	H	91.1	Very high	90.5	Very high	32 Å²	32	36.9 Å²	36.9	15%	0.148	18%	0.18	C	C	.	.	H	α-helix	trans	-63.6	-40.5	178.1	-59.2	88.8	0	0	0	112.5	L255 E259 F599 F600 N605 F606 A609	L255-H602 HydrophobicContact CD2-CB 3.44Å; L255-H602 VanDerWaalsContact CD2-CB 3.44Å; E259-H602 IonicContact OE1-CD2 3.65Å; E259-H602 IonicContact OE1-CE1 2.77Å; E259-H602 IonicContact OE1-NE2 2.72Å; E259-H602 PolarHBondContact OE1-NE2 3.17Å; E259-H602 IonicContact OE2-NE2 3.65Å; F599-H602 PolarHBondContact O-N 3.22Å; F600-H602 PolarHBondContact O-N 3.45Å; H602-N605 CarbonylContact O-C 3.46Å; H602-N605 PolarHBondContact O-N 2.95Å; H602-F606 PolarHBondContact O-N 3.3Å; H602-A609 HydrophobicContact CB-CB 4.35Å; H602-A609 WeakPolarHBondContact O-CB 3.29Å
603	L	91.3	Very high	90.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-74.3	-35.4	-179.5	-70.3	171.4	0	0	0	112.4	F389 A392 L393 L396 I474 F599 F600 T601 N605 F606	F389-L603 HydrophobicContact CD2-CD1 3.92Å; F389-L603 HydrophobicContact CE1-CD1 4.07Å; F389-L603 HydrophobicContact CE2-CB 4.46Å; F389-L603 HydrophobicContact CE2-CD1 3.2Å; F389-L603 HydrophobicContact CE2-CG 4.42Å; F389-L603 HydrophobicContact CZ-CD1 3.27Å; A392-L603 HydrophobicContact CB-CD2 4.23Å; L393-L603 HydrophobicContact CB-CD1 4.15Å; L393-L603 HydrophobicContact CB-CD2 4.15Å; L393-L603 HydrophobicContact CD1-CD1 4.31Å; L393-L603 HydrophobicContact CD1-CD2 4.39Å; L396-L603 HydrophobicContact CD1-CD2 3.94Å; I474-L603 HydrophobicContact CD1-CB 4.15Å; I474-L603 HydrophobicContact CD1-CD2 4.21Å; I474-L603 HydrophobicContact CG1-CB 4.45Å; I474-L603 HydrophobicContact CG2-CB 3.78Å; F599-L603 HydrophobicContact CB-CD1 4.29Å; F599-L603 WeakPolarHBondContact O-CG 3.49Å; F599-L603 PolarHBondContact O-N 3.17Å; F600-L603 PolarHBondContact O-N 3.08Å; T601-L603 VanDerWaalsContact C-N 3.35Å; T601-L603 PolarHBondContact O-N 2.92Å; L603-N605 PolarHBondContact O-N 3.43Å; L603-F606 WeakPolarHBondContact O-CB 3.36Å; L603-F606 PolarHBondContact O-N 3.35Å
604	L	90.6	Very high	90.7	Very high	32 Å²	32	32.5 Å²	32.5	17%	0.168	16%	0.158	C	C	.	.	H	α-helix	trans	-63.6	-31.9	171.6	-72.5	169.3	0	0	0	111.6	I474 R475 I478 F600 T601	I474-L604 HydrophobicContact CG2-CD2 4.38Å; R475-L604 HydrophobicContact CG-CD2 4Å; I478-L604 HydrophobicContact CD1-CD1 4.23Å; I478-L604 HydrophobicContact CD1-CD2 3.85Å; I478-L604 HydrophobicContact CD1-CG 3.67Å; F600-L604 WeakPolarHBondContact O-CB 3.5Å; F600-L604 VanDerWaalsContact O-CG 3.24Å; F600-L604 WeakPolarHBondContact O-CG 3.18Å; F600-L604 PolarHBondContact O-N 3.09Å; T601-L604 PolarHBondContact O-N 2.93Å
605	N	88.9	Confident	90.6	Very high	42 Å²	42	34.7 Å²	34.7	23%	0.225	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	45.4	174.4	-63.3	-20.6	0	0	0	111.5	T601 H602 L603 S607 E608 A609	T601-N605 PolarHBondContact O-N 3.3Å; T601-N605 VanDerWaalsContact O-N 3.1Å; H602-N605 CarbonylContact O-C 3.46Å; H602-N605 PolarHBondContact O-N 2.95Å; L603-N605 PolarHBondContact O-N 3.43Å; N605-S607 VanDerWaalsContact C-N 3.32Å; N605-S607 PolarHBondContact O-N 2.89Å; N605-E608 PolarHBondContact O-N 2.92Å; N605-E608 VanDerWaalsContact O-N 3.16Å; N605-A609 PolarHBondContact O-N 3.14Å
606	F	89.3	Confident	90.8	Very high	1 Å²	1	29.4 Å²	29.4	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-52.6	-44.8	-171.7	-178.3	-97.3	0	0	0	113.6	A392 L396 M463 E467 F470 I474 H602 L603 E608 A609 L610	A392-F606 HydrophobicContact CB-CD2 4.35Å; A392-F606 HydrophobicContact CB-CE2 3.94Å; L396-F606 HydrophobicContact CD1-CD2 3.78Å; L396-F606 HydrophobicContact CD1-CE2 3.78Å; L396-F606 HydrophobicContact CD2-CE2 4.01Å; L396-F606 HydrophobicContact CD2-CZ 4.44Å; L396-F606 HydrophobicContact CG-CD2 4.33Å; L396-F606 HydrophobicContact CG-CE2 3.83Å; M463-F606 HydrophobicContact CB-CZ 4.22Å; M463-F606 HydrophobicContact CE-CE2 3.99Å; M463-F606 HydrophobicContact CE-CZ 3.69Å; E467-F606 HydrophobicContact CB-CD1 4.43Å; E467-F606 HydrophobicContact CB-CE1 4.49Å; E467-F606 HydrophobicContact CG-CD1 4.12Å; F470-F606 AromaticContact CD2-CE1 3.98Å; F470-F606 HydrophobicContact CD2-CE1 3.98Å; F470-F606 HydrophobicContact CD2-CE2 4.25Å; F470-F606 AromaticContact CD2-CZ 3.7Å; F470-F606 HydrophobicContact CD2-CZ 3.7Å; F470-F606 HydrophobicContact CE2-CZ 4.11Å; I474-F606 HydrophobicContact CD1-CB 4.5Å; I474-F606 HydrophobicContact CD1-CD2 4.23Å; H602-F606 PolarHBondContact O-N 3.3Å; L603-F606 WeakPolarHBondContact O-CB 3.36Å; L603-F606 PolarHBondContact O-N 3.35Å; F606-E608 PolarHBondContact O-N 2.86Å; F606-A609 PolarHBondContact O-N 3.28Å; F606-L610 HydrophobicContact CE1-CB 4.49Å; F606-L610 HydrophobicContact CE1-CD2 4.02Å; F606-L610 HydrophobicContact CZ-CD2 4.48Å; F606-L610 VanDerWaalsContact O-CB 3.27Å; F606-L610 WeakPolarHBondContact O-CB 3.4Å; F606-L610 PolarHBondContact O-N 3.35Å
607	S	87.3	Confident	91.1	Very high	15 Å²	15	24.3 Å²	24.3	11%	0.105	12%	0.124	C	C	.	.	H	α-helix	trans	-57.6	-45.7	-179.4	-159.6	0	0	0	0	112.7	Q39 E467 N605 Q611	Q39-S607 PolarHBondContact NE2-OG 3.26Å; E467-S607 VanDerWaalsContact OE1-CB 3.29Å; E467-S607 WeakPolarHBondContact OE1-CB 3.25Å; E467-S607 PolarHBondContact OE2-OG 2.65Å; N605-S607 VanDerWaalsContact C-N 3.32Å; N605-S607 PolarHBondContact O-N 2.89Å; S607-Q611 PolarHBondContact O-N 2.78Å
608	E	86.1	Confident	91.1	Very high	70 Å²	70	25.7 Å²	25.7	33%	0.327	13%	0.13	S	C	.	.	H	α-helix	trans	-71	-44	178.9	-174.5	179.9	-174.4	0	0	110.9	N605 F606 L610 Q611 Q612	N605-E608 PolarHBondContact O-N 2.92Å; N605-E608 VanDerWaalsContact O-N 3.16Å; F606-E608 PolarHBondContact O-N 2.86Å; E608-L610 VanDerWaalsContact C-N 3.26Å; E608-L610 PolarHBondContact O-N 2.89Å; E608-Q611 PolarHBondContact O-N 3.11Å; E608-Q612 HydrophobicContact CG-CG 4.42Å; E608-Q612 WeakPolarHBondContact O-CG 3.25Å; E608-Q612 PolarHBondContact O-N 2.85Å; E608-Q612 PolarHBondContact OE1-NE2 2.98Å
609	A	90.1	Very high	91.3	Very high	3 Å²	3	24.4 Å²	24.4	3%	0.025	13%	0.125	C	C	.	.	H	α-helix	trans	-59.4	-39.7	176.6	0	0	0	0	0	111.5	L255 L396 H602 N605 F606 Q612 C613	L255-A609 HydrophobicContact CD2-CB 4.2Å; L396-A609 HydrophobicContact CD1-CB 4.13Å; H602-A609 HydrophobicContact CB-CB 4.35Å; H602-A609 WeakPolarHBondContact O-CB 3.29Å; N605-A609 PolarHBondContact O-N 3.14Å; F606-A609 PolarHBondContact O-N 3.28Å; A609-Q612 PolarHBondContact O-N 3.06Å; A609-C613 WeakPolarHBondContact O-CB 3.43Å; A609-C613 PolarHBondContact O-N 3.23Å; A609-C613 PolarHBondContact O-SG 2.86Å
610	L	91.5	Very high	91.4	Very high	9 Å²	9	23.5 Å²	23.5	5%	0.047	12%	0.121	C	C	.	.	H	α-helix	trans	-61.1	-46.8	177.2	-177.3	60.7	0	0	0	111.7	L396 L399 Q460 M463 F606 E608 C613 C614	L396-L610 HydrophobicContact CD2-CB 3.94Å; L396-L610 HydrophobicContact CD2-CD1 3.8Å; L399-L610 HydrophobicContact CD1-CD1 3.47Å; L399-L610 VanDerWaalsContact CD1-CD1 3.47Å; Q460-L610 HydrophobicContact CG-CD1 4.35Å; Q460-L610 HydrophobicContact CG-CD2 4.41Å; Q460-L610 HydrophobicContact CG-CG 4.17Å; M463-L610 HydrophobicContact CB-CD1 3.88Å; M463-L610 HydrophobicContact CB-CD2 4.04Å; M463-L610 HydrophobicContact CG-CD1 4.46Å; F606-L610 HydrophobicContact CE1-CB 4.49Å; F606-L610 HydrophobicContact CE1-CD2 4.02Å; F606-L610 HydrophobicContact CZ-CD2 4.48Å; F606-L610 VanDerWaalsContact O-CB 3.27Å; F606-L610 WeakPolarHBondContact O-CB 3.4Å; F606-L610 PolarHBondContact O-N 3.35Å; E608-L610 VanDerWaalsContact C-N 3.26Å; E608-L610 PolarHBondContact O-N 2.89Å; L610-C613 PolarHBondContact O-N 2.87Å; L610-C614 PolarHBondContact O-N 3.47Å; L610-C614 PolarHBondContact O-SG 3.14Å
611	Q	89.2	Confident	91.5	Very high	52 Å²	52	23.1 Å²	23.1	24%	0.243	12%	0.119	C	C	.	.	H	α-helix	trans	-62.7	-46	176.5	-70.2	179.7	1.3	0	0	111.6	S607 E608 C613 C614 D615	S607-Q611 PolarHBondContact O-N 2.78Å; E608-Q611 PolarHBondContact O-N 3.11Å; Q611-C613 VanDerWaalsContact C-N 3.31Å; Q611-C613 PolarHBondContact O-N 3.28Å; Q611-C614 CarbonylContact O-C 3.56Å; Q611-C614 PolarHBondContact O-N 3.18Å; Q611-C614 VanDerWaalsContact O-N 3.1Å; Q611-D615 PolarHBondContact O-N 2.96Å; Q611-D615 VanDerWaalsContact O-N 3.12Å
612	Q	89.3	Confident	91.8	Very high	71 Å²	71	20.2 Å²	20.2	33%	0.332	10%	0.101	S	C	.	.	H	α-helix	trans	-66.3	-31.1	180	-66.9	179.1	6.4	0	0	112.9	T256 E608 A609 C614	T256-Q612 HydrophobicContact CG2-CB 3.79Å; E608-Q612 HydrophobicContact CG-CG 4.42Å; E608-Q612 WeakPolarHBondContact O-CG 3.25Å; E608-Q612 PolarHBondContact O-N 2.85Å; E608-Q612 PolarHBondContact OE1-NE2 2.98Å; A609-Q612 PolarHBondContact O-N 3.06Å; Q612-C614 VanDerWaalsContact C-N 3.29Å
613	C	93.6	Very high	92	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-72.5	-21.1	174	-73.4	0	0	0	0	113.2	L399 S403 A609 L610 Q611	L399-C613 HydrophobicContact CB-CB 4.22Å; S403-C613 VanDerWaalsContact CB-O 3.24Å; S403-C613 WeakPolarHBondContact CB-O 3.46Å; S403-C613 PolarHBondContact OG-O 3.16Å; A609-C613 WeakPolarHBondContact O-CB 3.43Å; A609-C613 PolarHBondContact O-N 3.23Å; A609-C613 PolarHBondContact O-SG 2.86Å; L610-C613 PolarHBondContact O-N 2.87Å; Q611-C613 VanDerWaalsContact C-N 3.31Å; Q611-C613 PolarHBondContact O-N 3.28Å
614	C	92.8	Very high	92.2	Very high	3 Å²	3	20.9 Å²	20.9	2%	0.02	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	12.2	-177.9	-53.2	0	0	0	0	113.4	I456 Q460 L610 Q611 Q612 L616	I456-C614 HydrophobicContact CG2-CB 3.81Å; Q460-C614 HydrophobicContact CG-CB 4.31Å; L610-C614 PolarHBondContact O-N 3.47Å; L610-C614 PolarHBondContact O-SG 3.14Å; Q611-C614 CarbonylContact O-C 3.56Å; Q611-C614 PolarHBondContact O-N 3.18Å; Q611-C614 VanDerWaalsContact O-N 3.1Å; Q612-C614 VanDerWaalsContact C-N 3.29Å; C614-L616 PolarHBondContact O-N 3.04Å
615	D	89.3	Confident	92.3	Very high	58 Å²	58	20 Å²	20	31%	0.31	10%	0.099	S	C	.	.			trans	-70.6	112.5	-175.5	-176.3	14.3	0	0	0	111.8	Q611 S617	Q611-D615 PolarHBondContact O-N 2.96Å; Q611-D615 VanDerWaalsContact O-N 3.12Å; D615-S617 WeakPolarHBondContact OD1-CB 3.45Å; D615-S617 PolarHBondContact OD1-N 2.95Å; D615-S617 PolarHBondContact OD1-OG 3.49Å
616	L	94.7	Very high	92.6	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.091	C	C	.	.			trans	-120.2	13.9	175.7	-59.7	173.9	0	0	0	112	V406 M407 I453 I456 C614 Q618 L619 L668	V406-L616 HydrophobicContact CB-CD2 4.2Å; V406-L616 HydrophobicContact CG1-CD2 4.11Å; M407-L616 HydrophobicContact CE-CD2 3.6Å; M407-L616 HydrophobicContact SD-CD2 4.43Å; I453-L616 HydrophobicContact CB-CD1 4.37Å; I453-L616 HydrophobicContact CG1-CD1 3.98Å; I453-L616 HydrophobicContact CG2-CD1 4.03Å; I456-L616 HydrophobicContact CD1-CD1 4.24Å; C614-L616 PolarHBondContact O-N 3.04Å; L616-Q618 PolarHBondContact O-N 3.42Å; L616-Q618 VanDerWaalsContact O-N 3.12Å; L616-L619 HydrophobicContact CB-CD1 4.37Å; L616-L619 PolarHBondContact O-N 2.68Å; L616-L668 HydrophobicContact CB-CD2 3.72Å; L616-L668 HydrophobicContact CD1-CD2 4Å
617	S	93.3	Very high	92.8	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-60.6	-24.8	-174.3	60.6	0	0	0	0	114.3	D615 L619 F621 S672 Y675	D615-S617 WeakPolarHBondContact OD1-CB 3.45Å; D615-S617 PolarHBondContact OD1-N 2.95Å; D615-S617 PolarHBondContact OD1-OG 3.49Å; S617-L619 VanDerWaalsContact C-N 3.25Å; S617-L619 PolarHBondContact O-N 2.86Å; S617-F621 VanDerWaalsContact O-CD2 3.3Å; S617-F621 WeakPolarHBondContact O-CD2 3.49Å; S617-F621 WeakPolarHBondContact O-CE2 3.48Å; S617-S672 PolarHBondContact O-OG 3.44Å; S617-Y675 WeakPolarHBondContact OG-CD2 3.21Å
618	Q	94.3	Very high	93.1	Very high	29 Å²	29	22.3 Å²	22.3	14%	0.136	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-75.5	-8.6	-173.8	-54.9	-54.8	-58.4	0	0	114.2	L616 W620	L616-Q618 PolarHBondContact O-N 3.42Å; L616-Q618 VanDerWaalsContact O-N 3.12Å; Q618-W620 VanDerWaalsContact C-N 3.28Å; Q618-W620 PolarHBondContact O-N 2.58Å
619	L	95.6	Very high	93.4	Very high	4 Å²	4	20.2 Å²	20.2	2%	0.021	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-67.7	-25.2	179.6	-69.4	175.6	0	0	0	113.6	M407 Y410 I453 L616 S617 M642 L668	M407-L619 HydrophobicContact CE-CD1 3.98Å; M407-L619 HydrophobicContact CE-CD2 3.54Å; M407-L619 HydrophobicContact CE-CG 3.68Å; Y410-L619 HydrophobicContact CD1-CD2 3.69Å; Y410-L619 HydrophobicContact CD2-CD2 3.78Å; Y410-L619 HydrophobicContact CE1-CD2 4.05Å; Y410-L619 HydrophobicContact CE2-CD2 4.16Å; Y410-L619 HydrophobicContact CG-CD2 3.52Å; I453-L619 HydrophobicContact CD1-CD1 4.44Å; L616-L619 HydrophobicContact CB-CD1 4.37Å; L616-L619 PolarHBondContact O-N 2.68Å; S617-L619 VanDerWaalsContact C-N 3.25Å; S617-L619 PolarHBondContact O-N 2.86Å; L619-M642 HydrophobicContact CB-CB 4.21Å; L619-M642 WeakPolarHBondContact O-CB 3.15Å; L619-L668 HydrophobicContact CD1-CD1 3.89Å; L619-L668 HydrophobicContact CD1-CD2 4.16Å
620	W	96.8	Very high	93.5	Very high	3 Å²	3	27 Å²	27	1%	0.011	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-38	-179.1	-175.9	84	0	0	0	113.4	Q618 P643 Y669 S672 L685 E688 I689 E692	Q618-W620 VanDerWaalsContact C-N 3.28Å; Q618-W620 PolarHBondContact O-N 2.58Å; W620-P643 HydrophobicContact CB-CG 4.23Å; W620-Y669 AromaticContact CD1-CE1 3.65Å; W620-Y669 AromaticContact NE1-CE1 3.88Å; W620-S672 VanDerWaalsContact CB-OG 3.29Å; W620-S672 WeakPolarHBondContact CB-OG 3.39Å; W620-L685 HydrophobicContact CZ3-CD2 4.5Å; W620-E688 HydrophobicContact CH2-CB 3.9Å; W620-E688 HydrophobicContact CZ2-CB 4.21Å; W620-I689 HydrophobicContact CD2-CD1 4.33Å; W620-I689 HydrophobicContact CD2-CG1 3.71Å; W620-I689 HydrophobicContact CE3-CD1 3.81Å; W620-I689 HydrophobicContact CE3-CG1 3.55Å; W620-I689 HydrophobicContact CH2-CB 4.5Å; W620-I689 HydrophobicContact CH2-CD1 4.25Å; W620-I689 HydrophobicContact CH2-CG1 3.41Å; W620-I689 VanDerWaalsContact CH2-CG1 3.41Å; W620-I689 HydrophobicContact CZ2-CB 4.36Å; W620-I689 HydrophobicContact CZ2-CG1 3.53Å; W620-I689 HydrophobicContact CZ3-CD1 3.78Å; W620-I689 HydrophobicContact CZ3-CG1 3.41Å; W620-I689 VanDerWaalsContact CZ3-CG1 3.41Å; W620-E692 VanDerWaalsContact NE1-CD 3.29Å; W620-E692 PolarHBondContact NE1-OE1 2.79Å; W620-E692 PolarHBondContact NE1-OE2 2.88Å
621	F	96.6	Very high	93.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.			trans	-64.9	141.4	-174.8	-62.5	-67.2	0	0	0	111.6	D309 S617 S672 Y675 A676 F680 L685 I689	D309-F621 WeakPolarHBondContact CB-O 3.21Å; S617-F621 VanDerWaalsContact O-CD2 3.3Å; S617-F621 WeakPolarHBondContact O-CD2 3.49Å; S617-F621 WeakPolarHBondContact O-CE2 3.48Å; F621-S672 WeakPolarHBondContact CZ-O 3.35Å; F621-Y675 AromaticContact CE2-CD1 3.94Å; F621-Y675 HydrophobicContact CE2-CD1 3.94Å; F621-Y675 HydrophobicContact CE2-CG 4.23Å; F621-Y675 HydrophobicContact CZ-CD1 4.24Å; F621-A676 HydrophobicContact CE1-CB 4.27Å; F621-A676 HydrophobicContact CZ-CB 4.15Å; F621-F680 HydrophobicContact CD1-CD2 4.24Å; F621-F680 AromaticContact CD1-CE2 3.74Å; F621-F680 HydrophobicContact CD1-CE2 3.74Å; F621-F680 AromaticContact CD2-CE2 3.79Å; F621-F680 HydrophobicContact CD2-CE2 3.79Å; F621-F680 AromaticContact CE1-CD2 3.74Å; F621-F680 HydrophobicContact CE1-CD2 3.74Å; F621-F680 AromaticContact CE1-CE2 3.64Å; F621-F680 HydrophobicContact CE1-CE2 3.64Å; F621-F680 HydrophobicContact CE2-CD2 4.25Å; F621-F680 AromaticContact CE2-CE2 3.68Å; F621-F680 HydrophobicContact CE2-CE2 3.68Å; F621-F680 AromaticContact CG-CE2 3.83Å; F621-F680 HydrophobicContact CG-CE2 3.83Å; F621-F680 AromaticContact CZ-CD2 3.74Å; F621-F680 HydrophobicContact CZ-CD2 3.74Å; F621-F680 AromaticContact CZ-CE2 3.61Å; F621-F680 HydrophobicContact CZ-CE2 3.61Å; F621-L685 HydrophobicContact CE1-CD1 4.21Å; F621-I689 HydrophobicContact CE1-CD1 4.3Å
622	R	96	Very high	93.5	Very high	1 Å²	1	36 Å²	36	0%	0.004	18%	0.178	C	C	.	.			trans	-153.1	29.2	-170.7	56.6	-160.4	179.7	-168.1	-14.1	114.6	D309 Y433 F624 F625 L626 F636 E692	D309-R622 WeakPolarHBondContact OD2-CA 3.47Å; Y433-R622 HydrophobicContact CE1-CB 4.33Å; Y433-R622 HydrophobicContact CE2-CB 4.14Å; Y433-R622 WeakPolarHBondContact OH-CD 3.43Å; R622-F624 VanDerWaalsContact C-N 3.31Å; R622-F624 PolarHBondContact O-N 2.93Å; R622-F625 PolarHBondContact O-N 2.91Å; R622-L626 WeakPolarHBondContact O-CG 3.43Å; R622-L626 PolarHBondContact O-N 3.42Å; R622-F636 HydrophobicContact CB-CD2 4.41Å; R622-F636 HydrophobicContact CG-CD2 3.92Å; R622-F636 HydrophobicContact CG-CE2 4.45Å; R622-F636 PolarHBondContact NH2-O 2.82Å; R622-E692 IonicContact CZ-OE2 2.71Å; R622-E692 IonicContact NH2-OE2 3.44Å; R622-E692 PolarHBondContact NH2-OE2 3.32Å
623	E	95.3	Very high	93.6	Very high	2 Å²	2	37 Å²	37	1%	0.009	18%	0.179	C	C	.	.	H	α-helix	trans	-66.5	-29.6	-175.7	-64.5	-61.2	125.2	0	0	113.3	Y84 R87 D309 E627	Y84-E623 HydrophobicContact CD1-CB 4.38Å; Y84-E623 HydrophobicContact CD1-CG 4.3Å; Y84-E623 HydrophobicContact CD2-CB 4.29Å; Y84-E623 HydrophobicContact CE1-CB 3.92Å; Y84-E623 HydrophobicContact CE1-CG 3.79Å; Y84-E623 HydrophobicContact CE2-CB 3.82Å; Y84-E623 PolarHBondContact OH-N 2.66Å; R87-E623 IonicContact CZ-OE1 2.73Å; R87-E623 IonicContact CZ-OE2 2.72Å; R87-E623 IonicContact NE-OE1 2.83Å; R87-E623 PolarHBondContact NE-OE1 3.46Å; R87-E623 IonicContact NE-OE2 3.65Å; R87-E623 PolarHBondContact NE-OE2 3.38Å; R87-E623 IonicContact NH2-OE1 3.58Å; R87-E623 PolarHBondContact NH2-OE1 3.3Å; R87-E623 IonicContact NH2-OE2 3.5Å; D309-E623 PolarHBondContact OD1-N 3.05Å; E623-E627 PolarHBondContact O-N 3.49Å
624	F	94.7	Very high	93.5	Very high	44 Å²	44	43.5 Å²	43.5	19%	0.193	21%	0.212	C	C	.	.	H	α-helix	trans	-68.1	-49.7	176.3	164.4	-96.4	0	0	0	110.5	M177 D309 M310 R622 L626 E627 L628	M177-F624 HydrophobicContact CB-CD2 4.13Å; M177-F624 HydrophobicContact CB-CE2 4.09Å; M177-F624 HydrophobicContact CE-CB 4.4Å; M177-F624 HydrophobicContact CE-CD2 4.39Å; M177-F624 HydrophobicContact CG-CD2 4.05Å; M177-F624 HydrophobicContact CG-CE2 4.45Å; M177-F624 HydrophobicContact SD-CB 4.46Å; M177-F624 HydrophobicContact SD-CD2 3.78Å; D309-F624 WeakPolarHBondContact OD1-CB 3.46Å; D309-F624 PolarHBondContact OD1-N 3.28Å; D309-F624 WeakPolarHBondContact OD2-CB 3.39Å; D309-F624 PolarHBondContact OD2-N 3.2Å; D309-F624 VanDerWaalsContact OD2-N 3.1Å; M310-F624 HydrophobicContact CB-CB 4.11Å; M310-F624 HydrophobicContact CB-CD2 4.14Å; M310-F624 HydrophobicContact CB-CG 4.07Å; M310-F624 HydrophobicContact CG-CD2 3.88Å; M310-F624 HydrophobicContact CG-CE2 4.1Å; M310-F624 HydrophobicContact CG-CG 4.25Å; M310-F624 HydrophobicContact SD-CD2 4.14Å; M310-F624 HydrophobicContact SD-CE2 4.39Å; R622-F624 VanDerWaalsContact C-N 3.31Å; R622-F624 PolarHBondContact O-N 2.93Å; F624-L626 VanDerWaalsContact C-N 3.28Å; F624-L626 PolarHBondContact O-N 3.23Å; F624-E627 WeakPolarHBondContact O-CB 3.31Å; F624-E627 PolarHBondContact O-N 3.15Å; F624-L628 HydrophobicContact CD1-CD1 4.17Å; F624-L628 HydrophobicContact CE1-CD1 3.53Å; F624-L628 HydrophobicContact CE1-CG 4.35Å; F624-L628 HydrophobicContact CE2-CD1 4.29Å; F624-L628 HydrophobicContact CE2-CD2 4.47Å; F624-L628 HydrophobicContact CE2-CG 4.41Å; F624-L628 HydrophobicContact CZ-CD1 3.6Å; F624-L628 HydrophobicContact CZ-CD2 4.44Å; F624-L628 HydrophobicContact CZ-CG 4.2Å; F624-L628 WeakPolarHBondContact O-CG 3.4Å; F624-L628 PolarHBondContact O-N 2.96Å; F624-L628 VanDerWaalsContact O-N 3.1Å
625	F	94.3	Very high	93.6	Very high	13 Å²	13	45.1 Å²	45.1	6%	0.057	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-33.3	176.1	-77.1	-79.5	0	0	0	112.7	D309 L414 E432 Y433 R622 L628 T629 F636	D309-F625 HydrophobicContact CB-CD2 4.4Å; D309-F625 VanDerWaalsContact OD2-CD2 3.25Å; D309-F625 WeakPolarHBondContact OD2-CD2 3.5Å; D309-F625 PolarHBondContact OD2-N 3.16Å; L414-F625 HydrophobicContact CB-CE2 4.34Å; L414-F625 HydrophobicContact CB-CZ 4.39Å; L414-F625 HydrophobicContact CD1-CE2 4.32Å; L414-F625 HydrophobicContact CD2-CE2 3.84Å; L414-F625 HydrophobicContact CD2-CZ 4.27Å; L414-F625 HydrophobicContact CG-CE2 4.39Å; E432-F625 HydrophobicContact CG-CE1 4.39Å; Y433-F625 HydrophobicContact CD2-CB 3.72Å; Y433-F625 AromaticContact CD2-CD1 3.85Å; Y433-F625 HydrophobicContact CD2-CD1 3.85Å; Y433-F625 AromaticContact CD2-CD2 3.39Å; Y433-F625 HydrophobicContact CD2-CD2 3.39Å; Y433-F625 HydrophobicContact CD2-CE1 4.31Å; Y433-F625 AromaticContact CD2-CE2 3.92Å; Y433-F625 HydrophobicContact CD2-CE2 3.92Å; Y433-F625 AromaticContact CD2-CG 3.36Å; Y433-F625 HydrophobicContact CD2-CG 3.36Å; Y433-F625 HydrophobicContact CD2-CZ 4.34Å; Y433-F625 HydrophobicContact CE2-CB 4.36Å; Y433-F625 AromaticContact CE2-CD2 3.68Å; Y433-F625 HydrophobicContact CE2-CD2 3.68Å; Y433-F625 HydrophobicContact CE2-CE2 4.2Å; Y433-F625 HydrophobicContact CE2-CG 4.08Å; Y433-F625 HydrophobicContact CG-CB 4.06Å; Y433-F625 HydrophobicContact CG-CD1 4.37Å; Y433-F625 HydrophobicContact CG-CD2 4.47Å; Y433-F625 HydrophobicContact CG-CG 4.06Å; R622-F625 PolarHBondContact O-N 2.91Å; F625-L628 HydrophobicContact CD1-CD1 4.33Å; F625-L628 PolarHBondContact O-N 2.93Å; F625-T629 VanDerWaalsContact O-CG2 3.27Å; F625-T629 WeakPolarHBondContact O-CG2 3.36Å; F625-T629 PolarHBondContact O-N 3.39Å; F625-F636 HydrophobicContact CB-CE2 3.83Å; F625-F636 HydrophobicContact CB-CZ 3.97Å
626	L	94.8	Very high	93.9	Very high	12 Å²	12	42.8 Å²	42.8	6%	0.063	21%	0.206	C	C	.	.	H	α-helix	trans	-62.8	-44.1	173.5	-75	174.3	0	0	0	112.3	R622 F624 L628 T629 R633 F636	R622-L626 WeakPolarHBondContact O-CG 3.43Å; R622-L626 PolarHBondContact O-N 3.42Å; F624-L626 VanDerWaalsContact C-N 3.28Å; F624-L626 PolarHBondContact O-N 3.23Å; L626-L628 VanDerWaalsContact C-N 3.3Å; L626-L628 PolarHBondContact O-N 3.39Å; L626-T629 WeakPolarHBondContact O-CB 3.33Å; L626-T629 PolarHBondContact O-N 3.34Å; L626-T629 VanDerWaalsContact O-N 3.15Å; L626-T629 PolarHBondContact O-OG1 3Å; L626-R633 HydrophobicContact CD2-CB 4.13Å; L626-F636 HydrophobicContact CB-CE2 4.48Å; L626-F636 HydrophobicContact CD2-CD2 3.57Å; L626-F636 HydrophobicContact CD2-CE2 3.47Å; L626-F636 VanDerWaalsContact CD2-CE2 3.47Å; L626-F636 HydrophobicContact CD2-CG 4.31Å; L626-F636 HydrophobicContact CD2-CZ 4.1Å; L626-F636 HydrophobicContact CG-CD2 3.98Å; L626-F636 HydrophobicContact CG-CE2 3.69Å
627	E	94.3	Very high	93.9	Very high	20 Å²	20	44.6 Å²	44.6	9%	0.093	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-41.3	176.1	-176.4	67.1	-160.5	0	0	111.2	M177 K178 C179 S180 E623 F624 T629 M630	M177-E627 WeakPolarHBondContact O-CG 3.33Å; M177-E627 HydrophobicContact SD-CB 4.41Å; M177-E627 HydrophobicContact SD-CG 4.34Å; K178-E627 HydrophobicContact CD-CG 4.21Å; C179-E627 WeakPolarHBondContact CA-OE1 3.28Å; C179-E627 WeakPolarHBondContact CB-OE1 3.31Å; C179-E627 PolarHBondContact N-OE1 2.88Å; S180-E627 WeakPolarHBondContact CB-OE2 3.26Å; S180-E627 PolarHBondContact N-OE1 3.12Å; S180-E627 VanDerWaalsContact OG-CD 3.27Å; S180-E627 PolarHBondContact OG-OE1 3.38Å; S180-E627 VanDerWaalsContact OG-OE1 3.09Å; S180-E627 PolarHBondContact OG-OE2 3.44Å; E623-E627 PolarHBondContact O-N 3.49Å; F624-E627 WeakPolarHBondContact O-CB 3.31Å; F624-E627 PolarHBondContact O-N 3.15Å; E627-T629 PolarHBondContact O-N 3.23Å; E627-M630 PolarHBondContact O-N 3.34Å
628	L	92.8	Very high	94.1	Very high	75 Å²	75	46 Å²	46	39%	0.393	23%	0.226	S	C	.	.	H	α-helix	trans	-63.1	-23.9	177.4	-67.6	-177	0	0	0	113.8	F624 F625 L626 M630	F624-L628 HydrophobicContact CD1-CD1 4.17Å; F624-L628 HydrophobicContact CE1-CD1 3.53Å; F624-L628 HydrophobicContact CE1-CG 4.35Å; F624-L628 HydrophobicContact CE2-CD1 4.29Å; F624-L628 HydrophobicContact CE2-CD2 4.47Å; F624-L628 HydrophobicContact CE2-CG 4.41Å; F624-L628 HydrophobicContact CZ-CD1 3.6Å; F624-L628 HydrophobicContact CZ-CD2 4.44Å; F624-L628 HydrophobicContact CZ-CG 4.2Å; F624-L628 WeakPolarHBondContact O-CG 3.4Å; F624-L628 PolarHBondContact O-N 2.96Å; F624-L628 VanDerWaalsContact O-N 3.1Å; F625-L628 HydrophobicContact CD1-CD1 4.33Å; F625-L628 PolarHBondContact O-N 2.93Å; L626-L628 VanDerWaalsContact C-N 3.3Å; L626-L628 PolarHBondContact O-N 3.39Å; L628-M630 PolarHBondContact O-N 3.38Å; L628-M630 VanDerWaalsContact O-N 3.17Å
629	T	92.9	Very high	94	Very high	26 Å²	26	48.5 Å²	48.5	16%	0.16	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-6.4	174.2	77.1	0	0	0	0	113.5	F625 L626 E627 G631 R632 R633 F636	F625-T629 VanDerWaalsContact O-CG2 3.27Å; F625-T629 WeakPolarHBondContact O-CG2 3.36Å; F625-T629 PolarHBondContact O-N 3.39Å; L626-T629 WeakPolarHBondContact O-CB 3.33Å; L626-T629 PolarHBondContact O-N 3.34Å; L626-T629 VanDerWaalsContact O-N 3.15Å; L626-T629 PolarHBondContact O-OG1 3Å; E627-T629 PolarHBondContact O-N 3.23Å; T629-G631 PolarHBondContact O-N 3.04Å; T629-G631 VanDerWaalsContact O-N 3.16Å; T629-R632 VanDerWaalsContact O-CB 3.26Å; T629-R632 WeakPolarHBondContact O-CB 3.48Å; T629-R632 PolarHBondContact O-N 3.34Å; T629-R633 HydrophobicContact CG2-CB 3.99Å; T629-R633 HydrophobicContact CG2-CG 3.99Å; T629-R633 PolarHBondContact OG1-N 2.95Å; T629-F636 HydrophobicContact CG2-CE1 4.04Å; T629-F636 HydrophobicContact CG2-CZ 3.75Å
630	M	91.3	Very high	94.1	Very high	145 Å²	145	48.5 Å²	48.5	71%	0.714	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	38.2	180	-53.3	-176.7	-153.2	0	0	112.9	R91 E627 L628	R91-M630 VanDerWaalsContact CZ-C 3.45Å; R91-M630 PolarHBondContact NH1-O 3.22Å; R91-M630 PolarHBondContact NH2-O 2.91Å; E627-M630 PolarHBondContact O-N 3.34Å; L628-M630 PolarHBondContact O-N 3.38Å; L628-M630 VanDerWaalsContact O-N 3.17Å
631	G	89.9	Confident	94	Very high	43 Å²	43	48.3 Å²	48.3	44%	0.443	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	9.7	177.9	0	0	0	0	0	115.2	T629 R633	T629-G631 PolarHBondContact O-N 3.04Å; T629-G631 VanDerWaalsContact O-N 3.16Å; G631-R633 VanDerWaalsContact C-N 3.34Å
632	R	91	Very high	94	Very high	207 Å²	207	48.5 Å²	48.5	78%	0.781	24%	0.237	S	C	*	.	S	Bend	trans	-68.2	-35	170.1	-178.3	179.9	174.5	-178	-3.4	111.7	T629	T629-R632 VanDerWaalsContact O-CB 3.26Å; T629-R632 WeakPolarHBondContact O-CB 3.48Å; T629-R632 PolarHBondContact O-N 3.34Å
633	R	91.1	Very high	94	Very high	91 Å²	91	48.4 Å²	48.4	34%	0.343	24%	0.237	S	C	.	.			trans	-113.7	135.4	175.6	-65.3	-69	-165.6	175	2.4	109.4	E431 L626 T629 G631 F636	E431-R633 IonicContact OE1-CZ 3.41Å; E431-R633 VanDerWaalsContact OE1-CZ 3.29Å; E431-R633 IonicContact OE1-NE 3.9Å; E431-R633 PolarHBondContact OE1-NE 3.15Å; E431-R633 VanDerWaalsContact OE1-NE 3.16Å; E431-R633 IonicContact OE1-NH2 3.64Å; E431-R633 PolarHBondContact OE1-NH2 3.36Å; E431-R633 IonicContact OE2-NE 3.68Å; E431-R633 PolarHBondContact OE2-NE 3.03Å; L626-R633 HydrophobicContact CD2-CB 4.13Å; T629-R633 HydrophobicContact CG2-CB 3.99Å; T629-R633 HydrophobicContact CG2-CG 3.99Å; T629-R633 PolarHBondContact OG1-N 2.95Å; G631-R633 VanDerWaalsContact C-N 3.34Å; R633-F636 HydrophobicContact CG-CD1 4.32Å; R633-F636 HydrophobicContact CG-CE1 4.12Å
634	I	92.4	Very high	94.1	Very high	137 Å²	137	48.6 Å²	48.6	70%	0.703	24%	0.238	S	C	*	.	S	Bend	trans	-88.8	-31.5	166.7	-170	60.5	0	0	0	111.3	R87	R87-I634 PolarHBondContact NH1-O 3.04Å
635	Q	94.4	Very high	94.2	Very high	37 Å²	37	47.1 Å²	47.1	17%	0.173	23%	0.231	C	C	.	.	S	Bend	trans	-155.6	158.8	172.2	-169.1	47.5	-80.6	0	0	108.7	E688	Q635-E688 PolarHBondContact NE2-OE2 2.72Å
636	F	95.3	Very high	94.3	Very high	9 Å²	9	46.6 Å²	46.6	4%	0.039	23%	0.229	C	C	.	.			trans	-87.5	150.7	173.4	-66.3	-73.9	0	0	0	111.7	Y433 R622 F625 L626 T629 R633 M640	Y433-F636 HydrophobicContact CD1-CB 4.3Å; Y433-F636 AromaticContact CD1-CD1 3.91Å; Y433-F636 HydrophobicContact CD1-CD1 3.91Å; Y433-F636 AromaticContact CD1-CD2 3.65Å; Y433-F636 HydrophobicContact CD1-CD2 3.65Å; Y433-F636 HydrophobicContact CD1-CE1 4.09Å; Y433-F636 AromaticContact CD1-CE2 3.81Å; Y433-F636 HydrophobicContact CD1-CE2 3.81Å; Y433-F636 AromaticContact CD1-CG 3.69Å; Y433-F636 HydrophobicContact CD1-CG 3.69Å; Y433-F636 HydrophobicContact CD1-CZ 4.04Å; Y433-F636 HydrophobicContact CE1-CB 4.38Å; Y433-F636 AromaticContact CE1-CD2 3.9Å; Y433-F636 HydrophobicContact CE1-CD2 3.9Å; Y433-F636 HydrophobicContact CE1-CE2 4.33Å; Y433-F636 HydrophobicContact CE1-CG 4.11Å; Y433-F636 HydrophobicContact CG-CD2 4.34Å; Y433-F636 HydrophobicContact CG-CE1 4.32Å; Y433-F636 HydrophobicContact CG-CE2 4.03Å; Y433-F636 HydrophobicContact CG-CZ 4.03Å; R622-F636 HydrophobicContact CB-CD2 4.41Å; R622-F636 HydrophobicContact CG-CD2 3.92Å; R622-F636 HydrophobicContact CG-CE2 4.45Å; R622-F636 PolarHBondContact NH2-O 2.82Å; F625-F636 HydrophobicContact CB-CE2 3.83Å; F625-F636 HydrophobicContact CB-CZ 3.97Å; L626-F636 HydrophobicContact CB-CE2 4.48Å; L626-F636 HydrophobicContact CD2-CD2 3.57Å; L626-F636 HydrophobicContact CD2-CE2 3.47Å; L626-F636 VanDerWaalsContact CD2-CE2 3.47Å; L626-F636 HydrophobicContact CD2-CG 4.31Å; L626-F636 HydrophobicContact CD2-CZ 4.1Å; L626-F636 HydrophobicContact CG-CD2 3.98Å; L626-F636 HydrophobicContact CG-CE2 3.69Å; T629-F636 HydrophobicContact CG2-CE1 4.04Å; T629-F636 HydrophobicContact CG2-CZ 3.75Å; R633-F636 HydrophobicContact CG-CD1 4.32Å; R633-F636 HydrophobicContact CG-CE1 4.12Å; F636-M640 HydrophobicContact CB-CB 4.3Å; F636-M640 HydrophobicContact CB-SD 4.25Å; F636-M640 HydrophobicContact CD1-SD 3.76Å; F636-M640 HydrophobicContact CG-SD 4.36Å
637	P	95.8	Very high	94.4	Very high	38 Å²	38	46 Å²	46	25%	0.247	23%	0.226	C	C	.	.			trans	-68.7	160.8	176.1	29.9	-35.3	0	0	0	112.3	E639 M640	P637-E639 HydrophobicContact CB-CG 4.12Å; P637-E639 HydrophobicContact CG-CG 3.95Å; P637-E639 PolarHBondContact O-N 3.46Å; P637-E639 VanDerWaalsContact O-N 3.16Å; P637-M640 HydrophobicContact CG-CE 3.71Å; P637-M640 HydrophobicContact CG-CG 4.03Å; P637-M640 HydrophobicContact CG-SD 4Å; P637-M640 PolarHBondContact O-N 3.28Å
638	I	95.8	Very high	94.5	Very high	30 Å²	30	46.8 Å²	46.8	15%	0.154	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-60.6	-28.4	-175.7	67.1	177.4	0	0	0	113.4	M640 S641 W644 E692 L695	I638-M640 PolarHBondContact O-N 3.43Å; I638-S641 VanDerWaalsContact O-CB 3.28Å; I638-S641 WeakPolarHBondContact O-CB 3.27Å; I638-S641 PolarHBondContact O-N 2.85Å; I638-W644 HydrophobicContact CB-CG 4.23Å; I638-W644 HydrophobicContact CG1-CG 4.49Å; I638-E692 HydrophobicContact CG2-CG 3.81Å; I638-L695 HydrophobicContact CD1-CD2 4.09Å; I638-L695 HydrophobicContact CD1-CG 4.37Å; I638-L695 HydrophobicContact CG2-CD2 4.11Å
639	E	93.8	Very high	94.7	Very high	82 Å²	82	44.5 Å²	44.5	38%	0.383	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-67.4	-11.5	176.6	64.7	-163.6	163	0	0	114.1	R438 P637 I645	R438-E639 IonicContact CZ-OE2 3.18Å; R438-E639 IonicContact NH1-OE1 3.59Å; R438-E639 IonicContact NH1-OE2 3.88Å; R438-E639 PolarHBondContact NH1-OE2 2.95Å; R438-E639 IonicContact NH2-OE2 3.11Å; R438-E639 PolarHBondContact NH2-OE2 3.49Å; R438-E639 VanDerWaalsContact NH2-OE2 3.11Å; P637-E639 HydrophobicContact CB-CG 4.12Å; P637-E639 HydrophobicContact CG-CG 3.95Å; P637-E639 PolarHBondContact O-N 3.46Å; P637-E639 VanDerWaalsContact O-N 3.16Å; E639-I645 WeakPolarHBondContact O-CD1 3.44Å; E639-I645 VanDerWaalsContact O-CG1 3.29Å; E639-I645 WeakPolarHBondContact O-CG1 3.46Å
640	M	96.1	Very high	94.8	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.015	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-103.1	-4.2	172	-56.7	-176.6	-168.5	0	0	112.5	E431 Y433 E434 T437 F636 P637 I638	E431-M640 HydrophobicContact CG-CE 4.08Å; E431-M640 HydrophobicContact CG-SD 4.27Å; E431-M640 WeakPolarHBondContact OE1-CE 3.22Å; Y433-M640 HydrophobicContact CD1-CB 4.01Å; Y433-M640 HydrophobicContact CD1-SD 4.39Å; Y433-M640 HydrophobicContact CE1-CB 4.02Å; Y433-M640 WeakPolarHBondContact CE1-O 3.45Å; E434-M640 HydrophobicContact CB-CE 3.65Å; E434-M640 HydrophobicContact CB-CG 4.11Å; E434-M640 HydrophobicContact CB-SD 3.76Å; E434-M640 HydrophobicContact CG-CE 3.7Å; E434-M640 HydrophobicContact CG-CG 3.98Å; E434-M640 HydrophobicContact CG-SD 4.16Å; T437-M640 PolarHBondContact OG1-O 3.26Å; F636-M640 HydrophobicContact CB-CB 4.3Å; F636-M640 HydrophobicContact CB-SD 4.25Å; F636-M640 HydrophobicContact CD1-SD 3.76Å; F636-M640 HydrophobicContact CG-SD 4.36Å; P637-M640 HydrophobicContact CG-CE 3.71Å; P637-M640 HydrophobicContact CG-CG 4.03Å; P637-M640 HydrophobicContact CG-SD 4Å; P637-M640 PolarHBondContact O-N 3.28Å; I638-M640 PolarHBondContact O-N 3.43Å
641	S	96.5	Very high	95	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.178	C	C	.	.			trans	-85.6	123.9	-178.5	-170	0	0	0	0	111	I638 W644 I645 E692	I638-S641 VanDerWaalsContact O-CB 3.28Å; I638-S641 WeakPolarHBondContact O-CB 3.27Å; I638-S641 PolarHBondContact O-N 2.85Å; S641-W644 PolarHBondContact O-N 2.9Å; S641-I645 WeakPolarHBondContact O-CB 3.41Å; S641-I645 WeakPolarHBondContact O-CD1 3.41Å; S641-I645 VanDerWaalsContact O-CG1 3.23Å; S641-I645 WeakPolarHBondContact O-CG1 3.45Å; S641-I645 PolarHBondContact O-N 3.08Å; S641-E692 WeakPolarHBondContact CB-OE1 3.4Å; S641-E692 PolarHBondContact OG-OE1 3.44Å
642	M	95.1	Very high	95.2	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-58.9	-46.9	-175.2	-71	-60.1	-61.6	0	0	113.9	Y410 T437 Y441 L619 W644 I645 L646	Y410-M642 HydrophobicContact CD2-CE 4.46Å; Y410-M642 HydrophobicContact CD2-CG 4.23Å; Y410-M642 HydrophobicContact CE2-CG 3.66Å; Y410-M642 HydrophobicContact CE2-SD 4.34Å; T437-M642 HydrophobicContact CG2-CG 4.27Å; T437-M642 HydrophobicContact CG2-SD 3.94Å; Y441-M642 HydrophobicContact CD2-CE 4.16Å; Y441-M642 HydrophobicContact CD2-SD 4.4Å; Y441-M642 HydrophobicContact CE1-CE 4.49Å; Y441-M642 HydrophobicContact CE2-CE 3.54Å; Y441-M642 HydrophobicContact CE2-SD 3.74Å; L619-M642 HydrophobicContact CB-CB 4.21Å; L619-M642 WeakPolarHBondContact O-CB 3.15Å; M642-W644 VanDerWaalsContact C-N 3.28Å; M642-W644 PolarHBondContact O-N 2.89Å; M642-I645 PolarHBondContact O-N 3.24Å; M642-I645 HydrophobicContact SD-CD1 4.14Å; M642-L646 WeakPolarHBondContact O-CG 3.23Å; M642-L646 PolarHBondContact O-N 2.77Å; M642-L646 VanDerWaalsContact O-N 3.1Å
643	P	96.6	Very high	95.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-55.9	-42.1	176.8	-27.1	36.2	0	0	0	112.9	W620 T647 L668 Y669	W620-P643 HydrophobicContact CB-CG 4.23Å; P643-T647 WeakPolarHBondContact O-CB 3.45Å; P643-T647 PolarHBondContact O-N 2.94Å; P643-T647 VanDerWaalsContact O-N 3.12Å; P643-T647 PolarHBondContact O-OG1 3.41Å; P643-L668 HydrophobicContact CB-CB 4.16Å; P643-L668 HydrophobicContact CB-CD1 4.3Å; P643-L668 HydrophobicContact CG-CB 4.01Å; P643-L668 HydrophobicContact CG-CD1 4.3Å; P643-Y669 HydrophobicContact CB-CD1 4.39Å; P643-Y669 HydrophobicContact CB-CD2 4.21Å; P643-Y669 HydrophobicContact CB-CE1 3.97Å; P643-Y669 HydrophobicContact CB-CE2 3.75Å; P643-Y669 HydrophobicContact CG-CD1 4.49Å; P643-Y669 HydrophobicContact CG-CE1 4.2Å
644	W	97.3	Very high	95.5	Very high	6 Å²	6	33.3 Å²	33.3	2%	0.023	17%	0.167	C	C	.	.	H	α-helix	trans	-74.1	-40.7	178.4	-172.7	-116.5	0	0	0	113.1	I638 S641 M642 L646 T647 D648 L651 C696 Q699 F700	I638-W644 HydrophobicContact CB-CG 4.23Å; I638-W644 HydrophobicContact CG1-CG 4.49Å; S641-W644 PolarHBondContact O-N 2.9Å; M642-W644 VanDerWaalsContact C-N 3.28Å; M642-W644 PolarHBondContact O-N 2.89Å; W644-L646 PolarHBondContact O-N 3.23Å; W644-T647 HydrophobicContact CE3-CG2 4.3Å; W644-T647 HydrophobicContact CZ3-CG2 4.09Å; W644-T647 PolarHBondContact O-N 2.96Å; W644-D648 HydrophobicContact CD2-CB 4.08Å; W644-D648 HydrophobicContact CG-CB 4.46Å; W644-D648 HydrophobicContact CH2-CB 4.46Å; W644-D648 HydrophobicContact CZ2-CB 3.91Å; W644-D648 WeakPolarHBondContact CZ2-OD1 3.46Å; W644-D648 WeakPolarHBondContact O-CB 3.33Å; W644-D648 PolarHBondContact O-N 3.35Å; W644-L651 HydrophobicContact CH2-CD1 4.28Å; W644-C696 HydrophobicContact CD2-CB 3.99Å; W644-C696 VanDerWaalsContact CD2-SG 3.55Å; W644-C696 HydrophobicContact CE3-CB 3.49Å; W644-C696 VanDerWaalsContact CE3-CB 3.49Å; W644-C696 HydrophobicContact CH2-CB 4.38Å; W644-C696 VanDerWaalsContact CH2-O 3.28Å; W644-C696 WeakPolarHBondContact CH2-O 3.49Å; W644-C696 HydrophobicContact CZ3-CB 3.72Å; W644-C696 VanDerWaalsContact CZ3-O 3.27Å; W644-C696 WeakPolarHBondContact CZ3-O 3.34Å; W644-Q699 HydrophobicContact CH2-CB 3.75Å; W644-Q699 HydrophobicContact CZ2-CB 3.86Å; W644-F700 HydrophobicContact CZ3-CB 4.4Å
645	I	96.9	Very high	95.5	Very high	12 Å²	12	29.9 Å²	29.9	6%	0.062	15%	0.147	C	C	.	.	H	α-helix	trans	-54.7	-43.7	176.1	-71.3	161.7	0	0	0	110.6	R438 K446 E639 S641 M642 H649	R438-I645 HydrophobicContact CB-CD1 4.23Å; K446-I645 HydrophobicContact CD-CG2 4.23Å; E639-I645 WeakPolarHBondContact O-CD1 3.44Å; E639-I645 VanDerWaalsContact O-CG1 3.29Å; E639-I645 WeakPolarHBondContact O-CG1 3.46Å; S641-I645 WeakPolarHBondContact O-CB 3.41Å; S641-I645 WeakPolarHBondContact O-CD1 3.41Å; S641-I645 VanDerWaalsContact O-CG1 3.23Å; S641-I645 WeakPolarHBondContact O-CG1 3.45Å; S641-I645 PolarHBondContact O-N 3.08Å; M642-I645 PolarHBondContact O-N 3.24Å; M642-I645 HydrophobicContact SD-CD1 4.14Å; I645-H649 WeakPolarHBondContact O-CB 3.24Å; I645-H649 PolarHBondContact O-N 3.41Å
646	L	96.8	Very high	95.3	Very high	2 Å²	2	30 Å²	30	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-70.5	-44	179.7	-64.7	177.9	0	0	0	111.9	K446 L449 V450 I453 M642 W644 P665 L668	K446-L646 HydrophobicContact CB-CD2 4.03Å; K446-L646 HydrophobicContact CG-CD2 4.25Å; L449-L646 HydrophobicContact CB-CD2 4.21Å; L449-L646 HydrophobicContact CD1-CD2 4.29Å; V450-L646 HydrophobicContact CG2-CB 3.83Å; V450-L646 HydrophobicContact CG2-CD2 4.23Å; V450-L646 HydrophobicContact CG2-CG 4.4Å; I453-L646 HydrophobicContact CD1-CD1 3.86Å; M642-L646 WeakPolarHBondContact O-CG 3.23Å; M642-L646 PolarHBondContact O-N 2.77Å; M642-L646 VanDerWaalsContact O-N 3.1Å; W644-L646 PolarHBondContact O-N 3.23Å; L646-P665 HydrophobicContact CB-CB 4.04Å; L646-P665 HydrophobicContact CB-CG 4.44Å; L646-L668 HydrophobicContact CD1-CD1 4.4Å
647	T	96.3	Very high	95.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.6	-52	-179.9	-53.8	0	0	0	0	111.7	P643 W644 H649 I650 L651 V662 L666 F700	P643-T647 WeakPolarHBondContact O-CB 3.45Å; P643-T647 PolarHBondContact O-N 2.94Å; P643-T647 VanDerWaalsContact O-N 3.12Å; P643-T647 PolarHBondContact O-OG1 3.41Å; W644-T647 HydrophobicContact CE3-CG2 4.3Å; W644-T647 HydrophobicContact CZ3-CG2 4.09Å; W644-T647 PolarHBondContact O-N 2.96Å; T647-H649 VanDerWaalsContact C-N 3.27Å; T647-H649 PolarHBondContact O-N 3.08Å; T647-I650 PolarHBondContact O-N 3.11Å; T647-L651 HydrophobicContact CG2-CD1 4.42Å; T647-L651 PolarHBondContact O-N 2.92Å; T647-V662 HydrophobicContact CG2-CG2 3.93Å; T647-L666 HydrophobicContact CG2-CD1 3.94Å; T647-F700 HydrophobicContact CG2-CD2 3.91Å; T647-F700 HydrophobicContact CG2-CE2 4.33Å
648	D	96.4	Very high	95	Very high	37 Å²	37	31.3 Å²	31.3	20%	0.198	16%	0.162	C	C	.	.	H	α-helix	trans	-65.3	-32.7	-175.2	-166.5	49.6	0	0	0	111.8	W644 I650 L651 E652 K703	W644-D648 HydrophobicContact CD2-CB 4.08Å; W644-D648 HydrophobicContact CG-CB 4.46Å; W644-D648 HydrophobicContact CH2-CB 4.46Å; W644-D648 HydrophobicContact CZ2-CB 3.91Å; W644-D648 WeakPolarHBondContact CZ2-OD1 3.46Å; W644-D648 WeakPolarHBondContact O-CB 3.33Å; W644-D648 PolarHBondContact O-N 3.35Å; D648-I650 VanDerWaalsContact C-N 3.3Å; D648-I650 PolarHBondContact O-N 3.06Å; D648-L651 PolarHBondContact O-N 2.85Å; D648-E652 VanDerWaalsContact O-CB 3.32Å; D648-E652 WeakPolarHBondContact O-CB 3.47Å; D648-E652 PolarHBondContact O-N 3.45Å; D648-K703 WeakPolarHBondContact OD1-CE 3.1Å; D648-K703 IonicContact OD1-NZ 3.6Å; D648-K703 PolarHBondContact OD1-NZ 2.99Å; D648-K703 IonicContact OD2-NZ 2.61Å; D648-K703 PolarHBondContact OD2-NZ 2.85Å
649	H	96.6	Very high	94.9	Very high	27 Å²	27	29.9 Å²	29.9	13%	0.125	16%	0.155	C	C	.	.	H	α-helix	trans	-60.3	-39.1	175.9	-174.1	73.9	0	0	0	112.2	S443 K446 F447 I645 T647 T653	S443-H649 PolarHBondContact OG-CE1 2.95Å; S443-H649 VanDerWaalsContact OG-CE1 3.25Å; S443-H649 PolarHBondContact OG-NE2 3.11Å; K446-H649 HydrophobicContact CD-CB 3.96Å; F447-H649 AromaticContact CD1-CD2 3.84Å; F447-H649 AromaticContact CE1-CD2 3.38Å; F447-H649 WeakPolarHBondContact CE1-CD2 3.32Å; F447-H649 AromaticContact CE1-NE2 3.62Å; F447-H649 AromaticContact CE2-NE2 3.77Å; F447-H649 AromaticContact CZ-CD2 3.68Å; F447-H649 AromaticContact CZ-NE2 3.4Å; F447-H649 WeakPolarHBondContact CZ-NE2 3.28Å; I645-H649 WeakPolarHBondContact O-CB 3.24Å; I645-H649 PolarHBondContact O-N 3.41Å; T647-H649 VanDerWaalsContact C-N 3.27Å; T647-H649 PolarHBondContact O-N 3.08Å; H649-T653 WeakPolarHBondContact O-CB 3.38Å; H649-T653 VanDerWaalsContact O-CG2 3.28Å; H649-T653 WeakPolarHBondContact O-CG2 3.5Å; H649-T653 PolarHBondContact O-N 3.45Å; H649-T653 PolarHBondContact O-OG1 3.35Å
650	I	96.1	Very high	94.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.2	-42.3	175.5	-62.7	170.6	0	0	0	110.7	F447 V450 T647 D648 E652 T653 K654 M658 M659 V662	F447-I650 HydrophobicContact CD1-CG1 4.39Å; F447-I650 HydrophobicContact CE1-CG1 4.17Å; V450-I650 HydrophobicContact CB-CD1 4.35Å; V450-I650 HydrophobicContact CG1-CD1 3.81Å; V450-I650 HydrophobicContact CG2-CD1 4.11Å; T647-I650 PolarHBondContact O-N 3.11Å; D648-I650 VanDerWaalsContact C-N 3.3Å; D648-I650 PolarHBondContact O-N 3.06Å; I650-E652 PolarHBondContact O-N 3.44Å; I650-T653 PolarHBondContact O-OG1 3.08Å; I650-K654 WeakPolarHBondContact O-CA 3.29Å; I650-K654 PolarHBondContact O-N 3.12Å; I650-M658 HydrophobicContact CD1-CB 4.13Å; I650-M658 HydrophobicContact CG1-CB 4.04Å; I650-M658 HydrophobicContact CG2-CB 4.06Å; I650-M659 HydrophobicContact CG2-CE 4.34Å; I650-V662 HydrophobicContact CB-CG2 4.02Å; I650-V662 HydrophobicContact CD1-CB 4.29Å; I650-V662 HydrophobicContact CD1-CG2 4.27Å; I650-V662 HydrophobicContact CG2-CB 4.09Å; I650-V662 HydrophobicContact CG2-CG2 4Å
651	L	94.7	Very high	94.7	Very high	3 Å²	3	32 Å²	32	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-66.6	-36.3	179.7	-63.4	175.4	0	0	0	112.7	W644 T647 D648 V662 F700 K703 L704	W644-L651 HydrophobicContact CH2-CD1 4.28Å; T647-L651 HydrophobicContact CG2-CD1 4.42Å; T647-L651 PolarHBondContact O-N 2.92Å; D648-L651 PolarHBondContact O-N 2.85Å; L651-V662 HydrophobicContact CD2-CG2 4.25Å; L651-V662 HydrophobicContact CG-CG2 4.37Å; L651-F700 HydrophobicContact CD1-CB 4.33Å; L651-F700 HydrophobicContact CD1-CD2 3.78Å; L651-F700 HydrophobicContact CD1-CG 4.39Å; L651-F700 HydrophobicContact CD2-CD2 4.22Å; L651-F700 HydrophobicContact CD2-CE2 4.22Å; L651-F700 HydrophobicContact CG-CD2 4.45Å; L651-K703 HydrophobicContact CB-CB 4.3Å; L651-K703 HydrophobicContact CB-CD 4.12Å; L651-K703 HydrophobicContact CD1-CB 4.29Å; L651-K703 HydrophobicContact CD1-CD 4.37Å; L651-L704 HydrophobicContact CD2-CB 4.4Å
652	E	94.8	Very high	94.6	Very high	118 Å²	118	32 Å²	32	55%	0.551	16%	0.162	S	C	*	.	H	α-helix	trans	-78.4	-43.1	-178	-163.5	62.6	-145.1	0	0	111.7	D648 I650 K703	D648-E652 VanDerWaalsContact O-CB 3.32Å; D648-E652 WeakPolarHBondContact O-CB 3.47Å; D648-E652 PolarHBondContact O-N 3.45Å; I650-E652 PolarHBondContact O-N 3.44Å; E652-K703 IonicContact OE2-NZ 3.3Å; E652-K703 PolarHBondContact OE2-NZ 2.98Å
653	T	94.3	Very high	94.5	Very high	60 Å²	60	32.1 Å²	32.1	37%	0.368	16%	0.162	S	C	.	.	H	α-helix	trans	-75.6	-25.1	178	57.6	0	0	0	0	113	F447 H649 I650 E655	F447-T653 HydrophobicContact CZ-CG2 4.19Å; F447-T653 WeakPolarHBondContact CZ-OG1 3.44Å; H649-T653 WeakPolarHBondContact O-CB 3.38Å; H649-T653 VanDerWaalsContact O-CG2 3.28Å; H649-T653 WeakPolarHBondContact O-CG2 3.5Å; H649-T653 PolarHBondContact O-N 3.45Å; H649-T653 PolarHBondContact O-OG1 3.35Å; I650-T653 PolarHBondContact O-OG1 3.08Å; T653-E655 PolarHBondContact O-N 3.3Å
654	K	94.5	Very high	94.3	Very high	96 Å²	96	33.2 Å²	33.2	42%	0.417	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	31.5	-178.5	-44.6	-177.9	-177.1	-178	0	112.4	I650 P656 Q707 N742	I650-K654 WeakPolarHBondContact O-CA 3.29Å; I650-K654 PolarHBondContact O-N 3.12Å; K654-P656 VanDerWaalsContact O-CD 3.27Å; K654-P656 WeakPolarHBondContact O-CD 3.37Å; K654-Q707 HydrophobicContact CD-CB 4.27Å; K654-N742 PolarHBondContact O-ND2 3.16Å
655	E	91.6	Very high	94.1	Very high	64 Å²	64	33 Å²	33	30%	0.299	17%	0.166	S	C	.	.			trans	-63.7	115.4	-172	177.1	47.2	-131.2	0	0	111.5	F447 T653 S657 M658 M659	F447-E655 HydrophobicContact CE1-CB 4.03Å; F447-E655 HydrophobicContact CE1-CG 4.28Å; F447-E655 HydrophobicContact CE2-CG 4.32Å; F447-E655 HydrophobicContact CZ-CB 3.75Å; F447-E655 HydrophobicContact CZ-CG 3.97Å; T653-E655 PolarHBondContact O-N 3.3Å; E655-S657 VanDerWaalsContact C-N 3.28Å; E655-S657 WeakPolarHBondContact CG-OG 3.21Å; E655-S657 PolarHBondContact O-N 3.41Å; E655-S657 WeakPolarHBondContact OE1-CB 3.24Å; E655-S657 PolarHBondContact OE1-N 2.88Å; E655-S657 PolarHBondContact OE1-OG 2.77Å; E655-M658 HydrophobicContact CB-CB 4.19Å; E655-M658 HydrophobicContact CB-CG 4.32Å; E655-M658 HydrophobicContact CG-CB 4.04Å; E655-M658 HydrophobicContact CG-CG 3.72Å; E655-M658 PolarHBondContact O-N 3.31Å; E655-M658 VanDerWaalsContact O-N 3.13Å; E655-M659 PolarHBondContact O-N 3.34Å
656	P	91.1	Very high	93.9	Very high	39 Å²	39	32.6 Å²	32.6	25%	0.253	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-35	-176	-29.6	38	0	0	0	114.9	K654 M658 S741	K654-P656 VanDerWaalsContact O-CD 3.27Å; K654-P656 WeakPolarHBondContact O-CD 3.37Å; P656-M658 VanDerWaalsContact C-N 3.28Å; P656-M658 PolarHBondContact O-N 3.18Å; P656-S741 WeakPolarHBondContact CB-O 3.43Å; P656-S741 WeakPolarHBondContact CG-O 3.39Å
657	S	91.7	Very high	93.6	Very high	67 Å²	67	33 Å²	33	47%	0.469	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-23.5	-179.2	59	0	0	0	0	113.1	E655 Y661	E655-S657 VanDerWaalsContact C-N 3.28Å; E655-S657 WeakPolarHBondContact CG-OG 3.21Å; E655-S657 PolarHBondContact O-N 3.41Å; E655-S657 WeakPolarHBondContact OE1-CB 3.24Å; E655-S657 PolarHBondContact OE1-N 2.88Å; E655-S657 PolarHBondContact OE1-OG 2.77Å; S657-Y661 WeakPolarHBondContact O-CD2 3.49Å; S657-Y661 VanDerWaalsContact O-CE2 3.24Å; S657-Y661 WeakPolarHBondContact O-CE2 3.44Å
658	M	92.8	Very high	93.4	Very high	9 Å²	9	33 Å²	33	4%	0.044	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-10.8	-173.2	-63.5	-68.1	164.4	0	0	113.5	F447 E451 I650 E655 P656 E660 Y661 V662	F447-M658 HydrophobicContact CB-CE 3.67Å; F447-M658 HydrophobicContact CB-CG 4.43Å; F447-M658 HydrophobicContact CB-SD 4.16Å; F447-M658 HydrophobicContact CD1-CB 4.28Å; F447-M658 HydrophobicContact CD1-CG 3.57Å; F447-M658 HydrophobicContact CD1-SD 4.21Å; F447-M658 HydrophobicContact CE1-CB 4.35Å; F447-M658 HydrophobicContact CE1-CG 3.96Å; F447-M658 HydrophobicContact CG-CE 4.2Å; F447-M658 HydrophobicContact CG-CG 4.08Å; F447-M658 HydrophobicContact CG-SD 4.44Å; E451-M658 HydrophobicContact CG-CE 3.68Å; E451-M658 HydrophobicContact CG-SD 3.93Å; E451-M658 WeakPolarHBondContact OE1-CE 3.27Å; I650-M658 HydrophobicContact CD1-CB 4.13Å; I650-M658 HydrophobicContact CG1-CB 4.04Å; I650-M658 HydrophobicContact CG2-CB 4.06Å; E655-M658 HydrophobicContact CB-CB 4.19Å; E655-M658 HydrophobicContact CB-CG 4.32Å; E655-M658 HydrophobicContact CG-CB 4.04Å; E655-M658 HydrophobicContact CG-CG 3.72Å; E655-M658 PolarHBondContact O-N 3.31Å; E655-M658 VanDerWaalsContact O-N 3.13Å; P656-M658 VanDerWaalsContact C-N 3.28Å; P656-M658 PolarHBondContact O-N 3.18Å; M658-E660 VanDerWaalsContact C-N 3.26Å; M658-E660 PolarHBondContact O-N 3.19Å; M658-Y661 WeakPolarHBondContact O-CA 3.01Å; M658-Y661 WeakPolarHBondContact O-CB 3.18Å; M658-Y661 PolarHBondContact O-N 3.08Å; M658-Y661 HydrophobicContact SD-CD2 4.44Å; M658-V662 PolarHBondContact O-N 3.32Å
659	M	92.9	Very high	93.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-62.1	-32.4	-174.8	-164.4	58.5	60.6	0	0	113	I650 E655 Y661 V662 L704 R743 Y744 L747	I650-M659 HydrophobicContact CG2-CE 4.34Å; E655-M659 PolarHBondContact O-N 3.34Å; M659-Y661 PolarHBondContact O-N 3.21Å; M659-V662 WeakPolarHBondContact O-CG1 3.47Å; M659-L704 HydrophobicContact SD-CD1 4.22Å; M659-R743 HydrophobicContact CB-CB 4.5Å; M659-Y744 HydrophobicContact CE-CD1 4.41Å; M659-Y744 HydrophobicContact CE-CE1 3.56Å; M659-Y744 HydrophobicContact CG-CD1 3.64Å; M659-Y744 HydrophobicContact CG-CE1 3.76Å; M659-Y744 HydrophobicContact SD-CD1 3.88Å; M659-Y744 HydrophobicContact SD-CE1 3.56Å; M659-Y744 VanDerWaalsContact SD-CE1 3.56Å; M659-L747 HydrophobicContact CG-CD1 3.73Å; M659-L747 HydrophobicContact SD-CD1 3.74Å
660	E	92.4	Very high	93.1	Very high	51 Å²	51	30.6 Å²	30.6	24%	0.238	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-73.5	-13	175.4	-57.4	-170.8	172.9	0	0	112.9	M658 R743 T746	M658-E660 VanDerWaalsContact C-N 3.26Å; M658-E660 PolarHBondContact O-N 3.19Å; E660-R743 HydrophobicContact CG-CB 3.92Å; E660-R743 IonicContact OE1-CZ 3.72Å; E660-R743 VanDerWaalsContact OE1-CZ 3.22Å; E660-R743 IonicContact OE1-NE 3.82Å; E660-R743 PolarHBondContact OE1-NE 3.05Å; E660-R743 IonicContact OE1-NH2 3.33Å; E660-R743 PolarHBondContact OE1-NH2 3.41Å; E660-T746 HydrophobicContact CG-CG2 4.28Å
661	Y	93.6	Very high	92.8	Very high	78 Å²	78	31.7 Å²	31.7	31%	0.306	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-98.2	-10.5	-176.1	-63.1	-93.3	0	0	0	113.6	A454 S657 M658 M659 L663 Y664 P665	A454-Y661 HydrophobicContact CB-CD1 3.34Å; A454-Y661 HydrophobicContact CB-CE1 3.9Å; A454-Y661 HydrophobicContact CB-CG 4.45Å; S657-Y661 WeakPolarHBondContact O-CD2 3.49Å; S657-Y661 VanDerWaalsContact O-CE2 3.24Å; S657-Y661 WeakPolarHBondContact O-CE2 3.44Å; M658-Y661 WeakPolarHBondContact O-CA 3.01Å; M658-Y661 WeakPolarHBondContact O-CB 3.18Å; M658-Y661 PolarHBondContact O-N 3.08Å; M658-Y661 HydrophobicContact SD-CD2 4.44Å; M659-Y661 PolarHBondContact O-N 3.21Å; Y661-L663 PolarHBondContact O-N 2.66Å; Y661-L663 VanDerWaalsContact O-N 3.08Å; Y661-Y664 HydrophobicContact CD1-CD2 4.48Å; Y661-Y664 WeakPolarHBondContact O-CD2 3.44Å; Y661-Y664 PolarHBondContact O-N 2.8Å; Y661-Y664 VanDerWaalsContact O-N 3.11Å; Y661-P665 WeakPolarHBondContact O-CD 3.47Å
662	V	94.3	Very high	92.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-20	-168	75	0	0	0	0	114.6	T647 I650 L651 M658 M659 F700 L747	T647-V662 HydrophobicContact CG2-CG2 3.93Å; I650-V662 HydrophobicContact CB-CG2 4.02Å; I650-V662 HydrophobicContact CD1-CB 4.29Å; I650-V662 HydrophobicContact CD1-CG2 4.27Å; I650-V662 HydrophobicContact CG2-CB 4.09Å; I650-V662 HydrophobicContact CG2-CG2 4Å; L651-V662 HydrophobicContact CD2-CG2 4.25Å; L651-V662 HydrophobicContact CG-CG2 4.37Å; M658-V662 PolarHBondContact O-N 3.32Å; M659-V662 WeakPolarHBondContact O-CG1 3.47Å; V662-F700 HydrophobicContact CB-CE2 4.48Å; V662-F700 HydrophobicContact CG1-CE2 3.87Å; V662-F700 HydrophobicContact CG1-CZ 4.07Å; V662-F700 HydrophobicContact CG2-CE2 3.84Å; V662-L747 HydrophobicContact CG1-CD1 3.89Å; V662-L747 HydrophobicContact CG1-CD2 3.75Å; V662-L747 HydrophobicContact CG1-CG 4.46Å
663	L	93.3	Very high	92.6	Very high	6 Å²	6	26 Å²	26	3%	0.031	13%	0.134	C	C	.	.	H	α-helix	trans	-80	-26.2	177.8	-62.5	178.8	0	0	0	113	I29 E30 Y661 L666 D667 F700 L747 Q750 L762	I29-L663 HydrophobicContact CD1-CD1 3.7Å; I29-L663 HydrophobicContact CG1-CD1 4.13Å; E30-L663 HydrophobicContact CG-CB 4.29Å; E30-L663 HydrophobicContact CG-CD1 3.88Å; E30-L663 WeakPolarHBondContact OE1-CD1 3.37Å; Y661-L663 PolarHBondContact O-N 2.66Å; Y661-L663 VanDerWaalsContact O-N 3.08Å; L663-L666 WeakPolarHBondContact O-CB 3.39Å; L663-L666 PolarHBondContact O-N 3.38Å; L663-D667 PolarHBondContact O-N 3.27Å; L663-F700 HydrophobicContact CD2-CE1 4.29Å; L663-F700 HydrophobicContact CD2-CE2 4.37Å; L663-F700 HydrophobicContact CD2-CZ 3.68Å; L663-L747 HydrophobicContact CD1-CD2 3.81Å; L663-L747 HydrophobicContact CD2-CD2 4.31Å; L663-L747 HydrophobicContact CG-CD2 3.8Å; L663-Q750 HydrophobicContact CD1-CG 3.86Å; L663-L762 HydrophobicContact CD2-CD2 4.49Å
664	Y	92	Very high	92.4	Very high	23 Å²	23	27.8 Å²	27.8	9%	0.09	13%	0.134	C	C	.	.	H	α-helix	trans	-67.9	-39.8	-179.7	-61.2	-79	0	0	0	113.9	I29 A454 K457 Y661 L666 D667	I29-Y664 WeakPolarHBondContact CA-OH 3.39Å; A454-Y664 HydrophobicContact CB-CD1 4.26Å; A454-Y664 HydrophobicContact CB-CD2 3.31Å; A454-Y664 HydrophobicContact CB-CE2 3.74Å; A454-Y664 HydrophobicContact CB-CG 3.6Å; K457-Y664 HydrophobicContact CB-CD1 3.69Å; K457-Y664 HydrophobicContact CB-CE1 4.15Å; K457-Y664 HydrophobicContact CD-CD1 4.3Å; Y661-Y664 HydrophobicContact CD1-CD2 4.48Å; Y661-Y664 WeakPolarHBondContact O-CD2 3.44Å; Y661-Y664 PolarHBondContact O-N 2.8Å; Y661-Y664 VanDerWaalsContact O-N 3.11Å; Y664-L666 VanDerWaalsContact C-N 3.29Å; Y664-L666 PolarHBondContact O-N 3.29Å; Y664-D667 WeakPolarHBondContact O-CB 3.46Å; Y664-D667 PolarHBondContact O-N 3.24Å
665	P	93.3	Very high	92.3	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.7	-31.8	171.1	-24.7	36	0	0	0	113	V450 L646 Y661 D667 L668	V450-P665 HydrophobicContact CB-CG 4.12Å; V450-P665 HydrophobicContact CG1-CG 3.54Å; V450-P665 HydrophobicContact CG2-CG 3.6Å; L646-P665 HydrophobicContact CB-CB 4.04Å; L646-P665 HydrophobicContact CB-CG 4.44Å; Y661-P665 WeakPolarHBondContact O-CD 3.47Å; P665-D667 VanDerWaalsContact C-N 3.27Å; P665-D667 PolarHBondContact O-N 3.27Å; P665-L668 VanDerWaalsContact O-CB 3.27Å; P665-L668 WeakPolarHBondContact O-CB 3.39Å; P665-L668 WeakPolarHBondContact O-CD1 3.33Å; P665-L668 VanDerWaalsContact O-CG 3.27Å; P665-L668 WeakPolarHBondContact O-CG 3.46Å; P665-L668 PolarHBondContact O-N 3.05Å
666	L	91.9	Very high	92.3	Very high	4 Å²	4	22 Å²	22	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-68.6	-30.9	176.5	-154.5	114.3	0	0	0	111.2	T647 L663 Y664 L668 Y669 F697 F700 L755	T647-L666 HydrophobicContact CG2-CD1 3.94Å; L663-L666 WeakPolarHBondContact O-CB 3.39Å; L663-L666 PolarHBondContact O-N 3.38Å; Y664-L666 VanDerWaalsContact C-N 3.29Å; Y664-L666 PolarHBondContact O-N 3.29Å; L666-L668 PolarHBondContact O-N 3.3Å; L666-Y669 VanDerWaalsContact O-CD2 3.24Å; L666-Y669 WeakPolarHBondContact O-CD2 3.4Å; L666-Y669 PolarHBondContact O-N 2.82Å; L666-F697 HydrophobicContact CD2-CD2 4.04Å; L666-F697 HydrophobicContact CD2-CE2 4.35Å; L666-F700 HydrophobicContact CD1-CD2 4.02Å; L666-F700 HydrophobicContact CD1-CG 4.34Å; L666-L755 HydrophobicContact CD2-CD1 3.91Å; L666-L755 HydrophobicContact CD2-CD2 3.43Å; L666-L755 VanDerWaalsContact CD2-CD2 3.43Å; L666-L755 HydrophobicContact CD2-CG 4.28Å
667	D	90.4	Very high	92.2	Very high	11 Å²	11	24.3 Å²	24.3	6%	0.059	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-16.4	173.6	-175.9	71.3	0	0	0	114	P31 K457 L663 Y664 P665 Y669 N670 D671	P31-D667 HydrophobicContact CG-CB 3.48Å; P31-D667 VanDerWaalsContact CG-CB 3.48Å; P31-D667 VanDerWaalsContact CG-OD1 3.25Å; P31-D667 WeakPolarHBondContact CG-OD1 3.29Å; P31-D667 WeakPolarHBondContact CG-OD2 3.37Å; K457-D667 HydrophobicContact CD-CB 4.25Å; K457-D667 WeakPolarHBondContact CD-OD2 3.2Å; K457-D667 WeakPolarHBondContact CE-OD2 3.2Å; K457-D667 IonicContact NZ-OD2 3.95Å; K457-D667 PolarHBondContact NZ-OD2 3.1Å; L663-D667 PolarHBondContact O-N 3.27Å; Y664-D667 WeakPolarHBondContact O-CB 3.46Å; Y664-D667 PolarHBondContact O-N 3.24Å; P665-D667 VanDerWaalsContact C-N 3.27Å; P665-D667 PolarHBondContact O-N 3.27Å; D667-Y669 PolarHBondContact O-N 3.05Å; D667-Y669 VanDerWaalsContact O-N 3.08Å; D667-N670 WeakPolarHBondContact O-CA 3.49Å; D667-N670 VanDerWaalsContact O-CB 3.26Å; D667-N670 WeakPolarHBondContact O-CB 3.37Å; D667-N670 PolarHBondContact O-N 3.17Å; D667-N670 WeakPolarHBondContact OD1-CB 3.5Å; D667-N670 PolarHBondContact OD1-ND2 2.91Å; D667-D671 PolarHBondContact O-N 2.85Å
668	L	93.6	Very high	92	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-58.1	-26.5	173.1	-61.4	171.6	0	0	0	112	I453 L616 L619 P643 L646 P665 L666 N670 D671 S672	I453-L668 HydrophobicContact CD1-CD1 4.14Å; I453-L668 HydrophobicContact CG2-CD2 4.03Å; L616-L668 HydrophobicContact CB-CD2 3.72Å; L616-L668 HydrophobicContact CD1-CD2 4Å; L619-L668 HydrophobicContact CD1-CD1 3.89Å; L619-L668 HydrophobicContact CD1-CD2 4.16Å; P643-L668 HydrophobicContact CB-CB 4.16Å; P643-L668 HydrophobicContact CB-CD1 4.3Å; P643-L668 HydrophobicContact CG-CB 4.01Å; P643-L668 HydrophobicContact CG-CD1 4.3Å; L646-L668 HydrophobicContact CD1-CD1 4.4Å; P665-L668 VanDerWaalsContact O-CB 3.27Å; P665-L668 WeakPolarHBondContact O-CB 3.39Å; P665-L668 WeakPolarHBondContact O-CD1 3.33Å; P665-L668 VanDerWaalsContact O-CG 3.27Å; P665-L668 WeakPolarHBondContact O-CG 3.46Å; P665-L668 PolarHBondContact O-N 3.05Å; L666-L668 PolarHBondContact O-N 3.3Å; L668-N670 VanDerWaalsContact C-N 3.29Å; L668-N670 PolarHBondContact O-N 2.86Å; L668-D671 PolarHBondContact O-N 3.08Å; L668-S672 PolarHBondContact O-N 3.25Å; L668-S672 PolarHBondContact O-OG 2.83Å
669	Y	94.6	Very high	91.8	Very high	1 Å²	1	27.9 Å²	27.9	0%	0.004	13%	0.128	C	C	.	.	H	α-helix	trans	-66.3	-29.9	172.4	-67.8	-66.7	0	0	0	112.9	W620 P643 L666 D667 G673 I689 E692 V693 L756	W620-Y669 AromaticContact CD1-CE1 3.65Å; W620-Y669 AromaticContact NE1-CE1 3.88Å; P643-Y669 HydrophobicContact CB-CD1 4.39Å; P643-Y669 HydrophobicContact CB-CD2 4.21Å; P643-Y669 HydrophobicContact CB-CE1 3.97Å; P643-Y669 HydrophobicContact CB-CE2 3.75Å; P643-Y669 HydrophobicContact CG-CD1 4.49Å; P643-Y669 HydrophobicContact CG-CE1 4.2Å; L666-Y669 VanDerWaalsContact O-CD2 3.24Å; L666-Y669 WeakPolarHBondContact O-CD2 3.4Å; L666-Y669 PolarHBondContact O-N 2.82Å; D667-Y669 PolarHBondContact O-N 3.05Å; D667-Y669 VanDerWaalsContact O-N 3.08Å; Y669-G673 PolarHBondContact O-N 3.28Å; Y669-I689 HydrophobicContact CD1-CG2 4.21Å; Y669-E692 HydrophobicContact CE1-CG 4.19Å; Y669-E692 WeakPolarHBondContact CE1-OE1 3.22Å; Y669-E692 PolarHBondContact OH-OE1 2.85Å; Y669-V693 VanDerWaalsContact CB-CG2 3.49Å; Y669-V693 HydrophobicContact CD1-CG2 3.6Å; Y669-V693 HydrophobicContact CD2-CG2 3.59Å; Y669-V693 HydrophobicContact CE1-CG2 4.14Å; Y669-V693 HydrophobicContact CE2-CG2 4.14Å; Y669-V693 HydrophobicContact CG-CG2 3.28Å; Y669-L756 WeakPolarHBondContact O-CD2 3.5Å
670	N	91.1	Very high	91.8	Very high	12 Å²	12	28 Å²	28	6%	0.064	13%	0.129	C	C	.	.	H	α-helix	trans	-66.7	-45.5	172.5	-72.5	-32.9	0	0	0	110.8	D667 L668 S672 G673 Y674 Q754 L756	D667-N670 WeakPolarHBondContact O-CA 3.49Å; D667-N670 VanDerWaalsContact O-CB 3.26Å; D667-N670 WeakPolarHBondContact O-CB 3.37Å; D667-N670 PolarHBondContact O-N 3.17Å; D667-N670 WeakPolarHBondContact OD1-CB 3.5Å; D667-N670 PolarHBondContact OD1-ND2 2.91Å; L668-N670 VanDerWaalsContact C-N 3.29Å; L668-N670 PolarHBondContact O-N 2.86Å; N670-S672 PolarHBondContact O-N 3.34Å; N670-G673 PolarHBondContact O-N 3.16Å; N670-Y674 VanDerWaalsContact O-CB 3.31Å; N670-Y674 WeakPolarHBondContact O-CB 3.3Å; N670-Y674 PolarHBondContact O-N 2.99Å; N670-Q754 PolarHBondContact ND2-O 3.4Å; N670-L756 WeakPolarHBondContact OD1-CA 3.47Å; N670-L756 PolarHBondContact OD1-N 2.85Å
671	D	90.9	Very high	91.8	Very high	24 Å²	24	32.2 Å²	32.2	13%	0.128	15%	0.147	C	C	.	.	H	α-helix	trans	-57.4	-50.3	176.3	-60.4	-13.6	0	0	0	110.6	K457 D667 L668 Y675	K457-D671 IonicContact NZ-OD1 2.85Å; K457-D671 PolarHBondContact NZ-OD1 2.84Å; K457-D671 IonicContact NZ-OD2 2.7Å; K457-D671 PolarHBondContact NZ-OD2 3.19Å; D667-D671 PolarHBondContact O-N 2.85Å; L668-D671 PolarHBondContact O-N 3.08Å; D671-Y675 VanDerWaalsContact O-CB 3.32Å; D671-Y675 WeakPolarHBondContact O-CB 3.32Å; D671-Y675 PolarHBondContact O-N 2.99Å
672	S	93.3	Very high	91.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.8	-40	178.7	-57.4	0	0	0	0	112.4	S617 W620 F621 L668 N670 Y675 A676	S617-S672 PolarHBondContact O-OG 3.44Å; W620-S672 VanDerWaalsContact CB-OG 3.29Å; W620-S672 WeakPolarHBondContact CB-OG 3.39Å; F621-S672 WeakPolarHBondContact CZ-O 3.35Å; L668-S672 PolarHBondContact O-N 3.25Å; L668-S672 PolarHBondContact O-OG 2.83Å; N670-S672 PolarHBondContact O-N 3.34Å; S672-Y675 PolarHBondContact O-N 3.06Å; S672-A676 VanDerWaalsContact O-CB 3.32Å; S672-A676 WeakPolarHBondContact O-CB 3.42Å; S672-A676 PolarHBondContact O-N 2.8Å
673	G	91.9	Very high	91.8	Very high	2 Å²	2	39.2 Å²	39.2	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-64	-45.8	177.6	0	0	0	0	0	112.1	Y669 N670 A676 L677	Y669-G673 PolarHBondContact O-N 3.28Å; N670-G673 PolarHBondContact O-N 3.16Å; G673-A676 PolarHBondContact O-N 2.97Å; G673-L677 WeakPolarHBondContact O-CG 3.41Å; G673-L677 PolarHBondContact O-N 3.26Å; G673-L677 VanDerWaalsContact O-N 3.13Å
674	Y	89.6	Confident	91.9	Very high	96 Å²	96	42 Å²	42	38%	0.376	19%	0.193	S	C	.	.	H	α-helix	trans	-61.2	-44.4	174.7	178	-102.4	0	0	0	111.6	N670 L677 T678	N670-Y674 VanDerWaalsContact O-CB 3.31Å; N670-Y674 WeakPolarHBondContact O-CB 3.3Å; N670-Y674 PolarHBondContact O-N 2.99Å; Y674-L677 PolarHBondContact O-N 3.46Å; Y674-T678 HydrophobicContact CD2-CG2 3.89Å; Y674-T678 HydrophobicContact CE1-CG2 4.46Å; Y674-T678 HydrophobicContact CE2-CG2 3.53Å; Y674-T678 HydrophobicContact CG-CG2 4.49Å; Y674-T678 WeakPolarHBondContact O-CB 3.36Å; Y674-T678 PolarHBondContact O-N 3.24Å; Y674-T678 PolarHBondContact O-OG1 3.13Å
675	Y	91.1	Very high	92	Very high	38 Å²	38	40.9 Å²	40.9	15%	0.149	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-41.2	178.5	-158.9	-79.2	0	0	0	112	S617 F621 D671 S672 L677 K679 F680	S617-Y675 WeakPolarHBondContact OG-CD2 3.21Å; F621-Y675 AromaticContact CE2-CD1 3.94Å; F621-Y675 HydrophobicContact CE2-CD1 3.94Å; F621-Y675 HydrophobicContact CE2-CG 4.23Å; F621-Y675 HydrophobicContact CZ-CD1 4.24Å; D671-Y675 VanDerWaalsContact O-CB 3.32Å; D671-Y675 WeakPolarHBondContact O-CB 3.32Å; D671-Y675 PolarHBondContact O-N 2.99Å; S672-Y675 PolarHBondContact O-N 3.06Å; Y675-L677 VanDerWaalsContact C-N 3.32Å; Y675-L677 PolarHBondContact O-N 3.3Å; Y675-K679 HydrophobicContact CD1-CB 3.76Å; Y675-K679 HydrophobicContact CD1-CG 4.33Å; Y675-K679 HydrophobicContact CD2-CB 4.28Å; Y675-K679 HydrophobicContact CD2-CG 3.93Å; Y675-K679 HydrophobicContact CE1-CB 3.6Å; Y675-K679 HydrophobicContact CE1-CG 4.23Å; Y675-K679 HydrophobicContact CE2-CB 4.18Å; Y675-K679 HydrophobicContact CE2-CG 3.86Å; Y675-K679 HydrophobicContact CG-CB 4.08Å; Y675-K679 HydrophobicContact CG-CG 4.17Å; Y675-K679 WeakPolarHBondContact O-CA 3.19Å; Y675-K679 WeakPolarHBondContact O-CB 3.47Å; Y675-K679 PolarHBondContact O-N 3.02Å; Y675-F680 HydrophobicContact CD1-CD1 4.42Å; Y675-F680 AromaticContact CD1-CD2 3.76Å; Y675-F680 HydrophobicContact CD1-CD2 3.76Å; Y675-F680 HydrophobicContact CD1-CE1 4.37Å; Y675-F680 AromaticContact CD1-CE2 3.69Å; Y675-F680 HydrophobicContact CD1-CE2 3.69Å; Y675-F680 HydrophobicContact CD1-CG 4.14Å; Y675-F680 HydrophobicContact CD1-CZ 4.02Å; Y675-F680 AromaticContact CE1-CD1 4Å; Y675-F680 HydrophobicContact CE1-CD1 4Å; Y675-F680 HydrophobicContact CE1-CD2 4.07Å; Y675-F680 AromaticContact CE1-CE1 3.7Å; Y675-F680 HydrophobicContact CE1-CE1 3.7Å; Y675-F680 AromaticContact CE1-CE2 3.76Å; Y675-F680 HydrophobicContact CE1-CE2 3.76Å; Y675-F680 HydrophobicContact CE1-CG 4.19Å; Y675-F680 AromaticContact CE1-CZ 3.57Å; Y675-F680 HydrophobicContact CE1-CZ 3.57Å; Y675-F680 PolarHBondContact O-N 3.18Å
676	A	92.5	Very high	92.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.196	C	C	.	.	I	π-helix	trans	-61.7	-39.3	177.2	0	0	0	0	0	112.4	F621 S672 G673 K681 K682 L685 I689	F621-A676 HydrophobicContact CE1-CB 4.27Å; F621-A676 HydrophobicContact CZ-CB 4.15Å; S672-A676 VanDerWaalsContact O-CB 3.32Å; S672-A676 WeakPolarHBondContact O-CB 3.42Å; S672-A676 PolarHBondContact O-N 2.8Å; G673-A676 PolarHBondContact O-N 2.97Å; A676-K681 WeakPolarHBondContact O-CA 3.4Å; A676-K681 PolarHBondContact O-N 3.22Å; A676-K682 PolarHBondContact O-N 3.1Å; A676-K682 VanDerWaalsContact O-N 3.16Å; A676-L685 HydrophobicContact CB-CB 4.03Å; A676-I689 HydrophobicContact CB-CD1 4.01Å
677	L	89.8	Confident	92.2	Very high	89 Å²	89	46.8 Å²	46.8	47%	0.466	22%	0.217	S	C	.	.	I	π-helix	trans	-78.6	-42.7	-179.1	-68.4	174.7	0	0	0	113.2	G673 Y674 Y675 Y686	G673-L677 WeakPolarHBondContact O-CG 3.41Å; G673-L677 PolarHBondContact O-N 3.26Å; G673-L677 VanDerWaalsContact O-N 3.13Å; Y674-L677 PolarHBondContact O-N 3.46Å; Y675-L677 VanDerWaalsContact C-N 3.32Å; Y675-L677 PolarHBondContact O-N 3.3Å; L677-Y686 HydrophobicContact CD1-CD2 3.69Å; L677-Y686 HydrophobicContact CD1-CE2 3.7Å; L677-Y686 HydrophobicContact CD1-CG 4.4Å; L677-Y686 HydrophobicContact CD2-CD2 3.97Å; L677-Y686 HydrophobicContact CD2-CG 3.89Å; L677-Y686 HydrophobicContact CG-CD2 3.7Å; L677-Y686 HydrophobicContact CG-CE2 4.24Å; L677-Y686 HydrophobicContact CG-CG 4.16Å
678	T	87.1	Confident	92.5	Very high	51 Å²	51	48.3 Å²	48.3	31%	0.313	22%	0.224	S	C	.	.	I	π-helix	trans	-96.2	-41.2	-170.4	61.9	0	0	0	0	113.9	Y674 K681	Y674-T678 HydrophobicContact CD2-CG2 3.89Å; Y674-T678 HydrophobicContact CE1-CG2 4.46Å; Y674-T678 HydrophobicContact CE2-CG2 3.53Å; Y674-T678 HydrophobicContact CG-CG2 4.49Å; Y674-T678 WeakPolarHBondContact O-CB 3.36Å; Y674-T678 PolarHBondContact O-N 3.24Å; Y674-T678 PolarHBondContact O-OG1 3.13Å; T678-K681 WeakPolarHBondContact O-CE 3.45Å; T678-K681 WeakPolarHBondContact O-CG 3.35Å
679	K	88.6	Confident	92.6	Very high	99 Å²	99	48.3 Å²	48.3	43%	0.43	22%	0.224	S	C	.	.	I	π-helix	trans	-93.2	-57.4	-177.6	-60.7	-65.4	-176.8	178.6	0	111.2	Y675	Y675-K679 HydrophobicContact CD1-CB 3.76Å; Y675-K679 HydrophobicContact CD1-CG 4.33Å; Y675-K679 HydrophobicContact CD2-CB 4.28Å; Y675-K679 HydrophobicContact CD2-CG 3.93Å; Y675-K679 HydrophobicContact CE1-CB 3.6Å; Y675-K679 HydrophobicContact CE1-CG 4.23Å; Y675-K679 HydrophobicContact CE2-CB 4.18Å; Y675-K679 HydrophobicContact CE2-CG 3.86Å; Y675-K679 HydrophobicContact CG-CB 4.08Å; Y675-K679 HydrophobicContact CG-CG 4.17Å; Y675-K679 WeakPolarHBondContact O-CA 3.19Å; Y675-K679 WeakPolarHBondContact O-CB 3.47Å; Y675-K679 PolarHBondContact O-N 3.02Å
680	F	92.1	Very high	92.6	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.009	24%	0.239	C	C	.	.	I	π-helix	trans	-73	-30.5	178.7	-69	-35.5	0	0	0	113.3	V81 Y84 T85 F307 F621 Y675 K682 L685	V81-F680 HydrophobicContact CB-CD1 4.4Å; V81-F680 HydrophobicContact CG1-CB 4.28Å; V81-F680 HydrophobicContact CG1-CD1 3.88Å; V81-F680 WeakPolarHBondContact CG1-O 3.39Å; V81-F680 HydrophobicContact CG2-CD1 3.92Å; V81-F680 HydrophobicContact CG2-CE1 4.36Å; Y84-F680 HydrophobicContact CD1-CE1 4.02Å; Y84-F680 HydrophobicContact CD1-CE2 4.49Å; Y84-F680 AromaticContact CD1-CZ 3.85Å; Y84-F680 HydrophobicContact CD1-CZ 3.85Å; Y84-F680 HydrophobicContact CE1-CE1 4.37Å; Y84-F680 HydrophobicContact CE1-CE2 4.13Å; Y84-F680 AromaticContact CE1-CZ 3.72Å; Y84-F680 HydrophobicContact CE1-CZ 3.72Å; T85-F680 HydrophobicContact CG2-CB 4.39Å; T85-F680 HydrophobicContact CG2-CD1 4.32Å; T85-F680 HydrophobicContact CG2-CG 4.25Å; F307-F680 AromaticContact CE1-CE1 3.92Å; F307-F680 HydrophobicContact CE1-CE1 3.92Å; F307-F680 HydrophobicContact CZ-CE1 4.07Å; F621-F680 HydrophobicContact CD1-CD2 4.24Å; F621-F680 AromaticContact CD1-CE2 3.74Å; F621-F680 HydrophobicContact CD1-CE2 3.74Å; F621-F680 AromaticContact CD2-CE2 3.79Å; F621-F680 HydrophobicContact CD2-CE2 3.79Å; F621-F680 AromaticContact CE1-CD2 3.74Å; F621-F680 HydrophobicContact CE1-CD2 3.74Å; F621-F680 AromaticContact CE1-CE2 3.64Å; F621-F680 HydrophobicContact CE1-CE2 3.64Å; F621-F680 HydrophobicContact CE2-CD2 4.25Å; F621-F680 AromaticContact CE2-CE2 3.68Å; F621-F680 HydrophobicContact CE2-CE2 3.68Å; F621-F680 AromaticContact CG-CE2 3.83Å; F621-F680 HydrophobicContact CG-CE2 3.83Å; F621-F680 AromaticContact CZ-CD2 3.74Å; F621-F680 HydrophobicContact CZ-CD2 3.74Å; F621-F680 AromaticContact CZ-CE2 3.61Å; F621-F680 HydrophobicContact CZ-CE2 3.61Å; Y675-F680 HydrophobicContact CD1-CD1 4.42Å; Y675-F680 AromaticContact CD1-CD2 3.76Å; Y675-F680 HydrophobicContact CD1-CD2 3.76Å; Y675-F680 HydrophobicContact CD1-CE1 4.37Å; Y675-F680 AromaticContact CD1-CE2 3.69Å; Y675-F680 HydrophobicContact CD1-CE2 3.69Å; Y675-F680 HydrophobicContact CD1-CG 4.14Å; Y675-F680 HydrophobicContact CD1-CZ 4.02Å; Y675-F680 AromaticContact CE1-CD1 4Å; Y675-F680 HydrophobicContact CE1-CD1 4Å; Y675-F680 HydrophobicContact CE1-CD2 4.07Å; Y675-F680 AromaticContact CE1-CE1 3.7Å; Y675-F680 HydrophobicContact CE1-CE1 3.7Å; Y675-F680 AromaticContact CE1-CE2 3.76Å; Y675-F680 HydrophobicContact CE1-CE2 3.76Å; Y675-F680 HydrophobicContact CE1-CG 4.19Å; Y675-F680 AromaticContact CE1-CZ 3.57Å; Y675-F680 HydrophobicContact CE1-CZ 3.57Å; Y675-F680 PolarHBondContact O-N 3.18Å; F680-K682 HydrophobicContact CB-CG 4.45Å; F680-K682 WeakPolarHBondContact O-CG 3.25Å; F680-K682 PolarHBondContact O-N 3.34Å; F680-K682 PolarHBondContact O-NZ 3.3Å; F680-L685 HydrophobicContact CB-CD1 4.14Å; F680-L685 HydrophobicContact CD2-CD1 3.73Å; F680-L685 HydrophobicContact CG-CD1 4.22Å
681	K	93.8	Very high	92.8	Very high	141 Å²	141	53.6 Å²	53.6	61%	0.613	26%	0.259	S	S	*	.			trans	51.9	53.2	-178.4	-56.2	175.3	-176.2	172.5	0	111	A676 T678	A676-K681 WeakPolarHBondContact O-CA 3.4Å; A676-K681 PolarHBondContact O-N 3.22Å; T678-K681 WeakPolarHBondContact O-CE 3.45Å; T678-K681 WeakPolarHBondContact O-CG 3.35Å
682	K	92.7	Very high	93.1	Very high	65 Å²	65	53.1 Å²	53.1	28%	0.283	26%	0.256	S	S	.	.			trans	-131.1	124.7	178.8	-61.9	-63.7	163.8	-71.3	0	111	T85 A676 F680 F684 L685	T85-K682 HydrophobicContact CG2-CG 4.06Å; T85-K682 WeakPolarHBondContact OG1-CE 3.48Å; A676-K682 PolarHBondContact O-N 3.1Å; A676-K682 VanDerWaalsContact O-N 3.16Å; F680-K682 HydrophobicContact CB-CG 4.45Å; F680-K682 WeakPolarHBondContact O-CG 3.25Å; F680-K682 PolarHBondContact O-N 3.34Å; F680-K682 PolarHBondContact O-NZ 3.3Å; K682-F684 HydrophobicContact CB-CD1 4.15Å; K682-F684 HydrophobicContact CB-CE1 3.89Å; K682-F684 HydrophobicContact CB-CZ 4.48Å; K682-F684 HydrophobicContact CD-CE1 4.09Å; K682-F684 HydrophobicContact CG-CE1 4.06Å; K682-L685 HydrophobicContact CB-CB 4.44Å; K682-L685 HydrophobicContact CB-CD1 4.04Å; K682-L685 HydrophobicContact CB-CG 4.16Å; K682-L685 HydrophobicContact CG-CD1 4.42Å
683	Q	93.3	Very high	93.2	Very high	160 Å²	160	53.7 Å²	53.7	75%	0.748	26%	0.259	S	S	*	.	H	α-helix	trans	-66.3	-50.5	179.5	-70.8	176.2	-17.9	0	0	111.8	L685 Y686 D687	Q683-L685 PolarHBondContact O-N 2.84Å; Q683-Y686 CarbonylContact O-C 3.01Å; Q683-Y686 WeakPolarHBondContact O-CA 3.02Å; Q683-Y686 WeakPolarHBondContact O-CB 3.35Å; Q683-Y686 PolarHBondContact O-N 3.46Å; Q683-D687 VanDerWaalsContact O-CG 3.28Å; Q683-D687 PolarHBondContact O-N 3.39Å
684	F	95.3	Very high	93.4	Very high	64 Å²	64	58.8 Å²	58.8	28%	0.281	29%	0.286	S	S	.	.	H	α-helix	trans	-58	-30.5	-175.4	74.6	-95.3	0	0	0	114	T85 K682 E688	T85-F684 WeakPolarHBondContact O-CZ 3.28Å; K682-F684 HydrophobicContact CB-CD1 4.15Å; K682-F684 HydrophobicContact CB-CE1 3.89Å; K682-F684 HydrophobicContact CB-CZ 4.48Å; K682-F684 HydrophobicContact CD-CE1 4.09Å; K682-F684 HydrophobicContact CG-CE1 4.06Å; F684-E688 WeakPolarHBondContact O-CB 3.19Å; F684-E688 VanDerWaalsContact O-CG 3.27Å; F684-E688 WeakPolarHBondContact O-CG 3.43Å; F684-E688 PolarHBondContact O-N 2.98Å; F684-E688 VanDerWaalsContact O-N 3.08Å
685	L	94.9	Very high	93.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.8	-43.5	174.4	-70.2	178.8	0	0	0	111	T85 W620 F621 A676 F680 K682 Q683 E688 I689	T85-L685 HydrophobicContact CG2-CD1 3.86Å; W620-L685 HydrophobicContact CZ3-CD2 4.5Å; F621-L685 HydrophobicContact CE1-CD1 4.21Å; A676-L685 HydrophobicContact CB-CB 4.03Å; F680-L685 HydrophobicContact CB-CD1 4.14Å; F680-L685 HydrophobicContact CD2-CD1 3.73Å; F680-L685 HydrophobicContact CG-CD1 4.22Å; K682-L685 HydrophobicContact CB-CB 4.44Å; K682-L685 HydrophobicContact CB-CD1 4.04Å; K682-L685 HydrophobicContact CB-CG 4.16Å; K682-L685 HydrophobicContact CG-CD1 4.42Å; Q683-L685 PolarHBondContact O-N 2.84Å; L685-E688 PolarHBondContact O-N 2.81Å; L685-I689 VanDerWaalsContact O-CG1 3.24Å; L685-I689 WeakPolarHBondContact O-CG1 3.3Å; L685-I689 PolarHBondContact O-N 2.86Å
686	Y	94.9	Very high	93.8	Very high	39 Å²	39	56.7 Å²	56.7	15%	0.153	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-42	175.4	-177	-93.9	0	0	0	111.4	L677 Q683 E688 I689 E690 L756 R758	L677-Y686 HydrophobicContact CD1-CD2 3.69Å; L677-Y686 HydrophobicContact CD1-CE2 3.7Å; L677-Y686 HydrophobicContact CD1-CG 4.4Å; L677-Y686 HydrophobicContact CD2-CD2 3.97Å; L677-Y686 HydrophobicContact CD2-CG 3.89Å; L677-Y686 HydrophobicContact CG-CD2 3.7Å; L677-Y686 HydrophobicContact CG-CE2 4.24Å; L677-Y686 HydrophobicContact CG-CG 4.16Å; Q683-Y686 CarbonylContact O-C 3.01Å; Q683-Y686 WeakPolarHBondContact O-CA 3.02Å; Q683-Y686 WeakPolarHBondContact O-CB 3.35Å; Q683-Y686 PolarHBondContact O-N 3.46Å; Y686-E688 VanDerWaalsContact C-N 3.26Å; Y686-E688 PolarHBondContact O-N 3.32Å; Y686-I689 PolarHBondContact O-N 3.42Å; Y686-E690 HydrophobicContact CE1-CB 4.37Å; Y686-E690 VanDerWaalsContact O-CB 3.32Å; Y686-E690 WeakPolarHBondContact O-CB 3.27Å; Y686-E690 PolarHBondContact O-N 3.17Å; Y686-L756 HydrophobicContact CE2-CD2 4.43Å; Y686-R758 PolarHBondContact OH-NH1 3.21Å
687	D	95.2	Very high	93.9	Very high	88 Å²	88	57.6 Å²	57.6	47%	0.471	29%	0.288	S	S	.	.	H	α-helix	trans	-58.3	-40.1	177.3	-57.8	-23.3	0	0	0	111.2	Q683 A691	Q683-D687 VanDerWaalsContact O-CG 3.28Å; Q683-D687 PolarHBondContact O-N 3.39Å; D687-A691 VanDerWaalsContact O-CB 3.3Å; D687-A691 WeakPolarHBondContact O-CB 3.41Å; D687-A691 PolarHBondContact O-N 3.42Å
688	E	96.7	Very high	94.2	Very high	44 Å²	44	57.6 Å²	57.6	21%	0.206	29%	0.288	C	S	.	.	H	α-helix	trans	-70.7	-41.1	176.3	-73.8	173.9	-174.7	0	0	112.9	R87 W620 Q635 F684 L685 Y686 E690 A691 E692	R87-E688 IonicContact CZ-OE1 3.59Å; R87-E688 IonicContact CZ-OE2 2.77Å; R87-E688 IonicContact NH1-OE1 3.57Å; R87-E688 PolarHBondContact NH1-OE1 2.94Å; R87-E688 IonicContact NH1-OE2 3.16Å; R87-E688 IonicContact NH2-OE1 3.64Å; R87-E688 PolarHBondContact NH2-OE1 2.65Å; R87-E688 IonicContact NH2-OE2 2.79Å; R87-E688 PolarHBondContact NH2-OE2 3.09Å; W620-E688 HydrophobicContact CH2-CB 3.9Å; W620-E688 HydrophobicContact CZ2-CB 4.21Å; Q635-E688 PolarHBondContact NE2-OE2 2.72Å; F684-E688 WeakPolarHBondContact O-CB 3.19Å; F684-E688 VanDerWaalsContact O-CG 3.27Å; F684-E688 WeakPolarHBondContact O-CG 3.43Å; F684-E688 PolarHBondContact O-N 2.98Å; F684-E688 VanDerWaalsContact O-N 3.08Å; L685-E688 PolarHBondContact O-N 2.81Å; Y686-E688 VanDerWaalsContact C-N 3.26Å; Y686-E688 PolarHBondContact O-N 3.32Å; E688-E690 VanDerWaalsContact C-N 3.34Å; E688-A691 PolarHBondContact O-N 3.18Å; E688-E692 WeakPolarHBondContact O-CB 3.36Å; E688-E692 PolarHBondContact O-N 3.08Å
689	I	95.8	Very high	94.5	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.6	-46.6	173.7	-68.6	165.2	0	0	0	109.9	W620 F621 Y669 A676 L685 Y686 E692 V693 L756	W620-I689 HydrophobicContact CD2-CD1 4.33Å; W620-I689 HydrophobicContact CD2-CG1 3.71Å; W620-I689 HydrophobicContact CE3-CD1 3.81Å; W620-I689 HydrophobicContact CE3-CG1 3.55Å; W620-I689 HydrophobicContact CH2-CB 4.5Å; W620-I689 HydrophobicContact CH2-CD1 4.25Å; W620-I689 HydrophobicContact CH2-CG1 3.41Å; W620-I689 VanDerWaalsContact CH2-CG1 3.41Å; W620-I689 HydrophobicContact CZ2-CB 4.36Å; W620-I689 HydrophobicContact CZ2-CG1 3.53Å; W620-I689 HydrophobicContact CZ3-CD1 3.78Å; W620-I689 HydrophobicContact CZ3-CG1 3.41Å; W620-I689 VanDerWaalsContact CZ3-CG1 3.41Å; F621-I689 HydrophobicContact CE1-CD1 4.3Å; Y669-I689 HydrophobicContact CD1-CG2 4.21Å; A676-I689 HydrophobicContact CB-CD1 4.01Å; L685-I689 VanDerWaalsContact O-CG1 3.24Å; L685-I689 WeakPolarHBondContact O-CG1 3.3Å; L685-I689 PolarHBondContact O-N 2.86Å; Y686-I689 PolarHBondContact O-N 3.42Å; I689-E692 PolarHBondContact O-N 3.02Å; I689-V693 HydrophobicContact CG2-CG2 4.43Å; I689-V693 WeakPolarHBondContact O-CB 3.23Å; I689-V693 WeakPolarHBondContact O-CG2 3.46Å; I689-V693 PolarHBondContact O-N 3.16Å; I689-L756 HydrophobicContact CG2-CD1 4.36Å; I689-L756 HydrophobicContact CG2-CD2 4.12Å
690	E	94.8	Very high	94.9	Very high	64 Å²	64	53.4 Å²	53.4	30%	0.299	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-45.3	179.7	-179.1	176.5	-107	0	0	111.8	Y686 E688 E692 V693 N694 L756 R758	Y686-E690 HydrophobicContact CE1-CB 4.37Å; Y686-E690 VanDerWaalsContact O-CB 3.32Å; Y686-E690 WeakPolarHBondContact O-CB 3.27Å; Y686-E690 PolarHBondContact O-N 3.17Å; E688-E690 VanDerWaalsContact C-N 3.34Å; E690-E692 VanDerWaalsContact C-N 3.33Å; E690-E692 PolarHBondContact O-N 3.47Å; E690-V693 PolarHBondContact O-N 3.22Å; E690-N694 WeakPolarHBondContact O-CB 3.43Å; E690-N694 PolarHBondContact O-N 3.23Å; E690-L756 HydrophobicContact CB-CD1 4.16Å; E690-L756 HydrophobicContact CG-CD1 4.43Å; E690-R758 IonicContact OE1-CZ 3.69Å; E690-R758 VanDerWaalsContact OE1-CZ 3.3Å; E690-R758 IonicContact OE1-NH1 3.48Å; E690-R758 PolarHBondContact OE1-NH1 3Å; E690-R758 VanDerWaalsContact OE1-NH1 3.17Å; E690-R758 IonicContact OE1-NH2 2.86Å; E690-R758 PolarHBondContact OE1-NH2 3.45Å
691	A	95.3	Very high	95.1	Very high	60 Å²	60	53.4 Å²	53.4	50%	0.496	27%	0.267	S	S	.	.	H	α-helix	trans	-62.8	-39.9	176.4	0	0	0	0	0	112.2	D687 E688 L695	D687-A691 VanDerWaalsContact O-CB 3.3Å; D687-A691 WeakPolarHBondContact O-CB 3.41Å; D687-A691 PolarHBondContact O-N 3.42Å; E688-A691 PolarHBondContact O-N 3.18Å; A691-L695 PolarHBondContact O-N 2.9Å
692	E	97	Very high	95.1	Very high	13 Å²	13	53 Å²	53	6%	0.061	26%	0.262	C	S	.	.	H	α-helix	trans	-66.2	-45.8	176.2	-172.1	166.9	127.6	0	0	111.5	W620 R622 I638 S641 Y669 E688 I689 E690 N694 L695 C696	W620-E692 VanDerWaalsContact NE1-CD 3.29Å; W620-E692 PolarHBondContact NE1-OE1 2.79Å; W620-E692 PolarHBondContact NE1-OE2 2.88Å; R622-E692 IonicContact CZ-OE2 2.71Å; R622-E692 IonicContact NH2-OE2 3.44Å; R622-E692 PolarHBondContact NH2-OE2 3.32Å; I638-E692 HydrophobicContact CG2-CG 3.81Å; S641-E692 WeakPolarHBondContact CB-OE1 3.4Å; S641-E692 PolarHBondContact OG-OE1 3.44Å; Y669-E692 HydrophobicContact CE1-CG 4.19Å; Y669-E692 WeakPolarHBondContact CE1-OE1 3.22Å; Y669-E692 PolarHBondContact OH-OE1 2.85Å; E688-E692 WeakPolarHBondContact O-CB 3.36Å; E688-E692 PolarHBondContact O-N 3.08Å; I689-E692 PolarHBondContact O-N 3.02Å; E690-E692 VanDerWaalsContact C-N 3.33Å; E690-E692 PolarHBondContact O-N 3.47Å; E692-N694 VanDerWaalsContact C-N 3.33Å; E692-N694 PolarHBondContact O-N 3.22Å; E692-L695 PolarHBondContact O-N 3.4Å; E692-C696 VanDerWaalsContact O-CB 3.26Å; E692-C696 WeakPolarHBondContact O-CB 3.2Å; E692-C696 PolarHBondContact O-N 2.89Å; E692-C696 PolarHBondContact O-SG 2.96Å
693	V	95.8	Very high	95.3	Very high	12 Å²	12	52.2 Å²	52.2	7%	0.073	26%	0.259	C	S	.	.	H	α-helix	trans	-59.5	-43.6	175.5	166.7	0	0	0	0	111.3	Y669 I689 E690 L695 C696 F697 L755 L756	Y669-V693 VanDerWaalsContact CB-CG2 3.49Å; Y669-V693 HydrophobicContact CD1-CG2 3.6Å; Y669-V693 HydrophobicContact CD2-CG2 3.59Å; Y669-V693 HydrophobicContact CE1-CG2 4.14Å; Y669-V693 HydrophobicContact CE2-CG2 4.14Å; Y669-V693 HydrophobicContact CG-CG2 3.28Å; I689-V693 HydrophobicContact CG2-CG2 4.43Å; I689-V693 WeakPolarHBondContact O-CB 3.23Å; I689-V693 WeakPolarHBondContact O-CG2 3.46Å; I689-V693 PolarHBondContact O-N 3.16Å; E690-V693 PolarHBondContact O-N 3.22Å; V693-L695 VanDerWaalsContact C-N 3.34Å; V693-L695 PolarHBondContact O-N 3.43Å; V693-C696 PolarHBondContact O-N 3.18Å; V693-F697 WeakPolarHBondContact O-CB 3.29Å; V693-F697 PolarHBondContact O-N 3.45Å; V693-L755 HydrophobicContact CG1-CD2 3.52Å; V693-L755 HydrophobicContact CG1-CG 4.04Å; V693-L756 HydrophobicContact CB-CD1 3.85Å; V693-L756 HydrophobicContact CG1-CD1 4Å; V693-L756 HydrophobicContact CG2-CD1 3.83Å; V693-L756 HydrophobicContact CG2-CG 4.38Å
694	N	94.4	Very high	95.4	Very high	110 Å²	110	44.6 Å²	44.6	59%	0.588	22%	0.223	S	C	*	.	H	α-helix	trans	-59.2	-46.2	-179.9	-165.7	32.4	0	0	0	111.5	E690 E692 D698	E690-N694 WeakPolarHBondContact O-CB 3.43Å; E690-N694 PolarHBondContact O-N 3.23Å; E692-N694 VanDerWaalsContact C-N 3.33Å; E692-N694 PolarHBondContact O-N 3.22Å; N694-D698 PolarHBondContact O-N 2.81Å
695	L	95.2	Very high	95.4	Very high	88 Å²	88	41.7 Å²	41.7	46%	0.461	21%	0.211	S	C	.	.	H	α-helix	trans	-66.8	-47.5	177	177.5	62	0	0	0	112.5	I638 A691 E692 V693 Q699	I638-L695 HydrophobicContact CD1-CD2 4.09Å; I638-L695 HydrophobicContact CD1-CG 4.37Å; I638-L695 HydrophobicContact CG2-CD2 4.11Å; A691-L695 PolarHBondContact O-N 2.9Å; E692-L695 PolarHBondContact O-N 3.4Å; V693-L695 VanDerWaalsContact C-N 3.34Å; V693-L695 PolarHBondContact O-N 3.43Å; L695-Q699 WeakPolarHBondContact O-CG 3.38Å; L695-Q699 PolarHBondContact O-N 3.06Å
696	C	95.4	Very high	95.4	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-65.8	-38.9	-178.4	-72.4	0	0	0	0	111.6	W644 E692 V693 Q699 F700	W644-C696 HydrophobicContact CD2-CB 3.99Å; W644-C696 VanDerWaalsContact CD2-SG 3.55Å; W644-C696 HydrophobicContact CE3-CB 3.49Å; W644-C696 VanDerWaalsContact CE3-CB 3.49Å; W644-C696 HydrophobicContact CH2-CB 4.38Å; W644-C696 VanDerWaalsContact CH2-O 3.28Å; W644-C696 WeakPolarHBondContact CH2-O 3.49Å; W644-C696 HydrophobicContact CZ3-CB 3.72Å; W644-C696 VanDerWaalsContact CZ3-O 3.27Å; W644-C696 WeakPolarHBondContact CZ3-O 3.34Å; E692-C696 VanDerWaalsContact O-CB 3.26Å; E692-C696 WeakPolarHBondContact O-CB 3.2Å; E692-C696 PolarHBondContact O-N 2.89Å; E692-C696 PolarHBondContact O-SG 2.96Å; V693-C696 PolarHBondContact O-N 3.18Å; C696-Q699 PolarHBondContact O-N 2.77Å; C696-F700 WeakPolarHBondContact O-CB 3.49Å; C696-F700 PolarHBondContact O-N 2.93Å
697	F	94.7	Very high	95.4	Very high	20 Å²	20	42.1 Å²	42.1	9%	0.088	22%	0.216	C	C	.	.	H	α-helix	trans	-70.1	-38.4	179.9	-167.9	-101	0	0	0	111.9	L666 V693 Q699 F700 V701 L755 I760 L762 L765	L666-F697 HydrophobicContact CD2-CD2 4.04Å; L666-F697 HydrophobicContact CD2-CE2 4.35Å; V693-F697 WeakPolarHBondContact O-CB 3.29Å; V693-F697 PolarHBondContact O-N 3.45Å; F697-Q699 VanDerWaalsContact C-N 3.31Å; F697-Q699 PolarHBondContact O-N 3.24Å; F697-F700 HydrophobicContact CD2-CD1 4.35Å; F697-F700 HydrophobicContact CE2-CD1 4.19Å; F697-F700 WeakPolarHBondContact O-CB 3.38Å; F697-F700 PolarHBondContact O-N 2.91Å; F697-V701 HydrophobicContact CD1-CG2 4.01Å; F697-V701 HydrophobicContact CE1-CG2 3.62Å; F697-V701 HydrophobicContact CE2-CG2 4.48Å; F697-V701 HydrophobicContact CZ-CG2 3.88Å; F697-V701 WeakPolarHBondContact O-CG2 3.45Å; F697-V701 PolarHBondContact O-N 3.39Å; F697-L755 HydrophobicContact CD2-CD2 4.04Å; F697-L755 HydrophobicContact CE2-CD2 4.48Å; F697-I760 HydrophobicContact CD1-CD1 4.47Å; F697-I760 HydrophobicContact CE1-CD1 3.98Å; F697-I760 HydrophobicContact CE1-CG2 3.8Å; F697-I760 HydrophobicContact CE2-CD1 4.23Å; F697-I760 HydrophobicContact CZ-CB 4.39Å; F697-I760 HydrophobicContact CZ-CD1 3.86Å; F697-I760 HydrophobicContact CZ-CG2 3.65Å; F697-L762 HydrophobicContact CZ-CD1 4.41Å; F697-L765 HydrophobicContact CE1-CD1 3.69Å; F697-L765 HydrophobicContact CZ-CD1 4.22Å
698	D	94.4	Very high	95.4	Very high	88 Å²	88	37.9 Å²	37.9	47%	0.471	19%	0.193	S	C	.	.	H	α-helix	trans	-60.1	-42	171.8	-88.3	-16.3	0	0	0	112.2	N694 Y702	N694-D698 PolarHBondContact O-N 2.81Å; D698-Y702 WeakPolarHBondContact O-CB 3.34Å; D698-Y702 PolarHBondContact O-N 3.42Å
699	Q	94.8	Very high	95.4	Very high	62 Å²	62	35.9 Å²	35.9	29%	0.29	18%	0.184	S	C	.	.	H	α-helix	trans	-66.9	-40.8	173.9	-70	-175.1	42	0	0	112	W644 L695 C696 F697 Y702 K703	W644-Q699 HydrophobicContact CH2-CB 3.75Å; W644-Q699 HydrophobicContact CZ2-CB 3.86Å; L695-Q699 WeakPolarHBondContact O-CG 3.38Å; L695-Q699 PolarHBondContact O-N 3.06Å; C696-Q699 PolarHBondContact O-N 2.77Å; F697-Q699 VanDerWaalsContact C-N 3.31Å; F697-Q699 PolarHBondContact O-N 3.24Å; Q699-Y702 PolarHBondContact O-N 3.22Å; Q699-K703 WeakPolarHBondContact O-CB 3.44Å; Q699-K703 WeakPolarHBondContact O-CG 3.45Å; Q699-K703 PolarHBondContact O-N 2.97Å
700	F	96	Very high	95.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-56.4	-53.7	175.9	174.4	-88.1	0	0	0	110.6	W644 T647 L651 V662 L663 L666 C696 F697 Y702 K703 L704 L762	W644-F700 HydrophobicContact CZ3-CB 4.4Å; T647-F700 HydrophobicContact CG2-CD2 3.91Å; T647-F700 HydrophobicContact CG2-CE2 4.33Å; L651-F700 HydrophobicContact CD1-CB 4.33Å; L651-F700 HydrophobicContact CD1-CD2 3.78Å; L651-F700 HydrophobicContact CD1-CG 4.39Å; L651-F700 HydrophobicContact CD2-CD2 4.22Å; L651-F700 HydrophobicContact CD2-CE2 4.22Å; L651-F700 HydrophobicContact CG-CD2 4.45Å; V662-F700 HydrophobicContact CB-CE2 4.48Å; V662-F700 HydrophobicContact CG1-CE2 3.87Å; V662-F700 HydrophobicContact CG1-CZ 4.07Å; V662-F700 HydrophobicContact CG2-CE2 3.84Å; L663-F700 HydrophobicContact CD2-CE1 4.29Å; L663-F700 HydrophobicContact CD2-CE2 4.37Å; L663-F700 HydrophobicContact CD2-CZ 3.68Å; L666-F700 HydrophobicContact CD1-CD2 4.02Å; L666-F700 HydrophobicContact CD1-CG 4.34Å; C696-F700 WeakPolarHBondContact O-CB 3.49Å; C696-F700 PolarHBondContact O-N 2.93Å; F697-F700 HydrophobicContact CD2-CD1 4.35Å; F697-F700 HydrophobicContact CE2-CD1 4.19Å; F697-F700 WeakPolarHBondContact O-CB 3.38Å; F697-F700 PolarHBondContact O-N 2.91Å; F700-Y702 VanDerWaalsContact C-N 3.33Å; F700-Y702 PolarHBondContact O-N 2.91Å; F700-K703 PolarHBondContact O-N 3.46Å; F700-L704 HydrophobicContact CD1-CD2 4.49Å; F700-L704 HydrophobicContact CE1-CD2 3.67Å; F700-L704 HydrophobicContact CZ-CD2 3.76Å; F700-L704 WeakPolarHBondContact O-CB 3.43Å; F700-L704 PolarHBondContact O-N 3.35Å; F700-L762 HydrophobicContact CD1-CD1 4.44Å; F700-L762 HydrophobicContact CE1-CD1 3.9Å; F700-L762 HydrophobicContact CE1-CD2 4.06Å
701	V	96.1	Very high	95.5	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	18%	0.183	C	C	.	.	H	α-helix	trans	-64.6	-38.2	-180	-179.1	0	0	0	0	110.9	F697 A705 L762 L765	F697-V701 HydrophobicContact CD1-CG2 4.01Å; F697-V701 HydrophobicContact CE1-CG2 3.62Å; F697-V701 HydrophobicContact CE2-CG2 4.48Å; F697-V701 HydrophobicContact CZ-CG2 3.88Å; F697-V701 WeakPolarHBondContact O-CG2 3.45Å; F697-V701 PolarHBondContact O-N 3.39Å; V701-A705 WeakPolarHBondContact O-CB 3.14Å; V701-A705 PolarHBondContact O-N 3.32Å; V701-L762 HydrophobicContact CG2-CD1 4.08Å; V701-L765 HydrophobicContact CG1-CB 3.85Å; V701-L765 HydrophobicContact CG2-CD1 4.2Å
702	Y	94.9	Very high	95.5	Very high	132 Å²	132	32.9 Å²	32.9	52%	0.518	16%	0.162	S	C	.	.	H	α-helix	trans	-61.7	-57.1	175.6	179.8	-87.9	0	0	0	111.8	D698 Q699 F700 L704 A705 D706 R769	D698-Y702 WeakPolarHBondContact O-CB 3.34Å; D698-Y702 PolarHBondContact O-N 3.42Å; Q699-Y702 PolarHBondContact O-N 3.22Å; F700-Y702 VanDerWaalsContact C-N 3.33Å; F700-Y702 PolarHBondContact O-N 2.91Å; Y702-L704 VanDerWaalsContact C-N 3.33Å; Y702-L704 PolarHBondContact O-N 3.41Å; Y702-A705 PolarHBondContact O-N 3.01Å; Y702-D706 WeakPolarHBondContact O-CB 3.36Å; Y702-D706 PolarHBondContact O-N 2.9Å; Y702-R769 VanDerWaalsContact CB-NH1 3.34Å; Y702-R769 VanDerWaalsContact CD2-NH1 3.29Å
703	K	95.5	Very high	95.5	Very high	49 Å²	49	32.3 Å²	32.3	21%	0.213	16%	0.159	C	C	.	.	H	α-helix	trans	-62.4	-41.6	-177.5	-71.3	-168.9	178	-163.9	0	111	D648 L651 E652 Q699 F700 Q707	D648-K703 WeakPolarHBondContact OD1-CE 3.1Å; D648-K703 IonicContact OD1-NZ 3.6Å; D648-K703 PolarHBondContact OD1-NZ 2.99Å; D648-K703 IonicContact OD2-NZ 2.61Å; D648-K703 PolarHBondContact OD2-NZ 2.85Å; L651-K703 HydrophobicContact CB-CB 4.3Å; L651-K703 HydrophobicContact CB-CD 4.12Å; L651-K703 HydrophobicContact CD1-CB 4.29Å; L651-K703 HydrophobicContact CD1-CD 4.37Å; E652-K703 IonicContact OE2-NZ 3.3Å; E652-K703 PolarHBondContact OE2-NZ 2.98Å; Q699-K703 WeakPolarHBondContact O-CB 3.44Å; Q699-K703 WeakPolarHBondContact O-CG 3.45Å; Q699-K703 PolarHBondContact O-N 2.97Å; F700-K703 PolarHBondContact O-N 3.46Å; K703-Q707 WeakPolarHBondContact O-CB 3.36Å; K703-Q707 VanDerWaalsContact O-CG 3.23Å; K703-Q707 WeakPolarHBondContact O-CG 3.26Å; K703-Q707 PolarHBondContact O-N 3.39Å; K703-Q707 PolarHBondContact O-NE2 3.11Å
704	L	95.8	Very high	95.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.8	-47.8	178.2	-173.9	59.3	0	0	0	112.7	L651 M659 F700 Y702 Q707 I708 Y744 L747 L762 I766	L651-L704 HydrophobicContact CD2-CB 4.4Å; M659-L704 HydrophobicContact SD-CD1 4.22Å; F700-L704 HydrophobicContact CD1-CD2 4.49Å; F700-L704 HydrophobicContact CE1-CD2 3.67Å; F700-L704 HydrophobicContact CZ-CD2 3.76Å; F700-L704 WeakPolarHBondContact O-CB 3.43Å; F700-L704 PolarHBondContact O-N 3.35Å; Y702-L704 VanDerWaalsContact C-N 3.33Å; Y702-L704 PolarHBondContact O-N 3.41Å; L704-Q707 HydrophobicContact CD1-CG 4.44Å; L704-Q707 VanDerWaalsContact O-CG 3.26Å; L704-Q707 WeakPolarHBondContact O-CG 3.33Å; L704-I708 HydrophobicContact CD1-CD1 3.76Å; L704-I708 HydrophobicContact CD1-CG1 4.17Å; L704-I708 HydrophobicContact CG-CD1 3.74Å; L704-I708 WeakPolarHBondContact O-CB 3.35Å; L704-I708 WeakPolarHBondContact O-CD1 3.43Å; L704-I708 WeakPolarHBondContact O-CG1 3.46Å; L704-I708 PolarHBondContact O-N 3.42Å; L704-Y744 HydrophobicContact CD1-CD1 3.98Å; L704-Y744 HydrophobicContact CD1-CE1 4.07Å; L704-L747 HydrophobicContact CD1-CD1 3.74Å; L704-L747 HydrophobicContact CD2-CB 4.44Å; L704-L747 HydrophobicContact CD2-CD1 4.03Å; L704-L762 HydrophobicContact CD2-CD2 4.32Å; L704-I766 HydrophobicContact CD2-CD1 3.8Å; L704-I766 HydrophobicContact CG-CD1 4.23Å
705	A	95.9	Very high	95.5	Very high	4 Å²	4	29.4 Å²	29.4	3%	0.033	14%	0.144	C	C	.	.	H	α-helix	trans	-65.7	-41.2	178.6	0	0	0	0	0	112.4	V701 Y702 I708 F709 I766 R769	V701-A705 WeakPolarHBondContact O-CB 3.14Å; V701-A705 PolarHBondContact O-N 3.32Å; Y702-A705 PolarHBondContact O-N 3.01Å; A705-I708 PolarHBondContact O-N 3.35Å; A705-F709 WeakPolarHBondContact O-CB 3.48Å; A705-F709 PolarHBondContact O-N 3.46Å; A705-I766 HydrophobicContact CB-CG2 4.43Å; A705-R769 HydrophobicContact CB-CB 3.68Å; A705-R769 HydrophobicContact CB-CG 4.36Å
706	D	94.6	Very high	95.5	Very high	42 Å²	42	25.2 Å²	25.2	23%	0.225	12%	0.122	C	C	.	.	H	α-helix	trans	-63.7	-44.9	179.6	-170.1	71.1	0	0	0	111.4	Y702 A710 Y884	Y702-D706 WeakPolarHBondContact O-CB 3.36Å; Y702-D706 PolarHBondContact O-N 2.9Å; D706-A710 WeakPolarHBondContact O-CB 3.36Å; D706-A710 PolarHBondContact O-N 3.48Å; D706-Y884 WeakPolarHBondContact OD1-CE2 3.46Å; D706-Y884 PolarHBondContact OD1-OH 3.24Å
707	Q	94.7	Very high	95.5	Very high	5 Å²	5	25.1 Å²	25.1	2%	0.023	12%	0.121	C	C	.	.	H	α-helix	trans	-69.2	-36.3	177.2	72.1	-175.6	-52.6	0	0	113.2	K654 K703 L704 A710 Y711 Y744	K654-Q707 HydrophobicContact CD-CB 4.27Å; K703-Q707 WeakPolarHBondContact O-CB 3.36Å; K703-Q707 VanDerWaalsContact O-CG 3.23Å; K703-Q707 WeakPolarHBondContact O-CG 3.26Å; K703-Q707 PolarHBondContact O-N 3.39Å; K703-Q707 PolarHBondContact O-NE2 3.11Å; L704-Q707 HydrophobicContact CD1-CG 4.44Å; L704-Q707 VanDerWaalsContact O-CG 3.26Å; L704-Q707 WeakPolarHBondContact O-CG 3.33Å; Q707-A710 PolarHBondContact O-N 3.36Å; Q707-Y711 WeakPolarHBondContact O-CB 3.49Å; Q707-Y711 PolarHBondContact O-N 2.95Å; Q707-Y744 HydrophobicContact CG-CE1 3.86Å; Q707-Y744 PolarHBondContact OE1-OH 2.83Å
708	I	96.2	Very high	95.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.5	-48.8	176.1	-73.8	170.6	0	0	0	110.2	L704 A705 A710 Y711 Y712 Y744 L748 I766 I770 L810	L704-I708 HydrophobicContact CD1-CD1 3.76Å; L704-I708 HydrophobicContact CD1-CG1 4.17Å; L704-I708 HydrophobicContact CG-CD1 3.74Å; L704-I708 WeakPolarHBondContact O-CB 3.35Å; L704-I708 WeakPolarHBondContact O-CD1 3.43Å; L704-I708 WeakPolarHBondContact O-CG1 3.46Å; L704-I708 PolarHBondContact O-N 3.42Å; A705-I708 PolarHBondContact O-N 3.35Å; I708-A710 PolarHBondContact O-N 3.45Å; I708-Y711 WeakPolarHBondContact O-CB 3.19Å; I708-Y711 PolarHBondContact O-N 3.38Å; I708-Y712 HydrophobicContact CG2-CD2 3.76Å; I708-Y712 HydrophobicContact CG2-CE2 3.83Å; I708-Y712 VanDerWaalsContact O-CD2 3.3Å; I708-Y712 WeakPolarHBondContact O-CD2 3.36Å; I708-Y712 PolarHBondContact O-N 3.07Å; I708-Y744 HydrophobicContact CD1-CD1 4.1Å; I708-Y744 HydrophobicContact CD1-CG 4.27Å; I708-Y744 HydrophobicContact CG1-CD1 3.57Å; I708-Y744 HydrophobicContact CG1-CD2 4.07Å; I708-Y744 HydrophobicContact CG1-CE1 4Å; I708-Y744 HydrophobicContact CG1-CE2 4.46Å; I708-Y744 HydrophobicContact CG1-CG 3.61Å; I708-L748 HydrophobicContact CD1-CD2 3.92Å; I708-L748 HydrophobicContact CD1-CG 4.23Å; I708-L748 HydrophobicContact CG2-CD1 4.43Å; I708-L748 HydrophobicContact CG2-CD2 4.48Å; I708-I766 HydrophobicContact CD1-CD1 4.19Å; I708-I766 HydrophobicContact CD1-CG2 4.28Å; I708-I770 HydrophobicContact CB-CD1 4.26Å; I708-I770 HydrophobicContact CG2-CD1 3.58Å; I708-L810 HydrophobicContact CG2-CD2 4.27Å
709	F	96.8	Very high	95.5	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.009	12%	0.122	C	C	.	.	H	α-helix	trans	-61.1	-46.7	178.4	-178.8	-104.6	0	0	0	111.4	A705 Y711 Y712 K713 I770 A773 M774 T806 L810 Y884 Y885	A705-F709 WeakPolarHBondContact O-CB 3.48Å; A705-F709 PolarHBondContact O-N 3.46Å; F709-Y711 VanDerWaalsContact C-N 3.31Å; F709-Y711 PolarHBondContact O-N 3.27Å; F709-Y712 PolarHBondContact O-N 3.06Å; F709-K713 WeakPolarHBondContact O-CB 3.49Å; F709-K713 PolarHBondContact O-N 3.47Å; F709-I770 HydrophobicContact CB-CG1 4.44Å; F709-I770 HydrophobicContact CD2-CG2 4.26Å; F709-A773 HydrophobicContact CD1-CB 3.87Å; F709-A773 HydrophobicContact CD2-CB 3.89Å; F709-A773 HydrophobicContact CE1-CB 3.94Å; F709-A773 HydrophobicContact CE2-CB 3.95Å; F709-A773 HydrophobicContact CG-CB 3.84Å; F709-A773 HydrophobicContact CZ-CB 3.97Å; F709-M774 HydrophobicContact CE2-CG 3.92Å; F709-M774 HydrophobicContact CE2-SD 3.67Å; F709-M774 HydrophobicContact CZ-SD 4.39Å; F709-T806 HydrophobicContact CE2-CG2 4.36Å; F709-L810 HydrophobicContact CD2-CD1 4.22Å; F709-Y884 AromaticContact CD1-CD2 3.81Å; F709-Y884 HydrophobicContact CD1-CD2 3.81Å; F709-Y884 HydrophobicContact CD1-CE2 4.4Å; F709-Y884 HydrophobicContact CE1-CD2 4.04Å; F709-Y884 WeakPolarHBondContact CE1-O 3.4Å; F709-Y885 HydrophobicContact CE1-CD1 4.06Å; F709-Y885 HydrophobicContact CE1-CE1 4.28Å
710	A	95.8	Very high	95.5	Very high	20 Å²	20	24.1 Å²	24.1	17%	0.165	12%	0.122	C	C	.	.	H	α-helix	trans	-60.9	-39.1	177.1	0	0	0	0	0	112.7	D706 Q707 I708 A714 Y884	D706-A710 WeakPolarHBondContact O-CB 3.36Å; D706-A710 PolarHBondContact O-N 3.48Å; Q707-A710 PolarHBondContact O-N 3.36Å; I708-A710 PolarHBondContact O-N 3.45Å; A710-A714 VanDerWaalsContact O-CB 3.28Å; A710-A714 WeakPolarHBondContact O-CB 3.23Å; A710-A714 PolarHBondContact O-N 3.18Å; A710-Y884 HydrophobicContact CB-CD1 4.37Å; A710-Y884 HydrophobicContact CB-CG 4Å
711	Y	95.6	Very high	95.4	Very high	28 Å²	28	24.2 Å²	24.2	11%	0.11	12%	0.123	C	C	.	.	H	α-helix	trans	-62.5	-54.3	176.8	172.4	-104.7	0	0	0	112	Q707 I708 F709 K713 A714 M715 P740 N742 Y744	Q707-Y711 WeakPolarHBondContact O-CB 3.49Å; Q707-Y711 PolarHBondContact O-N 2.95Å; I708-Y711 WeakPolarHBondContact O-CB 3.19Å; I708-Y711 PolarHBondContact O-N 3.38Å; F709-Y711 VanDerWaalsContact C-N 3.31Å; F709-Y711 PolarHBondContact O-N 3.27Å; Y711-K713 VanDerWaalsContact C-N 3.32Å; Y711-K713 PolarHBondContact O-N 3.17Å; Y711-A714 PolarHBondContact O-N 3.15Å; Y711-M715 HydrophobicContact CD1-CE 4.5Å; Y711-M715 HydrophobicContact CE1-CE 3.55Å; Y711-M715 HydrophobicContact CE2-CE 4.11Å; Y711-M715 WeakPolarHBondContact O-CB 3.4Å; Y711-M715 PolarHBondContact O-N 2.7Å; Y711-M715 WeakPolarHBondContact OH-CE 3.28Å; Y711-P740 VanDerWaalsContact CE2-O 3.27Å; Y711-P740 WeakPolarHBondContact CE2-O 3.38Å; Y711-N742 HydrophobicContact CD2-CB 4.25Å; Y711-N742 HydrophobicContact CE2-CB 3.93Å; Y711-N742 PolarHBondContact OH-N 3.01Å; Y711-Y744 AromaticContact CD1-CD2 3.85Å; Y711-Y744 HydrophobicContact CD1-CD2 3.85Å; Y711-Y744 AromaticContact CD1-CE2 3.95Å; Y711-Y744 HydrophobicContact CD1-CE2 3.95Å; Y711-Y744 HydrophobicContact CD2-CE2 4.31Å; Y711-Y744 HydrophobicContact CE1-CD2 4.28Å; Y711-Y744 HydrophobicContact CG-CD2 4.18Å; Y711-Y744 AromaticContact CG-CE2 3.78Å; Y711-Y744 HydrophobicContact CG-CE2 3.78Å
712	Y	96.1	Very high	95.4	Very high	13 Å²	13	28.3 Å²	28.3	5%	0.051	14%	0.144	C	C	.	.	H	α-helix	trans	-68.5	-31	-179.1	-75.2	-71.7	0	0	0	112.5	I708 F709 M715 A716 L748 L809 L810 H813	I708-Y712 HydrophobicContact CG2-CD2 3.76Å; I708-Y712 HydrophobicContact CG2-CE2 3.83Å; I708-Y712 VanDerWaalsContact O-CD2 3.3Å; I708-Y712 WeakPolarHBondContact O-CD2 3.36Å; I708-Y712 PolarHBondContact O-N 3.07Å; F709-Y712 PolarHBondContact O-N 3.06Å; Y712-M715 HydrophobicContact CD1-SD 4.44Å; Y712-M715 PolarHBondContact O-N 3.43Å; Y712-A716 WeakPolarHBondContact O-CB 3.33Å; Y712-A716 PolarHBondContact O-N 3.06Å; Y712-L748 HydrophobicContact CE2-CD1 4.16Å; Y712-L809 HydrophobicContact CD1-CB 3.82Å; Y712-L809 HydrophobicContact CD1-CD1 4.4Å; Y712-L809 HydrophobicContact CE1-CB 4.42Å; Y712-L810 HydrophobicContact CD2-CD2 3.47Å; Y712-L810 VanDerWaalsContact CD2-CD2 3.47Å; Y712-L810 HydrophobicContact CD2-CG 4.41Å; Y712-L810 HydrophobicContact CE2-CD2 4.16Å; Y712-L810 HydrophobicContact CG-CD2 3.88Å; Y712-L810 HydrophobicContact CG-CG 4.36Å; Y712-H813 AromaticContact CZ-CD2 3.98Å; Y712-H813 PolarHBondContact OH-CD2 2.97Å; Y712-H813 VanDerWaalsContact OH-CD2 3.31Å; Y712-H813 PolarHBondContact OH-NE2 2.88Å
713	K	96.4	Very high	95.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.7	-50.4	170.8	-177.9	75.1	75.7	112.1	0	111.7	F709 Y711 M715 A716 G717 S777 I802 N803 T806 Y884 Y885 L886	F709-K713 WeakPolarHBondContact O-CB 3.49Å; F709-K713 PolarHBondContact O-N 3.47Å; Y711-K713 VanDerWaalsContact C-N 3.32Å; Y711-K713 PolarHBondContact O-N 3.17Å; K713-M715 PolarHBondContact O-N 2.91Å; K713-A716 PolarHBondContact O-N 2.88Å; K713-G717 PolarHBondContact O-N 3.41Å; K713-S777 PolarHBondContact NZ-OG 3.07Å; K713-I802 HydrophobicContact CD-CG2 3.87Å; K713-N803 WeakPolarHBondContact CE-OD1 3.31Å; K713-N803 PolarHBondContact NZ-OD1 3.06Å; K713-T806 HydrophobicContact CB-CG2 4.28Å; K713-T806 HydrophobicContact CD-CG2 4.39Å; K713-Y884 VanDerWaalsContact CE-O 3.32Å; K713-Y884 WeakPolarHBondContact CE-O 3.32Å; K713-Y884 VanDerWaalsContact CG-O 3.31Å; K713-Y884 WeakPolarHBondContact CG-O 3.22Å; K713-Y885 PolarHBondContact NZ-O 3.37Å; K713-L886 WeakPolarHBondContact CD-O 3.2Å; K713-L886 PolarHBondContact NZ-O 3.09Å
714	A	95.2	Very high	95.2	Very high	13 Å²	13	34 Å²	34	11%	0.107	17%	0.167	C	C	.	.	H	α-helix	trans	-62.8	-33.3	179.1	0	0	0	0	0	111.8	A710 Y711 S718 P739	A710-A714 VanDerWaalsContact O-CB 3.28Å; A710-A714 WeakPolarHBondContact O-CB 3.23Å; A710-A714 PolarHBondContact O-N 3.18Å; Y711-A714 PolarHBondContact O-N 3.15Å; A714-S718 WeakPolarHBondContact O-CB 3.26Å; A714-S718 PolarHBondContact O-N 3.35Å; A714-S718 PolarHBondContact O-OG 3.48Å; A714-P739 HydrophobicContact CB-CB 4.29Å
715	M	95	Very high	95.1	Very high	48 Å²	48	36 Å²	36	24%	0.236	18%	0.176	C	C	.	.	H	α-helix	trans	-63.7	-51.5	171.3	-175.1	-178.7	-68.4	0	0	111.3	Y711 Y712 K713 G717 S718 V719 L809	Y711-M715 HydrophobicContact CD1-CE 4.5Å; Y711-M715 HydrophobicContact CE1-CE 3.55Å; Y711-M715 HydrophobicContact CE2-CE 4.11Å; Y711-M715 WeakPolarHBondContact O-CB 3.4Å; Y711-M715 PolarHBondContact O-N 2.7Å; Y711-M715 WeakPolarHBondContact OH-CE 3.28Å; Y712-M715 HydrophobicContact CD1-SD 4.44Å; Y712-M715 PolarHBondContact O-N 3.43Å; K713-M715 PolarHBondContact O-N 2.91Å; M715-G717 PolarHBondContact O-N 3.34Å; M715-S718 PolarHBondContact O-N 3.49Å; M715-V719 HydrophobicContact CG-CG2 4.35Å; M715-V719 VanDerWaalsContact O-CG2 3.3Å; M715-V719 WeakPolarHBondContact O-CG2 3.31Å; M715-V719 PolarHBondContact O-N 3.37Å; M715-L809 HydrophobicContact CB-CD1 4.39Å; M715-L809 HydrophobicContact CG-CD1 4.13Å; M715-L809 HydrophobicContact SD-CD1 4Å
716	A	95.9	Very high	94.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57.9	-49.4	178	0	0	0	0	0	111.9	Y712 K713 S718 V719 L720 I802 L805 T806 L809	Y712-A716 WeakPolarHBondContact O-CB 3.33Å; Y712-A716 PolarHBondContact O-N 3.06Å; K713-A716 PolarHBondContact O-N 2.88Å; A716-S718 PolarHBondContact O-N 2.93Å; A716-V719 PolarHBondContact O-N 3.46Å; A716-L720 PolarHBondContact O-N 2.99Å; A716-L720 VanDerWaalsContact O-N 3.11Å; A716-I802 HydrophobicContact CB-CG2 4.24Å; A716-L805 HydrophobicContact CB-CB 4.09Å; A716-L805 HydrophobicContact CB-CD2 3.99Å; A716-L805 HydrophobicContact CB-CG 3.93Å; A716-T806 VanDerWaalsContact CB-OG1 3.25Å; A716-T806 WeakPolarHBondContact CB-OG1 3.38Å; A716-L809 HydrophobicContact CB-CD1 4.22Å
717	G	95.3	Very high	94.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.1	-29.7	175.7	0	0	0	0	0	112.9	K713 M715 L721 Y896	K713-G717 PolarHBondContact O-N 3.41Å; M715-G717 PolarHBondContact O-N 3.34Å; G717-L721 WeakPolarHBondContact O-CB 3.35Å; G717-L721 PolarHBondContact O-N 3.15Å; G717-Y896 WeakPolarHBondContact O-CE2 3.4Å; G717-Y896 PolarHBondContact O-OH 2.86Å
718	S	94.6	Very high	94.8	Very high	4 Å²	4	40.5 Å²	40.5	3%	0.028	20%	0.202	C	C	.	.	H	α-helix	trans	-81.1	-33.9	177.4	-64.7	0	0	0	0	114.3	A714 M715 A716 R726 P739	A714-S718 WeakPolarHBondContact O-CB 3.26Å; A714-S718 PolarHBondContact O-N 3.35Å; A714-S718 PolarHBondContact O-OG 3.48Å; M715-S718 PolarHBondContact O-N 3.49Å; A716-S718 PolarHBondContact O-N 2.93Å; S718-R726 VanDerWaalsContact CA-NH2 3.28Å; S718-R726 PolarHBondContact O-NH2 2.99Å; S718-R726 PolarHBondContact OG-NH2 3.19Å; S718-P739 VanDerWaalsContact OG-CD 3.28Å; S718-P739 WeakPolarHBondContact OG-CD 3.25Å
719	V	94.6	Very high	94.6	Very high	90 Å²	90	41.4 Å²	41.4	55%	0.545	21%	0.209	S	C	.	.	H	α-helix	trans	-67.6	-41.7	176.9	168.4	0	0	0	0	110.9	M715 A716 L805	M715-V719 HydrophobicContact CG-CG2 4.35Å; M715-V719 VanDerWaalsContact O-CG2 3.3Å; M715-V719 WeakPolarHBondContact O-CG2 3.31Å; M715-V719 PolarHBondContact O-N 3.37Å; A716-V719 PolarHBondContact O-N 3.46Å; V719-L805 HydrophobicContact CB-CD2 4.16Å; V719-L805 HydrophobicContact CG1-CD2 4.03Å
720	L	94.9	Very high	94.3	Very high	55 Å²	55	48.2 Å²	48.2	29%	0.288	24%	0.238	S	C	.	.	H	α-helix	trans	-82.7	-13.5	-178.7	-66.7	174.8	0	0	0	114	A716 D722 E801 I802 L805 Y896	A716-L720 PolarHBondContact O-N 2.99Å; A716-L720 VanDerWaalsContact O-N 3.11Å; L720-D722 PolarHBondContact O-N 2.87Å; L720-E801 HydrophobicContact CD1-CG 4.39Å; L720-I802 HydrophobicContact CD1-CB 4.49Å; L720-I802 HydrophobicContact CD1-CG1 3.75Å; L720-L805 HydrophobicContact CD1-CB 4.14Å; L720-L805 HydrophobicContact CD1-CD2 3.77Å; L720-L805 HydrophobicContact CD2-CD2 4.1Å; L720-L805 HydrophobicContact CG-CD2 3.62Å; L720-Y896 VanDerWaalsContact C-OH 3.31Å
721	L	94.7	Very high	94.3	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	27%	0.265	C	S	.	.	S	Bend	trans	-68.4	131.1	179.7	-173	63.9	0	0	0	110.3	G717 K723 F725 R726 I736 L892 A895 Y896 I899	G717-L721 WeakPolarHBondContact O-CB 3.35Å; G717-L721 PolarHBondContact O-N 3.15Å; L721-K723 PolarHBondContact O-N 3.32Å; L721-F725 HydrophobicContact CD1-CD1 4.35Å; L721-R726 HydrophobicContact CD2-CG 3.78Å; L721-R726 VanDerWaalsContact CD2-CZ 3.48Å; L721-R726 HydrophobicContact CG-CG 4.15Å; L721-I736 HydrophobicContact CD2-CD1 4.02Å; L721-I736 HydrophobicContact CD2-CG2 4.21Å; L721-L892 HydrophobicContact CD2-CD2 4.02Å; L721-A895 HydrophobicContact CD1-CB 4.26Å; L721-A895 HydrophobicContact CD2-CB 4.18Å; L721-Y896 WeakPolarHBondContact CA-OH 3.43Å; L721-Y896 HydrophobicContact CD1-CD1 4.34Å; L721-Y896 HydrophobicContact CD1-CE1 4Å; L721-Y896 HydrophobicContact CD1-CE2 4.15Å; L721-Y896 PolarHBondContact N-OH 3.01Å; L721-I899 HydrophobicContact CD1-CD1 3.59Å
722	D	94.4	Very high	94.1	Very high	87 Å²	87	61.7 Å²	61.7	47%	0.465	30%	0.296	S	S	.	.			trans	-53.4	127.8	-177.1	178	54.5	0	0	0	112.4	L720 R724 F725 R726	L720-D722 PolarHBondContact O-N 2.87Å; D722-R724 VanDerWaalsContact C-N 3.33Å; D722-R724 PolarHBondContact O-N 2.66Å; D722-R724 WeakPolarHBondContact OD2-CB 3.45Å; D722-R724 PolarHBondContact OD2-N 3.04Å; D722-F725 HydrophobicContact CB-CB 3.99Å; D722-F725 WeakPolarHBondContact OD2-CB 3.43Å; D722-F725 PolarHBondContact OD2-N 3.37Å; D722-R726 PolarHBondContact O-N 2.83Å; D722-R726 VanDerWaalsContact O-N 3.15Å
723	K	93.6	Very high	93.9	Very high	124 Å²	124	64 Å²	64	54%	0.539	33%	0.325	S	S	.	.	H	α-helix	trans	-68.5	-35.1	-174.8	-66.6	-75.2	178.8	-178	0	111.2	L721 A727 Y738	L721-K723 PolarHBondContact O-N 3.32Å; K723-A727 PolarHBondContact O-N 3.36Å; K723-A727 VanDerWaalsContact O-N 3.16Å; K723-Y738 PolarHBondContact NZ-OH 2.73Å
724	R	94.1	Very high	93.6	Very high	177 Å²	177	68.2 Å²	68.2	67%	0.668	35%	0.35	S	S	*	.	H	α-helix	trans	-70.3	-45.8	179	178	179.3	175.8	169.4	1.5	110.8	D722 R726 A727 E728	D722-R724 VanDerWaalsContact C-N 3.33Å; D722-R724 PolarHBondContact O-N 2.66Å; D722-R724 WeakPolarHBondContact OD2-CB 3.45Å; D722-R724 PolarHBondContact OD2-N 3.04Å; R724-R726 VanDerWaalsContact C-N 3.32Å; R724-R726 PolarHBondContact O-N 2.94Å; R724-A727 WeakPolarHBondContact O-CB 3.43Å; R724-A727 PolarHBondContact O-N 3.25Å; R724-E728 HydrophobicContact CG-CG 4.47Å; R724-E728 IonicContact CZ-OE1 3.2Å; R724-E728 IonicContact NE-OE1 3.09Å; R724-E728 PolarHBondContact NE-OE1 3.29Å; R724-E728 IonicContact NH2-OE1 3.99Å; R724-E728 PolarHBondContact NH2-OE1 3.17Å; R724-E728 PolarHBondContact O-N 3.46Å
725	F	92.6	Very high	93.2	Very high	42 Å²	42	73.8 Å²	73.8	18%	0.184	38%	0.376	C	S	.	.	H	α-helix	trans	-54.2	-47.2	174.1	-179.1	-100	0	0	0	111.6	L721 D722 A727 E728 C729 I736 A895 I899	L721-F725 HydrophobicContact CD1-CD1 4.35Å; D722-F725 HydrophobicContact CB-CB 3.99Å; D722-F725 WeakPolarHBondContact OD2-CB 3.43Å; D722-F725 PolarHBondContact OD2-N 3.37Å; F725-A727 VanDerWaalsContact C-N 3.32Å; F725-A727 PolarHBondContact O-N 3.41Å; F725-E728 PolarHBondContact O-N 3.14Å; F725-C729 VanDerWaalsContact CE1-SG 3.55Å; F725-C729 VanDerWaalsContact CZ-SG 3.58Å; F725-C729 PolarHBondContact O-N 3.36Å; F725-C729 PolarHBondContact O-SG 2.66Å; F725-I736 HydrophobicContact CD1-CD1 4.23Å; F725-I736 HydrophobicContact CE1-CD1 3.81Å; F725-A895 HydrophobicContact CE1-CB 3.88Å; F725-I899 HydrophobicContact CD1-CD1 4.17Å; F725-I899 HydrophobicContact CD2-CG1 4.4Å; F725-I899 HydrophobicContact CE1-CD1 4.37Å; F725-I899 HydrophobicContact CE2-CG1 4.34Å; F725-I899 HydrophobicContact CG-CD1 4.32Å; F725-I899 HydrophobicContact CZ-CG1 4.43Å
726	R	92.1	Very high	93	Very high	19 Å²	19	72.4 Å²	72.4	7%	0.072	37%	0.37	C	S	.	.	H	α-helix	trans	-58.3	-41.7	174.7	-75.5	-175.2	179.4	-90.8	-3.7	113	S718 L721 D722 R724 K730 I736	S718-R726 VanDerWaalsContact CA-NH2 3.28Å; S718-R726 PolarHBondContact O-NH2 2.99Å; S718-R726 PolarHBondContact OG-NH2 3.19Å; L721-R726 HydrophobicContact CD2-CG 3.78Å; L721-R726 VanDerWaalsContact CD2-CZ 3.48Å; L721-R726 HydrophobicContact CG-CG 4.15Å; D722-R726 PolarHBondContact O-N 2.83Å; D722-R726 VanDerWaalsContact O-N 3.15Å; R724-R726 VanDerWaalsContact C-N 3.32Å; R724-R726 PolarHBondContact O-N 2.94Å; R726-K730 PolarHBondContact O-N 3.11Å; R726-K730 VanDerWaalsContact O-N 3.11Å; R726-I736 PolarHBondContact NH1-O 3.37Å
727	A	93.1	Very high	92.5	Very high	50 Å²	50	76.2 Å²	76.2	41%	0.413	39%	0.394	S	S	.	.	H	α-helix	trans	-67.1	-41.6	178.7	0	0	0	0	0	111.7	K723 R724 F725 K730 N731	K723-A727 PolarHBondContact O-N 3.36Å; K723-A727 VanDerWaalsContact O-N 3.16Å; R724-A727 WeakPolarHBondContact O-CB 3.43Å; R724-A727 PolarHBondContact O-N 3.25Å; F725-A727 VanDerWaalsContact C-N 3.32Å; F725-A727 PolarHBondContact O-N 3.41Å; A727-K730 WeakPolarHBondContact O-CB 3.4Å; A727-K730 PolarHBondContact O-N 3.41Å; A727-N731 VanDerWaalsContact O-CG 3.27Å; A727-N731 PolarHBondContact O-N 3.5Å; A727-N731 PolarHBondContact O-ND2 3.16Å; A727-N731 PolarHBondContact O-OD1 2.79Å
728	E	93.8	Very high	92.1	Very high	76 Å²	76	82.6 Å²	82.6	36%	0.355	42%	0.42	S	S	.	.	H	α-helix	trans	-64.7	-47	176	-71.6	-179.2	-173.3	0	0	111.1	R724 F725 K730 N731 Y732	R724-E728 HydrophobicContact CG-CG 4.47Å; R724-E728 IonicContact CZ-OE1 3.2Å; R724-E728 IonicContact NE-OE1 3.09Å; R724-E728 PolarHBondContact NE-OE1 3.29Å; R724-E728 IonicContact NH2-OE1 3.99Å; R724-E728 PolarHBondContact NH2-OE1 3.17Å; R724-E728 PolarHBondContact O-N 3.46Å; F725-E728 PolarHBondContact O-N 3.14Å; E728-K730 VanDerWaalsContact C-N 3.26Å; E728-K730 PolarHBondContact O-N 3.06Å; E728-N731 WeakPolarHBondContact O-CA 3.32Å; E728-N731 WeakPolarHBondContact O-CB 3.34Å; E728-N731 PolarHBondContact O-N 2.79Å; E728-Y732 WeakPolarHBondContact O-CD2 3.22Å; E728-Y732 PolarHBondContact O-N 2.97Å
729	C	91.6	Very high	91.9	Very high	20 Å²	20	84.2 Å²	84.2	14%	0.135	43%	0.43	C	S	.	.	H	α-helix	trans	-54.6	-43.5	174.2	-68.4	0	0	0	0	112	F725 N731 Y732 G733 V734 I736	F725-C729 VanDerWaalsContact CE1-SG 3.55Å; F725-C729 VanDerWaalsContact CZ-SG 3.58Å; F725-C729 PolarHBondContact O-N 3.36Å; F725-C729 PolarHBondContact O-SG 2.66Å; C729-N731 VanDerWaalsContact C-N 3.32Å; C729-N731 PolarHBondContact O-N 2.87Å; C729-Y732 CarbonylContact O-C 3.6Å; C729-Y732 PolarHBondContact O-N 3.36Å; C729-Y732 VanDerWaalsContact O-N 3.11Å; C729-G733 PolarHBondContact O-N 3.08Å; C729-V734 CarbonylContact C-O 3.6Å; C729-V734 HydrophobicContact CB-CB 4.23Å; C729-V734 VanDerWaalsContact CB-O 3.26Å; C729-V734 WeakPolarHBondContact CB-O 3.27Å; C729-V734 CarbonylContact O-C 3.55Å; C729-V734 WeakPolarHBondContact O-CA 3.39Å; C729-V734 PolarHBondContact O-N 3.17Å; C729-V734 VanDerWaalsContact O-O 3.04Å; C729-I736 HydrophobicContact CB-CD1 4.32Å
730	K	92	Very high	91.7	Very high	144 Å²	144	84.8 Å²	84.8	63%	0.626	44%	0.435	S	S	*	.	H	α-helix	trans	-60.9	-40.4	176.5	-173.6	-178.8	178.7	-176.7	0	112	R726 A727 E728 Y732 G733 V734	R726-K730 PolarHBondContact O-N 3.11Å; R726-K730 VanDerWaalsContact O-N 3.11Å; A727-K730 WeakPolarHBondContact O-CB 3.4Å; A727-K730 PolarHBondContact O-N 3.41Å; E728-K730 VanDerWaalsContact C-N 3.26Å; E728-K730 PolarHBondContact O-N 3.06Å; K730-Y732 VanDerWaalsContact C-N 3.26Å; K730-Y732 PolarHBondContact O-N 3.17Å; K730-G733 PolarHBondContact O-N 3.05Å; K730-V734 PolarHBondContact N-O 3.41Å
731	N	94.2	Very high	91.5	Very high	138 Å²	138	86.5 Å²	86.5	74%	0.738	45%	0.452	S	S	*	.	H	α-helix	trans	-64.7	-31	176.4	-65.6	-17.7	0	0	0	112.3	A727 E728 C729 G733	A727-N731 VanDerWaalsContact O-CG 3.27Å; A727-N731 PolarHBondContact O-N 3.5Å; A727-N731 PolarHBondContact O-ND2 3.16Å; A727-N731 PolarHBondContact O-OD1 2.79Å; E728-N731 WeakPolarHBondContact O-CA 3.32Å; E728-N731 WeakPolarHBondContact O-CB 3.34Å; E728-N731 PolarHBondContact O-N 2.79Å; C729-N731 VanDerWaalsContact C-N 3.32Å; C729-N731 PolarHBondContact O-N 2.87Å; N731-G733 VanDerWaalsContact C-N 3.27Å; N731-G733 PolarHBondContact O-N 3.42Å
732	Y	92.1	Very high	91.5	Very high	193 Å²	193	87.2 Å²	87.2	76%	0.757	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	6.7	173	-69.8	-70.7	0	0	0	114	E728 C729 K730 V734	E728-Y732 WeakPolarHBondContact O-CD2 3.22Å; E728-Y732 PolarHBondContact O-N 2.97Å; C729-Y732 CarbonylContact O-C 3.6Å; C729-Y732 PolarHBondContact O-N 3.36Å; C729-Y732 VanDerWaalsContact O-N 3.11Å; K730-Y732 VanDerWaalsContact C-N 3.26Å; K730-Y732 PolarHBondContact O-N 3.17Å; Y732-V734 VanDerWaalsContact C-N 3.32Å; Y732-V734 PolarHBondContact O-N 2.79Å
733	G	90.9	Very high	91.3	Very high	63 Å²	63	88.8 Å²	88.8	65%	0.649	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	5	-179.6	0	0	0	0	0	115	C729 K730 N731	C729-G733 PolarHBondContact O-N 3.08Å; K730-G733 PolarHBondContact O-N 3.05Å; N731-G733 VanDerWaalsContact C-N 3.27Å; N731-G733 PolarHBondContact O-N 3.42Å
734	V	90.4	Very high	91.4	Very high	88 Å²	88	83.1 Å²	83.1	53%	0.533	43%	0.43	S	S	.	.			trans	-96.9	101.2	176.7	-177.5	0	0	0	0	109.5	C729 K730 Y732	C729-V734 CarbonylContact C-O 3.6Å; C729-V734 HydrophobicContact CB-CB 4.23Å; C729-V734 VanDerWaalsContact CB-O 3.26Å; C729-V734 WeakPolarHBondContact CB-O 3.27Å; C729-V734 CarbonylContact O-C 3.55Å; C729-V734 WeakPolarHBondContact O-CA 3.39Å; C729-V734 PolarHBondContact O-N 3.17Å; C729-V734 VanDerWaalsContact O-O 3.04Å; K730-V734 PolarHBondContact N-O 3.41Å; Y732-V734 VanDerWaalsContact C-N 3.32Å; Y732-V734 PolarHBondContact O-N 2.79Å
735	I	87.4	Confident	91.2	Very high	129 Å²	129	78.6 Å²	78.6	66%	0.662	42%	0.417	S	S	*	.			trans	-88.6	117.1	178.8	-57.5	175	0	0	0	109.3	P737	I735-P737 VanDerWaalsContact O-CD 3.27Å; I735-P737 WeakPolarHBondContact O-CD 3.48Å
736	I	90.4	Very high	91.1	Very high	20 Å²	20	77.4 Å²	77.4	10%	0.103	41%	0.413	C	S	.	.			trans	-90.8	103.6	169.3	-52.8	173.9	0	0	0	107.4	L721 F725 R726 C729 L892 A895	L721-I736 HydrophobicContact CD2-CD1 4.02Å; L721-I736 HydrophobicContact CD2-CG2 4.21Å; F725-I736 HydrophobicContact CD1-CD1 4.23Å; F725-I736 HydrophobicContact CE1-CD1 3.81Å; R726-I736 PolarHBondContact NH1-O 3.37Å; C729-I736 HydrophobicContact CB-CD1 4.32Å; I736-L892 HydrophobicContact CG2-CD2 4.31Å; I736-A895 HydrophobicContact CD1-CB 4.04Å
737	P	86	Confident	91.1	Very high	79 Å²	79	76.5 Å²	76.5	51%	0.513	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-65.4	148.8	-174.4	27.5	-34.4	0	0	0	111.2	I735	I735-P737 VanDerWaalsContact O-CD 3.27Å; I735-P737 WeakPolarHBondContact O-CD 3.48Å
738	Y	87.4	Confident	91	Very high	135 Å²	135	74.1 Å²	74.1	53%	0.529	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-77.1	145.6	162.7	-74.8	-82.7	0	0	0	108.9	K723	K723-Y738 PolarHBondContact NZ-OH 2.73Å
739	P	89.3	Confident	90.9	Very high	37 Å²	37	75.1 Å²	75.1	24%	0.24	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-62.4	134.5	173.2	25.9	-32.7	0	0	0	109.3	A714 S718	A714-P739 HydrophobicContact CB-CB 4.29Å; S718-P739 VanDerWaalsContact OG-CD 3.28Å; S718-P739 WeakPolarHBondContact OG-CD 3.25Å
740	P	90.1	Very high	90.8	Very high	102 Å²	102	74.1 Å²	74.1	66%	0.662	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-62.8	137.6	176.9	26.9	-33.5	0	0	0	109.6	Y711	Y711-P740 VanDerWaalsContact CE2-O 3.27Å; Y711-P740 WeakPolarHBondContact CE2-O 3.38Å
741	S	92	Very high	90.6	Very high	91 Å²	91	73.6 Å²	73.6	64%	0.636	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-63.4	145.7	177.2	-166.3	0	0	0	0	110.8	P656	P656-S741 WeakPolarHBondContact CB-O 3.43Å; P656-S741 WeakPolarHBondContact CG-O 3.39Å
742	N	93.1	Very high	90.2	Very high	17 Å²	17	69.9 Å²	69.9	9%	0.091	36%	0.359	C	S	.	.			trans	-139.8	164.4	-179.3	-150	-41.1	0	0	0	110.8	K654 Y711 Y744	K654-N742 PolarHBondContact O-ND2 3.16Å; Y711-N742 HydrophobicContact CD2-CB 4.25Å; Y711-N742 HydrophobicContact CE2-CB 3.93Å; Y711-N742 PolarHBondContact OH-N 3.01Å; N742-Y744 HydrophobicContact CB-CD2 3.99Å; N742-Y744 HydrophobicContact CB-CE2 3.55Å; N742-Y744 PolarHBondContact ND2-OH 2.98Å
743	R	92.1	Very high	90.1	Very high	120 Å²	120	61 Å²	61	45%	0.453	33%	0.325	S	S	.	.			trans	-116.3	58.1	-168.6	-62.7	-67	-65.1	-173.9	-4.9	112	M659 E660 E745	M659-R743 HydrophobicContact CB-CB 4.5Å; E660-R743 HydrophobicContact CG-CB 3.92Å; E660-R743 IonicContact OE1-CZ 3.72Å; E660-R743 VanDerWaalsContact OE1-CZ 3.22Å; E660-R743 IonicContact OE1-NE 3.82Å; E660-R743 PolarHBondContact OE1-NE 3.05Å; E660-R743 IonicContact OE1-NH2 3.33Å; E660-R743 PolarHBondContact OE1-NH2 3.41Å; R743-E745 VanDerWaalsContact C-N 3.34Å
744	Y	94.1	Very high	89.8	Confident	5 Å²	5	60.7 Å²	60.7	2%	0.02	31%	0.306	C	S	.	.			trans	-81.3	-12	177.3	-60.4	-65.3	0	0	0	114.2	M659 L704 Q707 I708 Y711 N742 T746 L747 L748	M659-Y744 HydrophobicContact CE-CD1 4.41Å; M659-Y744 HydrophobicContact CE-CE1 3.56Å; M659-Y744 HydrophobicContact CG-CD1 3.64Å; M659-Y744 HydrophobicContact CG-CE1 3.76Å; M659-Y744 HydrophobicContact SD-CD1 3.88Å; M659-Y744 HydrophobicContact SD-CE1 3.56Å; M659-Y744 VanDerWaalsContact SD-CE1 3.56Å; L704-Y744 HydrophobicContact CD1-CD1 3.98Å; L704-Y744 HydrophobicContact CD1-CE1 4.07Å; Q707-Y744 HydrophobicContact CG-CE1 3.86Å; Q707-Y744 PolarHBondContact OE1-OH 2.83Å; I708-Y744 HydrophobicContact CD1-CD1 4.1Å; I708-Y744 HydrophobicContact CD1-CG 4.27Å; I708-Y744 HydrophobicContact CG1-CD1 3.57Å; I708-Y744 HydrophobicContact CG1-CD2 4.07Å; I708-Y744 HydrophobicContact CG1-CE1 4Å; I708-Y744 HydrophobicContact CG1-CE2 4.46Å; I708-Y744 HydrophobicContact CG1-CG 3.61Å; Y711-Y744 AromaticContact CD1-CD2 3.85Å; Y711-Y744 HydrophobicContact CD1-CD2 3.85Å; Y711-Y744 AromaticContact CD1-CE2 3.95Å; Y711-Y744 HydrophobicContact CD1-CE2 3.95Å; Y711-Y744 HydrophobicContact CD2-CE2 4.31Å; Y711-Y744 HydrophobicContact CE1-CD2 4.28Å; Y711-Y744 HydrophobicContact CG-CD2 4.18Å; Y711-Y744 AromaticContact CG-CE2 3.78Å; Y711-Y744 HydrophobicContact CG-CE2 3.78Å; N742-Y744 HydrophobicContact CB-CD2 3.99Å; N742-Y744 HydrophobicContact CB-CE2 3.55Å; N742-Y744 PolarHBondContact ND2-OH 2.98Å; Y744-T746 VanDerWaalsContact C-N 3.31Å; Y744-T746 PolarHBondContact O-N 3.2Å; Y744-L747 PolarHBondContact O-N 2.94Å; Y744-L748 WeakPolarHBondContact O-CG 3.26Å; Y744-L748 PolarHBondContact O-N 3.31Å
745	E	90.7	Very high	89.7	Confident	82 Å²	82	56.8 Å²	56.8	38%	0.383	28%	0.283	S	S	.	.	H	α-helix	trans	-61.6	-36.7	-170.9	-59.7	-174.1	176.4	0	0	113.3	R743 K749 H813	R743-E745 VanDerWaalsContact C-N 3.34Å; E745-K749 VanDerWaalsContact O-CG 3.28Å; E745-K749 WeakPolarHBondContact O-CG 3.28Å; E745-K749 PolarHBondContact O-N 3.3Å; E745-H813 IonicContact OE1-CE1 2.8Å
746	T	89.8	Confident	89.7	Confident	18 Å²	18	51.5 Å²	51.5	11%	0.11	26%	0.255	C	S	.	.	H	α-helix	trans	-69.5	-42.1	178.9	52.2	0	0	0	0	111.4	P27 E660 Y744 K749 Q750	P27-T746 HydrophobicContact CB-CG2 4.26Å; P27-T746 HydrophobicContact CG-CG2 4.29Å; E660-T746 HydrophobicContact CG-CG2 4.28Å; Y744-T746 VanDerWaalsContact C-N 3.31Å; Y744-T746 PolarHBondContact O-N 3.2Å; T746-K749 PolarHBondContact O-N 3.03Å; T746-Q750 PolarHBondContact O-NE2 2.75Å
747	L	91.8	Very high	89.4	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.5	-42.3	174.7	-62.9	176.9	0	0	0	111.9	I29 M659 V662 L663 L704 Y744 K749 Q750	I29-L747 HydrophobicContact CD1-CD2 3.85Å; M659-L747 HydrophobicContact CG-CD1 3.73Å; M659-L747 HydrophobicContact SD-CD1 3.74Å; V662-L747 HydrophobicContact CG1-CD1 3.89Å; V662-L747 HydrophobicContact CG1-CD2 3.75Å; V662-L747 HydrophobicContact CG1-CG 4.46Å; L663-L747 HydrophobicContact CD1-CD2 3.81Å; L663-L747 HydrophobicContact CD2-CD2 4.31Å; L663-L747 HydrophobicContact CG-CD2 3.8Å; L704-L747 HydrophobicContact CD1-CD1 3.74Å; L704-L747 HydrophobicContact CD2-CB 4.44Å; L704-L747 HydrophobicContact CD2-CD1 4.03Å; Y744-L747 PolarHBondContact O-N 2.94Å; L747-K749 PolarHBondContact O-N 2.97Å; L747-Q750 PolarHBondContact O-N 3.47Å; L747-Q750 VanDerWaalsContact O-N 3.16Å
748	L	92.8	Very high	89.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.8	-20.8	176.3	-72.9	174	0	0	0	112.9	I708 Y712 Y744 N763 I766 H813 M814	I708-L748 HydrophobicContact CD1-CD2 3.92Å; I708-L748 HydrophobicContact CD1-CG 4.23Å; I708-L748 HydrophobicContact CG2-CD1 4.43Å; I708-L748 HydrophobicContact CG2-CD2 4.48Å; Y712-L748 HydrophobicContact CE2-CD1 4.16Å; Y744-L748 WeakPolarHBondContact O-CG 3.26Å; Y744-L748 PolarHBondContact O-N 3.31Å; L748-N763 WeakPolarHBondContact O-CB 2.96Å; L748-N763 PolarHBondContact O-ND2 3.21Å; L748-I766 HydrophobicContact CD2-CD1 4.13Å; L748-I766 HydrophobicContact CD2-CG2 3.76Å; L748-H813 HydrophobicContact CB-CB 4.07Å; L748-H813 HydrophobicContact CD1-CB 3.81Å; L748-M814 HydrophobicContact CD1-CE 4.23Å; L748-M814 HydrophobicContact CD2-CE 3.63Å
749	K	90.7	Very high	89.5	Confident	96 Å²	96	52.7 Å²	52.7	42%	0.417	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-6.2	177	-73.1	172.7	-177.5	179.8	0	113.8	P27 E745 T746 L747 R751	P27-K749 VanDerWaalsContact CD-CB 3.48Å; P27-K749 HydrophobicContact CG-CB 4.05Å; P27-K749 HydrophobicContact CG-CD 3.8Å; E745-K749 VanDerWaalsContact O-CG 3.28Å; E745-K749 WeakPolarHBondContact O-CG 3.28Å; E745-K749 PolarHBondContact O-N 3.3Å; T746-K749 PolarHBondContact O-N 3.03Å; L747-K749 PolarHBondContact O-N 2.97Å; K749-R751 PolarHBondContact O-N 3.05Å
750	Q	89.4	Confident	89.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.278	C	S	.	.			trans	-73.4	121.5	-179.4	-57.7	-52.3	-61.2	0	0	111	P27 I29 E30 L663 T746 L747 V753 L762 N763	P27-Q750 PolarHBondContact O-NE2 3.25Å; P27-Q750 VanDerWaalsContact O-NE2 3.08Å; I29-Q750 HydrophobicContact CD1-CG 4.1Å; I29-Q750 HydrophobicContact CG1-CG 4.38Å; I29-Q750 VanDerWaalsContact CG1-NE2 3.32Å; E30-Q750 PolarHBondContact OE1-OE1 3.21Å; L663-Q750 HydrophobicContact CD1-CG 3.86Å; T746-Q750 PolarHBondContact O-NE2 2.75Å; L747-Q750 PolarHBondContact O-N 3.47Å; L747-Q750 VanDerWaalsContact O-N 3.16Å; Q750-V753 HydrophobicContact CB-CG2 3.99Å; Q750-L762 HydrophobicContact CB-CB 4.18Å; Q750-L762 HydrophobicContact CB-CD2 4.31Å; Q750-N763 PolarHBondContact O-N 2.94Å
751	R	87.6	Confident	89.6	Confident	132 Å²	132	49.7 Å²	49.7	50%	0.498	26%	0.258	S	S	.	.	S	Bend	trans	-112.6	-17	-177.6	-56.3	-55	-65.6	-82.4	-4.7	113.5	K749 D761	K749-R751 PolarHBondContact O-N 3.05Å; R751-D761 IonicContact CZ-OD2 3.55Å; R751-D761 IonicContact NE-OD1 3.83Å; R751-D761 PolarHBondContact NE-OD1 3.37Å; R751-D761 IonicContact NE-OD2 3.69Å; R751-D761 PolarHBondContact NE-OD2 3.38Å; R751-D761 IonicContact NH2-OD2 3.87Å; R751-D761 PolarHBondContact NH2-OD2 3.01Å; R751-D761 WeakPolarHBondContact O-CA 3.43Å; R751-D761 WeakPolarHBondContact O-CB 3.44Å
752	H	86.8	Confident	89.6	Confident	61 Å²	61	45.3 Å²	45.3	28%	0.282	23%	0.227	S	C	.	.			trans	-148.4	53.4	-173.9	51	67.1	0	0	0	113.5	D24 Q26 Q754 S759 I760	D24-H752 IonicContact OD2-CD2 3.24Å; D24-H752 IonicContact OD2-CE1 3.57Å; D24-H752 PolarHBondContact OD2-CE1 3.31Å; D24-H752 IonicContact OD2-NE2 3Å; D24-H752 PolarHBondContact OD2-NE2 2.79Å; Q26-H752 PolarHBondContact NE2-CE1 2.86Å; Q26-H752 VanDerWaalsContact NE2-CE1 3.29Å; Q26-H752 PolarHBondContact NE2-ND1 2.92Å; Q26-H752 PolarHBondContact OE1-CD2 3.45Å; Q26-H752 PolarHBondContact OE1-CE1 3.37Å; Q26-H752 VanDerWaalsContact OE1-CE1 3.28Å; Q26-H752 PolarHBondContact OE1-NE2 3.06Å; Q26-H752 VanDerWaalsContact OE1-NE2 3.13Å; H752-Q754 PolarHBondContact O-N 2.9Å; H752-Q754 PolarHBondContact O-NE2 2.92Å; H752-Q754 VanDerWaalsContact O-NE2 3.16Å; H752-S759 WeakPolarHBondContact CA-OG 3.45Å; H752-S759 WeakPolarHBondContact CB-OG 3.37Å; H752-I760 CarbonylContact C-O 3.52Å; H752-I760 WeakPolarHBondContact CA-O 3.47Å
753	V	88.4	Confident	89.7	Confident	6 Å²	6	45.2 Å²	45.2	4%	0.036	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	122.7	177.4	-174	0	0	0	0	110.5	E30 Q750 R758 I760 L762	E30-V753 WeakPolarHBondContact OE1-CA 3.36Å; E30-V753 WeakPolarHBondContact OE1-CB 3.47Å; E30-V753 WeakPolarHBondContact OE1-CG1 3.48Å; E30-V753 VanDerWaalsContact OE1-CG2 3.24Å; E30-V753 WeakPolarHBondContact OE1-CG2 3.19Å; E30-V753 VanDerWaalsContact OE2-CA 3.29Å; E30-V753 WeakPolarHBondContact OE2-CA 3.14Å; Q750-V753 HydrophobicContact CB-CG2 3.99Å; V753-R758 VanDerWaalsContact O-O 3.13Å; V753-I760 HydrophobicContact CB-CB 4.24Å; V753-I760 PolarHBondContact N-O 2.88Å; V753-I760 PolarHBondContact O-N 3.17Å; V753-L762 HydrophobicContact CG2-CB 3.74Å; V753-L762 HydrophobicContact CG2-CD2 4.35Å
754	Q	85.4	Confident	89.8	Confident	57 Å²	57	47 Å²	47	27%	0.266	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	106.8	-176.8	-61.3	-66.2	-29.9	0	0	110.7	E30 P33 N670 H752 R758 S759	E30-Q754 PolarHBondContact OE2-N 3.39Å; P33-Q754 HydrophobicContact CB-CB 4.35Å; P33-Q754 HydrophobicContact CB-CG 3.99Å; N670-Q754 PolarHBondContact ND2-O 3.4Å; H752-Q754 PolarHBondContact O-N 2.9Å; H752-Q754 PolarHBondContact O-NE2 2.92Å; H752-Q754 VanDerWaalsContact O-NE2 3.16Å; Q754-R758 WeakPolarHBondContact CA-O 3.31Å; Q754-S759 PolarHBondContact NE2-OG 3.37Å
755	L	88.9	Confident	89.8	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	122.2	-176.4	-167	65.7	0	0	0	112	L666 V693 F697 G757 R758 I760	L666-L755 HydrophobicContact CD2-CD1 3.91Å; L666-L755 HydrophobicContact CD2-CD2 3.43Å; L666-L755 VanDerWaalsContact CD2-CD2 3.43Å; L666-L755 HydrophobicContact CD2-CG 4.28Å; V693-L755 HydrophobicContact CG1-CD2 3.52Å; V693-L755 HydrophobicContact CG1-CG 4.04Å; F697-L755 HydrophobicContact CD2-CD2 4.04Å; F697-L755 HydrophobicContact CE2-CD2 4.48Å; L755-G757 PolarHBondContact O-N 3.28Å; L755-G757 VanDerWaalsContact O-N 3.16Å; L755-R758 PolarHBondContact N-O 3.18Å; L755-R758 WeakPolarHBondContact O-CB 3.4Å; L755-R758 WeakPolarHBondContact O-CD 3.49Å; L755-R758 PolarHBondContact O-N 2.9Å; L755-I760 HydrophobicContact CB-CD1 4.07Å; L755-I760 HydrophobicContact CD2-CD1 4.27Å
756	L	87.7	Confident	90.1	Very high	17 Å²	17	45.2 Å²	45.2	9%	0.089	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	47	38.7	-174.4	-58.3	-176.4	0	0	0	112.9	Y669 N670 Y686 I689 E690 V693 R758	Y669-L756 WeakPolarHBondContact O-CD2 3.5Å; N670-L756 WeakPolarHBondContact OD1-CA 3.47Å; N670-L756 PolarHBondContact OD1-N 2.85Å; Y686-L756 HydrophobicContact CE2-CD2 4.43Å; I689-L756 HydrophobicContact CG2-CD1 4.36Å; I689-L756 HydrophobicContact CG2-CD2 4.12Å; E690-L756 HydrophobicContact CB-CD1 4.16Å; E690-L756 HydrophobicContact CG-CD1 4.43Å; V693-L756 HydrophobicContact CB-CD1 3.85Å; V693-L756 HydrophobicContact CG1-CD1 4Å; V693-L756 HydrophobicContact CG2-CD1 3.83Å; V693-L756 HydrophobicContact CG2-CG 4.38Å; L756-R758 VanDerWaalsContact C-N 3.31Å; L756-R758 VanDerWaalsContact O-CD 3.24Å; L756-R758 WeakPolarHBondContact O-CD 3.36Å; L756-R758 PolarHBondContact O-N 2.88Å; L756-R758 PolarHBondContact O-NH1 3.43Å
757	G	83	Confident	90.4	Very high	73 Å²	73	45.3 Å²	45.3	75%	0.753	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.9	2.3	-177.7	0	0	0	0	0	115.4	L755	L755-G757 PolarHBondContact O-N 3.28Å; L755-G757 VanDerWaalsContact O-N 3.16Å
758	R	86.8	Confident	90.5	Very high	111 Å²	111	50.3 Å²	50.3	42%	0.419	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	146.8	173.3	-68.2	71.4	171.2	-175	-3.4	109.6	Y686 E690 V753 Q754 L755 L756 I760	Y686-R758 PolarHBondContact OH-NH1 3.21Å; E690-R758 IonicContact OE1-CZ 3.69Å; E690-R758 VanDerWaalsContact OE1-CZ 3.3Å; E690-R758 IonicContact OE1-NH1 3.48Å; E690-R758 PolarHBondContact OE1-NH1 3Å; E690-R758 VanDerWaalsContact OE1-NH1 3.17Å; E690-R758 IonicContact OE1-NH2 2.86Å; E690-R758 PolarHBondContact OE1-NH2 3.45Å; V753-R758 VanDerWaalsContact O-O 3.13Å; Q754-R758 WeakPolarHBondContact CA-O 3.31Å; L755-R758 PolarHBondContact N-O 3.18Å; L755-R758 WeakPolarHBondContact O-CB 3.4Å; L755-R758 WeakPolarHBondContact O-CD 3.49Å; L755-R758 PolarHBondContact O-N 2.9Å; L756-R758 VanDerWaalsContact C-N 3.31Å; L756-R758 VanDerWaalsContact O-CD 3.24Å; L756-R758 WeakPolarHBondContact O-CD 3.36Å; L756-R758 PolarHBondContact O-N 2.88Å; L756-R758 PolarHBondContact O-NH1 3.43Å; R758-I760 HydrophobicContact CB-CG1 4.12Å
759	S	88.8	Confident	90.6	Very high	75 Å²	75	54.5 Å²	54.5	52%	0.524	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	112.3	166.1	-175.8	0	0	0	0	108.9	H752 Q754	H752-S759 WeakPolarHBondContact CA-OG 3.45Å; H752-S759 WeakPolarHBondContact CB-OG 3.37Å; Q754-S759 PolarHBondContact NE2-OG 3.37Å
760	I	89.3	Confident	90.9	Very high	34 Å²	34	50 Å²	50	17%	0.174	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.7	-172.8	-51.7	174	0	0	0	110.6	F697 H752 V753 L755 R758 L762 L765	F697-I760 HydrophobicContact CD1-CD1 4.47Å; F697-I760 HydrophobicContact CE1-CD1 3.98Å; F697-I760 HydrophobicContact CE1-CG2 3.8Å; F697-I760 HydrophobicContact CE2-CD1 4.23Å; F697-I760 HydrophobicContact CZ-CB 4.39Å; F697-I760 HydrophobicContact CZ-CD1 3.86Å; F697-I760 HydrophobicContact CZ-CG2 3.65Å; H752-I760 CarbonylContact C-O 3.52Å; H752-I760 WeakPolarHBondContact CA-O 3.47Å; V753-I760 HydrophobicContact CB-CB 4.24Å; V753-I760 PolarHBondContact N-O 2.88Å; V753-I760 PolarHBondContact O-N 3.17Å; L755-I760 HydrophobicContact CB-CD1 4.07Å; L755-I760 HydrophobicContact CD2-CD1 4.27Å; R758-I760 HydrophobicContact CB-CG1 4.12Å; I760-L762 PolarHBondContact O-N 3.03Å; I760-L762 VanDerWaalsContact O-N 3.09Å; I760-L765 HydrophobicContact CG2-CD1 3.64Å
761	D	92.1	Very high	91.2	Very high	42 Å²	42	50.9 Å²	50.9	23%	0.225	25%	0.253	C	S	.	.			trans	-80.3	89.9	171.7	-168.6	-22	0	0	0	110.4	R751 N763 R764 L765	R751-D761 IonicContact CZ-OD2 3.55Å; R751-D761 IonicContact NE-OD1 3.83Å; R751-D761 PolarHBondContact NE-OD1 3.37Å; R751-D761 IonicContact NE-OD2 3.69Å; R751-D761 PolarHBondContact NE-OD2 3.38Å; R751-D761 IonicContact NH2-OD2 3.87Å; R751-D761 PolarHBondContact NH2-OD2 3.01Å; R751-D761 WeakPolarHBondContact O-CA 3.43Å; R751-D761 WeakPolarHBondContact O-CB 3.44Å; D761-N763 VanDerWaalsContact C-N 3.35Å; D761-N763 WeakPolarHBondContact OD1-CB 3.26Å; D761-N763 PolarHBondContact OD1-N 3.23Å; D761-R764 HydrophobicContact CB-CB 3.85Å; D761-R764 VanDerWaalsContact CG-CB 3.48Å; D761-R764 WeakPolarHBondContact O-CB 3.43Å; D761-R764 PolarHBondContact O-N 3.28Å; D761-R764 PolarHBondContact OD1-N 3.49Å; D761-L765 WeakPolarHBondContact O-CG 3.42Å; D761-L765 PolarHBondContact O-N 3.49Å
762	L	93.3	Very high	91.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.8	-39.2	179.4	-178.7	61.4	0	0	0	111.8	L663 F697 F700 V701 L704 Q750 V753 I760 R764 L765 I766	L663-L762 HydrophobicContact CD2-CD2 4.49Å; F697-L762 HydrophobicContact CZ-CD1 4.41Å; F700-L762 HydrophobicContact CD1-CD1 4.44Å; F700-L762 HydrophobicContact CE1-CD1 3.9Å; F700-L762 HydrophobicContact CE1-CD2 4.06Å; V701-L762 HydrophobicContact CG2-CD1 4.08Å; L704-L762 HydrophobicContact CD2-CD2 4.32Å; Q750-L762 HydrophobicContact CB-CB 4.18Å; Q750-L762 HydrophobicContact CB-CD2 4.31Å; V753-L762 HydrophobicContact CG2-CB 3.74Å; V753-L762 HydrophobicContact CG2-CD2 4.35Å; I760-L762 PolarHBondContact O-N 3.03Å; I760-L762 VanDerWaalsContact O-N 3.09Å; L762-R764 VanDerWaalsContact C-N 3.31Å; L762-R764 PolarHBondContact O-N 3.13Å; L762-L765 PolarHBondContact O-N 3.26Å; L762-I766 HydrophobicContact CD1-CD1 3.94Å; L762-I766 HydrophobicContact CD1-CG1 4.08Å; L762-I766 HydrophobicContact CD2-CD1 4.31Å; L762-I766 HydrophobicContact CG-CD1 3.71Å; L762-I766 HydrophobicContact CG-CG1 4.29Å; L762-I766 WeakPolarHBondContact O-CB 3.5Å; L762-I766 VanDerWaalsContact O-CG1 3.29Å; L762-I766 WeakPolarHBondContact O-CG1 3.24Å; L762-I766 PolarHBondContact O-N 2.79Å
763	N	94.3	Very high	92.1	Very high	15 Å²	15	45 Å²	45	8%	0.08	24%	0.243	C	C	.	.	H	α-helix	trans	-56.1	-46.6	174.6	178.2	-90.7	0	0	0	111	L748 Q750 D761 L765 I766 T767 H813	L748-N763 WeakPolarHBondContact O-CB 2.96Å; L748-N763 PolarHBondContact O-ND2 3.21Å; Q750-N763 PolarHBondContact O-N 2.94Å; D761-N763 VanDerWaalsContact C-N 3.35Å; D761-N763 WeakPolarHBondContact OD1-CB 3.26Å; D761-N763 PolarHBondContact OD1-N 3.23Å; N763-L765 PolarHBondContact O-N 2.71Å; N763-I766 PolarHBondContact O-N 3.42Å; N763-T767 VanDerWaalsContact O-CB 3.28Å; N763-T767 WeakPolarHBondContact O-CB 3.42Å; N763-T767 PolarHBondContact O-N 2.9Å; N763-T767 PolarHBondContact O-OG1 2.83Å; N763-H813 PolarHBondContact ND2-O 3.03Å; N763-H813 VanDerWaalsContact ND2-O 3.09Å
764	R	94.2	Very high	92.5	Very high	156 Å²	156	44.7 Å²	44.7	59%	0.589	24%	0.242	S	C	*	.	H	α-helix	trans	-59.8	-47.6	177.9	177.5	-179.2	171.6	134	-1.4	112	D761 L762 T767 Q768	D761-R764 HydrophobicContact CB-CB 3.85Å; D761-R764 VanDerWaalsContact CG-CB 3.48Å; D761-R764 WeakPolarHBondContact O-CB 3.43Å; D761-R764 PolarHBondContact O-N 3.28Å; D761-R764 PolarHBondContact OD1-N 3.49Å; L762-R764 VanDerWaalsContact C-N 3.31Å; L762-R764 PolarHBondContact O-N 3.13Å; R764-T767 WeakPolarHBondContact O-CB 3.44Å; R764-T767 PolarHBondContact O-N 3.2Å; R764-Q768 WeakPolarHBondContact O-CG 3.37Å; R764-Q768 PolarHBondContact O-N 3.32Å
765	L	95	Very high	93	Very high	51 Å²	51	44.3 Å²	44.3	27%	0.267	24%	0.238	S	C	.	.	H	α-helix	trans	-64.6	-40.9	-178.8	-66.4	176.2	0	0	0	112.2	F697 V701 I760 D761 L762 N763 R769	F697-L765 HydrophobicContact CE1-CD1 3.69Å; F697-L765 HydrophobicContact CZ-CD1 4.22Å; V701-L765 HydrophobicContact CG1-CB 3.85Å; V701-L765 HydrophobicContact CG2-CD1 4.2Å; I760-L765 HydrophobicContact CG2-CD1 3.64Å; D761-L765 WeakPolarHBondContact O-CG 3.42Å; D761-L765 PolarHBondContact O-N 3.49Å; L762-L765 PolarHBondContact O-N 3.26Å; N763-L765 PolarHBondContact O-N 2.71Å; L765-R769 PolarHBondContact O-N 2.77Å
766	I	95.6	Very high	93.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-45.2	174.4	-67.8	170.7	0	0	0	110.3	L704 A705 I708 L748 L762 N763 Q768 R769 I770	L704-I766 HydrophobicContact CD2-CD1 3.8Å; L704-I766 HydrophobicContact CG-CD1 4.23Å; A705-I766 HydrophobicContact CB-CG2 4.43Å; I708-I766 HydrophobicContact CD1-CD1 4.19Å; I708-I766 HydrophobicContact CD1-CG2 4.28Å; L748-I766 HydrophobicContact CD2-CD1 4.13Å; L748-I766 HydrophobicContact CD2-CG2 3.76Å; L762-I766 HydrophobicContact CD1-CD1 3.94Å; L762-I766 HydrophobicContact CD1-CG1 4.08Å; L762-I766 HydrophobicContact CD2-CD1 4.31Å; L762-I766 HydrophobicContact CG-CD1 3.71Å; L762-I766 HydrophobicContact CG-CG1 4.29Å; L762-I766 WeakPolarHBondContact O-CB 3.5Å; L762-I766 VanDerWaalsContact O-CG1 3.29Å; L762-I766 WeakPolarHBondContact O-CG1 3.24Å; L762-I766 PolarHBondContact O-N 2.79Å; N763-I766 PolarHBondContact O-N 3.42Å; I766-Q768 VanDerWaalsContact C-N 3.32Å; I766-Q768 PolarHBondContact O-N 2.81Å; I766-R769 PolarHBondContact O-N 2.94Å; I766-I770 HydrophobicContact CG2-CD1 3.37Å; I766-I770 HydrophobicContact CG2-CG1 4.01Å; I766-I770 WeakPolarHBondContact O-CB 3.41Å; I766-I770 WeakPolarHBondContact O-CG1 3.34Å; I766-I770 PolarHBondContact O-N 2.72Å
767	T	95.8	Very high	93.7	Very high	19 Å²	19	47.7 Å²	47.7	12%	0.117	25%	0.252	C	S	.	.	H	α-helix	trans	-58.3	-42.6	-179.7	-59.5	0	0	0	0	111.7	N763 R764 R769 I770 S771 M814 T815 L816	N763-T767 VanDerWaalsContact O-CB 3.28Å; N763-T767 WeakPolarHBondContact O-CB 3.42Å; N763-T767 PolarHBondContact O-N 2.9Å; N763-T767 PolarHBondContact O-OG1 2.83Å; R764-T767 WeakPolarHBondContact O-CB 3.44Å; R764-T767 PolarHBondContact O-N 3.2Å; T767-R769 PolarHBondContact O-N 2.86Å; T767-I770 PolarHBondContact O-N 2.73Å; T767-S771 VanDerWaalsContact O-CB 3.23Å; T767-S771 WeakPolarHBondContact O-CB 3.32Å; T767-S771 PolarHBondContact O-N 3.07Å; T767-M814 HydrophobicContact CG2-CB 4.45Å; T767-M814 WeakPolarHBondContact OG1-CB 3.46Å; T767-T815 WeakPolarHBondContact CG2-O 3.45Å; T767-L816 HydrophobicContact CG2-CD2 3.98Å
768	Q	95	Very high	94.4	Very high	105 Å²	105	44.2 Å²	44.2	49%	0.491	22%	0.216	S	C	.	.	H	α-helix	trans	-58.3	-46.2	177.2	-72.9	173.6	-11.1	0	0	112	R764 I766 A772	R764-Q768 WeakPolarHBondContact O-CG 3.37Å; R764-Q768 PolarHBondContact O-N 3.32Å; I766-Q768 VanDerWaalsContact C-N 3.32Å; I766-Q768 PolarHBondContact O-N 2.81Å; Q768-A772 PolarHBondContact O-N 3.17Å; Q768-A772 VanDerWaalsContact O-N 3.15Å
769	R	95.4	Very high	94.8	Very high	88 Å²	88	41.6 Å²	41.6	33%	0.332	21%	0.21	S	C	.	.	H	α-helix	trans	-70.9	-40.5	-179.8	-67.4	-179.1	-174.7	-115.1	10.6	112.2	Y702 A705 L765 I766 T767 A772 A773	Y702-R769 VanDerWaalsContact CB-NH1 3.34Å; Y702-R769 VanDerWaalsContact CD2-NH1 3.29Å; A705-R769 HydrophobicContact CB-CB 3.68Å; A705-R769 HydrophobicContact CB-CG 4.36Å; L765-R769 PolarHBondContact O-N 2.77Å; I766-R769 PolarHBondContact O-N 2.94Å; T767-R769 PolarHBondContact O-N 2.86Å; R769-A772 PolarHBondContact O-N 2.99Å; R769-A773 WeakPolarHBondContact O-CB 3.46Å; R769-A773 PolarHBondContact O-N 2.68Å
770	I	96.1	Very high	95.1	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-67.9	-38.6	178.1	-70.9	-178.7	0	0	0	111.3	I708 F709 I766 T767 A773 M774 L810 M814 L816	I708-I770 HydrophobicContact CB-CD1 4.26Å; I708-I770 HydrophobicContact CG2-CD1 3.58Å; F709-I770 HydrophobicContact CB-CG1 4.44Å; F709-I770 HydrophobicContact CD2-CG2 4.26Å; I766-I770 HydrophobicContact CG2-CD1 3.37Å; I766-I770 HydrophobicContact CG2-CG1 4.01Å; I766-I770 WeakPolarHBondContact O-CB 3.41Å; I766-I770 WeakPolarHBondContact O-CG1 3.34Å; I766-I770 PolarHBondContact O-N 2.72Å; T767-I770 PolarHBondContact O-N 2.73Å; I770-A773 PolarHBondContact O-N 3.4Å; I770-M774 WeakPolarHBondContact O-CG 3.15Å; I770-M774 PolarHBondContact O-N 3.33Å; I770-L810 HydrophobicContact CD1-CD2 4.11Å; I770-L810 HydrophobicContact CG2-CD1 3.61Å; I770-L810 HydrophobicContact CG2-CD2 4.14Å; I770-L810 HydrophobicContact CG2-CG 4.38Å; I770-M814 HydrophobicContact CB-SD 4.11Å; I770-M814 HydrophobicContact CD1-CE 3.61Å; I770-M814 HydrophobicContact CD1-SD 3.84Å; I770-M814 HydrophobicContact CG2-SD 3.75Å; I770-L816 HydrophobicContact CG2-CD2 4.4Å
771	S	96.3	Very high	95.3	Very high	20 Å²	20	38.2 Å²	38.2	14%	0.14	19%	0.185	C	C	.	.	H	α-helix	trans	-59.1	-49.8	173.4	-172.7	0	0	0	0	110.4	T767 A773 M774 Y775 M822	T767-S771 VanDerWaalsContact O-CB 3.23Å; T767-S771 WeakPolarHBondContact O-CB 3.32Å; T767-S771 PolarHBondContact O-N 3.07Å; S771-A773 VanDerWaalsContact C-N 3.3Å; S771-A773 PolarHBondContact O-N 3.33Å; S771-M774 WeakPolarHBondContact O-CB 3.48Å; S771-M774 PolarHBondContact O-N 2.99Å; S771-M774 VanDerWaalsContact O-N 3.11Å; S771-Y775 WeakPolarHBondContact O-CD2 3.29Å; S771-Y775 PolarHBondContact O-N 3.5Å; S771-M822 WeakPolarHBondContact OG-CE 3.27Å
772	A	96.1	Very high	95.5	Very high	58 Å²	58	36.2 Å²	36.2	48%	0.479	18%	0.175	S	C	.	.	H	α-helix	trans	-58.9	-39.3	174.8	0	0	0	0	0	112.9	Q768 R769 Y775 K776	Q768-A772 PolarHBondContact O-N 3.17Å; Q768-A772 VanDerWaalsContact O-N 3.15Å; R769-A772 PolarHBondContact O-N 2.99Å; A772-Y775 PolarHBondContact O-N 2.87Å; A772-K776 WeakPolarHBondContact O-CB 3.37Å; A772-K776 PolarHBondContact O-N 3.36Å
773	A	96.3	Very high	95.6	Very high	11 Å²	11	38.2 Å²	38.2	9%	0.091	19%	0.189	C	C	.	.	H	α-helix	trans	-66.2	-37.3	176.1	0	0	0	0	0	112.6	F709 R769 I770 S771 K776 S777 Y885	F709-A773 HydrophobicContact CD1-CB 3.87Å; F709-A773 HydrophobicContact CD2-CB 3.89Å; F709-A773 HydrophobicContact CE1-CB 3.94Å; F709-A773 HydrophobicContact CE2-CB 3.95Å; F709-A773 HydrophobicContact CG-CB 3.84Å; F709-A773 HydrophobicContact CZ-CB 3.97Å; R769-A773 WeakPolarHBondContact O-CB 3.46Å; R769-A773 PolarHBondContact O-N 2.68Å; I770-A773 PolarHBondContact O-N 3.4Å; S771-A773 VanDerWaalsContact C-N 3.3Å; S771-A773 PolarHBondContact O-N 3.33Å; A773-K776 PolarHBondContact O-N 2.98Å; A773-S777 WeakPolarHBondContact O-CB 3.08Å; A773-S777 PolarHBondContact O-N 3.43Å; A773-Y885 HydrophobicContact CB-CE1 4.18Å
774	M	96.9	Very high	95.5	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-48.5	173.4	-81.2	-63.2	-50	0	0	111.7	F709 I770 S771 K776 S777 L778 N803 T806 H807 L810 M822	F709-M774 HydrophobicContact CE2-CG 3.92Å; F709-M774 HydrophobicContact CE2-SD 3.67Å; F709-M774 HydrophobicContact CZ-SD 4.39Å; I770-M774 WeakPolarHBondContact O-CG 3.15Å; I770-M774 PolarHBondContact O-N 3.33Å; S771-M774 WeakPolarHBondContact O-CB 3.48Å; S771-M774 PolarHBondContact O-N 2.99Å; S771-M774 VanDerWaalsContact O-N 3.11Å; M774-K776 VanDerWaalsContact C-N 3.32Å; M774-K776 PolarHBondContact O-N 3.41Å; M774-S777 WeakPolarHBondContact O-CB 3.32Å; M774-S777 PolarHBondContact O-N 3.11Å; M774-L778 WeakPolarHBondContact O-CG 3.36Å; M774-L778 PolarHBondContact O-N 2.72Å; M774-N803 HydrophobicContact CE-CB 4.39Å; M774-T806 HydrophobicContact SD-CG2 4.11Å; M774-H807 HydrophobicContact CE-CB 3.89Å; M774-L810 HydrophobicContact CG-CD1 4.4Å; M774-L810 HydrophobicContact SD-CD1 4.26Å; M774-M822 HydrophobicContact CB-SD 4.08Å
775	Y	96.3	Very high	95.6	Very high	48 Å²	48	32.7 Å²	32.7	19%	0.188	17%	0.167	C	C	.	.	H	α-helix	trans	-56.5	-47.4	174.3	-80.1	-73.6	0	0	0	111.2	S771 A772 S777 L778 D779 D817 M822 E825	S771-Y775 WeakPolarHBondContact O-CD2 3.29Å; S771-Y775 PolarHBondContact O-N 3.5Å; A772-Y775 PolarHBondContact O-N 2.87Å; Y775-S777 VanDerWaalsContact C-N 3.32Å; Y775-S777 PolarHBondContact O-N 3.47Å; Y775-L778 PolarHBondContact O-N 3.04Å; Y775-D779 WeakPolarHBondContact O-CB 3.18Å; Y775-D779 PolarHBondContact O-N 3.32Å; Y775-D817 PolarHBondContact OH-OD2 3.23Å; Y775-M822 HydrophobicContact CD1-CB 4.43Å; Y775-M822 HydrophobicContact CE1-CB 3.92Å; Y775-M822 HydrophobicContact CE1-CG 4.01Å; Y775-M822 HydrophobicContact CE2-CE 3.99Å; Y775-M822 HydrophobicContact CE2-CG 4.18Å; Y775-E825 HydrophobicContact CE1-CB 4.03Å; Y775-E825 HydrophobicContact CE1-CG 4.11Å; Y775-E825 VanDerWaalsContact CE1-OE2 3.27Å; Y775-E825 WeakPolarHBondContact CE1-OE2 3.33Å; Y775-E825 PolarHBondContact OH-OE2 3.08Å
776	K	95.8	Very high	95.5	Very high	94 Å²	94	33.5 Å²	33.5	41%	0.409	17%	0.169	S	C	.	.	H	α-helix	trans	-61.6	-37.6	177.5	-173.6	168.5	179.6	-179.5	0	112.8	A772 A773 M774 H780 Y885	A772-K776 WeakPolarHBondContact O-CB 3.37Å; A772-K776 PolarHBondContact O-N 3.36Å; A773-K776 PolarHBondContact O-N 2.98Å; M774-K776 VanDerWaalsContact C-N 3.32Å; M774-K776 PolarHBondContact O-N 3.41Å; K776-H780 WeakPolarHBondContact CE-NE2 3.49Å; K776-H780 WeakPolarHBondContact CG-NE2 3.27Å; K776-H780 WeakPolarHBondContact O-CB 3.3Å; K776-H780 PolarHBondContact O-CD2 2.87Å; K776-H780 VanDerWaalsContact O-CG 3.22Å; K776-H780 PolarHBondContact O-N 2.89Å; K776-Y885 HydrophobicContact CB-CD1 4.29Å; K776-Y885 HydrophobicContact CB-CE1 4.11Å; K776-Y885 HydrophobicContact CD-CD1 4.26Å; K776-Y885 HydrophobicContact CD-CE1 3.71Å; K776-Y885 HydrophobicContact CG-CD1 4.05Å; K776-Y885 HydrophobicContact CG-CE1 3.95Å
777	S	96.3	Very high	95.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.4	-39.1	174.4	-100.4	0	0	0	0	113.6	K713 A773 M774 Y775 A781 Y885	K713-S777 PolarHBondContact NZ-OG 3.07Å; A773-S777 WeakPolarHBondContact O-CB 3.08Å; A773-S777 PolarHBondContact O-N 3.43Å; M774-S777 WeakPolarHBondContact O-CB 3.32Å; M774-S777 PolarHBondContact O-N 3.11Å; Y775-S777 VanDerWaalsContact C-N 3.32Å; Y775-S777 PolarHBondContact O-N 3.47Å; S777-A781 PolarHBondContact O-N 2.98Å; S777-A781 VanDerWaalsContact O-N 3.16Å; S777-Y885 VanDerWaalsContact OG-CA 3.24Å; S777-Y885 WeakPolarHBondContact OG-CA 3.48Å; S777-Y885 PolarHBondContact OG-O 3.43Å
778	L	96.6	Very high	95.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-71.1	-45.1	177.4	-69	169.6	0	0	0	111	M774 Y775 H780 A781 I782 L800 N803 F819 M822 A826	M774-L778 WeakPolarHBondContact O-CG 3.36Å; M774-L778 PolarHBondContact O-N 2.72Å; Y775-L778 PolarHBondContact O-N 3.04Å; L778-H780 PolarHBondContact O-N 3.03Å; L778-A781 WeakPolarHBondContact O-CB 3.49Å; L778-A781 PolarHBondContact O-N 3.28Å; L778-A781 VanDerWaalsContact O-N 3.16Å; L778-I782 WeakPolarHBondContact O-CG1 3.36Å; L778-I782 PolarHBondContact O-N 3.42Å; L778-I782 VanDerWaalsContact O-N 3.08Å; L778-L800 HydrophobicContact CD2-CD2 3.76Å; L778-N803 HydrophobicContact CD2-CB 3.86Å; L778-F819 HydrophobicContact CD2-CE2 3.97Å; L778-F819 HydrophobicContact CD2-CZ 4.1Å; L778-M822 HydrophobicContact CD1-CB 3.73Å; L778-A826 HydrophobicContact CB-CB 3.71Å
779	D	95.6	Very high	95.1	Very high	56 Å²	56	30.8 Å²	30.8	30%	0.299	16%	0.158	S	C	.	.	H	α-helix	trans	-58.3	-47.8	176.1	-178.9	56.7	0	0	0	111.5	Y775 A781 I782 S783 R836	Y775-D779 WeakPolarHBondContact O-CB 3.18Å; Y775-D779 PolarHBondContact O-N 3.32Å; D779-A781 VanDerWaalsContact C-N 3.3Å; D779-A781 PolarHBondContact O-N 2.84Å; D779-I782 PolarHBondContact O-N 2.77Å; D779-S783 WeakPolarHBondContact O-CB 3.44Å; D779-S783 PolarHBondContact O-N 2.95Å; D779-S783 PolarHBondContact O-OG 3.24Å; D779-R836 IonicContact OD1-CZ 3.16Å; D779-R836 IonicContact OD1-NH1 3.25Å; D779-R836 PolarHBondContact OD1-NH1 2.9Å; D779-R836 IonicContact OD1-NH2 2.74Å
780	H	94.3	Very high	95	Very high	36 Å²	36	26.7 Å²	26.7	17%	0.167	14%	0.143	C	C	.	.	H	α-helix	trans	-63.9	-31.8	176.5	-72.6	-36.4	0	0	0	113.9	K776 L778 R784	K776-H780 WeakPolarHBondContact CE-NE2 3.49Å; K776-H780 WeakPolarHBondContact CG-NE2 3.27Å; K776-H780 WeakPolarHBondContact O-CB 3.3Å; K776-H780 PolarHBondContact O-CD2 2.87Å; K776-H780 VanDerWaalsContact O-CG 3.22Å; K776-H780 PolarHBondContact O-N 2.89Å; L778-H780 PolarHBondContact O-N 3.03Å; H780-R784 VanDerWaalsContact O-CB 3.24Å; H780-R784 WeakPolarHBondContact O-CB 3.44Å; H780-R784 PolarHBondContact O-N 3.4Å; H780-R784 VanDerWaalsContact O-N 3.09Å
781	A	95.3	Very high	95	Very high	2 Å²	2	26.7 Å²	26.7	2%	0.017	14%	0.143	C	C	.	.	H	α-helix	trans	-65.2	-45.2	174.1	0	0	0	0	0	110.9	S777 L778 D779 R784 F785 L796 L799 L800	S777-A781 PolarHBondContact O-N 2.98Å; S777-A781 VanDerWaalsContact O-N 3.16Å; L778-A781 WeakPolarHBondContact O-CB 3.49Å; L778-A781 PolarHBondContact O-N 3.28Å; L778-A781 VanDerWaalsContact O-N 3.16Å; D779-A781 VanDerWaalsContact C-N 3.3Å; D779-A781 PolarHBondContact O-N 2.84Å; A781-R784 PolarHBondContact O-N 3.23Å; A781-F785 PolarHBondContact O-N 3.42Å; A781-L796 HydrophobicContact CB-CD1 4.03Å; A781-L796 WeakPolarHBondContact O-CD1 3.46Å; A781-L799 HydrophobicContact CB-CD2 3.56Å; A781-L799 HydrophobicContact CB-CG 3.92Å; A781-L800 HydrophobicContact CB-CD2 4.42Å
782	I	95.5	Very high	94.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-70.8	-46.3	-179.3	-61.5	170.7	0	0	0	111	L778 D779 R784 F785 E786 F823 A826 N827 R836 I837	L778-I782 WeakPolarHBondContact O-CG1 3.36Å; L778-I782 PolarHBondContact O-N 3.42Å; L778-I782 VanDerWaalsContact O-N 3.08Å; D779-I782 PolarHBondContact O-N 2.77Å; I782-R784 PolarHBondContact O-N 3.46Å; I782-F785 WeakPolarHBondContact O-CA 3.43Å; I782-F785 WeakPolarHBondContact O-CB 3.47Å; I782-F785 PolarHBondContact O-N 3.44Å; I782-E786 PolarHBondContact O-N 2.92Å; I782-F823 HydrophobicContact CD1-CE2 4.38Å; I782-A826 HydrophobicContact CD1-CB 4.11Å; I782-N827 HydrophobicContact CD1-CB 3.85Å; I782-R836 HydrophobicContact CG2-CB 3.83Å; I782-I837 HydrophobicContact CD1-CD1 4.46Å; I782-I837 HydrophobicContact CG1-CD1 4.24Å; I782-I837 HydrophobicContact CG1-CG1 4.33Å; I782-I837 HydrophobicContact CG2-CG1 4.16Å
783	S	94.5	Very high	94.9	Very high	43 Å²	43	23.1 Å²	23.1	30%	0.301	11%	0.114	S	C	.	.	H	α-helix	trans	-60.2	-32.3	176	-71.3	0	0	0	0	112.8	D779 E786 S787 R836	D779-S783 WeakPolarHBondContact O-CB 3.44Å; D779-S783 PolarHBondContact O-N 2.95Å; D779-S783 PolarHBondContact O-OG 3.24Å; S783-E786 WeakPolarHBondContact CA-OE2 3.44Å; S783-E786 PolarHBondContact O-N 2.78Å; S783-S787 PolarHBondContact O-N 3.49Å; S783-R836 PolarHBondContact OG-NH2 3.3Å
784	R	93.3	Very high	94.9	Very high	52 Å²	52	22.9 Å²	22.9	20%	0.196	11%	0.112	C	C	.	.	H	α-helix	trans	-67.9	-39.4	173.6	-176.2	172	178	-172.6	-12.2	111.8	H780 A781 I782 E786 S787 E788 E795 P878	H780-R784 VanDerWaalsContact O-CB 3.24Å; H780-R784 WeakPolarHBondContact O-CB 3.44Å; H780-R784 PolarHBondContact O-N 3.4Å; H780-R784 VanDerWaalsContact O-N 3.09Å; A781-R784 PolarHBondContact O-N 3.23Å; I782-R784 PolarHBondContact O-N 3.46Å; R784-E786 VanDerWaalsContact C-N 3.35Å; R784-S787 PolarHBondContact O-N 2.86Å; R784-S787 PolarHBondContact O-OG 3.26Å; R784-E788 IonicContact CZ-OE1 2.87Å; R784-E788 IonicContact NE-OE1 2.86Å; R784-E788 PolarHBondContact NE-OE1 2.66Å; R784-E788 IonicContact NH2-OE1 4Å; R784-E788 WeakPolarHBondContact O-CG 3.38Å; R784-E795 IonicContact CZ-OE1 2.66Å; R784-E795 IonicContact NE-OE1 3.75Å; R784-E795 IonicContact NH1-OE1 2.73Å; R784-E795 PolarHBondContact NH1-OE1 3.34Å; R784-E795 IonicContact NH2-OE1 2.65Å; R784-E795 PolarHBondContact NH2-OE1 3.24Å; R784-E795 IonicContact NH2-OE2 3.47Å; R784-P878 HydrophobicContact CG-CB 4.43Å
785	F	95.4	Very high	94.8	Very high	3 Å²	3	23.3 Å²	23.3	1%	0.013	11%	0.114	C	C	.	.	H	α-helix	trans	-62.2	-43.1	173.4	177.3	-117.7	0	0	0	111.6	A781 I782 S787 E788 S792 I793 L796 I837 H840 V841	A781-F785 PolarHBondContact O-N 3.42Å; I782-F785 WeakPolarHBondContact O-CA 3.43Å; I782-F785 WeakPolarHBondContact O-CB 3.47Å; I782-F785 PolarHBondContact O-N 3.44Å; F785-S787 PolarHBondContact O-N 3.46Å; F785-E788 PolarHBondContact O-N 2.98Å; F785-S792 WeakPolarHBondContact CD2-OG 3.4Å; F785-S792 WeakPolarHBondContact CE2-OG 3.44Å; F785-I793 HydrophobicContact CD2-CB 4.35Å; F785-I793 HydrophobicContact CD2-CG1 4.49Å; F785-I793 HydrophobicContact CE2-CB 3.58Å; F785-I793 HydrophobicContact CE2-CG1 3.81Å; F785-I793 HydrophobicContact CZ-CB 4.03Å; F785-I793 HydrophobicContact CZ-CD1 4.13Å; F785-I793 HydrophobicContact CZ-CG1 3.84Å; F785-L796 HydrophobicContact CB-CB 4.36Å; F785-L796 HydrophobicContact CB-CD1 4.24Å; F785-L796 HydrophobicContact CB-CD2 3.85Å; F785-L796 HydrophobicContact CB-CG 4.37Å; F785-L796 HydrophobicContact CD1-CD2 3.82Å; F785-L796 HydrophobicContact CD2-CB 4.42Å; F785-L796 HydrophobicContact CD2-CD2 4.19Å; F785-L796 HydrophobicContact CE1-CD2 4.44Å; F785-L796 HydrophobicContact CG-CB 4.5Å; F785-L796 HydrophobicContact CG-CD2 3.69Å; F785-I837 HydrophobicContact CD1-CG2 4.34Å; F785-I837 HydrophobicContact CE1-CG2 3.93Å; F785-H840 HydrophobicContact CD1-CB 4.27Å; F785-H840 AromaticContact CD1-CD2 3.64Å; F785-H840 HydrophobicContact CE1-CB 3.95Å; F785-H840 AromaticContact CE1-CD2 3.46Å; F785-H840 VanDerWaalsContact CE1-CD2 3.46Å; F785-H840 WeakPolarHBondContact CE1-CD2 3.46Å; F785-H840 AromaticContact CZ-CD2 3.74Å; F785-H840 PolarHBondContact O-CD2 3.07Å; F785-H840 VanDerWaalsContact O-CD2 3.3Å; F785-H840 PolarHBondContact O-NE2 3.49Å; F785-V841 HydrophobicContact CE1-CG2 4.02Å; F785-V841 HydrophobicContact CZ-CG2 3.8Å
786	E	94.1	Very high	94.7	Very high	67 Å²	67	21.3 Å²	21.3	31%	0.313	11%	0.106	S	C	.	.	H	α-helix	trans	-60.5	-26.8	176.6	-68.7	171.1	157.4	0	0	113.4	I782 S783 R784 E788 R836 H840	I782-E786 PolarHBondContact O-N 2.92Å; S783-E786 WeakPolarHBondContact CA-OE2 3.44Å; S783-E786 PolarHBondContact O-N 2.78Å; R784-E786 VanDerWaalsContact C-N 3.35Å; E786-E788 VanDerWaalsContact C-N 3.34Å; E786-R836 WeakPolarHBondContact OE1-CB 3.41Å; E786-R836 IonicContact OE1-CZ 3.29Å; E786-R836 IonicContact OE1-NE 3.48Å; E786-R836 PolarHBondContact OE1-NE 3.23Å; E786-R836 IonicContact OE1-NH2 2.61Å; E786-R836 IonicContact OE2-CZ 2.88Å; E786-R836 IonicContact OE2-NE 3.55Å; E786-R836 IonicContact OE2-NH2 3.42Å; E786-R836 PolarHBondContact OE2-NH2 2.98Å; E786-H840 HydrophobicContact CG-CB 4.33Å; E786-H840 PolarHBondContact O-CE1 3.26Å
787	S	92.4	Very high	94.7	Very high	17 Å²	17	18.5 Å²	18.5	12%	0.119	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-5.2	176.1	64.7	0	0	0	0	114.8	S783 R784 F785 D876 P878	S783-S787 PolarHBondContact O-N 3.49Å; R784-S787 PolarHBondContact O-N 2.86Å; R784-S787 PolarHBondContact O-OG 3.26Å; F785-S787 PolarHBondContact O-N 3.46Å; S787-D876 WeakPolarHBondContact CB-O 3.46Å; S787-P878 WeakPolarHBondContact OG-CB 3.32Å
788	E	91.9	Very high	94.5	Very high	29 Å²	29	23.4 Å²	23.4	14%	0.136	11%	0.113	C	C	.	.	S	Bend	trans	-126.7	169.9	-171.2	-64.7	-176	-167.6	0	0	112.1	R784 F785 E786 S792 H840 R904	R784-E788 IonicContact CZ-OE1 2.87Å; R784-E788 IonicContact NE-OE1 2.86Å; R784-E788 PolarHBondContact NE-OE1 2.66Å; R784-E788 IonicContact NH2-OE1 4Å; R784-E788 WeakPolarHBondContact O-CG 3.38Å; F785-E788 PolarHBondContact O-N 2.98Å; E786-E788 VanDerWaalsContact C-N 3.34Å; E788-S792 WeakPolarHBondContact OE2-CB 3.41Å; E788-H840 PolarHBondContact O-NE2 2.86Å; E788-R904 IonicContact OE1-NH2 3.79Å; E788-R904 IonicContact OE2-CZ 2.89Å; E788-R904 IonicContact OE2-NH1 2.85Å; E788-R904 PolarHBondContact OE2-NH1 2.92Å; E788-R904 IonicContact OE2-NH2 3.11Å; E788-R904 PolarHBondContact OE2-NH2 2.88Å
789	D	92.8	Very high	94.4	Very high	22 Å²	22	23.6 Å²	23.6	12%	0.118	11%	0.114	C	C	.	.			trans	-76.8	172.7	179.1	72.1	13	0	0	0	113	T791 S792 E844 R864 R904	D789-T791 PolarHBondContact O-N 3.45Å; D789-T791 WeakPolarHBondContact OD1-CB 3.39Å; D789-T791 PolarHBondContact OD1-N 2.88Å; D789-T791 PolarHBondContact OD1-OG1 3.32Å; D789-S792 WeakPolarHBondContact O-CB 3.25Å; D789-S792 PolarHBondContact O-N 2.97Å; D789-S792 VanDerWaalsContact O-N 3.09Å; D789-S792 PolarHBondContact O-OG 3.11Å; D789-E844 WeakPolarHBondContact CA-OE2 3.43Å; D789-R864 IonicContact OD2-CZ 3.29Å; D789-R864 IonicContact OD2-NH2 3.32Å; D789-R864 PolarHBondContact OD2-NH2 3.11Å; D789-R904 IonicContact OD1-NH1 3.61Å
790	L	94.4	Very high	94.5	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.01	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-55.8	-26.4	-179.1	-174.1	61.7	0	0	0	113.9	S792 I793 V841 E844 L845 F849 I915	L790-S792 PolarHBondContact O-N 3.49Å; L790-I793 WeakPolarHBondContact O-CB 3.21Å; L790-I793 WeakPolarHBondContact O-CG2 3.36Å; L790-I793 PolarHBondContact O-N 3.28Å; L790-V841 HydrophobicContact CD1-CB 4.41Å; L790-V841 HydrophobicContact CD1-CG1 4.07Å; L790-V841 HydrophobicContact CD1-CG2 4.04Å; L790-E844 HydrophobicContact CB-CB 4.16Å; L790-L845 HydrophobicContact CD2-CD2 3.8Å; L790-L845 HydrophobicContact CD2-CG 4.43Å; L790-F849 HydrophobicContact CD2-CB 4.38Å; L790-F849 HydrophobicContact CD2-CD2 4.17Å; L790-F849 HydrophobicContact CD2-CG 4.35Å; L790-I915 HydrophobicContact CD1-CD1 3.99Å; L790-I915 HydrophobicContact CD1-CG1 4.49Å; L790-I915 HydrophobicContact CD2-CD1 4.34Å; L790-I915 HydrophobicContact CG-CD1 4.37Å
791	T	94.8	Very high	94.6	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.006	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-69.3	-23.6	-177.4	74.4	0	0	0	0	112.7	D789 I793 Y853 R904 V907	D789-T791 PolarHBondContact O-N 3.45Å; D789-T791 WeakPolarHBondContact OD1-CB 3.39Å; D789-T791 PolarHBondContact OD1-N 2.88Å; D789-T791 PolarHBondContact OD1-OG1 3.32Å; T791-I793 PolarHBondContact O-N 2.94Å; T791-Y853 WeakPolarHBondContact CG2-OH 3.3Å; T791-R904 WeakPolarHBondContact OG1-CA 3.34Å; T791-R904 VanDerWaalsContact OG1-CD 3.28Å; T791-R904 WeakPolarHBondContact OG1-CD 3.45Å; T791-V907 HydrophobicContact CG2-CG2 3.82Å
792	S	95	Very high	94.6	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.021	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-67.2	-12.7	177	69.8	0	0	0	0	114	F785 E788 D789 L790 V794 E795 L796	F785-S792 WeakPolarHBondContact CD2-OG 3.4Å; F785-S792 WeakPolarHBondContact CE2-OG 3.44Å; E788-S792 WeakPolarHBondContact OE2-CB 3.41Å; D789-S792 WeakPolarHBondContact O-CB 3.25Å; D789-S792 PolarHBondContact O-N 2.97Å; D789-S792 VanDerWaalsContact O-N 3.09Å; D789-S792 PolarHBondContact O-OG 3.11Å; L790-S792 PolarHBondContact O-N 3.49Å; S792-V794 PolarHBondContact O-N 3.16Å; S792-V794 VanDerWaalsContact O-N 3.14Å; S792-E795 WeakPolarHBondContact O-CA 3.18Å; S792-E795 VanDerWaalsContact O-CB 3.27Å; S792-E795 WeakPolarHBondContact O-CB 3.49Å; S792-E795 PolarHBondContact O-N 3.47Å; S792-L796 PolarHBondContact O-N 3.19Å
793	I	96.1	Very high	94.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.9	-29.8	-175.8	-155.6	-179.9	0	0	0	112.8	F785 L790 T791 E795 L796 E797 V841 T914 I915 L918	F785-I793 HydrophobicContact CD2-CB 4.35Å; F785-I793 HydrophobicContact CD2-CG1 4.49Å; F785-I793 HydrophobicContact CE2-CB 3.58Å; F785-I793 HydrophobicContact CE2-CG1 3.81Å; F785-I793 HydrophobicContact CZ-CB 4.03Å; F785-I793 HydrophobicContact CZ-CD1 4.13Å; F785-I793 HydrophobicContact CZ-CG1 3.84Å; L790-I793 WeakPolarHBondContact O-CB 3.21Å; L790-I793 WeakPolarHBondContact O-CG2 3.36Å; L790-I793 PolarHBondContact O-N 3.28Å; T791-I793 PolarHBondContact O-N 2.94Å; I793-E795 VanDerWaalsContact C-N 3.35Å; I793-L796 WeakPolarHBondContact O-CB 3.27Å; I793-L796 PolarHBondContact O-N 3.08Å; I793-E797 PolarHBondContact O-N 3.42Å; I793-V841 HydrophobicContact CD1-CG2 3.82Å; I793-T914 HydrophobicContact CB-CG2 4.46Å; I793-T914 HydrophobicContact CD1-CG2 4.29Å; I793-T914 HydrophobicContact CG1-CG2 3.96Å; I793-T914 HydrophobicContact CG2-CG2 4.1Å; I793-T914 WeakPolarHBondContact O-CG2 3.42Å; I793-I915 HydrophobicContact CD1-CB 4.34Å; I793-I915 HydrophobicContact CD1-CG1 3.51Å; I793-I915 HydrophobicContact CG2-CG1 4.29Å; I793-L918 HydrophobicContact CD1-CD1 4.03Å; I793-L918 HydrophobicContact CG1-CD1 3.87Å
794	V	95.3	Very high	94.8	Very high	5 Å²	5	25.4 Å²	25.4	3%	0.03	11%	0.111	C	C	.	.	H	α-helix	trans	-67	-39.2	174.9	-179.8	0	0	0	0	110.6	S792 L796 E797 W798 Y900 Y903	S792-V794 PolarHBondContact O-N 3.16Å; S792-V794 VanDerWaalsContact O-N 3.14Å; V794-L796 VanDerWaalsContact C-N 3.33Å; V794-E797 PolarHBondContact O-N 2.93Å; V794-W798 VanDerWaalsContact O-CD1 3.27Å; V794-W798 PolarHBondContact O-N 3.39Å; V794-Y900 HydrophobicContact CG1-CD1 4.34Å; V794-Y903 HydrophobicContact CB-CG 4.5Å; V794-Y903 HydrophobicContact CG1-CD1 4.25Å; V794-Y903 HydrophobicContact CG1-CD2 4.32Å; V794-Y903 HydrophobicContact CG1-CE1 4.48Å; V794-Y903 HydrophobicContact CG1-CG 4.16Å; V794-Y903 HydrophobicContact CG2-CD1 4.39Å
795	E	94.6	Very high	95	Very high	10 Å²	10	24 Å²	24	5%	0.047	11%	0.107	C	C	.	.	H	α-helix	trans	-63.4	-41.9	174	-174.8	173.5	173.6	0	0	110.8	R784 S792 I793 W798 L799 Y887 Y900 R904	R784-E795 IonicContact CZ-OE1 2.66Å; R784-E795 IonicContact NE-OE1 3.75Å; R784-E795 IonicContact NH1-OE1 2.73Å; R784-E795 PolarHBondContact NH1-OE1 3.34Å; R784-E795 IonicContact NH2-OE1 2.65Å; R784-E795 PolarHBondContact NH2-OE1 3.24Å; R784-E795 IonicContact NH2-OE2 3.47Å; S792-E795 WeakPolarHBondContact O-CA 3.18Å; S792-E795 VanDerWaalsContact O-CB 3.27Å; S792-E795 WeakPolarHBondContact O-CB 3.49Å; S792-E795 PolarHBondContact O-N 3.47Å; I793-E795 VanDerWaalsContact C-N 3.35Å; E795-W798 PolarHBondContact O-N 3.44Å; E795-L799 WeakPolarHBondContact O-CB 3.34Å; E795-L799 PolarHBondContact O-N 2.89Å; E795-Y887 WeakPolarHBondContact CG-OH 3.44Å; E795-Y887 PolarHBondContact OE1-OH 3.49Å; E795-Y900 HydrophobicContact CB-CD2 4.14Å; E795-Y900 HydrophobicContact CB-CG 4.12Å; E795-Y900 HydrophobicContact CG-CD2 3.75Å; E795-Y900 HydrophobicContact CG-CE2 4.5Å; E795-Y900 HydrophobicContact CG-CG 4.2Å; E795-R904 IonicContact OE2-CZ 3.34Å; E795-R904 IonicContact OE2-NH2 3.83Å; E795-R904 PolarHBondContact OE2-NH2 3.11Å
796	L	95.6	Very high	95.1	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.026	11%	0.107	C	C	.	.	H	α-helix	trans	-59	-49.9	176.2	175.2	67.5	0	0	0	112.1	A781 F785 S792 I793 V794 W798 L799 L800 I837 L918	A781-L796 HydrophobicContact CB-CD1 4.03Å; A781-L796 WeakPolarHBondContact O-CD1 3.46Å; F785-L796 HydrophobicContact CB-CB 4.36Å; F785-L796 HydrophobicContact CB-CD1 4.24Å; F785-L796 HydrophobicContact CB-CD2 3.85Å; F785-L796 HydrophobicContact CB-CG 4.37Å; F785-L796 HydrophobicContact CD1-CD2 3.82Å; F785-L796 HydrophobicContact CD2-CB 4.42Å; F785-L796 HydrophobicContact CD2-CD2 4.19Å; F785-L796 HydrophobicContact CE1-CD2 4.44Å; F785-L796 HydrophobicContact CG-CB 4.5Å; F785-L796 HydrophobicContact CG-CD2 3.69Å; S792-L796 PolarHBondContact O-N 3.19Å; I793-L796 WeakPolarHBondContact O-CB 3.27Å; I793-L796 PolarHBondContact O-N 3.08Å; V794-L796 VanDerWaalsContact C-N 3.33Å; L796-W798 VanDerWaalsContact C-N 3.3Å; L796-W798 PolarHBondContact O-N 2.72Å; L796-L799 PolarHBondContact O-N 2.7Å; L796-L800 HydrophobicContact CD1-CD1 4.12Å; L796-L800 HydrophobicContact CD1-CG 4.06Å; L796-L800 HydrophobicContact CG-CD1 3.97Å; L796-L800 HydrophobicContact CG-CG 4.31Å; L796-L800 VanDerWaalsContact O-CG 3.32Å; L796-L800 WeakPolarHBondContact O-CG 3.24Å; L796-L800 PolarHBondContact O-N 2.92Å; L796-I837 HydrophobicContact CD2-CD1 3.88Å; L796-I837 HydrophobicContact CD2-CG1 3.96Å; L796-I837 HydrophobicContact CD2-CG2 4.22Å; L796-L918 HydrophobicContact CD2-CD1 4.13Å
797	E	94.4	Very high	95.3	Very high	36 Å²	36	21.7 Å²	21.7	17%	0.168	10%	0.097	C	C	.	.	H	α-helix	trans	-55.9	-46.1	-178.3	-177.9	-178	-168	0	0	111.7	I793 V794 L800 E801 T914 R917	I793-E797 PolarHBondContact O-N 3.42Å; V794-E797 PolarHBondContact O-N 2.93Å; E797-L800 WeakPolarHBondContact O-CB 3.47Å; E797-L800 PolarHBondContact O-N 2.98Å; E797-E801 PolarHBondContact O-N 3.23Å; E797-T914 HydrophobicContact CB-CG2 3.57Å; E797-T914 HydrophobicContact CG-CG2 4.13Å; E797-T914 WeakPolarHBondContact OE2-CB 3.21Å; E797-T914 WeakPolarHBondContact OE2-CG2 3.47Å; E797-T914 PolarHBondContact OE2-OG1 2.97Å; E797-R917 WeakPolarHBondContact OE1-CD 3.42Å; E797-R917 IonicContact OE1-CZ 3.31Å; E797-R917 IonicContact OE1-NH1 3.9Å; E797-R917 PolarHBondContact OE1-NH1 3.5Å
798	W	92.6	Very high	95.5	Very high	103 Å²	103	27.6 Å²	27.6	39%	0.39	12%	0.116	S	C	.	.	H	α-helix	trans	-70.8	-35.6	-180	-78.6	104.5	0	0	0	113.1	V794 E795 L796 L800 E801 I802 Y900	V794-W798 VanDerWaalsContact O-CD1 3.27Å; V794-W798 PolarHBondContact O-N 3.39Å; E795-W798 PolarHBondContact O-N 3.44Å; L796-W798 VanDerWaalsContact C-N 3.3Å; L796-W798 PolarHBondContact O-N 2.72Å; W798-L800 VanDerWaalsContact C-N 3.31Å; W798-E801 PolarHBondContact O-N 3.46Å; W798-I802 WeakPolarHBondContact O-CG1 3.24Å; W798-I802 PolarHBondContact O-N 3.09Å; W798-Y900 HydrophobicContact CB-CE1 4.07Å; W798-Y900 HydrophobicContact CB-CE2 4.09Å; W798-Y900 VanDerWaalsContact CB-CZ 3.46Å; W798-Y900 WeakPolarHBondContact CB-OH 3.47Å; W798-Y900 AromaticContact CD1-CE1 3.34Å; W798-Y900 AromaticContact CD1-CZ 3.66Å; W798-Y900 AromaticContact CG-CE1 3.75Å; W798-Y900 HydrophobicContact CG-CE1 3.75Å; W798-Y900 AromaticContact CG-CZ 3.55Å; W798-Y900 AromaticContact NE1-CE1 3.98Å
799	L	95.4	Very high	95.7	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.016	12%	0.116	C	C	.	.	H	α-helix	trans	-64.4	-38.5	173	-176.2	57.2	0	0	0	111.2	A781 E795 L796 I802 N803 L886 Y887	A781-L799 HydrophobicContact CB-CD2 3.56Å; A781-L799 HydrophobicContact CB-CG 3.92Å; E795-L799 WeakPolarHBondContact O-CB 3.34Å; E795-L799 PolarHBondContact O-N 2.89Å; L796-L799 PolarHBondContact O-N 2.7Å; L799-I802 PolarHBondContact O-N 3.3Å; L799-N803 PolarHBondContact O-N 3.28Å; L799-N803 PolarHBondContact O-ND2 2.89Å; L799-L886 HydrophobicContact CD2-CD2 4.18Å; L799-Y887 HydrophobicContact CB-CE1 4.23Å; L799-Y887 HydrophobicContact CD1-CD1 4.02Å; L799-Y887 HydrophobicContact CD1-CE1 3.89Å; L799-Y887 HydrophobicContact CD1-CG 4.36Å
800	L	96.4	Very high	95.8	Very high	12 Å²	12	26.3 Å²	26.3	6%	0.063	11%	0.11	C	C	.	.	H	α-helix	trans	-64.2	-38.6	171.8	-68.4	174.9	0	0	0	111.9	L778 A781 L796 E797 W798 N803 R804 F823 I837 L918	L778-L800 HydrophobicContact CD2-CD2 3.76Å; A781-L800 HydrophobicContact CB-CD2 4.42Å; L796-L800 HydrophobicContact CD1-CD1 4.12Å; L796-L800 HydrophobicContact CD1-CG 4.06Å; L796-L800 HydrophobicContact CG-CD1 3.97Å; L796-L800 HydrophobicContact CG-CG 4.31Å; L796-L800 VanDerWaalsContact O-CG 3.32Å; L796-L800 WeakPolarHBondContact O-CG 3.24Å; L796-L800 PolarHBondContact O-N 2.92Å; E797-L800 WeakPolarHBondContact O-CB 3.47Å; E797-L800 PolarHBondContact O-N 2.98Å; W798-L800 VanDerWaalsContact C-N 3.31Å; L800-N803 CarbonylContact O-C 3.55Å; L800-N803 WeakPolarHBondContact O-CB 3.35Å; L800-N803 PolarHBondContact O-N 3Å; L800-R804 WeakPolarHBondContact O-CB 3.28Å; L800-R804 PolarHBondContact O-N 3.25Å; L800-F823 HydrophobicContact CD1-CD2 4.39Å; L800-F823 HydrophobicContact CD1-CE2 3.6Å; L800-F823 HydrophobicContact CD1-CZ 4.15Å; L800-F823 HydrophobicContact CD2-CD2 3.91Å; L800-F823 HydrophobicContact CD2-CE2 3.84Å; L800-F823 HydrophobicContact CG-CE2 4.38Å; L800-I837 HydrophobicContact CD1-CD1 4.48Å; L800-L918 HydrophobicContact CD1-CD2 4.02Å
801	E	95.9	Very high	95.8	Very high	52 Å²	52	28.4 Å²	28.4	24%	0.243	13%	0.125	C	C	.	.	H	α-helix	trans	-68.4	-35.2	176.6	-167.6	57.4	-146.2	0	0	112.1	L720 E797 W798 R804 L805	L720-E801 HydrophobicContact CD1-CG 4.39Å; E797-E801 PolarHBondContact O-N 3.23Å; W798-E801 PolarHBondContact O-N 3.46Å; E801-R804 WeakPolarHBondContact O-CB 3.47Å; E801-R804 PolarHBondContact O-N 2.75Å; E801-R804 IonicContact OE2-CZ 2.72Å; E801-R804 IonicContact OE2-NE 3.75Å; E801-R804 IonicContact OE2-NH1 2.69Å; E801-R804 PolarHBondContact OE2-NH1 3.05Å; E801-L805 PolarHBondContact O-N 3.39Å
802	I	96.6	Very high	95.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.2	-42.9	170.5	-69.6	166.4	0	0	0	110.6	K713 A716 L720 W798 L799 R804 L805 T806 Y887 Y896	K713-I802 HydrophobicContact CD-CG2 3.87Å; A716-I802 HydrophobicContact CB-CG2 4.24Å; L720-I802 HydrophobicContact CD1-CB 4.49Å; L720-I802 HydrophobicContact CD1-CG1 3.75Å; W798-I802 WeakPolarHBondContact O-CG1 3.24Å; W798-I802 PolarHBondContact O-N 3.09Å; L799-I802 PolarHBondContact O-N 3.3Å; I802-R804 VanDerWaalsContact C-N 3.31Å; I802-R804 PolarHBondContact O-N 3.07Å; I802-L805 PolarHBondContact O-N 2.93Å; I802-T806 WeakPolarHBondContact O-CB 3.11Å; I802-T806 PolarHBondContact O-N 3.47Å; I802-T806 PolarHBondContact O-OG1 2.93Å; I802-Y887 HydrophobicContact CD1-CD1 3.46Å; I802-Y887 VanDerWaalsContact CD1-CD1 3.46Å; I802-Y887 HydrophobicContact CD1-CE1 4Å; I802-Y896 HydrophobicContact CD1-CD2 4.41Å; I802-Y896 HydrophobicContact CD1-CE1 4.09Å; I802-Y896 HydrophobicContact CD1-CE2 3.88Å
803	N	97.4	Very high	95.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.5	-40.9	174.3	-73.1	-36.2	0	0	0	111.1	K713 M774 L778 L799 L800 T806 H807 F819	K713-N803 WeakPolarHBondContact CE-OD1 3.31Å; K713-N803 PolarHBondContact NZ-OD1 3.06Å; M774-N803 HydrophobicContact CE-CB 4.39Å; L778-N803 HydrophobicContact CD2-CB 3.86Å; L799-N803 PolarHBondContact O-N 3.28Å; L799-N803 PolarHBondContact O-ND2 2.89Å; L800-N803 CarbonylContact O-C 3.55Å; L800-N803 WeakPolarHBondContact O-CB 3.35Å; L800-N803 PolarHBondContact O-N 3Å; N803-T806 WeakPolarHBondContact O-CB 3.46Å; N803-T806 PolarHBondContact O-N 3.16Å; N803-H807 WeakPolarHBondContact O-CB 3.37Å; N803-H807 PolarHBondContact O-N 3.21Å; N803-F819 HydrophobicContact CB-CE2 4.07Å
804	R	97.3	Very high	95.4	Very high	111 Å²	111	37.7 Å²	37.7	42%	0.419	17%	0.166	S	C	.	.	H	α-helix	trans	-62.9	-44	176.3	-174.2	-178.2	-74	169.7	-11.8	112.2	L800 E801 I802 T806 H807 R808 F819	L800-R804 WeakPolarHBondContact O-CB 3.28Å; L800-R804 PolarHBondContact O-N 3.25Å; E801-R804 WeakPolarHBondContact O-CB 3.47Å; E801-R804 PolarHBondContact O-N 2.75Å; E801-R804 IonicContact OE2-CZ 2.72Å; E801-R804 IonicContact OE2-NE 3.75Å; E801-R804 IonicContact OE2-NH1 2.69Å; E801-R804 PolarHBondContact OE2-NH1 3.05Å; I802-R804 VanDerWaalsContact C-N 3.31Å; I802-R804 PolarHBondContact O-N 3.07Å; R804-T806 VanDerWaalsContact C-N 3.35Å; R804-H807 PolarHBondContact O-N 3.27Å; R804-R808 PolarHBondContact O-N 3.11Å; R804-F819 VanDerWaalsContact CA-CE2 3.43Å; R804-F819 HydrophobicContact CB-CD1 4.28Å; R804-F819 HydrophobicContact CB-CD2 4.22Å; R804-F819 HydrophobicContact CB-CE1 3.92Å; R804-F819 HydrophobicContact CB-CE2 3.85Å; R804-F819 HydrophobicContact CB-CG 4.42Å; R804-F819 HydrophobicContact CB-CZ 3.69Å; R804-F819 HydrophobicContact CG-CD1 4.07Å; R804-F819 HydrophobicContact CG-CD2 4.48Å; R804-F819 HydrophobicContact CG-CE1 4.14Å; R804-F819 HydrophobicContact CG-CG 4.24Å; R804-F819 HydrophobicContact CG-CZ 4.37Å
805	L	97.2	Very high	95.2	Very high	22 Å²	22	43.5 Å²	43.5	12%	0.115	20%	0.201	C	C	.	.	H	α-helix	trans	-66.8	-38.6	175.2	-178	60.3	0	0	0	111.4	A716 V719 L720 E801 I802 R808 L809	A716-L805 HydrophobicContact CB-CB 4.09Å; A716-L805 HydrophobicContact CB-CD2 3.99Å; A716-L805 HydrophobicContact CB-CG 3.93Å; V719-L805 HydrophobicContact CB-CD2 4.16Å; V719-L805 HydrophobicContact CG1-CD2 4.03Å; L720-L805 HydrophobicContact CD1-CB 4.14Å; L720-L805 HydrophobicContact CD1-CD2 3.77Å; L720-L805 HydrophobicContact CD2-CD2 4.1Å; L720-L805 HydrophobicContact CG-CD2 3.62Å; E801-L805 PolarHBondContact O-N 3.39Å; I802-L805 PolarHBondContact O-N 2.93Å; L805-R808 PolarHBondContact O-N 3.45Å; L805-L809 HydrophobicContact CD1-CG 4.4Å; L805-L809 HydrophobicContact CG-CD1 4.37Å; L805-L809 HydrophobicContact CG-CG 4.49Å; L805-L809 WeakPolarHBondContact O-CG 3.32Å; L805-L809 PolarHBondContact O-N 3.07Å
806	T	97.3	Very high	95.2	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.9	-48.2	175.2	-55	0	0	0	0	110.8	F709 K713 A716 M774 I802 N803 R804 R808 L809 L810	F709-T806 HydrophobicContact CE2-CG2 4.36Å; K713-T806 HydrophobicContact CB-CG2 4.28Å; K713-T806 HydrophobicContact CD-CG2 4.39Å; A716-T806 VanDerWaalsContact CB-OG1 3.25Å; A716-T806 WeakPolarHBondContact CB-OG1 3.38Å; M774-T806 HydrophobicContact SD-CG2 4.11Å; I802-T806 WeakPolarHBondContact O-CB 3.11Å; I802-T806 PolarHBondContact O-N 3.47Å; I802-T806 PolarHBondContact O-OG1 2.93Å; N803-T806 WeakPolarHBondContact O-CB 3.46Å; N803-T806 PolarHBondContact O-N 3.16Å; R804-T806 VanDerWaalsContact C-N 3.35Å; T806-R808 VanDerWaalsContact C-N 3.34Å; T806-R808 PolarHBondContact O-N 2.67Å; T806-L809 PolarHBondContact O-N 3.43Å; T806-L810 HydrophobicContact CG2-CD1 3.83Å; T806-L810 WeakPolarHBondContact O-CB 3.48Å; T806-L810 VanDerWaalsContact O-CG 3.31Å; T806-L810 WeakPolarHBondContact O-CG 3.4Å; T806-L810 PolarHBondContact O-N 3.09Å
807	H	97.7	Very high	95.1	Very high	23 Å²	23	47.7 Å²	47.7	11%	0.106	22%	0.224	C	C	.	.	H	α-helix	trans	-55.6	-46.4	173	174.8	-82.1	0	0	0	111.9	M774 N803 R804 L809 L810 S811 D817 F819	M774-H807 HydrophobicContact CE-CB 3.89Å; N803-H807 WeakPolarHBondContact O-CB 3.37Å; N803-H807 PolarHBondContact O-N 3.21Å; R804-H807 PolarHBondContact O-N 3.27Å; H807-L809 PolarHBondContact O-N 3.09Å; H807-L810 PolarHBondContact O-N 3.2Å; H807-S811 PolarHBondContact CE1-OG 3.21Å; H807-S811 PolarHBondContact ND1-OG 3Å; H807-S811 VanDerWaalsContact O-CB 3.26Å; H807-S811 WeakPolarHBondContact O-CB 3.3Å; H807-S811 PolarHBondContact O-N 2.95Å; H807-S811 PolarHBondContact O-OG 2.83Å; H807-D817 PolarHBondContact NE2-O 3.34Å; H807-F819 HydrophobicContact CB-CD2 3.91Å
808	R	96.9	Very high	95.2	Very high	140 Å²	140	49.3 Å²	49.3	53%	0.528	24%	0.24	S	C	.	.	H	α-helix	trans	-63.3	-38.9	178.9	-171.5	-176	-64	152.7	2.7	112.7	R804 L805 T806	R804-R808 PolarHBondContact O-N 3.11Å; L805-R808 PolarHBondContact O-N 3.45Å; T806-R808 VanDerWaalsContact C-N 3.34Å; T806-R808 PolarHBondContact O-N 2.67Å
809	L	95.1	Very high	95.3	Very high	25 Å²	25	45.5 Å²	45.5	13%	0.131	23%	0.226	C	C	.	.	H	α-helix	trans	-67.7	-44.3	177.2	-69.6	174.3	0	0	0	111.2	Y712 M715 A716 L805 T806 H807 K812	Y712-L809 HydrophobicContact CD1-CB 3.82Å; Y712-L809 HydrophobicContact CD1-CD1 4.4Å; Y712-L809 HydrophobicContact CE1-CB 4.42Å; M715-L809 HydrophobicContact CB-CD1 4.39Å; M715-L809 HydrophobicContact CG-CD1 4.13Å; M715-L809 HydrophobicContact SD-CD1 4Å; A716-L809 HydrophobicContact CB-CD1 4.22Å; L805-L809 HydrophobicContact CD1-CG 4.4Å; L805-L809 HydrophobicContact CG-CD1 4.37Å; L805-L809 HydrophobicContact CG-CG 4.49Å; L805-L809 WeakPolarHBondContact O-CG 3.32Å; L805-L809 PolarHBondContact O-N 3.07Å; T806-L809 PolarHBondContact O-N 3.43Å; H807-L809 PolarHBondContact O-N 3.09Å; L809-K812 WeakPolarHBondContact O-CB 3.44Å; L809-K812 PolarHBondContact O-N 3.42Å
810	L	95.5	Very high	95.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.6	-43	178	-69.9	165.2	0	0	0	111.9	I708 F709 Y712 I770 M774 T806 H807 K812 H813 M814 L816	I708-L810 HydrophobicContact CG2-CD2 4.27Å; F709-L810 HydrophobicContact CD2-CD1 4.22Å; Y712-L810 HydrophobicContact CD2-CD2 3.47Å; Y712-L810 VanDerWaalsContact CD2-CD2 3.47Å; Y712-L810 HydrophobicContact CD2-CG 4.41Å; Y712-L810 HydrophobicContact CE2-CD2 4.16Å; Y712-L810 HydrophobicContact CG-CD2 3.88Å; Y712-L810 HydrophobicContact CG-CG 4.36Å; I770-L810 HydrophobicContact CD1-CD2 4.11Å; I770-L810 HydrophobicContact CG2-CD1 3.61Å; I770-L810 HydrophobicContact CG2-CD2 4.14Å; I770-L810 HydrophobicContact CG2-CG 4.38Å; M774-L810 HydrophobicContact CG-CD1 4.4Å; M774-L810 HydrophobicContact SD-CD1 4.26Å; T806-L810 HydrophobicContact CG2-CD1 3.83Å; T806-L810 WeakPolarHBondContact O-CB 3.48Å; T806-L810 VanDerWaalsContact O-CG 3.31Å; T806-L810 WeakPolarHBondContact O-CG 3.4Å; T806-L810 PolarHBondContact O-N 3.09Å; H807-L810 PolarHBondContact O-N 3.2Å; L810-K812 PolarHBondContact O-N 3.32Å; L810-H813 PolarHBondContact O-N 3.33Å; L810-M814 HydrophobicContact CB-CE 4.36Å; L810-M814 HydrophobicContact CB-SD 4.12Å; L810-M814 HydrophobicContact CD2-CE 3.83Å; L810-M814 HydrophobicContact CD2-SD 4.26Å; L810-M814 WeakPolarHBondContact O-CG 3.34Å; L810-M814 PolarHBondContact O-N 2.69Å; L810-L816 HydrophobicContact CB-CD1 3.91Å; L810-L816 HydrophobicContact CD1-CD1 4.44Å
811	S	95.2	Very high	95.2	Very high	46 Å²	46	50.3 Å²	50.3	32%	0.322	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-11	-178.6	-60.2	0	0	0	0	114.3	H807 H813 M814	H807-S811 PolarHBondContact CE1-OG 3.21Å; H807-S811 PolarHBondContact ND1-OG 3Å; H807-S811 VanDerWaalsContact O-CB 3.26Å; H807-S811 WeakPolarHBondContact O-CB 3.3Å; H807-S811 PolarHBondContact O-N 2.95Å; H807-S811 PolarHBondContact O-OG 2.83Å; S811-H813 VanDerWaalsContact C-N 3.26Å; S811-M814 WeakPolarHBondContact CA-O 3.41Å
812	K	93.6	Very high	95.3	Very high	150 Å²	150	47.8 Å²	47.8	65%	0.652	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-24.1	170.9	-67.1	179.6	178.8	-178.1	0	113.1	L809 L810	L809-K812 WeakPolarHBondContact O-CB 3.44Å; L809-K812 PolarHBondContact O-N 3.42Å; L810-K812 PolarHBondContact O-N 3.32Å
813	H	90.8	Very high	95.3	Very high	41 Å²	41	49.3 Å²	49.3	19%	0.19	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-18.2	-172.2	-53.8	-69.1	0	0	0	113.1	Y712 E745 L748 N763 L810 S811	Y712-H813 AromaticContact CZ-CD2 3.98Å; Y712-H813 PolarHBondContact OH-CD2 2.97Å; Y712-H813 VanDerWaalsContact OH-CD2 3.31Å; Y712-H813 PolarHBondContact OH-NE2 2.88Å; E745-H813 IonicContact OE1-CE1 2.8Å; L748-H813 HydrophobicContact CB-CB 4.07Å; L748-H813 HydrophobicContact CD1-CB 3.81Å; N763-H813 PolarHBondContact ND2-O 3.03Å; N763-H813 VanDerWaalsContact ND2-O 3.09Å; L810-H813 PolarHBondContact O-N 3.33Å; S811-H813 VanDerWaalsContact C-N 3.26Å
814	M	91.8	Very high	95.1	Very high	8 Å²	8	54.7 Å²	54.7	4%	0.039	27%	0.273	C	S	.	.	S	Bend	trans	-141.6	164.2	-176.7	70.1	-165.2	63.7	0	0	111.7	L748 T767 I770 L810 S811 L816	L748-M814 HydrophobicContact CD1-CE 4.23Å; L748-M814 HydrophobicContact CD2-CE 3.63Å; T767-M814 HydrophobicContact CG2-CB 4.45Å; T767-M814 WeakPolarHBondContact OG1-CB 3.46Å; I770-M814 HydrophobicContact CB-SD 4.11Å; I770-M814 HydrophobicContact CD1-CE 3.61Å; I770-M814 HydrophobicContact CD1-SD 3.84Å; I770-M814 HydrophobicContact CG2-SD 3.75Å; L810-M814 HydrophobicContact CB-CE 4.36Å; L810-M814 HydrophobicContact CB-SD 4.12Å; L810-M814 HydrophobicContact CD2-CE 3.83Å; L810-M814 HydrophobicContact CD2-SD 4.26Å; L810-M814 WeakPolarHBondContact O-CG 3.34Å; L810-M814 PolarHBondContact O-N 2.69Å; S811-M814 WeakPolarHBondContact CA-O 3.41Å; M814-L816 HydrophobicContact CG-CD1 4.44Å; M814-L816 HydrophobicContact CG-CD2 4.22Å; M814-L816 HydrophobicContact CG-CG 3.98Å; M814-L816 HydrophobicContact SD-CD1 4.44Å; M814-L816 HydrophobicContact SD-CD2 4.12Å; M814-L816 HydrophobicContact SD-CG 4.32Å
815	T	92.8	Very high	95	Very high	126 Å²	126	54.4 Å²	54.4	77%	0.773	28%	0.276	S	S	*	.			trans	-100.3	103.9	179.9	-49.5	0	0	0	0	109.6	T767	T767-T815 WeakPolarHBondContact CG2-O 3.45Å
816	L	93.8	Very high	94.9	Very high	21 Å²	21	53.8 Å²	53.8	11%	0.11	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-102.1	157.3	173.5	-62	175.7	0	0	0	110	T767 I770 L810 M814 M822	T767-L816 HydrophobicContact CG2-CD2 3.98Å; I770-L816 HydrophobicContact CG2-CD2 4.4Å; L810-L816 HydrophobicContact CB-CD1 3.91Å; L810-L816 HydrophobicContact CD1-CD1 4.44Å; M814-L816 HydrophobicContact CG-CD1 4.44Å; M814-L816 HydrophobicContact CG-CD2 4.22Å; M814-L816 HydrophobicContact CG-CG 3.98Å; M814-L816 HydrophobicContact SD-CD1 4.44Å; M814-L816 HydrophobicContact SD-CD2 4.12Å; M814-L816 HydrophobicContact SD-CG 4.32Å; L816-M822 HydrophobicContact CB-CE 4Å; L816-M822 HydrophobicContact CD2-CE 4.46Å
817	D	94.2	Very high	94.9	Very high	82 Å²	82	54 Å²	54	44%	0.439	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-55.7	155	165.3	-52.5	-37.9	0	0	0	110	Y775 H807 F819 M822	Y775-D817 PolarHBondContact OH-OD2 3.23Å; H807-D817 PolarHBondContact NE2-O 3.34Å; D817-F819 PolarHBondContact O-N 2.84Å; D817-M822 HydrophobicContact CB-CE 3.76Å; D817-M822 HydrophobicContact CB-CG 3.96Å
818	S	95	Very high	94.7	Very high	71 Å²	71	58.4 Å²	58.4	50%	0.497	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-57.7	140.3	177.2	78.6	0	0	0	0	110.3	D820 A821 M822	S818-D820 PolarHBondContact O-N 3.47Å; S818-D820 VanDerWaalsContact O-N 3.17Å; S818-A821 WeakPolarHBondContact O-CB 3.3Å; S818-A821 PolarHBondContact O-N 2.94Å; S818-A821 VanDerWaalsContact OG-CB 3.27Å; S818-A821 WeakPolarHBondContact OG-CB 3.35Å; S818-A821 PolarHBondContact OG-N 3.41Å; S818-A821 VanDerWaalsContact OG-N 3.17Å; S818-M822 PolarHBondContact O-N 2.83Å
819	F	96.3	Very high	94.6	Very high	22 Å²	22	54.1 Å²	54.1	10%	0.096	28%	0.283	C	S	.	.	H	α-helix	trans	-54.8	-37.7	179.6	178.1	-95.2	0	0	0	112.2	L778 N803 R804 H807 D817 M822 F823	L778-F819 HydrophobicContact CD2-CE2 3.97Å; L778-F819 HydrophobicContact CD2-CZ 4.1Å; N803-F819 HydrophobicContact CB-CE2 4.07Å; R804-F819 VanDerWaalsContact CA-CE2 3.43Å; R804-F819 HydrophobicContact CB-CD1 4.28Å; R804-F819 HydrophobicContact CB-CD2 4.22Å; R804-F819 HydrophobicContact CB-CE1 3.92Å; R804-F819 HydrophobicContact CB-CE2 3.85Å; R804-F819 HydrophobicContact CB-CG 4.42Å; R804-F819 HydrophobicContact CB-CZ 3.69Å; R804-F819 HydrophobicContact CG-CD1 4.07Å; R804-F819 HydrophobicContact CG-CD2 4.48Å; R804-F819 HydrophobicContact CG-CE1 4.14Å; R804-F819 HydrophobicContact CG-CG 4.24Å; R804-F819 HydrophobicContact CG-CZ 4.37Å; H807-F819 HydrophobicContact CB-CD2 3.91Å; D817-F819 PolarHBondContact O-N 2.84Å; F819-M822 PolarHBondContact O-N 2.85Å; F819-F823 HydrophobicContact CE1-CB 4.33Å; F819-F823 VanDerWaalsContact O-CB 3.27Å; F819-F823 WeakPolarHBondContact O-CB 3.4Å; F819-F823 PolarHBondContact O-N 2.98Å
820	D	94.5	Very high	94.3	Very high	74 Å²	74	58 Å²	58	40%	0.396	31%	0.307	S	S	.	.	H	α-helix	trans	-66.1	-40.2	178.8	-170.1	46.9	0	0	0	112	S818 F823 R824	S818-D820 PolarHBondContact O-N 3.47Å; S818-D820 VanDerWaalsContact O-N 3.17Å; D820-F823 PolarHBondContact O-N 3.21Å; D820-R824 WeakPolarHBondContact O-CB 3.47Å; D820-R824 VanDerWaalsContact O-CG 3.25Å; D820-R824 WeakPolarHBondContact O-CG 3.24Å; D820-R824 PolarHBondContact O-N 3.38Å; D820-R824 IonicContact OD1-NE 2.78Å; D820-R824 PolarHBondContact OD1-NE 3.08Å; D820-R824 IonicContact OD1-NH2 2.77Å; D820-R824 IonicContact OD2-CZ 3.26Å; D820-R824 IonicContact OD2-NE 3.5Å; D820-R824 PolarHBondContact OD2-NE 3.32Å; D820-R824 IonicContact OD2-NH2 2.84Å; D820-R824 PolarHBondContact OD2-NH2 3.47Å
821	A	94.9	Very high	94	Very high	42 Å²	42	63.9 Å²	63.9	35%	0.347	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-49.1	173.6	0	0	0	0	0	111.3	S818 F823 R824 E825	S818-A821 WeakPolarHBondContact O-CB 3.3Å; S818-A821 PolarHBondContact O-N 2.94Å; S818-A821 VanDerWaalsContact OG-CB 3.27Å; S818-A821 WeakPolarHBondContact OG-CB 3.35Å; S818-A821 PolarHBondContact OG-N 3.41Å; S818-A821 VanDerWaalsContact OG-N 3.17Å; A821-F823 VanDerWaalsContact C-N 3.31Å; A821-F823 PolarHBondContact O-N 3.29Å; A821-R824 PolarHBondContact O-N 2.93Å; A821-E825 WeakPolarHBondContact O-CB 3.44Å; A821-E825 PolarHBondContact O-N 3.46Å
822	M	96.9	Very high	93.7	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-59.5	-42.5	178	-64.7	-172.4	161.9	0	0	112	S771 M774 Y775 L778 L816 D817 S818 F819 A826	S771-M822 WeakPolarHBondContact OG-CE 3.27Å; M774-M822 HydrophobicContact CB-SD 4.08Å; Y775-M822 HydrophobicContact CD1-CB 4.43Å; Y775-M822 HydrophobicContact CE1-CB 3.92Å; Y775-M822 HydrophobicContact CE1-CG 4.01Å; Y775-M822 HydrophobicContact CE2-CE 3.99Å; Y775-M822 HydrophobicContact CE2-CG 4.18Å; L778-M822 HydrophobicContact CD1-CB 3.73Å; L816-M822 HydrophobicContact CB-CE 4Å; L816-M822 HydrophobicContact CD2-CE 4.46Å; D817-M822 HydrophobicContact CB-CE 3.76Å; D817-M822 HydrophobicContact CB-CG 3.96Å; S818-M822 PolarHBondContact O-N 2.83Å; F819-M822 PolarHBondContact O-N 2.85Å; M822-A826 WeakPolarHBondContact O-CB 3.32Å; M822-A826 PolarHBondContact O-N 2.92Å
823	F	96.4	Very high	93.4	Very high	31 Å²	31	60.1 Å²	60.1	14%	0.136	34%	0.342	C	S	.	.	H	α-helix	trans	-66	-47	178.4	171.7	-111.3	0	0	0	111.9	I782 L800 F819 D820 A821 E825 A826 N827 I837	I782-F823 HydrophobicContact CD1-CE2 4.38Å; L800-F823 HydrophobicContact CD1-CD2 4.39Å; L800-F823 HydrophobicContact CD1-CE2 3.6Å; L800-F823 HydrophobicContact CD1-CZ 4.15Å; L800-F823 HydrophobicContact CD2-CD2 3.91Å; L800-F823 HydrophobicContact CD2-CE2 3.84Å; L800-F823 HydrophobicContact CG-CE2 4.38Å; F819-F823 HydrophobicContact CE1-CB 4.33Å; F819-F823 VanDerWaalsContact O-CB 3.27Å; F819-F823 WeakPolarHBondContact O-CB 3.4Å; F819-F823 PolarHBondContact O-N 2.98Å; D820-F823 PolarHBondContact O-N 3.21Å; A821-F823 VanDerWaalsContact C-N 3.31Å; A821-F823 PolarHBondContact O-N 3.29Å; F823-E825 VanDerWaalsContact C-N 3.31Å; F823-E825 PolarHBondContact O-N 3.48Å; F823-A826 PolarHBondContact O-N 2.96Å; F823-N827 WeakPolarHBondContact O-CB 3.44Å; F823-N827 PolarHBondContact O-N 3.46Å; F823-I837 HydrophobicContact CE2-CD1 3.78Å; F823-I837 HydrophobicContact CZ-CD1 3.66Å
824	R	94.4	Very high	93.4	Very high	114 Å²	114	62.2 Å²	62.2	43%	0.43	35%	0.349	S	S	.	.	H	α-helix	trans	-62.4	-40.1	177.4	-72.7	-179.5	-165.7	-154.7	8.7	111.4	D820 A821 N827 H828 N829 V830	D820-R824 WeakPolarHBondContact O-CB 3.47Å; D820-R824 VanDerWaalsContact O-CG 3.25Å; D820-R824 WeakPolarHBondContact O-CG 3.24Å; D820-R824 PolarHBondContact O-N 3.38Å; D820-R824 IonicContact OD1-NE 2.78Å; D820-R824 PolarHBondContact OD1-NE 3.08Å; D820-R824 IonicContact OD1-NH2 2.77Å; D820-R824 IonicContact OD2-CZ 3.26Å; D820-R824 IonicContact OD2-NE 3.5Å; D820-R824 PolarHBondContact OD2-NE 3.32Å; D820-R824 IonicContact OD2-NH2 2.84Å; D820-R824 PolarHBondContact OD2-NH2 3.47Å; A821-R824 PolarHBondContact O-N 2.93Å; R824-N827 CarbonylContact O-C 3.35Å; R824-N827 PolarHBondContact O-N 3.02Å; R824-H828 PolarHBondContact O-N 3.41Å; R824-N829 HydrophobicContact CB-CB 4.45Å; R824-N829 PolarHBondContact O-N 2.86Å; R824-V830 HydrophobicContact CB-CG2 3.8Å
825	E	95.4	Very high	93.5	Very high	104 Å²	104	61.8 Å²	61.8	49%	0.486	35%	0.347	S	S	.	.	H	α-helix	trans	-63	-50.8	176.2	-176.8	174.1	171	0	0	111.3	Y775 A821 F823 N827 H828 V830	Y775-E825 HydrophobicContact CE1-CB 4.03Å; Y775-E825 HydrophobicContact CE1-CG 4.11Å; Y775-E825 VanDerWaalsContact CE1-OE2 3.27Å; Y775-E825 WeakPolarHBondContact CE1-OE2 3.33Å; Y775-E825 PolarHBondContact OH-OE2 3.08Å; A821-E825 WeakPolarHBondContact O-CB 3.44Å; A821-E825 PolarHBondContact O-N 3.46Å; F823-E825 VanDerWaalsContact C-N 3.31Å; F823-E825 PolarHBondContact O-N 3.48Å; E825-N827 PolarHBondContact O-N 2.81Å; E825-H828 WeakPolarHBondContact O-CA 3.04Å; E825-H828 PolarHBondContact O-CD2 3.47Å; E825-H828 PolarHBondContact O-N 3.36Å; E825-V830 HydrophobicContact CB-CG2 4.29Å
826	A	95.3	Very high	93.6	Very high	9 Å²	9	57 Å²	57	7%	0.074	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-33.5	176.4	0	0	0	0	0	112.8	L778 I782 M822 F823 H828 R836	L778-A826 HydrophobicContact CB-CB 3.71Å; I782-A826 HydrophobicContact CD1-CB 4.11Å; M822-A826 WeakPolarHBondContact O-CB 3.32Å; M822-A826 PolarHBondContact O-N 2.92Å; F823-A826 PolarHBondContact O-N 2.96Å; A826-H828 PolarHBondContact O-N 3.28Å; A826-R836 WeakPolarHBondContact O-CD 3.47Å; A826-R836 PolarHBondContact O-NH1 3.23Å
827	N	95.6	Very high	93.7	Very high	4 Å²	4	56 Å²	56	2%	0.021	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	1.8	175.3	-164.7	26.1	0	0	0	113.1	I782 F823 R824 E825 N829 G835 R836 I837	I782-N827 HydrophobicContact CD1-CB 3.85Å; F823-N827 WeakPolarHBondContact O-CB 3.44Å; F823-N827 PolarHBondContact O-N 3.46Å; R824-N827 CarbonylContact O-C 3.35Å; R824-N827 PolarHBondContact O-N 3.02Å; E825-N827 PolarHBondContact O-N 2.81Å; N827-N829 HydrophobicContact CB-CB 4.42Å; N827-N829 PolarHBondContact O-N 3.1Å; N827-G835 CarbonylContact O-C 3.5Å; N827-G835 WeakPolarHBondContact O-CA 3.46Å; N827-R836 PolarHBondContact O-N 2.88Å; N827-R836 WeakPolarHBondContact OD1-CB 3.33Å; N827-R836 PolarHBondContact OD1-N 3.33Å; N827-I837 WeakPolarHBondContact OD1-CG1 3.4Å; N827-I837 PolarHBondContact OD1-N 3.39Å
828	H	94.9	Very high	93.7	Very high	117 Å²	117	52.6 Å²	52.6	54%	0.542	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	30.9	-174.5	-60.6	179.6	0	0	0	114	R824 E825 A826 A832 R836	R824-H828 PolarHBondContact O-N 3.41Å; E825-H828 WeakPolarHBondContact O-CA 3.04Å; E825-H828 PolarHBondContact O-CD2 3.47Å; E825-H828 PolarHBondContact O-N 3.36Å; A826-H828 PolarHBondContact O-N 3.28Å; H828-A832 WeakPolarHBondContact O-CB 3.42Å; H828-R836 HydrophobicContact CB-CG 4.21Å
829	N	93.2	Very high	93.7	Very high	49 Å²	49	53.9 Å²	53.9	26%	0.262	29%	0.292	S	S	.	.			trans	-106.2	33	-175.6	-161.6	42.2	0	0	0	113	R824 N827 A832 P833 G835	R824-N829 HydrophobicContact CB-CB 4.45Å; R824-N829 PolarHBondContact O-N 2.86Å; N827-N829 HydrophobicContact CB-CB 4.42Å; N827-N829 PolarHBondContact O-N 3.1Å; N829-A832 PolarHBondContact OD1-O 3.34Å; N829-P833 PolarHBondContact OD1-O 3.46Å; N829-G835 PolarHBondContact OD1-N 3.09Å
830	V	90.5	Very high	93.6	Very high	106 Å²	106	53.8 Å²	53.8	64%	0.642	29%	0.292	S	S	*	.	S	Bend	trans	-106.1	-54.9	175.6	179.5	0	0	0	0	110.2	R824 E825	R824-V830 HydrophobicContact CB-CG2 3.8Å; E825-V830 HydrophobicContact CB-CG2 4.29Å
831	S	89.3	Confident	93.7	Very high	124 Å²	124	50.2 Å²	50.2	87%	0.867	27%	0.273	S	S	*	.	S	Bend	trans	-93.1	-6.2	177	58	0	0	0	0	113.6
832	A	88.1	Confident	93.7	Very high	38 Å²	38	50.8 Å²	50.8	31%	0.314	27%	0.268	S	S	.	.	S	Bend	trans	-119	149	177.5	0	0	0	0	0	110.4	H828 N829 Y834	H828-A832 WeakPolarHBondContact O-CB 3.42Å; N829-A832 PolarHBondContact OD1-O 3.34Å; A832-Y834 VanDerWaalsContact C-N 3.29Å; A832-Y834 PolarHBondContact O-N 3.41Å
833	P	87.8	Confident	93.5	Very high	80 Å²	80	57.3 Å²	57.3	52%	0.519	29%	0.292	S	S	.	.	S	Bend	trans	-74.4	-18.6	-179.8	29.1	-34.8	0	0	0	113.6	N829 Q922	N829-P833 PolarHBondContact OD1-O 3.46Å; P833-Q922 PolarHBondContact O-NE2 3.13Å
834	Y	90.8	Very high	93.4	Very high	84 Å²	84	55.9 Å²	55.9	33%	0.329	29%	0.286	S	S	.	.	S	Bend	trans	-133.1	129.6	-178.7	-50.1	-67	0	0	0	109.6	A832 Q922 V926	A832-Y834 VanDerWaalsContact C-N 3.29Å; A832-Y834 PolarHBondContact O-N 3.41Å; Y834-Q922 HydrophobicContact CD1-CG 4.32Å; Y834-Q922 HydrophobicContact CE1-CG 3.76Å; Y834-V926 HydrophobicContact CD1-CB 4.36Å; Y834-V926 HydrophobicContact CD1-CG1 3.73Å; Y834-V926 HydrophobicContact CE1-CB 3.61Å; Y834-V926 HydrophobicContact CE1-CG1 3.46Å; Y834-V926 VanDerWaalsContact CE1-CG1 3.46Å; Y834-V926 HydrophobicContact CE1-CG2 4.05Å; Y834-V926 HydrophobicContact CE2-CG2 4.09Å; Y834-V926 HydrophobicContact CG-CG1 4.46Å
835	G	93.1	Very high	93.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.266	C	S	.	.			trans	-79.8	166.7	177.9	0	0	0	0	0	113.4	N827 N829 I837 T838 L839	N827-G835 CarbonylContact O-C 3.5Å; N827-G835 WeakPolarHBondContact O-CA 3.46Å; N829-G835 PolarHBondContact OD1-N 3.09Å; G835-I837 VanDerWaalsContact C-N 3.29Å; G835-I837 PolarHBondContact O-N 2.9Å; G835-T838 PolarHBondContact O-N 3.37Å; G835-T838 VanDerWaalsContact O-N 3.11Å; G835-L839 WeakPolarHBondContact O-CG 3.49Å; G835-L839 PolarHBondContact O-N 3.18Å; G835-L839 VanDerWaalsContact O-N 3.11Å
836	R	95.1	Very high	93.2	Very high	26 Å²	26	47.9 Å²	47.9	10%	0.098	26%	0.255	C	S	.	.	H	α-helix	trans	-49.3	-44.8	175.2	-71.8	168.1	64.1	-172.1	5.9	113.3	D779 I782 S783 E786 A826 N827 H828 T838 L839 H840	D779-R836 IonicContact OD1-CZ 3.16Å; D779-R836 IonicContact OD1-NH1 3.25Å; D779-R836 PolarHBondContact OD1-NH1 2.9Å; D779-R836 IonicContact OD1-NH2 2.74Å; I782-R836 HydrophobicContact CG2-CB 3.83Å; S783-R836 PolarHBondContact OG-NH2 3.3Å; E786-R836 WeakPolarHBondContact OE1-CB 3.41Å; E786-R836 IonicContact OE1-CZ 3.29Å; E786-R836 IonicContact OE1-NE 3.48Å; E786-R836 PolarHBondContact OE1-NE 3.23Å; E786-R836 IonicContact OE1-NH2 2.61Å; E786-R836 IonicContact OE2-CZ 2.88Å; E786-R836 IonicContact OE2-NE 3.55Å; E786-R836 IonicContact OE2-NH2 3.42Å; E786-R836 PolarHBondContact OE2-NH2 2.98Å; A826-R836 WeakPolarHBondContact O-CD 3.47Å; A826-R836 PolarHBondContact O-NH1 3.23Å; N827-R836 PolarHBondContact O-N 2.88Å; N827-R836 WeakPolarHBondContact OD1-CB 3.33Å; N827-R836 PolarHBondContact OD1-N 3.33Å; H828-R836 HydrophobicContact CB-CG 4.21Å; R836-T838 PolarHBondContact O-N 2.87Å; R836-L839 PolarHBondContact O-N 3.34Å; R836-H840 WeakPolarHBondContact O-CB 3.32Å; R836-H840 PolarHBondContact O-N 3.18Å
837	I	96.2	Very high	93	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-46.3	179.2	-62.3	166.2	0	0	0	111.1	I782 F785 L796 L800 F823 N827 G835 L839 H840 V841 L918	I782-I837 HydrophobicContact CD1-CD1 4.46Å; I782-I837 HydrophobicContact CG1-CD1 4.24Å; I782-I837 HydrophobicContact CG1-CG1 4.33Å; I782-I837 HydrophobicContact CG2-CG1 4.16Å; F785-I837 HydrophobicContact CD1-CG2 4.34Å; F785-I837 HydrophobicContact CE1-CG2 3.93Å; L796-I837 HydrophobicContact CD2-CD1 3.88Å; L796-I837 HydrophobicContact CD2-CG1 3.96Å; L796-I837 HydrophobicContact CD2-CG2 4.22Å; L800-I837 HydrophobicContact CD1-CD1 4.48Å; F823-I837 HydrophobicContact CE2-CD1 3.78Å; F823-I837 HydrophobicContact CZ-CD1 3.66Å; N827-I837 WeakPolarHBondContact OD1-CG1 3.4Å; N827-I837 PolarHBondContact OD1-N 3.39Å; G835-I837 VanDerWaalsContact C-N 3.29Å; G835-I837 PolarHBondContact O-N 2.9Å; I837-L839 VanDerWaalsContact C-N 3.35Å; I837-L839 PolarHBondContact O-N 2.87Å; I837-H840 PolarHBondContact O-N 3.03Å; I837-V841 HydrophobicContact CG2-CG2 4.47Å; I837-V841 WeakPolarHBondContact O-CG2 3.48Å; I837-V841 PolarHBondContact O-N 2.93Å; I837-L918 HydrophobicContact CG2-CB 4.29Å; I837-L918 HydrophobicContact CG2-CD1 4.29Å
838	T	94.7	Very high	92.8	Very high	10 Å²	10	51.3 Å²	51.3	6%	0.061	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-42.6	180	-57.1	0	0	0	0	111.3	G835 R836 V841 F842 L919 V926	G835-T838 PolarHBondContact O-N 3.37Å; G835-T838 VanDerWaalsContact O-N 3.11Å; R836-T838 PolarHBondContact O-N 2.87Å; T838-V841 PolarHBondContact O-N 2.89Å; T838-F842 PolarHBondContact O-N 3.47Å; T838-F842 VanDerWaalsContact O-N 3.09Å; T838-L919 HydrophobicContact CG2-CD2 4.48Å; T838-L919 HydrophobicContact CG2-CG 4.1Å; T838-V926 HydrophobicContact CG2-CG1 4.16Å
839	L	94.1	Very high	92.8	Very high	98 Å²	98	45.8 Å²	45.8	51%	0.513	24%	0.243	S	C	.	.	H	α-helix	trans	-64.5	-43.1	177.7	-64.4	173.4	0	0	0	111.5	G835 R836 I837 F842 W843	G835-L839 WeakPolarHBondContact O-CG 3.49Å; G835-L839 PolarHBondContact O-N 3.18Å; G835-L839 VanDerWaalsContact O-N 3.11Å; R836-L839 PolarHBondContact O-N 3.34Å; I837-L839 VanDerWaalsContact C-N 3.35Å; I837-L839 PolarHBondContact O-N 2.87Å; L839-F842 PolarHBondContact O-N 2.91Å; L839-W843 WeakPolarHBondContact O-CB 3.44Å; L839-W843 PolarHBondContact O-N 3.34Å
840	H	95.3	Very high	92.8	Very high	19 Å²	19	43.5 Å²	43.5	9%	0.088	23%	0.231	C	C	.	.	H	α-helix	trans	-67.3	-39.6	177.4	-168	59.1	0	0	0	112.4	F785 E786 E788 R836 I837 F842 W843 E844	F785-H840 HydrophobicContact CD1-CB 4.27Å; F785-H840 AromaticContact CD1-CD2 3.64Å; F785-H840 HydrophobicContact CE1-CB 3.95Å; F785-H840 AromaticContact CE1-CD2 3.46Å; F785-H840 VanDerWaalsContact CE1-CD2 3.46Å; F785-H840 WeakPolarHBondContact CE1-CD2 3.46Å; F785-H840 AromaticContact CZ-CD2 3.74Å; F785-H840 PolarHBondContact O-CD2 3.07Å; F785-H840 VanDerWaalsContact O-CD2 3.3Å; F785-H840 PolarHBondContact O-NE2 3.49Å; E786-H840 HydrophobicContact CG-CB 4.33Å; E786-H840 PolarHBondContact O-CE1 3.26Å; E788-H840 PolarHBondContact O-NE2 2.86Å; R836-H840 WeakPolarHBondContact O-CB 3.32Å; R836-H840 PolarHBondContact O-N 3.18Å; I837-H840 PolarHBondContact O-N 3.03Å; H840-F842 VanDerWaalsContact C-N 3.32Å; H840-F842 PolarHBondContact O-N 3.2Å; H840-W843 WeakPolarHBondContact O-CB 3.41Å; H840-W843 PolarHBondContact O-N 3.42Å; H840-E844 IonicContact CE1-OE1 2.6Å; H840-E844 PolarHBondContact CE1-OE1 3Å; H840-E844 WeakPolarHBondContact NE2-CG 3.09Å; H840-E844 IonicContact NE2-OE1 3.78Å; H840-E844 WeakPolarHBondContact O-CB 3.43Å; H840-E844 WeakPolarHBondContact O-CG 3.43Å; H840-E844 PolarHBondContact O-N 3.14Å
841	V	95.8	Very high	92.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.2	-46.5	173.4	167.4	0	0	0	0	110.6	F785 L790 I793 I837 T838 E844 L845 I915 L919	F785-V841 HydrophobicContact CE1-CG2 4.02Å; F785-V841 HydrophobicContact CZ-CG2 3.8Å; L790-V841 HydrophobicContact CD1-CB 4.41Å; L790-V841 HydrophobicContact CD1-CG1 4.07Å; L790-V841 HydrophobicContact CD1-CG2 4.04Å; I793-V841 HydrophobicContact CD1-CG2 3.82Å; I837-V841 HydrophobicContact CG2-CG2 4.47Å; I837-V841 WeakPolarHBondContact O-CG2 3.48Å; I837-V841 PolarHBondContact O-N 2.93Å; T838-V841 PolarHBondContact O-N 2.89Å; V841-E844 PolarHBondContact O-N 3.43Å; V841-L845 HydrophobicContact CG1-CD1 3.96Å; V841-L845 HydrophobicContact CG1-CG 4.37Å; V841-L845 WeakPolarHBondContact O-CB 3.24Å; V841-L845 WeakPolarHBondContact O-CG 3.48Å; V841-L845 PolarHBondContact O-N 3.37Å; V841-I915 HydrophobicContact CG1-CG2 4.26Å; V841-L919 HydrophobicContact CB-CD1 4.36Å; V841-L919 HydrophobicContact CG1-CD2 4.22Å; V841-L919 HydrophobicContact CG2-CD1 4.07Å
842	F	94.5	Very high	93	Very high	54 Å²	54	33 Å²	33	24%	0.237	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-42.4	176.1	174.2	-107.4	0	0	0	112.5	T838 L839 H840 L845 N846 V927 E930 I934	T838-F842 PolarHBondContact O-N 3.47Å; T838-F842 VanDerWaalsContact O-N 3.09Å; L839-F842 PolarHBondContact O-N 2.91Å; H840-F842 VanDerWaalsContact C-N 3.32Å; H840-F842 PolarHBondContact O-N 3.2Å; F842-L845 PolarHBondContact O-N 2.97Å; F842-N846 WeakPolarHBondContact O-CB 3.28Å; F842-N846 PolarHBondContact O-N 3.25Å; F842-V927 HydrophobicContact CB-CG2 4.38Å; F842-E930 HydrophobicContact CD2-CB 3.9Å; F842-E930 HydrophobicContact CE2-CB 3.23Å; F842-E930 HydrophobicContact CE2-CG 4.06Å; F842-E930 HydrophobicContact CZ-CB 3.59Å; F842-E930 HydrophobicContact CZ-CG 4.08Å; F842-I934 HydrophobicContact CE2-CD1 3.94Å; F842-I934 HydrophobicContact CZ-CD1 4.15Å
843	W	93.6	Very high	93.3	Very high	136 Å²	136	31.2 Å²	31.2	52%	0.515	15%	0.147	S	C	.	.	H	α-helix	trans	-56.9	-51.9	176.4	-176.7	-88.1	0	0	0	111.6	L839 H840 L845 N846 F847	L839-W843 WeakPolarHBondContact O-CB 3.44Å; L839-W843 PolarHBondContact O-N 3.34Å; H840-W843 WeakPolarHBondContact O-CB 3.41Å; H840-W843 PolarHBondContact O-N 3.42Å; W843-L845 VanDerWaalsContact C-N 3.31Å; W843-L845 PolarHBondContact O-N 3.27Å; W843-N846 PolarHBondContact O-N 3Å; W843-F847 AromaticContact CD1-CD2 3.97Å; W843-F847 AromaticContact CD2-CD2 3.6Å; W843-F847 HydrophobicContact CD2-CD2 3.6Å; W843-F847 AromaticContact CD2-CE2 3.55Å; W843-F847 HydrophobicContact CD2-CE2 3.55Å; W843-F847 AromaticContact CE2-CD2 3.49Å; W843-F847 VanDerWaalsContact CE2-CD2 3.49Å; W843-F847 AromaticContact CE2-CE2 3.58Å; W843-F847 HydrophobicContact CE3-CD2 4.12Å; W843-F847 AromaticContact CE3-CE2 3.58Å; W843-F847 HydrophobicContact CE3-CE2 3.58Å; W843-F847 AromaticContact CG-CD2 3.89Å; W843-F847 HydrophobicContact CG-CD2 3.89Å; W843-F847 HydrophobicContact CG-CE2 4.27Å; W843-F847 HydrophobicContact CH2-CD2 4.39Å; W843-F847 AromaticContact CH2-CE2 3.66Å; W843-F847 HydrophobicContact CH2-CE2 3.66Å; W843-F847 HydrophobicContact CH2-CZ 4.14Å; W843-F847 AromaticContact CZ2-CD2 3.92Å; W843-F847 HydrophobicContact CZ2-CD2 3.92Å; W843-F847 AromaticContact CZ2-CE2 3.65Å; W843-F847 HydrophobicContact CZ2-CE2 3.65Å; W843-F847 HydrophobicContact CZ2-CZ 4.31Å; W843-F847 HydrophobicContact CZ3-CD2 4.49Å; W843-F847 AromaticContact CZ3-CE2 3.63Å; W843-F847 HydrophobicContact CZ3-CE2 3.63Å; W843-F847 HydrophobicContact CZ3-CZ 4.31Å; W843-F847 AromaticContact NE1-CD2 3.72Å; W843-F847 VanDerWaalsContact O-CD2 3.24Å; W843-F847 WeakPolarHBondContact O-CD2 3.24Å; W843-F847 PolarHBondContact O-N 3.3Å
844	E	94.1	Very high	93.6	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.009	12%	0.123	C	C	.	.	H	α-helix	trans	-66.3	-32.4	178.3	-69.8	-64.2	136.8	0	0	112.3	D789 L790 H840 V841 D848 F849 R875	D789-E844 WeakPolarHBondContact CA-OE2 3.43Å; L790-E844 HydrophobicContact CB-CB 4.16Å; H840-E844 IonicContact CE1-OE1 2.6Å; H840-E844 PolarHBondContact CE1-OE1 3Å; H840-E844 WeakPolarHBondContact NE2-CG 3.09Å; H840-E844 IonicContact NE2-OE1 3.78Å; H840-E844 WeakPolarHBondContact O-CB 3.43Å; H840-E844 WeakPolarHBondContact O-CG 3.43Å; H840-E844 PolarHBondContact O-N 3.14Å; V841-E844 PolarHBondContact O-N 3.43Å; E844-D848 WeakPolarHBondContact O-CA 3.41Å; E844-D848 PolarHBondContact O-N 3.02Å; E844-F849 PolarHBondContact O-N 2.91Å; E844-R875 IonicContact OE1-CZ 2.76Å; E844-R875 IonicContact OE1-NE 3.78Å; E844-R875 PolarHBondContact OE1-NE 2.77Å; E844-R875 IonicContact OE1-NH2 2.7Å; E844-R875 IonicContact OE2-CZ 2.82Å; E844-R875 IonicContact OE2-NE 2.74Å; E844-R875 IonicContact OE2-NH2 3.88Å; E844-R875 PolarHBondContact OE2-NH2 2.95Å
845	L	94.1	Very high	93.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.112	C	C	.	.	I	π-helix	trans	-61.2	-49.9	172.6	-75.1	171.8	0	0	0	111	L790 V841 F842 W843 F849 L850 V927 F1004	L790-L845 HydrophobicContact CD2-CD2 3.8Å; L790-L845 HydrophobicContact CD2-CG 4.43Å; V841-L845 HydrophobicContact CG1-CD1 3.96Å; V841-L845 HydrophobicContact CG1-CG 4.37Å; V841-L845 WeakPolarHBondContact O-CB 3.24Å; V841-L845 WeakPolarHBondContact O-CG 3.48Å; V841-L845 PolarHBondContact O-N 3.37Å; F842-L845 PolarHBondContact O-N 2.97Å; W843-L845 VanDerWaalsContact C-N 3.31Å; W843-L845 PolarHBondContact O-N 3.27Å; L845-F849 HydrophobicContact CD2-CB 3.79Å; L845-F849 HydrophobicContact CD2-CD1 3.48Å; L845-F849 VanDerWaalsContact CD2-CD1 3.48Å; L845-F849 HydrophobicContact CD2-CE1 4.2Å; L845-F849 HydrophobicContact CD2-CG 3.71Å; L845-L850 WeakPolarHBondContact O-CB 3.34Å; L845-L850 WeakPolarHBondContact O-CG 3.4Å; L845-L850 PolarHBondContact O-N 2.97Å; L845-V927 HydrophobicContact CD1-CG1 3.63Å; L845-F1004 HydrophobicContact CD1-CD1 4.47Å; L845-F1004 HydrophobicContact CD1-CD2 4.33Å; L845-F1004 HydrophobicContact CD1-CE1 3.93Å; L845-F1004 HydrophobicContact CD1-CE2 3.8Å; L845-F1004 HydrophobicContact CD1-CZ 3.57Å; L845-F1004 HydrophobicContact CD2-CD2 3.57Å; L845-F1004 HydrophobicContact CD2-CE2 3.48Å; L845-F1004 VanDerWaalsContact CD2-CE2 3.48Å; L845-F1004 HydrophobicContact CD2-CG 4.36Å; L845-F1004 HydrophobicContact CD2-CZ 4.16Å; L845-F1004 HydrophobicContact CG-CE2 4.26Å; L845-F1004 HydrophobicContact CG-CZ 4.5Å
846	N	91.7	Very high	94	Very high	50 Å²	50	28 Å²	28	27%	0.267	13%	0.129	S	C	.	.	I	π-helix	trans	-67.1	-44.1	-177.2	-173.8	60.2	0	0	0	112.9	F842 W843 I934	F842-N846 WeakPolarHBondContact O-CB 3.28Å; F842-N846 PolarHBondContact O-N 3.25Å; W843-N846 PolarHBondContact O-N 3Å; N846-I934 HydrophobicContact CB-CD1 4.36Å; N846-I934 VanDerWaalsContact OD1-CD1 3.27Å; N846-I934 WeakPolarHBondContact OD1-CD1 3.31Å
847	F	90.1	Very high	93.8	Very high	84 Å²	84	28.3 Å²	28.3	37%	0.368	14%	0.14	S	C	.	.	I	π-helix	trans	-97.4	-20.5	-170.3	-67.2	-69.2	0	0	0	115.3	W843 P851 P873	W843-F847 AromaticContact CD1-CD2 3.97Å; W843-F847 AromaticContact CD2-CD2 3.6Å; W843-F847 HydrophobicContact CD2-CD2 3.6Å; W843-F847 AromaticContact CD2-CE2 3.55Å; W843-F847 HydrophobicContact CD2-CE2 3.55Å; W843-F847 AromaticContact CE2-CD2 3.49Å; W843-F847 VanDerWaalsContact CE2-CD2 3.49Å; W843-F847 AromaticContact CE2-CE2 3.58Å; W843-F847 HydrophobicContact CE3-CD2 4.12Å; W843-F847 AromaticContact CE3-CE2 3.58Å; W843-F847 HydrophobicContact CE3-CE2 3.58Å; W843-F847 AromaticContact CG-CD2 3.89Å; W843-F847 HydrophobicContact CG-CD2 3.89Å; W843-F847 HydrophobicContact CG-CE2 4.27Å; W843-F847 HydrophobicContact CH2-CD2 4.39Å; W843-F847 AromaticContact CH2-CE2 3.66Å; W843-F847 HydrophobicContact CH2-CE2 3.66Å; W843-F847 HydrophobicContact CH2-CZ 4.14Å; W843-F847 AromaticContact CZ2-CD2 3.92Å; W843-F847 HydrophobicContact CZ2-CD2 3.92Å; W843-F847 AromaticContact CZ2-CE2 3.65Å; W843-F847 HydrophobicContact CZ2-CE2 3.65Å; W843-F847 HydrophobicContact CZ2-CZ 4.31Å; W843-F847 HydrophobicContact CZ3-CD2 4.49Å; W843-F847 AromaticContact CZ3-CE2 3.63Å; W843-F847 HydrophobicContact CZ3-CE2 3.63Å; W843-F847 HydrophobicContact CZ3-CZ 4.31Å; W843-F847 AromaticContact NE1-CD2 3.72Å; W843-F847 VanDerWaalsContact O-CD2 3.24Å; W843-F847 WeakPolarHBondContact O-CD2 3.24Å; W843-F847 PolarHBondContact O-N 3.3Å; F847-P851 VanDerWaalsContact O-CG 3.31Å; F847-P851 WeakPolarHBondContact O-CG 3.38Å; F847-P873 HydrophobicContact CB-CG 4.36Å
848	D	92.4	Very high	93.5	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.181	C	C	.	.	I	π-helix	trans	-125.2	-54.2	-178.6	-165.7	17.2	0	0	0	112.6	E844 P851 N852 R864 R875	E844-D848 WeakPolarHBondContact O-CA 3.41Å; E844-D848 PolarHBondContact O-N 3.02Å; D848-P851 WeakPolarHBondContact O-CD 3.27Å; D848-N852 VanDerWaalsContact O-CB 3.22Å; D848-N852 WeakPolarHBondContact O-CB 3.41Å; D848-N852 PolarHBondContact O-N 3.18Å; D848-N852 PolarHBondContact OD1-ND2 3.35Å; D848-R864 IonicContact OD1-CZ 3.62Å; D848-R864 IonicContact OD1-NH1 3.44Å; D848-R864 PolarHBondContact OD1-NH1 2.71Å; D848-R864 IonicContact OD1-NH2 2.91Å; D848-R864 IonicContact OD2-CZ 3.34Å; D848-R864 IonicContact OD2-NH1 3.24Å; D848-R864 PolarHBondContact OD2-NH1 3.34Å; D848-R864 IonicContact OD2-NH2 3.58Å; D848-R864 PolarHBondContact OD2-NH2 3.36Å; D848-R875 IonicContact OD2-CZ 3.82Å; D848-R875 IonicContact OD2-NH2 2.68Å; D848-R875 PolarHBondContact OD2-NH2 3.42Å
849	F	94.3	Very high	93.5	Very high	1 Å²	1	37.3 Å²	37.3	0%	0.004	20%	0.201	C	C	.	.	I	π-helix	trans	-62.2	-56.6	-172.5	-177.1	-102.8	0	0	0	113.5	L790 E844 L845 Y853 F862 V907 F912 N1000 F1004	L790-F849 HydrophobicContact CD2-CB 4.38Å; L790-F849 HydrophobicContact CD2-CD2 4.17Å; L790-F849 HydrophobicContact CD2-CG 4.35Å; E844-F849 PolarHBondContact O-N 2.91Å; L845-F849 HydrophobicContact CD2-CB 3.79Å; L845-F849 HydrophobicContact CD2-CD1 3.48Å; L845-F849 VanDerWaalsContact CD2-CD1 3.48Å; L845-F849 HydrophobicContact CD2-CE1 4.2Å; L845-F849 HydrophobicContact CD2-CG 3.71Å; F849-Y853 HydrophobicContact CB-CD2 4.43Å; F849-Y853 HydrophobicContact CD2-CD1 4.34Å; F849-Y853 HydrophobicContact CD2-CD2 4.06Å; F849-Y853 HydrophobicContact CD2-CE2 4.49Å; F849-Y853 AromaticContact CD2-CG 3.93Å; F849-Y853 HydrophobicContact CD2-CG 3.93Å; F849-Y853 HydrophobicContact CE2-CG 4.35Å; F849-Y853 WeakPolarHBondContact O-CB 3.34Å; F849-Y853 PolarHBondContact O-N 3.27Å; F849-F862 HydrophobicContact CE1-CE1 4.26Å; F849-F862 HydrophobicContact CE1-CZ 4.4Å; F849-F862 HydrophobicContact CE2-CB 4.15Å; F849-F862 AromaticContact CE2-CD1 3.97Å; F849-F862 HydrophobicContact CE2-CD1 3.97Å; F849-F862 HydrophobicContact CE2-CD2 4Å; F849-F862 HydrophobicContact CE2-CE1 4.34Å; F849-F862 HydrophobicContact CE2-CE2 4.39Å; F849-F862 AromaticContact CE2-CG 3.79Å; F849-F862 HydrophobicContact CE2-CG 3.79Å; F849-F862 AromaticContact CZ-CD1 3.72Å; F849-F862 HydrophobicContact CZ-CD1 3.72Å; F849-F862 AromaticContact CZ-CD2 3.85Å; F849-F862 HydrophobicContact CZ-CD2 3.85Å; F849-F862 AromaticContact CZ-CE1 3.61Å; F849-F862 HydrophobicContact CZ-CE1 3.61Å; F849-F862 AromaticContact CZ-CE2 3.77Å; F849-F862 HydrophobicContact CZ-CE2 3.77Å; F849-F862 AromaticContact CZ-CG 3.83Å; F849-F862 HydrophobicContact CZ-CG 3.83Å; F849-F862 AromaticContact CZ-CZ 3.66Å; F849-F862 HydrophobicContact CZ-CZ 3.66Å; F849-V907 HydrophobicContact CD2-CG2 4.34Å; F849-V907 HydrophobicContact CE2-CB 4.04Å; F849-V907 HydrophobicContact CE2-CG1 3.91Å; F849-V907 HydrophobicContact CE2-CG2 4.27Å; F849-F912 HydrophobicContact CZ-CZ 4.45Å; F849-N1000 HydrophobicContact CE1-CB 4.47Å; F849-F1004 HydrophobicContact CE1-CB 4.25Å; F849-F1004 AromaticContact CE1-CD2 4Å; F849-F1004 HydrophobicContact CE1-CD2 4Å; F849-F1004 HydrophobicContact CZ-CD2 4.43Å
850	L	93.5	Very high	93.5	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-59	-47.6	-179.8	-61.9	177.8	0	0	0	112.4	L845 L931 I934 R996 E997 N1000 A1001	L845-L850 WeakPolarHBondContact O-CB 3.34Å; L845-L850 WeakPolarHBondContact O-CG 3.4Å; L845-L850 PolarHBondContact O-N 2.97Å; L850-L931 HydrophobicContact CD1-CD2 3.85Å; L850-L931 HydrophobicContact CD2-CD2 4.48Å; L850-I934 HydrophobicContact CD1-CD1 4.41Å; L850-I934 HydrophobicContact CD1-CG2 4.34Å; L850-R996 PolarHBondContact O-NE 3.33Å; L850-R996 PolarHBondContact O-NH2 3.16Å; L850-E997 HydrophobicContact CB-CB 4.3Å; L850-E997 HydrophobicContact CB-CG 4.15Å; L850-E997 WeakPolarHBondContact O-CG 3.42Å; L850-N1000 HydrophobicContact CD2-CB 3.73Å; L850-N1000 PolarHBondContact O-ND2 3.48Å; L850-A1001 HydrophobicContact CD2-CB 3.83Å; L850-A1001 VanDerWaalsContact CD2-N 3.34Å
851	P	92	Very high	93.5	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.032	21%	0.206	C	C	.	.	H	α-helix	trans	-79	-26.8	-176.8	28.3	-35.8	0	0	0	115.3	F847 D848 T870 Q993 R996	F847-P851 VanDerWaalsContact O-CG 3.31Å; F847-P851 WeakPolarHBondContact O-CG 3.38Å; D848-P851 WeakPolarHBondContact O-CD 3.27Å; P851-T870 HydrophobicContact CB-CG2 4.4Å; P851-Q993 PolarHBondContact O-NE2 3.2Å; P851-R996 VanDerWaalsContact C-NH2 3.3Å; P851-R996 PolarHBondContact O-NH1 3.31Å; P851-R996 VanDerWaalsContact O-NH1 3.16Å; P851-R996 PolarHBondContact O-NH2 2.98Å
852	N	92.3	Very high	93.5	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.016	21%	0.206	C	C	.	.	H	α-helix	trans	-115.5	-5.6	-167.7	-58.6	-37.8	0	0	0	114.9	D848 R864 T865	D848-N852 VanDerWaalsContact O-CB 3.22Å; D848-N852 WeakPolarHBondContact O-CB 3.41Å; D848-N852 PolarHBondContact O-N 3.18Å; D848-N852 PolarHBondContact OD1-ND2 3.35Å; N852-R864 CarbonylContact O-C 3.56Å; N852-R864 WeakPolarHBondContact O-CA 3.48Å; N852-T865 WeakPolarHBondContact O-CG2 3.39Å; N852-T865 PolarHBondContact O-N 3.09Å
853	Y	94	Very high	93.5	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.008	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	146.1	-177.3	-74.6	-106.3	0	0	0	113.9	T791 F849 F862 V863 R864 V907 R996 N1000	T791-Y853 WeakPolarHBondContact CG2-OH 3.3Å; F849-Y853 HydrophobicContact CB-CD2 4.43Å; F849-Y853 HydrophobicContact CD2-CD1 4.34Å; F849-Y853 HydrophobicContact CD2-CD2 4.06Å; F849-Y853 HydrophobicContact CD2-CE2 4.49Å; F849-Y853 AromaticContact CD2-CG 3.93Å; F849-Y853 HydrophobicContact CD2-CG 3.93Å; F849-Y853 HydrophobicContact CE2-CG 4.35Å; F849-Y853 WeakPolarHBondContact O-CB 3.34Å; F849-Y853 PolarHBondContact O-N 3.27Å; Y853-F862 HydrophobicContact CD1-CB 3.8Å; Y853-F862 HydrophobicContact CG-CB 4.39Å; Y853-V863 CarbonylContact C-O 3.48Å; Y853-V863 WeakPolarHBondContact CA-O 3.48Å; Y853-R864 HydrophobicContact CE1-CG 4.18Å; Y853-R864 HydrophobicContact CE2-CG 4.37Å; Y853-R864 PolarHBondContact OH-NH2 3.26Å; Y853-V907 HydrophobicContact CD1-CG2 4.22Å; Y853-V907 HydrophobicContact CE1-CB 4.46Å; Y853-V907 HydrophobicContact CE1-CG2 3.64Å; Y853-R996 WeakPolarHBondContact O-CD 3.43Å; Y853-N1000 PolarHBondContact O-ND2 3.02Å
854	C	94.4	Very high	93.4	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.034	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	117.8	-179.4	-62.8	0	0	0	0	109.3	F862 V863 C1150	C854-F862 VanDerWaalsContact O-CA 3.27Å; C854-F862 WeakPolarHBondContact O-CA 3.38Å; C854-V863 HydrophobicContact CB-CG2 4.32Å; C854-V863 PolarHBondContact N-O 3.27Å; C854-V863 PolarHBondContact O-N 3.34Å; C854-C1150 VanDerWaalsContact SG-C 3.51Å; C854-C1150 PolarHBondContact SG-O 3.12Å
855	Y	96.6	Very high	93.2	Very high	23 Å²	23	38.6 Å²	38.6	9%	0.09	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	138.4	176.5	-172.7	-124.4	0	0	0	111.8	N860 F862 L1003 L1007 D1153	Y855-N860 PolarHBondContact OH-OD1 2.85Å; Y855-N860 VanDerWaalsContact OH-OD1 3.05Å; Y855-F862 VanDerWaalsContact CB-CE1 3.48Å; Y855-F862 HydrophobicContact CD2-CD1 4.07Å; Y855-F862 AromaticContact CD2-CD2 3.76Å; Y855-F862 HydrophobicContact CD2-CD2 3.76Å; Y855-F862 AromaticContact CD2-CE1 3.79Å; Y855-F862 HydrophobicContact CD2-CE1 3.79Å; Y855-F862 AromaticContact CD2-CE2 3.43Å; Y855-F862 HydrophobicContact CD2-CE2 3.43Å; Y855-F862 VanDerWaalsContact CD2-CE2 3.43Å; Y855-F862 HydrophobicContact CD2-CG 4.05Å; Y855-F862 AromaticContact CD2-CZ 3.44Å; Y855-F862 HydrophobicContact CD2-CZ 3.44Å; Y855-F862 VanDerWaalsContact CD2-CZ 3.44Å; Y855-F862 HydrophobicContact CE2-CD2 4.38Å; Y855-F862 AromaticContact CE2-CE2 3.9Å; Y855-F862 HydrophobicContact CE2-CE2 3.9Å; Y855-F862 HydrophobicContact CE2-CZ 4.17Å; Y855-F862 HydrophobicContact CG-CD1 4.36Å; Y855-F862 AromaticContact CG-CE1 3.94Å; Y855-F862 HydrophobicContact CG-CE1 3.94Å; Y855-F862 HydrophobicContact CG-CE2 4.35Å; Y855-F862 AromaticContact CG-CZ 3.91Å; Y855-F862 HydrophobicContact CG-CZ 3.91Å; Y855-L1003 HydrophobicContact CD1-CD1 3.49Å; Y855-L1003 VanDerWaalsContact CD1-CD1 3.49Å; Y855-L1003 HydrophobicContact CD1-CD2 3.78Å; Y855-L1003 HydrophobicContact CD1-CG 4.28Å; Y855-L1003 HydrophobicContact CE1-CD1 4.27Å; Y855-L1003 HydrophobicContact CE1-CD2 3.68Å; Y855-L1003 HydrophobicContact CG-CD1 3.67Å; Y855-L1003 HydrophobicContact CG-CD2 4.48Å; Y855-L1007 HydrophobicContact CE2-CD1 3.95Å; Y855-D1153 HydrophobicContact CD1-CB 4.02Å; Y855-D1153 PolarHBondContact O-N 3.31Å
856	N	94.8	Very high	92.6	Very high	68 Å²	68	40.8 Å²	40.8	36%	0.364	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	101.5	170.1	179.7	-32.4	0	0	0	109.3	S858 T859 N860 R861	N856-S858 PolarHBondContact O-N 2.82Å; N856-S858 WeakPolarHBondContact OD1-CB 3.49Å; N856-S858 PolarHBondContact OD1-N 3.04Å; N856-S858 VanDerWaalsContact OD1-N 3.12Å; N856-T859 PolarHBondContact O-N 3.06Å; N856-T859 VanDerWaalsContact O-N 3.14Å; N856-T859 PolarHBondContact O-OG1 3.06Å; N856-T859 PolarHBondContact OD1-N 3.38Å; N856-T859 PolarHBondContact OD1-OG1 3.23Å; N856-N860 PolarHBondContact O-N 3.02Å; N856-R861 PolarHBondContact N-O 2.7Å; N856-R861 PolarHBondContact O-N 3.32Å
857	G	91	Very high	91.9	Very high	32 Å²	32	41.5 Å²	41.5	33%	0.33	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.1	-176.1	0	0	0	0	0	114.3	T859 D1153	G857-T859 VanDerWaalsContact C-N 3.35Å; G857-D1153 PolarHBondContact N-OD2 3.14Å
858	S	91.3	Very high	91.1	Very high	122 Å²	122	41.7 Å²	41.7	85%	0.853	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-32.2	177.1	-62	0	0	0	0	112.5	N856	N856-S858 PolarHBondContact O-N 2.82Å; N856-S858 WeakPolarHBondContact OD1-CB 3.49Å; N856-S858 PolarHBondContact OD1-N 3.04Å; N856-S858 VanDerWaalsContact OD1-N 3.12Å
859	T	93.2	Very high	90.1	Very high	78 Å²	78	44.7 Å²	44.7	48%	0.479	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-11.2	-179.8	62.3	0	0	0	0	113.5	N856 G857 R861	N856-T859 PolarHBondContact O-N 3.06Å; N856-T859 VanDerWaalsContact O-N 3.14Å; N856-T859 PolarHBondContact O-OG1 3.06Å; N856-T859 PolarHBondContact OD1-N 3.38Å; N856-T859 PolarHBondContact OD1-OG1 3.23Å; G857-T859 VanDerWaalsContact C-N 3.35Å; T859-R861 VanDerWaalsContact C-N 3.29Å; T859-R861 PolarHBondContact O-N 3.14Å
860	N	93.8	Very high	89.1	Confident	51 Å²	51	47.2 Å²	47.2	27%	0.273	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	45.6	-170.4	-167.2	13.4	0	0	0	112.2	Y855 N856 P909 L1007	Y855-N860 PolarHBondContact OH-OD1 2.85Å; Y855-N860 VanDerWaalsContact OH-OD1 3.05Å; N856-N860 PolarHBondContact O-N 3.02Å; N860-P909 WeakPolarHBondContact O-CD 3.36Å; N860-L1007 WeakPolarHBondContact OD1-CD2 3.42Å
861	R	95.8	Very high	87.9	Confident	116 Å²	116	55.9 Å²	55.9	44%	0.438	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	148.2	-179.3	-68	179.1	-178.8	-168	-1.6	110.6	N856 T859 F906 V907	N856-R861 PolarHBondContact N-O 2.7Å; N856-R861 PolarHBondContact O-N 3.32Å; T859-R861 VanDerWaalsContact C-N 3.29Å; T859-R861 PolarHBondContact O-N 3.14Å; R861-F906 HydrophobicContact CB-CD2 4.19Å; R861-F906 HydrophobicContact CG-CD2 3.74Å; R861-F906 HydrophobicContact CG-CE2 4.16Å; R861-V907 CarbonylContact C-O 3.4Å; R861-V907 WeakPolarHBondContact CA-O 3.41Å
862	F	96.1	Very high	87	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	139.9	167.3	-64	-101	0	0	0	110	F849 Y853 C854 Y855 F906 V907 F912 L1003 L1007	F849-F862 HydrophobicContact CE1-CE1 4.26Å; F849-F862 HydrophobicContact CE1-CZ 4.4Å; F849-F862 HydrophobicContact CE2-CB 4.15Å; F849-F862 AromaticContact CE2-CD1 3.97Å; F849-F862 HydrophobicContact CE2-CD1 3.97Å; F849-F862 HydrophobicContact CE2-CD2 4Å; F849-F862 HydrophobicContact CE2-CE1 4.34Å; F849-F862 HydrophobicContact CE2-CE2 4.39Å; F849-F862 AromaticContact CE2-CG 3.79Å; F849-F862 HydrophobicContact CE2-CG 3.79Å; F849-F862 AromaticContact CZ-CD1 3.72Å; F849-F862 HydrophobicContact CZ-CD1 3.72Å; F849-F862 AromaticContact CZ-CD2 3.85Å; F849-F862 HydrophobicContact CZ-CD2 3.85Å; F849-F862 AromaticContact CZ-CE1 3.61Å; F849-F862 HydrophobicContact CZ-CE1 3.61Å; F849-F862 AromaticContact CZ-CE2 3.77Å; F849-F862 HydrophobicContact CZ-CE2 3.77Å; F849-F862 AromaticContact CZ-CG 3.83Å; F849-F862 HydrophobicContact CZ-CG 3.83Å; F849-F862 AromaticContact CZ-CZ 3.66Å; F849-F862 HydrophobicContact CZ-CZ 3.66Å; Y853-F862 HydrophobicContact CD1-CB 3.8Å; Y853-F862 HydrophobicContact CG-CB 4.39Å; C854-F862 VanDerWaalsContact O-CA 3.27Å; C854-F862 WeakPolarHBondContact O-CA 3.38Å; Y855-F862 VanDerWaalsContact CB-CE1 3.48Å; Y855-F862 HydrophobicContact CD2-CD1 4.07Å; Y855-F862 AromaticContact CD2-CD2 3.76Å; Y855-F862 HydrophobicContact CD2-CD2 3.76Å; Y855-F862 AromaticContact CD2-CE1 3.79Å; Y855-F862 HydrophobicContact CD2-CE1 3.79Å; Y855-F862 AromaticContact CD2-CE2 3.43Å; Y855-F862 HydrophobicContact CD2-CE2 3.43Å; Y855-F862 VanDerWaalsContact CD2-CE2 3.43Å; Y855-F862 HydrophobicContact CD2-CG 4.05Å; Y855-F862 AromaticContact CD2-CZ 3.44Å; Y855-F862 HydrophobicContact CD2-CZ 3.44Å; Y855-F862 VanDerWaalsContact CD2-CZ 3.44Å; Y855-F862 HydrophobicContact CE2-CD2 4.38Å; Y855-F862 AromaticContact CE2-CE2 3.9Å; Y855-F862 HydrophobicContact CE2-CE2 3.9Å; Y855-F862 HydrophobicContact CE2-CZ 4.17Å; Y855-F862 HydrophobicContact CG-CD1 4.36Å; Y855-F862 AromaticContact CG-CE1 3.94Å; Y855-F862 HydrophobicContact CG-CE1 3.94Å; Y855-F862 HydrophobicContact CG-CE2 4.35Å; Y855-F862 AromaticContact CG-CZ 3.91Å; Y855-F862 HydrophobicContact CG-CZ 3.91Å; F862-F906 CarbonylContact O-C 3.59Å; F862-F906 WeakPolarHBondContact O-CA 3.2Å; F862-F906 WeakPolarHBondContact O-CB 3.41Å; F862-V907 HydrophobicContact CB-CB 4.19Å; F862-V907 PolarHBondContact N-O 3.48Å; F862-V907 PolarHBondContact O-N 3.03Å; F862-F912 HydrophobicContact CD2-CE2 4.35Å; F862-F912 HydrophobicContact CD2-CZ 4.46Å; F862-F912 HydrophobicContact CE2-CE2 4.05Å; F862-F912 AromaticContact CE2-CZ 3.92Å; F862-F912 HydrophobicContact CE2-CZ 3.92Å; F862-L1003 HydrophobicContact CE1-CD1 4.37Å; F862-L1003 HydrophobicContact CZ-CB 3.96Å; F862-L1003 HydrophobicContact CZ-CD1 4.34Å; F862-L1007 HydrophobicContact CE2-CD1 3.53Å; F862-L1007 HydrophobicContact CZ-CD1 4.03Å
863	V	94.7	Very high	86.4	Confident	69 Å²	69	62.4 Å²	62.4	42%	0.418	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	155.2	173.9	-65.2	0	0	0	0	109.6	Y853 C854 F906	Y853-V863 CarbonylContact C-O 3.48Å; Y853-V863 WeakPolarHBondContact CA-O 3.48Å; C854-V863 HydrophobicContact CB-CG2 4.32Å; C854-V863 PolarHBondContact N-O 3.27Å; C854-V863 PolarHBondContact O-N 3.34Å; V863-F906 HydrophobicContact CG1-CB 4.48Å
864	R	91.7	Very high	85.8	Confident	81 Å²	81	71.3 Å²	71.3	31%	0.306	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	146.7	176.8	-71.6	-173.5	176.1	-80.7	-8.3	110.9	D789 D848 N852 Y853 E872	D789-R864 IonicContact OD2-CZ 3.29Å; D789-R864 IonicContact OD2-NH2 3.32Å; D789-R864 PolarHBondContact OD2-NH2 3.11Å; D848-R864 IonicContact OD1-CZ 3.62Å; D848-R864 IonicContact OD1-NH1 3.44Å; D848-R864 PolarHBondContact OD1-NH1 2.71Å; D848-R864 IonicContact OD1-NH2 2.91Å; D848-R864 IonicContact OD2-CZ 3.34Å; D848-R864 IonicContact OD2-NH1 3.24Å; D848-R864 PolarHBondContact OD2-NH1 3.34Å; D848-R864 IonicContact OD2-NH2 3.58Å; D848-R864 PolarHBondContact OD2-NH2 3.36Å; N852-R864 CarbonylContact O-C 3.56Å; N852-R864 WeakPolarHBondContact O-CA 3.48Å; Y853-R864 HydrophobicContact CE1-CG 4.18Å; Y853-R864 HydrophobicContact CE2-CG 4.37Å; Y853-R864 PolarHBondContact OH-NH2 3.26Å; R864-E872 IonicContact NH1-OE1 2.58Å
865	T	90.4	Very high	85.4	Confident	19 Å²	19	74.2 Å²	74.2	12%	0.117	39%	0.394	C	S	.	.			trans	-63.8	148.6	176.3	-175.3	0	0	0	0	111.5	N852 I867 C1150	N852-T865 WeakPolarHBondContact O-CG2 3.39Å; N852-T865 PolarHBondContact O-N 3.09Å; T865-I867 VanDerWaalsContact C-N 3.32Å; T865-I867 VanDerWaalsContact CG2-O 3.23Å; T865-I867 WeakPolarHBondContact CG2-O 3.48Å; T865-I867 PolarHBondContact OG1-O 3.3Å; T865-C1150 WeakPolarHBondContact CB-O 3.27Å; T865-C1150 PolarHBondContact OG1-O 3.36Å
866	A	81.4	Confident	84.9	Confident	46 Å²	46	79.6 Å²	79.6	38%	0.38	43%	0.425	S	S	.	.	S	Bend	trans	-71.4	-26.5	176.8	0	0	0	0	0	113.2	F1145 Q1149	A866-F1145 HydrophobicContact CB-CD1 3.58Å; A866-F1145 HydrophobicContact CB-CE1 3.76Å; A866-F1145 HydrophobicContact CB-CG 4.06Å; A866-F1145 HydrophobicContact CB-CZ 4.35Å; A866-Q1149 PolarHBondContact N-O 3.11Å
867	I	76.7	Confident	84.3	Confident	65 Å²	65	85.8 Å²	85.8	33%	0.333	45%	0.448	S	S	.	.	S	Bend	trans	-128.3	114.5	178.8	-56.4	176	0	0	0	107.8	T865 F869 F1145	T865-I867 VanDerWaalsContact C-N 3.32Å; T865-I867 VanDerWaalsContact CG2-O 3.23Å; T865-I867 WeakPolarHBondContact CG2-O 3.48Å; T865-I867 PolarHBondContact OG1-O 3.3Å; I867-F869 HydrophobicContact CB-CE2 4.01Å; I867-F869 HydrophobicContact CB-CZ 3.97Å; I867-F869 HydrophobicContact CD1-CZ 4.48Å; I867-F869 HydrophobicContact CG2-CE1 4.1Å; I867-F869 HydrophobicContact CG2-CE2 4.28Å; I867-F869 HydrophobicContact CG2-CZ 3.96Å; I867-F869 WeakPolarHBondContact O-CD2 3.45Å; I867-F869 VanDerWaalsContact O-CE2 3.29Å; I867-F869 WeakPolarHBondContact O-CE2 3.22Å; I867-F869 PolarHBondContact O-N 3.02Å; I867-F1145 HydrophobicContact CD1-CB 4.32Å; I867-F1145 HydrophobicContact CD1-CD2 3.81Å; I867-F1145 HydrophobicContact CD1-CG 4.4Å; I867-F1145 HydrophobicContact CG1-CD2 3.9Å; I867-F1145 HydrophobicContact CG1-CE2 4.35Å; I867-F1145 HydrophobicContact CG1-CG 4.45Å
868	P	72.3	Confident	83.8	Confident	87 Å²	87	87.4 Å²	87.4	57%	0.565	45%	0.453	S	S	*	.			trans	-71.8	113.8	174.7	28.4	-31.4	0	0	0	109.5
869	F	71	Confident	83.3	Confident	64 Å²	64	85.4 Å²	85.4	28%	0.281	44%	0.444	S	S	.	.	S	Bend	trans	-88.6	-11.5	174.3	-63.9	-79.5	0	0	0	112.5	I867 T989 C1150 F1151	I867-F869 HydrophobicContact CB-CE2 4.01Å; I867-F869 HydrophobicContact CB-CZ 3.97Å; I867-F869 HydrophobicContact CD1-CZ 4.48Å; I867-F869 HydrophobicContact CG2-CE1 4.1Å; I867-F869 HydrophobicContact CG2-CE2 4.28Å; I867-F869 HydrophobicContact CG2-CZ 3.96Å; I867-F869 WeakPolarHBondContact O-CD2 3.45Å; I867-F869 VanDerWaalsContact O-CE2 3.29Å; I867-F869 WeakPolarHBondContact O-CE2 3.22Å; I867-F869 PolarHBondContact O-N 3.02Å; F869-T989 HydrophobicContact CD1-CG2 4.11Å; F869-T989 HydrophobicContact CE1-CG2 4.28Å; F869-C1150 HydrophobicContact CE2-CB 4.11Å; F869-C1150 HydrophobicContact CZ-CB 4.49Å; F869-F1151 HydrophobicContact CD2-CE1 4.05Å; F869-F1151 HydrophobicContact CD2-CZ 4.24Å; F869-F1151 AromaticContact CE2-CE1 3.89Å; F869-F1151 HydrophobicContact CE2-CE1 3.89Å; F869-F1151 HydrophobicContact CE2-CE2 4.49Å; F869-F1151 AromaticContact CE2-CZ 3.68Å; F869-F1151 HydrophobicContact CE2-CZ 3.68Å; F869-F1151 AromaticContact CZ-CZ 3.89Å; F869-F1151 HydrophobicContact CZ-CZ 3.89Å
870	T	73.6	Confident	82.8	Confident	54 Å²	54	89.7 Å²	89.7	33%	0.331	46%	0.464	S	S	.	.	S	Bend	trans	-127.2	143.3	179.9	-48.9	0	0	0	0	108.9	P851 E872 Q993	P851-T870 HydrophobicContact CB-CG2 4.4Å; T870-E872 PolarHBondContact O-N 2.7Å; T870-Q993 PolarHBondContact OG1-NE2 2.55Å; T870-Q993 VanDerWaalsContact OG1-NE2 3.13Å
871	Q	69.5	Low	82.6	Confident	184 Å²	184	88.7 Å²	88.7	86%	0.86	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-67	129.7	177.2	-69.3	-178.4	4.6	0	0	110
872	E	72.4	Confident	82.4	Confident	114 Å²	114	88.6 Å²	88.6	53%	0.533	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-63	139.6	174.3	-68.3	-169.3	164.4	0	0	110.4	R864 T870 Q874	R864-E872 IonicContact NH1-OE1 2.58Å; T870-E872 PolarHBondContact O-N 2.7Å; E872-Q874 PolarHBondContact O-N 3Å
873	P	79.4	Confident	82.2	Confident	30 Å²	30	89.5 Å²	89.5	20%	0.195	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-62.9	131.7	177	25.9	-33	0	0	0	109.9	F847 R875	F847-P873 HydrophobicContact CB-CG 4.36Å; P873-R875 PolarHBondContact O-N 3.02Å
874	Q	80.9	Confident	82.1	Confident	189 Å²	189	87.8 Å²	87.8	88%	0.883	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-69	121	170.7	-176.7	177.2	-6.2	0	0	108.8	E872	E872-Q874 PolarHBondContact O-N 3Å
875	R	86.8	Confident	82.2	Confident	66 Å²	66	85.2 Å²	85.2	25%	0.249	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-103.4	138.4	178.6	-58.5	-175.9	-177.9	90.3	-8.5	110.6	E844 D848 P873	E844-R875 IonicContact OE1-CZ 2.76Å; E844-R875 IonicContact OE1-NE 3.78Å; E844-R875 PolarHBondContact OE1-NE 2.77Å; E844-R875 IonicContact OE1-NH2 2.7Å; E844-R875 IonicContact OE2-CZ 2.82Å; E844-R875 IonicContact OE2-NE 2.74Å; E844-R875 IonicContact OE2-NH2 3.88Å; E844-R875 PolarHBondContact OE2-NH2 2.95Å; D848-R875 IonicContact OD2-CZ 3.82Å; D848-R875 IonicContact OD2-NH2 2.68Å; D848-R875 PolarHBondContact OD2-NH2 3.42Å; P873-R875 PolarHBondContact O-N 3.02Å
876	D	86.3	Confident	82.4	Confident	137 Å²	137	85.4 Å²	85.4	73%	0.733	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-69.2	141.5	171.9	-72.8	-30	0	0	0	110	S787	S787-D876 WeakPolarHBondContact CB-O 3.46Å
877	K	82.8	Confident	82.9	Confident	198 Å²	198	83.2 Å²	83.2	86%	0.861	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-73.1	143.5	-179.9	-73.5	-176.8	178.2	177.7	0	111
878	P	80.2	Confident	83.6	Confident	66 Å²	66	80.6 Å²	80.6	43%	0.429	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-63.1	145.5	175.3	24.5	-32	0	0	0	111.3	R784 S787	R784-P878 HydrophobicContact CG-CB 4.43Å; S787-P878 WeakPolarHBondContact OG-CB 3.32Å
879	A	81.2	Confident	84.7	Confident	79 Å²	79	78.3 Å²	78.3	65%	0.653	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-62.6	142.6	173.5	0	0	0	0	0	111	V881	A879-V881 HydrophobicContact CB-CG2 4.4Å; A879-V881 PolarHBondContact O-N 3.5Å
880	N	81.4	Confident	85.7	Confident	169 Å²	169	82.5 Å²	82.5	90%	0.904	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-79.2	117.6	173.8	-171	12.5	0	0	0	109.6
881	V	89.3	Confident	86.7	Confident	29 Å²	29	82.6 Å²	82.6	18%	0.176	42%	0.423	C	S	.	.			trans	-121.7	151.2	-173.1	-169.8	0	0	0	0	110.7	A879 Y885	A879-V881 HydrophobicContact CB-CG2 4.4Å; A879-V881 PolarHBondContact O-N 3.5Å; V881-Y885 HydrophobicContact CG1-CD2 3.49Å; V881-Y885 VanDerWaalsContact CG1-CD2 3.49Å; V881-Y885 HydrophobicContact CG1-CE2 4.48Å; V881-Y885 HydrophobicContact CG1-CG 3.84Å
882	Q	91.8	Very high	87.8	Confident	114 Å²	114	74 Å²	74	53%	0.533	38%	0.383	S	S	.	.			trans	-56.6	142.5	173.1	-65.4	-68	-10.2	0	0	111.7	Y884 Y885	Q882-Y884 HydrophobicContact CB-CD1 3.75Å; Q882-Y884 HydrophobicContact CB-CE1 3.32Å; Q882-Y884 HydrophobicContact CB-CG 4.48Å; Q882-Y884 HydrophobicContact CG-CE1 3.82Å; Q882-Y884 PolarHBondContact O-N 3.45Å; Q882-Y884 VanDerWaalsContact O-N 3.07Å; Q882-Y885 HydrophobicContact CB-CD2 3.96Å; Q882-Y885 HydrophobicContact CB-CE2 4.22Å; Q882-Y885 PolarHBondContact O-N 2.96Å
883	P	92.5	Very high	88.8	Confident	20 Å²	20	70 Å²	70	13%	0.13	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-58	-29.3	-172.1	-26.7	34.3	0	0	0	115.4	Y885 L886 Y887 G888 K890	P883-Y885 VanDerWaalsContact C-N 3.26Å; P883-Y885 PolarHBondContact O-N 2.91Å; P883-L886 CarbonylContact O-C 3.59Å; P883-L886 PolarHBondContact O-N 3.44Å; P883-Y887 PolarHBondContact O-N 3.4Å; P883-G888 CarbonylContact O-C 3.57Å; P883-G888 PolarHBondContact O-N 3.38Å; P883-K890 HydrophobicContact CB-CG 4.43Å; P883-K890 HydrophobicContact CG-CG 3.66Å
884	Y	92.1	Very high	89.4	Confident	33 Å²	33	74.4 Å²	74.4	13%	0.129	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-74.4	-13.6	-178.6	60.2	-98.7	0	0	0	114	D706 F709 A710 K713 Q882 L886 G888	D706-Y884 WeakPolarHBondContact OD1-CE2 3.46Å; D706-Y884 PolarHBondContact OD1-OH 3.24Å; F709-Y884 AromaticContact CD1-CD2 3.81Å; F709-Y884 HydrophobicContact CD1-CD2 3.81Å; F709-Y884 HydrophobicContact CD1-CE2 4.4Å; F709-Y884 HydrophobicContact CE1-CD2 4.04Å; F709-Y884 WeakPolarHBondContact CE1-O 3.4Å; A710-Y884 HydrophobicContact CB-CD1 4.37Å; A710-Y884 HydrophobicContact CB-CG 4Å; K713-Y884 VanDerWaalsContact CE-O 3.32Å; K713-Y884 WeakPolarHBondContact CE-O 3.32Å; K713-Y884 VanDerWaalsContact CG-O 3.31Å; K713-Y884 WeakPolarHBondContact CG-O 3.22Å; Q882-Y884 HydrophobicContact CB-CD1 3.75Å; Q882-Y884 HydrophobicContact CB-CE1 3.32Å; Q882-Y884 HydrophobicContact CB-CG 4.48Å; Q882-Y884 HydrophobicContact CG-CE1 3.82Å; Q882-Y884 PolarHBondContact O-N 3.45Å; Q882-Y884 VanDerWaalsContact O-N 3.07Å; Y884-L886 VanDerWaalsContact C-N 3.31Å; Y884-G888 WeakPolarHBondContact CA-O 3.46Å; Y884-G888 PolarHBondContact N-O 2.91Å
885	Y	94.4	Very high	90	Very high	27 Å²	27	65.7 Å²	65.7	11%	0.106	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-80.6	-16.8	167.5	-66	-71.6	0	0	0	112.7	F709 K713 A773 K776 S777 V881 Q882 P883	F709-Y885 HydrophobicContact CE1-CD1 4.06Å; F709-Y885 HydrophobicContact CE1-CE1 4.28Å; K713-Y885 PolarHBondContact NZ-O 3.37Å; A773-Y885 HydrophobicContact CB-CE1 4.18Å; K776-Y885 HydrophobicContact CB-CD1 4.29Å; K776-Y885 HydrophobicContact CB-CE1 4.11Å; K776-Y885 HydrophobicContact CD-CD1 4.26Å; K776-Y885 HydrophobicContact CD-CE1 3.71Å; K776-Y885 HydrophobicContact CG-CD1 4.05Å; K776-Y885 HydrophobicContact CG-CE1 3.95Å; S777-Y885 VanDerWaalsContact OG-CA 3.24Å; S777-Y885 WeakPolarHBondContact OG-CA 3.48Å; S777-Y885 PolarHBondContact OG-O 3.43Å; V881-Y885 HydrophobicContact CG1-CD2 3.49Å; V881-Y885 VanDerWaalsContact CG1-CD2 3.49Å; V881-Y885 HydrophobicContact CG1-CE2 4.48Å; V881-Y885 HydrophobicContact CG1-CG 3.84Å; Q882-Y885 HydrophobicContact CB-CD2 3.96Å; Q882-Y885 HydrophobicContact CB-CE2 4.22Å; Q882-Y885 PolarHBondContact O-N 2.96Å; P883-Y885 VanDerWaalsContact C-N 3.26Å; P883-Y885 PolarHBondContact O-N 2.91Å
886	L	93.5	Very high	90.4	Very high	22 Å²	22	62.8 Å²	62.8	12%	0.115	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-113.5	177.3	-61.5	176.3	0	0	0	110.3	K713 L799 P883 Y884	K713-L886 WeakPolarHBondContact CD-O 3.2Å; K713-L886 PolarHBondContact NZ-O 3.09Å; L799-L886 HydrophobicContact CD2-CD2 4.18Å; P883-L886 CarbonylContact O-C 3.59Å; P883-L886 PolarHBondContact O-N 3.44Å; Y884-L886 VanDerWaalsContact C-N 3.31Å
887	Y	93.1	Very high	90.7	Very high	1 Å²	1	59 Å²	59	0%	0.004	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	0.1	-174.9	-55	-86.7	0	0	0	114	E795 L799 I802 P883 L892 N893 Y896 Y900	E795-Y887 WeakPolarHBondContact CG-OH 3.44Å; E795-Y887 PolarHBondContact OE1-OH 3.49Å; L799-Y887 HydrophobicContact CB-CE1 4.23Å; L799-Y887 HydrophobicContact CD1-CD1 4.02Å; L799-Y887 HydrophobicContact CD1-CE1 3.89Å; L799-Y887 HydrophobicContact CD1-CG 4.36Å; I802-Y887 HydrophobicContact CD1-CD1 3.46Å; I802-Y887 VanDerWaalsContact CD1-CD1 3.46Å; I802-Y887 HydrophobicContact CD1-CE1 4Å; P883-Y887 PolarHBondContact O-N 3.4Å; Y887-L892 WeakPolarHBondContact O-CD1 3.5Å; Y887-N893 VanDerWaalsContact CB-OD1 3.24Å; Y887-N893 WeakPolarHBondContact CB-OD1 3.07Å; Y887-N893 HydrophobicContact CD2-CB 4.24Å; Y887-N893 WeakPolarHBondContact CD2-OD1 3.3Å; Y887-N893 PolarHBondContact N-OD1 3.15Å; Y887-N893 VanDerWaalsContact N-OD1 3.14Å; Y887-Y896 HydrophobicContact CD1-CD1 4.2Å; Y887-Y896 AromaticContact CD1-CD2 3.31Å; Y887-Y896 HydrophobicContact CD1-CD2 3.31Å; Y887-Y896 AromaticContact CD1-CE2 3.97Å; Y887-Y896 HydrophobicContact CD1-CE2 3.97Å; Y887-Y896 AromaticContact CD1-CG 3.45Å; Y887-Y896 HydrophobicContact CD1-CG 3.45Å; Y887-Y896 VanDerWaalsContact CD1-CG 3.45Å; Y887-Y896 HydrophobicContact CE1-CD1 4.22Å; Y887-Y896 HydrophobicContact CE1-CD2 4.07Å; Y887-Y896 AromaticContact CE1-CG 3.71Å; Y887-Y896 HydrophobicContact CE1-CG 3.71Å; Y887-Y896 AromaticContact CG-CD2 3.66Å; Y887-Y896 HydrophobicContact CG-CD2 3.66Å; Y887-Y896 HydrophobicContact CG-CE2 4.46Å; Y887-Y896 HydrophobicContact CG-CG 4.05Å; Y887-Y900 HydrophobicContact CE1-CE2 4.23Å
888	G	92.1	Very high	91.1	Very high	9 Å²	9	55.2 Å²	55.2	9%	0.093	31%	0.305	C	S	.	.	S	Bend	trans	115.3	-50.3	174.4	0	0	0	0	0	114	P883 Y884	P883-G888 CarbonylContact O-C 3.57Å; P883-G888 PolarHBondContact O-N 3.38Å; Y884-G888 WeakPolarHBondContact CA-O 3.46Å; Y884-G888 PolarHBondContact N-O 2.91Å
889	S	93.9	Very high	91.6	Very high	39 Å²	39	54.1 Å²	54.1	27%	0.273	30%	0.295	S	S	.	.	S	Bend	trans	-143.3	162	-175.9	71.9	0	0	0	0	112	L892 N893	S889-L892 PolarHBondContact O-N 2.85Å; S889-L892 VanDerWaalsContact O-N 3.16Å; S889-L892 WeakPolarHBondContact OG-CD1 3.38Å; S889-L892 VanDerWaalsContact OG-CG 3.32Å; S889-L892 WeakPolarHBondContact OG-CG 3.4Å; S889-L892 PolarHBondContact OG-N 3.11Å; S889-N893 PolarHBondContact O-N 3.36Å; S889-N893 PolarHBondContact O-OD1 3.43Å
890	K	93.4	Very high	92.2	Very high	152 Å²	152	50.8 Å²	50.8	66%	0.661	27%	0.266	S	S	*	.	H	α-helix	trans	-56.5	-45.7	178.9	-62.7	-177.1	179.8	178.8	0	112.7	P883 L892 N893 I894	P883-K890 HydrophobicContact CB-CG 4.43Å; P883-K890 HydrophobicContact CG-CG 3.66Å; K890-L892 VanDerWaalsContact C-N 3.33Å; K890-L892 PolarHBondContact O-N 3.36Å; K890-N893 PolarHBondContact O-N 2.88Å; K890-I894 WeakPolarHBondContact O-CG1 3.39Å; K890-I894 PolarHBondContact O-N 3.09Å; K890-I894 VanDerWaalsContact O-N 3.16Å
891	P	92.7	Very high	92.7	Very high	57 Å²	57	45.3 Å²	45.3	37%	0.37	24%	0.24	S	C	.	.	H	α-helix	trans	-61.2	-38.5	175.8	-24.8	35.3	0	0	0	113.5	I894 A895	P891-I894 PolarHBondContact O-N 3.49Å; P891-A895 WeakPolarHBondContact O-CB 3.47Å; P891-A895 PolarHBondContact O-N 3.25Å
892	L	93.7	Very high	92.9	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-67.7	-42.9	177.5	-68.5	173.3	0	0	0	111.4	L721 I736 Y887 S889 K890 I894 A895 Y896	L721-L892 HydrophobicContact CD2-CD2 4.02Å; I736-L892 HydrophobicContact CG2-CD2 4.31Å; Y887-L892 WeakPolarHBondContact O-CD1 3.5Å; S889-L892 PolarHBondContact O-N 2.85Å; S889-L892 VanDerWaalsContact O-N 3.16Å; S889-L892 WeakPolarHBondContact OG-CD1 3.38Å; S889-L892 VanDerWaalsContact OG-CG 3.32Å; S889-L892 WeakPolarHBondContact OG-CG 3.4Å; S889-L892 PolarHBondContact OG-N 3.11Å; K890-L892 VanDerWaalsContact C-N 3.33Å; K890-L892 PolarHBondContact O-N 3.36Å; L892-I894 VanDerWaalsContact C-N 3.28Å; L892-I894 PolarHBondContact O-N 3.41Å; L892-A895 PolarHBondContact O-N 2.95Å; L892-Y896 HydrophobicContact CB-CD2 4.42Å; L892-Y896 HydrophobicContact CD2-CE2 4.49Å; L892-Y896 VanDerWaalsContact O-CD2 3.25Å; L892-Y896 WeakPolarHBondContact O-CD2 3.36Å; L892-Y896 PolarHBondContact O-N 2.88Å
893	N	93.7	Very high	93	Very high	30 Å²	30	45.9 Å²	45.9	16%	0.16	25%	0.247	C	C	.	.	H	α-helix	trans	-56.8	-43.3	176.2	-71.4	1.4	0	0	0	111.7	Y887 S889 K890 S897	Y887-N893 VanDerWaalsContact CB-OD1 3.24Å; Y887-N893 WeakPolarHBondContact CB-OD1 3.07Å; Y887-N893 HydrophobicContact CD2-CB 4.24Å; Y887-N893 WeakPolarHBondContact CD2-OD1 3.3Å; Y887-N893 PolarHBondContact N-OD1 3.15Å; Y887-N893 VanDerWaalsContact N-OD1 3.14Å; S889-N893 PolarHBondContact O-N 3.36Å; S889-N893 PolarHBondContact O-OD1 3.43Å; K890-N893 PolarHBondContact O-N 2.88Å; N893-S897 WeakPolarHBondContact O-CB 3.21Å; N893-S897 PolarHBondContact O-N 3.5Å
894	I	92.6	Very high	93	Very high	123 Å²	123	47.8 Å²	47.8	63%	0.631	25%	0.252	S	S	*	.	H	α-helix	trans	-66.8	-45.4	178.1	-64.6	166.3	0	0	0	110.6	K890 P891 L892 S897 H898	K890-I894 WeakPolarHBondContact O-CG1 3.39Å; K890-I894 PolarHBondContact O-N 3.09Å; K890-I894 VanDerWaalsContact O-N 3.16Å; P891-I894 PolarHBondContact O-N 3.49Å; L892-I894 VanDerWaalsContact C-N 3.28Å; L892-I894 PolarHBondContact O-N 3.41Å; I894-S897 PolarHBondContact O-N 3.3Å; I894-H898 WeakPolarHBondContact O-CB 3.33Å; I894-H898 PolarHBondContact O-N 2.9Å
895	A	93.3	Very high	93	Very high	6 Å²	6	52.5 Å²	52.5	5%	0.05	28%	0.279	C	S	.	.	H	α-helix	trans	-58.8	-50.5	179.3	0	0	0	0	0	111.9	L721 F725 I736 P891 L892 H898 I899	L721-A895 HydrophobicContact CD1-CB 4.26Å; L721-A895 HydrophobicContact CD2-CB 4.18Å; F725-A895 HydrophobicContact CE1-CB 3.88Å; I736-A895 HydrophobicContact CD1-CB 4.04Å; P891-A895 WeakPolarHBondContact O-CB 3.47Å; P891-A895 PolarHBondContact O-N 3.25Å; L892-A895 PolarHBondContact O-N 2.95Å; A895-H898 PolarHBondContact O-N 3.49Å; A895-I899 WeakPolarHBondContact O-CG1 3.25Å; A895-I899 PolarHBondContact O-N 3.05Å
896	Y	94.3	Very high	93.1	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-66.3	-42.6	179	-79.7	-68.7	0	0	0	112.2	G717 L720 L721 I802 Y887 L892 H898 I899 Y900	G717-Y896 WeakPolarHBondContact O-CE2 3.4Å; G717-Y896 PolarHBondContact O-OH 2.86Å; L720-Y896 VanDerWaalsContact C-OH 3.31Å; L721-Y896 WeakPolarHBondContact CA-OH 3.43Å; L721-Y896 HydrophobicContact CD1-CD1 4.34Å; L721-Y896 HydrophobicContact CD1-CE1 4Å; L721-Y896 HydrophobicContact CD1-CE2 4.15Å; L721-Y896 PolarHBondContact N-OH 3.01Å; I802-Y896 HydrophobicContact CD1-CD2 4.41Å; I802-Y896 HydrophobicContact CD1-CE1 4.09Å; I802-Y896 HydrophobicContact CD1-CE2 3.88Å; Y887-Y896 HydrophobicContact CD1-CD1 4.2Å; Y887-Y896 AromaticContact CD1-CD2 3.31Å; Y887-Y896 HydrophobicContact CD1-CD2 3.31Å; Y887-Y896 AromaticContact CD1-CE2 3.97Å; Y887-Y896 HydrophobicContact CD1-CE2 3.97Å; Y887-Y896 AromaticContact CD1-CG 3.45Å; Y887-Y896 HydrophobicContact CD1-CG 3.45Å; Y887-Y896 VanDerWaalsContact CD1-CG 3.45Å; Y887-Y896 HydrophobicContact CE1-CD1 4.22Å; Y887-Y896 HydrophobicContact CE1-CD2 4.07Å; Y887-Y896 AromaticContact CE1-CG 3.71Å; Y887-Y896 HydrophobicContact CE1-CG 3.71Å; Y887-Y896 AromaticContact CG-CD2 3.66Å; Y887-Y896 HydrophobicContact CG-CD2 3.66Å; Y887-Y896 HydrophobicContact CG-CE2 4.46Å; Y887-Y896 HydrophobicContact CG-CG 4.05Å; L892-Y896 HydrophobicContact CB-CD2 4.42Å; L892-Y896 HydrophobicContact CD2-CE2 4.49Å; L892-Y896 VanDerWaalsContact O-CD2 3.25Å; L892-Y896 WeakPolarHBondContact O-CD2 3.36Å; L892-Y896 PolarHBondContact O-N 2.88Å; Y896-H898 VanDerWaalsContact C-N 3.28Å; Y896-H898 PolarHBondContact O-N 3.39Å; Y896-I899 PolarHBondContact O-N 3.11Å; Y896-I899 VanDerWaalsContact O-N 3.14Å; Y896-Y900 AromaticContact CD1-CE2 3.53Å; Y896-Y900 HydrophobicContact CD1-CE2 3.53Å; Y896-Y900 AromaticContact CD1-CZ 3.84Å; Y896-Y900 WeakPolarHBondContact CD1-OH 3.22Å; Y896-Y900 HydrophobicContact CG-CE2 4.11Å; Y896-Y900 WeakPolarHBondContact O-CD2 3.44Å; Y896-Y900 PolarHBondContact O-N 3.26Å
897	S	91.9	Very high	93.3	Very high	58 Å²	58	51.2 Å²	51.2	41%	0.406	27%	0.273	S	S	.	.	H	α-helix	trans	-57.4	-41.4	174.6	177.8	0	0	0	0	111.9	N893 I894 Y900 S901	N893-S897 WeakPolarHBondContact O-CB 3.21Å; N893-S897 PolarHBondContact O-N 3.5Å; I894-S897 PolarHBondContact O-N 3.3Å; S897-Y900 PolarHBondContact O-N 2.96Å; S897-S901 WeakPolarHBondContact O-CB 3.36Å; S897-S901 PolarHBondContact O-N 2.86Å
898	H	91.1	Very high	93.4	Very high	119 Å²	119	51.1 Å²	51.1	55%	0.551	27%	0.273	S	S	*	.	H	α-helix	trans	-66.3	-42	175.8	-170.2	-79.7	0	0	0	112.3	I894 A895 Y896 Y900 S901	I894-H898 WeakPolarHBondContact O-CB 3.33Å; I894-H898 PolarHBondContact O-N 2.9Å; A895-H898 PolarHBondContact O-N 3.49Å; Y896-H898 VanDerWaalsContact C-N 3.28Å; Y896-H898 PolarHBondContact O-N 3.39Å; H898-Y900 VanDerWaalsContact C-N 3.34Å; H898-Y900 PolarHBondContact O-N 3.34Å; H898-S901 PolarHBondContact O-N 3.48Å; H898-S901 PolarHBondContact O-OG 2.69Å
899	I	92.8	Very high	93.5	Very high	42 Å²	42	53.1 Å²	53.1	22%	0.215	28%	0.284	C	S	.	.	H	α-helix	trans	-59.4	-46.9	175.9	-69.6	165.6	0	0	0	110.2	L721 F725 A895 Y896	L721-I899 HydrophobicContact CD1-CD1 3.59Å; F725-I899 HydrophobicContact CD1-CD1 4.17Å; F725-I899 HydrophobicContact CD2-CG1 4.4Å; F725-I899 HydrophobicContact CE1-CD1 4.37Å; F725-I899 HydrophobicContact CE2-CG1 4.34Å; F725-I899 HydrophobicContact CG-CD1 4.32Å; F725-I899 HydrophobicContact CZ-CG1 4.43Å; A895-I899 WeakPolarHBondContact O-CG1 3.25Å; A895-I899 PolarHBondContact O-N 3.05Å; Y896-I899 PolarHBondContact O-N 3.11Å; Y896-I899 VanDerWaalsContact O-N 3.14Å
900	Y	92.6	Very high	93.5	Very high	10 Å²	10	53.3 Å²	53.3	4%	0.039	28%	0.284	C	S	.	.	H	α-helix	trans	-80.5	-16.1	-175.4	-57.7	-52.7	0	0	0	114.3	V794 E795 W798 Y887 Y896 S897 H898 S902 Y903	V794-Y900 HydrophobicContact CG1-CD1 4.34Å; E795-Y900 HydrophobicContact CB-CD2 4.14Å; E795-Y900 HydrophobicContact CB-CG 4.12Å; E795-Y900 HydrophobicContact CG-CD2 3.75Å; E795-Y900 HydrophobicContact CG-CE2 4.5Å; E795-Y900 HydrophobicContact CG-CG 4.2Å; W798-Y900 HydrophobicContact CB-CE1 4.07Å; W798-Y900 HydrophobicContact CB-CE2 4.09Å; W798-Y900 VanDerWaalsContact CB-CZ 3.46Å; W798-Y900 WeakPolarHBondContact CB-OH 3.47Å; W798-Y900 AromaticContact CD1-CE1 3.34Å; W798-Y900 AromaticContact CD1-CZ 3.66Å; W798-Y900 AromaticContact CG-CE1 3.75Å; W798-Y900 HydrophobicContact CG-CE1 3.75Å; W798-Y900 AromaticContact CG-CZ 3.55Å; W798-Y900 AromaticContact NE1-CE1 3.98Å; Y887-Y900 HydrophobicContact CE1-CE2 4.23Å; Y896-Y900 AromaticContact CD1-CE2 3.53Å; Y896-Y900 HydrophobicContact CD1-CE2 3.53Å; Y896-Y900 AromaticContact CD1-CZ 3.84Å; Y896-Y900 WeakPolarHBondContact CD1-OH 3.22Å; Y896-Y900 HydrophobicContact CG-CE2 4.11Å; Y896-Y900 WeakPolarHBondContact O-CD2 3.44Å; Y896-Y900 PolarHBondContact O-N 3.26Å; S897-Y900 PolarHBondContact O-N 2.96Å; H898-Y900 VanDerWaalsContact C-N 3.34Å; H898-Y900 PolarHBondContact O-N 3.34Å; Y900-S902 PolarHBondContact O-N 3.27Å; Y900-S902 VanDerWaalsContact O-N 3.12Å; Y900-Y903 HydrophobicContact CD1-CD2 4.35Å; Y900-Y903 HydrophobicContact CD1-CE2 4.48Å; Y900-Y903 PolarHBondContact O-N 3.46Å
901	S	92.3	Very high	93.6	Very high	54 Å²	54	46 Å²	46	38%	0.378	25%	0.253	S	S	.	.	H	α-helix	trans	-55.9	-29.2	171.4	75.4	0	0	0	0	112.7	S897 H898 Y903 R904	S897-S901 WeakPolarHBondContact O-CB 3.36Å; S897-S901 PolarHBondContact O-N 2.86Å; H898-S901 PolarHBondContact O-N 3.48Å; H898-S901 PolarHBondContact O-OG 2.69Å; S901-Y903 PolarHBondContact O-N 2.93Å; S901-R904 PolarHBondContact O-N 3.44Å
902	S	92.7	Very high	93.7	Very high	78 Å²	78	43.5 Å²	43.5	55%	0.545	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.1	177.4	-61.2	0	0	0	0	113.8	Y900	Y900-S902 PolarHBondContact O-N 3.27Å; Y900-S902 VanDerWaalsContact O-N 3.12Å
903	Y	94.4	Very high	93.7	Very high	76 Å²	76	47.3 Å²	47.3	30%	0.298	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-1.2	-178.9	-63.9	-90.3	0	0	0	113.5	V794 Y900 S901 F906 P910 H911	V794-Y903 HydrophobicContact CB-CG 4.5Å; V794-Y903 HydrophobicContact CG1-CD1 4.25Å; V794-Y903 HydrophobicContact CG1-CD2 4.32Å; V794-Y903 HydrophobicContact CG1-CE1 4.48Å; V794-Y903 HydrophobicContact CG1-CG 4.16Å; V794-Y903 HydrophobicContact CG2-CD1 4.39Å; Y900-Y903 HydrophobicContact CD1-CD2 4.35Å; Y900-Y903 HydrophobicContact CD1-CE2 4.48Å; Y900-Y903 PolarHBondContact O-N 3.46Å; S901-Y903 PolarHBondContact O-N 2.93Å; Y903-F906 HydrophobicContact CD1-CZ 4.38Å; Y903-P910 HydrophobicContact CD1-CB 4.29Å; Y903-P910 HydrophobicContact CD1-CG 4.08Å; Y903-P910 HydrophobicContact CE1-CB 3.98Å; Y903-P910 HydrophobicContact CE1-CG 3.99Å; Y903-H911 PolarHBondContact O-NE2 3.31Å
904	R	92.3	Very high	93.8	Very high	61 Å²	61	46 Å²	46	23%	0.23	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-25	-175.3	-62.8	-61.7	-167.3	146.1	4.7	114.9	E788 D789 T791 E795 S901	E788-R904 IonicContact OE1-NH2 3.79Å; E788-R904 IonicContact OE2-CZ 2.89Å; E788-R904 IonicContact OE2-NH1 2.85Å; E788-R904 PolarHBondContact OE2-NH1 2.92Å; E788-R904 IonicContact OE2-NH2 3.11Å; E788-R904 PolarHBondContact OE2-NH2 2.88Å; D789-R904 IonicContact OD1-NH1 3.61Å; T791-R904 WeakPolarHBondContact OG1-CA 3.34Å; T791-R904 VanDerWaalsContact OG1-CD 3.28Å; T791-R904 WeakPolarHBondContact OG1-CD 3.45Å; E795-R904 IonicContact OE2-CZ 3.34Å; E795-R904 IonicContact OE2-NH2 3.83Å; E795-R904 PolarHBondContact OE2-NH2 3.11Å; S901-R904 PolarHBondContact O-N 3.44Å
905	N	93.1	Very high	93.9	Very high	131 Å²	131	40.2 Å²	40.2	70%	0.701	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-0.7	-169.1	-61.1	-23.2	0	0	0	113.6
906	F	95.7	Very high	93.9	Very high	22 Å²	22	40 Å²	40	10%	0.096	21%	0.213	C	C	.	.			trans	-154.4	163.4	180	76.6	-82.3	0	0	0	111.4	R861 F862 V863 Y903 P910 H911	R861-F906 HydrophobicContact CB-CD2 4.19Å; R861-F906 HydrophobicContact CG-CD2 3.74Å; R861-F906 HydrophobicContact CG-CE2 4.16Å; F862-F906 CarbonylContact O-C 3.59Å; F862-F906 WeakPolarHBondContact O-CA 3.2Å; F862-F906 WeakPolarHBondContact O-CB 3.41Å; V863-F906 HydrophobicContact CG1-CB 4.48Å; Y903-F906 HydrophobicContact CD1-CZ 4.38Å; F906-P910 HydrophobicContact CE2-CG 4.18Å; F906-P910 HydrophobicContact CZ-CG 4.16Å; F906-H911 AromaticContact CD2-CE1 3.95Å; F906-H911 AromaticContact CE2-CE1 3.66Å; F906-H911 AromaticContact CE2-ND1 3.94Å; F906-H911 AromaticContact CZ-CE1 3.86Å; F906-H911 PolarHBondContact O-CE1 3.24Å; F906-H911 PolarHBondContact O-NE2 3.07Å; F906-H911 VanDerWaalsContact O-NE2 3.16Å
907	V	97.1	Very high	93.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-118.1	130.6	164.8	177.5	0	0	0	0	108.5	T791 F849 Y853 R861 F862 H911 F912	T791-V907 HydrophobicContact CG2-CG2 3.82Å; F849-V907 HydrophobicContact CD2-CG2 4.34Å; F849-V907 HydrophobicContact CE2-CB 4.04Å; F849-V907 HydrophobicContact CE2-CG1 3.91Å; F849-V907 HydrophobicContact CE2-CG2 4.27Å; Y853-V907 HydrophobicContact CD1-CG2 4.22Å; Y853-V907 HydrophobicContact CE1-CB 4.46Å; Y853-V907 HydrophobicContact CE1-CG2 3.64Å; R861-V907 CarbonylContact C-O 3.4Å; R861-V907 WeakPolarHBondContact CA-O 3.41Å; F862-V907 HydrophobicContact CB-CB 4.19Å; F862-V907 PolarHBondContact N-O 3.48Å; F862-V907 PolarHBondContact O-N 3.03Å; V907-H911 HydrophobicContact CG1-CB 4.05Å; V907-F912 HydrophobicContact CG1-CE2 4.05Å; V907-F912 HydrophobicContact CG1-CZ 4.31Å
908	G	95.2	Very high	93.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.228	C	C	.	.			trans	-160.9	-160.8	-178.2	0	0	0	0	0	112.7	H911 F912	G908-H911 PolarHBondContact N-ND1 3.28Å; G908-H911 WeakPolarHBondContact O-CB 2.99Å; G908-H911 PolarHBondContact O-N 2.9Å; G908-F912 WeakPolarHBondContact O-CD2 3.46Å; G908-F912 PolarHBondContact O-N 2.91Å; G908-F912 VanDerWaalsContact O-N 3.08Å
909	P	94.1	Very high	93.9	Very high	50 Å²	50	40.5 Å²	40.5	33%	0.325	21%	0.205	S	C	.	.	H	α-helix	trans	-49	-40.8	-176.5	-29.2	35	0	0	0	116.5	N860 H911 F912 K913	N860-P909 WeakPolarHBondContact O-CD 3.36Å; P909-H911 PolarHBondContact O-N 3.41Å; P909-F912 PolarHBondContact O-N 3.14Å; P909-K913 VanDerWaalsContact O-CG 3.31Å; P909-K913 WeakPolarHBondContact O-CG 3.46Å; P909-K913 PolarHBondContact O-N 3.42Å
910	P	94.4	Very high	93.9	Very high	43 Å²	43	39.9 Å²	39.9	28%	0.279	21%	0.209	S	C	.	.	H	α-helix	trans	-61.9	-43.4	177.4	22.6	-32	0	0	0	111.9	Y903 F906 K913 T914	Y903-P910 HydrophobicContact CD1-CB 4.29Å; Y903-P910 HydrophobicContact CD1-CG 4.08Å; Y903-P910 HydrophobicContact CE1-CB 3.98Å; Y903-P910 HydrophobicContact CE1-CG 3.99Å; F906-P910 HydrophobicContact CE2-CG 4.18Å; F906-P910 HydrophobicContact CZ-CG 4.16Å; P910-K913 PolarHBondContact O-N 3.48Å; P910-T914 PolarHBondContact O-N 3.43Å; P910-T914 VanDerWaalsContact O-N 3.12Å; P910-T914 PolarHBondContact O-OG1 3.23Å; P910-T914 VanDerWaalsContact O-OG1 3.06Å
911	H	95.8	Very high	93.9	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.1	-46.2	178.4	-49.8	84.3	0	0	0	111.8	Y903 F906 V907 G908 P909 K913 T914 I915	Y903-H911 PolarHBondContact O-NE2 3.31Å; F906-H911 AromaticContact CD2-CE1 3.95Å; F906-H911 AromaticContact CE2-CE1 3.66Å; F906-H911 AromaticContact CE2-ND1 3.94Å; F906-H911 AromaticContact CZ-CE1 3.86Å; F906-H911 PolarHBondContact O-CE1 3.24Å; F906-H911 PolarHBondContact O-NE2 3.07Å; F906-H911 VanDerWaalsContact O-NE2 3.16Å; V907-H911 HydrophobicContact CG1-CB 4.05Å; G908-H911 PolarHBondContact N-ND1 3.28Å; G908-H911 WeakPolarHBondContact O-CB 2.99Å; G908-H911 PolarHBondContact O-N 2.9Å; P909-H911 PolarHBondContact O-N 3.41Å; H911-K913 VanDerWaalsContact C-N 3.31Å; H911-K913 PolarHBondContact O-N 3.09Å; H911-T914 PolarHBondContact O-N 2.89Å; H911-I915 VanDerWaalsContact O-CG1 3.25Å; H911-I915 WeakPolarHBondContact O-CG1 3.3Å; H911-I915 PolarHBondContact O-N 3.04Å
912	F	95.3	Very high	93.8	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.018	23%	0.232	C	C	.	.	H	α-helix	trans	-61.1	-38.7	178.3	-74.5	-74.4	0	0	0	112.4	F849 F862 V907 G908 P909 I915 C916 F1004 L1007 I1008 A1011	F849-F912 HydrophobicContact CZ-CZ 4.45Å; F862-F912 HydrophobicContact CD2-CE2 4.35Å; F862-F912 HydrophobicContact CD2-CZ 4.46Å; F862-F912 HydrophobicContact CE2-CE2 4.05Å; F862-F912 AromaticContact CE2-CZ 3.92Å; F862-F912 HydrophobicContact CE2-CZ 3.92Å; V907-F912 HydrophobicContact CG1-CE2 4.05Å; V907-F912 HydrophobicContact CG1-CZ 4.31Å; G908-F912 WeakPolarHBondContact O-CD2 3.46Å; G908-F912 PolarHBondContact O-N 2.91Å; G908-F912 VanDerWaalsContact O-N 3.08Å; P909-F912 PolarHBondContact O-N 3.14Å; F912-I915 PolarHBondContact O-N 2.83Å; F912-C916 PolarHBondContact O-N 3.09Å; F912-C916 PolarHBondContact O-SG 2.55Å; F912-C916 VanDerWaalsContact O-SG 3.38Å; F912-F1004 HydrophobicContact CD1-CD2 4.45Å; F912-F1004 HydrophobicContact CD1-CE2 4.18Å; F912-F1004 AromaticContact CE1-CD2 3.47Å; F912-F1004 HydrophobicContact CE1-CD2 3.47Å; F912-F1004 VanDerWaalsContact CE1-CD2 3.47Å; F912-F1004 AromaticContact CE1-CE2 3.58Å; F912-F1004 HydrophobicContact CE1-CE2 3.58Å; F912-F1004 HydrophobicContact CE1-CG 4.23Å; F912-F1004 HydrophobicContact CE1-CZ 4.45Å; F912-F1004 HydrophobicContact CZ-CD2 4.15Å; F912-L1007 HydrophobicContact CD1-CB 4.25Å; F912-L1007 HydrophobicContact CD2-CB 4.3Å; F912-L1007 HydrophobicContact CE1-CB 4Å; F912-L1007 HydrophobicContact CE2-CB 4.11Å; F912-L1007 HydrophobicContact CE2-CD1 3.87Å; F912-L1007 HydrophobicContact CG-CB 4.41Å; F912-L1007 HydrophobicContact CZ-CB 3.96Å; F912-L1007 HydrophobicContact CZ-CD1 3.91Å; F912-I1008 HydrophobicContact CB-CD1 4.5Å; F912-I1008 HydrophobicContact CD1-CB 4.37Å; F912-I1008 HydrophobicContact CD1-CD1 3.98Å; F912-A1011 HydrophobicContact CB-CB 3.94Å
913	K	93.8	Very high	93.7	Very high	83 Å²	83	43.2 Å²	43.2	36%	0.361	21%	0.207	S	C	.	.	H	α-helix	trans	-63.1	-43.3	174.4	-74.6	178.7	180	-168.5	0	112.2	P909 P910 H911 C916 R917 A1011	P909-K913 VanDerWaalsContact O-CG 3.31Å; P909-K913 WeakPolarHBondContact O-CG 3.46Å; P909-K913 PolarHBondContact O-N 3.42Å; P910-K913 PolarHBondContact O-N 3.48Å; H911-K913 VanDerWaalsContact C-N 3.31Å; H911-K913 PolarHBondContact O-N 3.09Å; K913-C916 PolarHBondContact O-N 3.06Å; K913-R917 WeakPolarHBondContact O-CG 3.41Å; K913-R917 PolarHBondContact O-N 2.6Å; K913-R917 VanDerWaalsContact O-N 3.15Å; K913-A1011 HydrophobicContact CG-CB 4.41Å
914	T	94.4	Very high	93.7	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-64.1	-43	176.1	-56.7	0	0	0	0	111.8	I793 E797 P910 H911 C916 R917 L918	I793-T914 HydrophobicContact CB-CG2 4.46Å; I793-T914 HydrophobicContact CD1-CG2 4.29Å; I793-T914 HydrophobicContact CG1-CG2 3.96Å; I793-T914 HydrophobicContact CG2-CG2 4.1Å; I793-T914 WeakPolarHBondContact O-CG2 3.42Å; E797-T914 HydrophobicContact CB-CG2 3.57Å; E797-T914 HydrophobicContact CG-CG2 4.13Å; E797-T914 WeakPolarHBondContact OE2-CB 3.21Å; E797-T914 WeakPolarHBondContact OE2-CG2 3.47Å; E797-T914 PolarHBondContact OE2-OG1 2.97Å; P910-T914 PolarHBondContact O-N 3.43Å; P910-T914 VanDerWaalsContact O-N 3.12Å; P910-T914 PolarHBondContact O-OG1 3.23Å; P910-T914 VanDerWaalsContact O-OG1 3.06Å; H911-T914 PolarHBondContact O-N 2.89Å; T914-C916 PolarHBondContact O-N 3.03Å; T914-R917 PolarHBondContact O-N 2.76Å; T914-L918 HydrophobicContact CG2-CD1 3.86Å; T914-L918 HydrophobicContact CG2-CG 4.38Å; T914-L918 WeakPolarHBondContact O-CG 3.47Å; T914-L918 PolarHBondContact O-N 2.7Å; T914-L918 VanDerWaalsContact O-N 3.09Å
915	I	95.4	Very high	93.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-46.6	175.5	-66.8	165.2	0	0	0	110	L790 I793 V841 H911 F912 R917 L918 L919 F1004 I1008	L790-I915 HydrophobicContact CD1-CD1 3.99Å; L790-I915 HydrophobicContact CD1-CG1 4.49Å; L790-I915 HydrophobicContact CD2-CD1 4.34Å; L790-I915 HydrophobicContact CG-CD1 4.37Å; I793-I915 HydrophobicContact CD1-CB 4.34Å; I793-I915 HydrophobicContact CD1-CG1 3.51Å; I793-I915 HydrophobicContact CG2-CG1 4.29Å; V841-I915 HydrophobicContact CG1-CG2 4.26Å; H911-I915 VanDerWaalsContact O-CG1 3.25Å; H911-I915 WeakPolarHBondContact O-CG1 3.3Å; H911-I915 PolarHBondContact O-N 3.04Å; F912-I915 PolarHBondContact O-N 2.83Å; I915-R917 PolarHBondContact O-N 2.72Å; I915-L918 PolarHBondContact O-N 2.63Å; I915-L919 HydrophobicContact CG2-CD1 4.07Å; I915-L919 HydrophobicContact CG2-CD2 3.78Å; I915-L919 HydrophobicContact CG2-CG 4.42Å; I915-L919 WeakPolarHBondContact O-CB 3.27Å; I915-L919 WeakPolarHBondContact O-CD1 3.31Å; I915-L919 PolarHBondContact O-N 2.98Å; I915-F1004 HydrophobicContact CD1-CE2 4.39Å; I915-F1004 HydrophobicContact CG2-CZ 4.44Å; I915-I1008 HydrophobicContact CB-CD1 4.02Å; I915-I1008 HydrophobicContact CG2-CD1 3.68Å
916	C	93.9	Very high	93.7	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.007	18%	0.179	C	C	.	.	H	α-helix	trans	-55.8	-50.5	178.1	-76.9	0	0	0	0	112.4	F912 K913 T914 L918 G920 I924 I1008 A1011 E1015	F912-C916 PolarHBondContact O-N 3.09Å; F912-C916 PolarHBondContact O-SG 2.55Å; F912-C916 VanDerWaalsContact O-SG 3.38Å; K913-C916 PolarHBondContact O-N 3.06Å; T914-C916 PolarHBondContact O-N 3.03Å; C916-L918 PolarHBondContact O-N 3.43Å; C916-G920 WeakPolarHBondContact O-CA 3.18Å; C916-G920 PolarHBondContact O-N 2.92Å; C916-I924 HydrophobicContact CB-CD1 4.4Å; C916-I1008 WeakPolarHBondContact SG-CD1 3.48Å; C916-I1008 PolarHBondContact SG-O 2.88Å; C916-I1008 VanDerWaalsContact SG-O 3.42Å; C916-A1011 VanDerWaalsContact SG-CB 3.58Å; C916-E1015 VanDerWaalsContact CB-OE2 3.24Å; C916-E1015 WeakPolarHBondContact CB-OE2 3.49Å
917	R	91.3	Very high	93.6	Very high	144 Å²	144	33.7 Å²	33.7	54%	0.543	18%	0.176	S	C	.	.	H	α-helix	trans	-60.3	-44	-179.7	-75.7	170.1	180	178.8	0.2	113.4	E797 K913 T914 I915 E1015	E797-R917 WeakPolarHBondContact OE1-CD 3.42Å; E797-R917 IonicContact OE1-CZ 3.31Å; E797-R917 IonicContact OE1-NH1 3.9Å; E797-R917 PolarHBondContact OE1-NH1 3.5Å; K913-R917 WeakPolarHBondContact O-CG 3.41Å; K913-R917 PolarHBondContact O-N 2.6Å; K913-R917 VanDerWaalsContact O-N 3.15Å; T914-R917 PolarHBondContact O-N 2.76Å; I915-R917 PolarHBondContact O-N 2.72Å; R917-E1015 WeakPolarHBondContact CG-OE1 3.19Å
918	L	93.6	Very high	93.4	Very high	34 Å²	34	34.2 Å²	34.2	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-79.8	-32.1	-174.2	-66.5	179.1	0	0	0	112.9	I793 L796 L800 I837 T914 I915 C916	I793-L918 HydrophobicContact CD1-CD1 4.03Å; I793-L918 HydrophobicContact CG1-CD1 3.87Å; L796-L918 HydrophobicContact CD2-CD1 4.13Å; L800-L918 HydrophobicContact CD1-CD2 4.02Å; I837-L918 HydrophobicContact CG2-CB 4.29Å; I837-L918 HydrophobicContact CG2-CD1 4.29Å; T914-L918 HydrophobicContact CG2-CD1 3.86Å; T914-L918 HydrophobicContact CG2-CG 4.38Å; T914-L918 WeakPolarHBondContact O-CG 3.47Å; T914-L918 PolarHBondContact O-N 2.7Å; T914-L918 VanDerWaalsContact O-N 3.09Å; I915-L918 PolarHBondContact O-N 2.63Å; C916-L918 PolarHBondContact O-N 3.43Å
919	L	93	Very high	93.3	Very high	15 Å²	15	37.9 Å²	37.9	8%	0.079	20%	0.195	C	C	.	.	H	α-helix	trans	-83.9	-33.8	178.5	-87.8	59.7	0	0	0	112.3	T838 V841 I915 G923 I924 V927	T838-L919 HydrophobicContact CG2-CD2 4.48Å; T838-L919 HydrophobicContact CG2-CG 4.1Å; V841-L919 HydrophobicContact CB-CD1 4.36Å; V841-L919 HydrophobicContact CG1-CD2 4.22Å; V841-L919 HydrophobicContact CG2-CD1 4.07Å; I915-L919 HydrophobicContact CG2-CD1 4.07Å; I915-L919 HydrophobicContact CG2-CD2 3.78Å; I915-L919 HydrophobicContact CG2-CG 4.42Å; I915-L919 WeakPolarHBondContact O-CB 3.27Å; I915-L919 WeakPolarHBondContact O-CD1 3.31Å; I915-L919 PolarHBondContact O-N 2.98Å; L919-G923 WeakPolarHBondContact O-CA 3.42Å; L919-G923 PolarHBondContact O-N 2.82Å; L919-G923 VanDerWaalsContact O-N 3.08Å; L919-I924 HydrophobicContact CB-CG1 4.22Å; L919-V927 HydrophobicContact CD2-CG2 3.85Å
920	G	92.2	Very high	93.2	Very high	28 Å²	28	38.2 Å²	38.2	29%	0.289	19%	0.192	S	C	.	.	H	α-helix	trans	57.5	-171.1	-169.5	0	0	0	0	0	112.7	C916 Q922 G923 I924	C916-G920 WeakPolarHBondContact O-CA 3.18Å; C916-G920 PolarHBondContact O-N 2.92Å; G920-Q922 PolarHBondContact O-N 2.99Å; G920-G923 PolarHBondContact O-N 2.95Å; G920-I924 WeakPolarHBondContact O-CD1 3.33Å; G920-I924 VanDerWaalsContact O-CG1 3.22Å; G920-I924 WeakPolarHBondContact O-CG1 3.4Å; G920-I924 PolarHBondContact O-N 3.16Å
921	Y	91.4	Very high	93.2	Very high	98 Å²	98	36.2 Å²	36.2	38%	0.384	18%	0.179	S	C	.	.	H	α-helix	trans	-59	-44.9	-178.1	-66.3	-72.9	0	0	0	113.4	I924 A925 L1012 E1016 L1084	Y921-I924 PolarHBondContact O-N 3.33Å; Y921-A925 WeakPolarHBondContact O-CB 2.98Å; Y921-A925 PolarHBondContact O-N 3.46Å; Y921-L1012 HydrophobicContact CD1-CD1 4.43Å; Y921-L1012 HydrophobicContact CD1-CD2 4.15Å; Y921-L1012 HydrophobicContact CE1-CD1 3.98Å; Y921-L1012 HydrophobicContact CE1-CD2 3.99Å; Y921-L1012 HydrophobicContact CE1-CG 4.34Å; Y921-E1016 WeakPolarHBondContact CE1-OE1 3.46Å; Y921-E1016 VanDerWaalsContact CZ-OE1 3.29Å; Y921-E1016 WeakPolarHBondContact OH-CG 3.27Å; Y921-E1016 PolarHBondContact OH-OE1 3.2Å; Y921-L1084 HydrophobicContact CD1-CD1 4.29Å; Y921-L1084 HydrophobicContact CE1-CD1 4.03Å; Y921-L1084 HydrophobicContact CE1-CG 4.22Å
922	Q	90.5	Very high	93.1	Very high	112 Å²	112	36.4 Å²	36.4	52%	0.523	18%	0.181	S	C	.	.	H	α-helix	trans	-66.4	-40.5	-176.7	179.7	171.3	-9.2	0	0	112.1	P833 Y834 G920 V926	P833-Q922 PolarHBondContact O-NE2 3.13Å; Y834-Q922 HydrophobicContact CD1-CG 4.32Å; Y834-Q922 HydrophobicContact CE1-CG 3.76Å; G920-Q922 PolarHBondContact O-N 2.99Å; Q922-V926 PolarHBondContact O-N 3.42Å
923	G	91.9	Very high	93	Very high	2 Å²	2	41.7 Å²	41.7	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-68.4	-42	176	0	0	0	0	0	112.4	L919 G920 A925 V926 V927	L919-G923 WeakPolarHBondContact O-CA 3.42Å; L919-G923 PolarHBondContact O-N 2.82Å; L919-G923 VanDerWaalsContact O-N 3.08Å; G920-G923 PolarHBondContact O-N 2.95Å; G923-A925 VanDerWaalsContact C-N 3.34Å; G923-A925 PolarHBondContact O-N 2.87Å; G923-V926 VanDerWaalsContact O-CG1 3.24Å; G923-V926 WeakPolarHBondContact O-CG1 3.25Å; G923-V926 PolarHBondContact O-N 3.31Å; G923-V927 VanDerWaalsContact O-CG2 3.3Å; G923-V927 WeakPolarHBondContact O-CG2 3.41Å; G923-V927 PolarHBondContact O-N 3.36Å; G923-V927 VanDerWaalsContact O-N 3.08Å
924	I	93.6	Very high	93	Very high	6 Å²	6	39 Å²	39	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-44.2	176.5	-65.9	165.6	0	0	0	110.4	C916 L919 G920 Y921 V926 V927 M928 I1008 L1012	C916-I924 HydrophobicContact CB-CD1 4.4Å; L919-I924 HydrophobicContact CB-CG1 4.22Å; G920-I924 WeakPolarHBondContact O-CD1 3.33Å; G920-I924 VanDerWaalsContact O-CG1 3.22Å; G920-I924 WeakPolarHBondContact O-CG1 3.4Å; G920-I924 PolarHBondContact O-N 3.16Å; Y921-I924 PolarHBondContact O-N 3.33Å; I924-V926 PolarHBondContact O-N 2.82Å; I924-V927 PolarHBondContact O-N 3.26Å; I924-M928 HydrophobicContact CG2-CE 3.83Å; I924-M928 HydrophobicContact CG2-CG 4.32Å; I924-M928 HydrophobicContact CG2-SD 4.18Å; I924-M928 WeakPolarHBondContact O-CG 3.32Å; I924-M928 PolarHBondContact O-N 3.36Å; I924-I1008 HydrophobicContact CD1-CG1 4.44Å; I924-I1008 HydrophobicContact CG1-CG1 4.28Å; I924-I1008 HydrophobicContact CG2-CG1 4.42Å; I924-I1008 HydrophobicContact CG2-CG2 4.35Å; I924-L1012 HydrophobicContact CD1-CD1 4.07Å; I924-L1012 HydrophobicContact CD1-CD2 4.06Å; I924-L1012 HydrophobicContact CD1-CG 4.48Å
925	A	92	Very high	92.9	Very high	54 Å²	54	39 Å²	39	45%	0.446	19%	0.193	S	C	.	.	H	α-helix	trans	-60.1	-46	-179.9	0	0	0	0	0	112.4	Y921 G923 M928 E929	Y921-A925 WeakPolarHBondContact O-CB 2.98Å; Y921-A925 PolarHBondContact O-N 3.46Å; G923-A925 VanDerWaalsContact C-N 3.34Å; G923-A925 PolarHBondContact O-N 2.87Å; A925-M928 PolarHBondContact O-N 2.86Å; A925-E929 WeakPolarHBondContact O-CG 3.35Å; A925-E929 PolarHBondContact O-N 2.78Å
926	V	93.2	Very high	92.9	Very high	28 Å²	28	43.4 Å²	43.4	17%	0.17	21%	0.212	C	C	.	.	H	α-helix	trans	-67.2	-40.2	178.6	70.6	0	0	0	0	111.8	Y834 T838 Q922 G923 I924 M928 E929 E930	Y834-V926 HydrophobicContact CD1-CB 4.36Å; Y834-V926 HydrophobicContact CD1-CG1 3.73Å; Y834-V926 HydrophobicContact CE1-CB 3.61Å; Y834-V926 HydrophobicContact CE1-CG1 3.46Å; Y834-V926 VanDerWaalsContact CE1-CG1 3.46Å; Y834-V926 HydrophobicContact CE1-CG2 4.05Å; Y834-V926 HydrophobicContact CE2-CG2 4.09Å; Y834-V926 HydrophobicContact CG-CG1 4.46Å; T838-V926 HydrophobicContact CG2-CG1 4.16Å; Q922-V926 PolarHBondContact O-N 3.42Å; G923-V926 VanDerWaalsContact O-CG1 3.24Å; G923-V926 WeakPolarHBondContact O-CG1 3.25Å; G923-V926 PolarHBondContact O-N 3.31Å; I924-V926 PolarHBondContact O-N 2.82Å; V926-M928 VanDerWaalsContact C-N 3.35Å; V926-M928 PolarHBondContact O-N 3.43Å; V926-E929 PolarHBondContact O-N 3.22Å; V926-E930 HydrophobicContact CG2-CG 4.36Å; V926-E930 WeakPolarHBondContact O-CG 2.96Å; V926-E930 PolarHBondContact O-N 3.28Å
927	V	94.3	Very high	92.9	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.018	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-43.9	177	170.9	0	0	0	0	110.5	F842 L845 L919 G923 I924 E929 E930 L931 F1004	F842-V927 HydrophobicContact CB-CG2 4.38Å; L845-V927 HydrophobicContact CD1-CG1 3.63Å; L919-V927 HydrophobicContact CD2-CG2 3.85Å; G923-V927 VanDerWaalsContact O-CG2 3.3Å; G923-V927 WeakPolarHBondContact O-CG2 3.41Å; G923-V927 PolarHBondContact O-N 3.36Å; G923-V927 VanDerWaalsContact O-N 3.08Å; I924-V927 PolarHBondContact O-N 3.26Å; V927-E929 PolarHBondContact O-N 2.86Å; V927-E930 PolarHBondContact O-N 3.31Å; V927-L931 HydrophobicContact CG1-CD1 3.95Å; V927-L931 HydrophobicContact CG1-CG 4.26Å; V927-L931 WeakPolarHBondContact O-CB 3.49Å; V927-L931 WeakPolarHBondContact O-CG 3.38Å; V927-L931 PolarHBondContact O-N 3.41Å; V927-F1004 HydrophobicContact CG1-CE1 3.75Å; V927-F1004 HydrophobicContact CG1-CZ 4.36Å
928	M	92.6	Very high	93	Very high	10 Å²	10	41.6 Å²	41.6	5%	0.049	22%	0.219	C	C	.	.	H	α-helix	trans	-62.2	-42.7	176.1	-74.2	-172.2	173.9	0	0	112.7	I924 A925 V926 L931 L932 C1005 I1008 M1090 I1094	I924-M928 HydrophobicContact CG2-CE 3.83Å; I924-M928 HydrophobicContact CG2-CG 4.32Å; I924-M928 HydrophobicContact CG2-SD 4.18Å; I924-M928 WeakPolarHBondContact O-CG 3.32Å; I924-M928 PolarHBondContact O-N 3.36Å; A925-M928 PolarHBondContact O-N 2.86Å; V926-M928 VanDerWaalsContact C-N 3.35Å; V926-M928 PolarHBondContact O-N 3.43Å; M928-L931 PolarHBondContact O-N 3.3Å; M928-L932 WeakPolarHBondContact O-CG 3.05Å; M928-L932 PolarHBondContact O-N 3.14Å; M928-C1005 HydrophobicContact CE-CB 4.45Å; M928-I1008 HydrophobicContact CE-CG2 3.39Å; M928-M1090 HydrophobicContact CE-CE 3.85Å; M928-M1090 HydrophobicContact CE-SD 4.17Å; M928-M1090 HydrophobicContact SD-CE 4.46Å; M928-M1090 HydrophobicContact SD-SD 4Å; M928-I1094 HydrophobicContact CB-CD1 4.46Å; M928-I1094 HydrophobicContact SD-CD1 4.49Å
929	E	92.6	Very high	92.9	Very high	78 Å²	78	40 Å²	40	36%	0.364	21%	0.211	S	C	.	.	H	α-helix	trans	-64.2	-42.6	176.9	-76	-70.6	174.7	0	0	112.4	A925 V926 V927 L932 K933 R1097	A925-E929 WeakPolarHBondContact O-CG 3.35Å; A925-E929 PolarHBondContact O-N 2.78Å; V926-E929 PolarHBondContact O-N 3.22Å; V927-E929 PolarHBondContact O-N 2.86Å; E929-L932 WeakPolarHBondContact O-CB 3.32Å; E929-L932 PolarHBondContact O-N 3.44Å; E929-K933 WeakPolarHBondContact O-CG 3.45Å; E929-K933 PolarHBondContact O-N 3.31Å; E929-K933 VanDerWaalsContact O-N 3.1Å; E929-R1097 IonicContact OE1-CZ 3.51Å; E929-R1097 IonicContact OE1-NH1 2.63Å; E929-R1097 PolarHBondContact OE1-NH1 3.02Å; E929-R1097 IonicContact OE1-NH2 2.78Å; E929-R1097 IonicContact OE2-CZ 3.97Å; E929-R1097 IonicContact OE2-NH1 2.88Å; E929-R1097 PolarHBondContact OE2-NH1 3.23Å; E929-R1097 IonicContact OE2-NH2 3.08Å; E929-R1097 PolarHBondContact OE2-NH2 2.91Å
930	E	93.2	Very high	92.9	Very high	56 Å²	56	43.4 Å²	43.4	26%	0.262	23%	0.227	S	C	.	.	H	α-helix	trans	-69	-38.5	176.9	-66.2	-55.9	138.5	0	0	112	F842 V926 V927 L932 K933 I934	F842-E930 HydrophobicContact CD2-CB 3.9Å; F842-E930 HydrophobicContact CE2-CB 3.23Å; F842-E930 HydrophobicContact CE2-CG 4.06Å; F842-E930 HydrophobicContact CZ-CB 3.59Å; F842-E930 HydrophobicContact CZ-CG 4.08Å; V926-E930 HydrophobicContact CG2-CG 4.36Å; V926-E930 WeakPolarHBondContact O-CG 2.96Å; V926-E930 PolarHBondContact O-N 3.28Å; V927-E930 PolarHBondContact O-N 3.31Å; E930-L932 VanDerWaalsContact C-N 3.31Å; E930-L932 PolarHBondContact O-N 2.9Å; E930-K933 WeakPolarHBondContact O-CB 3.17Å; E930-K933 PolarHBondContact O-N 3.13Å; E930-K933 VanDerWaalsContact O-N 3.09Å; E930-K933 IonicContact OE1-NZ 3.02Å; E930-K933 PolarHBondContact OE1-NZ 3.24Å; E930-K933 WeakPolarHBondContact OE2-CD 3.4Å; E930-K933 IonicContact OE2-NZ 2.72Å; E930-I934 WeakPolarHBondContact O-CG1 3.49Å; E930-I934 PolarHBondContact O-N 3.21Å
931	L	93.4	Very high	92.8	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-60.1	-40.4	172	-73.9	177.5	0	0	0	111.7	L850 V927 M928 K933 I934 V935 A1001 F1004	L850-L931 HydrophobicContact CD1-CD2 3.85Å; L850-L931 HydrophobicContact CD2-CD2 4.48Å; V927-L931 HydrophobicContact CG1-CD1 3.95Å; V927-L931 HydrophobicContact CG1-CG 4.26Å; V927-L931 WeakPolarHBondContact O-CB 3.49Å; V927-L931 WeakPolarHBondContact O-CG 3.38Å; V927-L931 PolarHBondContact O-N 3.41Å; M928-L931 PolarHBondContact O-N 3.3Å; L931-K933 VanDerWaalsContact C-N 3.31Å; L931-K933 PolarHBondContact O-N 3.37Å; L931-I934 HydrophobicContact CD2-CD1 4.3Å; L931-I934 PolarHBondContact O-N 3.47Å; L931-V935 WeakPolarHBondContact O-CG2 3.45Å; L931-V935 PolarHBondContact O-N 2.92Å; L931-A1001 HydrophobicContact CD2-CB 4.26Å; L931-F1004 HydrophobicContact CD1-CB 4.35Å; L931-F1004 HydrophobicContact CD1-CD1 3.46Å; L931-F1004 VanDerWaalsContact CD1-CD1 3.46Å; L931-F1004 HydrophobicContact CD1-CE1 4.1Å; L931-F1004 HydrophobicContact CD1-CG 4.13Å
932	L	93	Very high	92.8	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-37.7	173.4	-80.7	177.4	0	0	0	112.4	M928 E929 E930 V935 K936 I1094 R1097 I1098 F1101	M928-L932 WeakPolarHBondContact O-CG 3.05Å; M928-L932 PolarHBondContact O-N 3.14Å; E929-L932 WeakPolarHBondContact O-CB 3.32Å; E929-L932 PolarHBondContact O-N 3.44Å; E930-L932 VanDerWaalsContact C-N 3.31Å; E930-L932 PolarHBondContact O-N 2.9Å; L932-V935 PolarHBondContact O-N 3.29Å; L932-K936 WeakPolarHBondContact O-CB 3.44Å; L932-K936 PolarHBondContact O-N 2.93Å; L932-I1094 HydrophobicContact CD1-CD1 3.72Å; L932-I1094 HydrophobicContact CD2-CD1 4.37Å; L932-I1094 HydrophobicContact CD2-CG2 3.93Å; L932-I1094 HydrophobicContact CG-CD1 4.09Å; L932-R1097 HydrophobicContact CD1-CB 4.48Å; L932-I1098 HydrophobicContact CD2-CD1 4.25Å; L932-I1098 HydrophobicContact CD2-CG1 3.78Å; L932-F1101 HydrophobicContact CD2-CE2 4.3Å
933	K	94	Very high	92.9	Very high	115 Å²	115	36.6 Å²	36.6	50%	0.5	20%	0.204	S	C	.	.	H	α-helix	trans	-66.3	-40.5	174.9	-68.7	171.9	-171.9	170.5	0	111.7	E929 E930 L931 K936 S937	E929-K933 WeakPolarHBondContact O-CG 3.45Å; E929-K933 PolarHBondContact O-N 3.31Å; E929-K933 VanDerWaalsContact O-N 3.1Å; E930-K933 WeakPolarHBondContact O-CB 3.17Å; E930-K933 PolarHBondContact O-N 3.13Å; E930-K933 VanDerWaalsContact O-N 3.09Å; E930-K933 IonicContact OE1-NZ 3.02Å; E930-K933 PolarHBondContact OE1-NZ 3.24Å; E930-K933 WeakPolarHBondContact OE2-CD 3.4Å; E930-K933 IonicContact OE2-NZ 2.72Å; L931-K933 VanDerWaalsContact C-N 3.31Å; L931-K933 PolarHBondContact O-N 3.37Å; K933-K936 PolarHBondContact O-N 2.84Å; K933-S937 WeakPolarHBondContact O-CB 3.46Å; K933-S937 PolarHBondContact O-N 2.89Å
934	I	92.8	Very high	92.9	Very high	26 Å²	26	37.5 Å²	37.5	13%	0.133	21%	0.208	C	C	.	.	H	α-helix	trans	-61.4	-49.9	174.5	-66.6	163.7	0	0	0	110	F842 N846 L850 E930 L931 K936 S937 L938	F842-I934 HydrophobicContact CE2-CD1 3.94Å; F842-I934 HydrophobicContact CZ-CD1 4.15Å; N846-I934 HydrophobicContact CB-CD1 4.36Å; N846-I934 VanDerWaalsContact OD1-CD1 3.27Å; N846-I934 WeakPolarHBondContact OD1-CD1 3.31Å; L850-I934 HydrophobicContact CD1-CD1 4.41Å; L850-I934 HydrophobicContact CD1-CG2 4.34Å; E930-I934 WeakPolarHBondContact O-CG1 3.49Å; E930-I934 PolarHBondContact O-N 3.21Å; L931-I934 HydrophobicContact CD2-CD1 4.3Å; L931-I934 PolarHBondContact O-N 3.47Å; I934-K936 VanDerWaalsContact C-N 3.31Å; I934-K936 PolarHBondContact O-N 3.44Å; I934-S937 WeakPolarHBondContact O-CB 3.48Å; I934-S937 PolarHBondContact O-N 3.08Å; I934-S937 VanDerWaalsContact O-N 3.11Å; I934-L938 HydrophobicContact CG2-CD1 4.03Å; I934-L938 HydrophobicContact CG2-CG 4.47Å; I934-L938 WeakPolarHBondContact O-CG 3.27Å; I934-L938 PolarHBondContact O-N 3.36Å
935	V	94.3	Very high	92.7	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.018	24%	0.237	C	C	.	.	H	α-helix	trans	-58.8	-42.7	177.1	170.9	0	0	0	0	111.3	L931 L932 L938 L939 V998 A1001 I1098	L931-V935 WeakPolarHBondContact O-CG2 3.45Å; L931-V935 PolarHBondContact O-N 2.92Å; L932-V935 PolarHBondContact O-N 3.29Å; V935-L938 PolarHBondContact O-N 3Å; V935-L939 HydrophobicContact CG1-CD1 3.62Å; V935-L939 HydrophobicContact CG1-CG 4.16Å; V935-L939 VanDerWaalsContact O-CB 3.3Å; V935-L939 WeakPolarHBondContact O-CB 3.3Å; V935-L939 VanDerWaalsContact O-CG 3.31Å; V935-L939 WeakPolarHBondContact O-CG 3.46Å; V935-L939 PolarHBondContact O-N 2.77Å; V935-V998 HydrophobicContact CG1-CG1 4.09Å; V935-V998 HydrophobicContact CG2-CG1 4.44Å; V935-A1001 HydrophobicContact CG2-CB 3.73Å; V935-I1098 HydrophobicContact CG1-CD1 4.23Å; V935-I1098 HydrophobicContact CG1-CG1 4.11Å; V935-I1098 HydrophobicContact CG1-CG2 4.34Å
936	K	94	Very high	92.7	Very high	93 Å²	93	43 Å²	43	40%	0.404	22%	0.223	S	C	.	.	H	α-helix	trans	-60.1	-46.5	174.8	-176.1	-178.1	176.9	-175.8	0	111.6	L932 K933 I934 L939 Q940 F1101	L932-K936 WeakPolarHBondContact O-CB 3.44Å; L932-K936 PolarHBondContact O-N 2.93Å; K933-K936 PolarHBondContact O-N 2.84Å; I934-K936 VanDerWaalsContact C-N 3.31Å; I934-K936 PolarHBondContact O-N 3.44Å; K936-L939 PolarHBondContact O-N 3.19Å; K936-Q940 HydrophobicContact CG-CG 4.4Å; K936-Q940 VanDerWaalsContact O-CB 3.31Å; K936-Q940 WeakPolarHBondContact O-CB 3.39Å; K936-Q940 WeakPolarHBondContact O-CG 3.33Å; K936-Q940 PolarHBondContact O-N 3.33Å; K936-F1101 HydrophobicContact CB-CD1 4.29Å; K936-F1101 HydrophobicContact CB-CD2 3.77Å; K936-F1101 HydrophobicContact CB-CE1 4.24Å; K936-F1101 HydrophobicContact CB-CE2 3.71Å; K936-F1101 HydrophobicContact CB-CG 4.08Å; K936-F1101 HydrophobicContact CB-CZ 3.96Å; K936-F1101 HydrophobicContact CD-CD1 4.08Å; K936-F1101 HydrophobicContact CD-CE1 3.92Å; K936-F1101 HydrophobicContact CD-CZ 4.32Å; K936-F1101 HydrophobicContact CG-CD1 3.91Å; K936-F1101 HydrophobicContact CG-CD2 4.2Å; K936-F1101 HydrophobicContact CG-CE1 4.11Å; K936-F1101 HydrophobicContact CG-CE2 4.38Å; K936-F1101 HydrophobicContact CG-CG 3.98Å; K936-F1101 HydrophobicContact CG-CZ 4.34Å
937	S	93.8	Very high	92.5	Very high	83 Å²	83	41.8 Å²	41.8	58%	0.58	22%	0.216	S	C	*	.	H	α-helix	trans	-60.4	-45.7	179.2	-172.8	0	0	0	0	111.5	K933 I934 G941	K933-S937 WeakPolarHBondContact O-CB 3.46Å; K933-S937 PolarHBondContact O-N 2.89Å; I934-S937 WeakPolarHBondContact O-CB 3.48Å; I934-S937 PolarHBondContact O-N 3.08Å; I934-S937 VanDerWaalsContact O-N 3.11Å; S937-G941 VanDerWaalsContact O-CA 3.3Å; S937-G941 WeakPolarHBondContact O-CA 3.41Å; S937-G941 PolarHBondContact O-N 2.96Å
938	L	92.9	Very high	92.3	Very high	24 Å²	24	45.7 Å²	45.7	13%	0.126	23%	0.232	C	C	.	.	H	α-helix	trans	-67	-47.3	178.1	-68.4	174.3	0	0	0	112	I934 V935 Q940 T942 I943 E997 V998	I934-L938 HydrophobicContact CG2-CD1 4.03Å; I934-L938 HydrophobicContact CG2-CG 4.47Å; I934-L938 WeakPolarHBondContact O-CG 3.27Å; I934-L938 PolarHBondContact O-N 3.36Å; V935-L938 PolarHBondContact O-N 3Å; L938-Q940 PolarHBondContact O-N 3.05Å; L938-T942 PolarHBondContact O-N 3.33Å; L938-I943 HydrophobicContact CB-CD1 3.97Å; L938-I943 VanDerWaalsContact O-CB 3.29Å; L938-I943 WeakPolarHBondContact O-CB 3.38Å; L938-I943 WeakPolarHBondContact O-CG1 3.46Å; L938-I943 PolarHBondContact O-N 3.35Å; L938-E997 HydrophobicContact CD1-CB 3.9Å; L938-V998 HydrophobicContact CB-CG2 3.95Å; L938-V998 HydrophobicContact CD1-CG2 3.86Å
939	L	92.1	Very high	92.2	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-69.5	-30.9	-177.7	-72.4	177.8	0	0	0	113.7	V935 K936 I943 L944 V998 I1098 L1102 I1162	V935-L939 HydrophobicContact CG1-CD1 3.62Å; V935-L939 HydrophobicContact CG1-CG 4.16Å; V935-L939 VanDerWaalsContact O-CB 3.3Å; V935-L939 WeakPolarHBondContact O-CB 3.3Å; V935-L939 VanDerWaalsContact O-CG 3.31Å; V935-L939 WeakPolarHBondContact O-CG 3.46Å; V935-L939 PolarHBondContact O-N 2.77Å; K936-L939 PolarHBondContact O-N 3.19Å; L939-I943 HydrophobicContact CD2-CD1 3.99Å; L939-I943 HydrophobicContact CD2-CG2 4.48Å; L939-L944 WeakPolarHBondContact O-CB 3.36Å; L939-V998 HydrophobicContact CG-CG2 4.48Å; L939-I1098 HydrophobicContact CD1-CG2 3.86Å; L939-L1102 HydrophobicContact CD1-CD2 4.28Å; L939-L1102 HydrophobicContact CD2-CD2 4.44Å; L939-I1162 HydrophobicContact CD2-CD1 3.83Å; L939-I1162 HydrophobicContact CD2-CG1 4.32Å
940	Q	92.4	Very high	92	Very high	86 Å²	86	44.1 Å²	44.1	40%	0.402	23%	0.229	S	C	.	.	H	α-helix	trans	-96.7	-16.3	179	-62.4	-173.3	-28.9	0	0	113.2	K936 L938 L944 F1101	K936-Q940 HydrophobicContact CG-CG 4.4Å; K936-Q940 VanDerWaalsContact O-CB 3.31Å; K936-Q940 WeakPolarHBondContact O-CB 3.39Å; K936-Q940 WeakPolarHBondContact O-CG 3.33Å; K936-Q940 PolarHBondContact O-N 3.33Å; L938-Q940 PolarHBondContact O-N 3.05Å; Q940-L944 WeakPolarHBondContact O-CD2 3.35Å; Q940-F1101 PolarHBondContact NE2-O 3.38Å; Q940-F1101 VanDerWaalsContact NE2-O 3.11Å
941	G	92	Very high	91.7	Very high	35 Å²	35	42.3 Å²	42.3	36%	0.361	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-102	179.1	0	0	0	0	0	112.1	S937 L944 Q945	S937-G941 VanDerWaalsContact O-CA 3.3Å; S937-G941 WeakPolarHBondContact O-CA 3.41Å; S937-G941 PolarHBondContact O-N 2.96Å; G941-L944 PolarHBondContact O-N 2.96Å; G941-Q945 PolarHBondContact O-N 3.19Å; G941-Q945 VanDerWaalsContact O-N 3.09Å
942	T	89.7	Confident	91.4	Very high	57 Å²	57	50.5 Å²	50.5	35%	0.35	26%	0.259	S	S	.	.	H	α-helix	trans	-61.4	-50.3	-170.8	52.4	0	0	0	0	112.4	L938 L944 Q945 Y946	L938-T942 PolarHBondContact O-N 3.33Å; T942-L944 VanDerWaalsContact C-N 3.34Å; T942-L944 PolarHBondContact O-N 3.29Å; T942-Q945 PolarHBondContact O-N 3.2Å; T942-Y946 WeakPolarHBondContact O-CD2 3.45Å; T942-Y946 PolarHBondContact O-N 3.07Å
943	I	92.6	Very high	91.2	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-64	-42.3	-177.1	-58.4	172.7	0	0	0	110.2	L938 L939 Q945 Y946 V947 L995 V998 W1107	L938-I943 HydrophobicContact CB-CD1 3.97Å; L938-I943 VanDerWaalsContact O-CB 3.29Å; L938-I943 WeakPolarHBondContact O-CB 3.38Å; L938-I943 WeakPolarHBondContact O-CG1 3.46Å; L938-I943 PolarHBondContact O-N 3.35Å; L939-I943 HydrophobicContact CD2-CD1 3.99Å; L939-I943 HydrophobicContact CD2-CG2 4.48Å; I943-Q945 VanDerWaalsContact C-N 3.32Å; I943-Q945 PolarHBondContact O-N 3.04Å; I943-Y946 PolarHBondContact O-N 2.85Å; I943-V947 HydrophobicContact CG2-CG2 4.06Å; I943-V947 WeakPolarHBondContact O-CB 3.49Å; I943-V947 WeakPolarHBondContact O-CG2 3.47Å; I943-V947 PolarHBondContact O-N 3.22Å; I943-L995 HydrophobicContact CD1-CD2 4.18Å; I943-L995 HydrophobicContact CG2-CD2 4.25Å; I943-V998 HydrophobicContact CD1-CG2 3.71Å; I943-W1107 HydrophobicContact CG2-CH2 4.03Å
944	L	91.8	Very high	90.9	Very high	21 Å²	21	47.6 Å²	47.6	11%	0.11	25%	0.25	C	S	.	.	H	α-helix	trans	-60.3	-43.5	177.3	-177.4	59.5	0	0	0	111.9	L939 Q940 G941 T942 V947 K948 D1104 V1106 W1107	L939-L944 WeakPolarHBondContact O-CB 3.36Å; Q940-L944 WeakPolarHBondContact O-CD2 3.35Å; G941-L944 PolarHBondContact O-N 2.96Å; T942-L944 VanDerWaalsContact C-N 3.34Å; T942-L944 PolarHBondContact O-N 3.29Å; L944-V947 PolarHBondContact O-N 2.94Å; L944-K948 HydrophobicContact CG-CD 4.41Å; L944-K948 WeakPolarHBondContact O-CG 3.39Å; L944-K948 PolarHBondContact O-N 2.6Å; L944-D1104 HydrophobicContact CD1-CB 4Å; L944-D1104 HydrophobicContact CD2-CB 4.39Å; L944-V1106 HydrophobicContact CD1-CG1 3.56Å; L944-W1107 HydrophobicContact CB-CZ2 4.42Å; L944-W1107 HydrophobicContact CD1-CZ2 3.84Å
945	Q	91.3	Very high	90.7	Very high	134 Å²	134	47.4 Å²	47.4	63%	0.626	25%	0.251	S	S	*	.	H	α-helix	trans	-62.5	-48.5	178.7	-175.4	176.7	-8.5	0	0	110.8	G941 T942 I943 V947 K948 T949	G941-Q945 PolarHBondContact O-N 3.19Å; G941-Q945 VanDerWaalsContact O-N 3.09Å; T942-Q945 PolarHBondContact O-N 3.2Å; I943-Q945 VanDerWaalsContact C-N 3.32Å; I943-Q945 PolarHBondContact O-N 3.04Å; Q945-V947 VanDerWaalsContact C-N 3.35Å; Q945-V947 PolarHBondContact O-N 3.24Å; Q945-K948 PolarHBondContact O-N 3.4Å; Q945-T949 PolarHBondContact O-N 3.48Å; Q945-T949 PolarHBondContact O-OG1 2.95Å
946	Y	90.3	Very high	90.2	Very high	42 Å²	42	55.8 Å²	55.8	17%	0.165	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-37.5	176.3	-78.3	-69.2	0	0	0	112.8	T942 I943 T949 L950 Y984 E986 D990 V991	T942-Y946 WeakPolarHBondContact O-CD2 3.45Å; T942-Y946 PolarHBondContact O-N 3.07Å; I943-Y946 PolarHBondContact O-N 2.85Å; Y946-T949 PolarHBondContact O-N 2.97Å; Y946-L950 VanDerWaalsContact O-CB 3.26Å; Y946-L950 WeakPolarHBondContact O-CB 3.45Å; Y946-L950 WeakPolarHBondContact O-CG 3.38Å; Y946-L950 PolarHBondContact O-N 3.44Å; Y946-Y984 HydrophobicContact CD1-CE1 4.21Å; Y946-Y984 HydrophobicContact CE1-CE1 4.24Å; Y946-Y984 WeakPolarHBondContact CE1-OH 3.24Å; Y946-E986 HydrophobicContact CE1-CB 4.27Å; Y946-E986 VanDerWaalsContact CE1-OE2 3.26Å; Y946-E986 WeakPolarHBondContact CE1-OE2 3.47Å; Y946-E986 PolarHBondContact OH-OE2 3.36Å; Y946-D990 HydrophobicContact CE2-CB 3.91Å; Y946-V991 HydrophobicContact CD1-CG2 3.76Å; Y946-V991 HydrophobicContact CD2-CG2 4.13Å; Y946-V991 HydrophobicContact CE1-CG2 4.35Å; Y946-V991 HydrophobicContact CG-CG2 3.64Å
947	V	90.3	Very high	89.8	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-64.2	-41.9	176.3	167.3	0	0	0	0	111.1	I943 L944 Q945 I951 V1106 W1107 F1125 L1128	I943-V947 HydrophobicContact CG2-CG2 4.06Å; I943-V947 WeakPolarHBondContact O-CB 3.49Å; I943-V947 WeakPolarHBondContact O-CG2 3.47Å; I943-V947 PolarHBondContact O-N 3.22Å; L944-V947 PolarHBondContact O-N 2.94Å; Q945-V947 VanDerWaalsContact C-N 3.35Å; Q945-V947 PolarHBondContact O-N 3.24Å; V947-I951 HydrophobicContact CG1-CD1 3.59Å; V947-I951 HydrophobicContact CG1-CG1 4.41Å; V947-I951 WeakPolarHBondContact O-CB 3.34Å; V947-I951 VanDerWaalsContact O-CG1 3.26Å; V947-I951 WeakPolarHBondContact O-CG1 3.33Å; V947-I951 PolarHBondContact O-N 3.36Å; V947-V1106 HydrophobicContact CG1-CG1 4.34Å; V947-W1107 HydrophobicContact CB-CH2 4.4Å; V947-W1107 HydrophobicContact CG1-CE3 4.39Å; V947-W1107 HydrophobicContact CG1-CH2 4.47Å; V947-W1107 HydrophobicContact CG1-CZ3 4.18Å; V947-W1107 HydrophobicContact CG2-CH2 3.9Å; V947-W1107 HydrophobicContact CG2-CZ3 3.95Å; V947-F1125 HydrophobicContact CG1-CD2 4.2Å; V947-F1125 HydrophobicContact CG2-CD2 4.15Å; V947-F1125 HydrophobicContact CG2-CE2 3.9Å; V947-L1128 HydrophobicContact CB-CD2 4.34Å; V947-L1128 HydrophobicContact CG1-CD2 4.17Å; V947-L1128 HydrophobicContact CG2-CD2 4.05Å
948	K	89.6	Confident	89.6	Confident	85 Å²	85	52.2 Å²	52.2	37%	0.37	27%	0.265	S	S	.	.	H	α-helix	trans	-60.7	-49.2	174	-75	176.2	179.5	178.4	0	111.3	L944 Q945 I951 E952 D1104 V1106	L944-K948 HydrophobicContact CG-CD 4.41Å; L944-K948 WeakPolarHBondContact O-CG 3.39Å; L944-K948 PolarHBondContact O-N 2.6Å; Q945-K948 PolarHBondContact O-N 3.4Å; K948-I951 PolarHBondContact O-N 3.25Å; K948-E952 PolarHBondContact O-N 3.28Å; K948-D1104 VanDerWaalsContact CE-OD2 3.28Å; K948-D1104 WeakPolarHBondContact CE-OD2 3.41Å; K948-D1104 IonicContact NZ-OD1 2.87Å; K948-D1104 IonicContact NZ-OD2 2.89Å; K948-D1104 PolarHBondContact NZ-OD2 3.25Å; K948-V1106 HydrophobicContact CG-CB 4.19Å; K948-V1106 HydrophobicContact CG-CG1 4.06Å; K948-V1106 HydrophobicContact CG-CG2 3.9Å
949	T	90.6	Very high	89.3	Confident	56 Å²	56	58.8 Å²	58.8	34%	0.344	29%	0.288	S	S	.	.	H	α-helix	trans	-60.3	-48.7	178	-54.4	0	0	0	0	111.7	Q945 Y946 I951 E952 V953	Q945-T949 PolarHBondContact O-N 3.48Å; Q945-T949 PolarHBondContact O-OG1 2.95Å; Y946-T949 PolarHBondContact O-N 2.97Å; T949-I951 PolarHBondContact O-N 3.28Å; T949-E952 PolarHBondContact O-N 3.38Å; T949-V953 WeakPolarHBondContact O-CG2 3.33Å; T949-V953 PolarHBondContact O-N 3.23Å; T949-V953 VanDerWaalsContact O-N 3.11Å
950	L	88.4	Confident	89.2	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-71.5	-28.9	-176.1	-68.7	173	0	0	0	113	Y946 E952 V953 M954 I981 Y984 L987 V991 L1128 M1132	Y946-L950 VanDerWaalsContact O-CB 3.26Å; Y946-L950 WeakPolarHBondContact O-CB 3.45Å; Y946-L950 WeakPolarHBondContact O-CG 3.38Å; Y946-L950 PolarHBondContact O-N 3.44Å; L950-E952 VanDerWaalsContact C-N 3.34Å; L950-V953 PolarHBondContact O-N 3.05Å; L950-M954 WeakPolarHBondContact O-CB 3.38Å; L950-M954 PolarHBondContact O-N 3.38Å; L950-I981 HydrophobicContact CB-CD1 4.45Å; L950-I981 HydrophobicContact CD2-CD1 3.95Å; L950-Y984 HydrophobicContact CD2-CD1 3.9Å; L950-Y984 HydrophobicContact CD2-CD2 4.15Å; L950-Y984 HydrophobicContact CD2-CE1 4.04Å; L950-Y984 HydrophobicContact CD2-CE2 4.3Å; L950-Y984 HydrophobicContact CD2-CG 3.96Å; L950-L987 HydrophobicContact CD1-CD1 4.11Å; L950-V991 HydrophobicContact CD1-CG1 4.47Å; L950-V991 HydrophobicContact CD1-CG2 4.28Å; L950-L1128 HydrophobicContact CB-CD1 3.66Å; L950-L1128 HydrophobicContact CB-CD2 4.05Å; L950-L1128 HydrophobicContact CD1-CD1 4.35Å; L950-M1132 HydrophobicContact CD1-CE 3.56Å
951	I	87.1	Confident	89.1	Confident	18 Å²	18	57.6 Å²	57.6	9%	0.092	29%	0.285	C	S	.	.	H	α-helix	trans	-68.7	-33.3	172.6	-75.4	168.3	0	0	0	111.3	V947 K948 T949 M954 V1106 L1128	V947-I951 HydrophobicContact CG1-CD1 3.59Å; V947-I951 HydrophobicContact CG1-CG1 4.41Å; V947-I951 WeakPolarHBondContact O-CB 3.34Å; V947-I951 VanDerWaalsContact O-CG1 3.26Å; V947-I951 WeakPolarHBondContact O-CG1 3.33Å; V947-I951 PolarHBondContact O-N 3.36Å; K948-I951 PolarHBondContact O-N 3.25Å; T949-I951 PolarHBondContact O-N 3.28Å; I951-M954 WeakPolarHBondContact O-CB 3.27Å; I951-M954 PolarHBondContact O-N 3.42Å; I951-V1106 HydrophobicContact CD1-CG2 3.66Å; I951-L1128 HydrophobicContact CG1-CB 4.45Å; I951-L1128 HydrophobicContact CG1-CD2 4.2Å
952	E	87.1	Confident	89	Confident	173 Å²	173	64.5 Å²	64.5	81%	0.808	30%	0.301	S	S	*	.	H	α-helix	trans	-70.3	-34.2	172.2	-69.8	-174.3	173.5	0	0	112.7	K948 T949 L950 M954	K948-E952 PolarHBondContact O-N 3.28Å; T949-E952 PolarHBondContact O-N 3.38Å; L950-E952 VanDerWaalsContact C-N 3.34Å; E952-M954 VanDerWaalsContact C-N 3.31Å
953	V	88.3	Confident	88.8	Confident	51 Å²	51	65.2 Å²	65.2	31%	0.309	30%	0.3	S	S	.	.	H	α-helix	trans	-73.7	-23.6	174.5	176.6	0	0	0	0	111.9	T949 L950 D980 I981	T949-V953 WeakPolarHBondContact O-CG2 3.33Å; T949-V953 PolarHBondContact O-N 3.23Å; T949-V953 VanDerWaalsContact O-N 3.11Å; L950-V953 PolarHBondContact O-N 3.05Å; V953-D980 HydrophobicContact CG1-CB 3.55Å; V953-I981 HydrophobicContact CB-CD1 4.25Å; V953-I981 HydrophobicContact CG1-CD1 3.87Å
954	M	88.3	Confident	88.4	Confident	7 Å²	7	72.3 Å²	72.3	3%	0.034	33%	0.333	C	S	.	.	S	Bend	trans	-65.5	141.7	-179.2	-162.6	66.9	-163.5	0	0	111.4	L950 I951 E952 K956 L978 I981 C1122 A1131 F1177	L950-M954 WeakPolarHBondContact O-CB 3.38Å; L950-M954 PolarHBondContact O-N 3.38Å; I951-M954 WeakPolarHBondContact O-CB 3.27Å; I951-M954 PolarHBondContact O-N 3.42Å; E952-M954 VanDerWaalsContact C-N 3.31Å; M954-K956 PolarHBondContact O-N 3.42Å; M954-L978 HydrophobicContact CE-CD2 3.45Å; M954-L978 VanDerWaalsContact CE-CD2 3.45Å; M954-L978 HydrophobicContact SD-CD2 4.24Å; M954-I981 HydrophobicContact SD-CD1 4.42Å; M954-I981 HydrophobicContact SD-CG1 4.1Å; M954-C1122 HydrophobicContact CE-CB 4.21Å; M954-C1122 HydrophobicContact CG-CB 3.61Å; M954-A1131 HydrophobicContact CE-CB 3.73Å; M954-A1131 HydrophobicContact SD-CB 3.72Å; M954-F1177 HydrophobicContact CE-CE2 3.68Å; M954-F1177 HydrophobicContact CE-CZ 3.93Å
955	P	88.3	Confident	88.1	Confident	23 Å²	23	79.1 Å²	79.1	15%	0.149	36%	0.358	C	S	.	.			trans	-57.5	126.9	173.5	23.4	-36.2	0	0	0	110.8	I957 C958 L978 C1122	P955-I957 PolarHBondContact O-N 3.3Å; P955-C958 HydrophobicContact CG-CB 4.19Å; P955-L978 HydrophobicContact CG-CD2 4.31Å; P955-C1122 VanDerWaalsContact O-CB 3.23Å; P955-C1122 WeakPolarHBondContact O-CB 3.34Å
956	K	84.3	Confident	88	Confident	179 Å²	179	73 Å²	73	78%	0.778	33%	0.331	S	S	*	.	S	Bend	trans	-52.6	-36.4	-177.6	-66.3	-173.6	177.2	-177.9	0	113.1	M954 C1122	M954-K956 PolarHBondContact O-N 3.42Å; K956-C1122 PolarHBondContact O-N 3.38Å
957	I	85.4	Confident	87.9	Confident	100 Å²	100	71 Å²	71	51%	0.513	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-138.9	124.1	179.8	-58.6	175.5	0	0	0	107.6	P955 R959 D1120	P955-I957 PolarHBondContact O-N 3.3Å; I957-R959 HydrophobicContact CG2-CG 4.39Å; I957-D1120 CarbonylContact C-O 3.26Å; I957-D1120 WeakPolarHBondContact CA-O 3.33Å; I957-D1120 HydrophobicContact CG2-CB 3.56Å
958	C	88.9	Confident	87.8	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.007	33%	0.326	C	S	.	.			trans	-130.1	100.4	174.8	-170	0	0	0	0	109.7	P955 D1120 C1122 F1177	P955-C958 HydrophobicContact CG-CB 4.19Å; C958-D1120 PolarHBondContact N-O 3.12Å; C958-C1122 VanDerWaalsContact CB-SG 3.53Å; C958-F1177 HydrophobicContact CB-CE1 3.95Å; C958-F1177 HydrophobicContact CB-CZ 4.01Å; C958-F1177 VanDerWaalsContact SG-CE1 3.56Å
959	R	87.4	Confident	87.6	Confident	162 Å²	162	68.7 Å²	68.7	61%	0.611	32%	0.323	S	S	*	.			trans	-74.9	145.7	178.7	-63.7	-162.7	165	153.7	4.8	110.9	I957 P961 F973 D1120	I957-R959 HydrophobicContact CG2-CG 4.39Å; R959-P961 VanDerWaalsContact O-CD 3.27Å; R959-P961 WeakPolarHBondContact O-CD 3.31Å; R959-F973 VanDerWaalsContact O-CE1 3.29Å; R959-F973 WeakPolarHBondContact O-CE1 3.35Å; R959-D1120 HydrophobicContact CG-CB 4.18Å; R959-D1120 WeakPolarHBondContact CG-OD2 3.31Å; R959-D1120 IonicContact CZ-OD2 3.85Å; R959-D1120 IonicContact NE-OD2 2.94Å; R959-D1120 PolarHBondContact NE-OD2 3.41Å; R959-D1120 IonicContact NH2-OD2 3.95Å
960	L	89.1	Confident	87.6	Confident	44 Å²	44	66 Å²	66	23%	0.23	31%	0.306	C	S	.	.			trans	-78.8	113.1	166.7	-62.4	-179.1	0	0	0	109.1	F974 F1175 F1177 H1180	L960-F974 HydrophobicContact CD2-CE1 4.31Å; L960-F974 HydrophobicContact CD2-CZ 3.9Å; L960-F1175 HydrophobicContact CD1-CD1 4.1Å; L960-F1177 HydrophobicContact CD2-CD1 3.97Å; L960-H1180 HydrophobicContact CD1-CB 4.36Å; L960-H1180 HydrophobicContact CD2-CB 3.97Å
961	P	90.5	Very high	87.7	Confident	17 Å²	17	66 Å²	66	11%	0.11	31%	0.306	C	S	.	.			trans	-64.8	148.8	-178.7	-16.4	29.9	0	0	0	110.8	R959 Y965 I970 F973 H1180	R959-P961 VanDerWaalsContact O-CD 3.27Å; R959-P961 WeakPolarHBondContact O-CD 3.31Å; P961-Y965 HydrophobicContact CB-CD2 4.07Å; P961-Y965 HydrophobicContact CB-CG 4.21Å; P961-I970 HydrophobicContact CB-CG1 4.03Å; P961-I970 HydrophobicContact CG-CG1 4.24Å; P961-F973 HydrophobicContact CG-CB 4.42Å; P961-F973 HydrophobicContact CG-CD1 3.5Å; P961-F973 VanDerWaalsContact CG-CD1 3.5Å; P961-F973 HydrophobicContact CG-CE1 3.81Å; P961-F973 HydrophobicContact CG-CG 3.91Å; P961-F973 HydrophobicContact CG-CZ 4.46Å; P961-H1180 PolarHBondContact O-CE1 2.77Å; P961-H1180 PolarHBondContact O-NE2 3.42Å
962	R	89.1	Confident	87.8	Confident	181 Å²	181	70.3 Å²	70.3	68%	0.683	33%	0.326	S	S	*	.			trans	-68.9	164.6	-179.7	-58.1	-175.8	174.7	-176.5	-0.9	111.7	E964 Y965	R962-E964 WeakPolarHBondContact CB-OE2 3.35Å; R962-E964 PolarHBondContact O-N 3.39Å; R962-Y965 HydrophobicContact CB-CD2 4.28Å; R962-Y965 HydrophobicContact CB-CE2 4.43Å; R962-Y965 WeakPolarHBondContact O-CD2 3.33Å; R962-Y965 PolarHBondContact O-N 3.14Å
963	H	87.1	Confident	88	Confident	72 Å²	72	65 Å²	65	33%	0.333	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-65.1	-22.5	-174.3	-67.8	-152.7	0	0	0	112.6	Y965 G966 H1180 Q1187	H963-Y965 PolarHBondContact O-N 3.48Å; H963-G966 PolarHBondContact O-N 3.23Å; H963-H1180 AromaticContact NE2-CE1 3.94Å; H963-Q1187 PolarHBondContact CE1-OE1 3.39Å; H963-Q1187 PolarHBondContact ND1-OE1 3.09Å
964	E	84.3	Confident	88.1	Confident	151 Å²	151	62.6 Å²	62.6	71%	0.706	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-67.4	-20.2	179.7	-55.6	86.8	174.6	0	0	113.5	R962 G966	R962-E964 WeakPolarHBondContact CB-OE2 3.35Å; R962-E964 PolarHBondContact O-N 3.39Å; E964-G966 PolarHBondContact O-N 3.3Å
965	Y	84.7	Confident	88.1	Confident	164 Å²	164	63.5 Å²	63.5	64%	0.643	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-70.6	-17.2	176.1	-72.8	-93.6	0	0	0	113	P961 R962 H963	P961-Y965 HydrophobicContact CB-CD2 4.07Å; P961-Y965 HydrophobicContact CB-CG 4.21Å; R962-Y965 HydrophobicContact CB-CD2 4.28Å; R962-Y965 HydrophobicContact CB-CE2 4.43Å; R962-Y965 WeakPolarHBondContact O-CD2 3.33Å; R962-Y965 PolarHBondContact O-N 3.14Å; H963-Y965 PolarHBondContact O-N 3.48Å
966	G	88.5	Confident	88.1	Confident	6 Å²	6	68.4 Å²	68.4	6%	0.062	31%	0.31	C	S	.	.	H	α-helix	trans	71.9	152.3	-176.8	0	0	0	0	0	113.7	H963 E964 P968 G969 I970	H963-G966 PolarHBondContact O-N 3.23Å; E964-G966 PolarHBondContact O-N 3.3Å; G966-P968 VanDerWaalsContact C-CD 3.45Å; G966-G969 PolarHBondContact O-N 3.17Å; G966-I970 VanDerWaalsContact O-CG1 3.3Å; G966-I970 WeakPolarHBondContact O-CG1 3.35Å; G966-I970 PolarHBondContact O-N 3.12Å
967	S	87.9	Confident	88.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.4	-33.7	-178.4	55.6	0	0	0	0	114.9	L971 L1181 D1188 L1199	S967-L971 WeakPolarHBondContact O-CB 3.31Å; S967-L971 PolarHBondContact O-N 3.08Å; S967-L1181 WeakPolarHBondContact O-CD1 3.42Å; S967-D1188 WeakPolarHBondContact CB-OD2 3.34Å; S967-D1188 PolarHBondContact N-OD2 2.91Å; S967-D1188 PolarHBondContact OG-OD1 2.72Å; S967-D1188 PolarHBondContact OG-OD2 3.41Å; S967-L1199 WeakPolarHBondContact OG-CD2 3.27Å
968	P	88.2	Confident	88.5	Confident	8 Å²	8	58 Å²	58	5%	0.052	26%	0.262	C	S	.	.	H	α-helix	trans	-65.9	-43	173.3	-20.2	33.1	0	0	0	113	G966 I970 L971 E972 K1190 E1192 I1194 L1199	G966-P968 VanDerWaalsContact C-CD 3.45Å; P968-I970 PolarHBondContact O-N 3.49Å; P968-L971 PolarHBondContact O-N 3.49Å; P968-E972 PolarHBondContact O-N 3.02Å; P968-K1190 HydrophobicContact CG-CB 4.06Å; P968-K1190 HydrophobicContact CG-CD 3.84Å; P968-E1192 HydrophobicContact CB-CB 4.29Å; P968-E1192 VanDerWaalsContact CB-OE2 3.24Å; P968-E1192 WeakPolarHBondContact CB-OE2 3.41Å; P968-E1192 HydrophobicContact CG-CB 4.22Å; P968-E1192 VanDerWaalsContact CG-CD 3.45Å; P968-E1192 HydrophobicContact CG-CG 4.08Å; P968-E1192 WeakPolarHBondContact CG-OE2 3.28Å; P968-I1194 HydrophobicContact CB-CD1 3.96Å; P968-I1194 HydrophobicContact CB-CG1 4.05Å; P968-L1199 HydrophobicContact CB-CD2 4.48Å; P968-L1199 HydrophobicContact CG-CD2 3.94Å
969	G	86.9	Confident	88.4	Confident	30 Å²	30	62.1 Å²	62.1	31%	0.309	28%	0.28	S	S	.	.	H	α-helix	trans	-68.5	-33.5	178.1	0	0	0	0	0	112.9	G966 F973	G966-G969 PolarHBondContact O-N 3.17Å; G969-F973 WeakPolarHBondContact O-CB 3.48Å; G969-F973 PolarHBondContact O-N 3.06Å
970	I	89.8	Confident	88.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.4	-41	173.4	-66.7	172.9	0	0	0	111.2	P961 G966 P968 F973 F974 L1181 V1184	P961-I970 HydrophobicContact CB-CG1 4.03Å; P961-I970 HydrophobicContact CG-CG1 4.24Å; G966-I970 VanDerWaalsContact O-CG1 3.3Å; G966-I970 WeakPolarHBondContact O-CG1 3.35Å; G966-I970 PolarHBondContact O-N 3.12Å; P968-I970 PolarHBondContact O-N 3.49Å; I970-F973 PolarHBondContact O-N 2.59Å; I970-F974 HydrophobicContact CG2-CD2 3.69Å; I970-F974 HydrophobicContact CG2-CE2 3.25Å; I970-F974 HydrophobicContact CG2-CZ 3.98Å; I970-F974 WeakPolarHBondContact O-CD2 3.47Å; I970-F974 PolarHBondContact O-N 3.33Å; I970-L1181 HydrophobicContact CB-CD1 4.19Å; I970-L1181 HydrophobicContact CG2-CD1 3.94Å; I970-V1184 HydrophobicContact CD1-CB 3.89Å; I970-V1184 HydrophobicContact CD1-CG1 3.76Å; I970-V1184 HydrophobicContact CD1-CG2 3.67Å
971	L	89.7	Confident	88.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-44.9	175	176.6	59	0	0	0	111	S967 P968 F973 F974 H975 F1134 L1181 I1194 V1197 L1199	S967-L971 WeakPolarHBondContact O-CB 3.31Å; S967-L971 PolarHBondContact O-N 3.08Å; P968-L971 PolarHBondContact O-N 3.49Å; L971-F973 VanDerWaalsContact C-N 3.34Å; L971-F973 PolarHBondContact O-N 3.39Å; L971-F974 PolarHBondContact O-N 2.93Å; L971-H975 VanDerWaalsContact O-CB 3.3Å; L971-H975 WeakPolarHBondContact O-CB 3.3Å; L971-H975 PolarHBondContact O-N 2.89Å; L971-F1134 HydrophobicContact CD1-CE2 3.9Å; L971-F1134 HydrophobicContact CD1-CZ 3.77Å; L971-L1181 HydrophobicContact CB-CD1 4.09Å; L971-L1181 HydrophobicContact CB-CD2 4.32Å; L971-L1181 HydrophobicContact CD1-CD2 3.89Å; L971-I1194 HydrophobicContact CD2-CB 3.84Å; L971-I1194 HydrophobicContact CD2-CG1 4.21Å; L971-I1194 HydrophobicContact CG-CB 4.21Å; L971-I1194 HydrophobicContact CG-CG2 4.35Å; L971-V1197 HydrophobicContact CD2-CB 4.33Å; L971-V1197 HydrophobicContact CD2-CG1 4.1Å; L971-L1199 HydrophobicContact CB-CD1 4.17Å; L971-L1199 HydrophobicContact CD2-CB 4.26Å; L971-L1199 HydrophobicContact CD2-CD1 3.72Å
972	E	90.4	Very high	88.2	Confident	107 Å²	107	58.3 Å²	58.3	50%	0.5	27%	0.271	S	S	.	.	H	α-helix	trans	-61.2	-42.7	176	-169.6	174	-168.5	0	0	112.1	P968 H975 H976 I1194	P968-E972 PolarHBondContact O-N 3.02Å; E972-H975 PolarHBondContact O-N 3.34Å; E972-H976 PolarHBondContact O-N 3.42Å; E972-I1194 HydrophobicContact CB-CG2 3.8Å; E972-I1194 HydrophobicContact CG-CG2 4.31Å
973	F	91	Very high	88.2	Confident	63 Å²	63	55.8 Å²	55.8	28%	0.276	27%	0.266	S	S	.	.	H	α-helix	trans	-58.7	-51.6	176.3	175.5	-96.5	0	0	0	111.9	R959 P961 G969 I970 L971 H975 H976 Q977	R959-F973 VanDerWaalsContact O-CE1 3.29Å; R959-F973 WeakPolarHBondContact O-CE1 3.35Å; P961-F973 HydrophobicContact CG-CB 4.42Å; P961-F973 HydrophobicContact CG-CD1 3.5Å; P961-F973 VanDerWaalsContact CG-CD1 3.5Å; P961-F973 HydrophobicContact CG-CE1 3.81Å; P961-F973 HydrophobicContact CG-CG 3.91Å; P961-F973 HydrophobicContact CG-CZ 4.46Å; G969-F973 WeakPolarHBondContact O-CB 3.48Å; G969-F973 PolarHBondContact O-N 3.06Å; I970-F973 PolarHBondContact O-N 2.59Å; L971-F973 VanDerWaalsContact C-N 3.34Å; L971-F973 PolarHBondContact O-N 3.39Å; F973-H975 VanDerWaalsContact C-N 3.31Å; F973-H975 PolarHBondContact O-N 3.18Å; F973-H976 PolarHBondContact O-N 3.3Å; F973-Q977 HydrophobicContact CD1-CG 4.23Å; F973-Q977 HydrophobicContact CD2-CG 4.27Å; F973-Q977 HydrophobicContact CE1-CG 3.83Å; F973-Q977 HydrophobicContact CE2-CG 3.87Å; F973-Q977 HydrophobicContact CG-CG 4.44Å; F973-Q977 HydrophobicContact CZ-CG 3.64Å; F973-Q977 WeakPolarHBondContact O-CG 3.2Å; F973-Q977 PolarHBondContact O-N 2.97Å
974	F	90.8	Very high	88.3	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.9	-36.5	178.2	-68	-42	0	0	0	112.2	L960 I970 L971 H976 Q977 L978 F1134 F1177 L1181	L960-F974 HydrophobicContact CD2-CE1 4.31Å; L960-F974 HydrophobicContact CD2-CZ 3.9Å; I970-F974 HydrophobicContact CG2-CD2 3.69Å; I970-F974 HydrophobicContact CG2-CE2 3.25Å; I970-F974 HydrophobicContact CG2-CZ 3.98Å; I970-F974 WeakPolarHBondContact O-CD2 3.47Å; I970-F974 PolarHBondContact O-N 3.33Å; L971-F974 PolarHBondContact O-N 2.93Å; F974-H976 PolarHBondContact O-N 2.74Å; F974-Q977 PolarHBondContact O-N 3.45Å; F974-L978 HydrophobicContact CB-CD1 4.44Å; F974-L978 VanDerWaalsContact O-CB 3.27Å; F974-L978 WeakPolarHBondContact O-CB 3.32Å; F974-L978 WeakPolarHBondContact O-CG 3.41Å; F974-L978 PolarHBondContact O-N 3.36Å; F974-F1134 HydrophobicContact CB-CD2 4.3Å; F974-F1134 HydrophobicContact CB-CE2 3.74Å; F974-F1134 HydrophobicContact CB-CZ 3.93Å; F974-F1177 HydrophobicContact CD1-CB 4.17Å; F974-F1177 HydrophobicContact CD1-CD1 4.08Å; F974-F1177 HydrophobicContact CD1-CG 4.23Å; F974-F1177 HydrophobicContact CD2-CB 4.27Å; F974-F1177 HydrophobicContact CE1-CB 4.02Å; F974-F1177 AromaticContact CE1-CD1 3.55Å; F974-F1177 HydrophobicContact CE1-CD1 3.55Å; F974-F1177 HydrophobicContact CE1-CE1 4.35Å; F974-F1177 HydrophobicContact CE1-CG 4.05Å; F974-F1177 HydrophobicContact CE2-CB 4.08Å; F974-F1177 VanDerWaalsContact CE2-O 3.3Å; F974-F1177 WeakPolarHBondContact CE2-O 3.33Å; F974-F1177 HydrophobicContact CG-CB 4.31Å; F974-F1177 HydrophobicContact CZ-CB 3.97Å; F974-F1177 HydrophobicContact CZ-CD1 4.04Å; F974-F1177 HydrophobicContact CZ-CG 4.43Å; F974-L1181 HydrophobicContact CE2-CB 4.38Å
975	H	88	Confident	88.2	Confident	26 Å²	26	52.1 Å²	52.1	12%	0.12	26%	0.263	C	S	.	.	H	α-helix	trans	-67.5	-25.6	177	-154.8	-38.8	0	0	0	112.9	L971 E972 F973 F1134 K1195	L971-H975 VanDerWaalsContact O-CB 3.3Å; L971-H975 WeakPolarHBondContact O-CB 3.3Å; L971-H975 PolarHBondContact O-N 2.89Å; E972-H975 PolarHBondContact O-N 3.34Å; F973-H975 VanDerWaalsContact C-N 3.31Å; F973-H975 PolarHBondContact O-N 3.18Å; H975-F1134 HydrophobicContact CB-CZ 4.43Å; H975-K1195 HydrophobicContact CB-CD 4.07Å
976	H	88.4	Confident	88.4	Confident	125 Å²	125	48.3 Å²	48.3	58%	0.579	25%	0.251	S	S	*	.	H	α-helix	trans	-80.9	-46.6	172	-173.5	78.2	0	0	0	111.8	E972 F973 F974 L978 K979	E972-H976 PolarHBondContact O-N 3.42Å; F973-H976 PolarHBondContact O-N 3.3Å; F974-H976 PolarHBondContact O-N 2.74Å; H976-L978 VanDerWaalsContact C-N 3.32Å; H976-L978 PolarHBondContact O-N 3.4Å; H976-K979 WeakPolarHBondContact O-CB 3.18Å; H976-K979 PolarHBondContact O-N 3.16Å
977	Q	87.4	Confident	88.2	Confident	60 Å²	60	48.1 Å²	48.1	28%	0.28	25%	0.249	S	C	.	.	H	α-helix	trans	-67.2	-29.9	-178.2	-68.7	-64.3	-22.6	0	0	113.6	F973 F974	F973-Q977 HydrophobicContact CD1-CG 4.23Å; F973-Q977 HydrophobicContact CD2-CG 4.27Å; F973-Q977 HydrophobicContact CE1-CG 3.83Å; F973-Q977 HydrophobicContact CE2-CG 3.87Å; F973-Q977 HydrophobicContact CG-CG 4.44Å; F973-Q977 HydrophobicContact CZ-CG 3.64Å; F973-Q977 WeakPolarHBondContact O-CG 3.2Å; F973-Q977 PolarHBondContact O-N 2.97Å; F974-Q977 PolarHBondContact O-N 3.45Å
978	L	89.9	Confident	88	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	12.5	-177.1	-54.5	178.2	0	0	0	113	M954 P955 F974 H976 D980 I981 I982 A1131 F1134 F1177	M954-L978 HydrophobicContact CE-CD2 3.45Å; M954-L978 VanDerWaalsContact CE-CD2 3.45Å; M954-L978 HydrophobicContact SD-CD2 4.24Å; P955-L978 HydrophobicContact CG-CD2 4.31Å; F974-L978 HydrophobicContact CB-CD1 4.44Å; F974-L978 VanDerWaalsContact O-CB 3.27Å; F974-L978 WeakPolarHBondContact O-CB 3.32Å; F974-L978 WeakPolarHBondContact O-CG 3.41Å; F974-L978 PolarHBondContact O-N 3.36Å; H976-L978 VanDerWaalsContact C-N 3.32Å; H976-L978 PolarHBondContact O-N 3.4Å; L978-D980 VanDerWaalsContact C-N 3.3Å; L978-D980 PolarHBondContact O-N 3.42Å; L978-I981 PolarHBondContact O-N 2.89Å; L978-I981 VanDerWaalsContact O-N 3.09Å; L978-I982 HydrophobicContact CB-CD1 4.3Å; L978-I982 VanDerWaalsContact O-CG1 3.31Å; L978-I982 WeakPolarHBondContact O-CG1 3.41Å; L978-I982 PolarHBondContact O-N 3.38Å; L978-A1131 HydrophobicContact CD1-CB 4.44Å; L978-A1131 HydrophobicContact CD2-CB 4.01Å; L978-F1134 HydrophobicContact CD1-CB 3.8Å; L978-F1134 HydrophobicContact CD1-CD1 3.85Å; L978-F1134 HydrophobicContact CD1-CD2 4.4Å; L978-F1134 HydrophobicContact CD1-CG 3.76Å; L978-F1177 HydrophobicContact CD1-CD2 3.86Å; L978-F1177 HydrophobicContact CD1-CE2 4.28Å; L978-F1177 HydrophobicContact CD2-CD2 4.45Å; L978-F1177 HydrophobicContact CD2-CE2 4.04Å
979	K	87.9	Confident	87.8	Confident	89 Å²	89	55.7 Å²	55.7	39%	0.387	29%	0.286	S	S	.	.	H	α-helix	trans	-53.7	-46.4	-174.1	-172.8	-171.3	172.2	-162.5	0	112.3	H976 I981 I982 E983	H976-K979 WeakPolarHBondContact O-CB 3.18Å; H976-K979 PolarHBondContact O-N 3.16Å; K979-I981 PolarHBondContact O-N 3.03Å; K979-I982 PolarHBondContact O-N 3.42Å; K979-I982 VanDerWaalsContact O-N 3.11Å; K979-E983 WeakPolarHBondContact CE-OE1 3.33Å; K979-E983 VanDerWaalsContact CE-OE2 3.24Å; K979-E983 WeakPolarHBondContact CE-OE2 3.19Å; K979-E983 HydrophobicContact CG-CG 4.5Å; K979-E983 IonicContact NZ-OE1 3.55Å; K979-E983 IonicContact NZ-OE2 3.83Å; K979-E983 PolarHBondContact O-N 3.22Å
980	D	88	Confident	87.7	Confident	99 Å²	99	57.1 Å²	57.1	53%	0.529	29%	0.286	S	S	.	.	H	α-helix	trans	-69.3	-23.6	-175.8	-57	-29.3	0	0	0	112.7	V953 L978	V953-D980 HydrophobicContact CG1-CB 3.55Å; L978-D980 VanDerWaalsContact C-N 3.3Å; L978-D980 PolarHBondContact O-N 3.42Å
981	I	88.2	Confident	87.6	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-80.2	-38.7	171.7	-56.6	-63.6	0	0	0	110.7	L950 V953 M954 L978 K979 E983 Y984 L987 A1131 V1135	L950-I981 HydrophobicContact CB-CD1 4.45Å; L950-I981 HydrophobicContact CD2-CD1 3.95Å; V953-I981 HydrophobicContact CB-CD1 4.25Å; V953-I981 HydrophobicContact CG1-CD1 3.87Å; M954-I981 HydrophobicContact SD-CD1 4.42Å; M954-I981 HydrophobicContact SD-CG1 4.1Å; L978-I981 PolarHBondContact O-N 2.89Å; L978-I981 VanDerWaalsContact O-N 3.09Å; K979-I981 PolarHBondContact O-N 3.03Å; I981-E983 VanDerWaalsContact C-N 3.35Å; I981-Y984 WeakPolarHBondContact O-CB 3.29Å; I981-Y984 PolarHBondContact O-N 2.96Å; I981-L987 HydrophobicContact CG2-CD2 4.29Å; I981-L987 WeakPolarHBondContact O-CD2 3.22Å; I981-A1131 HydrophobicContact CG1-CB 4.45Å; I981-A1131 HydrophobicContact CG2-CB 4.12Å; I981-V1135 HydrophobicContact CG2-CG2 4.23Å
982	I	86.3	Confident	87.7	Confident	42 Å²	42	57.4 Å²	57.4	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-64.9	-40	178.2	-64.1	161.3	0	0	0	111.1	L978 K979 Y984 F1134 V1135 I1138	L978-I982 HydrophobicContact CB-CD1 4.3Å; L978-I982 VanDerWaalsContact O-CG1 3.31Å; L978-I982 WeakPolarHBondContact O-CG1 3.41Å; L978-I982 PolarHBondContact O-N 3.38Å; K979-I982 PolarHBondContact O-N 3.42Å; K979-I982 VanDerWaalsContact O-N 3.11Å; I982-Y984 VanDerWaalsContact C-N 3.32Å; I982-F1134 HydrophobicContact CD1-CD1 4.07Å; I982-F1134 HydrophobicContact CD1-CE1 3.77Å; I982-F1134 HydrophobicContact CG1-CD1 4.39Å; I982-V1135 HydrophobicContact CB-CG2 4.47Å; I982-V1135 HydrophobicContact CG1-CG2 3.91Å; I982-I1138 HydrophobicContact CG1-CD1 4.46Å; I982-I1138 HydrophobicContact CG2-CD1 4.37Å
983	E	87.9	Confident	87.7	Confident	128 Å²	128	52.8 Å²	52.8	60%	0.598	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	1.6	-177.8	-67.6	177.4	-177.2	0	0	113.3	K979 I981 A985	K979-E983 WeakPolarHBondContact CE-OE1 3.33Å; K979-E983 VanDerWaalsContact CE-OE2 3.24Å; K979-E983 WeakPolarHBondContact CE-OE2 3.19Å; K979-E983 HydrophobicContact CG-CG 4.5Å; K979-E983 IonicContact NZ-OE1 3.55Å; K979-E983 IonicContact NZ-OE2 3.83Å; K979-E983 PolarHBondContact O-N 3.22Å; I981-E983 VanDerWaalsContact C-N 3.35Å; E983-A985 PolarHBondContact O-N 3.41Å; E983-A985 VanDerWaalsContact O-N 3.17Å
984	Y	90.1	Very high	87.7	Confident	57 Å²	57	50.4 Å²	50.4	22%	0.224	26%	0.257	C	S	.	.			trans	-69.8	111.3	-179.8	-167.4	-104.5	0	0	0	111.5	Y946 L950 I981 I982 E986 L987	Y946-Y984 HydrophobicContact CD1-CE1 4.21Å; Y946-Y984 HydrophobicContact CE1-CE1 4.24Å; Y946-Y984 WeakPolarHBondContact CE1-OH 3.24Å; L950-Y984 HydrophobicContact CD2-CD1 3.9Å; L950-Y984 HydrophobicContact CD2-CD2 4.15Å; L950-Y984 HydrophobicContact CD2-CE1 4.04Å; L950-Y984 HydrophobicContact CD2-CE2 4.3Å; L950-Y984 HydrophobicContact CD2-CG 3.96Å; I981-Y984 WeakPolarHBondContact O-CB 3.29Å; I981-Y984 PolarHBondContact O-N 2.96Å; I982-Y984 VanDerWaalsContact C-N 3.32Å; Y984-E986 HydrophobicContact CD1-CB 4.37Å; Y984-E986 HydrophobicContact CE1-CB 3.77Å; Y984-E986 PolarHBondContact O-N 2.82Å; Y984-L987 HydrophobicContact CD1-CB 3.92Å; Y984-L987 VanDerWaalsContact O-CB 3.31Å; Y984-L987 WeakPolarHBondContact O-CB 3.47Å; Y984-L987 PolarHBondContact O-N 2.98Å
985	A	82.9	Confident	87.8	Confident	90 Å²	90	50.5 Å²	50.5	74%	0.744	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-40.9	-170.7	0	0	0	0	0	113.7	E983 L987	E983-A985 PolarHBondContact O-N 3.41Å; E983-A985 VanDerWaalsContact O-N 3.17Å; A985-L987 VanDerWaalsContact C-N 3.28Å; A985-L987 PolarHBondContact O-N 2.98Å
986	E	87.6	Confident	88.1	Confident	84 Å²	84	49.2 Å²	49.2	39%	0.393	25%	0.252	S	S	.	.	H	α-helix	trans	-85.8	4.1	-174.9	-65.3	175.7	-165.4	0	0	113.4	Y946 Y984 K988 T989 D990 V991	Y946-E986 HydrophobicContact CE1-CB 4.27Å; Y946-E986 VanDerWaalsContact CE1-OE2 3.26Å; Y946-E986 WeakPolarHBondContact CE1-OE2 3.47Å; Y946-E986 PolarHBondContact OH-OE2 3.36Å; Y984-E986 HydrophobicContact CD1-CB 4.37Å; Y984-E986 HydrophobicContact CE1-CB 3.77Å; Y984-E986 PolarHBondContact O-N 2.82Å; E986-K988 VanDerWaalsContact C-N 3.33Å; E986-K988 PolarHBondContact O-N 3.41Å; E986-T989 WeakPolarHBondContact CA-OG1 3.43Å; E986-D990 HydrophobicContact CB-CB 4.43Å; E986-D990 PolarHBondContact O-N 3.03Å; E986-D990 VanDerWaalsContact O-N 3.09Å; E986-V991 PolarHBondContact O-N 3.15Å
987	L	86	Confident	88.3	Confident	2 Å²	2	45 Å²	45	1%	0.01	23%	0.232	C	C	.	.	I	π-helix	trans	-63.3	-40.7	-175.8	-170.8	63.2	0	0	0	111.8	L950 I981 Y984 A985 V991 F992 M1132 V1135	L950-L987 HydrophobicContact CD1-CD1 4.11Å; I981-L987 HydrophobicContact CG2-CD2 4.29Å; I981-L987 WeakPolarHBondContact O-CD2 3.22Å; Y984-L987 HydrophobicContact CD1-CB 3.92Å; Y984-L987 VanDerWaalsContact O-CB 3.31Å; Y984-L987 WeakPolarHBondContact O-CB 3.47Å; Y984-L987 PolarHBondContact O-N 2.98Å; A985-L987 VanDerWaalsContact C-N 3.28Å; A985-L987 PolarHBondContact O-N 2.98Å; L987-V991 HydrophobicContact CD1-CB 4.23Å; L987-V991 HydrophobicContact CD1-CG1 4.36Å; L987-V991 HydrophobicContact CD1-CG2 4.45Å; L987-V991 WeakPolarHBondContact O-CB 3.28Å; L987-F992 HydrophobicContact CD1-CE1 4.12Å; L987-F992 HydrophobicContact CD2-CE1 4.49Å; L987-F992 HydrophobicContact CD2-CZ 4.09Å; L987-F992 HydrophobicContact CG-CE1 3.98Å; L987-F992 HydrophobicContact CG-CE2 4.47Å; L987-F992 HydrophobicContact CG-CZ 3.94Å; L987-F992 WeakPolarHBondContact O-CD1 3.22Å; L987-F992 VanDerWaalsContact O-CG 3.31Å; L987-F992 WeakPolarHBondContact O-CG 3.32Å; L987-F992 PolarHBondContact O-N 3.4Å; L987-M1132 HydrophobicContact CD1-CE 4.08Å; L987-M1132 HydrophobicContact CD1-CG 4.32Å; L987-V1135 HydrophobicContact CD2-CB 4.21Å; L987-V1135 HydrophobicContact CD2-CG1 3.96Å; L987-V1135 HydrophobicContact CD2-CG2 3.96Å
988	K	82.1	Confident	88.7	Confident	108 Å²	108	42.2 Å²	42.2	47%	0.47	22%	0.22	S	C	.	.	I	π-helix	trans	-85.5	-44.2	-179.7	-65.5	-178.8	-178.6	176.4	0	111.8	E986 F992 F1151	E986-K988 VanDerWaalsContact C-N 3.33Å; E986-K988 PolarHBondContact O-N 3.41Å; K988-F992 HydrophobicContact CB-CD2 4.38Å; K988-F992 HydrophobicContact CG-CD2 3.94Å; K988-F992 HydrophobicContact CG-CE2 4.11Å; K988-F1151 HydrophobicContact CB-CZ 4.45Å; K988-F1151 WeakPolarHBondContact O-CZ 3.44Å
989	T	84.4	Confident	88.9	Confident	59 Å²	59	42.2 Å²	42.2	36%	0.362	22%	0.22	S	C	.	.	I	π-helix	trans	-71.2	-36.8	-172.7	50.7	0	0	0	0	113.4	F869 E986 Q993	F869-T989 HydrophobicContact CD1-CG2 4.11Å; F869-T989 HydrophobicContact CE1-CG2 4.28Å; E986-T989 WeakPolarHBondContact CA-OG1 3.43Å; T989-Q993 WeakPolarHBondContact O-CB 3.46Å
990	D	84.5	Confident	89.3	Confident	60 Å²	60	38 Å²	38	32%	0.321	20%	0.201	S	C	.	.	I	π-helix	trans	-116.8	-46.4	-171.7	-60.9	-67.1	0	0	0	111.7	Y946 E986 S994	Y946-D990 HydrophobicContact CE2-CB 3.91Å; E986-D990 HydrophobicContact CB-CB 4.43Å; E986-D990 PolarHBondContact O-N 3.03Å; E986-D990 VanDerWaalsContact O-N 3.09Å; D990-S994 WeakPolarHBondContact O-CB 3.26Å; D990-S994 PolarHBondContact O-N 3.47Å; D990-S994 PolarHBondContact O-OG 3.21Å
991	V	88.1	Confident	89.7	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.024	18%	0.177	C	C	.	.	I	π-helix	trans	-73.7	-53.8	-176.2	-174.3	0	0	0	0	111.7	Y946 L950 E986 L987 Q993 S994 L995 M1132	Y946-V991 HydrophobicContact CD1-CG2 3.76Å; Y946-V991 HydrophobicContact CD2-CG2 4.13Å; Y946-V991 HydrophobicContact CE1-CG2 4.35Å; Y946-V991 HydrophobicContact CG-CG2 3.64Å; L950-V991 HydrophobicContact CD1-CG1 4.47Å; L950-V991 HydrophobicContact CD1-CG2 4.28Å; E986-V991 PolarHBondContact O-N 3.15Å; L987-V991 HydrophobicContact CD1-CB 4.23Å; L987-V991 HydrophobicContact CD1-CG1 4.36Å; L987-V991 HydrophobicContact CD1-CG2 4.45Å; L987-V991 WeakPolarHBondContact O-CB 3.28Å; V991-Q993 VanDerWaalsContact C-N 3.32Å; V991-Q993 PolarHBondContact O-N 3.39Å; V991-S994 PolarHBondContact O-N 2.9Å; V991-L995 HydrophobicContact CG1-CD1 4.06Å; V991-L995 WeakPolarHBondContact O-CB 2.98Å; V991-L995 WeakPolarHBondContact O-CG 3.45Å; V991-L995 PolarHBondContact O-N 3.24Å; V991-M1132 HydrophobicContact CG1-CE 3.63Å; V991-M1132 HydrophobicContact CG1-SD 4.47Å
992	F	91.4	Very high	90	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.009	18%	0.177	C	C	.	.	I	π-helix	trans	-66.7	-35	177.6	-68.3	-7.1	0	0	0	112.4	L987 K988 R996 M1132 Y1136 F1151 L1155	L987-F992 HydrophobicContact CD1-CE1 4.12Å; L987-F992 HydrophobicContact CD2-CE1 4.49Å; L987-F992 HydrophobicContact CD2-CZ 4.09Å; L987-F992 HydrophobicContact CG-CE1 3.98Å; L987-F992 HydrophobicContact CG-CE2 4.47Å; L987-F992 HydrophobicContact CG-CZ 3.94Å; L987-F992 WeakPolarHBondContact O-CD1 3.22Å; L987-F992 VanDerWaalsContact O-CG 3.31Å; L987-F992 WeakPolarHBondContact O-CG 3.32Å; L987-F992 PolarHBondContact O-N 3.4Å; K988-F992 HydrophobicContact CB-CD2 4.38Å; K988-F992 HydrophobicContact CG-CD2 3.94Å; K988-F992 HydrophobicContact CG-CE2 4.11Å; F992-R996 WeakPolarHBondContact O-CB 3.26Å; F992-R996 PolarHBondContact O-N 3.19Å; F992-M1132 HydrophobicContact CE1-CB 4.01Å; F992-M1132 HydrophobicContact CE1-CG 4.1Å; F992-M1132 HydrophobicContact CE1-SD 4.22Å; F992-M1132 HydrophobicContact CZ-CB 4.35Å; F992-Y1136 HydrophobicContact CZ-CD1 4.23Å; F992-F1151 HydrophobicContact CB-CD1 4.19Å; F992-F1151 HydrophobicContact CB-CD2 4.17Å; F992-F1151 HydrophobicContact CB-CE1 3.94Å; F992-F1151 HydrophobicContact CB-CE2 3.91Å; F992-F1151 HydrophobicContact CB-CG 4.33Å; F992-F1151 HydrophobicContact CB-CZ 3.81Å; F992-F1151 HydrophobicContact CD2-CD2 4.4Å; F992-F1151 HydrophobicContact CD2-CE2 4.03Å; F992-L1155 HydrophobicContact CB-CD1 4.05Å; F992-L1155 HydrophobicContact CB-CD2 4.23Å; F992-L1155 HydrophobicContact CD1-CD1 3.93Å; F992-L1155 HydrophobicContact CD1-CD2 4.28Å; F992-L1155 HydrophobicContact CD2-CD2 4.13Å; F992-L1155 HydrophobicContact CG-CD1 4.12Å; F992-L1155 HydrophobicContact CG-CD2 3.97Å
993	Q	90.8	Very high	90.4	Very high	9 Å²	9	31.5 Å²	31.5	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-58.5	-54.7	172.5	177.1	70.8	16.4	0	0	111.7	P851 T870 T989 V991 L995 R996 E997 F1151	P851-Q993 PolarHBondContact O-NE2 3.2Å; T870-Q993 PolarHBondContact OG1-NE2 2.55Å; T870-Q993 VanDerWaalsContact OG1-NE2 3.13Å; T989-Q993 WeakPolarHBondContact O-CB 3.46Å; V991-Q993 VanDerWaalsContact C-N 3.32Å; V991-Q993 PolarHBondContact O-N 3.39Å; Q993-L995 VanDerWaalsContact C-N 3.32Å; Q993-L995 PolarHBondContact O-N 3.02Å; Q993-R996 WeakPolarHBondContact O-CB 3.46Å; Q993-R996 PolarHBondContact O-N 3.29Å; Q993-R996 VanDerWaalsContact O-N 3.15Å; Q993-R996 PolarHBondContact O-NH2 3.32Å; Q993-R996 VanDerWaalsContact OE1-CZ 3.32Å; Q993-R996 VanDerWaalsContact OE1-NH2 3.14Å; Q993-E997 PolarHBondContact NE2-OE1 2.9Å; Q993-E997 PolarHBondContact O-N 3.12Å; Q993-F1151 HydrophobicContact CB-CE1 4.37Å
994	S	91.4	Very high	90.8	Very high	13 Å²	13	25.6 Å²	25.6	9%	0.091	14%	0.14	C	C	.	.	H	α-helix	trans	-62.8	-39	-179.5	-60.3	0	0	0	0	111.9	D990 V991 E997 V998	D990-S994 WeakPolarHBondContact O-CB 3.26Å; D990-S994 PolarHBondContact O-N 3.47Å; D990-S994 PolarHBondContact O-OG 3.21Å; V991-S994 PolarHBondContact O-N 2.9Å; S994-E997 PolarHBondContact O-N 3.44Å; S994-V998 WeakPolarHBondContact O-CG2 3.41Å; S994-V998 PolarHBondContact O-N 2.68Å
995	L	93.1	Very high	91	Very high	2 Å²	2	23 Å²	23	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-67.1	-39.2	175.5	-74	168.9	0	0	0	111.7	I943 V991 Q993 E997 V998 G999 W1129 M1132 L1155 A1158 I1162	I943-L995 HydrophobicContact CD1-CD2 4.18Å; I943-L995 HydrophobicContact CG2-CD2 4.25Å; V991-L995 HydrophobicContact CG1-CD1 4.06Å; V991-L995 WeakPolarHBondContact O-CB 2.98Å; V991-L995 WeakPolarHBondContact O-CG 3.45Å; V991-L995 PolarHBondContact O-N 3.24Å; Q993-L995 VanDerWaalsContact C-N 3.32Å; Q993-L995 PolarHBondContact O-N 3.02Å; L995-E997 VanDerWaalsContact C-N 3.34Å; L995-E997 PolarHBondContact O-N 2.9Å; L995-V998 PolarHBondContact O-N 3.14Å; L995-G999 PolarHBondContact O-N 3.33Å; L995-W1129 HydrophobicContact CD1-CZ3 3.97Å; L995-M1132 HydrophobicContact CD1-SD 4.38Å; L995-L1155 HydrophobicContact CB-CD1 3.67Å; L995-L1155 HydrophobicContact CD1-CD1 4.11Å; L995-A1158 HydrophobicContact CB-CB 4.22Å; L995-A1158 HydrophobicContact CD2-CB 4.14Å; L995-A1158 WeakPolarHBondContact O-CB 3.44Å; L995-I1162 HydrophobicContact CD2-CD1 4.01Å
996	R	93.3	Very high	91.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61	-43.9	174.5	-173.4	-160.8	69.1	-107.1	-37.4	111.2	L850 P851 Y853 F992 Q993 V998 G999 N1000 F1151	L850-R996 PolarHBondContact O-NE 3.33Å; L850-R996 PolarHBondContact O-NH2 3.16Å; P851-R996 VanDerWaalsContact C-NH2 3.3Å; P851-R996 PolarHBondContact O-NH1 3.31Å; P851-R996 VanDerWaalsContact O-NH1 3.16Å; P851-R996 PolarHBondContact O-NH2 2.98Å; Y853-R996 WeakPolarHBondContact O-CD 3.43Å; F992-R996 WeakPolarHBondContact O-CB 3.26Å; F992-R996 PolarHBondContact O-N 3.19Å; Q993-R996 WeakPolarHBondContact O-CB 3.46Å; Q993-R996 PolarHBondContact O-N 3.29Å; Q993-R996 VanDerWaalsContact O-N 3.15Å; Q993-R996 PolarHBondContact O-NH2 3.32Å; Q993-R996 VanDerWaalsContact OE1-CZ 3.32Å; Q993-R996 VanDerWaalsContact OE1-NH2 3.14Å; R996-V998 VanDerWaalsContact C-N 3.33Å; R996-V998 PolarHBondContact O-N 3.02Å; R996-G999 CarbonylContact O-C 3.54Å; R996-G999 PolarHBondContact O-N 3.33Å; R996-G999 VanDerWaalsContact O-N 3.1Å; R996-N1000 WeakPolarHBondContact O-CB 3.24Å; R996-N1000 PolarHBondContact O-N 3.31Å; R996-F1151 HydrophobicContact CB-CB 4.34Å; R996-F1151 HydrophobicContact CB-CD1 4.18Å; R996-F1151 VanDerWaalsContact CD-O 3.29Å; R996-F1151 WeakPolarHBondContact CD-O 3.42Å; R996-F1151 HydrophobicContact CG-CB 4.25Å; R996-F1151 VanDerWaalsContact CG-O 3.3Å; R996-F1151 WeakPolarHBondContact CG-O 3.37Å
997	E	93.9	Very high	91.8	Very high	35 Å²	35	15.8 Å²	15.8	16%	0.164	8%	0.081	C	C	.	.	H	α-helix	trans	-57.8	-45.6	177.5	-72.5	172.6	-150.9	0	0	111.7	L850 L938 Q993 S994 L995 G999 N1000 A1001	L850-E997 HydrophobicContact CB-CB 4.3Å; L850-E997 HydrophobicContact CB-CG 4.15Å; L850-E997 WeakPolarHBondContact O-CG 3.42Å; L938-E997 HydrophobicContact CD1-CB 3.9Å; Q993-E997 PolarHBondContact NE2-OE1 2.9Å; Q993-E997 PolarHBondContact O-N 3.12Å; S994-E997 PolarHBondContact O-N 3.44Å; L995-E997 VanDerWaalsContact C-N 3.34Å; L995-E997 PolarHBondContact O-N 2.9Å; E997-G999 VanDerWaalsContact C-N 3.32Å; E997-G999 PolarHBondContact O-N 3.47Å; E997-N1000 PolarHBondContact O-N 3.41Å; E997-A1001 WeakPolarHBondContact O-CB 2.9Å; E997-A1001 PolarHBondContact O-N 3.03Å
998	V	95.3	Very high	92.2	Very high	2 Å²	2	15.7 Å²	15.7	1%	0.012	8%	0.081	C	C	.	.	H	α-helix	trans	-59.6	-43.5	173.9	171.9	0	0	0	0	111.3	V935 L938 L939 I943 S994 L995 R996 A1001 I1002 A1158	V935-V998 HydrophobicContact CG1-CG1 4.09Å; V935-V998 HydrophobicContact CG2-CG1 4.44Å; L938-V998 HydrophobicContact CB-CG2 3.95Å; L938-V998 HydrophobicContact CD1-CG2 3.86Å; L939-V998 HydrophobicContact CG-CG2 4.48Å; I943-V998 HydrophobicContact CD1-CG2 3.71Å; S994-V998 WeakPolarHBondContact O-CG2 3.41Å; S994-V998 PolarHBondContact O-N 2.68Å; L995-V998 PolarHBondContact O-N 3.14Å; R996-V998 VanDerWaalsContact C-N 3.33Å; R996-V998 PolarHBondContact O-N 3.02Å; V998-A1001 PolarHBondContact O-N 2.72Å; V998-I1002 HydrophobicContact CG1-CD1 4.02Å; V998-I1002 WeakPolarHBondContact O-CG1 3.45Å; V998-I1002 PolarHBondContact O-N 2.82Å; V998-I1002 VanDerWaalsContact O-N 3.08Å; V998-A1158 HydrophobicContact CB-CB 4.06Å; V998-A1158 HydrophobicContact CG1-CB 3.99Å
999	G	94.8	Very high	92.8	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-66.2	-43.3	179.8	0	0	0	0	0	113.1	L995 R996 E997 A1001 I1002 L1003 G1154	L995-G999 PolarHBondContact O-N 3.33Å; R996-G999 CarbonylContact O-C 3.54Å; R996-G999 PolarHBondContact O-N 3.33Å; R996-G999 VanDerWaalsContact O-N 3.1Å; E997-G999 VanDerWaalsContact C-N 3.32Å; E997-G999 PolarHBondContact O-N 3.47Å; G999-A1001 VanDerWaalsContact C-N 3.3Å; G999-A1001 PolarHBondContact O-N 2.94Å; G999-I1002 PolarHBondContact O-N 3.24Å; G999-L1003 WeakPolarHBondContact O-CB 3.28Å; G999-L1003 VanDerWaalsContact O-CG 3.3Å; G999-L1003 WeakPolarHBondContact O-CG 3.43Å; G999-L1003 PolarHBondContact O-N 2.66Å; G999-G1154 VanDerWaalsContact CA-O 3.31Å; G999-G1154 WeakPolarHBondContact CA-O 3.35Å
1000	N	95.7	Very high	93.2	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-63	-36.9	175.5	-74.2	-11.5	0	0	0	111.3	F849 L850 Y853 R996 E997 L1003 F1004	F849-N1000 HydrophobicContact CE1-CB 4.47Å; L850-N1000 HydrophobicContact CD2-CB 3.73Å; L850-N1000 PolarHBondContact O-ND2 3.48Å; Y853-N1000 PolarHBondContact O-ND2 3.02Å; R996-N1000 WeakPolarHBondContact O-CB 3.24Å; R996-N1000 PolarHBondContact O-N 3.31Å; E997-N1000 PolarHBondContact O-N 3.41Å; N1000-L1003 PolarHBondContact O-N 3.09Å; N1000-F1004 WeakPolarHBondContact O-CB 3.34Å; N1000-F1004 PolarHBondContact O-N 3.21Å
1001	A	95.6	Very high	93.6	Very high	2 Å²	2	9.5 Å²	9.5	2%	0.017	5%	0.049	C	C	.	.	H	α-helix	trans	-66	-43.3	175.6	0	0	0	0	0	112.1	L850 L931 V935 E997 V998 G999 F1004 C1005	L850-A1001 HydrophobicContact CD2-CB 3.83Å; L850-A1001 VanDerWaalsContact CD2-N 3.34Å; L931-A1001 HydrophobicContact CD2-CB 4.26Å; V935-A1001 HydrophobicContact CG2-CB 3.73Å; E997-A1001 WeakPolarHBondContact O-CB 2.9Å; E997-A1001 PolarHBondContact O-N 3.03Å; V998-A1001 PolarHBondContact O-N 2.72Å; G999-A1001 VanDerWaalsContact C-N 3.3Å; G999-A1001 PolarHBondContact O-N 2.94Å; A1001-F1004 PolarHBondContact O-N 3.04Å; A1001-C1005 PolarHBondContact O-N 3.43Å; A1001-C1005 VanDerWaalsContact O-N 3.14Å; A1001-C1005 PolarHBondContact O-SG 3.13Å
1002	I	94.3	Very high	93.8	Very high	4 Å²	4	9.7 Å²	9.7	2%	0.021	5%	0.05	C	C	.	.	H	α-helix	trans	-63.3	-45.3	175.4	-67.2	168.8	0	0	0	110.4	V998 G999 F1004 C1005 L1006 F1091 I1098 W1157 A1161	V998-I1002 HydrophobicContact CG1-CD1 4.02Å; V998-I1002 WeakPolarHBondContact O-CG1 3.45Å; V998-I1002 PolarHBondContact O-N 2.82Å; V998-I1002 VanDerWaalsContact O-N 3.08Å; G999-I1002 PolarHBondContact O-N 3.24Å; I1002-F1004 PolarHBondContact O-N 3.16Å; I1002-C1005 PolarHBondContact O-N 2.85Å; I1002-L1006 PolarHBondContact O-N 3.25Å; I1002-F1091 HydrophobicContact CG2-CE2 3.69Å; I1002-F1091 HydrophobicContact CG2-CZ 3.83Å; I1002-I1098 HydrophobicContact CD1-CD1 4.13Å; I1002-I1098 HydrophobicContact CG1-CD1 3.88Å; I1002-W1157 HydrophobicContact CG2-CE3 4.38Å; I1002-A1161 HydrophobicContact CD1-CB 3.91Å
1003	L	95.1	Very high	93.9	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.005	6%	0.063	C	C	.	.	H	α-helix	trans	-63.2	-40.2	177.5	-76.3	165.9	0	0	0	112.1	Y855 F862 G999 N1000 C1005 L1006 L1007 W1157	Y855-L1003 HydrophobicContact CD1-CD1 3.49Å; Y855-L1003 VanDerWaalsContact CD1-CD1 3.49Å; Y855-L1003 HydrophobicContact CD1-CD2 3.78Å; Y855-L1003 HydrophobicContact CD1-CG 4.28Å; Y855-L1003 HydrophobicContact CE1-CD1 4.27Å; Y855-L1003 HydrophobicContact CE1-CD2 3.68Å; Y855-L1003 HydrophobicContact CG-CD1 3.67Å; Y855-L1003 HydrophobicContact CG-CD2 4.48Å; F862-L1003 HydrophobicContact CE1-CD1 4.37Å; F862-L1003 HydrophobicContact CZ-CB 3.96Å; F862-L1003 HydrophobicContact CZ-CD1 4.34Å; G999-L1003 WeakPolarHBondContact O-CB 3.28Å; G999-L1003 VanDerWaalsContact O-CG 3.3Å; G999-L1003 WeakPolarHBondContact O-CG 3.43Å; G999-L1003 PolarHBondContact O-N 2.66Å; N1000-L1003 PolarHBondContact O-N 3.09Å; L1003-C1005 VanDerWaalsContact C-N 3.34Å; L1003-C1005 PolarHBondContact O-N 2.8Å; L1003-L1006 PolarHBondContact O-N 3.07Å; L1003-L1007 WeakPolarHBondContact O-CB 3.41Å; L1003-L1007 VanDerWaalsContact O-CG 3.26Å; L1003-L1007 WeakPolarHBondContact O-CG 3.26Å; L1003-L1007 PolarHBondContact O-N 3.13Å; L1003-W1157 HydrophobicContact CD1-CB 4.38Å; L1003-W1157 HydrophobicContact CD1-CG 4.08Å; L1003-W1157 HydrophobicContact CD2-CD2 3.67Å; L1003-W1157 HydrophobicContact CD2-CE3 4.18Å; L1003-W1157 HydrophobicContact CD2-CG 3.98Å; L1003-W1157 HydrophobicContact CD2-CH2 4.42Å; L1003-W1157 HydrophobicContact CD2-CZ2 3.96Å; L1003-W1157 HydrophobicContact CG-CB 4.43Å; L1003-W1157 HydrophobicContact CG-CD2 4.1Å; L1003-W1157 HydrophobicContact CG-CG 4.01Å
1004	F	95.7	Very high	93.9	Very high	3 Å²	3	15.5 Å²	15.5	1%	0.013	8%	0.081	C	C	.	.	H	α-helix	trans	-58.8	-47.4	175.3	-175.9	-85.8	0	0	0	110.9	L845 F849 F912 I915 V927 L931 N1000 A1001 I1002 L1006 L1007 I1008	L845-F1004 HydrophobicContact CD1-CD1 4.47Å; L845-F1004 HydrophobicContact CD1-CD2 4.33Å; L845-F1004 HydrophobicContact CD1-CE1 3.93Å; L845-F1004 HydrophobicContact CD1-CE2 3.8Å; L845-F1004 HydrophobicContact CD1-CZ 3.57Å; L845-F1004 HydrophobicContact CD2-CD2 3.57Å; L845-F1004 HydrophobicContact CD2-CE2 3.48Å; L845-F1004 VanDerWaalsContact CD2-CE2 3.48Å; L845-F1004 HydrophobicContact CD2-CG 4.36Å; L845-F1004 HydrophobicContact CD2-CZ 4.16Å; L845-F1004 HydrophobicContact CG-CE2 4.26Å; L845-F1004 HydrophobicContact CG-CZ 4.5Å; F849-F1004 HydrophobicContact CE1-CB 4.25Å; F849-F1004 AromaticContact CE1-CD2 4Å; F849-F1004 HydrophobicContact CE1-CD2 4Å; F849-F1004 HydrophobicContact CZ-CD2 4.43Å; F912-F1004 HydrophobicContact CD1-CD2 4.45Å; F912-F1004 HydrophobicContact CD1-CE2 4.18Å; F912-F1004 AromaticContact CE1-CD2 3.47Å; F912-F1004 HydrophobicContact CE1-CD2 3.47Å; F912-F1004 VanDerWaalsContact CE1-CD2 3.47Å; F912-F1004 AromaticContact CE1-CE2 3.58Å; F912-F1004 HydrophobicContact CE1-CE2 3.58Å; F912-F1004 HydrophobicContact CE1-CG 4.23Å; F912-F1004 HydrophobicContact CE1-CZ 4.45Å; F912-F1004 HydrophobicContact CZ-CD2 4.15Å; I915-F1004 HydrophobicContact CD1-CE2 4.39Å; I915-F1004 HydrophobicContact CG2-CZ 4.44Å; V927-F1004 HydrophobicContact CG1-CE1 3.75Å; V927-F1004 HydrophobicContact CG1-CZ 4.36Å; L931-F1004 HydrophobicContact CD1-CB 4.35Å; L931-F1004 HydrophobicContact CD1-CD1 3.46Å; L931-F1004 VanDerWaalsContact CD1-CD1 3.46Å; L931-F1004 HydrophobicContact CD1-CE1 4.1Å; L931-F1004 HydrophobicContact CD1-CG 4.13Å; N1000-F1004 WeakPolarHBondContact O-CB 3.34Å; N1000-F1004 PolarHBondContact O-N 3.21Å; A1001-F1004 PolarHBondContact O-N 3.04Å; I1002-F1004 PolarHBondContact O-N 3.16Å; F1004-L1006 VanDerWaalsContact C-N 3.32Å; F1004-L1006 PolarHBondContact O-N 3.12Å; F1004-L1007 PolarHBondContact O-N 2.9Å; F1004-I1008 HydrophobicContact CD1-CG2 4.36Å; F1004-I1008 HydrophobicContact CE1-CB 4.2Å; F1004-I1008 HydrophobicContact CE1-CG1 4.42Å; F1004-I1008 HydrophobicContact CE1-CG2 4.2Å; F1004-I1008 HydrophobicContact CZ-CD1 4.35Å; F1004-I1008 WeakPolarHBondContact O-CB 3.45Å; F1004-I1008 VanDerWaalsContact O-CG2 3.27Å; F1004-I1008 WeakPolarHBondContact O-CG2 3.35Å; F1004-I1008 PolarHBondContact O-N 2.89Å
1005	C	94.3	Very high	94	Very high	4 Å²	4	17.2 Å²	17.2	3%	0.027	9%	0.088	C	C	.	.	H	α-helix	trans	-60.2	-41.7	177.9	-63.3	0	0	0	0	112.1	M928 A1001 I1002 L1003 I1008 E1009 I1094	M928-C1005 HydrophobicContact CE-CB 4.45Å; A1001-C1005 PolarHBondContact O-N 3.43Å; A1001-C1005 VanDerWaalsContact O-N 3.14Å; A1001-C1005 PolarHBondContact O-SG 3.13Å; I1002-C1005 PolarHBondContact O-N 2.85Å; L1003-C1005 VanDerWaalsContact C-N 3.34Å; L1003-C1005 PolarHBondContact O-N 2.8Å; C1005-I1008 WeakPolarHBondContact O-CG2 3.5Å; C1005-E1009 WeakPolarHBondContact O-CB 3.16Å; C1005-E1009 PolarHBondContact O-N 3.44Å; C1005-I1094 HydrophobicContact CB-CG2 4.49Å
1006	L	93.9	Very high	93.9	Very high	11 Å²	11	17.2 Å²	17.2	6%	0.058	9%	0.088	C	C	.	.	H	α-helix	trans	-64.4	-47.2	176.6	178.7	61.3	0	0	0	112.2	I1002 L1003 F1004 Q1010 F1091 W1157 Y1223	I1002-L1006 PolarHBondContact O-N 3.25Å; L1003-L1006 PolarHBondContact O-N 3.07Å; F1004-L1006 VanDerWaalsContact C-N 3.32Å; F1004-L1006 PolarHBondContact O-N 3.12Å; L1006-Q1010 WeakPolarHBondContact O-CG 3.41Å; L1006-Q1010 PolarHBondContact O-N 2.97Å; L1006-Q1010 VanDerWaalsContact O-N 3.14Å; L1006-F1091 HydrophobicContact CB-CD2 3.89Å; L1006-F1091 HydrophobicContact CB-CE2 3.7Å; L1006-F1091 HydrophobicContact CB-CZ 4.21Å; L1006-F1091 HydrophobicContact CD1-CD1 4.01Å; L1006-F1091 HydrophobicContact CD1-CD2 4.16Å; L1006-F1091 HydrophobicContact CD1-CE1 4.19Å; L1006-F1091 HydrophobicContact CD1-CE2 4.35Å; L1006-F1091 HydrophobicContact CD1-CG 4Å; L1006-F1091 HydrophobicContact CD1-CZ 4.36Å; L1006-F1091 HydrophobicContact CD2-CZ 4.4Å; L1006-F1091 HydrophobicContact CG-CE2 4.45Å; L1006-W1157 HydrophobicContact CD2-CH2 3.79Å; L1006-W1157 HydrophobicContact CD2-CZ3 4.21Å; L1006-Y1223 HydrophobicContact CD1-CE2 4.18Å
1007	L	94.6	Very high	93.9	Very high	10 Å²	10	20.5 Å²	20.5	5%	0.052	11%	0.108	C	C	.	.	H	α-helix	trans	-75.7	-34.5	-173.2	-67.7	172.3	0	0	0	112.6	Y855 N860 F862 F912 L1003 F1004 Q1010 A1011	Y855-L1007 HydrophobicContact CE2-CD1 3.95Å; N860-L1007 WeakPolarHBondContact OD1-CD2 3.42Å; F862-L1007 HydrophobicContact CE2-CD1 3.53Å; F862-L1007 HydrophobicContact CZ-CD1 4.03Å; F912-L1007 HydrophobicContact CD1-CB 4.25Å; F912-L1007 HydrophobicContact CD2-CB 4.3Å; F912-L1007 HydrophobicContact CE1-CB 4Å; F912-L1007 HydrophobicContact CE2-CB 4.11Å; F912-L1007 HydrophobicContact CE2-CD1 3.87Å; F912-L1007 HydrophobicContact CG-CB 4.41Å; F912-L1007 HydrophobicContact CZ-CB 3.96Å; F912-L1007 HydrophobicContact CZ-CD1 3.91Å; L1003-L1007 WeakPolarHBondContact O-CB 3.41Å; L1003-L1007 VanDerWaalsContact O-CG 3.26Å; L1003-L1007 WeakPolarHBondContact O-CG 3.26Å; L1003-L1007 PolarHBondContact O-N 3.13Å; F1004-L1007 PolarHBondContact O-N 2.9Å; L1007-Q1010 PolarHBondContact O-N 3.46Å; L1007-A1011 WeakPolarHBondContact O-CB 3.33Å; L1007-A1011 PolarHBondContact O-N 3.22Å
1008	I	94.7	Very high	93.9	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-69	-37.2	175.2	-160.8	72.5	0	0	0	111.1	F912 I915 C916 I924 M928 F1004 C1005 A1011 L1012	F912-I1008 HydrophobicContact CB-CD1 4.5Å; F912-I1008 HydrophobicContact CD1-CB 4.37Å; F912-I1008 HydrophobicContact CD1-CD1 3.98Å; I915-I1008 HydrophobicContact CB-CD1 4.02Å; I915-I1008 HydrophobicContact CG2-CD1 3.68Å; C916-I1008 WeakPolarHBondContact SG-CD1 3.48Å; C916-I1008 PolarHBondContact SG-O 2.88Å; C916-I1008 VanDerWaalsContact SG-O 3.42Å; I924-I1008 HydrophobicContact CD1-CG1 4.44Å; I924-I1008 HydrophobicContact CG1-CG1 4.28Å; I924-I1008 HydrophobicContact CG2-CG1 4.42Å; I924-I1008 HydrophobicContact CG2-CG2 4.35Å; M928-I1008 HydrophobicContact CE-CG2 3.39Å; F1004-I1008 HydrophobicContact CD1-CG2 4.36Å; F1004-I1008 HydrophobicContact CE1-CB 4.2Å; F1004-I1008 HydrophobicContact CE1-CG1 4.42Å; F1004-I1008 HydrophobicContact CE1-CG2 4.2Å; F1004-I1008 HydrophobicContact CZ-CD1 4.35Å; F1004-I1008 WeakPolarHBondContact O-CB 3.45Å; F1004-I1008 VanDerWaalsContact O-CG2 3.27Å; F1004-I1008 WeakPolarHBondContact O-CG2 3.35Å; F1004-I1008 PolarHBondContact O-N 2.89Å; C1005-I1008 WeakPolarHBondContact O-CG2 3.5Å; I1008-A1011 PolarHBondContact O-N 3.14Å; I1008-L1012 WeakPolarHBondContact O-CB 3.47Å; I1008-L1012 PolarHBondContact O-N 3.36Å
1009	E	93.4	Very high	93.7	Very high	19 Å²	19	25.2 Å²	25.2	9%	0.089	14%	0.138	C	C	.	.	H	α-helix	trans	-64.1	-41.1	173.5	178.6	175.8	178.8	0	0	111.8	C1005 A1011 L1012 S1013 S1089 M1090 F1091	C1005-E1009 WeakPolarHBondContact O-CB 3.16Å; C1005-E1009 PolarHBondContact O-N 3.44Å; E1009-A1011 VanDerWaalsContact C-N 3.34Å; E1009-L1012 PolarHBondContact O-N 3.02Å; E1009-S1013 WeakPolarHBondContact O-CB 3.34Å; E1009-S1013 PolarHBondContact O-N 3.45Å; E1009-S1013 PolarHBondContact O-OG 2.98Å; E1009-S1089 VanDerWaalsContact OE1-CA 3.28Å; E1009-S1089 WeakPolarHBondContact OE1-CA 3.34Å; E1009-M1090 HydrophobicContact CB-CE 3.91Å; E1009-M1090 HydrophobicContact CG-CE 3.76Å; E1009-M1090 PolarHBondContact OE1-N 3.43Å; E1009-M1090 PolarHBondContact OE2-N 3.35Å; E1009-F1091 VanDerWaalsContact OE2-CB 3.26Å; E1009-F1091 WeakPolarHBondContact OE2-CB 3.43Å; E1009-F1091 PolarHBondContact OE2-N 3.03Å
1010	Q	92.6	Very high	93.6	Very high	71 Å²	71	26.9 Å²	26.9	33%	0.332	15%	0.147	S	C	.	.	H	α-helix	trans	-62.7	-41.9	174.2	-72.8	175.7	16.8	0	0	111.8	L1006 L1007 S1013 Q1014	L1006-Q1010 WeakPolarHBondContact O-CG 3.41Å; L1006-Q1010 PolarHBondContact O-N 2.97Å; L1006-Q1010 VanDerWaalsContact O-N 3.14Å; L1007-Q1010 PolarHBondContact O-N 3.46Å; Q1010-S1013 PolarHBondContact O-N 2.84Å; Q1010-Q1014 WeakPolarHBondContact O-CG 3.39Å; Q1010-Q1014 PolarHBondContact O-N 3.5Å; Q1010-Q1014 VanDerWaalsContact O-N 3.07Å
1011	A	93.6	Very high	93.5	Very high	6 Å²	6	32.6 Å²	32.6	5%	0.05	18%	0.177	C	C	.	.	H	α-helix	trans	-64.8	-42.3	176.5	0	0	0	0	0	111.5	F912 K913 C916 L1007 I1008 E1009 Q1014 E1015	F912-A1011 HydrophobicContact CB-CB 3.94Å; K913-A1011 HydrophobicContact CG-CB 4.41Å; C916-A1011 VanDerWaalsContact SG-CB 3.58Å; L1007-A1011 WeakPolarHBondContact O-CB 3.33Å; L1007-A1011 PolarHBondContact O-N 3.22Å; I1008-A1011 PolarHBondContact O-N 3.14Å; E1009-A1011 VanDerWaalsContact C-N 3.34Å; A1011-Q1014 WeakPolarHBondContact O-CB 3.26Å; A1011-Q1014 PolarHBondContact O-N 3.44Å; A1011-E1015 PolarHBondContact O-N 2.78Å
1012	L	93.3	Very high	93.4	Very high	9 Å²	9	39.3 Å²	39.3	5%	0.047	21%	0.208	C	C	.	.	H	α-helix	trans	-61.5	-44.8	175.3	-176.6	61	0	0	0	111.5	Y921 I924 I1008 E1009 Q1014 E1015 E1016 L1084 M1090	Y921-L1012 HydrophobicContact CD1-CD1 4.43Å; Y921-L1012 HydrophobicContact CD1-CD2 4.15Å; Y921-L1012 HydrophobicContact CE1-CD1 3.98Å; Y921-L1012 HydrophobicContact CE1-CD2 3.99Å; Y921-L1012 HydrophobicContact CE1-CG 4.34Å; I924-L1012 HydrophobicContact CD1-CD1 4.07Å; I924-L1012 HydrophobicContact CD1-CD2 4.06Å; I924-L1012 HydrophobicContact CD1-CG 4.48Å; I1008-L1012 WeakPolarHBondContact O-CB 3.47Å; I1008-L1012 PolarHBondContact O-N 3.36Å; E1009-L1012 PolarHBondContact O-N 3.02Å; L1012-Q1014 VanDerWaalsContact C-N 3.28Å; L1012-Q1014 PolarHBondContact O-N 3.31Å; L1012-E1015 WeakPolarHBondContact O-CB 3.31Å; L1012-E1015 PolarHBondContact O-N 3.11Å; L1012-E1015 VanDerWaalsContact O-N 3.07Å; L1012-E1016 HydrophobicContact CD1-CG 4.34Å; L1012-E1016 HydrophobicContact CG-CG 4.42Å; L1012-E1016 WeakPolarHBondContact O-CG 3.37Å; L1012-E1016 PolarHBondContact O-N 3.26Å; L1012-L1084 HydrophobicContact CD2-CD1 3.72Å; L1012-M1090 HydrophobicContact CD2-CE 3.87Å
1013	S	93	Very high	93.3	Very high	41 Å²	41	39.7 Å²	39.7	29%	0.287	21%	0.211	S	C	.	.	H	α-helix	trans	-60.8	-38.2	176.9	-59.4	0	0	0	0	112.3	E1009 Q1010 E1015 V1017	E1009-S1013 WeakPolarHBondContact O-CB 3.34Å; E1009-S1013 PolarHBondContact O-N 3.45Å; E1009-S1013 PolarHBondContact O-OG 2.98Å; Q1010-S1013 PolarHBondContact O-N 2.84Å; S1013-E1015 VanDerWaalsContact C-N 3.34Å; S1013-V1017 WeakPolarHBondContact O-CG1 3.39Å; S1013-V1017 PolarHBondContact O-N 3.43Å; S1013-V1017 VanDerWaalsContact O-N 3.11Å
1014	Q	91.7	Very high	93.2	Very high	92 Å²	92	40.4 Å²	40.4	43%	0.43	22%	0.217	S	C	.	.	H	α-helix	trans	-68.3	-32.8	175.2	-73.7	178.7	22.6	0	0	112.7	Q1010 A1011 L1012 V1017 C1018	Q1010-Q1014 WeakPolarHBondContact O-CG 3.39Å; Q1010-Q1014 PolarHBondContact O-N 3.5Å; Q1010-Q1014 VanDerWaalsContact O-N 3.07Å; A1011-Q1014 WeakPolarHBondContact O-CB 3.26Å; A1011-Q1014 PolarHBondContact O-N 3.44Å; L1012-Q1014 VanDerWaalsContact C-N 3.28Å; L1012-Q1014 PolarHBondContact O-N 3.31Å; Q1014-V1017 WeakPolarHBondContact O-CG1 3.31Å; Q1014-C1018 PolarHBondContact O-N 3.03Å; Q1014-C1018 PolarHBondContact O-SG 3Å
1015	E	91.6	Very high	93.1	Very high	49 Å²	49	42.8 Å²	42.8	23%	0.229	23%	0.233	C	C	.	.	H	α-helix	trans	-72.2	-49.2	176.3	-172.7	170.1	177.2	0	0	111	C916 R917 A1011 L1012 S1013 V1017 C1018 D1019	C916-E1015 VanDerWaalsContact CB-OE2 3.24Å; C916-E1015 WeakPolarHBondContact CB-OE2 3.49Å; R917-E1015 WeakPolarHBondContact CG-OE1 3.19Å; A1011-E1015 PolarHBondContact O-N 2.78Å; L1012-E1015 WeakPolarHBondContact O-CB 3.31Å; L1012-E1015 PolarHBondContact O-N 3.11Å; L1012-E1015 VanDerWaalsContact O-N 3.07Å; S1013-E1015 VanDerWaalsContact C-N 3.34Å; E1015-V1017 PolarHBondContact O-N 3.45Å; E1015-C1018 WeakPolarHBondContact O-CB 3.39Å; E1015-C1018 PolarHBondContact O-N 2.81Å; E1015-C1018 VanDerWaalsContact O-N 3.08Å; E1015-D1019 PolarHBondContact O-N 3.07Å
1016	E	92.9	Very high	93.1	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.009	25%	0.254	C	S	.	.	H	α-helix	trans	-60.2	-41.1	179.4	-70.3	179.6	143.9	0	0	112.8	Y921 L1012 C1018 D1019 L1020 R1083 L1084 C1085	Y921-E1016 WeakPolarHBondContact CE1-OE1 3.46Å; Y921-E1016 VanDerWaalsContact CZ-OE1 3.29Å; Y921-E1016 WeakPolarHBondContact OH-CG 3.27Å; Y921-E1016 PolarHBondContact OH-OE1 3.2Å; L1012-E1016 HydrophobicContact CD1-CG 4.34Å; L1012-E1016 HydrophobicContact CG-CG 4.42Å; L1012-E1016 WeakPolarHBondContact O-CG 3.37Å; L1012-E1016 PolarHBondContact O-N 3.26Å; E1016-C1018 VanDerWaalsContact C-N 3.29Å; E1016-C1018 PolarHBondContact O-N 2.89Å; E1016-D1019 PolarHBondContact O-N 3.45Å; E1016-L1020 WeakPolarHBondContact O-CG 3.3Å; E1016-L1020 PolarHBondContact O-N 3.14Å; E1016-R1083 HydrophobicContact CB-CB 4Å; E1016-R1083 HydrophobicContact CB-CG 4.32Å; E1016-R1083 HydrophobicContact CG-CB 4.07Å; E1016-R1083 HydrophobicContact CG-CG 4.45Å; E1016-L1084 PolarHBondContact OE1-N 3.34Å; E1016-L1084 PolarHBondContact OE2-N 3.47Å; E1016-C1085 HydrophobicContact CB-CB 4.34Å; E1016-C1085 WeakPolarHBondContact OE2-CB 2.95Å; E1016-C1085 PolarHBondContact OE2-N 2.87Å
1017	V	93.2	Very high	93.1	Very high	69 Å²	69	48.4 Å²	48.4	42%	0.418	26%	0.257	S	S	.	.	H	α-helix	trans	-66.2	-35.3	177.5	72.3	0	0	0	0	111.4	S1013 Q1014 E1015 D1019 L1020 L1021	S1013-V1017 WeakPolarHBondContact O-CG1 3.39Å; S1013-V1017 PolarHBondContact O-N 3.43Å; S1013-V1017 VanDerWaalsContact O-N 3.11Å; Q1014-V1017 WeakPolarHBondContact O-CG1 3.31Å; E1015-V1017 PolarHBondContact O-N 3.45Å; V1017-D1019 VanDerWaalsContact C-N 3.34Å; V1017-L1020 PolarHBondContact O-N 3.41Å; V1017-L1021 VanDerWaalsContact O-CG 3.24Å; V1017-L1021 WeakPolarHBondContact O-CG 3.42Å; V1017-L1021 PolarHBondContact O-N 2.9Å
1018	C	91.9	Very high	92.9	Very high	63 Å²	63	50 Å²	50	43%	0.426	27%	0.265	S	S	.	.	H	α-helix	trans	-63.9	-41.5	172.9	-80.6	0	0	0	0	111.2	Q1014 E1015 E1016 L1021 H1022	Q1014-C1018 PolarHBondContact O-N 3.03Å; Q1014-C1018 PolarHBondContact O-SG 3Å; E1015-C1018 WeakPolarHBondContact O-CB 3.39Å; E1015-C1018 PolarHBondContact O-N 2.81Å; E1015-C1018 VanDerWaalsContact O-N 3.08Å; E1016-C1018 VanDerWaalsContact C-N 3.29Å; E1016-C1018 PolarHBondContact O-N 2.89Å; C1018-L1021 PolarHBondContact O-N 2.9Å; C1018-H1022 PolarHBondContact O-N 3.3Å; C1018-H1022 PolarHBondContact O-ND1 3.41Å
1019	D	91.7	Very high	92.8	Very high	72 Å²	72	54.7 Å²	54.7	39%	0.385	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-44.9	176.7	-72.2	-8.6	0	0	0	111.8	E1015 E1016 V1017 L1021 H1022 A1023	E1015-D1019 PolarHBondContact O-N 3.07Å; E1016-D1019 PolarHBondContact O-N 3.45Å; V1017-D1019 VanDerWaalsContact C-N 3.34Å; D1019-L1021 VanDerWaalsContact C-N 3.3Å; D1019-L1021 PolarHBondContact O-N 3.44Å; D1019-H1022 PolarHBondContact O-N 3.1Å; D1019-H1022 VanDerWaalsContact O-N 3.13Å; D1019-A1023 WeakPolarHBondContact O-CB 3.4Å; D1019-A1023 PolarHBondContact O-N 3.06Å
1020	L	93.1	Very high	92.7	Very high	35 Å²	35	55.5 Å²	55.5	18%	0.183	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-37.6	176.8	-70.9	172.2	0	0	0	112.3	E1016 V1017 H1022 A1023 A1024 T1080 R1083	E1016-L1020 WeakPolarHBondContact O-CG 3.3Å; E1016-L1020 PolarHBondContact O-N 3.14Å; V1017-L1020 PolarHBondContact O-N 3.41Å; L1020-H1022 VanDerWaalsContact C-N 3.32Å; L1020-H1022 PolarHBondContact O-N 3.29Å; L1020-A1023 PolarHBondContact O-N 2.96Å; L1020-A1024 WeakPolarHBondContact O-CB 3.44Å; L1020-A1024 PolarHBondContact O-N 3.48Å; L1020-T1080 WeakPolarHBondContact CD2-O 3.39Å; L1020-R1083 HydrophobicContact CD1-CB 4.35Å; L1020-R1083 HydrophobicContact CD1-CG 4.23Å; L1020-R1083 HydrophobicContact CD2-CG 3.99Å; L1020-R1083 HydrophobicContact CG-CG 4.06Å
1021	L	93.6	Very high	92.6	Very high	121 Å²	121	57 Å²	57	63%	0.634	31%	0.31	S	S	*	.	H	α-helix	trans	-64.6	-35.8	175.8	-73.5	171.5	0	0	0	112.4	V1017 C1018 D1019	V1017-L1021 VanDerWaalsContact O-CG 3.24Å; V1017-L1021 WeakPolarHBondContact O-CG 3.42Å; V1017-L1021 PolarHBondContact O-N 2.9Å; C1018-L1021 PolarHBondContact O-N 2.9Å; D1019-L1021 VanDerWaalsContact C-N 3.3Å; D1019-L1021 PolarHBondContact O-N 3.44Å
1022	H	92.7	Very high	92.4	Very high	143 Å²	143	66.8 Å²	66.8	66%	0.662	35%	0.346	S	S	*	.	H	α-helix	trans	-76.4	-31.1	174.8	-69.3	93.4	0	0	0	112.5	C1018 D1019 L1020 P1025	C1018-H1022 PolarHBondContact O-N 3.3Å; C1018-H1022 PolarHBondContact O-ND1 3.41Å; D1019-H1022 PolarHBondContact O-N 3.1Å; D1019-H1022 VanDerWaalsContact O-N 3.13Å; L1020-H1022 VanDerWaalsContact C-N 3.32Å; L1020-H1022 PolarHBondContact O-N 3.29Å; H1022-P1025 WeakPolarHBondContact O-CD 3.44Å
1023	A	93.1	Very high	92.1	Very high	12 Å²	12	67.8 Å²	67.8	10%	0.099	35%	0.352	C	S	.	.	H	α-helix	trans	-74.9	-30	177	0	0	0	0	0	113.1	D1019 L1020 P1025 F1026 Q1027 T1080	D1019-A1023 WeakPolarHBondContact O-CB 3.4Å; D1019-A1023 PolarHBondContact O-N 3.06Å; L1020-A1023 PolarHBondContact O-N 2.96Å; A1023-P1025 VanDerWaalsContact C-CD 3.46Å; A1023-P1025 VanDerWaalsContact O-N 3.16Å; A1023-F1026 PolarHBondContact O-N 2.89Å; A1023-Q1027 HydrophobicContact CB-CG 4.44Å; A1023-Q1027 PolarHBondContact O-N 3.34Å; A1023-Q1027 VanDerWaalsContact O-N 3.14Å; A1023-T1080 HydrophobicContact CB-CG2 3.44Å; A1023-T1080 VanDerWaalsContact CB-CG2 3.44Å
1024	A	93.2	Very high	91.8	Very high	15 Å²	15	74.4 Å²	74.4	12%	0.124	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-45.9	-173.1	0	0	0	0	0	115.3	L1020 F1026 Q1027 N1028 I1029	L1020-A1024 WeakPolarHBondContact O-CB 3.44Å; L1020-A1024 PolarHBondContact O-N 3.48Å; A1024-F1026 VanDerWaalsContact C-N 3.28Å; A1024-F1026 PolarHBondContact O-N 3.16Å; A1024-Q1027 PolarHBondContact O-N 3.23Å; A1024-N1028 PolarHBondContact O-N 3.46Å; A1024-I1029 HydrophobicContact CB-CB 3.87Å; A1024-I1029 HydrophobicContact CB-CG2 4.24Å; A1024-I1029 PolarHBondContact O-N 3.49Å
1025	P	93.1	Very high	91.5	Very high	53 Å²	53	72.7 Å²	72.7	34%	0.344	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-31.6	178.2	-22.6	35	0	0	0	114.1	H1022 A1023	H1022-P1025 WeakPolarHBondContact O-CD 3.44Å; A1023-P1025 VanDerWaalsContact C-CD 3.46Å; A1023-P1025 VanDerWaalsContact O-N 3.16Å
1026	F	94.6	Very high	91.1	Very high	106 Å²	106	76.5 Å²	76.5	47%	0.465	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-18.7	-177.5	-54.8	-73.4	0	0	0	112.8	A1023 A1024 H1056 L1057	A1023-F1026 PolarHBondContact O-N 2.89Å; A1024-F1026 VanDerWaalsContact C-N 3.28Å; A1024-F1026 PolarHBondContact O-N 3.16Å; F1026-H1056 WeakPolarHBondContact O-CA 3.36Å; F1026-H1056 PolarHBondContact O-CD2 3.27Å; F1026-L1057 HydrophobicContact CB-CB 4.43Å; F1026-L1057 PolarHBondContact O-N 3.34Å
1027	Q	93	Very high	90.2	Very high	27 Å²	27	86.3 Å²	86.3	13%	0.126	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	11.4	177.6	-60.4	-171.4	-43.7	0	0	113.1	A1023 A1024 I1029 D1077	A1023-Q1027 HydrophobicContact CB-CG 4.44Å; A1023-Q1027 PolarHBondContact O-N 3.34Å; A1023-Q1027 VanDerWaalsContact O-N 3.14Å; A1024-Q1027 PolarHBondContact O-N 3.23Å; Q1027-I1029 VanDerWaalsContact C-N 3.3Å; Q1027-I1029 HydrophobicContact CB-CD1 4.31Å; Q1027-I1029 HydrophobicContact CB-CG1 4.33Å; Q1027-I1029 PolarHBondContact O-N 2.89Å; Q1027-D1077 WeakPolarHBondContact CG-OD1 3.31Å; Q1027-D1077 PolarHBondContact NE2-O 3.06Å; Q1027-D1077 PolarHBondContact NE2-OD1 2.98Å
1028	N	92.1	Very high	89.6	Confident	43 Å²	43	87.1 Å²	87.1	23%	0.23	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	31.5	-179.9	-164.1	39	0	0	0	114.5	A1024 E1049	A1024-N1028 PolarHBondContact O-N 3.46Å; N1028-E1049 PolarHBondContact ND2-OE1 3.01Å
1029	I	92.2	Very high	89.2	Confident	101 Å²	101	88.1 Å²	88.1	52%	0.518	45%	0.448	S	S	.	.			trans	-96.1	112.3	175.5	-57.7	174.3	0	0	0	108.6	A1024 Q1027	A1024-I1029 HydrophobicContact CB-CB 3.87Å; A1024-I1029 HydrophobicContact CB-CG2 4.24Å; A1024-I1029 PolarHBondContact O-N 3.49Å; Q1027-I1029 VanDerWaalsContact C-N 3.3Å; Q1027-I1029 HydrophobicContact CB-CD1 4.31Å; Q1027-I1029 HydrophobicContact CB-CG1 4.33Å; Q1027-I1029 PolarHBondContact O-N 2.89Å
1030	L	90.3	Very high	88.8	Confident	35 Å²	35	93.7 Å²	93.7	18%	0.183	46%	0.464	C	S	.	.			trans	-112.6	138.8	-177.3	-64.3	175.3	0	0	0	111.6	M1045 L1048 E1049 Y1052	L1030-M1045 HydrophobicContact CB-CE 4.13Å; L1030-L1048 HydrophobicContact CD1-CB 4.18Å; L1030-L1048 HydrophobicContact CD1-CD2 4.17Å; L1030-L1048 HydrophobicContact CD1-CG 4Å; L1030-E1049 HydrophobicContact CD1-CB 4.25Å; L1030-Y1052 HydrophobicContact CD1-CD2 4.39Å; L1030-Y1052 HydrophobicContact CD2-CD2 3.64Å; L1030-Y1052 HydrophobicContact CD2-CE2 4.18Å; L1030-Y1052 HydrophobicContact CD2-CG 4.24Å
1031	P	91.5	Very high	88.4	Confident	102 Å²	102	94.8 Å²	94.8	66%	0.662	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-69.5	157.2	175.5	30.7	-35.3	0	0	0	111	V1033	P1031-V1033 PolarHBondContact O-N 3.3Å
1032	R	87.9	Confident	87.9	Confident	212 Å²	212	95.9 Å²	95.9	80%	0.8	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-62.3	123.8	176.5	-172.8	176	-179.6	179.6	0.4	110.8	L1041	R1032-L1041 HydrophobicContact CG-CD1 4.34Å
1033	V	87.2	Confident	87.6	Confident	31 Å²	31	92.4 Å²	92.4	19%	0.188	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-88.5	143.6	-176.1	-172.3	0	0	0	0	111.3	P1031 I1035 R1044 M1045 L1048	P1031-V1033 PolarHBondContact O-N 3.3Å; V1033-I1035 PolarHBondContact O-N 2.84Å; V1033-R1044 HydrophobicContact CG1-CG 4.22Å; V1033-M1045 HydrophobicContact CB-SD 4.49Å; V1033-M1045 HydrophobicContact CG2-SD 3.79Å; V1033-L1048 HydrophobicContact CG2-CD2 3.4Å; V1033-L1048 VanDerWaalsContact CG2-CD2 3.4Å
1034	Y	87.4	Confident	87.2	Confident	179 Å²	179	95.3 Å²	95.3	70%	0.702	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-63	129.5	171.4	177.3	-102.6	0	0	0	111.6	K1036 R1044	Y1034-K1036 HydrophobicContact CD1-CG 4.38Å; Y1034-K1036 HydrophobicContact CE1-CG 3.88Å; Y1034-R1044 PolarHBondContact O-NH1 2.77Å; Y1034-R1044 PolarHBondContact O-NH2 3.08Å
1035	I	84.8	Confident	86.9	Confident	56 Å²	56	97.1 Å²	97.1	29%	0.287	48%	0.475	S	S	.	.			trans	-105	127.9	-177.9	-53	171.3	0	0	0	108.7	V1033 E1039 L1041	V1033-I1035 PolarHBondContact O-N 2.84Å; I1035-E1039 HydrophobicContact CG2-CB 3.73Å; I1035-E1039 WeakPolarHBondContact CG2-O 3.26Å; I1035-L1041 HydrophobicContact CD1-CB 3.44Å; I1035-L1041 VanDerWaalsContact CD1-CB 3.44Å; I1035-L1041 HydrophobicContact CD1-CD1 3.75Å; I1035-L1041 HydrophobicContact CD1-CG 4.06Å; I1035-L1041 HydrophobicContact CG1-CB 4.4Å; I1035-L1041 HydrophobicContact CG1-CD1 4.05Å
1036	K	84.3	Confident	86.6	Confident	130 Å²	130	101.4 Å²	101.4	57%	0.565	49%	0.488	S	S	*	.			trans	-83.3	157	171.6	-70.8	-176.8	178.4	-176.8	0	110.4	Y1034 G1038 E1039	Y1034-K1036 HydrophobicContact CD1-CG 4.38Å; Y1034-K1036 HydrophobicContact CE1-CG 3.88Å; K1036-G1038 PolarHBondContact O-N 3.25Å; K1036-E1039 PolarHBondContact O-N 3.47Å
1037	E	73.1	Confident	86.2	Confident	207 Å²	207	104.9 Å²	104.9	97%	0.967	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	123.8	178.2	-143.4	175.4	-175.2	0	0	110.6
1038	G	80.1	Confident	86	Confident	87 Å²	87	105.5 Å²	105.5	90%	0.897	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.3	-7.2	-175	0	0	0	0	0	116.3	K1036	K1036-G1038 PolarHBondContact O-N 3.25Å
1039	E	83.9	Confident	86	Confident	83 Å²	83	107.4 Å²	107.4	39%	0.388	51%	0.51	S	S	.	.			trans	-99	148.9	175.3	-67.6	-178.3	161	0	0	112.7	I1035 K1036 R1044	I1035-E1039 HydrophobicContact CG2-CB 3.73Å; I1035-E1039 WeakPolarHBondContact CG2-O 3.26Å; K1036-E1039 PolarHBondContact O-N 3.47Å; E1039-R1044 VanDerWaalsContact OE2-CD 3.29Å; E1039-R1044 WeakPolarHBondContact OE2-CD 3.34Å; E1039-R1044 IonicContact OE2-CZ 3.3Å; E1039-R1044 IonicContact OE2-NE 2.66Å; E1039-R1044 IonicContact OE2-NH1 2.72Å; E1039-R1044 PolarHBondContact OE2-NH1 2.91Å
1040	R	83.8	Confident	85.9	Confident	190 Å²	190	106 Å²	106	72%	0.717	51%	0.513	S	S	*	.			trans	-100.3	137.7	172.1	-65.5	-175.3	-178	-176.7	0.8	110.6	E1042 V1043 R1044	R1040-E1042 VanDerWaalsContact C-N 3.29Å; R1040-E1042 PolarHBondContact O-N 2.94Å; R1040-V1043 HydrophobicContact CB-CG2 4.15Å; R1040-V1043 PolarHBondContact O-N 2.78Å; R1040-R1044 PolarHBondContact O-N 2.98Å
1041	L	84.2	Confident	85.9	Confident	58 Å²	58	111 Å²	111	30%	0.304	53%	0.534	S	S	.	.	H	α-helix	trans	-52.2	-48	-179.9	-176.2	56.3	0	0	0	111.7	R1032 I1035 V1043 R1044 M1045	R1032-L1041 HydrophobicContact CG-CD1 4.34Å; I1035-L1041 HydrophobicContact CD1-CB 3.44Å; I1035-L1041 VanDerWaalsContact CD1-CB 3.44Å; I1035-L1041 HydrophobicContact CD1-CD1 3.75Å; I1035-L1041 HydrophobicContact CD1-CG 4.06Å; I1035-L1041 HydrophobicContact CG1-CB 4.4Å; I1035-L1041 HydrophobicContact CG1-CD1 4.05Å; L1041-V1043 PolarHBondContact O-N 2.78Å; L1041-R1044 PolarHBondContact O-N 3.06Å; L1041-M1045 HydrophobicContact CD1-CG 3.82Å; L1041-M1045 HydrophobicContact CD1-SD 4.43Å; L1041-M1045 HydrophobicContact CG-CG 4.1Å; L1041-M1045 WeakPolarHBondContact O-CB 3.43Å; L1041-M1045 VanDerWaalsContact O-CG 3.3Å; L1041-M1045 WeakPolarHBondContact O-CG 3.29Å; L1041-M1045 PolarHBondContact O-N 3.16Å
1042	E	84.1	Confident	86	Confident	143 Å²	143	110.1 Å²	110.1	67%	0.668	52%	0.517	S	S	*	.	H	α-helix	trans	-59.6	-43.6	-177	-64.6	172.2	-172.9	0	0	112.6	R1040 R1044 K1046	R1040-E1042 VanDerWaalsContact C-N 3.29Å; R1040-E1042 PolarHBondContact O-N 2.94Å; E1042-R1044 VanDerWaalsContact C-N 3.32Å; E1042-R1044 PolarHBondContact O-N 3.1Å; E1042-K1046 WeakPolarHBondContact O-CB 3.4Å; E1042-K1046 WeakPolarHBondContact O-CG 3.3Å; E1042-K1046 PolarHBondContact O-N 2.88Å
1043	V	84.8	Confident	86.2	Confident	71 Å²	71	102.5 Å²	102.5	43%	0.43	50%	0.5	S	S	.	.	H	α-helix	trans	-66.7	-40.3	-179.4	178.4	0	0	0	0	110.1	R1040 L1041 R1047	R1040-V1043 HydrophobicContact CB-CG2 4.15Å; R1040-V1043 PolarHBondContact O-N 2.78Å; L1041-V1043 PolarHBondContact O-N 2.78Å; V1043-R1047 WeakPolarHBondContact O-CG 3.32Å; V1043-R1047 PolarHBondContact O-N 3.37Å; V1043-R1047 VanDerWaalsContact O-N 3.15Å
1044	R	84.9	Confident	86.4	Confident	72 Å²	72	105.2 Å²	105.2	27%	0.272	52%	0.518	S	S	.	.	H	α-helix	trans	-73.2	-39	-179.6	-168.5	159.6	-178.8	179.6	-10.9	112.4	V1033 Y1034 E1039 R1040 L1041 E1042 R1047 L1048	V1033-R1044 HydrophobicContact CG1-CG 4.22Å; Y1034-R1044 PolarHBondContact O-NH1 2.77Å; Y1034-R1044 PolarHBondContact O-NH2 3.08Å; E1039-R1044 VanDerWaalsContact OE2-CD 3.29Å; E1039-R1044 WeakPolarHBondContact OE2-CD 3.34Å; E1039-R1044 IonicContact OE2-CZ 3.3Å; E1039-R1044 IonicContact OE2-NE 2.66Å; E1039-R1044 IonicContact OE2-NH1 2.72Å; E1039-R1044 PolarHBondContact OE2-NH1 2.91Å; R1040-R1044 PolarHBondContact O-N 2.98Å; L1041-R1044 PolarHBondContact O-N 3.06Å; E1042-R1044 VanDerWaalsContact C-N 3.32Å; E1042-R1044 PolarHBondContact O-N 3.1Å; R1044-R1047 PolarHBondContact O-N 3.15Å; R1044-L1048 PolarHBondContact O-N 3.37Å
1045	M	86.9	Confident	86.7	Confident	53 Å²	53	100.2 Å²	100.2	26%	0.261	50%	0.503	S	S	.	.	H	α-helix	trans	-62.6	-46.3	173.6	-73.2	-65.9	-68.5	0	0	111.2	L1030 V1033 L1041 R1047 L1048 E1049	L1030-M1045 HydrophobicContact CB-CE 4.13Å; V1033-M1045 HydrophobicContact CB-SD 4.49Å; V1033-M1045 HydrophobicContact CG2-SD 3.79Å; L1041-M1045 HydrophobicContact CD1-CG 3.82Å; L1041-M1045 HydrophobicContact CD1-SD 4.43Å; L1041-M1045 HydrophobicContact CG-CG 4.1Å; L1041-M1045 WeakPolarHBondContact O-CB 3.43Å; L1041-M1045 VanDerWaalsContact O-CG 3.3Å; L1041-M1045 WeakPolarHBondContact O-CG 3.29Å; L1041-M1045 PolarHBondContact O-N 3.16Å; M1045-R1047 VanDerWaalsContact C-N 3.33Å; M1045-R1047 PolarHBondContact O-N 3.16Å; M1045-L1048 CarbonylContact O-C 3.57Å; M1045-L1048 WeakPolarHBondContact O-CB 3.35Å; M1045-L1048 PolarHBondContact O-N 3.32Å; M1045-E1049 WeakPolarHBondContact O-CB 3.18Å; M1045-E1049 PolarHBondContact O-N 2.94Å
1046	K	87.7	Confident	87.1	Confident	144 Å²	144	99.9 Å²	99.9	63%	0.626	50%	0.501	S	S	*	.	H	α-helix	trans	-61.5	-37.6	176.6	-75.8	-177.2	178.8	-176.8	0	113.3	E1042 L1048 A1050	E1042-K1046 WeakPolarHBondContact O-CB 3.4Å; E1042-K1046 WeakPolarHBondContact O-CG 3.3Å; E1042-K1046 PolarHBondContact O-N 2.88Å; K1046-L1048 VanDerWaalsContact C-N 3.33Å; K1046-A1050 WeakPolarHBondContact O-CB 3.27Å; K1046-A1050 PolarHBondContact O-N 3.04Å
1047	R	86.8	Confident	87.5	Confident	178 Å²	178	97.7 Å²	97.7	67%	0.672	50%	0.495	S	S	*	.	H	α-helix	trans	-65.2	-37.7	173.3	-75.2	179.2	-175.3	175.2	1.9	112	V1043 R1044 M1045 K1051	V1043-R1047 WeakPolarHBondContact O-CG 3.32Å; V1043-R1047 PolarHBondContact O-N 3.37Å; V1043-R1047 VanDerWaalsContact O-N 3.15Å; R1044-R1047 PolarHBondContact O-N 3.15Å; M1045-R1047 VanDerWaalsContact C-N 3.33Å; M1045-R1047 PolarHBondContact O-N 3.16Å; R1047-K1051 PolarHBondContact O-N 2.81Å; R1047-K1051 VanDerWaalsContact O-N 3.12Å
1048	L	88.4	Confident	88.5	Confident	40 Å²	40	88.8 Å²	88.8	21%	0.209	45%	0.454	C	S	.	.	H	α-helix	trans	-72.7	-39.3	178.4	-164.5	66.2	0	0	0	111.7	L1030 V1033 R1044 M1045 K1046 K1051 Y1052	L1030-L1048 HydrophobicContact CD1-CB 4.18Å; L1030-L1048 HydrophobicContact CD1-CD2 4.17Å; L1030-L1048 HydrophobicContact CD1-CG 4Å; V1033-L1048 HydrophobicContact CG2-CD2 3.4Å; V1033-L1048 VanDerWaalsContact CG2-CD2 3.4Å; R1044-L1048 PolarHBondContact O-N 3.37Å; M1045-L1048 CarbonylContact O-C 3.57Å; M1045-L1048 WeakPolarHBondContact O-CB 3.35Å; M1045-L1048 PolarHBondContact O-N 3.32Å; K1046-L1048 VanDerWaalsContact C-N 3.33Å; L1048-K1051 HydrophobicContact CD1-CD 4.17Å; L1048-K1051 WeakPolarHBondContact O-CB 3.41Å; L1048-K1051 PolarHBondContact O-N 2.75Å; L1048-K1051 VanDerWaalsContact O-N 3.13Å; L1048-Y1052 HydrophobicContact CD1-CD2 4.08Å; L1048-Y1052 HydrophobicContact CD1-CE2 3.63Å; L1048-Y1052 HydrophobicContact CD2-CE2 4.45Å; L1048-Y1052 HydrophobicContact CG-CD2 3.94Å; L1048-Y1052 HydrophobicContact CG-CE2 3.86Å; L1048-Y1052 WeakPolarHBondContact O-CD2 3.35Å; L1048-Y1052 PolarHBondContact O-N 2.98Å
1049	E	91	Very high	89.2	Confident	84 Å²	84	87.2 Å²	87.2	39%	0.393	43%	0.428	S	S	.	.	H	α-helix	trans	-58.4	-47.1	170.9	-178.1	173.3	-158.6	0	0	110.9	N1028 L1030 M1045 K1051 Y1052 A1053	N1028-E1049 PolarHBondContact ND2-OE1 3.01Å; L1030-E1049 HydrophobicContact CD1-CB 4.25Å; M1045-E1049 WeakPolarHBondContact O-CB 3.18Å; M1045-E1049 PolarHBondContact O-N 2.94Å; E1049-K1051 PolarHBondContact O-N 3.46Å; E1049-Y1052 CarbonylContact O-C 3.54Å; E1049-Y1052 PolarHBondContact O-N 2.86Å; E1049-Y1052 VanDerWaalsContact O-N 3.13Å; E1049-A1053 PolarHBondContact O-N 2.95Å
1050	A	90	Very high	89.6	Confident	71 Å²	71	86 Å²	86	59%	0.587	42%	0.424	S	S	*	.	H	α-helix	trans	-59.8	-33.6	174.5	0	0	0	0	0	113	K1046	K1046-A1050 WeakPolarHBondContact O-CB 3.27Å; K1046-A1050 PolarHBondContact O-N 3.04Å
1051	K	91.9	Very high	90.1	Very high	141 Å²	141	78.9 Å²	78.9	61%	0.613	40%	0.4	S	S	*	.	H	α-helix	trans	-67.8	-39.4	176	-175.6	-171.9	177.1	-171.4	0	112.2	R1047 L1048 E1049 P1054	R1047-K1051 PolarHBondContact O-N 2.81Å; R1047-K1051 VanDerWaalsContact O-N 3.12Å; L1048-K1051 HydrophobicContact CD1-CD 4.17Å; L1048-K1051 WeakPolarHBondContact O-CB 3.41Å; L1048-K1051 PolarHBondContact O-N 2.75Å; L1048-K1051 VanDerWaalsContact O-N 3.13Å; E1049-K1051 PolarHBondContact O-N 3.46Å; K1051-P1054 WeakPolarHBondContact O-CD 3.4Å
1052	Y	93.1	Very high	90.6	Very high	82 Å²	82	80 Å²	80	32%	0.322	40%	0.403	S	S	.	.	H	α-helix	trans	-96.7	-3.5	-177.2	-70.2	-68.2	0	0	0	114.4	L1030 L1048 E1049 P1054 L1055	L1030-Y1052 HydrophobicContact CD1-CD2 4.39Å; L1030-Y1052 HydrophobicContact CD2-CD2 3.64Å; L1030-Y1052 HydrophobicContact CD2-CE2 4.18Å; L1030-Y1052 HydrophobicContact CD2-CG 4.24Å; L1048-Y1052 HydrophobicContact CD1-CD2 4.08Å; L1048-Y1052 HydrophobicContact CD1-CE2 3.63Å; L1048-Y1052 HydrophobicContact CD2-CE2 4.45Å; L1048-Y1052 HydrophobicContact CG-CD2 3.94Å; L1048-Y1052 HydrophobicContact CG-CE2 3.86Å; L1048-Y1052 WeakPolarHBondContact O-CD2 3.35Å; L1048-Y1052 PolarHBondContact O-N 2.98Å; E1049-Y1052 CarbonylContact O-C 3.54Å; E1049-Y1052 PolarHBondContact O-N 2.86Å; E1049-Y1052 VanDerWaalsContact O-N 3.13Å; Y1052-P1054 VanDerWaalsContact O-N 3.1Å; Y1052-L1055 HydrophobicContact CD1-CD1 3.64Å; Y1052-L1055 HydrophobicContact CD1-CG 4.41Å; Y1052-L1055 HydrophobicContact CE1-CD1 4.24Å; Y1052-L1055 WeakPolarHBondContact O-CB 3.12Å; Y1052-L1055 PolarHBondContact O-N 3.27Å
1053	A	91.5	Very high	91	Very high	53 Å²	53	81.9 Å²	81.9	44%	0.438	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-47.6	-36.2	173.8	0	0	0	0	0	114.6	E1049 L1055 H1056	E1049-A1053 PolarHBondContact O-N 2.95Å; A1053-L1055 PolarHBondContact O-N 3.28Å; A1053-H1056 WeakPolarHBondContact O-CB 3.5Å; A1053-H1056 PolarHBondContact O-N 2.89Å
1054	P	92.6	Very high	91.5	Very high	87 Å²	87	84.7 Å²	84.7	57%	0.565	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-65	-21.1	175.4	-23.1	35.4	0	0	0	115	K1051 Y1052	K1051-P1054 WeakPolarHBondContact O-CD 3.4Å; Y1052-P1054 VanDerWaalsContact O-N 3.1Å
1055	L	92.1	Very high	91.9	Very high	75 Å²	75	82.4 Å²	82.4	39%	0.393	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-86.7	-13.6	178	-56	-173	0	0	0	112.7	Y1052 A1053 L1057	Y1052-L1055 HydrophobicContact CD1-CD1 3.64Å; Y1052-L1055 HydrophobicContact CD1-CG 4.41Å; Y1052-L1055 HydrophobicContact CE1-CD1 4.24Å; Y1052-L1055 WeakPolarHBondContact O-CB 3.12Å; Y1052-L1055 PolarHBondContact O-N 3.27Å; A1053-L1055 PolarHBondContact O-N 3.28Å; L1055-L1057 PolarHBondContact O-N 3.11Å
1056	H	94.1	Very high	92.2	Very high	49 Å²	49	83.1 Å²	83.1	23%	0.227	42%	0.422	C	S	.	.			trans	-69.2	107.2	-177.6	-167.6	177.2	0	0	0	110.1	F1026 A1053 P1059 L1060	F1026-H1056 WeakPolarHBondContact O-CA 3.36Å; F1026-H1056 PolarHBondContact O-CD2 3.27Å; A1053-H1056 WeakPolarHBondContact O-CB 3.5Å; A1053-H1056 PolarHBondContact O-N 2.89Å; H1056-P1059 HydrophobicContact CB-CG 4.49Å; H1056-P1059 WeakPolarHBondContact CD2-CD 3.36Å; H1056-P1059 VanDerWaalsContact CE1-CG 3.48Å; H1056-P1059 WeakPolarHBondContact CE1-CG 3.26Å; H1056-P1059 WeakPolarHBondContact ND1-CG 3.5Å; H1056-P1059 WeakPolarHBondContact NE2-CD 3.21Å; H1056-L1060 VanDerWaalsContact O-CB 3.3Å; H1056-L1060 WeakPolarHBondContact O-CB 3.4Å; H1056-L1060 PolarHBondContact O-N 3.01Å
1057	L	92.5	Very high	92.6	Very high	84 Å²	84	81.4 Å²	81.4	44%	0.44	43%	0.426	S	S	.	.	H	α-helix	trans	-68	-49.2	-162.9	-176	65.3	0	0	0	113	F1026 L1055 L1060 I1061	F1026-L1057 HydrophobicContact CB-CB 4.43Å; F1026-L1057 PolarHBondContact O-N 3.34Å; L1055-L1057 PolarHBondContact O-N 3.11Å; L1057-L1060 WeakPolarHBondContact O-CB 3.45Å; L1057-L1060 PolarHBondContact O-N 3.49Å; L1057-I1061 HydrophobicContact CD1-CD1 3.79Å; L1057-I1061 HydrophobicContact CD1-CG1 4.3Å; L1057-I1061 HydrophobicContact CG-CD1 3.91Å; L1057-I1061 WeakPolarHBondContact O-CG1 3.31Å; L1057-I1061 PolarHBondContact O-N 3.45Å
1058	V	94.1	Very high	92.9	Very high	20 Å²	20	80.2 Å²	80.2	12%	0.121	43%	0.428	C	S	.	.	H	α-helix	trans	-63.5	-51.1	-174.9	176	0	0	0	0	111.6	L1060 I1061 E1062 R1074 D1077	V1058-L1060 VanDerWaalsContact C-N 3.26Å; V1058-L1060 PolarHBondContact O-N 3.06Å; V1058-I1061 PolarHBondContact O-N 3.07Å; V1058-E1062 HydrophobicContact CG1-CG 4.26Å; V1058-E1062 WeakPolarHBondContact O-CB 3.15Å; V1058-E1062 WeakPolarHBondContact O-CG 3.49Å; V1058-E1062 PolarHBondContact O-N 3.42Å; V1058-R1074 HydrophobicContact CG1-CG 4.09Å; V1058-D1077 HydrophobicContact CG2-CB 3.73Å
1059	P	94.1	Very high	93.1	Very high	54 Å²	54	83.2 Å²	83.2	35%	0.351	44%	0.441	S	S	.	.	H	α-helix	trans	-63.4	-29.8	176.6	-25.7	37.9	0	0	0	113.8	H1056 R1063	H1056-P1059 HydrophobicContact CB-CG 4.49Å; H1056-P1059 WeakPolarHBondContact CD2-CD 3.36Å; H1056-P1059 VanDerWaalsContact CE1-CG 3.48Å; H1056-P1059 WeakPolarHBondContact CE1-CG 3.26Å; H1056-P1059 WeakPolarHBondContact ND1-CG 3.5Å; H1056-P1059 WeakPolarHBondContact NE2-CD 3.21Å; P1059-R1063 WeakPolarHBondContact O-CB 3.49Å; P1059-R1063 PolarHBondContact O-N 3.05Å; P1059-R1063 VanDerWaalsContact O-N 3.09Å
1060	L	93.6	Very high	93.2	Very high	56 Å²	56	80.7 Å²	80.7	29%	0.293	43%	0.43	S	S	.	.	H	α-helix	trans	-66.6	-45.5	175.7	-177.8	64.9	0	0	0	111.3	H1056 L1057 V1058 R1063 L1064	H1056-L1060 VanDerWaalsContact O-CB 3.3Å; H1056-L1060 WeakPolarHBondContact O-CB 3.4Å; H1056-L1060 PolarHBondContact O-N 3.01Å; L1057-L1060 WeakPolarHBondContact O-CB 3.45Å; L1057-L1060 PolarHBondContact O-N 3.49Å; V1058-L1060 VanDerWaalsContact C-N 3.26Å; V1058-L1060 PolarHBondContact O-N 3.06Å; L1060-R1063 PolarHBondContact O-N 3.41Å; L1060-L1064 HydrophobicContact CD1-CD1 3.72Å; L1060-L1064 HydrophobicContact CD1-CG 4.5Å; L1060-L1064 HydrophobicContact CG-CD1 4.43Å; L1060-L1064 PolarHBondContact O-N 3.26Å; L1060-L1064 VanDerWaalsContact O-N 3.09Å
1061	I	94.2	Very high	93.4	Very high	41 Å²	41	79.6 Å²	79.6	21%	0.21	42%	0.421	C	S	.	.	H	α-helix	trans	-70.5	-35.4	176.5	-65.3	175.1	0	0	0	110.9	L1057 V1058 R1063 L1064 G1065 Q1069 I1070 A1073	L1057-I1061 HydrophobicContact CD1-CD1 3.79Å; L1057-I1061 HydrophobicContact CD1-CG1 4.3Å; L1057-I1061 HydrophobicContact CG-CD1 3.91Å; L1057-I1061 WeakPolarHBondContact O-CG1 3.31Å; L1057-I1061 PolarHBondContact O-N 3.45Å; V1058-I1061 PolarHBondContact O-N 3.07Å; I1061-R1063 PolarHBondContact O-N 3.23Å; I1061-L1064 PolarHBondContact O-N 3.46Å; I1061-G1065 WeakPolarHBondContact O-CA 3.23Å; I1061-G1065 PolarHBondContact O-N 3.46Å; I1061-Q1069 HydrophobicContact CG2-CB 3.96Å; I1061-I1070 HydrophobicContact CG2-CG1 4.03Å; I1061-A1073 HydrophobicContact CB-CB 4.38Å; I1061-A1073 HydrophobicContact CD1-CB 3.62Å; I1061-A1073 HydrophobicContact CG2-CB 4.14Å
1062	E	93.9	Very high	93.5	Very high	82 Å²	82	78.5 Å²	78.5	38%	0.383	42%	0.421	S	S	.	.	H	α-helix	trans	-62.4	-31.3	173.3	-74.7	178.1	164.1	0	0	112.7	V1058 I1070 R1074	V1058-E1062 HydrophobicContact CG1-CG 4.26Å; V1058-E1062 WeakPolarHBondContact O-CB 3.15Å; V1058-E1062 WeakPolarHBondContact O-CG 3.49Å; V1058-E1062 PolarHBondContact O-N 3.42Å; E1062-I1070 HydrophobicContact CG-CG1 4.31Å; E1062-I1070 HydrophobicContact CG-CG2 3.89Å; E1062-R1074 IonicContact OE1-CZ 3.18Å; E1062-R1074 VanDerWaalsContact OE1-CZ 3.24Å; E1062-R1074 IonicContact OE1-NE 3.92Å; E1062-R1074 PolarHBondContact OE1-NE 3.35Å; E1062-R1074 IonicContact OE1-NH2 3.89Å; E1062-R1074 PolarHBondContact OE1-NH2 3.17Å
1063	R	93.9	Very high	93.5	Very high	183 Å²	183	75.2 Å²	75.2	69%	0.691	41%	0.411	S	S	*	.	H	α-helix	trans	-81.9	-35.4	178.9	-171.4	177.3	65.7	-178.7	-1	113.6	P1059 L1060 I1061	P1059-R1063 WeakPolarHBondContact O-CB 3.49Å; P1059-R1063 PolarHBondContact O-N 3.05Å; P1059-R1063 VanDerWaalsContact O-N 3.09Å; L1060-R1063 PolarHBondContact O-N 3.41Å; I1061-R1063 PolarHBondContact O-N 3.23Å
1064	L	93.5	Very high	93.5	Very high	130 Å²	130	79.4 Å²	79.4	68%	0.681	42%	0.415	S	S	*	.	H	α-helix	trans	-118.9	-16.8	-168.5	-58.9	178.5	0	0	0	114.4	L1060 I1061	L1060-L1064 HydrophobicContact CD1-CD1 3.72Å; L1060-L1064 HydrophobicContact CD1-CG 4.5Å; L1060-L1064 HydrophobicContact CG-CD1 4.43Å; L1060-L1064 PolarHBondContact O-N 3.26Å; L1060-L1064 VanDerWaalsContact O-N 3.09Å; I1061-L1064 PolarHBondContact O-N 3.46Å
1065	G	93.6	Very high	93.6	Very high	24 Å²	24	81.6 Å²	81.6	25%	0.247	42%	0.418	C	S	.	.	S	Bend	trans	-94.3	168	-171.5	0	0	0	0	0	113.8	I1061	I1061-G1065 WeakPolarHBondContact O-CA 3.23Å; I1061-G1065 PolarHBondContact O-N 3.46Å
1066	T	94.6	Very high	93.6	Very high	67 Å²	67	79.4 Å²	79.4	41%	0.411	41%	0.414	S	S	.	.			trans	-77.9	160.8	173.9	61.6	0	0	0	0	111.8	Q1068 Q1069 I1070	T1066-Q1068 PolarHBondContact O-N 3.26Å; T1066-Q1069 PolarHBondContact O-N 2.79Å; T1066-Q1069 WeakPolarHBondContact OG1-CG 3.41Å; T1066-Q1069 PolarHBondContact OG1-N 3.11Å; T1066-Q1069 PolarHBondContact OG1-OE1 3.37Å; T1066-Q1069 VanDerWaalsContact OG1-OE1 3.08Å; T1066-I1070 WeakPolarHBondContact O-CG1 3.36Å; T1066-I1070 PolarHBondContact O-N 3.28Å
1067	P	94.9	Very high	93.5	Very high	108 Å²	108	78.7 Å²	78.7	70%	0.701	41%	0.412	S	S	*	.	H	α-helix	trans	-54.7	-35.4	175.9	-27.3	35.4	0	0	0	114.1	I1070 A1071	P1067-I1070 PolarHBondContact O-N 2.94Å; P1067-A1071 PolarHBondContact O-N 3.48Å; P1067-A1071 VanDerWaalsContact O-N 3.11Å
1068	Q	93.6	Very high	93.5	Very high	153 Å²	153	78.3 Å²	78.3	72%	0.715	41%	0.409	S	S	*	.	H	α-helix	trans	-66.4	-46	176	-68.5	175.3	-9.4	0	0	111.6	T1066 I1070 A1071 I1072	T1066-Q1068 PolarHBondContact O-N 3.26Å; Q1068-I1070 VanDerWaalsContact C-N 3.29Å; Q1068-I1070 PolarHBondContact O-N 3.26Å; Q1068-A1071 PolarHBondContact O-N 3.49Å; Q1068-I1072 VanDerWaalsContact O-CG1 3.29Å; Q1068-I1072 WeakPolarHBondContact O-CG1 3.29Å; Q1068-I1072 PolarHBondContact O-N 3.48Å
1069	Q	92.9	Very high	93.3	Very high	103 Å²	103	83.1 Å²	83.1	48%	0.481	43%	0.434	S	S	.	.	H	α-helix	trans	-63.1	-36.4	176.9	-72.8	166.7	-32.2	0	0	112	I1061 T1066 A1073	I1061-Q1069 HydrophobicContact CG2-CB 3.96Å; T1066-Q1069 PolarHBondContact O-N 2.79Å; T1066-Q1069 WeakPolarHBondContact OG1-CG 3.41Å; T1066-Q1069 PolarHBondContact OG1-N 3.11Å; T1066-Q1069 PolarHBondContact OG1-OE1 3.37Å; T1066-Q1069 VanDerWaalsContact OG1-OE1 3.08Å; Q1069-A1073 WeakPolarHBondContact O-CB 3.14Å; Q1069-A1073 PolarHBondContact O-N 2.7Å
1070	I	93.5	Very high	93.2	Very high	31 Å²	31	82.7 Å²	82.7	16%	0.159	43%	0.431	C	S	.	.	H	α-helix	trans	-64.3	-47	176.5	-65.7	168	0	0	0	110.8	I1061 E1062 T1066 P1067 Q1068 A1073 R1074	I1061-I1070 HydrophobicContact CG2-CG1 4.03Å; E1062-I1070 HydrophobicContact CG-CG1 4.31Å; E1062-I1070 HydrophobicContact CG-CG2 3.89Å; T1066-I1070 WeakPolarHBondContact O-CG1 3.36Å; T1066-I1070 PolarHBondContact O-N 3.28Å; P1067-I1070 PolarHBondContact O-N 2.94Å; Q1068-I1070 VanDerWaalsContact C-N 3.29Å; Q1068-I1070 PolarHBondContact O-N 3.26Å; I1070-A1073 PolarHBondContact O-N 2.79Å; I1070-R1074 WeakPolarHBondContact O-CG 3.33Å; I1070-R1074 PolarHBondContact O-N 3.25Å
1071	A	93.8	Very high	93	Very high	49 Å²	49	84.2 Å²	84.2	41%	0.405	44%	0.435	S	S	.	.	H	α-helix	trans	-59	-49.4	177.3	0	0	0	0	0	111.2	P1067 Q1068 A1073 R1074 E1075	P1067-A1071 PolarHBondContact O-N 3.48Å; P1067-A1071 VanDerWaalsContact O-N 3.11Å; Q1068-A1071 PolarHBondContact O-N 3.49Å; A1071-A1073 VanDerWaalsContact C-N 3.35Å; A1071-A1073 PolarHBondContact O-N 2.84Å; A1071-R1074 PolarHBondContact O-N 3.11Å; A1071-E1075 PolarHBondContact O-N 3.23Å
1072	I	93.9	Very high	92.9	Very high	117 Å²	117	88.5 Å²	88.5	60%	0.6	45%	0.454	S	S	*	.	H	α-helix	trans	-61	-42.9	178.3	-65.8	165.5	0	0	0	111.3	Q1068 E1075 G1076	Q1068-I1072 VanDerWaalsContact O-CG1 3.29Å; Q1068-I1072 WeakPolarHBondContact O-CG1 3.29Å; Q1068-I1072 PolarHBondContact O-N 3.48Å; I1072-E1075 PolarHBondContact O-N 2.98Å; I1072-G1076 PolarHBondContact O-N 2.95Å
1073	A	92.4	Very high	92.7	Very high	14 Å²	14	87.1 Å²	87.1	12%	0.116	45%	0.445	C	S	.	.	H	α-helix	trans	-65.8	-38.7	179.8	0	0	0	0	0	112.4	I1061 Q1069 I1070 A1071 D1077	I1061-A1073 HydrophobicContact CB-CB 4.38Å; I1061-A1073 HydrophobicContact CD1-CB 3.62Å; I1061-A1073 HydrophobicContact CG2-CB 4.14Å; Q1069-A1073 WeakPolarHBondContact O-CB 3.14Å; Q1069-A1073 PolarHBondContact O-N 2.7Å; I1070-A1073 PolarHBondContact O-N 2.79Å; A1071-A1073 VanDerWaalsContact C-N 3.35Å; A1071-A1073 PolarHBondContact O-N 2.84Å; A1073-D1077 VanDerWaalsContact O-CB 3.3Å; A1073-D1077 WeakPolarHBondContact O-CB 3.44Å; A1073-D1077 PolarHBondContact O-N 3.37Å
1074	R	92.7	Very high	92.5	Very high	141 Å²	141	80.4 Å²	80.4	53%	0.532	42%	0.423	S	S	.	.	H	α-helix	trans	-66.9	-42.2	175.9	-74.1	177.9	-179.8	171.4	-0.1	111.9	V1058 E1062 I1070 A1071 L1078	V1058-R1074 HydrophobicContact CG1-CG 4.09Å; E1062-R1074 IonicContact OE1-CZ 3.18Å; E1062-R1074 VanDerWaalsContact OE1-CZ 3.24Å; E1062-R1074 IonicContact OE1-NE 3.92Å; E1062-R1074 PolarHBondContact OE1-NE 3.35Å; E1062-R1074 IonicContact OE1-NH2 3.89Å; E1062-R1074 PolarHBondContact OE1-NH2 3.17Å; I1070-R1074 WeakPolarHBondContact O-CG 3.33Å; I1070-R1074 PolarHBondContact O-N 3.25Å; A1071-R1074 PolarHBondContact O-N 3.11Å; R1074-L1078 WeakPolarHBondContact O-CB 3.44Å; R1074-L1078 PolarHBondContact O-N 3.39Å
1075	E	93.5	Very high	92.4	Very high	132 Å²	132	76.5 Å²	76.5	62%	0.617	41%	0.406	S	S	*	.	H	α-helix	trans	-64.9	-45.5	174.7	-72.3	-178.4	-176.6	0	0	111.5	A1071 I1072 D1077 L1078 L1079	A1071-E1075 PolarHBondContact O-N 3.23Å; I1072-E1075 PolarHBondContact O-N 2.98Å; E1075-D1077 PolarHBondContact O-N 3.15Å; E1075-L1078 WeakPolarHBondContact O-CB 3.33Å; E1075-L1078 PolarHBondContact O-N 3.42Å; E1075-L1079 WeakPolarHBondContact O-CG 3.5Å; E1075-L1079 PolarHBondContact O-N 3.37Å
1076	G	92.6	Very high	92.1	Very high	30 Å²	30	79.2 Å²	79.2	31%	0.309	42%	0.42	S	S	.	.	H	α-helix	trans	-62.1	-41.3	177	0	0	0	0	0	113	I1072 T1080	I1072-G1076 PolarHBondContact O-N 2.95Å; G1076-T1080 WeakPolarHBondContact O-CB 3.22Å; G1076-T1080 PolarHBondContact O-N 2.81Å; G1076-T1080 PolarHBondContact O-OG1 3.06Å
1077	D	92.3	Very high	91.5	Very high	34 Å²	34	79.4 Å²	79.4	18%	0.182	44%	0.436	C	S	.	.	H	α-helix	trans	-62.1	-43.2	173.9	178.6	70.9	0	0	0	111.9	Q1027 V1058 A1073 E1075 T1080 K1081	Q1027-D1077 WeakPolarHBondContact CG-OD1 3.31Å; Q1027-D1077 PolarHBondContact NE2-O 3.06Å; Q1027-D1077 PolarHBondContact NE2-OD1 2.98Å; V1058-D1077 HydrophobicContact CG2-CB 3.73Å; A1073-D1077 VanDerWaalsContact O-CB 3.3Å; A1073-D1077 WeakPolarHBondContact O-CB 3.44Å; A1073-D1077 PolarHBondContact O-N 3.37Å; E1075-D1077 PolarHBondContact O-N 3.15Å; D1077-T1080 PolarHBondContact O-N 2.81Å; D1077-T1080 VanDerWaalsContact O-N 3.14Å; D1077-K1081 WeakPolarHBondContact O-CG 3.36Å; D1077-K1081 PolarHBondContact O-N 3.39Å; D1077-K1081 IonicContact OD2-NZ 2.71Å; D1077-K1081 PolarHBondContact OD2-NZ 3.42Å
1078	L	92.2	Very high	91.1	Very high	75 Å²	75	80.1 Å²	80.1	39%	0.393	43%	0.433	S	S	.	.	H	α-helix	trans	-59.9	-50.6	178	-171.6	66.1	0	0	0	111.5	R1074 E1075 T1080 K1081 E1082	R1074-L1078 WeakPolarHBondContact O-CB 3.44Å; R1074-L1078 PolarHBondContact O-N 3.39Å; E1075-L1078 WeakPolarHBondContact O-CB 3.33Å; E1075-L1078 PolarHBondContact O-N 3.42Å; L1078-T1080 PolarHBondContact O-N 3.41Å; L1078-K1081 PolarHBondContact O-N 3.34Å; L1078-E1082 VanDerWaalsContact CD1-CD 3.43Å; L1078-E1082 HydrophobicContact CD1-CG 4.1Å; L1078-E1082 WeakPolarHBondContact CD1-OE1 3.34Å; L1078-E1082 WeakPolarHBondContact O-CB 3.38Å; L1078-E1082 PolarHBondContact O-N 2.99Å
1079	L	90.8	Very high	90.7	Very high	122 Å²	122	75 Å²	75	64%	0.639	41%	0.414	S	S	*	.	H	α-helix	trans	-62.1	-27.4	176.2	-67.9	174.1	0	0	0	112.7	E1075 R1083	E1075-L1079 WeakPolarHBondContact O-CG 3.5Å; E1075-L1079 PolarHBondContact O-N 3.37Å; L1079-R1083 PolarHBondContact O-NE 3.47Å; L1079-R1083 PolarHBondContact O-NH1 3.4Å; L1079-R1083 VanDerWaalsContact O-NH1 3.09Å; L1079-R1083 PolarHBondContact O-NH2 3.48Å
1080	T	91.1	Very high	90.5	Very high	45 Å²	45	72.1 Å²	72.1	28%	0.276	40%	0.401	S	S	.	.	H	α-helix	trans	-78.4	-41	-178.7	-57.4	0	0	0	0	112.2	L1020 A1023 G1076 D1077 L1078 R1083	L1020-T1080 WeakPolarHBondContact CD2-O 3.39Å; A1023-T1080 HydrophobicContact CB-CG2 3.44Å; A1023-T1080 VanDerWaalsContact CB-CG2 3.44Å; G1076-T1080 WeakPolarHBondContact O-CB 3.22Å; G1076-T1080 PolarHBondContact O-N 2.81Å; G1076-T1080 PolarHBondContact O-OG1 3.06Å; D1077-T1080 PolarHBondContact O-N 2.81Å; D1077-T1080 VanDerWaalsContact O-N 3.14Å; L1078-T1080 PolarHBondContact O-N 3.41Å; T1080-R1083 PolarHBondContact O-NE 3.22Å
1081	K	89.4	Confident	90.3	Very high	88 Å²	88	70.7 Å²	70.7	38%	0.383	39%	0.393	S	S	.	.	H	α-helix	trans	-83.3	-29.2	-178.3	71.3	-165	176.6	-149.9	0	114	D1077 L1078 R1083 C1086	D1077-K1081 WeakPolarHBondContact O-CG 3.36Å; D1077-K1081 PolarHBondContact O-N 3.39Å; D1077-K1081 IonicContact OD2-NZ 2.71Å; D1077-K1081 PolarHBondContact OD2-NZ 3.42Å; L1078-K1081 PolarHBondContact O-N 3.34Å; K1081-R1083 PolarHBondContact O-N 3.37Å; K1081-C1086 PolarHBondContact O-SG 3.04Å
1082	E	91.2	Very high	89.9	Confident	131 Å²	131	70.2 Å²	70.2	61%	0.612	38%	0.383	S	S	*	.			trans	-88.6	94.4	-179.6	-64.7	-172.8	168.8	0	0	110.3	L1078	L1078-E1082 VanDerWaalsContact CD1-CD 3.43Å; L1078-E1082 HydrophobicContact CD1-CG 4.1Å; L1078-E1082 WeakPolarHBondContact CD1-OE1 3.34Å; L1078-E1082 WeakPolarHBondContact O-CB 3.38Å; L1078-E1082 PolarHBondContact O-N 2.99Å
1083	R	90.9	Very high	89.7	Confident	52 Å²	52	68.5 Å²	68.5	20%	0.196	38%	0.378	C	S	.	.			trans	-120.1	159.5	178.1	-56.1	-58.3	-177.5	-179.6	7	110.5	E1016 L1020 L1079 T1080 K1081 C1085 C1086	E1016-R1083 HydrophobicContact CB-CB 4Å; E1016-R1083 HydrophobicContact CB-CG 4.32Å; E1016-R1083 HydrophobicContact CG-CB 4.07Å; E1016-R1083 HydrophobicContact CG-CG 4.45Å; L1020-R1083 HydrophobicContact CD1-CB 4.35Å; L1020-R1083 HydrophobicContact CD1-CG 4.23Å; L1020-R1083 HydrophobicContact CD2-CG 3.99Å; L1020-R1083 HydrophobicContact CG-CG 4.06Å; L1079-R1083 PolarHBondContact O-NE 3.47Å; L1079-R1083 PolarHBondContact O-NH1 3.4Å; L1079-R1083 VanDerWaalsContact O-NH1 3.09Å; L1079-R1083 PolarHBondContact O-NH2 3.48Å; T1080-R1083 PolarHBondContact O-NE 3.22Å; K1081-R1083 PolarHBondContact O-N 3.37Å; R1083-C1085 VanDerWaalsContact C-N 3.32Å; R1083-C1085 PolarHBondContact O-N 2.99Å; R1083-C1086 VanDerWaalsContact O-CB 3.3Å; R1083-C1086 WeakPolarHBondContact O-CB 3.13Å; R1083-C1086 PolarHBondContact O-N 3.49Å
1084	L	89.5	Confident	89.6	Confident	42 Å²	42	68.4 Å²	68.4	22%	0.22	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-63.3	-40.1	-178.2	-64.3	177	0	0	0	111.4	Y921 L1012 E1016 C1086 G1087 L1088 M1090	Y921-L1084 HydrophobicContact CD1-CD1 4.29Å; Y921-L1084 HydrophobicContact CE1-CD1 4.03Å; Y921-L1084 HydrophobicContact CE1-CG 4.22Å; L1012-L1084 HydrophobicContact CD2-CD1 3.72Å; E1016-L1084 PolarHBondContact OE1-N 3.34Å; E1016-L1084 PolarHBondContact OE2-N 3.47Å; L1084-C1086 PolarHBondContact O-N 2.92Å; L1084-G1087 PolarHBondContact O-N 3.31Å; L1084-G1087 VanDerWaalsContact O-N 3.14Å; L1084-L1088 HydrophobicContact CD2-CB 4.13Å; L1084-L1088 HydrophobicContact CD2-CD1 3.85Å; L1084-L1088 PolarHBondContact O-N 2.91Å; L1084-L1088 VanDerWaalsContact O-O 3.13Å; L1084-M1090 HydrophobicContact CD1-CE 3.92Å; L1084-M1090 HydrophobicContact CD1-SD 3.98Å
1085	C	90.4	Very high	89.4	Confident	48 Å²	48	61.8 Å²	61.8	32%	0.324	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-60.6	-12.7	179	73.2	0	0	0	0	114.8	E1016 R1083 G1087	E1016-C1085 HydrophobicContact CB-CB 4.34Å; E1016-C1085 WeakPolarHBondContact OE2-CB 2.95Å; E1016-C1085 PolarHBondContact OE2-N 2.87Å; R1083-C1085 VanDerWaalsContact C-N 3.32Å; R1083-C1085 PolarHBondContact O-N 2.99Å; C1085-G1087 VanDerWaalsContact C-N 3.28Å; C1085-G1087 PolarHBondContact O-N 3.27Å
1086	C	87.6	Confident	89.2	Confident	82 Å²	82	58.4 Å²	58.4	55%	0.554	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-72.9	-16.2	176.9	-64.2	0	0	0	0	113.5	K1081 R1083 L1084	K1081-C1086 PolarHBondContact O-SG 3.04Å; R1083-C1086 VanDerWaalsContact O-CB 3.3Å; R1083-C1086 WeakPolarHBondContact O-CB 3.13Å; R1083-C1086 PolarHBondContact O-N 3.49Å; L1084-C1086 PolarHBondContact O-N 2.92Å
1087	G	83.1	Confident	89.2	Confident	71 Å²	71	61.5 Å²	61.5	73%	0.732	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	165.8	10.1	177.4	0	0	0	0	0	117.2	L1084 C1085	L1084-G1087 PolarHBondContact O-N 3.31Å; L1084-G1087 VanDerWaalsContact O-N 3.14Å; C1085-G1087 VanDerWaalsContact C-N 3.28Å; C1085-G1087 PolarHBondContact O-N 3.27Å
1088	L	85.9	Confident	89.2	Confident	123 Å²	123	60 Å²	60	64%	0.644	33%	0.333	S	S	*	.			trans	-114.5	146.4	-179.8	-61.9	173.3	0	0	0	110.3	L1084	L1084-L1088 HydrophobicContact CD2-CB 4.13Å; L1084-L1088 HydrophobicContact CD2-CD1 3.85Å; L1084-L1088 PolarHBondContact O-N 2.91Å; L1084-L1088 VanDerWaalsContact O-O 3.13Å
1089	S	84.9	Confident	89.1	Confident	45 Å²	45	63 Å²	63	32%	0.315	34%	0.339	S	S	.	.			trans	-131.7	140.9	172	92.9	0	0	0	0	111.1	E1009	E1009-S1089 VanDerWaalsContact OE1-CA 3.28Å; E1009-S1089 WeakPolarHBondContact OE1-CA 3.34Å
1090	M	87.9	Confident	89.1	Confident	43 Å²	43	59.8 Å²	59.8	21%	0.212	33%	0.327	C	S	.	.	S	Bend	trans	-95.8	-36.8	-177.7	-64.3	-178.4	-73.8	0	0	111.7	M928 E1009 L1012 L1084 E1092 V1093 I1094	M928-M1090 HydrophobicContact CE-CE 3.85Å; M928-M1090 HydrophobicContact CE-SD 4.17Å; M928-M1090 HydrophobicContact SD-CE 4.46Å; M928-M1090 HydrophobicContact SD-SD 4Å; E1009-M1090 HydrophobicContact CB-CE 3.91Å; E1009-M1090 HydrophobicContact CG-CE 3.76Å; E1009-M1090 PolarHBondContact OE1-N 3.43Å; E1009-M1090 PolarHBondContact OE2-N 3.35Å; L1012-M1090 HydrophobicContact CD2-CE 3.87Å; L1084-M1090 HydrophobicContact CD1-CE 3.92Å; L1084-M1090 HydrophobicContact CD1-SD 3.98Å; M1090-E1092 VanDerWaalsContact C-N 3.25Å; M1090-E1092 PolarHBondContact O-N 2.68Å; M1090-V1093 WeakPolarHBondContact O-CA 3.17Å; M1090-V1093 WeakPolarHBondContact O-CB 3.4Å; M1090-V1093 PolarHBondContact O-N 2.88Å; M1090-I1094 WeakPolarHBondContact O-CG1 3.4Å; M1090-I1094 PolarHBondContact O-N 3.14Å
1091	F	89.2	Confident	89.2	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-57.2	-36.7	-174.1	-169.2	-117.7	0	0	0	113.4	I1002 L1006 E1009 V1093 I1094 L1095 W1157 L1220 Y1223	I1002-F1091 HydrophobicContact CG2-CE2 3.69Å; I1002-F1091 HydrophobicContact CG2-CZ 3.83Å; L1006-F1091 HydrophobicContact CB-CD2 3.89Å; L1006-F1091 HydrophobicContact CB-CE2 3.7Å; L1006-F1091 HydrophobicContact CB-CZ 4.21Å; L1006-F1091 HydrophobicContact CD1-CD1 4.01Å; L1006-F1091 HydrophobicContact CD1-CD2 4.16Å; L1006-F1091 HydrophobicContact CD1-CE1 4.19Å; L1006-F1091 HydrophobicContact CD1-CE2 4.35Å; L1006-F1091 HydrophobicContact CD1-CG 4Å; L1006-F1091 HydrophobicContact CD1-CZ 4.36Å; L1006-F1091 HydrophobicContact CD2-CZ 4.4Å; L1006-F1091 HydrophobicContact CG-CE2 4.45Å; E1009-F1091 VanDerWaalsContact OE2-CB 3.26Å; E1009-F1091 WeakPolarHBondContact OE2-CB 3.43Å; E1009-F1091 PolarHBondContact OE2-N 3.03Å; F1091-V1093 PolarHBondContact O-N 2.96Å; F1091-I1094 PolarHBondContact O-N 3.46Å; F1091-L1095 HydrophobicContact CD1-CD1 3.97Å; F1091-L1095 HydrophobicContact CD1-CG 4.42Å; F1091-L1095 HydrophobicContact CE1-CD1 3.63Å; F1091-L1095 HydrophobicContact CE1-CG 4.16Å; F1091-L1095 HydrophobicContact CZ-CD1 4.11Å; F1091-L1095 HydrophobicContact CZ-CD2 4.2Å; F1091-L1095 HydrophobicContact CZ-CG 4.22Å; F1091-L1095 WeakPolarHBondContact O-CG 3.37Å; F1091-L1095 PolarHBondContact O-N 2.9Å; F1091-W1157 HydrophobicContact CZ-CZ3 4.33Å; F1091-L1220 HydrophobicContact CE1-CD2 4.27Å; F1091-L1220 HydrophobicContact CZ-CD2 4.22Å; F1091-Y1223 HydrophobicContact CD1-CD1 4.06Å; F1091-Y1223 AromaticContact CD1-CD2 3.69Å; F1091-Y1223 HydrophobicContact CD1-CD2 3.69Å; F1091-Y1223 HydrophobicContact CD1-CE1 4.5Å; F1091-Y1223 HydrophobicContact CD1-CE2 4.16Å; F1091-Y1223 AromaticContact CD1-CG 3.64Å; F1091-Y1223 HydrophobicContact CD1-CG 3.64Å; F1091-Y1223 AromaticContact CE1-CD2 3.91Å; F1091-Y1223 HydrophobicContact CE1-CD2 3.91Å; F1091-Y1223 HydrophobicContact CE1-CE2 4.43Å; F1091-Y1223 HydrophobicContact CE1-CG 4.23Å
1092	E	86.6	Confident	89.3	Confident	39 Å²	39	54.4 Å²	54.4	18%	0.182	30%	0.3	C	S	.	.	H	α-helix	trans	-59.6	-44	173.8	-179.5	-176.1	165.4	0	0	112.4	M1090 L1095 T1096 A1226 V1227	M1090-E1092 VanDerWaalsContact C-N 3.25Å; M1090-E1092 PolarHBondContact O-N 2.68Å; E1092-L1095 PolarHBondContact O-N 3.46Å; E1092-T1096 WeakPolarHBondContact O-CB 3.22Å; E1092-T1096 PolarHBondContact O-N 3.02Å; E1092-T1096 PolarHBondContact O-OG1 2.93Å; E1092-A1226 WeakPolarHBondContact OE2-CB 3.33Å; E1092-V1227 HydrophobicContact CG-CG2 3.75Å; E1092-V1227 WeakPolarHBondContact OE1-CG2 3.45Å; E1092-V1227 PolarHBondContact OE1-N 3.28Å
1093	V	88.7	Confident	89.1	Confident	82 Å²	82	55.3 Å²	55.3	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-66.3	-41.5	177.9	-178.4	0	0	0	0	110.6	M1090 F1091 T1096 R1097	M1090-V1093 WeakPolarHBondContact O-CA 3.17Å; M1090-V1093 WeakPolarHBondContact O-CB 3.4Å; M1090-V1093 PolarHBondContact O-N 2.88Å; F1091-V1093 PolarHBondContact O-N 2.96Å; V1093-T1096 PolarHBondContact O-N 3.38Å; V1093-R1097 WeakPolarHBondContact O-CG 3.39Å; V1093-R1097 PolarHBondContact O-N 3.32Å
1094	I	90.4	Very high	89.1	Confident	12 Å²	12	55.4 Å²	55.4	6%	0.062	31%	0.308	C	S	.	.	H	α-helix	trans	-58.2	-51.8	175.8	-62.2	-55.4	0	0	0	110.4	M928 L932 C1005 M1090 F1091 T1096 R1097 I1098	M928-I1094 HydrophobicContact CB-CD1 4.46Å; M928-I1094 HydrophobicContact SD-CD1 4.49Å; L932-I1094 HydrophobicContact CD1-CD1 3.72Å; L932-I1094 HydrophobicContact CD2-CD1 4.37Å; L932-I1094 HydrophobicContact CD2-CG2 3.93Å; L932-I1094 HydrophobicContact CG-CD1 4.09Å; C1005-I1094 HydrophobicContact CB-CG2 4.49Å; M1090-I1094 WeakPolarHBondContact O-CG1 3.4Å; M1090-I1094 PolarHBondContact O-N 3.14Å; F1091-I1094 PolarHBondContact O-N 3.46Å; I1094-T1096 PolarHBondContact O-N 3.25Å; I1094-R1097 PolarHBondContact O-N 3.05Å; I1094-I1098 HydrophobicContact CG2-CD1 3.93Å; I1094-I1098 WeakPolarHBondContact O-CG1 3.47Å; I1094-I1098 PolarHBondContact O-N 3.43Å
1095	L	90.1	Very high	89	Confident	1 Å²	1	57 Å²	57	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-61.4	-42.2	179.2	-71.2	-179.2	0	0	0	112.3	F1091 E1092 R1097 I1098 R1099 L1165 L1220 M1224	F1091-L1095 HydrophobicContact CD1-CD1 3.97Å; F1091-L1095 HydrophobicContact CD1-CG 4.42Å; F1091-L1095 HydrophobicContact CE1-CD1 3.63Å; F1091-L1095 HydrophobicContact CE1-CG 4.16Å; F1091-L1095 HydrophobicContact CZ-CD1 4.11Å; F1091-L1095 HydrophobicContact CZ-CD2 4.2Å; F1091-L1095 HydrophobicContact CZ-CG 4.22Å; F1091-L1095 WeakPolarHBondContact O-CG 3.37Å; F1091-L1095 PolarHBondContact O-N 2.9Å; E1092-L1095 PolarHBondContact O-N 3.46Å; L1095-R1097 VanDerWaalsContact C-N 3.33Å; L1095-R1097 PolarHBondContact O-N 3.34Å; L1095-I1098 PolarHBondContact O-N 2.88Å; L1095-R1099 PolarHBondContact O-N 3.16Å; L1095-L1165 HydrophobicContact CB-CD2 4.17Å; L1095-L1165 WeakPolarHBondContact O-CD2 3.33Å; L1095-L1220 HydrophobicContact CD1-CD2 3.93Å; L1095-L1220 HydrophobicContact CD2-CD2 4.03Å; L1095-M1224 HydrophobicContact CB-SD 3.78Å; L1095-M1224 HydrophobicContact CD1-CG 4.22Å; L1095-M1224 HydrophobicContact CD1-SD 4.18Å
1096	T	89.1	Confident	88.9	Confident	61 Å²	61	56 Å²	56	37%	0.374	32%	0.32	S	S	.	.	H	α-helix	trans	-62	-40.6	177.5	-59.2	0	0	0	0	111.7	E1092 V1093 I1094 R1099 S1100	E1092-T1096 WeakPolarHBondContact O-CB 3.22Å; E1092-T1096 PolarHBondContact O-N 3.02Å; E1092-T1096 PolarHBondContact O-OG1 2.93Å; V1093-T1096 PolarHBondContact O-N 3.38Å; I1094-T1096 PolarHBondContact O-N 3.25Å; T1096-R1099 WeakPolarHBondContact O-CB 3.39Å; T1096-R1099 PolarHBondContact O-N 3.09Å; T1096-S1100 PolarHBondContact O-N 2.95Å
1097	R	91.2	Very high	89	Confident	95 Å²	95	52.2 Å²	52.2	36%	0.358	29%	0.294	S	S	.	.	H	α-helix	trans	-67.8	-40.6	174.4	-73.8	-178.1	71.1	-176.3	-4.4	112	E929 L932 V1093 I1094 L1095 R1099 S1100	E929-R1097 IonicContact OE1-CZ 3.51Å; E929-R1097 IonicContact OE1-NH1 2.63Å; E929-R1097 PolarHBondContact OE1-NH1 3.02Å; E929-R1097 IonicContact OE1-NH2 2.78Å; E929-R1097 IonicContact OE2-CZ 3.97Å; E929-R1097 IonicContact OE2-NH1 2.88Å; E929-R1097 PolarHBondContact OE2-NH1 3.23Å; E929-R1097 IonicContact OE2-NH2 3.08Å; E929-R1097 PolarHBondContact OE2-NH2 2.91Å; L932-R1097 HydrophobicContact CD1-CB 4.48Å; V1093-R1097 WeakPolarHBondContact O-CG 3.39Å; V1093-R1097 PolarHBondContact O-N 3.32Å; I1094-R1097 PolarHBondContact O-N 3.05Å; L1095-R1097 VanDerWaalsContact C-N 3.33Å; L1095-R1097 PolarHBondContact O-N 3.34Å; R1097-R1099 VanDerWaalsContact C-N 3.28Å; R1097-R1099 PolarHBondContact O-N 3.44Å; R1097-S1100 WeakPolarHBondContact O-CB 3.49Å; R1097-S1100 PolarHBondContact O-N 3.13Å; R1097-S1100 PolarHBondContact O-OG 3.27Å
1098	I	92.7	Very high	89.2	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-38	175.7	-66	169	0	0	0	111.1	L932 V935 L939 I1002 I1094 L1095 S1100 F1101 L1165	L932-I1098 HydrophobicContact CD2-CD1 4.25Å; L932-I1098 HydrophobicContact CD2-CG1 3.78Å; V935-I1098 HydrophobicContact CG1-CD1 4.23Å; V935-I1098 HydrophobicContact CG1-CG1 4.11Å; V935-I1098 HydrophobicContact CG1-CG2 4.34Å; L939-I1098 HydrophobicContact CD1-CG2 3.86Å; I1002-I1098 HydrophobicContact CD1-CD1 4.13Å; I1002-I1098 HydrophobicContact CG1-CD1 3.88Å; I1094-I1098 HydrophobicContact CG2-CD1 3.93Å; I1094-I1098 WeakPolarHBondContact O-CG1 3.47Å; I1094-I1098 PolarHBondContact O-N 3.43Å; L1095-I1098 PolarHBondContact O-N 2.88Å; I1098-S1100 PolarHBondContact O-N 3.41Å; I1098-F1101 HydrophobicContact CB-CD2 4.44Å; I1098-F1101 HydrophobicContact CG1-CD2 4.42Å; I1098-F1101 HydrophobicContact CG1-CE2 4.23Å; I1098-F1101 WeakPolarHBondContact O-CB 3.45Å; I1098-F1101 PolarHBondContact O-N 3.05Å; I1098-L1165 HydrophobicContact CB-CD1 3.98Å; I1098-L1165 HydrophobicContact CG2-CD1 3.6Å
1099	R	90.5	Very high	89.2	Confident	138 Å²	138	48.9 Å²	48.9	52%	0.521	26%	0.257	S	S	.	.	H	α-helix	trans	-55.3	-37.1	174.1	-171.5	176.7	122.7	-179.5	0.3	112.2	L1095 T1096 R1097 F1101 L1102 L1165	L1095-R1099 PolarHBondContact O-N 3.16Å; T1096-R1099 WeakPolarHBondContact O-CB 3.39Å; T1096-R1099 PolarHBondContact O-N 3.09Å; R1097-R1099 VanDerWaalsContact C-N 3.28Å; R1097-R1099 PolarHBondContact O-N 3.44Å; R1099-F1101 PolarHBondContact O-N 2.85Å; R1099-L1102 PolarHBondContact O-N 3.23Å; R1099-L1165 HydrophobicContact CB-CB 4.27Å; R1099-L1165 HydrophobicContact CB-CD2 4.19Å; R1099-L1165 HydrophobicContact CG-CB 4.3Å
1100	S	91.5	Very high	89.2	Confident	54 Å²	54	50 Å²	50	38%	0.378	26%	0.264	S	S	.	.	H	α-helix	trans	-67.4	-18	178.4	81.6	0	0	0	0	113.6	T1096 R1097 I1098 L1102 Q1103	T1096-S1100 PolarHBondContact O-N 2.95Å; R1097-S1100 WeakPolarHBondContact O-CB 3.49Å; R1097-S1100 PolarHBondContact O-N 3.13Å; R1097-S1100 PolarHBondContact O-OG 3.27Å; I1098-S1100 PolarHBondContact O-N 3.41Å; S1100-L1102 VanDerWaalsContact C-N 3.34Å; S1100-Q1103 WeakPolarHBondContact O-CG 3.31Å; S1100-Q1103 PolarHBondContact O-NE2 3.47Å
1101	F	92.5	Very high	89	Confident	20 Å²	20	53.4 Å²	53.4	9%	0.088	29%	0.289	C	S	.	.	H	α-helix	trans	-79.6	-20.3	177.5	-52.4	-24.2	0	0	0	112.2	L932 K936 Q940 I1098 R1099 Q1103	L932-F1101 HydrophobicContact CD2-CE2 4.3Å; K936-F1101 HydrophobicContact CB-CD1 4.29Å; K936-F1101 HydrophobicContact CB-CD2 3.77Å; K936-F1101 HydrophobicContact CB-CE1 4.24Å; K936-F1101 HydrophobicContact CB-CE2 3.71Å; K936-F1101 HydrophobicContact CB-CG 4.08Å; K936-F1101 HydrophobicContact CB-CZ 3.96Å; K936-F1101 HydrophobicContact CD-CD1 4.08Å; K936-F1101 HydrophobicContact CD-CE1 3.92Å; K936-F1101 HydrophobicContact CD-CZ 4.32Å; K936-F1101 HydrophobicContact CG-CD1 3.91Å; K936-F1101 HydrophobicContact CG-CD2 4.2Å; K936-F1101 HydrophobicContact CG-CE1 4.11Å; K936-F1101 HydrophobicContact CG-CE2 4.38Å; K936-F1101 HydrophobicContact CG-CG 3.98Å; K936-F1101 HydrophobicContact CG-CZ 4.34Å; Q940-F1101 PolarHBondContact NE2-O 3.38Å; Q940-F1101 VanDerWaalsContact NE2-O 3.11Å; I1098-F1101 HydrophobicContact CB-CD2 4.44Å; I1098-F1101 HydrophobicContact CG1-CD2 4.42Å; I1098-F1101 HydrophobicContact CG1-CE2 4.23Å; I1098-F1101 WeakPolarHBondContact O-CB 3.45Å; I1098-F1101 PolarHBondContact O-N 3.05Å; R1099-F1101 PolarHBondContact O-N 2.85Å; F1101-Q1103 PolarHBondContact O-N 3.42Å
1102	L	91.4	Very high	88.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.298	C	S	.	.			trans	-94.1	54.6	-177.2	-56.8	172.4	0	0	0	112.3	L939 R1099 S1100 W1107 R1108 I1162 L1165 L1166	L939-L1102 HydrophobicContact CD1-CD2 4.28Å; L939-L1102 HydrophobicContact CD2-CD2 4.44Å; R1099-L1102 PolarHBondContact O-N 3.23Å; S1100-L1102 VanDerWaalsContact C-N 3.34Å; L1102-W1107 HydrophobicContact CB-CG 4.49Å; L1102-W1107 HydrophobicContact CD2-CD2 3.91Å; L1102-W1107 HydrophobicContact CD2-CE3 4.26Å; L1102-W1107 HydrophobicContact CD2-CG 4.41Å; L1102-W1107 HydrophobicContact CD2-CH2 4.19Å; L1102-W1107 HydrophobicContact CD2-CZ2 3.85Å; L1102-W1107 HydrophobicContact CD2-CZ3 4.37Å; L1102-R1108 PolarHBondContact O-NH1 3.33Å; L1102-R1108 PolarHBondContact O-NH2 2.86Å; L1102-R1108 VanDerWaalsContact O-NH2 3.1Å; L1102-I1162 HydrophobicContact CD1-CG2 4.08Å; L1102-I1162 HydrophobicContact CD2-CG2 4.49Å; L1102-L1165 HydrophobicContact CD1-CB 4.23Å; L1102-L1166 HydrophobicContact CB-CD2 4.1Å; L1102-L1166 HydrophobicContact CD1-CD2 4.29Å; L1102-L1166 HydrophobicContact CD1-CG 4.24Å
1103	Q	87.8	Confident	88.8	Confident	150 Å²	150	58.7 Å²	58.7	70%	0.701	32%	0.324	S	S	*	.			trans	-91.7	-21.6	-178.9	-73.1	-179.1	11.6	0	0	114.4	S1100 F1101	S1100-Q1103 WeakPolarHBondContact O-CG 3.31Å; S1100-Q1103 PolarHBondContact O-NE2 3.47Å; F1101-Q1103 PolarHBondContact O-N 3.42Å
1104	D	90.6	Very high	88.6	Confident	54 Å²	54	58.7 Å²	58.7	29%	0.289	32%	0.321	S	S	.	.	S	Bend	trans	-58.4	140.7	-179.9	-166.7	-63.1	0	0	0	111.2	L944 K948 V1106 W1107	L944-D1104 HydrophobicContact CD1-CB 4Å; L944-D1104 HydrophobicContact CD2-CB 4.39Å; K948-D1104 VanDerWaalsContact CE-OD2 3.28Å; K948-D1104 WeakPolarHBondContact CE-OD2 3.41Å; K948-D1104 IonicContact NZ-OD1 2.87Å; K948-D1104 IonicContact NZ-OD2 2.89Å; K948-D1104 PolarHBondContact NZ-OD2 3.25Å; D1104-V1106 HydrophobicContact CB-CG1 4.34Å; D1104-V1106 PolarHBondContact O-N 2.91Å; D1104-V1106 WeakPolarHBondContact OD1-CB 3.38Å; D1104-V1106 WeakPolarHBondContact OD1-CG1 3.3Å; D1104-V1106 PolarHBondContact OD1-N 3.14Å; D1104-W1107 VanDerWaalsContact O-CD1 3.28Å; D1104-W1107 PolarHBondContact O-N 3.25Å
1105	A	87.4	Confident	88.3	Confident	75 Å²	75	59.3 Å²	59.3	62%	0.62	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-62.2	-27.7	-177	0	0	0	0	0	112.4	W1107 R1108 G1109	A1105-W1107 PolarHBondContact O-N 2.91Å; A1105-W1107 VanDerWaalsContact O-N 3.16Å; A1105-R1108 PolarHBondContact O-N 2.91Å; A1105-R1108 VanDerWaalsContact O-N 3.16Å; A1105-G1109 PolarHBondContact O-N 3.44Å
1106	V	88.2	Confident	88	Confident	27 Å²	27	63 Å²	63	16%	0.164	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-59.3	-29.5	-178.1	79.3	0	0	0	0	112.8	L944 V947 K948 I951 D1104 R1108	L944-V1106 HydrophobicContact CD1-CG1 3.56Å; V947-V1106 HydrophobicContact CG1-CG1 4.34Å; K948-V1106 HydrophobicContact CG-CB 4.19Å; K948-V1106 HydrophobicContact CG-CG1 4.06Å; K948-V1106 HydrophobicContact CG-CG2 3.9Å; I951-V1106 HydrophobicContact CD1-CG2 3.66Å; D1104-V1106 HydrophobicContact CB-CG1 4.34Å; D1104-V1106 PolarHBondContact O-N 2.91Å; D1104-V1106 WeakPolarHBondContact OD1-CB 3.38Å; D1104-V1106 WeakPolarHBondContact OD1-CG1 3.3Å; D1104-V1106 PolarHBondContact OD1-N 3.14Å; V1106-R1108 PolarHBondContact O-N 3.03Å
1107	W	88.8	Confident	87.9	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.008	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-68	-35.6	-179.4	-62.9	110	0	0	0	112.9	I943 L944 V947 L1102 D1104 A1105 F1125 I1162 L1166 Q1168	I943-W1107 HydrophobicContact CG2-CH2 4.03Å; L944-W1107 HydrophobicContact CB-CZ2 4.42Å; L944-W1107 HydrophobicContact CD1-CZ2 3.84Å; V947-W1107 HydrophobicContact CB-CH2 4.4Å; V947-W1107 HydrophobicContact CG1-CE3 4.39Å; V947-W1107 HydrophobicContact CG1-CH2 4.47Å; V947-W1107 HydrophobicContact CG1-CZ3 4.18Å; V947-W1107 HydrophobicContact CG2-CH2 3.9Å; V947-W1107 HydrophobicContact CG2-CZ3 3.95Å; L1102-W1107 HydrophobicContact CB-CG 4.49Å; L1102-W1107 HydrophobicContact CD2-CD2 3.91Å; L1102-W1107 HydrophobicContact CD2-CE3 4.26Å; L1102-W1107 HydrophobicContact CD2-CG 4.41Å; L1102-W1107 HydrophobicContact CD2-CH2 4.19Å; L1102-W1107 HydrophobicContact CD2-CZ2 3.85Å; L1102-W1107 HydrophobicContact CD2-CZ3 4.37Å; D1104-W1107 VanDerWaalsContact O-CD1 3.28Å; D1104-W1107 PolarHBondContact O-N 3.25Å; A1105-W1107 PolarHBondContact O-N 2.91Å; A1105-W1107 VanDerWaalsContact O-N 3.16Å; W1107-F1125 HydrophobicContact CE3-CB 4.08Å; W1107-F1125 AromaticContact CE3-CD2 3.7Å; W1107-F1125 HydrophobicContact CE3-CD2 3.7Å; W1107-F1125 HydrophobicContact CE3-CE2 4.35Å; W1107-F1125 AromaticContact CE3-CG 3.9Å; W1107-F1125 HydrophobicContact CE3-CG 3.9Å; W1107-F1125 AromaticContact CZ3-CD2 3.45Å; W1107-F1125 HydrophobicContact CZ3-CD2 3.45Å; W1107-F1125 VanDerWaalsContact CZ3-CD2 3.45Å; W1107-F1125 AromaticContact CZ3-CE2 3.64Å; W1107-F1125 HydrophobicContact CZ3-CE2 3.64Å; W1107-F1125 HydrophobicContact CZ3-CG 4.03Å; W1107-F1125 HydrophobicContact CZ3-CZ 4.36Å; W1107-F1125 PolarHBondContact O-N 3.27Å; W1107-I1162 HydrophobicContact CE3-CG2 4Å; W1107-I1162 HydrophobicContact CZ3-CD1 4.41Å; W1107-I1162 HydrophobicContact CZ3-CG2 3.95Å; W1107-L1166 HydrophobicContact CB-CD1 3.9Å; W1107-L1166 HydrophobicContact CB-CD2 3.85Å; W1107-L1166 HydrophobicContact CE3-CD1 4.39Å; W1107-Q1168 PolarHBondContact O-NE2 2.84Å
1108	R	87.7	Confident	87.6	Confident	104 Å²	104	58.5 Å²	58.5	39%	0.392	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-20.4	-176.2	-64	179.3	-173	75.2	7.5	113.4	L1102 A1105 V1106 L1166	L1102-R1108 PolarHBondContact O-NH1 3.33Å; L1102-R1108 PolarHBondContact O-NH2 2.86Å; L1102-R1108 VanDerWaalsContact O-NH2 3.1Å; A1105-R1108 PolarHBondContact O-N 2.91Å; A1105-R1108 VanDerWaalsContact O-N 3.16Å; V1106-R1108 PolarHBondContact O-N 3.03Å; R1108-L1166 HydrophobicContact CG-CD2 4.18Å
1109	G	85.4	Confident	87.2	Confident	21 Å²	21	60.6 Å²	60.6	22%	0.216	35%	0.346	C	S	.	.			trans	71.9	177.5	-175.1	0	0	0	0	0	113.6	A1105 M1123	A1105-G1109 PolarHBondContact O-N 3.44Å; G1109-M1123 WeakPolarHBondContact CA-O 3.41Å
1110	P	86.4	Confident	87	Confident	69 Å²	69	56 Å²	56	45%	0.448	33%	0.332	S	S	.	.	S	Bend	trans	-66.8	167	174.8	29.8	-34.6	0	0	0	111.5	H1118	P1110-H1118 PolarHBondContact O-CE1 3.23Å; P1110-H1118 PolarHBondContact O-NE2 3.35Å
1111	P	83.9	Confident	86.8	Confident	114 Å²	114	55.4 Å²	55.4	74%	0.74	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-62.6	146.8	173	26.5	-34.2	0	0	0	111.7
1112	P	86.9	Confident	86.6	Confident	29 Å²	29	54.6 Å²	54.6	19%	0.188	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-70.1	141.7	-176.1	29.3	-35.9	0	0	0	112.8	N1114 G1115 M1117 H1118	P1112-N1114 VanDerWaalsContact C-N 3.3Å; P1112-N1114 PolarHBondContact O-N 3.41Å; P1112-G1115 PolarHBondContact O-N 2.9Å; P1112-M1117 VanDerWaalsContact CB-C 3.43Å; P1112-H1118 VanDerWaalsContact CA-CE1 3.41Å; P1112-H1118 WeakPolarHBondContact CA-CE1 3.42Å
1113	T	83.8	Confident	86.2	Confident	121 Å²	121	58 Å²	58	74%	0.742	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-36.5	-178.2	53	0	0	0	0	112.8	G1115 E1121	T1113-G1115 VanDerWaalsContact C-N 3.26Å; T1113-G1115 PolarHBondContact O-N 3.05Å; T1113-E1121 PolarHBondContact OG1-OE1 3.09Å; T1113-E1121 VanDerWaalsContact OG1-OE1 3.12Å
1114	N	84.9	Confident	86.3	Confident	81 Å²	81	51.3 Å²	51.3	43%	0.433	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-0.2	176.8	63.7	19.2	0	0	0	113.9	P1112 V1116 M1117	P1112-N1114 VanDerWaalsContact C-N 3.3Å; P1112-N1114 PolarHBondContact O-N 3.41Å; N1114-V1116 PolarHBondContact O-N 2.87Å; N1114-V1116 WeakPolarHBondContact OD1-CA 3.27Å; N1114-V1116 PolarHBondContact OD1-N 3.5Å; N1114-M1117 PolarHBondContact ND2-O 3.23Å; N1114-M1117 PolarHBondContact OD1-N 3.14Å; N1114-M1117 PolarHBondContact OD1-O 3.41Å; N1114-M1117 VanDerWaalsContact OD1-O 3.07Å
1115	G	82.7	Confident	86.4	Confident	25 Å²	25	48.8 Å²	48.8	26%	0.258	29%	0.291	S	S	.	.	S	Bend	trans	71.8	2.1	-177.5	0	0	0	0	0	115.3	P1112 T1113 R1238	P1112-G1115 PolarHBondContact O-N 2.9Å; T1113-G1115 VanDerWaalsContact C-N 3.26Å; T1113-G1115 PolarHBondContact O-N 3.05Å; G1115-R1238 PolarHBondContact O-NH1 3.18Å; G1115-R1238 PolarHBondContact O-NH2 2.75Å; G1115-R1238 VanDerWaalsContact O-NH2 3.11Å
1116	V	84.3	Confident	86.7	Confident	79 Å²	79	45.2 Å²	45.2	48%	0.479	26%	0.262	S	S	.	.	S	Bend	trans	-114.9	-65.7	-176.5	-174.3	0	0	0	0	111.5	N1114 F1240	N1114-V1116 PolarHBondContact O-N 2.87Å; N1114-V1116 WeakPolarHBondContact OD1-CA 3.27Å; N1114-V1116 PolarHBondContact OD1-N 3.5Å; V1116-F1240 HydrophobicContact CB-CZ 4.31Å; V1116-F1240 HydrophobicContact CG1-CZ 4.03Å; V1116-F1240 HydrophobicContact CG2-CE1 3.76Å; V1116-F1240 HydrophobicContact CG2-CZ 3.78Å
1117	M	86.5	Confident	86.8	Confident	53 Å²	53	44.1 Å²	44.1	26%	0.261	26%	0.255	S	S	.	.			trans	-163.3	151.9	-176.3	56.7	-167.5	-88.6	0	0	111	P1112 N1114 V1119 R1171 F1175	P1112-M1117 VanDerWaalsContact CB-C 3.43Å; N1114-M1117 PolarHBondContact ND2-O 3.23Å; N1114-M1117 PolarHBondContact OD1-N 3.14Å; N1114-M1117 PolarHBondContact OD1-O 3.41Å; N1114-M1117 VanDerWaalsContact OD1-O 3.07Å; M1117-V1119 HydrophobicContact CG-CG2 4.44Å; M1117-R1171 HydrophobicContact CE-CG 3.88Å; M1117-F1175 HydrophobicContact CE-CD2 4.33Å; M1117-F1175 HydrophobicContact CE-CE2 3.27Å; M1117-F1175 HydrophobicContact CE-CZ 3.76Å
1118	H	86.6	Confident	87	Confident	8 Å²	8	44.1 Å²	44.1	4%	0.037	26%	0.255	C	S	.	.			trans	-68.4	137	172.1	-65.9	-70.5	0	0	0	110.3	P1110 P1112 E1121 E1124 F1175	P1110-H1118 PolarHBondContact O-CE1 3.23Å; P1110-H1118 PolarHBondContact O-NE2 3.35Å; P1112-H1118 VanDerWaalsContact CA-CE1 3.41Å; P1112-H1118 WeakPolarHBondContact CA-CE1 3.42Å; H1118-E1121 HydrophobicContact CB-CB 4.32Å; H1118-E1121 IonicContact ND1-OE2 3.39Å; H1118-E1124 IonicContact CD2-OE1 3.72Å; H1118-E1124 PolarHBondContact CD2-OE1 3.49Å; H1118-F1175 WeakPolarHBondContact O-CE2 3.38Å
1119	V	84.3	Confident	87.3	Confident	49 Å²	49	39.1 Å²	39.1	30%	0.297	24%	0.236	S	C	.	.	S	Bend	trans	-121.4	-54.3	-174.9	177.9	0	0	0	0	110.6	M1117 E1121 R1127 F1175	M1117-V1119 HydrophobicContact CG-CG2 4.44Å; V1119-E1121 PolarHBondContact N-OE2 3.3Å; V1119-R1127 PolarHBondContact O-NH2 3.48Å; V1119-F1175 HydrophobicContact CB-CZ 4.1Å; V1119-F1175 HydrophobicContact CG1-CE1 3.79Å; V1119-F1175 HydrophobicContact CG1-CZ 3.75Å; V1119-F1175 HydrophobicContact CG2-CE2 4.45Å; V1119-F1175 HydrophobicContact CG2-CZ 3.95Å
1120	D	85.7	Confident	87.7	Confident	42 Å²	42	38.1 Å²	38.1	23%	0.225	23%	0.226	C	C	.	.	S	Bend	trans	-104.2	-19	179.4	-64.9	-29.3	0	0	0	111.6	I957 C958 R959	I957-D1120 CarbonylContact C-O 3.26Å; I957-D1120 WeakPolarHBondContact CA-O 3.33Å; I957-D1120 HydrophobicContact CG2-CB 3.56Å; C958-D1120 PolarHBondContact N-O 3.12Å; R959-D1120 HydrophobicContact CG-CB 4.18Å; R959-D1120 WeakPolarHBondContact CG-OD2 3.31Å; R959-D1120 IonicContact CZ-OD2 3.85Å; R959-D1120 IonicContact NE-OD2 2.94Å; R959-D1120 PolarHBondContact NE-OD2 3.41Å; R959-D1120 IonicContact NH2-OD2 3.95Å
1121	E	87.6	Confident	87.9	Confident	41 Å²	41	34.9 Å²	34.9	19%	0.192	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-71.1	133.7	-176.9	-56.8	90.1	161	0	0	111.6	T1113 H1118 V1119 M1123	T1113-E1121 PolarHBondContact OG1-OE1 3.09Å; T1113-E1121 VanDerWaalsContact OG1-OE1 3.12Å; H1118-E1121 HydrophobicContact CB-CB 4.32Å; H1118-E1121 IonicContact ND1-OE2 3.39Å; V1119-E1121 PolarHBondContact N-OE2 3.3Å; E1121-M1123 HydrophobicContact CB-CG 4.37Å; E1121-M1123 PolarHBondContact O-N 2.94Å
1122	C	87.1	Confident	88.3	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.014	17%	0.169	C	C	.	.			trans	-101.1	46.5	-179.2	-61.9	0	0	0	0	112.6	M954 P955 K956 C958 R1127	M954-C1122 HydrophobicContact CE-CB 4.21Å; M954-C1122 HydrophobicContact CG-CB 3.61Å; P955-C1122 VanDerWaalsContact O-CB 3.23Å; P955-C1122 WeakPolarHBondContact O-CB 3.34Å; K956-C1122 PolarHBondContact O-N 3.38Å; C958-C1122 VanDerWaalsContact CB-SG 3.53Å; C1122-R1127 HydrophobicContact CB-CB 4.19Å
1123	M	84.3	Confident	88.6	Confident	72 Å²	72	28.1 Å²	28.1	36%	0.355	16%	0.16	S	C	.	.			trans	-104	-4	-173.8	-56.8	-62.7	-67.4	0	0	114.1	G1109 E1121	G1109-M1123 WeakPolarHBondContact CA-O 3.41Å; E1121-M1123 HydrophobicContact CB-CG 4.37Å; E1121-M1123 PolarHBondContact O-N 2.94Å
1124	E	89.8	Confident	89.1	Confident	9 Å²	9	22.4 Å²	22.4	4%	0.042	13%	0.125	C	C	.	.	S	Bend	trans	-99.4	149.5	175.8	-63.5	-164.8	-177.2	0	0	111	H1118 H1126 R1127 Q1168 R1171	H1118-E1124 IonicContact CD2-OE1 3.72Å; H1118-E1124 PolarHBondContact CD2-OE1 3.49Å; E1124-H1126 VanDerWaalsContact C-N 3.29Å; E1124-H1126 PolarHBondContact O-N 3.22Å; E1124-H1126 IonicContact OE2-CD2 3.73Å; E1124-H1126 PolarHBondContact OE2-CD2 3.23Å; E1124-H1126 IonicContact OE2-NE2 3.85Å; E1124-H1126 PolarHBondContact OE2-NE2 2.84Å; E1124-R1127 WeakPolarHBondContact O-CB 3.49Å; E1124-R1127 PolarHBondContact O-N 3.4Å; E1124-Q1168 WeakPolarHBondContact OE2-CG 3.45Å; E1124-R1171 IonicContact OE1-CZ 2.8Å; E1124-R1171 IonicContact OE1-NE 3.83Å; E1124-R1171 PolarHBondContact OE1-NE 3.29Å; E1124-R1171 IonicContact OE1-NH2 3.73Å; E1124-R1171 PolarHBondContact OE1-NH2 3.2Å; E1124-R1171 IonicContact OE2-CZ 3.79Å; E1124-R1171 IonicContact OE2-NE 3.23Å; E1124-R1171 PolarHBondContact OE2-NE 2.9Å; E1124-R1171 IonicContact OE2-NH2 3.42Å; E1124-R1171 PolarHBondContact OE2-NH2 3.1Å
1125	F	92.5	Very high	89.4	Confident	1 Å²	1	19.2 Å²	19.2	0%	0.004	11%	0.109	C	C	.	.	H	α-helix	trans	-55.6	-39.9	179.7	176.5	-99.9	0	0	0	113.5	V947 W1107 R1127 L1128 W1129 I1162 I1163 L1166	V947-F1125 HydrophobicContact CG1-CD2 4.2Å; V947-F1125 HydrophobicContact CG2-CD2 4.15Å; V947-F1125 HydrophobicContact CG2-CE2 3.9Å; W1107-F1125 HydrophobicContact CE3-CB 4.08Å; W1107-F1125 AromaticContact CE3-CD2 3.7Å; W1107-F1125 HydrophobicContact CE3-CD2 3.7Å; W1107-F1125 HydrophobicContact CE3-CE2 4.35Å; W1107-F1125 AromaticContact CE3-CG 3.9Å; W1107-F1125 HydrophobicContact CE3-CG 3.9Å; W1107-F1125 AromaticContact CZ3-CD2 3.45Å; W1107-F1125 HydrophobicContact CZ3-CD2 3.45Å; W1107-F1125 VanDerWaalsContact CZ3-CD2 3.45Å; W1107-F1125 AromaticContact CZ3-CE2 3.64Å; W1107-F1125 HydrophobicContact CZ3-CE2 3.64Å; W1107-F1125 HydrophobicContact CZ3-CG 4.03Å; W1107-F1125 HydrophobicContact CZ3-CZ 4.36Å; W1107-F1125 PolarHBondContact O-N 3.27Å; F1125-R1127 PolarHBondContact O-N 3.04Å; F1125-R1127 VanDerWaalsContact O-N 3.1Å; F1125-L1128 HydrophobicContact CD2-CD2 4.46Å; F1125-L1128 WeakPolarHBondContact O-CB 3.33Å; F1125-L1128 PolarHBondContact O-N 3.16Å; F1125-W1129 HydrophobicContact CE1-CB 4.34Å; F1125-W1129 PolarHBondContact O-N 3.1Å; F1125-I1162 HydrophobicContact CD1-CB 4.14Å; F1125-I1162 HydrophobicContact CD1-CG2 3.41Å; F1125-I1162 VanDerWaalsContact CD1-CG2 3.41Å; F1125-I1162 HydrophobicContact CE1-CB 3.68Å; F1125-I1162 HydrophobicContact CE1-CD1 4.21Å; F1125-I1162 HydrophobicContact CE1-CG2 3.41Å; F1125-I1162 VanDerWaalsContact CE1-CG2 3.41Å; F1125-I1162 HydrophobicContact CG-CG2 4Å; F1125-I1162 HydrophobicContact CZ-CB 4.26Å; F1125-I1162 HydrophobicContact CZ-CD1 3.9Å; F1125-I1162 HydrophobicContact CZ-CG2 4Å; F1125-I1163 HydrophobicContact CD1-CG1 4.07Å; F1125-I1163 HydrophobicContact CE1-CG1 4.14Å; F1125-L1166 HydrophobicContact CB-CD1 4.02Å; F1125-L1166 HydrophobicContact CD1-CD1 4.48Å
1126	H	93	Very high	89.8	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-60.7	-24.2	179.9	81.8	83	0	0	0	113.5	E1124 S1130 I1163 Q1168 F1172	E1124-H1126 VanDerWaalsContact C-N 3.29Å; E1124-H1126 PolarHBondContact O-N 3.22Å; E1124-H1126 IonicContact OE2-CD2 3.73Å; E1124-H1126 PolarHBondContact OE2-CD2 3.23Å; E1124-H1126 IonicContact OE2-NE2 3.85Å; E1124-H1126 PolarHBondContact OE2-NE2 2.84Å; H1126-S1130 PolarHBondContact O-N 2.97Å; H1126-S1130 PolarHBondContact O-OG 3.11Å; H1126-S1130 VanDerWaalsContact O-OG 3.14Å; H1126-I1163 HydrophobicContact CB-CD1 4.22Å; H1126-I1163 HydrophobicContact CB-CG1 4.05Å; H1126-Q1168 HydrophobicContact CB-CB 4Å; H1126-F1172 HydrophobicContact CB-CB 4Å; H1126-F1172 HydrophobicContact CB-CD2 4.12Å; H1126-F1172 HydrophobicContact CB-CG 4.48Å
1127	R	91.3	Very high	90.2	Very high	3 Å²	3	14.7 Å²	14.7	1%	0.011	8%	0.075	C	C	.	.	H	α-helix	trans	-74.2	-39.2	174.6	-71.6	-63	-153.9	162.7	3.4	112.1	V1119 C1122 E1124 F1125 W1129 S1130 A1131 F1175	V1119-R1127 PolarHBondContact O-NH2 3.48Å; C1122-R1127 HydrophobicContact CB-CB 4.19Å; E1124-R1127 WeakPolarHBondContact O-CB 3.49Å; E1124-R1127 PolarHBondContact O-N 3.4Å; F1125-R1127 PolarHBondContact O-N 3.04Å; F1125-R1127 VanDerWaalsContact O-N 3.1Å; R1127-W1129 VanDerWaalsContact C-N 3.32Å; R1127-S1130 WeakPolarHBondContact O-CB 3.16Å; R1127-S1130 PolarHBondContact O-N 2.98Å; R1127-A1131 PolarHBondContact O-N 3.43Å; R1127-A1131 VanDerWaalsContact O-N 3.14Å; R1127-F1175 PolarHBondContact NH1-O 3.38Å
1128	L	91.8	Very high	90.4	Very high	2 Å²	2	13.7 Å²	13.7	1%	0.01	7%	0.071	C	C	.	.	H	α-helix	trans	-62.9	-42.5	170.1	176.2	62.7	0	0	0	110.5	V947 L950 I951 F1125 S1130 A1131 M1132	V947-L1128 HydrophobicContact CB-CD2 4.34Å; V947-L1128 HydrophobicContact CG1-CD2 4.17Å; V947-L1128 HydrophobicContact CG2-CD2 4.05Å; L950-L1128 HydrophobicContact CB-CD1 3.66Å; L950-L1128 HydrophobicContact CB-CD2 4.05Å; L950-L1128 HydrophobicContact CD1-CD1 4.35Å; I951-L1128 HydrophobicContact CG1-CB 4.45Å; I951-L1128 HydrophobicContact CG1-CD2 4.2Å; F1125-L1128 HydrophobicContact CD2-CD2 4.46Å; F1125-L1128 WeakPolarHBondContact O-CB 3.33Å; F1125-L1128 PolarHBondContact O-N 3.16Å; L1128-S1130 VanDerWaalsContact C-N 3.33Å; L1128-S1130 PolarHBondContact O-N 2.89Å; L1128-A1131 WeakPolarHBondContact O-CA 3.13Å; L1128-A1131 VanDerWaalsContact O-CB 3.32Å; L1128-A1131 WeakPolarHBondContact O-CB 3.32Å; L1128-A1131 PolarHBondContact O-N 3.11Å; L1128-M1132 HydrophobicContact CD1-CE 4.04Å; L1128-M1132 HydrophobicContact CD2-CE 3.93Å; L1128-M1132 HydrophobicContact CG-CE 3.82Å; L1128-M1132 WeakPolarHBondContact O-CG 3.24Å; L1128-M1132 PolarHBondContact O-N 2.85Å
1129	W	94.2	Very high	90.5	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-62.2	-38.2	174.6	-172.9	-109.4	0	0	0	112.6	L995 F1125 R1127 A1131 M1132 Q1133 Y1136 L1155 I1163 F1172	L995-W1129 HydrophobicContact CD1-CZ3 3.97Å; F1125-W1129 HydrophobicContact CE1-CB 4.34Å; F1125-W1129 PolarHBondContact O-N 3.1Å; R1127-W1129 VanDerWaalsContact C-N 3.32Å; W1129-A1131 VanDerWaalsContact C-N 3.26Å; W1129-A1131 PolarHBondContact O-N 2.72Å; W1129-M1132 HydrophobicContact CE3-CB 4.2Å; W1129-M1132 HydrophobicContact CE3-SD 3.83Å; W1129-M1132 HydrophobicContact CZ3-SD 4.13Å; W1129-M1132 PolarHBondContact O-N 2.78Å; W1129-Q1133 VanDerWaalsContact O-CB 3.32Å; W1129-Q1133 WeakPolarHBondContact O-CB 3.32Å; W1129-Q1133 PolarHBondContact O-N 3.41Å; W1129-Y1136 HydrophobicContact CH2-CE1 4.16Å; W1129-Y1136 HydrophobicContact CZ2-CE1 4.04Å; W1129-L1155 HydrophobicContact CH2-CD1 4.02Å; W1129-L1155 HydrophobicContact CH2-CG 4.06Å; W1129-L1155 WeakPolarHBondContact CH2-O 3.29Å; W1129-L1155 HydrophobicContact CZ3-CD1 4.27Å; W1129-I1163 HydrophobicContact CB-CD1 3.92Å; W1129-I1163 HydrophobicContact CG-CD1 3.69Å; W1129-F1172 AromaticContact CD1-CE2 3.6Å; W1129-F1172 AromaticContact CD1-CZ 3.81Å
1130	S	93.3	Very high	90.6	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.2	-34.6	171.5	-69.3	0	0	0	0	113.1	H1126 R1127 L1128 F1134 F1172 D1176	H1126-S1130 PolarHBondContact O-N 2.97Å; H1126-S1130 PolarHBondContact O-OG 3.11Å; H1126-S1130 VanDerWaalsContact O-OG 3.14Å; R1127-S1130 WeakPolarHBondContact O-CB 3.16Å; R1127-S1130 PolarHBondContact O-N 2.98Å; L1128-S1130 VanDerWaalsContact C-N 3.33Å; L1128-S1130 PolarHBondContact O-N 2.89Å; S1130-F1134 PolarHBondContact O-N 2.96Å; S1130-F1172 WeakPolarHBondContact OG-CD2 3.42Å; S1130-F1172 VanDerWaalsContact OG-CE2 3.29Å; S1130-F1172 WeakPolarHBondContact OG-CE2 3.38Å; S1130-D1176 VanDerWaalsContact CA-OD1 3.28Å; S1130-D1176 WeakPolarHBondContact CA-OD1 3.49Å; S1130-D1176 WeakPolarHBondContact CB-OD1 3.4Å; S1130-D1176 WeakPolarHBondContact OG-CA 3.29Å; S1130-D1176 PolarHBondContact OG-OD1 3.12Å
1131	A	91.7	Very high	90.4	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-70	-44.3	173.9	0	0	0	0	0	111.7	M954 L978 I981 R1127 L1128 W1129 Q1133 F1134 V1135	M954-A1131 HydrophobicContact CE-CB 3.73Å; M954-A1131 HydrophobicContact SD-CB 3.72Å; L978-A1131 HydrophobicContact CD1-CB 4.44Å; L978-A1131 HydrophobicContact CD2-CB 4.01Å; I981-A1131 HydrophobicContact CG1-CB 4.45Å; I981-A1131 HydrophobicContact CG2-CB 4.12Å; R1127-A1131 PolarHBondContact O-N 3.43Å; R1127-A1131 VanDerWaalsContact O-N 3.14Å; L1128-A1131 WeakPolarHBondContact O-CA 3.13Å; L1128-A1131 VanDerWaalsContact O-CB 3.32Å; L1128-A1131 WeakPolarHBondContact O-CB 3.32Å; L1128-A1131 PolarHBondContact O-N 3.11Å; W1129-A1131 VanDerWaalsContact C-N 3.26Å; W1129-A1131 PolarHBondContact O-N 2.72Å; A1131-Q1133 VanDerWaalsContact C-N 3.3Å; A1131-Q1133 PolarHBondContact O-N 3.41Å; A1131-F1134 WeakPolarHBondContact O-CB 3.42Å; A1131-F1134 PolarHBondContact O-N 3.2Å; A1131-F1134 VanDerWaalsContact O-N 3.17Å; A1131-V1135 PolarHBondContact O-N 3.47Å; A1131-V1135 VanDerWaalsContact O-N 3.14Å
1132	M	92.6	Very high	89.9	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-40.4	174	-67.4	178.3	176.6	0	0	111.7	L950 L987 V991 F992 L995 L1128 W1129 F1134 V1135 Y1136	L950-M1132 HydrophobicContact CD1-CE 3.56Å; L987-M1132 HydrophobicContact CD1-CE 4.08Å; L987-M1132 HydrophobicContact CD1-CG 4.32Å; V991-M1132 HydrophobicContact CG1-CE 3.63Å; V991-M1132 HydrophobicContact CG1-SD 4.47Å; F992-M1132 HydrophobicContact CE1-CB 4.01Å; F992-M1132 HydrophobicContact CE1-CG 4.1Å; F992-M1132 HydrophobicContact CE1-SD 4.22Å; F992-M1132 HydrophobicContact CZ-CB 4.35Å; L995-M1132 HydrophobicContact CD1-SD 4.38Å; L1128-M1132 HydrophobicContact CD1-CE 4.04Å; L1128-M1132 HydrophobicContact CD2-CE 3.93Å; L1128-M1132 HydrophobicContact CG-CE 3.82Å; L1128-M1132 WeakPolarHBondContact O-CG 3.24Å; L1128-M1132 PolarHBondContact O-N 2.85Å; W1129-M1132 HydrophobicContact CE3-CB 4.2Å; W1129-M1132 HydrophobicContact CE3-SD 3.83Å; W1129-M1132 HydrophobicContact CZ3-SD 4.13Å; W1129-M1132 PolarHBondContact O-N 2.78Å; M1132-F1134 VanDerWaalsContact C-N 3.31Å; M1132-F1134 PolarHBondContact O-N 2.99Å; M1132-V1135 WeakPolarHBondContact O-CB 3.23Å; M1132-V1135 PolarHBondContact O-N 3.24Å; M1132-V1135 VanDerWaalsContact O-N 3.08Å; M1132-Y1136 WeakPolarHBondContact O-CD1 3.28Å; M1132-Y1136 PolarHBondContact O-N 2.89Å
1133	Q	93.6	Very high	89.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-39.1	174.2	178.7	161.9	-82.1	0	0	112.6	W1129 A1131 V1135 Y1136 C1137 D1176 C1178 Y1179 N1213	W1129-Q1133 VanDerWaalsContact O-CB 3.32Å; W1129-Q1133 WeakPolarHBondContact O-CB 3.32Å; W1129-Q1133 PolarHBondContact O-N 3.41Å; A1131-Q1133 VanDerWaalsContact C-N 3.3Å; A1131-Q1133 PolarHBondContact O-N 3.41Å; Q1133-V1135 VanDerWaalsContact C-N 3.3Å; Q1133-V1135 PolarHBondContact O-N 3.29Å; Q1133-Y1136 HydrophobicContact CB-CE1 3.96Å; Q1133-Y1136 HydrophobicContact CB-CE2 4.11Å; Q1133-Y1136 VanDerWaalsContact CB-OH 3.3Å; Q1133-Y1136 WeakPolarHBondContact CB-OH 3.49Å; Q1133-Y1136 HydrophobicContact CG-CE2 3.77Å; Q1133-Y1136 WeakPolarHBondContact CG-OH 3.3Å; Q1133-Y1136 PolarHBondContact OE1-OH 3.09Å; Q1133-C1137 WeakPolarHBondContact O-CB 3.47Å; Q1133-C1137 PolarHBondContact O-N 3.2Å; Q1133-C1137 VanDerWaalsContact O-N 3.09Å; Q1133-C1137 PolarHBondContact O-SG 3.01Å; Q1133-D1176 PolarHBondContact NE2-OD1 2.59Å; Q1133-D1176 PolarHBondContact NE2-OD2 2.94Å; Q1133-C1178 HydrophobicContact CG-CB 4.31Å; Q1133-Y1179 VanDerWaalsContact NE2-CE1 3.26Å; Q1133-N1213 PolarHBondContact OE1-ND2 2.99Å
1134	F	92.4	Very high	89.5	Confident	1 Å²	1	29.6 Å²	29.6	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-57.9	-46.7	171.4	-171.5	-96.3	0	0	0	110.9	L971 F974 H975 L978 I982 S1130 A1131 M1132 C1137 I1138 C1178 M1202	L971-F1134 HydrophobicContact CD1-CE2 3.9Å; L971-F1134 HydrophobicContact CD1-CZ 3.77Å; F974-F1134 HydrophobicContact CB-CD2 4.3Å; F974-F1134 HydrophobicContact CB-CE2 3.74Å; F974-F1134 HydrophobicContact CB-CZ 3.93Å; H975-F1134 HydrophobicContact CB-CZ 4.43Å; L978-F1134 HydrophobicContact CD1-CB 3.8Å; L978-F1134 HydrophobicContact CD1-CD1 3.85Å; L978-F1134 HydrophobicContact CD1-CD2 4.4Å; L978-F1134 HydrophobicContact CD1-CG 3.76Å; I982-F1134 HydrophobicContact CD1-CD1 4.07Å; I982-F1134 HydrophobicContact CD1-CE1 3.77Å; I982-F1134 HydrophobicContact CG1-CD1 4.39Å; S1130-F1134 PolarHBondContact O-N 2.96Å; A1131-F1134 WeakPolarHBondContact O-CB 3.42Å; A1131-F1134 PolarHBondContact O-N 3.2Å; A1131-F1134 VanDerWaalsContact O-N 3.17Å; M1132-F1134 VanDerWaalsContact C-N 3.31Å; M1132-F1134 PolarHBondContact O-N 2.99Å; F1134-C1137 PolarHBondContact O-N 3.35Å; F1134-I1138 HydrophobicContact CD1-CD1 4.44Å; F1134-I1138 HydrophobicContact CE1-CD1 4.27Å; F1134-I1138 WeakPolarHBondContact O-CG1 3.43Å; F1134-I1138 PolarHBondContact O-N 3.34Å; F1134-C1178 WeakPolarHBondContact CA-SG 3.19Å; F1134-M1202 HydrophobicContact CD2-CE 3.83Å; F1134-M1202 HydrophobicContact CE2-CE 3.83Å; F1134-M1202 HydrophobicContact CG-CE 4.4Å; F1134-M1202 HydrophobicContact CZ-CE 4.39Å
1135	V	91.1	Very high	89.1	Confident	15 Å²	15	34.4 Å²	34.4	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-61.7	-51.1	-179.7	179.2	0	0	0	0	113	I981 I982 L987 A1131 M1132 Q1133 C1137 I1138	I981-V1135 HydrophobicContact CG2-CG2 4.23Å; I982-V1135 HydrophobicContact CB-CG2 4.47Å; I982-V1135 HydrophobicContact CG1-CG2 3.91Å; L987-V1135 HydrophobicContact CD2-CB 4.21Å; L987-V1135 HydrophobicContact CD2-CG1 3.96Å; L987-V1135 HydrophobicContact CD2-CG2 3.96Å; A1131-V1135 PolarHBondContact O-N 3.47Å; A1131-V1135 VanDerWaalsContact O-N 3.14Å; M1132-V1135 WeakPolarHBondContact O-CB 3.23Å; M1132-V1135 PolarHBondContact O-N 3.24Å; M1132-V1135 VanDerWaalsContact O-N 3.08Å; Q1133-V1135 VanDerWaalsContact C-N 3.3Å; Q1133-V1135 PolarHBondContact O-N 3.29Å; V1135-C1137 VanDerWaalsContact C-N 3.28Å; V1135-C1137 PolarHBondContact O-N 2.94Å; V1135-I1138 WeakPolarHBondContact O-CB 3.32Å; V1135-I1138 PolarHBondContact O-N 2.87Å
1136	Y	91.5	Very high	88.9	Confident	8 Å²	8	35.4 Å²	35.4	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-76.3	-14.7	-176.7	63.8	-118.1	0	0	0	114	F992 W1129 M1132 Q1133 R1205 Y1209	F992-Y1136 HydrophobicContact CZ-CD1 4.23Å; W1129-Y1136 HydrophobicContact CH2-CE1 4.16Å; W1129-Y1136 HydrophobicContact CZ2-CE1 4.04Å; M1132-Y1136 WeakPolarHBondContact O-CD1 3.28Å; M1132-Y1136 PolarHBondContact O-N 2.89Å; Q1133-Y1136 HydrophobicContact CB-CE1 3.96Å; Q1133-Y1136 HydrophobicContact CB-CE2 4.11Å; Q1133-Y1136 VanDerWaalsContact CB-OH 3.3Å; Q1133-Y1136 WeakPolarHBondContact CB-OH 3.49Å; Q1133-Y1136 HydrophobicContact CG-CE2 3.77Å; Q1133-Y1136 WeakPolarHBondContact CG-OH 3.3Å; Q1133-Y1136 PolarHBondContact OE1-OH 3.09Å; Y1136-R1205 PolarHBondContact O-NH2 3.2Å; Y1136-R1205 VanDerWaalsContact O-NH2 3.11Å; Y1136-Y1209 HydrophobicContact CD2-CD1 4.1Å; Y1136-Y1209 AromaticContact CD2-CD2 3.96Å; Y1136-Y1209 HydrophobicContact CD2-CD2 3.96Å; Y1136-Y1209 AromaticContact CD2-CE1 3.89Å; Y1136-Y1209 HydrophobicContact CD2-CE1 3.89Å; Y1136-Y1209 AromaticContact CD2-CE2 3.77Å; Y1136-Y1209 HydrophobicContact CD2-CE2 3.77Å; Y1136-Y1209 HydrophobicContact CD2-CG 4.12Å; Y1136-Y1209 AromaticContact CD2-CZ 3.72Å; Y1136-Y1209 AromaticContact CE2-CD1 3.56Å; Y1136-Y1209 HydrophobicContact CE2-CD1 3.56Å; Y1136-Y1209 AromaticContact CE2-CD2 3.89Å; Y1136-Y1209 HydrophobicContact CE2-CD2 3.89Å; Y1136-Y1209 AromaticContact CE2-CE1 3.79Å; Y1136-Y1209 HydrophobicContact CE2-CE1 3.79Å; Y1136-Y1209 HydrophobicContact CE2-CE2 4.13Å; Y1136-Y1209 AromaticContact CE2-CG 3.6Å; Y1136-Y1209 HydrophobicContact CE2-CG 3.6Å
1137	C	92.4	Very high	88.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-76.5	-23.7	170.6	-77.6	0	0	0	0	112.9	Q1133 F1134 V1135 P1139 M1202 R1205 I1206	Q1133-C1137 WeakPolarHBondContact O-CB 3.47Å; Q1133-C1137 PolarHBondContact O-N 3.2Å; Q1133-C1137 VanDerWaalsContact O-N 3.09Å; Q1133-C1137 PolarHBondContact O-SG 3.01Å; F1134-C1137 PolarHBondContact O-N 3.35Å; V1135-C1137 VanDerWaalsContact C-N 3.28Å; V1135-C1137 PolarHBondContact O-N 2.94Å; C1137-P1139 WeakPolarHBondContact O-CD 3.32Å; C1137-M1202 HydrophobicContact CB-CE 3.59Å; C1137-M1202 HydrophobicContact CB-SD 3.74Å; C1137-R1205 WeakPolarHBondContact O-CD 3.34Å; C1137-R1205 PolarHBondContact O-NE 3.07Å; C1137-R1205 VanDerWaalsContact O-NE 3.17Å; C1137-I1206 HydrophobicContact CB-CG1 3.84Å
1138	I	90.6	Very high	88.4	Confident	32 Å²	32	39.2 Å²	39.2	16%	0.164	21%	0.212	C	C	.	.	S	Bend	trans	-56.3	123.3	179.2	-63.8	174.1	0	0	0	109.4	I982 F1134 V1135 V1140 V1197 M1202	I982-I1138 HydrophobicContact CG1-CD1 4.46Å; I982-I1138 HydrophobicContact CG2-CD1 4.37Å; F1134-I1138 HydrophobicContact CD1-CD1 4.44Å; F1134-I1138 HydrophobicContact CE1-CD1 4.27Å; F1134-I1138 WeakPolarHBondContact O-CG1 3.43Å; F1134-I1138 PolarHBondContact O-N 3.34Å; V1135-I1138 WeakPolarHBondContact O-CB 3.32Å; V1135-I1138 PolarHBondContact O-N 2.87Å; I1138-V1140 PolarHBondContact O-N 3.29Å; I1138-V1197 HydrophobicContact CG2-CG2 3.89Å; I1138-M1202 HydrophobicContact CG1-CE 4.31Å
1139	P	88.9	Confident	88.2	Confident	26 Å²	26	43.9 Å²	43.9	17%	0.169	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-64.3	127.4	174.2	-18	31.3	0	0	0	110.9	C1137 P1198 K1201 M1202	C1137-P1139 WeakPolarHBondContact O-CD 3.32Å; P1139-P1198 HydrophobicContact CB-CG 4.45Å; P1139-P1198 HydrophobicContact CG-CG 4.3Å; P1139-K1201 HydrophobicContact CB-CB 4.47Å; P1139-K1201 HydrophobicContact CG-CB 3.93Å; P1139-M1202 HydrophobicContact CG-CB 4.38Å
1140	V	86.4	Confident	87.8	Confident	53 Å²	53	44.3 Å²	44.3	32%	0.321	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-92	168.9	174	-65	0	0	0	0	111.2	I1138 E1144 T1146	I1138-V1140 PolarHBondContact O-N 3.29Å; V1140-E1144 HydrophobicContact CB-CB 3.91Å; V1140-E1144 WeakPolarHBondContact CB-OE2 3.43Å; V1140-E1144 HydrophobicContact CG2-CB 4.05Å; V1140-T1146 HydrophobicContact CG2-CG2 3.77Å
1141	G	81.3	Confident	87.7	Confident	37 Å²	37	44.4 Å²	44.4	38%	0.381	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-58.7	158.5	177.4	0	0	0	0	0	112.9	H1143 E1144	G1141-H1143 PolarHBondContact O-N 2.8Å; G1141-E1144 PolarHBondContact N-OE2 3.42Å; G1141-E1144 PolarHBondContact O-N 3.45Å
1142	T	77.3	Confident	87.7	Confident	133 Å²	133	44.7 Å²	44.7	82%	0.816	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.8	-177	47.3	0	0	0	0	114.6
1143	H	80.8	Confident	87.8	Confident	178 Å²	178	45.9 Å²	45.9	82%	0.824	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.9	7.6	178.5	-60.4	-63.2	0	0	0	113.2	G1141	G1141-H1143 PolarHBondContact O-N 2.8Å
1144	E	82.5	Confident	87.8	Confident	121 Å²	121	45.9 Å²	45.9	57%	0.565	25%	0.246	S	C	*	.	S	Bend	trans	-98.9	142.8	177.7	-67.3	-179.5	157.1	0	0	110.2	V1140 G1141	V1140-E1144 HydrophobicContact CB-CB 3.91Å; V1140-E1144 WeakPolarHBondContact CB-OE2 3.43Å; V1140-E1144 HydrophobicContact CG2-CB 4.05Å; G1141-E1144 PolarHBondContact N-OE2 3.42Å; G1141-E1144 PolarHBondContact O-N 3.45Å
1145	F	82.6	Confident	87.9	Confident	110 Å²	110	46 Å²	46	48%	0.482	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-74.5	134.2	178.6	-61.5	-74.8	0	0	0	110.9	A866 I867	A866-F1145 HydrophobicContact CB-CD1 3.58Å; A866-F1145 HydrophobicContact CB-CE1 3.76Å; A866-F1145 HydrophobicContact CB-CG 4.06Å; A866-F1145 HydrophobicContact CB-CZ 4.35Å; I867-F1145 HydrophobicContact CD1-CB 4.32Å; I867-F1145 HydrophobicContact CD1-CD2 3.81Å; I867-F1145 HydrophobicContact CD1-CG 4.4Å; I867-F1145 HydrophobicContact CG1-CD2 3.9Å; I867-F1145 HydrophobicContact CG1-CE2 4.35Å; I867-F1145 HydrophobicContact CG1-CG 4.45Å
1146	T	88.3	Confident	88.1	Confident	22 Å²	22	45.4 Å²	45.4	14%	0.135	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-80.8	162.7	178.2	55.5	0	0	0	0	111.7	V1140 E1148 Q1149 C1150	V1140-T1146 HydrophobicContact CG2-CG2 3.77Å; T1146-E1148 VanDerWaalsContact C-N 3.28Å; T1146-E1148 WeakPolarHBondContact CB-OE1 3.41Å; T1146-E1148 WeakPolarHBondContact CB-OE2 3.39Å; T1146-E1148 PolarHBondContact O-N 2.99Å; T1146-E1148 VanDerWaalsContact OG1-CD 3.24Å; T1146-E1148 WeakPolarHBondContact OG1-CG 3.06Å; T1146-E1148 PolarHBondContact OG1-OE1 3.1Å; T1146-Q1149 PolarHBondContact O-N 2.95Å; T1146-Q1149 VanDerWaalsContact O-N 3.12Å; T1146-Q1149 VanDerWaalsContact OG1-CD 3.3Å; T1146-Q1149 VanDerWaalsContact OG1-CG 3.28Å; T1146-Q1149 WeakPolarHBondContact OG1-CG 3.31Å; T1146-Q1149 PolarHBondContact OG1-N 3.35Å; T1146-Q1149 PolarHBondContact OG1-OE1 2.77Å; T1146-Q1149 VanDerWaalsContact OG1-OE1 3.07Å; T1146-C1150 PolarHBondContact O-N 3.5Å; T1146-C1150 VanDerWaalsContact O-N 3.14Å
1147	A	85.2	Confident	88.2	Confident	17 Å²	17	45.6 Å²	45.6	14%	0.14	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-39.2	177.6	0	0	0	0	0	112.1	Q1149 C1150 F1151	A1147-Q1149 VanDerWaalsContact C-N 3.31Å; A1147-Q1149 PolarHBondContact O-N 3.29Å; A1147-C1150 PolarHBondContact O-N 3.26Å; A1147-F1151 PolarHBondContact O-N 3.46Å
1148	E	87.9	Confident	88.4	Confident	68 Å²	68	45.6 Å²	45.6	32%	0.318	24%	0.244	S	C	.	.	H	α-helix	trans	-65.9	-28.7	176.1	59.2	-88.9	-154	0	0	113.5	T1146 G1152 R1205 Y1209	T1146-E1148 VanDerWaalsContact C-N 3.28Å; T1146-E1148 WeakPolarHBondContact CB-OE1 3.41Å; T1146-E1148 WeakPolarHBondContact CB-OE2 3.39Å; T1146-E1148 PolarHBondContact O-N 2.99Å; T1146-E1148 VanDerWaalsContact OG1-CD 3.24Å; T1146-E1148 WeakPolarHBondContact OG1-CG 3.06Å; T1146-E1148 PolarHBondContact OG1-OE1 3.1Å; E1148-G1152 WeakPolarHBondContact O-CA 3.28Å; E1148-G1152 PolarHBondContact O-N 3.43Å; E1148-R1205 IonicContact OE1-CZ 2.8Å; E1148-R1205 IonicContact OE1-NH1 3.75Å; E1148-R1205 PolarHBondContact OE1-NH1 3.26Å; E1148-R1205 IonicContact OE1-NH2 3.38Å; E1148-R1205 PolarHBondContact OE1-NH2 3.06Å; E1148-R1205 IonicContact OE2-CZ 3.54Å; E1148-R1205 IonicContact OE2-NH1 3.47Å; E1148-R1205 IonicContact OE2-NH2 2.69Å; E1148-R1205 PolarHBondContact OE2-NH2 3.14Å; E1148-Y1209 PolarHBondContact OE2-OH 3.44Å
1149	Q	86.4	Confident	88.5	Confident	100 Å²	100	44.1 Å²	44.1	47%	0.467	24%	0.236	S	C	.	.	H	α-helix	trans	-78.7	-27.1	174.4	-75.2	169.6	-29.2	0	0	113	A866 T1146 A1147	A866-Q1149 PolarHBondContact N-O 3.11Å; T1146-Q1149 PolarHBondContact O-N 2.95Å; T1146-Q1149 VanDerWaalsContact O-N 3.12Å; T1146-Q1149 VanDerWaalsContact OG1-CD 3.3Å; T1146-Q1149 VanDerWaalsContact OG1-CG 3.28Å; T1146-Q1149 WeakPolarHBondContact OG1-CG 3.31Å; T1146-Q1149 PolarHBondContact OG1-N 3.35Å; T1146-Q1149 PolarHBondContact OG1-OE1 2.77Å; T1146-Q1149 VanDerWaalsContact OG1-OE1 3.07Å; A1147-Q1149 VanDerWaalsContact C-N 3.31Å; A1147-Q1149 PolarHBondContact O-N 3.29Å
1150	C	87.7	Confident	88.8	Confident	8 Å²	8	42.9 Å²	42.9	5%	0.054	23%	0.228	C	C	.	.	H	α-helix	trans	-90.9	-33.6	-178.7	-69.5	0	0	0	0	113.5	C854 T865 F869 T1146 A1147	C854-C1150 VanDerWaalsContact SG-C 3.51Å; C854-C1150 PolarHBondContact SG-O 3.12Å; T865-C1150 WeakPolarHBondContact CB-O 3.27Å; T865-C1150 PolarHBondContact OG1-O 3.36Å; F869-C1150 HydrophobicContact CE2-CB 4.11Å; F869-C1150 HydrophobicContact CZ-CB 4.49Å; T1146-C1150 PolarHBondContact O-N 3.5Å; T1146-C1150 VanDerWaalsContact O-N 3.14Å; A1147-C1150 PolarHBondContact O-N 3.26Å
1151	F	90	Very high	89.1	Confident	3 Å²	3	40.4 Å²	40.4	1%	0.013	21%	0.214	C	C	.	.	H	α-helix	trans	-125	-15	-173.8	-53.6	-77.6	0	0	0	114.3	F869 K988 F992 Q993 R996 A1147 L1155	F869-F1151 HydrophobicContact CD2-CE1 4.05Å; F869-F1151 HydrophobicContact CD2-CZ 4.24Å; F869-F1151 AromaticContact CE2-CE1 3.89Å; F869-F1151 HydrophobicContact CE2-CE1 3.89Å; F869-F1151 HydrophobicContact CE2-CE2 4.49Å; F869-F1151 AromaticContact CE2-CZ 3.68Å; F869-F1151 HydrophobicContact CE2-CZ 3.68Å; F869-F1151 AromaticContact CZ-CZ 3.89Å; F869-F1151 HydrophobicContact CZ-CZ 3.89Å; K988-F1151 HydrophobicContact CB-CZ 4.45Å; K988-F1151 WeakPolarHBondContact O-CZ 3.44Å; F992-F1151 HydrophobicContact CB-CD1 4.19Å; F992-F1151 HydrophobicContact CB-CD2 4.17Å; F992-F1151 HydrophobicContact CB-CE1 3.94Å; F992-F1151 HydrophobicContact CB-CE2 3.91Å; F992-F1151 HydrophobicContact CB-CG 4.33Å; F992-F1151 HydrophobicContact CB-CZ 3.81Å; F992-F1151 HydrophobicContact CD2-CD2 4.4Å; F992-F1151 HydrophobicContact CD2-CE2 4.03Å; Q993-F1151 HydrophobicContact CB-CE1 4.37Å; R996-F1151 HydrophobicContact CB-CB 4.34Å; R996-F1151 HydrophobicContact CB-CD1 4.18Å; R996-F1151 VanDerWaalsContact CD-O 3.29Å; R996-F1151 WeakPolarHBondContact CD-O 3.42Å; R996-F1151 HydrophobicContact CG-CB 4.25Å; R996-F1151 VanDerWaalsContact CG-O 3.3Å; R996-F1151 WeakPolarHBondContact CG-O 3.37Å; A1147-F1151 PolarHBondContact O-N 3.46Å; F1151-L1155 HydrophobicContact CB-CB 3.99Å; F1151-L1155 HydrophobicContact CB-CD2 4.29Å; F1151-L1155 HydrophobicContact CD2-CD2 4.43Å
1152	G	93.1	Very high	89.7	Confident	5 Å²	5	38.8 Å²	38.8	5%	0.052	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	58.2	-160.9	-174.5	0	0	0	0	0	113.3	E1148 G1154	E1148-G1152 WeakPolarHBondContact O-CA 3.28Å; E1148-G1152 PolarHBondContact O-N 3.43Å; G1152-G1154 PolarHBondContact O-N 2.77Å
1153	D	94.1	Very high	90.5	Very high	27 Å²	27	32.5 Å²	32.5	14%	0.144	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-15.2	-178.3	-61.5	-19	0	0	0	112.5	Y855 G857 L1155 N1156 W1157	Y855-D1153 HydrophobicContact CD1-CB 4.02Å; Y855-D1153 PolarHBondContact O-N 3.31Å; G857-D1153 PolarHBondContact N-OD2 3.14Å; D1153-L1155 VanDerWaalsContact C-N 3.26Å; D1153-L1155 PolarHBondContact O-N 2.94Å; D1153-N1156 PolarHBondContact O-N 3.06Å; D1153-W1157 VanDerWaalsContact O-CD1 3.28Å; D1153-W1157 PolarHBondContact O-N 2.92Å
1154	G	93.5	Very high	91.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-55.9	-40.3	-179.5	0	0	0	0	0	112.5	G999 G1152 N1156 W1157 A1158	G999-G1154 VanDerWaalsContact CA-O 3.31Å; G999-G1154 WeakPolarHBondContact CA-O 3.35Å; G1152-G1154 PolarHBondContact O-N 2.77Å; G1154-N1156 PolarHBondContact O-N 3.23Å; G1154-W1157 PolarHBondContact O-N 3.06Å; G1154-A1158 PolarHBondContact O-N 3.17Å; G1154-A1158 VanDerWaalsContact O-N 3.09Å
1155	L	94.8	Very high	91.5	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.01	10%	0.099	C	C	.	.	H	α-helix	trans	-55.9	-48.8	174.5	174.4	59.4	0	0	0	111.9	F992 L995 W1129 F1151 D1153 A1158 G1159	F992-L1155 HydrophobicContact CB-CD1 4.05Å; F992-L1155 HydrophobicContact CB-CD2 4.23Å; F992-L1155 HydrophobicContact CD1-CD1 3.93Å; F992-L1155 HydrophobicContact CD1-CD2 4.28Å; F992-L1155 HydrophobicContact CD2-CD2 4.13Å; F992-L1155 HydrophobicContact CG-CD1 4.12Å; F992-L1155 HydrophobicContact CG-CD2 3.97Å; L995-L1155 HydrophobicContact CB-CD1 3.67Å; L995-L1155 HydrophobicContact CD1-CD1 4.11Å; W1129-L1155 HydrophobicContact CH2-CD1 4.02Å; W1129-L1155 HydrophobicContact CH2-CG 4.06Å; W1129-L1155 WeakPolarHBondContact CH2-O 3.29Å; W1129-L1155 HydrophobicContact CZ3-CD1 4.27Å; F1151-L1155 HydrophobicContact CB-CB 3.99Å; F1151-L1155 HydrophobicContact CB-CD2 4.29Å; F1151-L1155 HydrophobicContact CD2-CD2 4.43Å; D1153-L1155 VanDerWaalsContact C-N 3.26Å; D1153-L1155 PolarHBondContact O-N 2.94Å; L1155-A1158 PolarHBondContact O-N 3.14Å; L1155-G1159 PolarHBondContact O-N 3.44Å; L1155-G1159 VanDerWaalsContact O-N 3.16Å
1156	N	94	Very high	91.8	Very high	3 Å²	3	15.3 Å²	15.3	2%	0.016	8%	0.081	C	C	.	.	H	α-helix	trans	-67.9	-36.1	179.5	-67.1	80.5	0	0	0	112	D1153 G1154 C1160 L1212 N1213 I1216	D1153-N1156 PolarHBondContact O-N 3.06Å; G1154-N1156 PolarHBondContact O-N 3.23Å; N1156-C1160 WeakPolarHBondContact O-CB 3.48Å; N1156-C1160 PolarHBondContact O-N 3.02Å; N1156-C1160 PolarHBondContact O-SG 3.36Å; N1156-L1212 HydrophobicContact CB-CD2 3.98Å; N1156-L1212 HydrophobicContact CB-CG 4.47Å; N1156-N1213 PolarHBondContact ND2-OD1 3.18Å; N1156-N1213 VanDerWaalsContact ND2-OD1 3.11Å; N1156-I1216 HydrophobicContact CB-CD1 3.82Å
1157	W	95.3	Very high	91.9	Very high	13 Å²	13	16.7 Å²	16.7	5%	0.049	10%	0.099	C	C	.	.	H	α-helix	trans	-61.3	-42.6	175.8	-88.9	86	0	0	0	112.4	I1002 L1003 L1006 F1091 D1153 G1154 A1161 I1216 I1219 L1220	I1002-W1157 HydrophobicContact CG2-CE3 4.38Å; L1003-W1157 HydrophobicContact CD1-CB 4.38Å; L1003-W1157 HydrophobicContact CD1-CG 4.08Å; L1003-W1157 HydrophobicContact CD2-CD2 3.67Å; L1003-W1157 HydrophobicContact CD2-CE3 4.18Å; L1003-W1157 HydrophobicContact CD2-CG 3.98Å; L1003-W1157 HydrophobicContact CD2-CH2 4.42Å; L1003-W1157 HydrophobicContact CD2-CZ2 3.96Å; L1003-W1157 HydrophobicContact CG-CB 4.43Å; L1003-W1157 HydrophobicContact CG-CD2 4.1Å; L1003-W1157 HydrophobicContact CG-CG 4.01Å; L1006-W1157 HydrophobicContact CD2-CH2 3.79Å; L1006-W1157 HydrophobicContact CD2-CZ3 4.21Å; F1091-W1157 HydrophobicContact CZ-CZ3 4.33Å; D1153-W1157 VanDerWaalsContact O-CD1 3.28Å; D1153-W1157 PolarHBondContact O-N 2.92Å; G1154-W1157 PolarHBondContact O-N 3.06Å; W1157-A1161 WeakPolarHBondContact O-CB 3.29Å; W1157-A1161 PolarHBondContact O-N 3.08Å; W1157-I1216 HydrophobicContact CD2-CD1 4.42Å; W1157-I1216 HydrophobicContact CD2-CG1 4.25Å; W1157-I1216 HydrophobicContact CD2-CG2 3.92Å; W1157-I1216 HydrophobicContact CE3-CG2 4.02Å; W1157-I1216 HydrophobicContact CG-CD1 4.04Å; W1157-I1216 HydrophobicContact CG-CG1 4.39Å; W1157-I1216 HydrophobicContact CG-CG2 4.33Å; W1157-I1216 HydrophobicContact CZ2-CG1 4.24Å; W1157-I1216 HydrophobicContact CZ3-CG2 4.39Å; W1157-I1219 HydrophobicContact CH2-CB 4.33Å; W1157-I1219 HydrophobicContact CH2-CD1 4.23Å; W1157-I1219 HydrophobicContact CH2-CG2 3.9Å; W1157-I1219 HydrophobicContact CZ2-CD1 4.18Å; W1157-L1220 HydrophobicContact CE3-CD2 4.39Å; W1157-L1220 HydrophobicContact CZ3-CD2 4Å; W1157-L1220 HydrophobicContact CZ3-CG 4.39Å
1158	A	94.9	Very high	92.2	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-67.3	-50.1	176.1	0	0	0	0	0	112.7	L995 V998 G1154 L1155 C1160 A1161 I1162	L995-A1158 HydrophobicContact CB-CB 4.22Å; L995-A1158 HydrophobicContact CD2-CB 4.14Å; L995-A1158 WeakPolarHBondContact O-CB 3.44Å; V998-A1158 HydrophobicContact CB-CB 4.06Å; V998-A1158 HydrophobicContact CG1-CB 3.99Å; G1154-A1158 PolarHBondContact O-N 3.17Å; G1154-A1158 VanDerWaalsContact O-N 3.09Å; L1155-A1158 PolarHBondContact O-N 3.14Å; A1158-C1160 VanDerWaalsContact C-N 3.35Å; A1158-C1160 PolarHBondContact O-N 3.03Å; A1158-A1161 PolarHBondContact O-N 3.46Å; A1158-I1162 WeakPolarHBondContact O-CG1 3.48Å; A1158-I1162 PolarHBondContact O-N 3.46Å
1159	G	93.2	Very high	92.3	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.3	-45.4	179.4	0	0	0	0	0	112.2	L1155 I1162 I1163	L1155-G1159 PolarHBondContact O-N 3.44Å; L1155-G1159 VanDerWaalsContact O-N 3.16Å; G1159-I1162 PolarHBondContact O-N 3.11Å; G1159-I1163 WeakPolarHBondContact O-CG1 3.24Å; G1159-I1163 PolarHBondContact O-N 2.8Å; G1159-I1163 VanDerWaalsContact O-N 3.14Å
1160	C	94.8	Very high	92.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-67.4	-38.3	177.3	-66	0	0	0	0	112.4	N1156 A1158 I1163 V1164 I1216 F1217 L1220	N1156-C1160 WeakPolarHBondContact O-CB 3.48Å; N1156-C1160 PolarHBondContact O-N 3.02Å; N1156-C1160 PolarHBondContact O-SG 3.36Å; A1158-C1160 VanDerWaalsContact C-N 3.35Å; A1158-C1160 PolarHBondContact O-N 3.03Å; C1160-I1163 PolarHBondContact O-N 3.36Å; C1160-V1164 WeakPolarHBondContact O-CG2 2.87Å; C1160-V1164 PolarHBondContact O-N 3.11Å; C1160-I1216 HydrophobicContact CB-CB 4.3Å; C1160-I1216 HydrophobicContact CB-CG2 3.6Å; C1160-F1217 HydrophobicContact CB-CD1 3.84Å; C1160-F1217 HydrophobicContact CB-CE1 3.49Å; C1160-F1217 VanDerWaalsContact CB-CE1 3.49Å; C1160-F1217 HydrophobicContact CB-CZ 4.22Å; C1160-L1220 HydrophobicContact CB-CD1 4.34Å
1161	A	93.4	Very high	92.6	Very high	2 Å²	2	22.2 Å²	22.2	2%	0.017	11%	0.11	C	C	.	.	H	α-helix	trans	-59.8	-48.1	175.2	0	0	0	0	0	111.5	I1002 W1157 A1158 I1163 V1164 L1165 L1220	I1002-A1161 HydrophobicContact CD1-CB 3.91Å; W1157-A1161 WeakPolarHBondContact O-CB 3.29Å; W1157-A1161 PolarHBondContact O-N 3.08Å; A1158-A1161 PolarHBondContact O-N 3.46Å; A1161-I1163 VanDerWaalsContact C-N 3.32Å; A1161-I1163 PolarHBondContact O-N 3.45Å; A1161-V1164 PolarHBondContact O-N 3.27Å; A1161-L1165 WeakPolarHBondContact O-CB 3.32Å; A1161-L1165 WeakPolarHBondContact O-CG 3.35Å; A1161-L1165 PolarHBondContact O-N 3.07Å; A1161-L1220 HydrophobicContact CB-CD1 4.18Å
1162	I	93.9	Very high	92.8	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.015	11%	0.109	C	C	.	.	H	α-helix	trans	-59.4	-44.7	177.6	-62.9	166.5	0	0	0	110.5	L939 L995 L1102 W1107 F1125 A1158 G1159 V1164 L1165 L1166	L939-I1162 HydrophobicContact CD2-CD1 3.83Å; L939-I1162 HydrophobicContact CD2-CG1 4.32Å; L995-I1162 HydrophobicContact CD2-CD1 4.01Å; L1102-I1162 HydrophobicContact CD1-CG2 4.08Å; L1102-I1162 HydrophobicContact CD2-CG2 4.49Å; W1107-I1162 HydrophobicContact CE3-CG2 4Å; W1107-I1162 HydrophobicContact CZ3-CD1 4.41Å; W1107-I1162 HydrophobicContact CZ3-CG2 3.95Å; F1125-I1162 HydrophobicContact CD1-CB 4.14Å; F1125-I1162 HydrophobicContact CD1-CG2 3.41Å; F1125-I1162 VanDerWaalsContact CD1-CG2 3.41Å; F1125-I1162 HydrophobicContact CE1-CB 3.68Å; F1125-I1162 HydrophobicContact CE1-CD1 4.21Å; F1125-I1162 HydrophobicContact CE1-CG2 3.41Å; F1125-I1162 VanDerWaalsContact CE1-CG2 3.41Å; F1125-I1162 HydrophobicContact CG-CG2 4Å; F1125-I1162 HydrophobicContact CZ-CB 4.26Å; F1125-I1162 HydrophobicContact CZ-CD1 3.9Å; F1125-I1162 HydrophobicContact CZ-CG2 4Å; A1158-I1162 WeakPolarHBondContact O-CG1 3.48Å; A1158-I1162 PolarHBondContact O-N 3.46Å; G1159-I1162 PolarHBondContact O-N 3.11Å; I1162-V1164 PolarHBondContact O-N 2.65Å; I1162-L1165 PolarHBondContact O-N 2.91Å; I1162-L1166 HydrophobicContact CG2-CD1 3.7Å; I1162-L1166 HydrophobicContact CG2-CG 4.36Å; I1162-L1166 WeakPolarHBondContact O-CB 3.32Å; I1162-L1166 VanDerWaalsContact O-CG 3.22Å; I1162-L1166 WeakPolarHBondContact O-CG 3.48Å; I1162-L1166 PolarHBondContact O-N 3.04Å
1163	I	93.9	Very high	92.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.3	-43.5	179	-70.8	170.4	0	0	0	112.2	F1125 H1126 W1129 G1159 C1160 A1161 G1167 Q1168 Q1169 F1172 F1217	F1125-I1163 HydrophobicContact CD1-CG1 4.07Å; F1125-I1163 HydrophobicContact CE1-CG1 4.14Å; H1126-I1163 HydrophobicContact CB-CD1 4.22Å; H1126-I1163 HydrophobicContact CB-CG1 4.05Å; W1129-I1163 HydrophobicContact CB-CD1 3.92Å; W1129-I1163 HydrophobicContact CG-CD1 3.69Å; G1159-I1163 WeakPolarHBondContact O-CG1 3.24Å; G1159-I1163 PolarHBondContact O-N 2.8Å; G1159-I1163 VanDerWaalsContact O-N 3.14Å; C1160-I1163 PolarHBondContact O-N 3.36Å; A1161-I1163 VanDerWaalsContact C-N 3.32Å; A1161-I1163 PolarHBondContact O-N 3.45Å; I1163-G1167 PolarHBondContact O-N 2.77Å; I1163-Q1168 HydrophobicContact CG2-CB 4.16Å; I1163-Q1168 PolarHBondContact O-N 2.99Å; I1163-Q1169 VanDerWaalsContact CG2-CA 3.47Å; I1163-Q1169 HydrophobicContact CG2-CB 4Å; I1163-F1172 HydrophobicContact CD1-CD2 4.12Å; I1163-F1172 HydrophobicContact CD1-CE2 4.4Å; I1163-F1172 HydrophobicContact CD1-CG 4.27Å; I1163-F1172 HydrophobicContact CG2-CB 4.29Å; I1163-F1217 HydrophobicContact CB-CE1 4.17Å; I1163-F1217 HydrophobicContact CB-CZ 4.48Å; I1163-F1217 HydrophobicContact CD1-CZ 4.42Å; I1163-F1217 HydrophobicContact CG2-CE1 3.96Å; I1163-F1217 HydrophobicContact CG2-CZ 4.04Å
1164	V	92.8	Very high	92.3	Very high	18 Å²	18	28.2 Å²	28.2	11%	0.109	14%	0.14	C	C	.	.	H	α-helix	trans	-68.3	-46.4	178.7	171.4	0	0	0	0	110.9	C1160 A1161 I1162 L1166 G1167 F1217 L1220	C1160-V1164 WeakPolarHBondContact O-CG2 2.87Å; C1160-V1164 PolarHBondContact O-N 3.11Å; A1161-V1164 PolarHBondContact O-N 3.27Å; I1162-V1164 PolarHBondContact O-N 2.65Å; V1164-L1166 PolarHBondContact O-N 3.25Å; V1164-G1167 PolarHBondContact O-N 3.48Å; V1164-F1217 HydrophobicContact CG2-CD1 3.42Å; V1164-F1217 VanDerWaalsContact CG2-CD1 3.42Å; V1164-F1217 HydrophobicContact CG2-CE1 3.9Å; V1164-F1217 HydrophobicContact CG2-CG 4.44Å; V1164-L1220 HydrophobicContact CB-CD1 4.39Å; V1164-L1220 HydrophobicContact CG1-CB 4.21Å; V1164-L1220 HydrophobicContact CG2-CB 4.29Å; V1164-L1220 HydrophobicContact CG2-CD1 4.09Å
1165	L	90.8	Very high	92.3	Very high	12 Å²	12	29.6 Å²	29.6	6%	0.063	15%	0.146	C	C	.	.	H	α-helix	trans	-65.8	-26.1	-178.3	-64.2	176.2	0	0	0	112.8	L1095 I1098 R1099 L1102 A1161 I1162 M1224	L1095-L1165 HydrophobicContact CB-CD2 4.17Å; L1095-L1165 WeakPolarHBondContact O-CD2 3.33Å; I1098-L1165 HydrophobicContact CB-CD1 3.98Å; I1098-L1165 HydrophobicContact CG2-CD1 3.6Å; R1099-L1165 HydrophobicContact CB-CB 4.27Å; R1099-L1165 HydrophobicContact CB-CD2 4.19Å; R1099-L1165 HydrophobicContact CG-CB 4.3Å; L1102-L1165 HydrophobicContact CD1-CB 4.23Å; A1161-L1165 WeakPolarHBondContact O-CB 3.32Å; A1161-L1165 WeakPolarHBondContact O-CG 3.35Å; A1161-L1165 PolarHBondContact O-N 3.07Å; I1162-L1165 PolarHBondContact O-N 2.91Å; L1165-M1224 HydrophobicContact CD2-CE 4.32Å; L1165-M1224 HydrophobicContact CD2-SD 4.07Å
1166	L	90.8	Very high	92.3	Very high	18 Å²	18	29.5 Å²	29.5	9%	0.094	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-6.3	171.9	-66.4	173.4	0	0	0	113.8	L1102 W1107 R1108 F1125 I1162 V1164 Q1168	L1102-L1166 HydrophobicContact CB-CD2 4.1Å; L1102-L1166 HydrophobicContact CD1-CD2 4.29Å; L1102-L1166 HydrophobicContact CD1-CG 4.24Å; W1107-L1166 HydrophobicContact CB-CD1 3.9Å; W1107-L1166 HydrophobicContact CB-CD2 3.85Å; W1107-L1166 HydrophobicContact CE3-CD1 4.39Å; R1108-L1166 HydrophobicContact CG-CD2 4.18Å; F1125-L1166 HydrophobicContact CB-CD1 4.02Å; F1125-L1166 HydrophobicContact CD1-CD1 4.48Å; I1162-L1166 HydrophobicContact CG2-CD1 3.7Å; I1162-L1166 HydrophobicContact CG2-CG 4.36Å; I1162-L1166 WeakPolarHBondContact O-CB 3.32Å; I1162-L1166 VanDerWaalsContact O-CG 3.22Å; I1162-L1166 WeakPolarHBondContact O-CG 3.48Å; I1162-L1166 PolarHBondContact O-N 3.04Å; V1164-L1166 PolarHBondContact O-N 3.25Å; L1166-Q1168 VanDerWaalsContact C-N 3.3Å; L1166-Q1168 HydrophobicContact CB-CB 4.49Å; L1166-Q1168 HydrophobicContact CB-CG 3.9Å; L1166-Q1168 PolarHBondContact O-N 2.69Å
1167	G	88.6	Confident	92.2	Very high	51 Å²	51	29.4 Å²	29.4	53%	0.526	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	26.4	-175.7	0	0	0	0	0	113.8	I1163 V1164	I1163-G1167 PolarHBondContact O-N 2.77Å; V1164-G1167 PolarHBondContact O-N 3.48Å
1168	Q	91.4	Very high	92.1	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.143	C	C	.	.			trans	-95.7	-8	-174.2	-72.5	178.5	4.1	0	0	113.9	W1107 E1124 H1126 I1163 L1166 R1170 R1171 F1172	W1107-Q1168 PolarHBondContact O-NE2 2.84Å; E1124-Q1168 WeakPolarHBondContact OE2-CG 3.45Å; H1126-Q1168 HydrophobicContact CB-CB 4Å; I1163-Q1168 HydrophobicContact CG2-CB 4.16Å; I1163-Q1168 PolarHBondContact O-N 2.99Å; L1166-Q1168 VanDerWaalsContact C-N 3.3Å; L1166-Q1168 HydrophobicContact CB-CB 4.49Å; L1166-Q1168 HydrophobicContact CB-CG 3.9Å; L1166-Q1168 PolarHBondContact O-N 2.69Å; Q1168-R1170 PolarHBondContact O-N 3.34Å; Q1168-R1171 PolarHBondContact O-N 3.41Å; Q1168-F1172 PolarHBondContact O-N 3.22Å
1169	Q	91.3	Very high	92	Very high	34 Å²	34	29.3 Å²	29.3	16%	0.159	15%	0.145	C	C	.	.	H	α-helix	trans	-54.1	-48.5	-172.8	-173.1	-154.6	-22.5	0	0	114	I1163 R1171 F1172 D1173 F1217 N1221	I1163-Q1169 VanDerWaalsContact CG2-CA 3.47Å; I1163-Q1169 HydrophobicContact CG2-CB 4Å; Q1169-R1171 PolarHBondContact O-N 3.07Å; Q1169-F1172 WeakPolarHBondContact O-CB 3.41Å; Q1169-F1172 PolarHBondContact O-N 3.23Å; Q1169-F1172 VanDerWaalsContact O-N 3.1Å; Q1169-D1173 PolarHBondContact NE2-OD2 3.34Å; Q1169-D1173 PolarHBondContact O-N 3.09Å; Q1169-F1217 HydrophobicContact CG-CB 4.37Å; Q1169-F1217 HydrophobicContact CG-CD1 3.9Å; Q1169-F1217 HydrophobicContact CG-CD2 3.75Å; Q1169-F1217 HydrophobicContact CG-CE1 4Å; Q1169-F1217 HydrophobicContact CG-CE2 3.88Å; Q1169-F1217 HydrophobicContact CG-CG 3.77Å; Q1169-F1217 HydrophobicContact CG-CZ 4.01Å; Q1169-N1221 PolarHBondContact OE1-ND2 3.37Å
1170	R	89.8	Confident	92	Very high	212 Å²	212	30.2 Å²	30.2	80%	0.8	15%	0.149	S	C	*	.	H	α-helix	trans	-62	-32.7	-178.3	-61.7	-178.1	-168.7	167.9	6	112.1	Q1168 L1174	Q1168-R1170 PolarHBondContact O-N 3.34Å; R1170-L1174 WeakPolarHBondContact O-CG 3.38Å; R1170-L1174 PolarHBondContact O-N 3.42Å
1171	R	90.8	Very high	91.8	Very high	63 Å²	63	30.2 Å²	30.2	24%	0.238	15%	0.149	C	C	.	.	H	α-helix	trans	-75.2	-38.8	176	-65.1	-165.8	-69.9	-86.7	9.2	111.3	M1117 E1124 Q1168 Q1169 L1174 F1175	M1117-R1171 HydrophobicContact CE-CG 3.88Å; E1124-R1171 IonicContact OE1-CZ 2.8Å; E1124-R1171 IonicContact OE1-NE 3.83Å; E1124-R1171 PolarHBondContact OE1-NE 3.29Å; E1124-R1171 IonicContact OE1-NH2 3.73Å; E1124-R1171 PolarHBondContact OE1-NH2 3.2Å; E1124-R1171 IonicContact OE2-CZ 3.79Å; E1124-R1171 IonicContact OE2-NE 3.23Å; E1124-R1171 PolarHBondContact OE2-NE 2.9Å; E1124-R1171 IonicContact OE2-NH2 3.42Å; E1124-R1171 PolarHBondContact OE2-NH2 3.1Å; Q1168-R1171 PolarHBondContact O-N 3.41Å; Q1169-R1171 PolarHBondContact O-N 3.07Å; R1171-L1174 PolarHBondContact O-N 2.98Å; R1171-F1175 HydrophobicContact CB-CD2 4.42Å; R1171-F1175 WeakPolarHBondContact O-CB 3.42Å; R1171-F1175 WeakPolarHBondContact O-CD2 3.26Å; R1171-F1175 PolarHBondContact O-N 2.83Å
1172	F	93	Very high	91.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-57.3	-50.9	171.7	177	-101.3	0	0	0	111.8	H1126 W1129 S1130 I1163 Q1168 Q1169 L1174 F1175 D1176 Y1179 F1217	H1126-F1172 HydrophobicContact CB-CB 4Å; H1126-F1172 HydrophobicContact CB-CD2 4.12Å; H1126-F1172 HydrophobicContact CB-CG 4.48Å; W1129-F1172 AromaticContact CD1-CE2 3.6Å; W1129-F1172 AromaticContact CD1-CZ 3.81Å; S1130-F1172 WeakPolarHBondContact OG-CD2 3.42Å; S1130-F1172 VanDerWaalsContact OG-CE2 3.29Å; S1130-F1172 WeakPolarHBondContact OG-CE2 3.38Å; I1163-F1172 HydrophobicContact CD1-CD2 4.12Å; I1163-F1172 HydrophobicContact CD1-CE2 4.4Å; I1163-F1172 HydrophobicContact CD1-CG 4.27Å; I1163-F1172 HydrophobicContact CG2-CB 4.29Å; Q1168-F1172 PolarHBondContact O-N 3.22Å; Q1169-F1172 WeakPolarHBondContact O-CB 3.41Å; Q1169-F1172 PolarHBondContact O-N 3.23Å; Q1169-F1172 VanDerWaalsContact O-N 3.1Å; F1172-L1174 PolarHBondContact O-N 3.43Å; F1172-L1174 VanDerWaalsContact O-N 3.16Å; F1172-F1175 PolarHBondContact O-N 3.45Å; F1172-F1175 VanDerWaalsContact O-N 3.16Å; F1172-D1176 HydrophobicContact CD2-CB 4.29Å; F1172-D1176 HydrophobicContact CE2-CB 4.01Å; F1172-D1176 VanDerWaalsContact CE2-OD1 3.24Å; F1172-D1176 WeakPolarHBondContact CE2-OD1 3.11Å; F1172-D1176 HydrophobicContact CZ-CB 4.18Å; F1172-D1176 VanDerWaalsContact O-CB 3.26Å; F1172-D1176 WeakPolarHBondContact O-CB 3.26Å; F1172-D1176 PolarHBondContact O-N 3.22Å; F1172-Y1179 HydrophobicContact CD1-CE2 4.38Å; F1172-Y1179 AromaticContact CE1-CE2 3.84Å; F1172-Y1179 HydrophobicContact CE1-CE2 3.84Å; F1172-Y1179 AromaticContact CE1-CZ 3.89Å; F1172-F1217 AromaticContact CD1-CE2 3.86Å; F1172-F1217 HydrophobicContact CD1-CE2 3.86Å; F1172-F1217 AromaticContact CD1-CZ 3.92Å; F1172-F1217 HydrophobicContact CD1-CZ 3.92Å; F1172-F1217 AromaticContact CE1-CE2 3.98Å; F1172-F1217 HydrophobicContact CE1-CE2 3.98Å; F1172-F1217 HydrophobicContact CE1-CZ 4.13Å
1173	D	90.5	Very high	91.7	Very high	52 Å²	52	35.7 Å²	35.7	28%	0.278	17%	0.173	S	C	.	.	H	α-helix	trans	-59.7	-31.3	-178.9	-68.7	-24.8	0	0	0	113	Q1169	Q1169-D1173 PolarHBondContact NE2-OD2 3.34Å; Q1169-D1173 PolarHBondContact O-N 3.09Å
1174	L	87.9	Confident	91.6	Very high	108 Å²	108	35.8 Å²	35.8	57%	0.565	17%	0.173	S	C	*	.	H	α-helix	trans	-81.2	-38.2	177.8	-72.1	172.7	0	0	0	113.2	R1170 R1171 F1172	R1170-L1174 WeakPolarHBondContact O-CG 3.38Å; R1170-L1174 PolarHBondContact O-N 3.42Å; R1171-L1174 PolarHBondContact O-N 2.98Å; F1172-L1174 PolarHBondContact O-N 3.43Å; F1172-L1174 VanDerWaalsContact O-N 3.16Å
1175	F	92.4	Very high	91.5	Very high	30 Å²	30	35.3 Å²	35.3	13%	0.132	17%	0.17	C	C	.	.	H	α-helix	trans	-113.6	2.9	-166.4	-63.4	-51.8	0	0	0	116	L960 M1117 H1118 V1119 R1127 R1171 F1172 F1177	L960-F1175 HydrophobicContact CD1-CD1 4.1Å; M1117-F1175 HydrophobicContact CE-CD2 4.33Å; M1117-F1175 HydrophobicContact CE-CE2 3.27Å; M1117-F1175 HydrophobicContact CE-CZ 3.76Å; H1118-F1175 WeakPolarHBondContact O-CE2 3.38Å; V1119-F1175 HydrophobicContact CB-CZ 4.1Å; V1119-F1175 HydrophobicContact CG1-CE1 3.79Å; V1119-F1175 HydrophobicContact CG1-CZ 3.75Å; V1119-F1175 HydrophobicContact CG2-CE2 4.45Å; V1119-F1175 HydrophobicContact CG2-CZ 3.95Å; R1127-F1175 PolarHBondContact NH1-O 3.38Å; R1171-F1175 HydrophobicContact CB-CD2 4.42Å; R1171-F1175 WeakPolarHBondContact O-CB 3.42Å; R1171-F1175 WeakPolarHBondContact O-CD2 3.26Å; R1171-F1175 PolarHBondContact O-N 2.83Å; F1172-F1175 PolarHBondContact O-N 3.45Å; F1172-F1175 VanDerWaalsContact O-N 3.16Å; F1175-F1177 PolarHBondContact O-N 3Å
1176	D	94.1	Very high	91.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.193	C	C	.	.			trans	-61.3	132.2	177.3	-179.5	74.4	0	0	0	112.8	S1130 Q1133 F1172 C1178 Y1179 H1180	S1130-D1176 VanDerWaalsContact CA-OD1 3.28Å; S1130-D1176 WeakPolarHBondContact CA-OD1 3.49Å; S1130-D1176 WeakPolarHBondContact CB-OD1 3.4Å; S1130-D1176 WeakPolarHBondContact OG-CA 3.29Å; S1130-D1176 PolarHBondContact OG-OD1 3.12Å; Q1133-D1176 PolarHBondContact NE2-OD1 2.59Å; Q1133-D1176 PolarHBondContact NE2-OD2 2.94Å; F1172-D1176 HydrophobicContact CD2-CB 4.29Å; F1172-D1176 HydrophobicContact CE2-CB 4.01Å; F1172-D1176 VanDerWaalsContact CE2-OD1 3.24Å; F1172-D1176 WeakPolarHBondContact CE2-OD1 3.11Å; F1172-D1176 HydrophobicContact CZ-CB 4.18Å; F1172-D1176 VanDerWaalsContact O-CB 3.26Å; F1172-D1176 WeakPolarHBondContact O-CB 3.26Å; F1172-D1176 PolarHBondContact O-N 3.22Å; D1176-C1178 PolarHBondContact O-N 3.16Å; D1176-C1178 WeakPolarHBondContact OD2-CA 3.44Å; D1176-C1178 VanDerWaalsContact OD2-CB 3.26Å; D1176-C1178 WeakPolarHBondContact OD2-CB 3.45Å; D1176-C1178 PolarHBondContact OD2-N 3.35Å; D1176-Y1179 HydrophobicContact CB-CD1 4.46Å; D1176-Y1179 HydrophobicContact CB-CD2 3.89Å; D1176-Y1179 HydrophobicContact CB-CE2 4.45Å; D1176-Y1179 HydrophobicContact CB-CG 3.88Å; D1176-Y1179 PolarHBondContact O-N 2.99Å; D1176-Y1179 VanDerWaalsContact OD2-CD1 3.29Å; D1176-Y1179 WeakPolarHBondContact OD2-CD1 3.42Å; D1176-Y1179 PolarHBondContact OD2-N 2.88Å; D1176-H1180 PolarHBondContact O-N 2.77Å
1177	F	92.5	Very high	91.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63	-42.4	-176.6	-54.1	-50.6	0	0	0	111.9	M954 C958 L960 F974 L978 F1175 H1180 L1181	M954-F1177 HydrophobicContact CE-CE2 3.68Å; M954-F1177 HydrophobicContact CE-CZ 3.93Å; C958-F1177 HydrophobicContact CB-CE1 3.95Å; C958-F1177 HydrophobicContact CB-CZ 4.01Å; C958-F1177 VanDerWaalsContact SG-CE1 3.56Å; L960-F1177 HydrophobicContact CD2-CD1 3.97Å; F974-F1177 HydrophobicContact CD1-CB 4.17Å; F974-F1177 HydrophobicContact CD1-CD1 4.08Å; F974-F1177 HydrophobicContact CD1-CG 4.23Å; F974-F1177 HydrophobicContact CD2-CB 4.27Å; F974-F1177 HydrophobicContact CE1-CB 4.02Å; F974-F1177 AromaticContact CE1-CD1 3.55Å; F974-F1177 HydrophobicContact CE1-CD1 3.55Å; F974-F1177 HydrophobicContact CE1-CE1 4.35Å; F974-F1177 HydrophobicContact CE1-CG 4.05Å; F974-F1177 HydrophobicContact CE2-CB 4.08Å; F974-F1177 VanDerWaalsContact CE2-O 3.3Å; F974-F1177 WeakPolarHBondContact CE2-O 3.33Å; F974-F1177 HydrophobicContact CG-CB 4.31Å; F974-F1177 HydrophobicContact CZ-CB 3.97Å; F974-F1177 HydrophobicContact CZ-CD1 4.04Å; F974-F1177 HydrophobicContact CZ-CG 4.43Å; L978-F1177 HydrophobicContact CD1-CD2 3.86Å; L978-F1177 HydrophobicContact CD1-CE2 4.28Å; L978-F1177 HydrophobicContact CD2-CD2 4.45Å; L978-F1177 HydrophobicContact CD2-CE2 4.04Å; F1175-F1177 PolarHBondContact O-N 3Å; F1177-H1180 PolarHBondContact O-N 2.85Å; F1177-L1181 PolarHBondContact O-N 2.66Å
1178	C	93.4	Very high	91.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.9	-40.9	179.6	-70.8	0	0	0	0	111.8	Q1133 F1134 D1176 H1180 L1181 L1182 I1206	Q1133-C1178 HydrophobicContact CG-CB 4.31Å; F1134-C1178 WeakPolarHBondContact CA-SG 3.19Å; D1176-C1178 PolarHBondContact O-N 3.16Å; D1176-C1178 WeakPolarHBondContact OD2-CA 3.44Å; D1176-C1178 VanDerWaalsContact OD2-CB 3.26Å; D1176-C1178 WeakPolarHBondContact OD2-CB 3.45Å; D1176-C1178 PolarHBondContact OD2-N 3.35Å; C1178-H1180 VanDerWaalsContact C-N 3.28Å; C1178-H1180 PolarHBondContact O-N 3.37Å; C1178-L1181 PolarHBondContact O-N 3.17Å; C1178-L1182 WeakPolarHBondContact O-CB 3.38Å; C1178-L1182 PolarHBondContact O-N 3.16Å; C1178-I1206 HydrophobicContact CB-CB 4.37Å; C1178-I1206 HydrophobicContact CB-CD1 3.78Å; C1178-I1206 HydrophobicContact CB-CG1 3.77Å; C1178-I1206 HydrophobicContact CB-CG2 3.68Å; C1178-I1206 WeakPolarHBondContact O-CG2 3.49Å
1179	Y	93.8	Very high	91.1	Very high	12 Å²	12	49.9 Å²	49.9	5%	0.047	23%	0.234	C	C	.	.	H	α-helix	trans	-65.1	-35.7	178.4	-67	2	0	0	0	111.3	Q1133 F1172 D1176 K1183 I1206 Q1210 N1213	Q1133-Y1179 VanDerWaalsContact NE2-CE1 3.26Å; F1172-Y1179 HydrophobicContact CD1-CE2 4.38Å; F1172-Y1179 AromaticContact CE1-CE2 3.84Å; F1172-Y1179 HydrophobicContact CE1-CE2 3.84Å; F1172-Y1179 AromaticContact CE1-CZ 3.89Å; D1176-Y1179 HydrophobicContact CB-CD1 4.46Å; D1176-Y1179 HydrophobicContact CB-CD2 3.89Å; D1176-Y1179 HydrophobicContact CB-CE2 4.45Å; D1176-Y1179 HydrophobicContact CB-CG 3.88Å; D1176-Y1179 PolarHBondContact O-N 2.99Å; D1176-Y1179 VanDerWaalsContact OD2-CD1 3.29Å; D1176-Y1179 WeakPolarHBondContact OD2-CD1 3.42Å; D1176-Y1179 PolarHBondContact OD2-N 2.88Å; Y1179-K1183 WeakPolarHBondContact O-CB 3.43Å; Y1179-K1183 PolarHBondContact O-N 3Å; Y1179-I1206 HydrophobicContact CD1-CG2 4.26Å; Y1179-Q1210 HydrophobicContact CD1-CB 4.17Å; Y1179-Q1210 HydrophobicContact CD1-CG 4.13Å; Y1179-Q1210 HydrophobicContact CE1-CB 3.52Å; Y1179-Q1210 HydrophobicContact CE1-CG 3.65Å; Y1179-Q1210 HydrophobicContact CE2-CG 4.19Å; Y1179-N1213 PolarHBondContact OH-ND2 3.14Å; Y1179-N1213 VanDerWaalsContact OH-ND2 3.14Å
1180	H	92.2	Very high	91	Very high	18 Å²	18	52.7 Å²	52.7	8%	0.083	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-48.5	171.8	-171.7	60.8	0	0	0	112.1	L960 P961 H963 D1176 F1177 C1178 L1182 K1183 V1184	L960-H1180 HydrophobicContact CD1-CB 4.36Å; L960-H1180 HydrophobicContact CD2-CB 3.97Å; P961-H1180 PolarHBondContact O-CE1 2.77Å; P961-H1180 PolarHBondContact O-NE2 3.42Å; H963-H1180 AromaticContact NE2-CE1 3.94Å; D1176-H1180 PolarHBondContact O-N 2.77Å; F1177-H1180 PolarHBondContact O-N 2.85Å; C1178-H1180 VanDerWaalsContact C-N 3.28Å; C1178-H1180 PolarHBondContact O-N 3.37Å; H1180-L1182 VanDerWaalsContact C-N 3.33Å; H1180-L1182 PolarHBondContact O-N 3.05Å; H1180-K1183 WeakPolarHBondContact O-CB 3.33Å; H1180-K1183 PolarHBondContact O-N 2.85Å; H1180-K1183 VanDerWaalsContact O-N 3.1Å; H1180-V1184 PolarHBondContact O-N 3.49Å
1181	L	91.5	Very high	90.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.7	-45.6	176.3	178.8	62.6	0	0	0	111.8	S967 I970 L971 F974 F1177 C1178 K1183 V1184 Q1185 L1199 M1202 I1206	S967-L1181 WeakPolarHBondContact O-CD1 3.42Å; I970-L1181 HydrophobicContact CB-CD1 4.19Å; I970-L1181 HydrophobicContact CG2-CD1 3.94Å; L971-L1181 HydrophobicContact CB-CD1 4.09Å; L971-L1181 HydrophobicContact CB-CD2 4.32Å; L971-L1181 HydrophobicContact CD1-CD2 3.89Å; F974-L1181 HydrophobicContact CE2-CB 4.38Å; F1177-L1181 PolarHBondContact O-N 2.66Å; C1178-L1181 PolarHBondContact O-N 3.17Å; L1181-K1183 VanDerWaalsContact C-N 3.33Å; L1181-K1183 PolarHBondContact O-N 2.83Å; L1181-V1184 PolarHBondContact O-N 3.39Å; L1181-Q1185 VanDerWaalsContact O-CB 3.29Å; L1181-Q1185 WeakPolarHBondContact O-CB 3.06Å; L1181-Q1185 PolarHBondContact O-N 2.87Å; L1181-L1199 HydrophobicContact CD1-CD1 4.02Å; L1181-L1199 HydrophobicContact CD2-CD1 4.39Å; L1181-L1199 HydrophobicContact CG-CD1 4.43Å; L1181-M1202 HydrophobicContact CD2-CG 4.25Å; L1181-I1206 HydrophobicContact CD2-CD1 4.01Å
1182	L	92.7	Very high	90.8	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-39.9	176.5	176.2	62.9	0	0	0	112	C1178 H1180 R1186 A1203 I1206 R1207	C1178-L1182 WeakPolarHBondContact O-CB 3.38Å; C1178-L1182 PolarHBondContact O-N 3.16Å; H1180-L1182 VanDerWaalsContact C-N 3.33Å; H1180-L1182 PolarHBondContact O-N 3.05Å; L1182-R1186 HydrophobicContact CD1-CG 4.18Å; L1182-R1186 WeakPolarHBondContact O-CB 3.47Å; L1182-R1186 VanDerWaalsContact O-CG 3.28Å; L1182-R1186 WeakPolarHBondContact O-CG 3.36Å; L1182-R1186 PolarHBondContact O-N 2.82Å; L1182-A1203 HydrophobicContact CD1-CB 4.05Å; L1182-I1206 HydrophobicContact CB-CG2 3.95Å; L1182-I1206 HydrophobicContact CD2-CG2 4.07Å; L1182-R1207 HydrophobicContact CD1-CB 4.46Å; L1182-R1207 HydrophobicContact CD2-CB 3.99Å
1183	K	91.4	Very high	90.6	Very high	113 Å²	113	54.5 Å²	54.5	49%	0.491	27%	0.272	S	S	.	.	H	α-helix	trans	-63.2	-44.3	179	-170.6	-175.3	-63.1	170.1	0	111.2	Y1179 H1180 L1181 Q1187	Y1179-K1183 WeakPolarHBondContact O-CB 3.43Å; Y1179-K1183 PolarHBondContact O-N 3Å; H1180-K1183 WeakPolarHBondContact O-CB 3.33Å; H1180-K1183 PolarHBondContact O-N 2.85Å; H1180-K1183 VanDerWaalsContact O-N 3.1Å; L1181-K1183 VanDerWaalsContact C-N 3.33Å; L1181-K1183 PolarHBondContact O-N 2.83Å; K1183-Q1187 PolarHBondContact O-N 3.39Å
1184	V	91.3	Very high	90.3	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-72.6	-42	178.7	-176.6	0	0	0	0	111.5	I970 H1180 L1181 R1186 Q1187 D1188	I970-V1184 HydrophobicContact CD1-CB 3.89Å; I970-V1184 HydrophobicContact CD1-CG1 3.76Å; I970-V1184 HydrophobicContact CD1-CG2 3.67Å; H1180-V1184 PolarHBondContact O-N 3.49Å; L1181-V1184 PolarHBondContact O-N 3.39Å; V1184-R1186 VanDerWaalsContact C-N 3.28Å; V1184-R1186 PolarHBondContact O-N 3.02Å; V1184-Q1187 WeakPolarHBondContact O-CB 3.33Å; V1184-Q1187 PolarHBondContact O-N 3.43Å; V1184-D1188 PolarHBondContact O-N 3.11Å
1185	Q	91	Very high	90	Very high	9 Å²	9	52.7 Å²	52.7	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-37.4	177.2	-165.6	-74.1	-33.2	0	0	112.1	L1181 Q1187 D1188 G1189 K1190 L1199 A1203	L1181-Q1185 VanDerWaalsContact O-CB 3.29Å; L1181-Q1185 WeakPolarHBondContact O-CB 3.06Å; L1181-Q1185 PolarHBondContact O-N 2.87Å; Q1185-Q1187 VanDerWaalsContact C-N 3.27Å; Q1185-Q1187 PolarHBondContact O-N 3.17Å; Q1185-D1188 WeakPolarHBondContact CA-OD1 3.44Å; Q1185-G1189 WeakPolarHBondContact O-CA 3.3Å; Q1185-G1189 PolarHBondContact O-N 3.38Å; Q1185-K1190 PolarHBondContact NE2-O 3.3Å; Q1185-L1199 HydrophobicContact CG-CD1 4.42Å; Q1185-L1199 HydrophobicContact CG-CD2 4.37Å; Q1185-L1199 HydrophobicContact CG-CG 4.1Å; Q1185-A1203 HydrophobicContact CB-CB 4.37Å; Q1185-A1203 HydrophobicContact CG-CB 3.98Å
1186	R	90.3	Very high	89.5	Confident	144 Å²	144	58.5 Å²	58.5	54%	0.543	29%	0.29	S	S	.	.	H	α-helix	trans	-66.8	-28.7	174.1	-79	178.3	174.6	-171.8	-2.7	113.4	L1182 V1184	L1182-R1186 HydrophobicContact CD1-CG 4.18Å; L1182-R1186 WeakPolarHBondContact O-CB 3.47Å; L1182-R1186 VanDerWaalsContact O-CG 3.28Å; L1182-R1186 WeakPolarHBondContact O-CG 3.36Å; L1182-R1186 PolarHBondContact O-N 2.82Å; V1184-R1186 VanDerWaalsContact C-N 3.28Å; V1184-R1186 PolarHBondContact O-N 3.02Å
1187	Q	89	Confident	89.2	Confident	135 Å²	135	58.7 Å²	58.7	63%	0.631	29%	0.291	S	S	*	.	H	α-helix	trans	-82.6	-43	-179.5	-178.9	174.7	-8.3	0	0	112	H963 K1183 V1184 Q1185	H963-Q1187 PolarHBondContact CE1-OE1 3.39Å; H963-Q1187 PolarHBondContact ND1-OE1 3.09Å; K1183-Q1187 PolarHBondContact O-N 3.39Å; V1184-Q1187 WeakPolarHBondContact O-CB 3.33Å; V1184-Q1187 PolarHBondContact O-N 3.43Å; Q1185-Q1187 VanDerWaalsContact C-N 3.27Å; Q1185-Q1187 PolarHBondContact O-N 3.17Å
1188	D	88.6	Confident	89.1	Confident	53 Å²	53	60.1 Å²	60.1	28%	0.283	30%	0.301	S	S	.	.	H	α-helix	trans	-93.4	-18.3	-176.4	70.7	8	0	0	0	114.3	S967 V1184 Q1185 K1190	S967-D1188 WeakPolarHBondContact CB-OD2 3.34Å; S967-D1188 PolarHBondContact N-OD2 2.91Å; S967-D1188 PolarHBondContact OG-OD1 2.72Å; S967-D1188 PolarHBondContact OG-OD2 3.41Å; V1184-D1188 PolarHBondContact O-N 3.11Å; Q1185-D1188 WeakPolarHBondContact CA-OD1 3.44Å; D1188-K1190 HydrophobicContact CB-CG 4.33Å; D1188-K1190 PolarHBondContact O-N 3.3Å; D1188-K1190 PolarHBondContact OD1-N 3.44Å
1189	G	86.6	Confident	88.9	Confident	55 Å²	55	60.1 Å²	60.1	57%	0.567	30%	0.301	S	S	*	.			trans	67.3	12.8	175.6	0	0	0	0	0	115.1	Q1185	Q1185-G1189 WeakPolarHBondContact O-CA 3.3Å; Q1185-G1189 PolarHBondContact O-N 3.38Å
1190	K	88	Confident	88.6	Confident	93 Å²	93	63.7 Å²	63.7	40%	0.404	32%	0.316	S	S	.	.			trans	-73.1	150.1	-175.6	-65.2	-176.3	176.7	-173.9	0	112.2	P968 Q1185 D1188	P968-K1190 HydrophobicContact CG-CB 4.06Å; P968-K1190 HydrophobicContact CG-CD 3.84Å; Q1185-K1190 PolarHBondContact NE2-O 3.3Å; D1188-K1190 HydrophobicContact CB-CG 4.33Å; D1188-K1190 PolarHBondContact O-N 3.3Å; D1188-K1190 PolarHBondContact OD1-N 3.44Å
1191	D	87.9	Confident	88.5	Confident	101 Å²	101	69 Å²	69	54%	0.54	34%	0.339	S	S	.	.			trans	-141.2	95.8	175.9	-172.4	20.7	0	0	0	110.2	K1200	D1191-K1200 HydrophobicContact CB-CB 4.13Å; D1191-K1200 WeakPolarHBondContact OD1-CB 3.3Å; D1191-K1200 PolarHBondContact OD1-N 2.98Å; D1191-K1200 WeakPolarHBondContact OD2-CB 3.33Å
1192	E	89.2	Confident	88.4	Confident	89 Å²	89	69 Å²	69	42%	0.416	34%	0.339	S	S	.	.			trans	-123.6	158	179.2	-67.6	175.5	-156.7	0	0	109.6	P968 I1194 L1199	P968-E1192 HydrophobicContact CB-CB 4.29Å; P968-E1192 VanDerWaalsContact CB-OE2 3.24Å; P968-E1192 WeakPolarHBondContact CB-OE2 3.41Å; P968-E1192 HydrophobicContact CG-CB 4.22Å; P968-E1192 VanDerWaalsContact CG-CD 3.45Å; P968-E1192 HydrophobicContact CG-CG 4.08Å; P968-E1192 WeakPolarHBondContact CG-OE2 3.28Å; E1192-I1194 HydrophobicContact CB-CD1 4.07Å; E1192-I1194 HydrophobicContact CB-CG1 4.36Å; E1192-L1199 WeakPolarHBondContact O-CB 3.29Å; E1192-L1199 PolarHBondContact O-N 3.39Å
1193	I	88.6	Confident	88.3	Confident	124 Å²	124	68.8 Å²	68.8	64%	0.636	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	107.5	174.1	-55.2	179.2	0	0	0	107.9
1194	I	84.8	Confident	88.2	Confident	23 Å²	23	67.3 Å²	67.3	12%	0.118	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.9	-177.3	-54.8	-58.9	0	0	0	108.5	P968 L971 E972 E1192 N1196 V1197	P968-I1194 HydrophobicContact CB-CD1 3.96Å; P968-I1194 HydrophobicContact CB-CG1 4.05Å; L971-I1194 HydrophobicContact CD2-CB 3.84Å; L971-I1194 HydrophobicContact CD2-CG1 4.21Å; L971-I1194 HydrophobicContact CG-CB 4.21Å; L971-I1194 HydrophobicContact CG-CG2 4.35Å; E972-I1194 HydrophobicContact CB-CG2 3.8Å; E972-I1194 HydrophobicContact CG-CG2 4.31Å; E1192-I1194 HydrophobicContact CB-CD1 4.07Å; E1192-I1194 HydrophobicContact CB-CG1 4.36Å; I1194-N1196 VanDerWaalsContact C-N 3.31Å; I1194-N1196 PolarHBondContact O-N 3.38Å; I1194-V1197 PolarHBondContact N-O 2.94Å; I1194-V1197 WeakPolarHBondContact O-CA 3.5Å; I1194-V1197 VanDerWaalsContact O-CB 3.29Å; I1194-V1197 WeakPolarHBondContact O-CB 3.42Å; I1194-V1197 PolarHBondContact O-N 2.93Å
1195	K	79.9	Confident	88.3	Confident	99 Å²	99	69.2 Å²	69.2	43%	0.43	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	49.4	-176.1	-67.4	-173.2	173.4	-175	0	113.2	H975 V1197	H975-K1195 HydrophobicContact CB-CD 4.07Å; K1195-V1197 PolarHBondContact O-N 3.33Å
1196	N	82.5	Confident	88.4	Confident	152 Å²	152	68.8 Å²	68.8	81%	0.813	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	10.1	-176.1	-59.6	-19.8	0	0	0	115.6	I1194 P1198	I1194-N1196 VanDerWaalsContact C-N 3.31Å; I1194-N1196 PolarHBondContact O-N 3.38Å; N1196-P1198 WeakPolarHBondContact O-CD 3.49Å
1197	V	87.7	Confident	88.5	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.024	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	111.7	176.2	179.9	0	0	0	0	110	L971 I1138 I1194 K1195 L1199 M1202	L971-V1197 HydrophobicContact CD2-CB 4.33Å; L971-V1197 HydrophobicContact CD2-CG1 4.1Å; I1138-V1197 HydrophobicContact CG2-CG2 3.89Å; I1194-V1197 PolarHBondContact N-O 2.94Å; I1194-V1197 WeakPolarHBondContact O-CA 3.5Å; I1194-V1197 VanDerWaalsContact O-CB 3.29Å; I1194-V1197 WeakPolarHBondContact O-CB 3.42Å; I1194-V1197 PolarHBondContact O-N 2.93Å; K1195-V1197 PolarHBondContact O-N 3.33Å; V1197-L1199 PolarHBondContact O-N 3.17Å; V1197-M1202 HydrophobicContact CG1-CB 3.89Å; V1197-M1202 HydrophobicContact CG1-CG 4.16Å; V1197-M1202 HydrophobicContact CG1-SD 4.44Å
1198	P	90.3	Very high	88.7	Confident	30 Å²	30	67.1 Å²	67.1	20%	0.195	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	113.4	172.8	23	-27.6	0	0	0	110.4	P1139 N1196 K1200 K1201 M1202	P1139-P1198 HydrophobicContact CB-CG 4.45Å; P1139-P1198 HydrophobicContact CG-CG 4.3Å; N1196-P1198 WeakPolarHBondContact O-CD 3.49Å; P1198-K1200 VanDerWaalsContact C-N 3.34Å; P1198-K1200 PolarHBondContact O-N 3.42Å; P1198-K1201 HydrophobicContact CB-CB 4.32Å; P1198-K1201 HydrophobicContact CB-CD 4.4Å; P1198-K1201 HydrophobicContact CB-CG 4.43Å; P1198-K1201 HydrophobicContact CG-CB 3.99Å; P1198-K1201 HydrophobicContact CG-CD 3.87Å; P1198-K1201 HydrophobicContact CG-CG 4.25Å; P1198-K1201 PolarHBondContact O-N 3.32Å; P1198-M1202 PolarHBondContact O-N 3.07Å
1199	L	89	Confident	88.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.2	-40.3	-171.6	178.6	62.3	0	0	0	112.8	S967 P968 L971 L1181 Q1185 E1192 V1197 M1202 A1203	S967-L1199 WeakPolarHBondContact OG-CD2 3.27Å; P968-L1199 HydrophobicContact CB-CD2 4.48Å; P968-L1199 HydrophobicContact CG-CD2 3.94Å; L971-L1199 HydrophobicContact CB-CD1 4.17Å; L971-L1199 HydrophobicContact CD2-CB 4.26Å; L971-L1199 HydrophobicContact CD2-CD1 3.72Å; L1181-L1199 HydrophobicContact CD1-CD1 4.02Å; L1181-L1199 HydrophobicContact CD2-CD1 4.39Å; L1181-L1199 HydrophobicContact CG-CD1 4.43Å; Q1185-L1199 HydrophobicContact CG-CD1 4.42Å; Q1185-L1199 HydrophobicContact CG-CD2 4.37Å; Q1185-L1199 HydrophobicContact CG-CG 4.1Å; E1192-L1199 WeakPolarHBondContact O-CB 3.29Å; E1192-L1199 PolarHBondContact O-N 3.39Å; V1197-L1199 PolarHBondContact O-N 3.17Å; L1199-M1202 PolarHBondContact O-N 3.03Å; L1199-A1203 WeakPolarHBondContact O-CB 3.21Å; L1199-A1203 PolarHBondContact O-N 2.98Å
1200	K	88.6	Confident	89.2	Confident	87 Å²	87	63.9 Å²	63.9	38%	0.378	30%	0.301	S	S	.	.	H	α-helix	trans	-63.3	-46.2	177.2	-177.8	65.1	-177.1	173.2	0	112.9	D1191 P1198 M1202 A1203 D1204	D1191-K1200 HydrophobicContact CB-CB 4.13Å; D1191-K1200 WeakPolarHBondContact OD1-CB 3.3Å; D1191-K1200 PolarHBondContact OD1-N 2.98Å; D1191-K1200 WeakPolarHBondContact OD2-CB 3.33Å; P1198-K1200 VanDerWaalsContact C-N 3.34Å; P1198-K1200 PolarHBondContact O-N 3.42Å; K1200-M1202 VanDerWaalsContact C-N 3.33Å; K1200-M1202 PolarHBondContact O-N 3.24Å; K1200-A1203 PolarHBondContact O-N 2.92Å; K1200-D1204 IonicContact NZ-OD1 3.85Å; K1200-D1204 VanDerWaalsContact O-CG 3.29Å; K1200-D1204 PolarHBondContact O-N 2.93Å
1201	K	88.8	Confident	89.4	Confident	130 Å²	130	63.2 Å²	63.2	57%	0.565	30%	0.301	S	S	*	.	H	α-helix	trans	-65.3	-37.1	177.1	-70.6	-174.8	176.9	178.5	0	111.8	P1139 P1198 D1204 R1205	P1139-K1201 HydrophobicContact CB-CB 4.47Å; P1139-K1201 HydrophobicContact CG-CB 3.93Å; P1198-K1201 HydrophobicContact CB-CB 4.32Å; P1198-K1201 HydrophobicContact CB-CD 4.4Å; P1198-K1201 HydrophobicContact CB-CG 4.43Å; P1198-K1201 HydrophobicContact CG-CB 3.99Å; P1198-K1201 HydrophobicContact CG-CD 3.87Å; P1198-K1201 HydrophobicContact CG-CG 4.25Å; P1198-K1201 PolarHBondContact O-N 3.32Å; K1201-D1204 PolarHBondContact O-N 3.12Å; K1201-R1205 WeakPolarHBondContact O-CG 3.48Å; K1201-R1205 PolarHBondContact O-N 3.14Å
1202	M	90.6	Very high	89.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.4	-50.5	173.3	-179.8	62.2	171.9	0	0	110.8	F1134 C1137 I1138 P1139 L1181 V1197 P1198 L1199 K1200 D1204 R1205 I1206	F1134-M1202 HydrophobicContact CD2-CE 3.83Å; F1134-M1202 HydrophobicContact CE2-CE 3.83Å; F1134-M1202 HydrophobicContact CG-CE 4.4Å; F1134-M1202 HydrophobicContact CZ-CE 4.39Å; C1137-M1202 HydrophobicContact CB-CE 3.59Å; C1137-M1202 HydrophobicContact CB-SD 3.74Å; I1138-M1202 HydrophobicContact CG1-CE 4.31Å; P1139-M1202 HydrophobicContact CG-CB 4.38Å; L1181-M1202 HydrophobicContact CD2-CG 4.25Å; V1197-M1202 HydrophobicContact CG1-CB 3.89Å; V1197-M1202 HydrophobicContact CG1-CG 4.16Å; V1197-M1202 HydrophobicContact CG1-SD 4.44Å; P1198-M1202 PolarHBondContact O-N 3.07Å; L1199-M1202 PolarHBondContact O-N 3.03Å; K1200-M1202 VanDerWaalsContact C-N 3.33Å; K1200-M1202 PolarHBondContact O-N 3.24Å; M1202-D1204 VanDerWaalsContact C-N 3.33Å; M1202-D1204 PolarHBondContact O-N 3.11Å; M1202-R1205 PolarHBondContact O-N 3.35Å; M1202-I1206 HydrophobicContact CE-CD1 4.04Å; M1202-I1206 HydrophobicContact CE-CG1 4.36Å; M1202-I1206 HydrophobicContact CG-CD1 3.91Å; M1202-I1206 WeakPolarHBondContact O-CG1 3.29Å; M1202-I1206 PolarHBondContact O-N 3.49Å; M1202-I1206 HydrophobicContact SD-CD1 4.29Å; M1202-I1206 HydrophobicContact SD-CG1 4.43Å
1203	A	89.3	Confident	89.9	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-40.3	177.7	0	0	0	0	0	112.6	L1182 Q1185 L1199 K1200 I1206 R1207	L1182-A1203 HydrophobicContact CD1-CB 4.05Å; Q1185-A1203 HydrophobicContact CB-CB 4.37Å; Q1185-A1203 HydrophobicContact CG-CB 3.98Å; L1199-A1203 WeakPolarHBondContact O-CB 3.21Å; L1199-A1203 PolarHBondContact O-N 2.98Å; K1200-A1203 PolarHBondContact O-N 2.92Å; A1203-I1206 PolarHBondContact O-N 3.42Å; A1203-R1207 PolarHBondContact O-N 3.4Å
1204	D	90.4	Very high	90.1	Very high	82 Å²	82	52.6 Å²	52.6	44%	0.439	25%	0.248	S	C	.	.	H	α-helix	trans	-65.7	-43	177.3	-69.7	-21.9	0	0	0	111.8	K1200 K1201 M1202 R1207 K1208	K1200-D1204 IonicContact NZ-OD1 3.85Å; K1200-D1204 VanDerWaalsContact O-CG 3.29Å; K1200-D1204 PolarHBondContact O-N 2.93Å; K1201-D1204 PolarHBondContact O-N 3.12Å; M1202-D1204 VanDerWaalsContact C-N 3.33Å; M1202-D1204 PolarHBondContact O-N 3.11Å; D1204-R1207 PolarHBondContact O-N 2.88Å; D1204-K1208 WeakPolarHBondContact O-CG 3.39Å; D1204-K1208 PolarHBondContact O-N 3.01Å
1205	R	92.8	Very high	90.5	Very high	43 Å²	43	56.7 Å²	56.7	16%	0.162	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-44.4	174	-74.7	-178	66.3	74.1	3.1	112	Y1136 C1137 E1148 K1201 M1202 R1207 K1208 Y1209	Y1136-R1205 PolarHBondContact O-NH2 3.2Å; Y1136-R1205 VanDerWaalsContact O-NH2 3.11Å; C1137-R1205 WeakPolarHBondContact O-CD 3.34Å; C1137-R1205 PolarHBondContact O-NE 3.07Å; C1137-R1205 VanDerWaalsContact O-NE 3.17Å; E1148-R1205 IonicContact OE1-CZ 2.8Å; E1148-R1205 IonicContact OE1-NH1 3.75Å; E1148-R1205 PolarHBondContact OE1-NH1 3.26Å; E1148-R1205 IonicContact OE1-NH2 3.38Å; E1148-R1205 PolarHBondContact OE1-NH2 3.06Å; E1148-R1205 IonicContact OE2-CZ 3.54Å; E1148-R1205 IonicContact OE2-NH1 3.47Å; E1148-R1205 IonicContact OE2-NH2 2.69Å; E1148-R1205 PolarHBondContact OE2-NH2 3.14Å; K1201-R1205 WeakPolarHBondContact O-CG 3.48Å; K1201-R1205 PolarHBondContact O-N 3.14Å; M1202-R1205 PolarHBondContact O-N 3.35Å; R1205-R1207 PolarHBondContact O-N 2.94Å; R1205-K1208 WeakPolarHBondContact O-CB 3.33Å; R1205-K1208 PolarHBondContact O-N 3Å; R1205-Y1209 WeakPolarHBondContact O-CD2 3.3Å; R1205-Y1209 PolarHBondContact O-N 3.29Å; R1205-Y1209 VanDerWaalsContact O-N 3.11Å
1206	I	93.8	Very high	91.1	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-55.8	-43.6	175	-68.6	165.9	0	0	0	110.5	C1137 C1178 Y1179 L1181 L1182 M1202 A1203 K1208 Y1209 Q1210	C1137-I1206 HydrophobicContact CB-CG1 3.84Å; C1178-I1206 HydrophobicContact CB-CB 4.37Å; C1178-I1206 HydrophobicContact CB-CD1 3.78Å; C1178-I1206 HydrophobicContact CB-CG1 3.77Å; C1178-I1206 HydrophobicContact CB-CG2 3.68Å; C1178-I1206 WeakPolarHBondContact O-CG2 3.49Å; Y1179-I1206 HydrophobicContact CD1-CG2 4.26Å; L1181-I1206 HydrophobicContact CD2-CD1 4.01Å; L1182-I1206 HydrophobicContact CB-CG2 3.95Å; L1182-I1206 HydrophobicContact CD2-CG2 4.07Å; M1202-I1206 HydrophobicContact CE-CD1 4.04Å; M1202-I1206 HydrophobicContact CE-CG1 4.36Å; M1202-I1206 HydrophobicContact CG-CD1 3.91Å; M1202-I1206 WeakPolarHBondContact O-CG1 3.29Å; M1202-I1206 PolarHBondContact O-N 3.49Å; M1202-I1206 HydrophobicContact SD-CD1 4.29Å; M1202-I1206 HydrophobicContact SD-CG1 4.43Å; A1203-I1206 PolarHBondContact O-N 3.42Å; I1206-K1208 VanDerWaalsContact C-N 3.29Å; I1206-K1208 PolarHBondContact O-N 3.45Å; I1206-Y1209 PolarHBondContact O-N 3.37Å; I1206-Q1210 VanDerWaalsContact O-CB 3.3Å; I1206-Q1210 WeakPolarHBondContact O-CB 3.42Å; I1206-Q1210 PolarHBondContact O-N 2.9Å
1207	R	93.1	Very high	91.6	Very high	92 Å²	92	44.8 Å²	44.8	35%	0.347	21%	0.207	S	C	.	.	H	α-helix	trans	-62.6	-36	178.3	179.3	53.6	175.9	179.6	8.6	112.2	L1182 A1203 D1204 R1205 Q1210 I1211	L1182-R1207 HydrophobicContact CD1-CB 4.46Å; L1182-R1207 HydrophobicContact CD2-CB 3.99Å; A1203-R1207 PolarHBondContact O-N 3.4Å; D1204-R1207 PolarHBondContact O-N 2.88Å; R1205-R1207 PolarHBondContact O-N 2.94Å; R1207-Q1210 PolarHBondContact O-N 3.38Å; R1207-I1211 HydrophobicContact CG-CD1 4.26Å; R1207-I1211 WeakPolarHBondContact O-CG1 3.36Å; R1207-I1211 PolarHBondContact O-N 3.45Å; R1207-I1211 VanDerWaalsContact O-N 3.11Å
1208	K	92.4	Very high	91.8	Very high	151 Å²	151	47.6 Å²	47.6	66%	0.657	23%	0.231	S	C	*	.	H	α-helix	trans	-64.7	-50.3	176.5	-64.2	-64.1	-175.3	175.3	0	111.4	D1204 R1205 I1206 Q1210 I1211 L1212	D1204-K1208 WeakPolarHBondContact O-CG 3.39Å; D1204-K1208 PolarHBondContact O-N 3.01Å; R1205-K1208 WeakPolarHBondContact O-CB 3.33Å; R1205-K1208 PolarHBondContact O-N 3Å; I1206-K1208 VanDerWaalsContact C-N 3.29Å; I1206-K1208 PolarHBondContact O-N 3.45Å; K1208-Q1210 VanDerWaalsContact C-N 3.3Å; K1208-Q1210 PolarHBondContact O-N 2.96Å; K1208-I1211 PolarHBondContact O-N 3.31Å; K1208-I1211 VanDerWaalsContact O-N 3.14Å; K1208-L1212 PolarHBondContact O-N 2.92Å
1209	Y	92.5	Very high	91.8	Very high	13 Å²	13	48.4 Å²	48.4	5%	0.051	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-32.3	176.5	-76.8	-71.5	0	0	0	113	Y1136 E1148 R1205 I1206 L1212 N1213	Y1136-Y1209 HydrophobicContact CD2-CD1 4.1Å; Y1136-Y1209 AromaticContact CD2-CD2 3.96Å; Y1136-Y1209 HydrophobicContact CD2-CD2 3.96Å; Y1136-Y1209 AromaticContact CD2-CE1 3.89Å; Y1136-Y1209 HydrophobicContact CD2-CE1 3.89Å; Y1136-Y1209 AromaticContact CD2-CE2 3.77Å; Y1136-Y1209 HydrophobicContact CD2-CE2 3.77Å; Y1136-Y1209 HydrophobicContact CD2-CG 4.12Å; Y1136-Y1209 AromaticContact CD2-CZ 3.72Å; Y1136-Y1209 AromaticContact CE2-CD1 3.56Å; Y1136-Y1209 HydrophobicContact CE2-CD1 3.56Å; Y1136-Y1209 AromaticContact CE2-CD2 3.89Å; Y1136-Y1209 HydrophobicContact CE2-CD2 3.89Å; Y1136-Y1209 AromaticContact CE2-CE1 3.79Å; Y1136-Y1209 HydrophobicContact CE2-CE1 3.79Å; Y1136-Y1209 HydrophobicContact CE2-CE2 4.13Å; Y1136-Y1209 AromaticContact CE2-CG 3.6Å; Y1136-Y1209 HydrophobicContact CE2-CG 3.6Å; E1148-Y1209 PolarHBondContact OE2-OH 3.44Å; R1205-Y1209 WeakPolarHBondContact O-CD2 3.3Å; R1205-Y1209 PolarHBondContact O-N 3.29Å; R1205-Y1209 VanDerWaalsContact O-N 3.11Å; I1206-Y1209 PolarHBondContact O-N 3.37Å; Y1209-L1212 HydrophobicContact CD1-CD2 4.24Å; Y1209-L1212 PolarHBondContact O-N 3.21Å; Y1209-N1213 WeakPolarHBondContact O-CB 3.39Å; Y1209-N1213 PolarHBondContact O-N 3.27Å; Y1209-N1213 PolarHBondContact O-OD1 2.95Å
1210	Q	92.9	Very high	91.8	Very high	28 Å²	28	48.5 Å²	48.5	13%	0.131	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-42	172	-177.4	177.8	60.7	0	0	112.2	Y1179 I1206 R1207 K1208 N1214	Y1179-Q1210 HydrophobicContact CD1-CB 4.17Å; Y1179-Q1210 HydrophobicContact CD1-CG 4.13Å; Y1179-Q1210 HydrophobicContact CE1-CB 3.52Å; Y1179-Q1210 HydrophobicContact CE1-CG 3.65Å; Y1179-Q1210 HydrophobicContact CE2-CG 4.19Å; I1206-Q1210 VanDerWaalsContact O-CB 3.3Å; I1206-Q1210 WeakPolarHBondContact O-CB 3.42Å; I1206-Q1210 PolarHBondContact O-N 2.9Å; R1207-Q1210 PolarHBondContact O-N 3.38Å; K1208-Q1210 VanDerWaalsContact C-N 3.3Å; K1208-Q1210 PolarHBondContact O-N 2.96Å; Q1210-N1214 VanDerWaalsContact O-CB 3.32Å; Q1210-N1214 WeakPolarHBondContact O-CB 3.3Å; Q1210-N1214 PolarHBondContact O-N 3.47Å; Q1210-N1214 VanDerWaalsContact O-N 3.09Å; Q1210-N1214 PolarHBondContact O-ND2 2.96Å; Q1210-N1214 VanDerWaalsContact O-ND2 3.12Å
1211	I	93.1	Very high	91.8	Very high	79 Å²	79	46.5 Å²	46.5	41%	0.405	23%	0.227	S	C	.	.	H	α-helix	trans	-65	-46.4	176.4	-67.7	163.8	0	0	0	109.9	R1207 K1208 N1214 E1215	R1207-I1211 HydrophobicContact CG-CD1 4.26Å; R1207-I1211 WeakPolarHBondContact O-CG1 3.36Å; R1207-I1211 PolarHBondContact O-N 3.45Å; R1207-I1211 VanDerWaalsContact O-N 3.11Å; K1208-I1211 PolarHBondContact O-N 3.31Å; K1208-I1211 VanDerWaalsContact O-N 3.14Å; I1211-N1214 PolarHBondContact O-N 3.36Å; I1211-E1215 PolarHBondContact O-N 3.47Å
1212	L	92.6	Very high	91.7	Very high	26 Å²	26	47.8 Å²	47.8	14%	0.136	23%	0.233	C	C	.	.	H	α-helix	trans	-59.1	-51.2	178.7	-179.7	62.6	0	0	0	112.1	N1156 K1208 Y1209 N1214 E1215 I1216	N1156-L1212 HydrophobicContact CB-CD2 3.98Å; N1156-L1212 HydrophobicContact CB-CG 4.47Å; K1208-L1212 PolarHBondContact O-N 2.92Å; Y1209-L1212 HydrophobicContact CD1-CD2 4.24Å; Y1209-L1212 PolarHBondContact O-N 3.21Å; L1212-N1214 VanDerWaalsContact C-N 3.32Å; L1212-N1214 PolarHBondContact O-N 2.98Å; L1212-E1215 WeakPolarHBondContact O-CB 3.4Å; L1212-E1215 PolarHBondContact O-N 3.37Å; L1212-I1216 HydrophobicContact CD1-CD1 4Å; L1212-I1216 HydrophobicContact CD1-CG1 4.39Å; L1212-I1216 HydrophobicContact CG-CD1 3.92Å; L1212-I1216 VanDerWaalsContact O-CG1 3.32Å; L1212-I1216 WeakPolarHBondContact O-CG1 3.39Å; L1212-I1216 PolarHBondContact O-N 3.21Å
1213	N	93.6	Very high	91.4	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-42	179.1	-66.3	-6.2	0	0	0	111.5	Q1133 N1156 Y1179 Y1209 E1215 I1216 F1217	Q1133-N1213 PolarHBondContact OE1-ND2 2.99Å; N1156-N1213 PolarHBondContact ND2-OD1 3.18Å; N1156-N1213 VanDerWaalsContact ND2-OD1 3.11Å; Y1179-N1213 PolarHBondContact OH-ND2 3.14Å; Y1179-N1213 VanDerWaalsContact OH-ND2 3.14Å; Y1209-N1213 WeakPolarHBondContact O-CB 3.39Å; Y1209-N1213 PolarHBondContact O-N 3.27Å; Y1209-N1213 PolarHBondContact O-OD1 2.95Å; N1213-E1215 VanDerWaalsContact C-N 3.31Å; N1213-E1215 PolarHBondContact O-N 3Å; N1213-I1216 PolarHBondContact O-N 3.42Å; N1213-F1217 HydrophobicContact CB-CD2 4.3Å; N1213-F1217 HydrophobicContact CB-CE2 3.99Å; N1213-F1217 WeakPolarHBondContact O-CB 3.29Å; N1213-F1217 WeakPolarHBondContact O-CD2 3.28Å; N1213-F1217 WeakPolarHBondContact O-CG 3.45Å; N1213-F1217 PolarHBondContact O-N 3.32Å
1214	N	92.9	Very high	90.8	Very high	64 Å²	64	52.3 Å²	52.3	34%	0.342	25%	0.252	S	S	.	.	H	α-helix	trans	-62.6	-38.5	178.1	-75.5	-21.5	0	0	0	112.4	Q1210 I1211 L1212 A1218	Q1210-N1214 VanDerWaalsContact O-CB 3.32Å; Q1210-N1214 WeakPolarHBondContact O-CB 3.3Å; Q1210-N1214 PolarHBondContact O-N 3.47Å; Q1210-N1214 VanDerWaalsContact O-N 3.09Å; Q1210-N1214 PolarHBondContact O-ND2 2.96Å; Q1210-N1214 VanDerWaalsContact O-ND2 3.12Å; I1211-N1214 PolarHBondContact O-N 3.36Å; L1212-N1214 VanDerWaalsContact C-N 3.32Å; L1212-N1214 PolarHBondContact O-N 2.98Å; N1214-A1218 WeakPolarHBondContact O-CB 3.45Å; N1214-A1218 PolarHBondContact O-N 3.18Å
1215	E	93	Very high	89.6	Confident	109 Å²	109	54.9 Å²	54.9	51%	0.509	26%	0.259	S	S	.	.	H	α-helix	trans	-63.4	-49.7	174.2	-177.7	177.3	176.9	0	0	111.1	I1211 L1212 N1213 F1217 A1218 I1219	I1211-E1215 PolarHBondContact O-N 3.47Å; L1212-E1215 WeakPolarHBondContact O-CB 3.4Å; L1212-E1215 PolarHBondContact O-N 3.37Å; N1213-E1215 VanDerWaalsContact C-N 3.31Å; N1213-E1215 PolarHBondContact O-N 3Å; E1215-F1217 PolarHBondContact O-N 3.03Å; E1215-A1218 PolarHBondContact O-N 3.3Å; E1215-I1219 HydrophobicContact CG-CD1 4.08Å; E1215-I1219 WeakPolarHBondContact O-CG1 3.16Å; E1215-I1219 PolarHBondContact O-N 2.75Å
1216	I	93.9	Very high	87.7	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-60.8	-46.5	178.6	-63.2	169.6	0	0	0	110.6	N1156 W1157 C1160 L1212 N1213 A1218 I1219 L1220	N1156-I1216 HydrophobicContact CB-CD1 3.82Å; W1157-I1216 HydrophobicContact CD2-CD1 4.42Å; W1157-I1216 HydrophobicContact CD2-CG1 4.25Å; W1157-I1216 HydrophobicContact CD2-CG2 3.92Å; W1157-I1216 HydrophobicContact CE3-CG2 4.02Å; W1157-I1216 HydrophobicContact CG-CD1 4.04Å; W1157-I1216 HydrophobicContact CG-CG1 4.39Å; W1157-I1216 HydrophobicContact CG-CG2 4.33Å; W1157-I1216 HydrophobicContact CZ2-CG1 4.24Å; W1157-I1216 HydrophobicContact CZ3-CG2 4.39Å; C1160-I1216 HydrophobicContact CB-CB 4.3Å; C1160-I1216 HydrophobicContact CB-CG2 3.6Å; L1212-I1216 HydrophobicContact CD1-CD1 4Å; L1212-I1216 HydrophobicContact CD1-CG1 4.39Å; L1212-I1216 HydrophobicContact CG-CD1 3.92Å; L1212-I1216 VanDerWaalsContact O-CG1 3.32Å; L1212-I1216 WeakPolarHBondContact O-CG1 3.39Å; L1212-I1216 PolarHBondContact O-N 3.21Å; N1213-I1216 PolarHBondContact O-N 3.42Å; I1216-A1218 VanDerWaalsContact C-N 3.33Å; I1216-A1218 PolarHBondContact O-N 2.91Å; I1216-I1219 PolarHBondContact O-N 3.49Å; I1216-L1220 HydrophobicContact CG2-CD1 3.73Å; I1216-L1220 HydrophobicContact CG2-CG 4.17Å; I1216-L1220 WeakPolarHBondContact O-CG 3.08Å; I1216-L1220 PolarHBondContact O-N 3.04Å
1217	F	92.7	Very high	85.3	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.2	-42.8	175.9	-70.2	-36.7	0	0	0	112.1	C1160 I1163 V1164 Q1169 F1172 N1213 E1215 I1219 N1221	C1160-F1217 HydrophobicContact CB-CD1 3.84Å; C1160-F1217 HydrophobicContact CB-CE1 3.49Å; C1160-F1217 VanDerWaalsContact CB-CE1 3.49Å; C1160-F1217 HydrophobicContact CB-CZ 4.22Å; I1163-F1217 HydrophobicContact CB-CE1 4.17Å; I1163-F1217 HydrophobicContact CB-CZ 4.48Å; I1163-F1217 HydrophobicContact CD1-CZ 4.42Å; I1163-F1217 HydrophobicContact CG2-CE1 3.96Å; I1163-F1217 HydrophobicContact CG2-CZ 4.04Å; V1164-F1217 HydrophobicContact CG2-CD1 3.42Å; V1164-F1217 VanDerWaalsContact CG2-CD1 3.42Å; V1164-F1217 HydrophobicContact CG2-CE1 3.9Å; V1164-F1217 HydrophobicContact CG2-CG 4.44Å; Q1169-F1217 HydrophobicContact CG-CB 4.37Å; Q1169-F1217 HydrophobicContact CG-CD1 3.9Å; Q1169-F1217 HydrophobicContact CG-CD2 3.75Å; Q1169-F1217 HydrophobicContact CG-CE1 4Å; Q1169-F1217 HydrophobicContact CG-CE2 3.88Å; Q1169-F1217 HydrophobicContact CG-CG 3.77Å; Q1169-F1217 HydrophobicContact CG-CZ 4.01Å; F1172-F1217 AromaticContact CD1-CE2 3.86Å; F1172-F1217 HydrophobicContact CD1-CE2 3.86Å; F1172-F1217 AromaticContact CD1-CZ 3.92Å; F1172-F1217 HydrophobicContact CD1-CZ 3.92Å; F1172-F1217 AromaticContact CE1-CE2 3.98Å; F1172-F1217 HydrophobicContact CE1-CE2 3.98Å; F1172-F1217 HydrophobicContact CE1-CZ 4.13Å; N1213-F1217 HydrophobicContact CB-CD2 4.3Å; N1213-F1217 HydrophobicContact CB-CE2 3.99Å; N1213-F1217 WeakPolarHBondContact O-CB 3.29Å; N1213-F1217 WeakPolarHBondContact O-CD2 3.28Å; N1213-F1217 WeakPolarHBondContact O-CG 3.45Å; N1213-F1217 PolarHBondContact O-N 3.32Å; E1215-F1217 PolarHBondContact O-N 3.03Å; F1217-I1219 VanDerWaalsContact C-N 3.33Å; F1217-I1219 PolarHBondContact O-N 2.89Å; F1217-N1221 VanDerWaalsContact O-CB 3.31Å; F1217-N1221 WeakPolarHBondContact O-CB 3.37Å; F1217-N1221 PolarHBondContact O-N 3.39Å; F1217-N1221 PolarHBondContact O-ND2 3.02Å
1218	A	90.8	Very high	83	Confident	63 Å²	63	58.9 Å²	58.9	52%	0.521	30%	0.297	S	S	.	.	H	α-helix	trans	-62	-41.8	177	0	0	0	0	0	111.6	N1214 E1215 I1216 K1222	N1214-A1218 WeakPolarHBondContact O-CB 3.45Å; N1214-A1218 PolarHBondContact O-N 3.18Å; E1215-A1218 PolarHBondContact O-N 3.3Å; I1216-A1218 VanDerWaalsContact C-N 3.33Å; I1216-A1218 PolarHBondContact O-N 2.91Å; A1218-K1222 WeakPolarHBondContact O-CB 3.24Å; A1218-K1222 PolarHBondContact O-N 3.45Å
1219	I	90.8	Very high	80.7	Confident	48 Å²	48	57.4 Å²	57.4	25%	0.246	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-52	177.9	-64.5	165.4	0	0	0	110.9	W1157 E1215 I1216 F1217 N1221 K1222 Y1223	W1157-I1219 HydrophobicContact CH2-CB 4.33Å; W1157-I1219 HydrophobicContact CH2-CD1 4.23Å; W1157-I1219 HydrophobicContact CH2-CG2 3.9Å; W1157-I1219 HydrophobicContact CZ2-CD1 4.18Å; E1215-I1219 HydrophobicContact CG-CD1 4.08Å; E1215-I1219 WeakPolarHBondContact O-CG1 3.16Å; E1215-I1219 PolarHBondContact O-N 2.75Å; I1216-I1219 PolarHBondContact O-N 3.49Å; F1217-I1219 VanDerWaalsContact C-N 3.33Å; F1217-I1219 PolarHBondContact O-N 2.89Å; I1219-N1221 PolarHBondContact O-N 3.1Å; I1219-K1222 WeakPolarHBondContact O-CB 2.87Å; I1219-K1222 PolarHBondContact O-N 3.02Å; I1219-K1222 VanDerWaalsContact O-N 3.11Å; I1219-Y1223 HydrophobicContact CG2-CD2 3.97Å; I1219-Y1223 HydrophobicContact CG2-CE2 3.85Å; I1219-Y1223 VanDerWaalsContact O-CD2 3.31Å; I1219-Y1223 WeakPolarHBondContact O-CD2 3.48Å; I1219-Y1223 PolarHBondContact O-N 3.5Å
1220	L	90.3	Very high	78.3	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-60	-44.3	-178.9	-68.5	171.9	0	0	0	112.1	F1091 L1095 W1157 C1160 A1161 V1164 I1216 K1222 Y1223 M1224	F1091-L1220 HydrophobicContact CE1-CD2 4.27Å; F1091-L1220 HydrophobicContact CZ-CD2 4.22Å; L1095-L1220 HydrophobicContact CD1-CD2 3.93Å; L1095-L1220 HydrophobicContact CD2-CD2 4.03Å; W1157-L1220 HydrophobicContact CE3-CD2 4.39Å; W1157-L1220 HydrophobicContact CZ3-CD2 4Å; W1157-L1220 HydrophobicContact CZ3-CG 4.39Å; C1160-L1220 HydrophobicContact CB-CD1 4.34Å; A1161-L1220 HydrophobicContact CB-CD1 4.18Å; V1164-L1220 HydrophobicContact CB-CD1 4.39Å; V1164-L1220 HydrophobicContact CG1-CB 4.21Å; V1164-L1220 HydrophobicContact CG2-CB 4.29Å; V1164-L1220 HydrophobicContact CG2-CD1 4.09Å; I1216-L1220 HydrophobicContact CG2-CD1 3.73Å; I1216-L1220 HydrophobicContact CG2-CG 4.17Å; I1216-L1220 WeakPolarHBondContact O-CG 3.08Å; I1216-L1220 PolarHBondContact O-N 3.04Å; L1220-K1222 VanDerWaalsContact C-N 3.31Å; L1220-K1222 PolarHBondContact O-N 2.89Å; L1220-Y1223 PolarHBondContact O-N 3.01Å; L1220-M1224 WeakPolarHBondContact O-CG 3.43Å; L1220-M1224 PolarHBondContact O-N 3.01Å
1221	N	87.4	Confident	75.9	Confident	45 Å²	45	65.9 Å²	65.9	24%	0.241	35%	0.352	C	S	.	.	H	α-helix	trans	-65.9	-33.3	176.2	-75.4	-57.8	0	0	0	112.8	Q1169 F1217 I1219 Y1223 M1224 K1225	Q1169-N1221 PolarHBondContact OE1-ND2 3.37Å; F1217-N1221 VanDerWaalsContact O-CB 3.31Å; F1217-N1221 WeakPolarHBondContact O-CB 3.37Å; F1217-N1221 PolarHBondContact O-N 3.39Å; F1217-N1221 PolarHBondContact O-ND2 3.02Å; I1219-N1221 PolarHBondContact O-N 3.1Å; N1221-Y1223 VanDerWaalsContact C-N 3.31Å; N1221-Y1223 PolarHBondContact O-N 3.31Å; N1221-M1224 PolarHBondContact O-N 3.24Å; N1221-K1225 WeakPolarHBondContact O-CB 3.38Å; N1221-K1225 VanDerWaalsContact O-CG 3.27Å; N1221-K1225 WeakPolarHBondContact O-CG 3.33Å; N1221-K1225 PolarHBondContact O-N 3Å
1222	K	87.3	Confident	73.2	Confident	157 Å²	157	68.1 Å²	68.1	68%	0.683	38%	0.375	S	S	*	.	H	α-helix	trans	-61.7	-41.9	177	-176.9	-174.5	175.4	-171.3	0	111	A1218 I1219 L1220	A1218-K1222 WeakPolarHBondContact O-CB 3.24Å; A1218-K1222 PolarHBondContact O-N 3.45Å; I1219-K1222 WeakPolarHBondContact O-CB 2.87Å; I1219-K1222 PolarHBondContact O-N 3.02Å; I1219-K1222 VanDerWaalsContact O-N 3.11Å; L1220-K1222 VanDerWaalsContact C-N 3.31Å; L1220-K1222 PolarHBondContact O-N 2.89Å
1223	Y	83.6	Confident	70.8	Confident	65 Å²	65	71.8 Å²	71.8	26%	0.255	40%	0.399	S	S	.	.	H	α-helix	trans	-76	-34.6	177.3	-74.7	-77.3	0	0	0	112.9	L1006 F1091 I1219 L1220 N1221	L1006-Y1223 HydrophobicContact CD1-CE2 4.18Å; F1091-Y1223 HydrophobicContact CD1-CD1 4.06Å; F1091-Y1223 AromaticContact CD1-CD2 3.69Å; F1091-Y1223 HydrophobicContact CD1-CD2 3.69Å; F1091-Y1223 HydrophobicContact CD1-CE1 4.5Å; F1091-Y1223 HydrophobicContact CD1-CE2 4.16Å; F1091-Y1223 AromaticContact CD1-CG 3.64Å; F1091-Y1223 HydrophobicContact CD1-CG 3.64Å; F1091-Y1223 AromaticContact CE1-CD2 3.91Å; F1091-Y1223 HydrophobicContact CE1-CD2 3.91Å; F1091-Y1223 HydrophobicContact CE1-CE2 4.43Å; F1091-Y1223 HydrophobicContact CE1-CG 4.23Å; I1219-Y1223 HydrophobicContact CG2-CD2 3.97Å; I1219-Y1223 HydrophobicContact CG2-CE2 3.85Å; I1219-Y1223 VanDerWaalsContact O-CD2 3.31Å; I1219-Y1223 WeakPolarHBondContact O-CD2 3.48Å; I1219-Y1223 PolarHBondContact O-N 3.5Å; L1220-Y1223 PolarHBondContact O-N 3.01Å; N1221-Y1223 VanDerWaalsContact C-N 3.31Å; N1221-Y1223 PolarHBondContact O-N 3.31Å
1224	M	77.8	Confident	68.5	Low	31 Å²	31	78.8 Å²	78.8	15%	0.153	44%	0.441	C	S	.	.	H	α-helix	trans	-71.7	-27.7	178.1	-73.2	-64.1	-59.3	0	0	114.2	L1095 L1165 L1220 N1221 A1226 V1227	L1095-M1224 HydrophobicContact CB-SD 3.78Å; L1095-M1224 HydrophobicContact CD1-CG 4.22Å; L1095-M1224 HydrophobicContact CD1-SD 4.18Å; L1165-M1224 HydrophobicContact CD2-CE 4.32Å; L1165-M1224 HydrophobicContact CD2-SD 4.07Å; L1220-M1224 WeakPolarHBondContact O-CG 3.43Å; L1220-M1224 PolarHBondContact O-N 3.01Å; N1221-M1224 PolarHBondContact O-N 3.24Å; M1224-A1226 VanDerWaalsContact C-N 3.27Å; M1224-A1226 PolarHBondContact O-N 2.98Å; M1224-V1227 PolarHBondContact O-N 3.23Å
1225	K	64.2	Low	66.7	Low	135 Å²	135	81.8 Å²	81.8	59%	0.587	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-15.7	-179.9	-81.1	178.2	179.8	-174.3	0	114.7	N1221 V1227 E1228	N1221-K1225 WeakPolarHBondContact O-CB 3.38Å; N1221-K1225 VanDerWaalsContact O-CG 3.27Å; N1221-K1225 WeakPolarHBondContact O-CG 3.33Å; N1221-K1225 PolarHBondContact O-N 3Å; K1225-V1227 PolarHBondContact O-N 3.32Å; K1225-E1228 PolarHBondContact O-N 2.67Å
1226	A	52.6	Low	65.5	Low	49 Å²	49	85.2 Å²	85.2	41%	0.405	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-26	176.7	0	0	0	0	0	112.7	E1092 M1224 T1229	E1092-A1226 WeakPolarHBondContact OE2-CB 3.33Å; M1224-A1226 VanDerWaalsContact C-N 3.27Å; M1224-A1226 PolarHBondContact O-N 2.98Å; A1226-T1229 PolarHBondContact O-OG1 3.43Å
1227	V	44.2	Very low	64.7	Low	66 Å²	66	90.5 Å²	90.5	40%	0.4	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-38.2	177.6	-173.8	0	0	0	0	112.7	E1092 M1224 K1225 T1229	E1092-V1227 HydrophobicContact CG-CG2 3.75Å; E1092-V1227 WeakPolarHBondContact OE1-CG2 3.45Å; E1092-V1227 PolarHBondContact OE1-N 3.28Å; M1224-V1227 PolarHBondContact O-N 3.23Å; K1225-V1227 PolarHBondContact O-N 3.32Å; V1227-T1229 VanDerWaalsContact C-N 3.29Å; V1227-T1229 PolarHBondContact O-N 3.38Å
1228	E	45.2	Very low	64	Low	105 Å²	105	98.2 Å²	98.2	49%	0.491	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-18.4	-169.4	-74.8	173	-171.3	0	0	113	K1225 S1231	K1225-E1228 PolarHBondContact O-N 2.67Å; E1228-S1231 PolarHBondContact O-OG 2.98Å
1229	T	43.6	Very low	63.6	Low	119 Å²	119	100.3 Å²	100.3	73%	0.73	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-20.3	-178.4	24.7	0	0	0	0	115	A1226 V1227	A1226-T1229 PolarHBondContact O-OG1 3.43Å; V1227-T1229 VanDerWaalsContact C-N 3.29Å; V1227-T1229 PolarHBondContact O-N 3.38Å
1230	D	42.3	Very low	63.3	Low	154 Å²	154	104.1 Å²	104.1	82%	0.824	56%	0.555	S	S	*	*	S	Bend	trans	-93	-13.7	179.9	-83.2	-12	0	0	0	113.9	S1232	D1230-S1232 PolarHBondContact O-N 3.28Å
1231	S	41.3	Very low	62.8	Low	65 Å²	65	111.8 Å²	111.8	46%	0.455	59%	0.59	S	S	.	*			trans	-90.5	95.7	170.9	58.5	0	0	0	0	111	E1228 T1233	E1228-S1231 PolarHBondContact O-OG 2.98Å; S1231-T1233 PolarHBondContact O-N 3.24Å
1232	S	37.2	Very low	62.6	Low	127 Å²	127	113.9 Å²	113.9	89%	0.888	61%	0.606	S	S	*	*			trans	-68.2	42.2	171.2	50.5	0	0	0	0	114	D1230	D1230-S1232 PolarHBondContact O-N 3.28Å
1233	T	42.9	Very low	62.1	Low	103 Å²	103	112.9 Å²	112.9	63%	0.632	62%	0.616	S	S	*	*	S	Bend	trans	-121.3	118.8	171.3	51.2	0	0	0	0	108.4	S1231 E1235	S1231-T1233 PolarHBondContact O-N 3.24Å; T1233-E1235 PolarHBondContact O-N 3.17Å
1234	V	44.6	Very low	61.9	Low	146 Å²	146	114.9 Å²	114.9	89%	0.885	63%	0.63	S	S	*	*			trans	-46.4	112.9	168.6	-179.2	0	0	0	0	108.1	H1236	V1234-H1236 PolarHBondContact O-N 3.21Å; V1234-H1236 VanDerWaalsContact O-N 3.16Å
1235	E	56	Low	61.8	Low	128 Å²	128	119.9 Å²	119.9	60%	0.598	65%	0.652	S	S	*	*			trans	-53.4	123.8	179.2	-77.4	-159.6	136.1	0	0	109.6	T1233 V1237	T1233-E1235 PolarHBondContact O-N 3.17Å; E1235-V1237 PolarHBondContact O-N 2.75Å
1236	H	66.3	Low	62.1	Low	180 Å²	180	121.9 Å²	121.9	83%	0.833	66%	0.664	S	S	*	*			trans	-70.9	98.3	-178.5	-172.6	66.8	0	0	0	110.1	V1234	V1234-H1236 PolarHBondContact O-N 3.21Å; V1234-H1236 VanDerWaalsContact O-N 3.16Å
1237	V	76.8	Confident	62.8	Low	113 Å²	113	123.4 Å²	123.4	69%	0.685	67%	0.672	S	S	*	*			trans	-76.3	133.2	173.1	-176.9	0	0	0	0	109.3	E1235 C1239	E1235-V1237 PolarHBondContact O-N 2.75Å; V1237-C1239 PolarHBondContact O-N 2.89Å; V1237-C1239 VanDerWaalsContact O-N 3.1Å
1238	R	78.4	Confident	63.8	Low	162 Å²	162	125.5 Å²	125.5	61%	0.611	68%	0.68	S	S	*	*			trans	-61.5	112.9	176.7	-174.8	177.3	-179.2	-169.2	-4.4	110.8	G1115	G1115-R1238 PolarHBondContact O-NH1 3.18Å; G1115-R1238 PolarHBondContact O-NH2 2.75Å; G1115-R1238 VanDerWaalsContact O-NH2 3.11Å
1239	C	83.1	Confident	64.3	Low	106 Å²	106	123.4 Å²	123.4	72%	0.716	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-83	148.5	175	-58.3	0	0	0	0	111.7	V1237	V1237-C1239 PolarHBondContact O-N 2.89Å; V1237-C1239 VanDerWaalsContact O-N 3.1Å
1240	F	83.6	Confident	64.9	Low	129 Å²	129	123.9 Å²	123.9	57%	0.566	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-103.7	140.6	171.1	-59.2	-73.4	0	0	0	109.6	V1116	V1116-F1240 HydrophobicContact CB-CZ 4.31Å; V1116-F1240 HydrophobicContact CG1-CZ 4.03Å; V1116-F1240 HydrophobicContact CG2-CE1 3.76Å; V1116-F1240 HydrophobicContact CG2-CZ 3.78Å
1241	Q	79.7	Confident	65.3	Low	162 Å²	162	122.2 Å²	122.2	76%	0.757	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-70.8	133.8	175.9	-66.9	-65.6	-19.2	0	0	109.6
1242	P	82.9	Confident	65.4	Low	89 Å²	89	128.1 Å²	128.1	58%	0.578	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-62.5	157	169	28.9	-33.7	0	0	0	109.8	I1244	P1242-I1244 PolarHBondContact O-N 3.33Å
1243	P	78.4	Confident	66.8	Low	136 Å²	136	128.2 Å²	128.2	88%	0.883	71%	0.71	S	S	*	*			trans	-57	110.4	176.7	22.4	-31.6	0	0	0	110
1244	I	78.1	Confident	68.1	Low	108 Å²	108	129.5 Å²	129.5	55%	0.554	71%	0.714	S	S	*	*			trans	-76.3	128.5	179.5	-96.6	165.2	0	0	0	109.3	P1242 A1249	P1242-I1244 PolarHBondContact O-N 3.33Å; I1244-A1249 HydrophobicContact CG2-CB 3.93Å
1245	H	77	Confident	69.4	Low	135 Å²	135	128.6 Å²	128.6	63%	0.625	70%	0.704	S	S	*	*			trans	-66.7	134.3	173.9	-168.9	-96.3	0	0	0	109.6	S1247 L1248	H1245-S1247 PolarHBondContact ND1-OG 2.95Å; H1245-S1247 PolarHBondContact O-N 2.88Å; H1245-L1248 PolarHBondContact O-N 2.96Å
1246	Q	69	Low	70.2	Confident	178 Å²	178	128.6 Å²	128.6	83%	0.832	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-53.9	-24.3	-173.6	-73.3	176.6	-12	0	0	113.9	L1248	Q1246-L1248 VanDerWaalsContact C-N 3.28Å; Q1246-L1248 PolarHBondContact O-N 3.36Å
1247	S	69.2	Low	70.4	Confident	81 Å²	81	125.4 Å²	125.4	57%	0.566	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-69.1	-17.2	178	70.4	0	0	0	0	115.2	H1245	H1245-S1247 PolarHBondContact ND1-OG 2.95Å; H1245-S1247 PolarHBondContact O-N 2.88Å
1248	L	64	Low	70	Confident	109 Å²	109	126.2 Å²	126.2	57%	0.571	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-107.9	-6.8	-177.9	-67	155.4	0	0	0	112.3	H1245 Q1246 T1250	H1245-L1248 PolarHBondContact O-N 2.96Å; Q1246-L1248 VanDerWaalsContact C-N 3.28Å; Q1246-L1248 PolarHBondContact O-N 3.36Å; L1248-T1250 VanDerWaalsContact C-N 3.33Å; L1248-T1250 PolarHBondContact O-N 3.22Å
1249	A	55.7	Low	69.4	Low	61 Å²	61	123.6 Å²	123.6	50%	0.504	71%	0.711	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.4	-10.7	-173.1	0	0	0	0	0	114.7	I1244	I1244-A1249 HydrophobicContact CG2-CB 3.93Å
1250	T	56.2	Low	68.3	Low	130 Å²	130	125 Å²	125	80%	0.798	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	0.8	-179.9	22.6	0	0	0	0	114.1	L1248	L1248-T1250 VanDerWaalsContact C-N 3.33Å; L1248-T1250 PolarHBondContact O-N 3.22Å
1251	T	51.8	Low	67.1	Low	118 Å²	118	124.7 Å²	124.7	72%	0.724	72%	0.722	S	S	*	*			trans	-119.3	16.4	-178.8	31.8	0	0	0	0	114.6
1252	C	42.9	Very low	65.9	Low	189 Å²	189	121.3 Å²	121.3	100%	1.277	72%	0.719	S	S	*	*			trans	-118.8	0	167.7	-80.7	0	0	0	0	111

Retrieved 1,252 of 1,252 residues in 872.8 ms (Link to these results)

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