X5D2F4_HUMAN Loading...

Cytoplasmic FMR1 interacting protein 1 isoform A

AlphaFold DB , UniProt , Accession X5D2F4, Species HUMAN (Homo sapiens, Human), Gene CYFIP1, Length 1,253 aa.

						>X5D2F4_HUMAN|X5D2F4|CYFIP1
MAAQVTLEDALSNVDLLEELPLPDQQPCIEPPPSSLLYQPNFNTNFEDRNAFVTGIARYIEQATVHSSMNEMLEEGQEYAVMLYTWRSCSRAIPQVKCNEQPNRVEIYEKTVEVLEPEVTKLMNFMYFQRNAIERFCGEVRRLCHAERRKDFVSEAYLITLGKFINMFAVLDELKNMKCSVKNDHSAYKRAAQFLRKMADPQSIQESQNLSMFLANHNKITQSLQQQLEVISGYEELLADIVNLCVDYYENRMYLTPSEKHMLLKVMGFGLYLMDGSVSNIYKLDAKKRINLSKIDKYFKQLQVVPLFGDMQIELARYIKTSAHYEENKSRWTCTSSGSSPQYNICEQMIQIREDHMRFISELARYSNSEVVTGSGRQEAQKTDAEYRKLFDLALQGLQLLSQWSAHVMEVYSWKLVHPTDKYSNKDCPDSAEEYERATRYNYTSEEKFALVEVIAMIKGLQVLMGRMESVFNHAIRHTVYAALQDFSQVTLREPLRQAIKKKKNVIQSVLQAIRKTVCDWETGHEPFNDPALRGEKDPKSGFDIKVPRRAVGPSSTQLYMVRTMLESLIADKSGSKKTLRSSLEGPTILDIEKFHRESFFYTHLINFSETLQQCCDLSQLWFREFFLELTMGRRIQFPIEMSMPWILTDHVLETKEASMMEYVLYSLDLYNDSAHYALTRFNKQFLYDEIEAEVNLCFDQFVYKLADQIFAYYKVMAGSLLLDKRLRSECKNQGATIHLPPSNRYETLLKQRHVQLLGRSIDLNRLITQRVSAAMYKSLELAIGRFESEDLTSIVELDGLLEINRMTHKLLSRYLTLDGFDAMFREANHNVSAPYGRITLHVFWELNYDFLPNYCYNGSTNRFVRTVLPFSQEFQRDKQPNAQPQYLHGSKALNLAYSSIYGSYRNFVGPPHFQVICRLLGYQGIAVVMEELLKVVKSLLQGTILQYVKTLMEVMPKICRLPRHEYGSPGILEFFHHQLKDIVEYAELKTVCFQNLREVGNAILFCLLIEQSLSLEEVCDLLHAAPFQNILPRVHVKEGERLDAKMKRLESKYAPLHLVPLIERLGTPQQIAIAREGDLLTKERLCCGLSMFEVILTRIRSFLDDPIWRGPLPSNGVMHVDECVEFHRLWSAMQFVYCIPVGTHEFTVEQCFGDGLHWAGCMIIVLLGQQRRFAVLDFCYHLLKVQKHDGKDEIIKNVPLKKMVERIRKFQILNDEIITILDKYLKSGDGEGTPVEHVRCFQPPIHQSLASS
					

Structure Viewer

Loading PAE data...

(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	33.8	Very low	43.1	Very low	248 Å²	248	135.5 Å²	135.5	100%	1.222	78%	0.781	S	S	*	*				0	133.8	0	-68.4	-172.2	-115.5	0	0	106.6
2	A	33.2	Very low	43.4	Very low	106 Å²	106	132.3 Å²	132.3	88%	0.876	77%	0.772	S	S	*	*			cis	-162.2	166.6	-6.4	0	0	0	0	0	106.6
3	A	46.2	Very low	43.3	Very low	94 Å²	94	133.5 Å²	133.5	78%	0.777	77%	0.774	S	S	*	*			trans	-80.3	158	-162.3	0	0	0	0	0	118.5
4	Q	43.2	Very low	43.3	Very low	187 Å²	187	131.7 Å²	131.7	87%	0.874	77%	0.765	S	S	*	*				165.2	131	102.6	-100.3	180	-19.9	0	0	116.1
5	V	56.3	Low	42.9	Very low	127 Å²	127	132.2 Å²	132.2	77%	0.77	76%	0.764	S	S	*	*			trans	35.1	138.2	151.1	-171.1	0	0	0	0	121.6
6	T	54.1	Low	42.5	Very low	114 Å²	114	135 Å²	135	70%	0.699	77%	0.774	S	S	*	*			trans	175.6	163.3	135.9	46.7	0	0	0	0	115.8	E8	T6-E8 PolarHBondContact O-N 3.22Å
7	L	38.6	Very low	42.5	Very low	132 Å²	132	136.5 Å²	136.5	69%	0.691	78%	0.778	S	S	*	*	S	Bend	trans	72	-36.5	147.7	-160.5	60.1	0	0	0	121.2
8	E	45	Very low	42	Very low	153 Å²	153	139.5 Å²	139.5	72%	0.715	78%	0.784	S	S	*	*	S	Bend	trans	-94.6	107.3	165.4	-56.8	92.8	-168.7	0	0	107.5	T6	T6-E8 PolarHBondContact O-N 3.22Å
9	D	35.6	Very low	41.3	Very low	127 Å²	127	142.7 Å²	142.7	68%	0.679	79%	0.792	S	S	*	*	S	Bend		-143.4	19.8	67.9	-82.8	-39.9	0	0	0	111.3	L11 S12	D9-L11 PolarHBondContact O-N 3.38Å; D9-S12 PolarHBondContact O-N 3.25Å
10	A	43.2	Very low	41	Very low	74 Å²	74	142.9 Å²	142.9	61%	0.612	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-12.6	171.6	0	0	0	0	0	113.1
11	L	45.1	Very low	40.5	Very low	129 Å²	129	142 Å²	142	68%	0.675	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-13	174.7	-80.1	101.1	0	0	0	115.6	D9 N13	D9-L11 PolarHBondContact O-N 3.38Å; L11-N13 VanDerWaalsContact C-N 3.27Å; L11-N13 PolarHBondContact O-N 3.3Å
12	S	46	Very low	40.7	Very low	96 Å²	96	137.3 Å²	137.3	67%	0.671	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-2.9	-177	-66.5	0	0	0	0	114.3	D9	D9-S12 PolarHBondContact O-N 3.25Å
13	N	43.3	Very low	41.1	Very low	149 Å²	149	137.8 Å²	137.8	80%	0.797	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	6.3	-173.6	-81.2	-17.6	0	0	0	115.1	L11	L11-N13 VanDerWaalsContact C-N 3.27Å; L11-N13 PolarHBondContact O-N 3.3Å
14	V	42.8	Very low	40.1	Very low	108 Å²	108	140.2 Å²	140.2	66%	0.655	77%	0.765	S	S	*	*	S	Bend	trans	-119.2	-18.5	-166.3	-177.8	0	0	0	0	116.1
15	D	37.7	Very low	39.4	Very low	139 Å²	139	139.6 Å²	139.6	74%	0.743	76%	0.762	S	S	*	*	S	Bend	trans	-103.9	6.3	-161.3	-76.9	-13.1	0	0	0	118.9
16	L	36.7	Very low	38	Very low	177 Å²	177	142.6 Å²	142.6	93%	0.927	77%	0.768	S	S	*	*			trans	-137	63.8	175.6	-83.1	98.5	0	0	0	114.3
17	L	42.5	Very low	36.9	Very low	160 Å²	160	142.5 Å²	142.5	84%	0.838	77%	0.769	S	S	*	*			trans	-112.9	105.8	155.1	-70.9	169.8	0	0	0	107.9
18	E	33.7	Very low	36.5	Very low	191 Å²	191	141.6 Å²	141.6	89%	0.893	77%	0.772	S	S	*	*			trans	168.9	105.8	149.9	-105.8	177	142.4	0	0	110.7
19	E	28.7	Very low	36	Very low	200 Å²	200	140 Å²	140	94%	0.935	77%	0.767	S	S	*	*				171	111.1	129.3	-92	176.3	-173.5	0	0	111.5
20	L	35.1	Very low	35.7	Very low	146 Å²	146	136.8 Å²	136.8	76%	0.764	75%	0.748	S	S	*	*			trans	-81.3	149.5	170.6	-102.7	152.8	0	0	0	109.7	L22	L20-L22 HydrophobicContact CD2-CD1 4.25Å; L20-L22 HydrophobicContact CD2-CG 3.99Å
21	P	30.3	Very low	35.1	Very low	125 Å²	125	136.8 Å²	136.8	81%	0.812	74%	0.742	S	S	*	*				-150.8	169.9	88	32.5	-10.5	0	0	0	117
22	L	37	Very low	34.4	Very low	149 Å²	149	134.6 Å²	134.6	78%	0.78	74%	0.735	S	S	*	*			trans	-100.8	-173.3	-179.3	-60	149.5	0	0	0	110.9	L20	L20-L22 HydrophobicContact CD2-CD1 4.25Å; L20-L22 HydrophobicContact CD2-CG 3.99Å
23	P	41.5	Very low	33.8	Very low	116 Å²	116	133.6 Å²	133.6	75%	0.753	73%	0.727	S	S	*	*			cis	-118.5	178.7	-31.6	28.7	-6.1	0	0	0	110.6
24	D	25.3	Very low	33.6	Very low	146 Å²	146	132.3 Å²	132.3	78%	0.781	73%	0.73	S	S	*	*				176.2	164.4	81.8	-149.3	-4.5	0	0	0	112.4
25	Q	29.9	Very low	33.1	Very low	173 Å²	173	131.5 Å²	131.5	81%	0.808	73%	0.729	S	S	*	*			trans	-94.6	146.8	-147.7	-58	165.1	4.1	0	0	118
26	Q	26.3	Very low	33	Very low	191 Å²	191	133.6 Å²	133.6	89%	0.893	74%	0.739	S	S	*	*				-175.7	134.3	123.2	-120.8	178.6	-4.6	0	0	113.2
27	P	29.8	Very low	32.6	Very low	112 Å²	112	130.8 Å²	130.8	73%	0.727	72%	0.724	S	S	*	*			trans	-97.8	143.3	173.5	33.2	-26.9	0	0	0	113.3
28	C	30.6	Very low	32	Very low	113 Å²	113	133.5 Å²	133.5	76%	0.764	73%	0.725	S	S	*	*			trans	-121.7	124.3	172.9	-159.8	0	0	0	0	111
29	I	34	Very low	32.1	Very low	118 Å²	118	128.4 Å²	128.4	61%	0.605	70%	0.701	S	S	*	*			trans	-111.6	89.7	-158.9	-50.2	161.4	0	0	0	108.1
30	E	29.3	Very low	32.1	Very low	60 Å²	60	122.6 Å²	122.6	28%	0.28	68%	0.681	S	S	.	*			trans	-172.1	138.5	162.1	-108.5	153.2	-171.7	0	0	114.1	R467 H754	E30-R467 PolarHBondContact O-NH2 3.3Å; E30-H754 IonicContact OE1-CE1 2.6Å; E30-H754 IonicContact OE1-ND1 2.78Å; E30-H754 IonicContact OE1-NE2 3.86Å; E30-H754 IonicContact OE2-CE1 3.69Å; E30-H754 PolarHBondContact OE2-CE1 3.25Å; E30-H754 IonicContact OE2-ND1 3.02Å; E30-H754 IonicContact OE2-NE2 2.82Å; E30-H754 PolarHBondContact OE2-NE2 3.41Å
31	P	30.6	Very low	32.4	Very low	75 Å²	75	121.7 Å²	121.7	49%	0.487	68%	0.676	S	S	.	*	P	Polyproline II helix	trans	-68.7	148.1	175	28	-33.7	0	0	0	112.8	V463	P31-V463 HydrophobicContact CB-CG1 4.34Å; P31-V463 HydrophobicContact CB-CG2 3.59Å
32	P	31.4	Very low	33	Very low	82 Å²	82	123 Å²	123	53%	0.532	67%	0.67	S	S	.	*	P	Polyproline II helix	trans	-68.3	141.2	172.9	28.3	-31.4	0	0	0	110.7
33	P	33.7	Very low	33.6	Very low	76 Å²	76	119.4 Å²	119.4	49%	0.494	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-68.7	137.3	176	27.6	-31.9	0	0	0	110.6	S35 Q756	P33-S35 PolarHBondContact O-N 3.25Å; P33-Q756 HydrophobicContact CB-CG 4.26Å
34	S	39.2	Very low	34.4	Very low	122 Å²	122	116.1 Å²	116.1	85%	0.853	63%	0.629	S	S	*	*			trans	-70.7	67.7	173.2	-41.9	0	0	0	0	110.7
35	S	32.3	Very low	36.3	Very low	91 Å²	91	111.6 Å²	111.6	64%	0.636	61%	0.605	S	S	*	*			trans	-71.7	129.7	163.6	43.6	0	0	0	0	108.9	P33 L37	P33-S35 PolarHBondContact O-N 3.25Å; S35-L37 PolarHBondContact O-N 3.01Å
36	L	34	Very low	37.8	Very low	183 Å²	183	104.3 Å²	104.3	96%	0.958	57%	0.571	S	S	*	*			trans	-18.3	95	172.7	-85.3	148.3	0	0	0	113.1	Y38	L36-Y38 PolarHBondContact O-N 3.23Å
37	L	29.6	Very low	39.4	Very low	118 Å²	118	102.8 Å²	102.8	62%	0.618	56%	0.564	S	S	*	*			trans	-74.8	102.5	173.4	-88.3	154.5	0	0	0	107.9	S35 Q39	S35-L37 PolarHBondContact O-N 3.01Å; L37-Q39 HydrophobicContact CB-CG 4.46Å; L37-Q39 PolarHBondContact O-N 3.06Å
38	Y	29.7	Very low	41	Very low	216 Å²	216	99.6 Å²	99.6	85%	0.847	54%	0.54	S	S	*	.			trans	-77	98.9	161.6	-176.1	-98.9	0	0	0	107.8	L36	L36-Y38 PolarHBondContact O-N 3.23Å
39	Q	36.6	Very low	42.5	Very low	85 Å²	85	97 Å²	97	40%	0.397	52%	0.515	S	S	.	.			trans	-94.4	122.3	177.5	-83.8	178.3	-10.4	0	0	110.6	L37 N41 S609	L37-Q39 HydrophobicContact CB-CG 4.46Å; L37-Q39 PolarHBondContact O-N 3.06Å; Q39-N41 PolarHBondContact O-N 3.06Å; Q39-S609 VanDerWaalsContact NE2-CB 3.33Å; Q39-S609 PolarHBondContact NE2-OG 3.34Å
40	P	28.6	Very low	43.8	Very low	78 Å²	78	97.1 Å²	97.1	51%	0.506	52%	0.516	S	S	.	.			trans	-69.9	112.1	167.2	26.8	-29.8	0	0	0	109.5	F42	P40-F42 HydrophobicContact CB-CE1 4.41Å; P40-F42 HydrophobicContact CB-CE2 3.9Å; P40-F42 HydrophobicContact CB-CZ 3.82Å; P40-F42 HydrophobicContact CG-CE2 3.69Å; P40-F42 HydrophobicContact CG-CZ 3.85Å; P40-F42 WeakPolarHBondContact O-CD2 3.04Å; P40-F42 PolarHBondContact O-N 3.13Å
41	N	40	Very low	45	Very low	126 Å²	126	98.3 Å²	98.3	67%	0.674	54%	0.536	S	S	*	.			trans	-76.2	110.3	169.9	-176.8	2.2	0	0	0	109	Q39 N43	Q39-N41 PolarHBondContact O-N 3.06Å; N41-N43 VanDerWaalsContact OD1-CB 3.22Å; N41-N43 WeakPolarHBondContact OD1-CB 3.33Å; N41-N43 PolarHBondContact OD1-N 3.16Å
42	F	43.6	Very low	46.2	Very low	152 Å²	152	96.8 Å²	96.8	67%	0.667	52%	0.522	S	S	*	.			trans	-90.1	1.9	176.6	-63.6	-75.6	0	0	0	113.2	P40 T44	P40-F42 HydrophobicContact CB-CE1 4.41Å; P40-F42 HydrophobicContact CB-CE2 3.9Å; P40-F42 HydrophobicContact CB-CZ 3.82Å; P40-F42 HydrophobicContact CG-CE2 3.69Å; P40-F42 HydrophobicContact CG-CZ 3.85Å; P40-F42 WeakPolarHBondContact O-CD2 3.04Å; P40-F42 PolarHBondContact O-N 3.13Å; F42-T44 PolarHBondContact O-N 3.27Å
43	N	50.3	Low	47.2	Very low	74 Å²	74	97.8 Å²	97.8	40%	0.396	53%	0.527	S	S	.	.			trans	-78.6	104.6	175.6	-171.5	6.9	0	0	0	109.9	N41 N45 S556	N41-N43 VanDerWaalsContact OD1-CB 3.22Å; N41-N43 WeakPolarHBondContact OD1-CB 3.33Å; N41-N43 PolarHBondContact OD1-N 3.16Å; N43-N45 PolarHBondContact O-N 3.19Å; N43-N45 PolarHBondContact OD1-N 3.42Å; N43-S556 WeakPolarHBondContact OD1-CB 3.4Å; N43-S556 PolarHBondContact OD1-OG 2.92Å; N43-S556 VanDerWaalsContact OD1-OG 3.06Å
44	T	58.2	Low	48	Very low	48 Å²	48	97.1 Å²	97.1	29%	0.294	52%	0.521	S	S	.	.			trans	-76.3	1.7	179.8	55.6	0	0	0	0	113.9	F42 F46 E47 D48 S556	F42-T44 PolarHBondContact O-N 3.27Å; T44-F46 PolarHBondContact O-N 3.03Å; T44-E47 VanDerWaalsContact O-CB 3.29Å; T44-E47 WeakPolarHBondContact O-CB 3.36Å; T44-E47 WeakPolarHBondContact O-CG 3.19Å; T44-E47 PolarHBondContact O-N 3.11Å; T44-D48 WeakPolarHBondContact CB-OD1 3.49Å; T44-D48 PolarHBondContact OG1-OD1 3.22Å; T44-S556 PolarHBondContact OG1-OG 3.15Å
45	N	63.7	Low	48.4	Very low	50 Å²	50	94.5 Å²	94.5	27%	0.267	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.4	37.5	-173.6	-169.1	28.5	0	0	0	113.7	N43 E47 S67	N43-N45 PolarHBondContact O-N 3.19Å; N43-N45 PolarHBondContact OD1-N 3.42Å; N45-E47 PolarHBondContact O-N 3.11Å; N45-S67 PolarHBondContact ND2-OG 3.49Å; N45-S67 PolarHBondContact O-OG 3.08Å; N45-S67 PolarHBondContact OD1-OG 3.28Å
46	F	62.3	Low	49.7	Very low	21 Å²	21	92.2 Å²	92.2	9%	0.092	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	18.1	-178	-39.5	-71.2	0	0	0	117	T44 D48 R49 T557 Y560	T44-F46 PolarHBondContact O-N 3.03Å; F46-D48 VanDerWaalsContact C-N 3.26Å; F46-D48 PolarHBondContact O-N 3.44Å; F46-R49 VanDerWaalsContact O-CB 3.24Å; F46-R49 WeakPolarHBondContact O-CB 3.47Å; F46-R49 VanDerWaalsContact O-CD 3.25Å; F46-R49 WeakPolarHBondContact O-CD 3.45Å; F46-R49 WeakPolarHBondContact O-CG 3.46Å; F46-R49 PolarHBondContact O-N 2.6Å; F46-T557 VanDerWaalsContact CA-CG2 3.5Å; F46-T557 HydrophobicContact CB-CG2 4.03Å; F46-T557 HydrophobicContact CD1-CG2 3.86Å; F46-T557 HydrophobicContact CG-CG2 4.45Å; F46-Y560 HydrophobicContact CD1-CD1 4.41Å; F46-Y560 HydrophobicContact CD1-CG 4.41Å; F46-Y560 VanDerWaalsContact CE1-CB 3.42Å; F46-Y560 AromaticContact CE1-CD1 3.87Å; F46-Y560 HydrophobicContact CE1-CD1 3.87Å; F46-Y560 AromaticContact CE1-CD2 3.97Å; F46-Y560 HydrophobicContact CE1-CD2 3.97Å; F46-Y560 AromaticContact CE1-CG 3.47Å; F46-Y560 HydrophobicContact CE1-CG 3.47Å; F46-Y560 VanDerWaalsContact CE1-CG 3.47Å; F46-Y560 HydrophobicContact CZ-CD1 4.28Å; F46-Y560 AromaticContact CZ-CD2 3.75Å; F46-Y560 HydrophobicContact CZ-CD2 3.75Å; F46-Y560 HydrophobicContact CZ-CE2 4.24Å; F46-Y560 AromaticContact CZ-CG 3.77Å; F46-Y560 HydrophobicContact CZ-CG 3.77Å
47	E	59.6	Low	51	Low	158 Å²	158	87.3 Å²	87.3	74%	0.738	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-58.9	-35.1	176.8	-76.7	176.7	-177.1	0	0	113.1	T44 N45 R49	T44-E47 VanDerWaalsContact O-CB 3.29Å; T44-E47 WeakPolarHBondContact O-CB 3.36Å; T44-E47 WeakPolarHBondContact O-CG 3.19Å; T44-E47 PolarHBondContact O-N 3.11Å; N45-E47 PolarHBondContact O-N 3.11Å; E47-R49 VanDerWaalsContact C-N 3.29Å; E47-R49 PolarHBondContact O-N 3.5Å
48	D	63.6	Low	53.1	Low	45 Å²	45	86 Å²	86	24%	0.241	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-82.9	4.6	-179.4	60	-50.8	0	0	0	114.3	T44 F46 N50 A51 F52 T557	T44-D48 WeakPolarHBondContact CB-OD1 3.49Å; T44-D48 PolarHBondContact OG1-OD1 3.22Å; F46-D48 VanDerWaalsContact C-N 3.26Å; F46-D48 PolarHBondContact O-N 3.44Å; D48-N50 PolarHBondContact O-N 3.35Å; D48-A51 WeakPolarHBondContact O-CB 3.43Å; D48-A51 PolarHBondContact O-N 2.93Å; D48-F52 WeakPolarHBondContact OD2-CE2 3.12Å; D48-T557 WeakPolarHBondContact OD1-CG2 3.37Å; D48-T557 PolarHBondContact OD2-OG1 3.49Å
49	R	61.7	Low	55.3	Low	59 Å²	59	76.6 Å²	76.6	22%	0.223	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-54.4	-29.4	-177.5	66.6	-170.3	171.4	-141.3	0.1	114.8	F46 E47 A51 F52 I60 T64 T557	F46-R49 VanDerWaalsContact O-CB 3.24Å; F46-R49 WeakPolarHBondContact O-CB 3.47Å; F46-R49 VanDerWaalsContact O-CD 3.25Å; F46-R49 WeakPolarHBondContact O-CD 3.45Å; F46-R49 WeakPolarHBondContact O-CG 3.46Å; F46-R49 PolarHBondContact O-N 2.6Å; E47-R49 VanDerWaalsContact C-N 3.29Å; E47-R49 PolarHBondContact O-N 3.5Å; R49-A51 PolarHBondContact O-N 3.4Å; R49-F52 PolarHBondContact O-N 3.09Å; R49-I60 HydrophobicContact CB-CG2 4.32Å; R49-I60 HydrophobicContact CG-CG2 4.09Å; R49-T64 PolarHBondContact NE-OG1 2.69Å; R49-T64 VanDerWaalsContact NE-OG1 3.13Å; R49-T64 PolarHBondContact NH1-OG1 3.18Å; R49-T557 HydrophobicContact CB-CG2 4.47Å
50	N	62	Low	57	Low	120 Å²	120	73.7 Å²	73.7	64%	0.642	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-71.9	-11.4	179.8	-69	-23.4	0	0	0	113.3	D48 V53	D48-N50 PolarHBondContact O-N 3.35Å; N50-V53 VanDerWaalsContact O-CG2 3.27Å; N50-V53 WeakPolarHBondContact O-CG2 3.39Å
51	A	54.5	Low	59.3	Low	85 Å²	85	75.8 Å²	75.8	70%	0.702	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-79.1	-18.3	175.3	0	0	0	0	0	113	D48 R49	D48-A51 WeakPolarHBondContact O-CB 3.43Å; D48-A51 PolarHBondContact O-N 2.93Å; R49-A51 PolarHBondContact O-N 3.4Å
52	F	56.6	Low	61	Low	43 Å²	43	70.4 Å²	70.4	19%	0.189	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-104	28.9	-172.5	-55.5	-77.8	0	0	0	113.7	D48 R49 T54 T517 T557 Q558	D48-F52 WeakPolarHBondContact OD2-CE2 3.12Å; R49-F52 PolarHBondContact O-N 3.09Å; F52-T54 VanDerWaalsContact C-N 3.28Å; F52-T54 PolarHBondContact O-N 2.88Å; F52-T517 HydrophobicContact CD1-CG2 3.98Å; F52-T517 HydrophobicContact CG-CG2 4.38Å; F52-T557 WeakPolarHBondContact CE2-OG1 3.32Å; F52-Q558 HydrophobicContact CE1-CG 3.8Å; F52-Q558 HydrophobicContact CZ-CG 3.75Å
53	V	52.5	Low	62.6	Low	103 Å²	103	63.3 Å²	63.3	62%	0.624	36%	0.36	S	S	*	.			trans	-68.1	79.8	-176.1	-174.6	0	0	0	0	111.2	N50	N50-V53 VanDerWaalsContact O-CG2 3.27Å; N50-V53 WeakPolarHBondContact O-CG2 3.39Å
54	T	49.9	Very low	64.1	Low	63 Å²	63	61.6 Å²	61.6	39%	0.387	35%	0.352	S	S	.	.	S	Bend	trans	-141	77.2	175.4	54.6	0	0	0	0	111.5	F52 K516	F52-T54 VanDerWaalsContact C-N 3.28Å; F52-T54 PolarHBondContact O-N 2.88Å; T54-K516 HydrophobicContact CG2-CD 4.16Å; T54-K516 PolarHBondContact O-NZ 3.1Å; T54-K516 VanDerWaalsContact OG1-CD 3.27Å; T54-K516 WeakPolarHBondContact OG1-CD 3.16Å
55	G	48	Very low	65.4	Low	67 Å²	67	60.5 Å²	60.5	69%	0.691	35%	0.345	S	S	*	.	S	Bend	trans	116.6	-17.2	146.3	0	0	0	0	0	118.8
56	I	58.8	Low	66.3	Low	43 Å²	43	58.6 Å²	58.6	22%	0.221	34%	0.335	C	S	.	.			trans	-143.9	88	175.3	-53.1	174.6	0	0	0	110.2	R58 Y59 V510	I56-R58 HydrophobicContact CG2-CB 3.9Å; I56-R58 PolarHBondContact O-N 3.38Å; I56-Y59 HydrophobicContact CB-CD2 3.85Å; I56-Y59 HydrophobicContact CB-CE2 4.08Å; I56-Y59 HydrophobicContact CD1-CD2 4.37Å; I56-Y59 HydrophobicContact CD1-CE2 3.79Å; I56-Y59 HydrophobicContact CG2-CD2 3.64Å; I56-Y59 HydrophobicContact CG2-CE2 3.71Å; I56-Y59 PolarHBondContact O-N 3.39Å; I56-V510 HydrophobicContact CD1-CG2 3.67Å
57	A	61.7	Low	67.3	Low	80 Å²	80	57.9 Å²	57.9	66%	0.661	33%	0.333	S	S	*	.	H	α-helix	trans	-54.5	-23.9	178.9	0	0	0	0	0	113.8	Y59 I60 E61	A57-Y59 PolarHBondContact O-N 3Å; A57-I60 PolarHBondContact O-N 2.9Å; A57-E61 PolarHBondContact O-N 2.89Å; A57-E61 VanDerWaalsContact O-N 3.08Å
58	R	72.7	Confident	68.7	Low	90 Å²	90	51.9 Å²	51.9	34%	0.34	31%	0.308	S	S	.	.	H	α-helix	trans	-57.6	-38.9	178.8	175.4	-176.1	166.5	155.6	0.9	113.8	I56 Q62 R148 D151 F152	I56-R58 HydrophobicContact CG2-CB 3.9Å; I56-R58 PolarHBondContact O-N 3.38Å; R58-Q62 WeakPolarHBondContact O-CB 3.48Å; R58-Q62 PolarHBondContact O-N 3.25Å; R58-Q62 VanDerWaalsContact O-N 3.08Å; R58-R148 VanDerWaalsContact CZ-NH1 3.34Å; R58-D151 IonicContact CZ-OD2 2.75Å; R58-D151 IonicContact NH1-OD2 3.83Å; R58-D151 PolarHBondContact NH1-OD2 2.99Å; R58-D151 IonicContact NH2-OD2 3.99Å; R58-D151 PolarHBondContact NH2-OD2 2.93Å; R58-F152 PolarHBondContact NH2-O 3.03Å
59	Y	76.4	Confident	69.8	Low	18 Å²	18	49.8 Å²	49.8	7%	0.071	30%	0.297	C	S	.	.	H	α-helix	trans	-75.8	-32.4	-177.8	-65.1	-59.5	0	0	0	112.2	I56 A57 Q62 A63 F152 T564 M565 S568	I56-Y59 HydrophobicContact CB-CD2 3.85Å; I56-Y59 HydrophobicContact CB-CE2 4.08Å; I56-Y59 HydrophobicContact CD1-CD2 4.37Å; I56-Y59 HydrophobicContact CD1-CE2 3.79Å; I56-Y59 HydrophobicContact CG2-CD2 3.64Å; I56-Y59 HydrophobicContact CG2-CE2 3.71Å; I56-Y59 PolarHBondContact O-N 3.39Å; A57-Y59 PolarHBondContact O-N 3Å; Y59-Q62 PolarHBondContact O-N 3.46Å; Y59-A63 WeakPolarHBondContact O-CB 3.17Å; Y59-A63 PolarHBondContact O-N 3.26Å; Y59-F152 HydrophobicContact CE1-CE1 4.46Å; Y59-T564 HydrophobicContact CD1-CG2 3.86Å; Y59-T564 HydrophobicContact CE1-CG2 4.19Å; Y59-M565 HydrophobicContact CD2-CG 3.82Å; Y59-M565 HydrophobicContact CD2-SD 4.36Å; Y59-M565 HydrophobicContact CE2-CG 3.78Å; Y59-M565 HydrophobicContact CG-CG 4.4Å; Y59-S568 WeakPolarHBondContact OH-CB 3.18Å; Y59-S568 PolarHBondContact OH-OG 3.18Å; Y59-S568 VanDerWaalsContact OH-OG 3.06Å
60	I	72.9	Confident	71.1	Confident	25 Å²	25	48.9 Å²	48.9	13%	0.128	30%	0.296	C	S	.	.	H	α-helix	trans	-69	-43.1	175.6	-60.3	171.9	0	0	0	110.2	R49 A57 Q62 A63 T64 M561	R49-I60 HydrophobicContact CB-CG2 4.32Å; R49-I60 HydrophobicContact CG-CG2 4.09Å; A57-I60 PolarHBondContact O-N 2.9Å; I60-Q62 VanDerWaalsContact C-N 3.33Å; I60-Q62 PolarHBondContact O-N 3.42Å; I60-A63 PolarHBondContact O-N 2.87Å; I60-T64 PolarHBondContact O-N 3.28Å; I60-T64 PolarHBondContact O-OG1 2.94Å; I60-M561 HydrophobicContact CG1-CE 4Å
61	E	75.8	Confident	72.4	Confident	121 Å²	121	48.2 Å²	48.2	57%	0.565	29%	0.289	S	S	*	.	H	α-helix	trans	-61.3	-43.8	174	-174.2	60.8	-157	0	0	111	A57 A63 T64 V65	A57-E61 PolarHBondContact O-N 2.89Å; A57-E61 VanDerWaalsContact O-N 3.08Å; E61-A63 PolarHBondContact O-N 3.14Å; E61-T64 WeakPolarHBondContact O-CB 3.2Å; E61-T64 PolarHBondContact O-N 3.28Å; E61-T64 VanDerWaalsContact O-N 3.13Å; E61-V65 WeakPolarHBondContact O-CG2 3.48Å; E61-V65 PolarHBondContact O-N 3.34Å
62	Q	77.3	Confident	74.2	Confident	14 Å²	14	44.6 Å²	44.6	7%	0.065	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-39.4	176.3	-169.4	-179.4	-22.2	0	0	112.2	R58 Y59 I60 T64 H66	R58-Q62 WeakPolarHBondContact O-CB 3.48Å; R58-Q62 PolarHBondContact O-N 3.25Å; R58-Q62 VanDerWaalsContact O-N 3.08Å; Y59-Q62 PolarHBondContact O-N 3.46Å; I60-Q62 VanDerWaalsContact C-N 3.33Å; I60-Q62 PolarHBondContact O-N 3.42Å; Q62-T64 VanDerWaalsContact C-N 3.29Å; Q62-T64 PolarHBondContact O-N 3.29Å; Q62-H66 VanDerWaalsContact O-CB 3.26Å; Q62-H66 WeakPolarHBondContact O-CB 3.49Å; Q62-H66 PolarHBondContact O-N 3.35Å
63	A	77.3	Confident	75.9	Confident	2 Å²	2	43.6 Å²	43.6	2%	0.017	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-35.4	173	0	0	0	0	0	112	Y59 I60 E61 H66 S67 Y560	Y59-A63 WeakPolarHBondContact O-CB 3.17Å; Y59-A63 PolarHBondContact O-N 3.26Å; I60-A63 PolarHBondContact O-N 2.87Å; E61-A63 PolarHBondContact O-N 3.14Å; A63-H66 PolarHBondContact O-N 3.12Å; A63-S67 VanDerWaalsContact O-CB 3.31Å; A63-S67 WeakPolarHBondContact O-CB 3.29Å; A63-S67 PolarHBondContact O-N 3.06Å; A63-Y560 HydrophobicContact CB-CD1 4.31Å; A63-Y560 HydrophobicContact CB-CE1 3.72Å
64	T	80.9	Confident	77.7	Confident	38 Å²	38	45 Å²	45	23%	0.233	25%	0.254	C	S	.	.	H	α-helix	trans	-66.1	-48.3	177.4	-56.8	0	0	0	0	111.9	R49 I60 E61 Q62 H66 S67 S68	R49-T64 PolarHBondContact NE-OG1 2.69Å; R49-T64 VanDerWaalsContact NE-OG1 3.13Å; R49-T64 PolarHBondContact NH1-OG1 3.18Å; I60-T64 PolarHBondContact O-N 3.28Å; I60-T64 PolarHBondContact O-OG1 2.94Å; E61-T64 WeakPolarHBondContact O-CB 3.2Å; E61-T64 PolarHBondContact O-N 3.28Å; E61-T64 VanDerWaalsContact O-N 3.13Å; Q62-T64 VanDerWaalsContact C-N 3.29Å; Q62-T64 PolarHBondContact O-N 3.29Å; T64-H66 VanDerWaalsContact C-N 3.3Å; T64-H66 PolarHBondContact O-N 3.26Å; T64-S67 PolarHBondContact O-N 2.96Å; T64-S68 PolarHBondContact O-N 3.43Å; T64-S68 VanDerWaalsContact O-N 3.1Å
65	V	84.3	Confident	79.8	Confident	26 Å²	26	45.6 Å²	45.6	16%	0.158	25%	0.252	C	S	.	.	H	α-helix	trans	-61.7	-42.4	174.8	177.4	0	0	0	0	110.4	E61 S68 M69 Y157	E61-V65 WeakPolarHBondContact O-CG2 3.48Å; E61-V65 PolarHBondContact O-N 3.34Å; V65-S68 PolarHBondContact O-N 2.65Å; V65-M69 HydrophobicContact CG1-CG 4.4Å; V65-M69 WeakPolarHBondContact O-CG 3.44Å; V65-M69 PolarHBondContact O-N 2.96Å; V65-Y157 HydrophobicContact CG1-CE2 4.42Å; V65-Y157 WeakPolarHBondContact CG1-OH 3.43Å
66	H	84.6	Confident	82	Confident	9 Å²	9	42.4 Å²	42.4	4%	0.042	22%	0.22	C	C	.	.	H	α-helix	trans	-62.4	-48.4	179	-169.6	178.1	0	0	0	112.4	Q62 A63 T64 S68 M69 N70 Y157 T160 Y560	Q62-H66 VanDerWaalsContact O-CB 3.26Å; Q62-H66 WeakPolarHBondContact O-CB 3.49Å; Q62-H66 PolarHBondContact O-N 3.35Å; A63-H66 PolarHBondContact O-N 3.12Å; T64-H66 VanDerWaalsContact C-N 3.3Å; T64-H66 PolarHBondContact O-N 3.26Å; H66-S68 PolarHBondContact O-N 3.02Å; H66-M69 PolarHBondContact O-N 3.29Å; H66-N70 PolarHBondContact O-N 2.97Å; H66-Y157 HydrophobicContact CB-CD2 3.81Å; H66-Y157 HydrophobicContact CB-CE2 4.15Å; H66-Y157 AromaticContact CD2-CD2 3.75Å; H66-Y157 AromaticContact CG-CD2 3.66Å; H66-T160 PolarHBondContact NE2-OG1 2.72Å; H66-Y560 AromaticContact ND1-CE2 3.6Å; H66-Y560 AromaticContact ND1-CZ 3.67Å; H66-Y560 PolarHBondContact ND1-OH 3.09Å
67	S	83.3	Confident	83.6	Confident	7 Å²	7	44.2 Å²	44.2	5%	0.049	23%	0.228	C	C	.	.	H	α-helix	trans	-54.9	-49.1	175.8	179.4	0	0	0	0	111.7	N45 A63 T64 M69 N70 E71	N45-S67 PolarHBondContact ND2-OG 3.49Å; N45-S67 PolarHBondContact O-OG 3.08Å; N45-S67 PolarHBondContact OD1-OG 3.28Å; A63-S67 VanDerWaalsContact O-CB 3.31Å; A63-S67 WeakPolarHBondContact O-CB 3.29Å; A63-S67 PolarHBondContact O-N 3.06Å; T64-S67 PolarHBondContact O-N 2.96Å; S67-M69 VanDerWaalsContact C-N 3.29Å; S67-M69 PolarHBondContact O-N 2.87Å; S67-N70 WeakPolarHBondContact O-CB 3.44Å; S67-N70 PolarHBondContact O-N 3.38Å; S67-N70 VanDerWaalsContact O-N 3.09Å; S67-E71 PolarHBondContact O-N 3.09Å
68	S	86.9	Confident	85.2	Confident	31 Å²	31	47.1 Å²	47.1	22%	0.217	23%	0.227	C	C	.	.	H	α-helix	trans	-67.4	-27.7	-180	-170.8	0	0	0	0	113.7	T64 V65 H66 R135	T64-S68 PolarHBondContact O-N 3.43Å; T64-S68 VanDerWaalsContact O-N 3.1Å; V65-S68 PolarHBondContact O-N 2.65Å; H66-S68 PolarHBondContact O-N 3.02Å; S68-R135 PolarHBondContact OG-NH2 3.47Å
69	M	88.2	Confident	86.3	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-72.6	-35.2	172.8	-70.5	-70.3	-76.2	0	0	111.5	V65 H66 S67 M72 L73 R135 Y157 T160 L161 F164	V65-M69 HydrophobicContact CG1-CG 4.4Å; V65-M69 WeakPolarHBondContact O-CG 3.44Å; V65-M69 PolarHBondContact O-N 2.96Å; H66-M69 PolarHBondContact O-N 3.29Å; S67-M69 VanDerWaalsContact C-N 3.29Å; S67-M69 PolarHBondContact O-N 2.87Å; M69-M72 PolarHBondContact O-N 2.82Å; M69-L73 PolarHBondContact O-N 2.96Å; M69-R135 HydrophobicContact SD-CG 4.06Å; M69-Y157 HydrophobicContact CG-CE2 4.29Å; M69-T160 HydrophobicContact CB-CG2 4.3Å; M69-L161 HydrophobicContact CE-CD2 3.99Å; M69-F164 HydrophobicContact CB-CE2 3.85Å; M69-F164 HydrophobicContact CB-CZ 4.08Å; M69-F164 HydrophobicContact CE-CD1 4.27Å; M69-F164 HydrophobicContact CE-CD2 4.03Å; M69-F164 HydrophobicContact CE-CE1 3.82Å; M69-F164 HydrophobicContact CE-CE2 3.57Å; M69-F164 HydrophobicContact CE-CG 4.36Å; M69-F164 HydrophobicContact CE-CZ 3.44Å; M69-F164 VanDerWaalsContact CE-CZ 3.44Å; M69-F164 WeakPolarHBondContact O-CE2 3.39Å; M69-F164 WeakPolarHBondContact O-CZ 3.4Å; M69-F164 HydrophobicContact SD-CE1 4.49Å; M69-F164 HydrophobicContact SD-CE2 4.35Å; M69-F164 HydrophobicContact SD-CZ 3.9Å
70	N	87.6	Confident	87.3	Confident	40 Å²	40	43.6 Å²	43.6	21%	0.214	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-38.7	176.5	-71.6	-26.4	0	0	0	112.3	H66 S67 M72 L73 E74 T160	H66-N70 PolarHBondContact O-N 2.97Å; S67-N70 WeakPolarHBondContact O-CB 3.44Å; S67-N70 PolarHBondContact O-N 3.38Å; S67-N70 VanDerWaalsContact O-N 3.09Å; N70-M72 PolarHBondContact O-N 3.02Å; N70-L73 WeakPolarHBondContact O-CB 3.1Å; N70-L73 PolarHBondContact O-N 2.88Å; N70-E74 PolarHBondContact O-N 3.38Å; N70-E74 VanDerWaalsContact O-N 3.16Å; N70-T160 VanDerWaalsContact OD1-CG2 3.25Å; N70-T160 WeakPolarHBondContact OD1-CG2 3.48Å; N70-T160 PolarHBondContact OD1-OG1 3.45Å
71	E	89.3	Confident	88.3	Confident	107 Å²	107	43 Å²	43	50%	0.5	21%	0.212	S	C	.	.	H	α-helix	trans	-56	-38.2	174.4	-69	169.2	-175.7	0	0	112.1	S67 E74 E75	S67-E71 PolarHBondContact O-N 3.09Å; E71-E74 PolarHBondContact O-N 3.29Å; E71-E75 PolarHBondContact O-N 2.85Å
72	M	93.9	Very high	89.3	Confident	9 Å²	9	38.5 Å²	38.5	4%	0.044	19%	0.191	C	C	.	.	H	α-helix	trans	-73	-25.7	178.1	-173.2	171.2	-78.5	0	0	113	M69 N70 G76 F128 A132 R135 F164	M69-M72 PolarHBondContact O-N 2.82Å; N70-M72 PolarHBondContact O-N 3.02Å; M72-G76 PolarHBondContact O-N 3.44Å; M72-F128 HydrophobicContact CG-CE2 3.82Å; M72-F128 HydrophobicContact CG-CZ 4.15Å; M72-F128 WeakPolarHBondContact O-CZ 3.38Å; M72-A132 HydrophobicContact CG-CB 4.41Å; M72-A132 HydrophobicContact SD-CB 3.88Å; M72-R135 HydrophobicContact SD-CB 4.39Å; M72-R135 HydrophobicContact SD-CG 4.5Å; M72-F164 HydrophobicContact CB-CE1 4.45Å; M72-F164 HydrophobicContact CB-CZ 4.02Å; M72-F164 HydrophobicContact CG-CE1 4.12Å; M72-F164 HydrophobicContact CG-CZ 4.19Å; M72-F164 HydrophobicContact SD-CE1 3.97Å; M72-F164 HydrophobicContact SD-CZ 4.3Å
73	L	92.3	Very high	90.2	Very high	22 Å²	22	37.9 Å²	37.9	12%	0.115	19%	0.188	C	C	.	.	H	α-helix	trans	-69.2	-41.1	170.8	-72.9	172	0	0	0	111.4	M69 N70 G76 Q77 T160 K163 F164 M167	M69-L73 PolarHBondContact O-N 2.96Å; N70-L73 WeakPolarHBondContact O-CB 3.1Å; N70-L73 PolarHBondContact O-N 2.88Å; L73-G76 PolarHBondContact O-N 2.95Å; L73-Q77 PolarHBondContact O-N 3.42Å; L73-T160 HydrophobicContact CD1-CG2 3.96Å; L73-K163 HydrophobicContact CD1-CB 3.81Å; L73-K163 HydrophobicContact CD1-CD 4.21Å; L73-K163 HydrophobicContact CD2-CB 4.1Å; L73-F164 HydrophobicContact CD1-CD2 4.07Å; L73-F164 HydrophobicContact CD1-CE2 3.98Å; L73-F164 HydrophobicContact CD2-CD2 3.6Å; L73-F164 HydrophobicContact CD2-CE2 3.83Å; L73-F164 HydrophobicContact CD2-CG 4.01Å; L73-F164 HydrophobicContact CD2-CZ 4.43Å; L73-F164 HydrophobicContact CG-CD2 3.8Å; L73-F164 HydrophobicContact CG-CE2 3.54Å; L73-F164 HydrophobicContact CG-CZ 4.2Å; L73-M167 HydrophobicContact CD2-CB 4.13Å; L73-M167 HydrophobicContact CD2-SD 3.94Å
74	E	90.6	Very high	91.2	Very high	132 Å²	132	37.8 Å²	37.8	62%	0.617	19%	0.187	S	C	*	.	H	α-helix	trans	-63.9	-45.8	175.3	-62.2	-57.3	143.2	0	0	110.8	N70 E71 G76 Q77 E78	N70-E74 PolarHBondContact O-N 3.38Å; N70-E74 VanDerWaalsContact O-N 3.16Å; E71-E74 PolarHBondContact O-N 3.29Å; E74-G76 VanDerWaalsContact C-N 3.29Å; E74-G76 PolarHBondContact O-N 3.32Å; E74-Q77 WeakPolarHBondContact O-CB 3.46Å; E74-Q77 PolarHBondContact O-N 3.04Å; E74-Q77 VanDerWaalsContact O-N 3.07Å; E74-E78 PolarHBondContact O-N 3.39Å; E74-E78 VanDerWaalsContact O-N 3.1Å
75	E	93.8	Very high	92	Very high	75 Å²	75	36.3 Å²	36.3	35%	0.35	18%	0.179	S	C	.	.	H	α-helix	trans	-58.9	-40.9	174	-170.3	-173.6	174.7	0	0	111.5	E71 Q77 E78 Y79 F128	E71-E75 PolarHBondContact O-N 2.85Å; E75-Q77 VanDerWaalsContact C-N 3.31Å; E75-Q77 PolarHBondContact O-N 2.65Å; E75-E78 WeakPolarHBondContact O-CB 3.49Å; E75-E78 PolarHBondContact O-N 3.25Å; E75-Y79 HydrophobicContact CG-CD2 4.35Å; E75-Y79 HydrophobicContact CG-CE2 3.88Å; E75-Y79 VanDerWaalsContact O-CD2 3.23Å; E75-Y79 WeakPolarHBondContact O-CD2 3.31Å; E75-Y79 PolarHBondContact O-N 2.88Å; E75-F128 HydrophobicContact CB-CE2 3.87Å; E75-F128 HydrophobicContact CG-CD2 3.88Å; E75-F128 HydrophobicContact CG-CE2 3.75Å; E75-F128 WeakPolarHBondContact OE1-CD2 3.48Å
76	G	94.1	Very high	92.6	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-35.8	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 2.95Å; E74-G76 VanDerWaalsContact C-N 3.29Å; E74-G76 PolarHBondContact O-N 3.32Å; G76-Y79 PolarHBondContact O-N 2.88Å; G76-A80 PolarHBondContact O-N 2.77Å
77	Q	92.6	Very high	93.1	Very high	81 Å²	81	38.1 Å²	38.1	38%	0.379	18%	0.182	S	C	.	.	H	α-helix	trans	-66	-37.9	175.4	-177.3	64.6	12.9	0	0	111.5	L73 E74 E75 Y79 A80 V81	L73-Q77 PolarHBondContact O-N 3.42Å; E74-Q77 WeakPolarHBondContact O-CB 3.46Å; E74-Q77 PolarHBondContact O-N 3.04Å; E74-Q77 VanDerWaalsContact O-N 3.07Å; E75-Q77 VanDerWaalsContact C-N 3.31Å; E75-Q77 PolarHBondContact O-N 2.65Å; Q77-Y79 VanDerWaalsContact C-N 3.33Å; Q77-Y79 PolarHBondContact O-N 3.32Å; Q77-A80 WeakPolarHBondContact O-CB 3.12Å; Q77-A80 PolarHBondContact O-N 3.11Å; Q77-A80 VanDerWaalsContact O-N 3.17Å; Q77-V81 WeakPolarHBondContact O-CG2 3.27Å; Q77-V81 PolarHBondContact O-N 3.44Å
78	E	93.9	Very high	93.7	Very high	140 Å²	140	38.7 Å²	38.7	65%	0.654	19%	0.186	S	C	*	.	H	α-helix	trans	-60.3	-42.5	174	-65.2	-178.9	-167.8	0	0	111.9	E74 E75 V81 M82	E74-E78 PolarHBondContact O-N 3.39Å; E74-E78 VanDerWaalsContact O-N 3.1Å; E75-E78 WeakPolarHBondContact O-CB 3.49Å; E75-E78 PolarHBondContact O-N 3.25Å; E78-V81 PolarHBondContact O-N 3.18Å; E78-M82 PolarHBondContact O-N 3.41Å
79	Y	96.8	Very high	94.1	Very high	34 Å²	34	39.2 Å²	39.2	13%	0.133	19%	0.189	C	C	.	.	H	α-helix	trans	-67.3	-34.7	174.2	-72.8	-66.7	0	0	0	112.8	E75 G76 Q77 M82 L83 N124 F125 F128	E75-Y79 HydrophobicContact CG-CD2 4.35Å; E75-Y79 HydrophobicContact CG-CE2 3.88Å; E75-Y79 VanDerWaalsContact O-CD2 3.23Å; E75-Y79 WeakPolarHBondContact O-CD2 3.31Å; E75-Y79 PolarHBondContact O-N 2.88Å; G76-Y79 PolarHBondContact O-N 2.88Å; Q77-Y79 VanDerWaalsContact C-N 3.33Å; Q77-Y79 PolarHBondContact O-N 3.32Å; Y79-M82 HydrophobicContact CD1-CE 4.07Å; Y79-M82 HydrophobicContact CD1-SD 4.13Å; Y79-M82 WeakPolarHBondContact O-CB 3.39Å; Y79-M82 PolarHBondContact O-N 2.89Å; Y79-L83 WeakPolarHBondContact O-CG 3.47Å; Y79-L83 PolarHBondContact O-N 3.05Å; Y79-N124 HydrophobicContact CE1-CB 4.32Å; Y79-N124 WeakPolarHBondContact OH-CB 3.45Å; Y79-F125 HydrophobicContact CD1-CB 3.66Å; Y79-F125 AromaticContact CD1-CD2 3.97Å; Y79-F125 HydrophobicContact CD1-CD2 3.97Å; Y79-F125 HydrophobicContact CD1-CG 4.22Å; Y79-F125 HydrophobicContact CE1-CB 3.8Å; Y79-F125 HydrophobicContact CG-CB 4.43Å; Y79-F125 AromaticContact CG-CD2 3.92Å; Y79-F125 HydrophobicContact CG-CD2 3.92Å; Y79-F128 HydrophobicContact CD2-CB 4.08Å; Y79-F128 AromaticContact CD2-CD1 3.59Å; Y79-F128 HydrophobicContact CD2-CD1 3.59Å; Y79-F128 HydrophobicContact CD2-CD2 4.13Å; Y79-F128 HydrophobicContact CD2-CE1 4.07Å; Y79-F128 AromaticContact CD2-CG 3.64Å; Y79-F128 HydrophobicContact CD2-CG 3.64Å; Y79-F128 HydrophobicContact CE2-CB 3.52Å; Y79-F128 AromaticContact CE2-CD1 3.91Å; Y79-F128 HydrophobicContact CE2-CD1 3.91Å; Y79-F128 AromaticContact CE2-CD2 3.77Å; Y79-F128 HydrophobicContact CE2-CD2 3.77Å; Y79-F128 HydrophobicContact CE2-CE2 4.5Å; Y79-F128 AromaticContact CE2-CG 3.42Å; Y79-F128 HydrophobicContact CE2-CG 3.42Å; Y79-F128 VanDerWaalsContact CE2-CG 3.42Å; Y79-F128 HydrophobicContact CG-CD1 4.43Å
80	A	95.9	Very high	94.3	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-44.3	173.7	0	0	0	0	0	111.2	G76 Q77 M82 L83 Y84 V170 L171 L174 F308	G76-A80 PolarHBondContact O-N 2.77Å; Q77-A80 WeakPolarHBondContact O-CB 3.12Å; Q77-A80 PolarHBondContact O-N 3.11Å; Q77-A80 VanDerWaalsContact O-N 3.17Å; A80-M82 PolarHBondContact O-N 3.22Å; A80-L83 PolarHBondContact O-N 3.47Å; A80-Y84 WeakPolarHBondContact O-CB 3.48Å; A80-Y84 PolarHBondContact O-N 3.2Å; A80-V170 HydrophobicContact CB-CG1 3.96Å; A80-L171 HydrophobicContact CB-CD2 3.96Å; A80-L174 HydrophobicContact CB-CD1 3.73Å; A80-L174 WeakPolarHBondContact O-CD1 3.29Å; A80-F308 HydrophobicContact CB-CD2 4.03Å; A80-F308 HydrophobicContact CB-CE2 3.47Å; A80-F308 VanDerWaalsContact CB-CE2 3.47Å; A80-F308 HydrophobicContact CB-CZ 3.97Å
81	V	95.8	Very high	94.5	Very high	13 Å²	13	44.9 Å²	44.9	8%	0.079	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-46.1	172.8	170.4	0	0	0	0	111	Q77 E78 L83 Y84 T85 F308 F682	Q77-V81 WeakPolarHBondContact O-CG2 3.27Å; Q77-V81 PolarHBondContact O-N 3.44Å; E78-V81 PolarHBondContact O-N 3.18Å; V81-L83 PolarHBondContact O-N 3.38Å; V81-Y84 PolarHBondContact O-N 2.96Å; V81-T85 HydrophobicContact CG1-CG2 4.42Å; V81-T85 WeakPolarHBondContact O-CB 3.23Å; V81-T85 WeakPolarHBondContact O-CG2 3.45Å; V81-T85 PolarHBondContact O-N 3.27Å; V81-T85 PolarHBondContact O-OG1 2.86Å; V81-F308 HydrophobicContact CG2-CZ 3.96Å; V81-F682 HydrophobicContact CB-CD1 4.5Å; V81-F682 HydrophobicContact CG1-CB 4.36Å; V81-F682 HydrophobicContact CG1-CD1 3.97Å; V81-F682 WeakPolarHBondContact CG1-O 3.49Å; V81-F682 HydrophobicContact CG2-CD1 4.01Å; V81-F682 HydrophobicContact CG2-CE1 4.47Å
82	M	96.4	Very high	94.7	Very high	26 Å²	26	43.9 Å²	43.9	13%	0.128	22%	0.223	C	C	.	.	H	α-helix	trans	-56.1	-49.4	177	-179	-155.8	70.8	0	0	111.2	E78 Y79 A80 W86 K121 L122 F125	E78-M82 PolarHBondContact O-N 3.41Å; Y79-M82 HydrophobicContact CD1-CE 4.07Å; Y79-M82 HydrophobicContact CD1-SD 4.13Å; Y79-M82 WeakPolarHBondContact O-CB 3.39Å; Y79-M82 PolarHBondContact O-N 2.89Å; A80-M82 PolarHBondContact O-N 3.22Å; M82-W86 HydrophobicContact CE-CE3 4.44Å; M82-W86 HydrophobicContact CE-CZ3 4.32Å; M82-W86 HydrophobicContact CG-CE3 4.01Å; M82-W86 HydrophobicContact CG-CZ3 4.13Å; M82-W86 WeakPolarHBondContact O-CB 3.48Å; M82-W86 PolarHBondContact O-N 3.22Å; M82-W86 VanDerWaalsContact O-N 3.17Å; M82-W86 HydrophobicContact SD-CE3 4.38Å; M82-W86 HydrophobicContact SD-CZ3 3.99Å; M82-K121 HydrophobicContact SD-CB 3.65Å; M82-K121 HydrophobicContact SD-CD 4.45Å; M82-L122 HydrophobicContact CE-CD2 4.18Å; M82-F125 HydrophobicContact CE-CB 4.11Å; M82-F125 HydrophobicContact CE-CG 4.31Å
83	L	96.5	Very high	94.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.9	-49.1	-179.6	-70.5	171.1	0	0	0	111.8	Y79 A80 V81 T85 W86 F125 L171 L174 K178 V181	Y79-L83 WeakPolarHBondContact O-CG 3.47Å; Y79-L83 PolarHBondContact O-N 3.05Å; A80-L83 PolarHBondContact O-N 3.47Å; V81-L83 PolarHBondContact O-N 3.38Å; L83-T85 VanDerWaalsContact C-N 3.34Å; L83-T85 PolarHBondContact O-N 3.35Å; L83-W86 WeakPolarHBondContact O-CB 3.41Å; L83-W86 PolarHBondContact O-N 3.03Å; L83-F125 HydrophobicContact CD1-CE1 4.06Å; L83-F125 HydrophobicContact CD1-CE2 4.08Å; L83-F125 HydrophobicContact CD1-CZ 3.7Å; L83-F125 HydrophobicContact CD2-CD1 4.46Å; L83-F125 HydrophobicContact CD2-CE1 4.22Å; L83-L171 HydrophobicContact CD1-CD2 4.11Å; L83-L174 HydrophobicContact CB-CB 3.95Å; L83-L174 HydrophobicContact CB-CD1 4.38Å; L83-L174 HydrophobicContact CD1-CB 3.99Å; L83-K178 WeakPolarHBondContact O-CD 3.35Å; L83-K178 WeakPolarHBondContact O-CE 3.38Å; L83-K178 WeakPolarHBondContact O-CG 3.43Å; L83-V181 HydrophobicContact CD2-CG2 4.24Å
84	Y	97.5	Very high	94.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.3	-44.2	-177.4	179.4	-105.5	0	0	0	112.1	A80 V81 W86 L174 M177 K178 F308 D310 F623 E625 F682	A80-Y84 WeakPolarHBondContact O-CB 3.48Å; A80-Y84 PolarHBondContact O-N 3.2Å; V81-Y84 PolarHBondContact O-N 2.96Å; Y84-W86 VanDerWaalsContact C-N 3.29Å; Y84-W86 PolarHBondContact O-N 3.32Å; Y84-L174 HydrophobicContact CD2-CD2 4Å; Y84-M177 HydrophobicContact CD2-CE 4.11Å; Y84-K178 VanDerWaalsContact O-CE 3.24Å; Y84-K178 WeakPolarHBondContact O-CE 3.39Å; Y84-K178 PolarHBondContact O-NZ 3.25Å; Y84-F308 HydrophobicContact CD1-CD1 4.25Å; Y84-F308 AromaticContact CD1-CE1 3.8Å; Y84-F308 HydrophobicContact CD1-CE1 3.8Å; Y84-F308 AromaticContact CD2-CD1 3.76Å; Y84-F308 HydrophobicContact CD2-CD1 3.76Å; Y84-F308 HydrophobicContact CD2-CE1 4.1Å; Y84-F308 HydrophobicContact CE2-CD1 4.39Å; Y84-F308 AromaticContact CG-CD1 3.67Å; Y84-F308 HydrophobicContact CG-CD1 3.67Å; Y84-F308 AromaticContact CG-CE1 3.5Å; Y84-F308 HydrophobicContact CG-CE1 3.5Å; Y84-D310 VanDerWaalsContact CE2-OD1 3.24Å; Y84-D310 WeakPolarHBondContact CE2-OD1 3.28Å; Y84-D310 PolarHBondContact OH-N 2.73Å; Y84-D310 PolarHBondContact OH-OD1 3.2Å; Y84-F623 WeakPolarHBondContact OH-CB 3.12Å; Y84-E625 HydrophobicContact CD1-CB 4.37Å; Y84-E625 HydrophobicContact CD1-CG 4.3Å; Y84-E625 HydrophobicContact CD2-CB 4.27Å; Y84-E625 HydrophobicContact CE1-CB 3.96Å; Y84-E625 HydrophobicContact CE1-CG 3.81Å; Y84-E625 HydrophobicContact CE2-CB 3.84Å; Y84-F682 AromaticContact CD1-CE1 3.99Å; Y84-F682 HydrophobicContact CD1-CE1 3.99Å; Y84-F682 AromaticContact CD1-CZ 3.93Å; Y84-F682 HydrophobicContact CD1-CZ 3.93Å; Y84-F682 HydrophobicContact CE1-CE1 4.22Å; Y84-F682 HydrophobicContact CE1-CE2 4.13Å; Y84-F682 AromaticContact CE1-CZ 3.67Å; Y84-F682 HydrophobicContact CE1-CZ 3.67Å
85	T	96.6	Very high	94.5	Very high	8 Å²	8	49 Å²	49	5%	0.049	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	3.3	-178.9	62.8	0	0	0	0	114	V81 L83 R87 F682 K684 L687	V81-T85 HydrophobicContact CG1-CG2 4.42Å; V81-T85 WeakPolarHBondContact O-CB 3.23Å; V81-T85 WeakPolarHBondContact O-CG2 3.45Å; V81-T85 PolarHBondContact O-N 3.27Å; V81-T85 PolarHBondContact O-OG1 2.86Å; L83-T85 VanDerWaalsContact C-N 3.34Å; L83-T85 PolarHBondContact O-N 3.35Å; T85-R87 PolarHBondContact O-N 3.19Å; T85-F682 HydrophobicContact CG2-CB 4.37Å; T85-F682 HydrophobicContact CG2-CD1 4.3Å; T85-F682 HydrophobicContact CG2-CG 4.27Å; T85-K684 HydrophobicContact CG2-CG 4.04Å; T85-K684 WeakPolarHBondContact OG1-CE 3.4Å; T85-L687 HydrophobicContact CG2-CD1 3.93Å
86	W	97.3	Very high	94.4	Very high	16 Å²	16	47 Å²	47	6%	0.061	25%	0.246	C	C	.	.			trans	-73.9	109.2	176.8	-160.9	-60.5	0	0	0	110.9	M82 L83 Y84 E118 L122 K178 V181 D184	M82-W86 HydrophobicContact CE-CE3 4.44Å; M82-W86 HydrophobicContact CE-CZ3 4.32Å; M82-W86 HydrophobicContact CG-CE3 4.01Å; M82-W86 HydrophobicContact CG-CZ3 4.13Å; M82-W86 WeakPolarHBondContact O-CB 3.48Å; M82-W86 PolarHBondContact O-N 3.22Å; M82-W86 VanDerWaalsContact O-N 3.17Å; M82-W86 HydrophobicContact SD-CE3 4.38Å; M82-W86 HydrophobicContact SD-CZ3 3.99Å; L83-W86 WeakPolarHBondContact O-CB 3.41Å; L83-W86 PolarHBondContact O-N 3.03Å; Y84-W86 VanDerWaalsContact C-N 3.29Å; Y84-W86 PolarHBondContact O-N 3.32Å; W86-E118 HydrophobicContact CH2-CB 3.7Å; W86-E118 WeakPolarHBondContact CH2-O 3.33Å; W86-E118 HydrophobicContact CZ2-CB 3.82Å; W86-L122 HydrophobicContact CE3-CD2 4.16Å; W86-L122 HydrophobicContact CH2-CD1 3.83Å; W86-L122 HydrophobicContact CH2-CD2 3.61Å; W86-L122 HydrophobicContact CH2-CG 3.52Å; W86-L122 HydrophobicContact CZ2-CD1 4.1Å; W86-L122 HydrophobicContact CZ2-CD2 4.37Å; W86-L122 HydrophobicContact CZ2-CG 4.28Å; W86-L122 HydrophobicContact CZ3-CD2 3.48Å; W86-L122 VanDerWaalsContact CZ3-CD2 3.48Å; W86-L122 HydrophobicContact CZ3-CG 3.9Å; W86-K178 PolarHBondContact O-NZ 3.35Å; W86-V181 HydrophobicContact CB-CG2 3.99Å; W86-V181 HydrophobicContact CD2-CG2 3.68Å; W86-V181 HydrophobicContact CE3-CG2 4.15Å; W86-V181 HydrophobicContact CG-CG2 3.58Å; W86-D184 PolarHBondContact NE1-OD2 3.29Å
87	R	96	Very high	94.1	Very high	57 Å²	57	55.5 Å²	55.5	22%	0.215	28%	0.283	C	S	.	.			trans	-100.6	151	168	-67.3	-172.2	178.4	173.2	7.2	110.3	T85 C89 E625 E690	T85-R87 PolarHBondContact O-N 3.19Å; R87-C89 PolarHBondContact O-N 3.41Å; R87-E625 IonicContact CZ-OE1 2.73Å; R87-E625 IonicContact CZ-OE2 3.79Å; R87-E625 IonicContact NE-OE1 3.29Å; R87-E625 PolarHBondContact NE-OE1 3.45Å; R87-E625 IonicContact NE-OE2 3.11Å; R87-E625 PolarHBondContact NE-OE2 3.33Å; R87-E625 IonicContact NH2-OE1 2.8Å; R87-E625 PolarHBondContact NH2-OE1 3.11Å; R87-E625 IonicContact NH2-OE2 2.72Å; R87-E690 IonicContact CZ-OE1 2.86Å; R87-E690 IonicContact CZ-OE2 3.41Å; R87-E690 IonicContact NH1-OE1 2.94Å; R87-E690 PolarHBondContact NH1-OE1 2.89Å; R87-E690 IonicContact NH1-OE2 2.7Å; R87-E690 IonicContact NH2-OE1 3.91Å; R87-E690 PolarHBondContact NH2-OE1 3.39Å; R87-E690 IonicContact NH2-OE2 3.88Å; R87-E690 PolarHBondContact NH2-OE2 3.23Å
88	S	95.8	Very high	93.8	Very high	19 Å²	19	54.5 Å²	54.5	13%	0.133	29%	0.285	C	S	.	.			trans	-69.3	116.5	-172.5	-176.8	0	0	0	0	113.1	S90 R91 S180 D184	S88-S90 PolarHBondContact OG-N 3.05Å; S88-S90 PolarHBondContact OG-OG 3.34Å; S88-R91 WeakPolarHBondContact OG-CG 3.43Å; S88-R91 PolarHBondContact OG-N 3.43Å; S88-S180 WeakPolarHBondContact CB-OG 3.24Å; S88-D184 WeakPolarHBondContact CA-OD2 3.47Å; S88-D184 PolarHBondContact OG-OD1 2.99Å
89	C	94.6	Very high	93.4	Very high	41 Å²	41	53.2 Å²	53.2	28%	0.277	28%	0.282	S	S	.	.	S	Bend	trans	-72.8	-35.7	169.7	-64.7	0	0	0	0	111.6	R87 R91 A92 I93 L115 D184	R87-C89 PolarHBondContact O-N 3.41Å; C89-R91 PolarHBondContact O-N 3.45Å; C89-A92 WeakPolarHBondContact O-CB 3.49Å; C89-A92 PolarHBondContact O-N 3.19Å; C89-I93 PolarHBondContact O-N 2.99Å; C89-L115 HydrophobicContact CB-CD2 3.53Å; C89-D184 PolarHBondContact N-OD1 2.92Å; C89-D184 PolarHBondContact N-OD2 3.35Å
90	S	92.1	Very high	93	Very high	32 Å²	32	59 Å²	59	22%	0.224	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.2	-178.9	56.2	0	0	0	0	113.7	S88 A92 I93 D184	S88-S90 PolarHBondContact OG-N 3.05Å; S88-S90 PolarHBondContact OG-OG 3.34Å; S90-A92 VanDerWaalsContact C-N 3.3Å; S90-A92 PolarHBondContact O-N 2.88Å; S90-I93 PolarHBondContact O-N 2.95Å; S90-D184 WeakPolarHBondContact CB-OD1 3.35Å; S90-D184 PolarHBondContact N-OD1 3Å; S90-D184 PolarHBondContact OG-OD1 3.17Å
91	R	92.8	Very high	92.7	Very high	128 Å²	128	60.7 Å²	60.7	48%	0.483	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-27.3	171.1	-69.9	179.3	-168.9	-83.2	3.7	113.4	S88 C89 M632	S88-R91 WeakPolarHBondContact OG-CG 3.43Å; S88-R91 PolarHBondContact OG-N 3.43Å; C89-R91 PolarHBondContact O-N 3.45Å; R91-M632 VanDerWaalsContact CZ-C 3.47Å; R91-M632 PolarHBondContact NH1-O 3.23Å; R91-M632 PolarHBondContact NH2-O 3.41Å
92	A	92.9	Very high	92.3	Very high	87 Å²	87	66 Å²	66	72%	0.719	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-16.7	177	0	0	0	0	0	112.9	C89 S90	C89-A92 WeakPolarHBondContact O-CB 3.49Å; C89-A92 PolarHBondContact O-N 3.19Å; S90-A92 VanDerWaalsContact C-N 3.3Å; S90-A92 PolarHBondContact O-N 2.88Å
93	I	93	Very high	92.1	Very high	40 Å²	40	68.2 Å²	68.2	21%	0.205	37%	0.365	C	S	.	.	S	Bend	trans	-79.8	131.4	179.8	-69.1	163.3	0	0	0	110.1	C89 S90 Q95 I107 T111 L115	C89-I93 PolarHBondContact O-N 2.99Å; S90-I93 PolarHBondContact O-N 2.95Å; I93-Q95 PolarHBondContact O-N 3.16Å; I93-I107 HydrophobicContact CG2-CG2 4.3Å; I93-T111 HydrophobicContact CD1-CG2 3.95Å; I93-T111 WeakPolarHBondContact CG2-OG1 3.23Å; I93-L115 HydrophobicContact CD1-CD1 3.87Å; I93-L115 HydrophobicContact CD1-CG 4.23Å
94	P	91.2	Very high	91.8	Very high	79 Å²	79	71.1 Å²	71.1	51%	0.513	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-64.8	122	175.6	26.8	-34.4	0	0	0	110.9	I107	P94-I107 HydrophobicContact CB-CD1 4.38Å; P94-I107 HydrophobicContact CG-CD1 4.12Å; P94-I107 HydrophobicContact CG-CG1 4.02Å; P94-I107 HydrophobicContact CG-CG2 4.4Å; P94-I107 WeakPolarHBondContact O-CG2 3.47Å
95	Q	89.9	Confident	91.5	Very high	150 Å²	150	74 Å²	74	70%	0.701	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-70	140.1	179.2	64.6	179	-14.8	0	0	112.3	I93 K97	I93-Q95 PolarHBondContact O-N 3.16Å; Q95-K97 PolarHBondContact O-N 3.5Å
96	V	90.3	Very high	91.3	Very high	33 Å²	33	78.5 Å²	78.5	20%	0.2	41%	0.414	C	S	.	.			trans	-77.2	110.4	170.5	178.3	0	0	0	0	108.4	C98 Q101 R104 I107 Y108	V96-C98 VanDerWaalsContact CG1-O 3.29Å; V96-C98 WeakPolarHBondContact CG1-O 3.37Å; V96-Q101 VanDerWaalsContact CA-OE1 3.29Å; V96-Q101 HydrophobicContact CG1-CB 4.39Å; V96-R104 HydrophobicContact CG1-CB 4.31Å; V96-R104 HydrophobicContact CG1-CG 3.74Å; V96-R104 HydrophobicContact CG2-CG 4.11Å; V96-I107 HydrophobicContact CG2-CB 4.39Å; V96-I107 HydrophobicContact CG2-CD1 4.28Å; V96-I107 HydrophobicContact CG2-CG2 4.04Å; V96-Y108 HydrophobicContact CG2-CE1 4.09Å; V96-Y108 HydrophobicContact CG2-CE2 4.13Å
97	K	87.9	Confident	91.1	Very high	180 Å²	180	78.4 Å²	78.4	78%	0.783	41%	0.414	S	S	*	.			trans	-77.3	-35.9	-173.9	-68.2	-176	179.8	-180	0	113.2	Q95	Q95-K97 PolarHBondContact O-N 3.5Å
98	C	87.1	Confident	91	Very high	61 Å²	61	77.3 Å²	77.3	41%	0.412	41%	0.411	S	S	.	.	S	Bend	trans	-149.5	168	-179.5	61.8	0	0	0	0	110.7	V96 E100 Q101	V96-C98 VanDerWaalsContact CG1-O 3.29Å; V96-C98 WeakPolarHBondContact CG1-O 3.37Å; C98-E100 WeakPolarHBondContact CB-OE2 3.49Å; C98-E100 PolarHBondContact O-N 3.24Å; C98-Q101 WeakPolarHBondContact O-CB 3.22Å; C98-Q101 PolarHBondContact O-N 3.24Å
99	N	85.9	Confident	90.8	Very high	113 Å²	113	81.3 Å²	81.3	60%	0.604	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-20.4	-177.8	-72.2	-22.3	0	0	0	112.7	Q101 R104	N99-Q101 VanDerWaalsContact C-N 3.31Å; N99-R104 PolarHBondContact O-NE 3.38Å; N99-R104 PolarHBondContact O-NH1 2.78Å; N99-R104 PolarHBondContact O-NH2 3.39Å
100	E	86.8	Confident	90.8	Very high	154 Å²	154	85 Å²	85	72%	0.72	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	6.7	-177.4	-56.8	73.9	-159.3	0	0	112.9	C98	C98-E100 WeakPolarHBondContact CB-OE2 3.49Å; C98-E100 PolarHBondContact O-N 3.24Å
101	Q	89.4	Confident	91	Very high	38 Å²	38	83.9 Å²	83.9	18%	0.178	43%	0.43	C	S	.	.			trans	-67	126.9	-177.2	-176.9	169.6	-24	0	0	111.6	V96 C98 N99 N103 R104	V96-Q101 VanDerWaalsContact CA-OE1 3.29Å; V96-Q101 HydrophobicContact CG1-CB 4.39Å; C98-Q101 WeakPolarHBondContact O-CB 3.22Å; C98-Q101 PolarHBondContact O-N 3.24Å; N99-Q101 VanDerWaalsContact C-N 3.31Å; Q101-N103 VanDerWaalsContact CG-OD1 3.27Å; Q101-N103 WeakPolarHBondContact CG-OD1 3.37Å; Q101-N103 PolarHBondContact NE2-OD1 2.96Å; Q101-N103 PolarHBondContact O-N 3.39Å; Q101-R104 HydrophobicContact CB-CB 4.31Å; Q101-R104 WeakPolarHBondContact O-CB 3.46Å; Q101-R104 PolarHBondContact O-N 3.01Å
102	P	88.2	Confident	91.1	Very high	123 Å²	123	78.4 Å²	78.4	80%	0.799	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-46.9	-173	-26.7	34.2	0	0	0	114.1	R104	P102-R104 PolarHBondContact O-N 3.33Å
103	N	92.4	Very high	91.2	Very high	73 Å²	73	79.8 Å²	79.8	39%	0.39	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	21.1	-177.1	64.7	-21.2	0	0	0	113.6	Q101 V105 E106 I107	Q101-N103 VanDerWaalsContact CG-OD1 3.27Å; Q101-N103 WeakPolarHBondContact CG-OD1 3.37Å; Q101-N103 PolarHBondContact NE2-OD1 2.96Å; Q101-N103 PolarHBondContact O-N 3.39Å; N103-V105 VanDerWaalsContact C-N 3.35Å; N103-V105 PolarHBondContact O-N 3.13Å; N103-E106 WeakPolarHBondContact CA-OE2 3.48Å; N103-I107 WeakPolarHBondContact O-CB 3.28Å; N103-I107 WeakPolarHBondContact O-CD1 3.39Å; N103-I107 WeakPolarHBondContact O-CG1 3.3Å; N103-I107 PolarHBondContact O-N 2.98Å
104	R	90.3	Very high	91.3	Very high	61 Å²	61	81.7 Å²	81.7	23%	0.23	42%	0.416	C	S	.	.	H	α-helix	trans	-63	-40.3	-174	176.1	175.2	66	165.1	-4.1	112.4	V96 N99 Q101 P102 Y108 F194	V96-R104 HydrophobicContact CG1-CB 4.31Å; V96-R104 HydrophobicContact CG1-CG 3.74Å; V96-R104 HydrophobicContact CG2-CG 4.11Å; N99-R104 PolarHBondContact O-NE 3.38Å; N99-R104 PolarHBondContact O-NH1 2.78Å; N99-R104 PolarHBondContact O-NH2 3.39Å; Q101-R104 HydrophobicContact CB-CB 4.31Å; Q101-R104 WeakPolarHBondContact O-CB 3.46Å; Q101-R104 PolarHBondContact O-N 3.01Å; P102-R104 PolarHBondContact O-N 3.33Å; R104-Y108 HydrophobicContact CG-CD2 3.97Å; R104-Y108 HydrophobicContact CG-CE2 3.65Å; R104-Y108 WeakPolarHBondContact O-CD2 3.45Å; R104-Y108 PolarHBondContact O-N 2.87Å; R104-F194 HydrophobicContact CG-CE1 4.47Å; R104-F194 HydrophobicContact CG-CZ 4.35Å
105	V	91.4	Very high	91.5	Very high	61 Å²	61	78 Å²	78	37%	0.37	39%	0.392	S	S	.	.	H	α-helix	trans	-70.3	-46.6	-176.9	179.2	0	0	0	0	109.5	N103 I107 Y108 E109 F194 L195	N103-V105 VanDerWaalsContact C-N 3.35Å; N103-V105 PolarHBondContact O-N 3.13Å; V105-I107 VanDerWaalsContact C-N 3.33Å; V105-I107 PolarHBondContact O-N 3.48Å; V105-Y108 PolarHBondContact O-N 2.96Å; V105-Y108 VanDerWaalsContact O-N 3.09Å; V105-E109 HydrophobicContact CG1-CG 4.4Å; V105-E109 WeakPolarHBondContact O-CG 3.34Å; V105-E109 PolarHBondContact O-N 3.3Å; V105-F194 HydrophobicContact CG2-CE1 4.42Å; V105-L195 HydrophobicContact CG1-CD2 4.05Å
106	E	92.3	Very high	91.7	Very high	103 Å²	103	74.4 Å²	74.4	48%	0.481	38%	0.375	S	S	.	.	H	α-helix	trans	-61.1	-41.4	179.4	-59.9	89.6	152.2	0	0	111.3	N103 Y108 E109 K110	N103-E106 WeakPolarHBondContact CA-OE2 3.48Å; E106-Y108 VanDerWaalsContact C-N 3.34Å; E106-Y108 PolarHBondContact O-N 3.46Å; E106-E109 PolarHBondContact O-N 2.83Å; E106-K110 WeakPolarHBondContact O-CB 3.37Å; E106-K110 WeakPolarHBondContact O-CG 3.49Å; E106-K110 PolarHBondContact O-N 3.2Å
107	I	93.3	Very high	92	Very high	13 Å²	13	76.1 Å²	76.1	7%	0.067	39%	0.387	C	S	.	.	H	α-helix	trans	-59.3	-46.9	174.6	-71.7	168.5	0	0	0	110.3	I93 P94 V96 N103 V105 T111	I93-I107 HydrophobicContact CG2-CG2 4.3Å; P94-I107 HydrophobicContact CB-CD1 4.38Å; P94-I107 HydrophobicContact CG-CD1 4.12Å; P94-I107 HydrophobicContact CG-CG1 4.02Å; P94-I107 HydrophobicContact CG-CG2 4.4Å; P94-I107 WeakPolarHBondContact O-CG2 3.47Å; V96-I107 HydrophobicContact CG2-CB 4.39Å; V96-I107 HydrophobicContact CG2-CD1 4.28Å; V96-I107 HydrophobicContact CG2-CG2 4.04Å; N103-I107 WeakPolarHBondContact O-CB 3.28Å; N103-I107 WeakPolarHBondContact O-CD1 3.39Å; N103-I107 WeakPolarHBondContact O-CG1 3.3Å; N103-I107 PolarHBondContact O-N 2.98Å; V105-I107 VanDerWaalsContact C-N 3.33Å; V105-I107 PolarHBondContact O-N 3.48Å; I107-T111 VanDerWaalsContact O-CB 3.28Å; I107-T111 WeakPolarHBondContact O-CB 3.48Å; I107-T111 PolarHBondContact O-N 3.48Å; I107-T111 PolarHBondContact O-OG1 3.5Å
108	Y	93.3	Very high	92.3	Very high	34 Å²	34	69.9 Å²	69.9	13%	0.133	36%	0.36	C	S	.	.	H	α-helix	trans	-69.4	-36.4	-179.6	-71.2	-44.4	0	0	0	112.7	V96 R104 V105 E106 T111 V112 A191 F194	V96-Y108 HydrophobicContact CG2-CE1 4.09Å; V96-Y108 HydrophobicContact CG2-CE2 4.13Å; R104-Y108 HydrophobicContact CG-CD2 3.97Å; R104-Y108 HydrophobicContact CG-CE2 3.65Å; R104-Y108 WeakPolarHBondContact O-CD2 3.45Å; R104-Y108 PolarHBondContact O-N 2.87Å; V105-Y108 PolarHBondContact O-N 2.96Å; V105-Y108 VanDerWaalsContact O-N 3.09Å; E106-Y108 VanDerWaalsContact C-N 3.34Å; E106-Y108 PolarHBondContact O-N 3.46Å; Y108-T111 WeakPolarHBondContact O-CB 3.29Å; Y108-T111 PolarHBondContact O-N 3.38Å; Y108-V112 WeakPolarHBondContact O-CG2 3.43Å; Y108-V112 PolarHBondContact O-N 2.6Å; Y108-A191 HydrophobicContact CD1-CB 3.53Å; Y108-A191 HydrophobicContact CE1-CB 4.38Å; Y108-A191 HydrophobicContact CG-CB 4.09Å; Y108-F194 HydrophobicContact CD2-CB 4.12Å; Y108-F194 AromaticContact CD2-CD1 3.27Å; Y108-F194 HydrophobicContact CD2-CD1 3.27Å; Y108-F194 HydrophobicContact CD2-CD2 4.48Å; Y108-F194 AromaticContact CD2-CE1 3.75Å; Y108-F194 HydrophobicContact CD2-CE1 3.75Å; Y108-F194 AromaticContact CD2-CG 3.7Å; Y108-F194 HydrophobicContact CD2-CG 3.7Å; Y108-F194 HydrophobicContact CE2-CB 4.19Å; Y108-F194 AromaticContact CE2-CD1 3.71Å; Y108-F194 HydrophobicContact CE2-CD1 3.71Å; Y108-F194 HydrophobicContact CE2-CD2 4.09Å; Y108-F194 HydrophobicContact CE2-CE1 4.09Å; Y108-F194 HydrophobicContact CE2-CE2 4.45Å; Y108-F194 AromaticContact CE2-CG 3.7Å; Y108-F194 HydrophobicContact CE2-CG 3.7Å; Y108-F194 HydrophobicContact CE2-CZ 4.45Å; Y108-F194 HydrophobicContact CG-CD1 4.22Å
109	E	92.7	Very high	92.7	Very high	103 Å²	103	67.4 Å²	67.4	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-61.2	-48.7	175.1	-74.9	177.7	167.1	0	0	110.6	V105 E106 T111 V112 E113 L195	V105-E109 HydrophobicContact CG1-CG 4.4Å; V105-E109 WeakPolarHBondContact O-CG 3.34Å; V105-E109 PolarHBondContact O-N 3.3Å; E106-E109 PolarHBondContact O-N 2.83Å; E109-T111 VanDerWaalsContact C-N 3.33Å; E109-T111 PolarHBondContact O-N 2.82Å; E109-V112 PolarHBondContact O-N 2.82Å; E109-E113 WeakPolarHBondContact O-CB 3.44Å; E109-E113 PolarHBondContact O-N 3.36Å; E109-L195 HydrophobicContact CB-CD1 4.41Å; E109-L195 HydrophobicContact CG-CD1 3.87Å; E109-L195 HydrophobicContact CG-CD2 3.88Å
110	K	94.3	Very high	93.1	Very high	120 Å²	120	65.5 Å²	65.5	52%	0.522	34%	0.336	S	S	.	.	H	α-helix	trans	-67.1	-32.5	175.9	-65.3	-52.2	-175.5	-178.7	0	113.2	E106 E113 V114	E106-K110 WeakPolarHBondContact O-CB 3.37Å; E106-K110 WeakPolarHBondContact O-CG 3.49Å; E106-K110 PolarHBondContact O-N 3.2Å; K110-E113 WeakPolarHBondContact CD-OE2 3.32Å; K110-E113 WeakPolarHBondContact CE-OE2 3.41Å; K110-E113 IonicContact NZ-OE1 3.43Å; K110-E113 PolarHBondContact NZ-OE1 3.03Å; K110-E113 IonicContact NZ-OE2 2.65Å; K110-E113 PolarHBondContact NZ-OE2 2.96Å; K110-E113 PolarHBondContact O-N 3.16Å; K110-V114 WeakPolarHBondContact O-CB 3.48Å; K110-V114 VanDerWaalsContact O-CG2 3.31Å; K110-V114 WeakPolarHBondContact O-CG2 3.45Å; K110-V114 PolarHBondContact O-N 3.44Å
111	T	94.8	Very high	93.5	Very high	7 Å²	7	62.3 Å²	62.3	4%	0.043	32%	0.32	C	S	.	.	H	α-helix	trans	-62.4	-44.6	173.9	-62.1	0	0	0	0	111.1	I93 I107 Y108 E109 L115 A191	I93-T111 HydrophobicContact CD1-CG2 3.95Å; I93-T111 WeakPolarHBondContact CG2-OG1 3.23Å; I107-T111 VanDerWaalsContact O-CB 3.28Å; I107-T111 WeakPolarHBondContact O-CB 3.48Å; I107-T111 PolarHBondContact O-N 3.48Å; I107-T111 PolarHBondContact O-OG1 3.5Å; Y108-T111 WeakPolarHBondContact O-CB 3.29Å; Y108-T111 PolarHBondContact O-N 3.38Å; E109-T111 VanDerWaalsContact C-N 3.33Å; E109-T111 PolarHBondContact O-N 2.82Å; T111-L115 HydrophobicContact CG2-CD1 3.75Å; T111-L115 VanDerWaalsContact O-CB 3.29Å; T111-L115 WeakPolarHBondContact O-CB 3.2Å; T111-L115 WeakPolarHBondContact O-CG 3.35Å; T111-L115 PolarHBondContact O-N 3.35Å; T111-A191 HydrophobicContact CG2-CB 3.73Å
112	V	94.7	Very high	93.8	Very high	13 Å²	13	60.5 Å²	60.5	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-65.9	-47	176.3	169.9	0	0	0	0	110.5	Y108 E109 V114 L115 E116 Y188 A191 A192 L195 K197	Y108-V112 WeakPolarHBondContact O-CG2 3.43Å; Y108-V112 PolarHBondContact O-N 2.6Å; E109-V112 PolarHBondContact O-N 2.82Å; V112-V114 VanDerWaalsContact C-N 3.31Å; V112-V114 PolarHBondContact O-N 3.26Å; V112-L115 PolarHBondContact O-N 3.01Å; V112-E116 WeakPolarHBondContact O-CB 3.16Å; V112-E116 PolarHBondContact O-N 2.93Å; V112-Y188 HydrophobicContact CB-CE2 4.42Å; V112-Y188 HydrophobicContact CG1-CE2 3.98Å; V112-Y188 HydrophobicContact CG2-CD2 4.43Å; V112-Y188 HydrophobicContact CG2-CE2 4.34Å; V112-A191 HydrophobicContact CG2-CB 3.78Å; V112-A192 HydrophobicContact CG2-CB 4.15Å; V112-L195 HydrophobicContact CG2-CD1 4.03Å; V112-K197 HydrophobicContact CG1-CD 4.39Å
113	E	94.9	Very high	94	Very high	116 Å²	116	55.7 Å²	55.7	54%	0.542	28%	0.279	S	S	.	.	H	α-helix	trans	-55.7	-43	179.4	-174.4	-178.8	158.5	0	0	112.7	E109 K110	E109-E113 WeakPolarHBondContact O-CB 3.44Å; E109-E113 PolarHBondContact O-N 3.36Å; K110-E113 WeakPolarHBondContact CD-OE2 3.32Å; K110-E113 WeakPolarHBondContact CE-OE2 3.41Å; K110-E113 IonicContact NZ-OE1 3.43Å; K110-E113 PolarHBondContact NZ-OE1 3.03Å; K110-E113 IonicContact NZ-OE2 2.65Å; K110-E113 PolarHBondContact NZ-OE2 2.96Å; K110-E113 PolarHBondContact O-N 3.16Å
114	V	95.3	Very high	94.2	Very high	81 Å²	81	55.8 Å²	55.8	49%	0.491	28%	0.279	S	S	.	.	H	α-helix	trans	-77	-43.5	-179.4	173.3	0	0	0	0	112.3	K110 V112	K110-V114 WeakPolarHBondContact O-CB 3.48Å; K110-V114 VanDerWaalsContact O-CG2 3.31Å; K110-V114 WeakPolarHBondContact O-CG2 3.45Å; K110-V114 PolarHBondContact O-N 3.44Å; V112-V114 VanDerWaalsContact C-N 3.31Å; V112-V114 PolarHBondContact O-N 3.26Å
115	L	96.4	Very high	94.5	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-89.5	-19.5	-170.8	-69.5	174.9	0	0	0	114.2	C89 I93 T111 V112 E118 V119 D184 A187 Y188	C89-L115 HydrophobicContact CB-CD2 3.53Å; I93-L115 HydrophobicContact CD1-CD1 3.87Å; I93-L115 HydrophobicContact CD1-CG 4.23Å; T111-L115 HydrophobicContact CG2-CD1 3.75Å; T111-L115 VanDerWaalsContact O-CB 3.29Å; T111-L115 WeakPolarHBondContact O-CB 3.2Å; T111-L115 WeakPolarHBondContact O-CG 3.35Å; T111-L115 PolarHBondContact O-N 3.35Å; V112-L115 PolarHBondContact O-N 3.01Å; L115-E118 PolarHBondContact O-N 3.26Å; L115-V119 WeakPolarHBondContact O-CG2 3.29Å; L115-V119 PolarHBondContact O-N 2.74Å; L115-D184 HydrophobicContact CD2-CB 4.03Å; L115-A187 HydrophobicContact CD1-CB 4.09Å; L115-Y188 HydrophobicContact CB-CD2 4.03Å; L115-Y188 HydrophobicContact CB-CG 4.38Å
116	E	94.4	Very high	94.7	Very high	74 Å²	74	50.4 Å²	50.4	35%	0.346	25%	0.253	S	S	.	.	H	α-helix	trans	-57.1	-49.9	-179	178.4	167.3	-160.4	0	0	113.1	V112 E118 V119 T120 Y188 K197	V112-E116 WeakPolarHBondContact O-CB 3.16Å; V112-E116 PolarHBondContact O-N 2.93Å; E116-E118 PolarHBondContact O-N 2.98Å; E116-V119 PolarHBondContact O-N 3.06Å; E116-T120 PolarHBondContact O-N 3Å; E116-T120 PolarHBondContact O-OG1 3.48Å; E116-Y188 HydrophobicContact CB-CE2 3.75Å; E116-Y188 HydrophobicContact CG-CE2 4.33Å; E116-K197 IonicContact OE1-NZ 2.6Å; E116-K197 PolarHBondContact OE1-NZ 3.13Å; E116-K197 IonicContact OE2-NZ 2.69Å; E116-K197 PolarHBondContact OE2-NZ 3.45Å
117	P	95.5	Very high	94.8	Very high	69 Å²	69	48.3 Å²	48.3	45%	0.448	24%	0.241	S	C	.	.	H	α-helix	trans	-61.5	-34.5	178.3	-21.8	34.4	0	0	0	112.7	T120 K121	P117-T120 WeakPolarHBondContact O-CB 3.4Å; P117-T120 PolarHBondContact O-N 3.2Å; P117-K121 PolarHBondContact O-N 3.49Å
118	E	94.9	Very high	95	Very high	49 Å²	49	48.1 Å²	48.1	23%	0.229	24%	0.239	C	C	.	.	H	α-helix	trans	-70.5	-42.2	177.6	-59.2	-52.1	134.1	0	0	111	W86 L115 E116 T120 K121 L122	W86-E118 HydrophobicContact CH2-CB 3.7Å; W86-E118 WeakPolarHBondContact CH2-O 3.33Å; W86-E118 HydrophobicContact CZ2-CB 3.82Å; L115-E118 PolarHBondContact O-N 3.26Å; E116-E118 PolarHBondContact O-N 2.98Å; E118-T120 VanDerWaalsContact C-N 3.26Å; E118-T120 PolarHBondContact O-N 3.43Å; E118-K121 WeakPolarHBondContact O-CB 3.47Å; E118-K121 PolarHBondContact O-N 3.22Å; E118-K121 IonicContact OE1-NZ 2.76Å; E118-K121 PolarHBondContact OE1-NZ 3.29Å; E118-K121 WeakPolarHBondContact OE2-CD 3.06Å; E118-K121 WeakPolarHBondContact OE2-CE 3.39Å; E118-K121 IonicContact OE2-NZ 2.74Å; E118-K121 PolarHBondContact OE2-NZ 2.95Å; E118-L122 PolarHBondContact O-N 3.29Å
119	V	94.9	Very high	95.1	Very high	9 Å²	9	47.2 Å²	47.2	6%	0.055	24%	0.236	C	C	.	.	H	α-helix	trans	-62.2	-33.8	174.9	170.8	0	0	0	0	111.7	L115 E116 K121 L122 M123 Y188 L210	L115-V119 WeakPolarHBondContact O-CG2 3.29Å; L115-V119 PolarHBondContact O-N 2.74Å; E116-V119 PolarHBondContact O-N 3.06Å; V119-K121 VanDerWaalsContact C-N 3.31Å; V119-K121 PolarHBondContact O-N 3.25Å; V119-L122 WeakPolarHBondContact O-CB 3.36Å; V119-L122 PolarHBondContact O-N 3.42Å; V119-L122 VanDerWaalsContact O-N 3.16Å; V119-M123 PolarHBondContact O-N 3.09Å; V119-Y188 HydrophobicContact CB-CD1 4.28Å; V119-Y188 HydrophobicContact CB-CE1 4.46Å; V119-Y188 HydrophobicContact CG1-CD1 4.1Å; V119-Y188 HydrophobicContact CG1-CE1 4.08Å; V119-Y188 HydrophobicContact CG2-CD1 3.77Å; V119-Y188 HydrophobicContact CG2-CD2 4.4Å; V119-Y188 HydrophobicContact CG2-CE1 4.42Å; V119-Y188 HydrophobicContact CG2-CG 3.75Å; V119-L210 HydrophobicContact CG1-CD2 4.1Å
120	T	94.9	Very high	95.2	Very high	73 Å²	73	47.8 Å²	47.8	45%	0.448	23%	0.234	S	C	.	.	H	α-helix	trans	-59.2	-41	171.8	-55	0	0	0	0	112	E116 P117 E118 L122 M123 N124	E116-T120 PolarHBondContact O-N 3Å; E116-T120 PolarHBondContact O-OG1 3.48Å; P117-T120 WeakPolarHBondContact O-CB 3.4Å; P117-T120 PolarHBondContact O-N 3.2Å; E118-T120 VanDerWaalsContact C-N 3.26Å; E118-T120 PolarHBondContact O-N 3.43Å; T120-L122 VanDerWaalsContact C-N 3.3Å; T120-L122 PolarHBondContact O-N 2.68Å; T120-M123 WeakPolarHBondContact O-CB 3.39Å; T120-M123 PolarHBondContact O-N 3.14Å; T120-N124 PolarHBondContact O-N 3.26Å
121	K	95.8	Very high	95.2	Very high	87 Å²	87	45.9 Å²	45.9	38%	0.378	23%	0.23	S	C	.	.	H	α-helix	trans	-62.5	-38.5	175.5	-57.7	175.2	-168.6	162.1	0	111.7	M82 P117 E118 V119 N124 F125	M82-K121 HydrophobicContact SD-CB 3.65Å; M82-K121 HydrophobicContact SD-CD 4.45Å; P117-K121 PolarHBondContact O-N 3.49Å; E118-K121 WeakPolarHBondContact O-CB 3.47Å; E118-K121 PolarHBondContact O-N 3.22Å; E118-K121 IonicContact OE1-NZ 2.76Å; E118-K121 PolarHBondContact OE1-NZ 3.29Å; E118-K121 WeakPolarHBondContact OE2-CD 3.06Å; E118-K121 WeakPolarHBondContact OE2-CE 3.39Å; E118-K121 IonicContact OE2-NZ 2.74Å; E118-K121 PolarHBondContact OE2-NZ 2.95Å; V119-K121 VanDerWaalsContact C-N 3.31Å; V119-K121 PolarHBondContact O-N 3.25Å; K121-N124 PolarHBondContact O-N 3.47Å; K121-F125 WeakPolarHBondContact O-CB 3.21Å; K121-F125 PolarHBondContact O-N 2.97Å
122	L	95	Very high	95.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.4	-35.8	175.8	-60.6	178.9	0	0	0	113	M82 W86 E118 V119 T120 F125 M126 V181 H185 L210 L214	M82-L122 HydrophobicContact CE-CD2 4.18Å; W86-L122 HydrophobicContact CE3-CD2 4.16Å; W86-L122 HydrophobicContact CH2-CD1 3.83Å; W86-L122 HydrophobicContact CH2-CD2 3.61Å; W86-L122 HydrophobicContact CH2-CG 3.52Å; W86-L122 HydrophobicContact CZ2-CD1 4.1Å; W86-L122 HydrophobicContact CZ2-CD2 4.37Å; W86-L122 HydrophobicContact CZ2-CG 4.28Å; W86-L122 HydrophobicContact CZ3-CD2 3.48Å; W86-L122 VanDerWaalsContact CZ3-CD2 3.48Å; W86-L122 HydrophobicContact CZ3-CG 3.9Å; E118-L122 PolarHBondContact O-N 3.29Å; V119-L122 WeakPolarHBondContact O-CB 3.36Å; V119-L122 PolarHBondContact O-N 3.42Å; V119-L122 VanDerWaalsContact O-N 3.16Å; T120-L122 VanDerWaalsContact C-N 3.3Å; T120-L122 PolarHBondContact O-N 2.68Å; L122-F125 PolarHBondContact O-N 3.45Å; L122-M126 WeakPolarHBondContact O-CB 3.37Å; L122-M126 PolarHBondContact O-N 3.28Å; L122-V181 HydrophobicContact CD1-CG1 3.75Å; L122-V181 HydrophobicContact CD2-CG1 3.44Å; L122-V181 VanDerWaalsContact CD2-CG1 3.44Å; L122-V181 HydrophobicContact CG-CG1 4.24Å; L122-H185 HydrophobicContact CD1-CB 4.19Å; L122-L210 HydrophobicContact CB-CD1 4.16Å; L122-L210 HydrophobicContact CB-CD2 4.01Å; L122-L214 HydrophobicContact CD1-CD1 4.3Å
123	M	93.1	Very high	95.3	Very high	23 Å²	23	45 Å²	45	11%	0.113	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-48.8	171.7	-71.8	-63.2	-175	0	0	110.7	V119 T120 F125 M126 Y127 E206 L210	V119-M123 PolarHBondContact O-N 3.09Å; T120-M123 WeakPolarHBondContact O-CB 3.39Å; T120-M123 PolarHBondContact O-N 3.14Å; M123-F125 VanDerWaalsContact C-N 3.31Å; M123-F125 PolarHBondContact O-N 3.45Å; M123-M126 WeakPolarHBondContact O-CB 3.2Å; M123-M126 PolarHBondContact O-N 3.45Å; M123-M126 VanDerWaalsContact O-N 3.13Å; M123-M126 HydrophobicContact SD-CE 3.91Å; M123-Y127 HydrophobicContact CB-CE2 4.23Å; M123-Y127 VanDerWaalsContact O-CD2 3.23Å; M123-Y127 WeakPolarHBondContact O-CD2 3.39Å; M123-Y127 PolarHBondContact O-N 3.17Å; M123-E206 HydrophobicContact CE-CB 4.15Å; M123-E206 HydrophobicContact SD-CB 4.44Å; M123-L210 HydrophobicContact CE-CB 3.71Å; M123-L210 HydrophobicContact CE-CD2 3.56Å; M123-L210 HydrophobicContact CE-CG 4.25Å; M123-L210 HydrophobicContact CG-CD2 4.08Å; M123-L210 HydrophobicContact SD-CB 3.76Å; M123-L210 HydrophobicContact SD-CD1 4.5Å; M123-L210 HydrophobicContact SD-CD2 3.67Å; M123-L210 HydrophobicContact SD-CG 4.17Å
124	N	95.5	Very high	95.3	Very high	74 Å²	74	44.1 Å²	44.1	40%	0.396	22%	0.22	S	C	.	.	H	α-helix	trans	-60.8	-41	178.1	-66.1	-13.4	0	0	0	111.4	Y79 T120 K121 M126 Y127 F128	Y79-N124 HydrophobicContact CE1-CB 4.32Å; Y79-N124 WeakPolarHBondContact OH-CB 3.45Å; T120-N124 PolarHBondContact O-N 3.26Å; K121-N124 PolarHBondContact O-N 3.47Å; N124-M126 PolarHBondContact O-N 3.43Å; N124-Y127 PolarHBondContact O-N 3.24Å; N124-F128 VanDerWaalsContact O-CB 3.29Å; N124-F128 WeakPolarHBondContact O-CB 3.31Å; N124-F128 PolarHBondContact O-N 3.06Å
125	F	97.3	Very high	95.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.2	-45.7	172.9	171.6	-123.8	0	0	0	112.7	Y79 M82 L83 K121 L122 M123 Y127 F128 Q129 L171 K175 F213 I220	Y79-F125 HydrophobicContact CD1-CB 3.66Å; Y79-F125 AromaticContact CD1-CD2 3.97Å; Y79-F125 HydrophobicContact CD1-CD2 3.97Å; Y79-F125 HydrophobicContact CD1-CG 4.22Å; Y79-F125 HydrophobicContact CE1-CB 3.8Å; Y79-F125 HydrophobicContact CG-CB 4.43Å; Y79-F125 AromaticContact CG-CD2 3.92Å; Y79-F125 HydrophobicContact CG-CD2 3.92Å; M82-F125 HydrophobicContact CE-CB 4.11Å; M82-F125 HydrophobicContact CE-CG 4.31Å; L83-F125 HydrophobicContact CD1-CE1 4.06Å; L83-F125 HydrophobicContact CD1-CE2 4.08Å; L83-F125 HydrophobicContact CD1-CZ 3.7Å; L83-F125 HydrophobicContact CD2-CD1 4.46Å; L83-F125 HydrophobicContact CD2-CE1 4.22Å; K121-F125 WeakPolarHBondContact O-CB 3.21Å; K121-F125 PolarHBondContact O-N 2.97Å; L122-F125 PolarHBondContact O-N 3.45Å; M123-F125 VanDerWaalsContact C-N 3.31Å; M123-F125 PolarHBondContact O-N 3.45Å; F125-Y127 VanDerWaalsContact C-N 3.28Å; F125-Y127 PolarHBondContact O-N 3.19Å; F125-F128 PolarHBondContact O-N 2.92Å; F125-Q129 HydrophobicContact CE2-CB 4.5Å; F125-Q129 WeakPolarHBondContact O-CG 3.41Å; F125-Q129 PolarHBondContact O-N 3.36Å; F125-L171 HydrophobicContact CE2-CB 4.3Å; F125-L171 HydrophobicContact CE2-CD1 4.28Å; 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 4.33Å; F125-F213 AromaticContact CD1-CE1 3.79Å; F125-F213 HydrophobicContact CD1-CE1 3.79Å; F125-F213 HydrophobicContact CD1-CZ 4.21Å; F125-F213 AromaticContact CE1-CE1 3.54Å; F125-F213 HydrophobicContact CE1-CE1 3.54Å; F125-F213 AromaticContact CE1-CZ 3.63Å; F125-F213 HydrophobicContact CE1-CZ 3.63Å; F125-F213 HydrophobicContact CZ-CE1 4.45Å; F125-F213 HydrophobicContact CZ-CZ 4.12Å; F125-I220 HydrophobicContact CE2-CD1 4.49Å; F125-I220 HydrophobicContact CZ-CD1 3.9Å
126	M	95.9	Very high	95.2	Very high	10 Å²	10	44.7 Å²	44.7	5%	0.049	21%	0.213	C	C	.	.	H	α-helix	trans	-60.1	-39.4	176.7	179.6	-174.3	66.9	0	0	111.5	L122 M123 N124 Q129 R130 N209 L210 F213	L122-M126 WeakPolarHBondContact O-CB 3.37Å; L122-M126 PolarHBondContact O-N 3.28Å; M123-M126 WeakPolarHBondContact O-CB 3.2Å; M123-M126 PolarHBondContact O-N 3.45Å; M123-M126 VanDerWaalsContact O-N 3.13Å; M123-M126 HydrophobicContact SD-CE 3.91Å; N124-M126 PolarHBondContact O-N 3.43Å; M126-Q129 WeakPolarHBondContact O-CG 3.36Å; M126-Q129 PolarHBondContact O-NE2 2.88Å; M126-R130 PolarHBondContact O-N 3.32Å; M126-N209 HydrophobicContact CE-CB 4.21Å; M126-N209 HydrophobicContact SD-CB 4.1Å; M126-L210 HydrophobicContact CB-CD1 4.13Å; M126-L210 HydrophobicContact CE-CB 4.45Å; M126-L210 VanDerWaalsContact SD-CA 3.59Å; M126-L210 HydrophobicContact SD-CB 4.13Å; M126-L210 HydrophobicContact SD-CD1 4.19Å; M126-F213 HydrophobicContact CB-CD1 4.11Å; M126-F213 HydrophobicContact CB-CE1 4.32Å; M126-F213 HydrophobicContact CG-CB 4.25Å; M126-F213 HydrophobicContact CG-CD1 4.12Å; M126-F213 HydrophobicContact CG-CG 4.05Å; M126-F213 HydrophobicContact SD-CB 4.06Å; M126-F213 HydrophobicContact SD-CG 4.49Å
127	Y	94.5	Very high	95.2	Very high	59 Å²	59	41.4 Å²	41.4	23%	0.231	20%	0.199	C	C	.	.	H	α-helix	trans	-71.6	-43.4	176.5	-63.6	-37.4	0	0	0	112.8	M123 N124 F125 R130 N131 E206	M123-Y127 HydrophobicContact CB-CE2 4.23Å; M123-Y127 VanDerWaalsContact O-CD2 3.23Å; M123-Y127 WeakPolarHBondContact O-CD2 3.39Å; M123-Y127 PolarHBondContact O-N 3.17Å; N124-Y127 PolarHBondContact O-N 3.24Å; F125-Y127 VanDerWaalsContact C-N 3.28Å; F125-Y127 PolarHBondContact O-N 3.19Å; Y127-R130 PolarHBondContact O-N 3.12Å; Y127-N131 WeakPolarHBondContact O-CB 3.31Å; Y127-N131 PolarHBondContact O-N 2.92Å; Y127-E206 WeakPolarHBondContact OH-CG 3.44Å; Y127-E206 PolarHBondContact OH-OE1 3.02Å; Y127-E206 PolarHBondContact OH-OE2 3.29Å
128	F	97.3	Very high	95.1	Very high	9 Å²	9	39.9 Å²	39.9	4%	0.039	20%	0.195	C	C	.	.	H	α-helix	trans	-55.6	-56.6	177.2	169	-97.7	0	0	0	110.9	M72 E75 Y79 N124 F125 R130 N131 A132 M167 L171	M72-F128 HydrophobicContact CG-CE2 3.82Å; M72-F128 HydrophobicContact CG-CZ 4.15Å; M72-F128 WeakPolarHBondContact O-CZ 3.38Å; E75-F128 HydrophobicContact CB-CE2 3.87Å; E75-F128 HydrophobicContact CG-CD2 3.88Å; E75-F128 HydrophobicContact CG-CE2 3.75Å; E75-F128 WeakPolarHBondContact OE1-CD2 3.48Å; Y79-F128 HydrophobicContact CD2-CB 4.08Å; Y79-F128 AromaticContact CD2-CD1 3.59Å; Y79-F128 HydrophobicContact CD2-CD1 3.59Å; Y79-F128 HydrophobicContact CD2-CD2 4.13Å; Y79-F128 HydrophobicContact CD2-CE1 4.07Å; Y79-F128 AromaticContact CD2-CG 3.64Å; Y79-F128 HydrophobicContact CD2-CG 3.64Å; Y79-F128 HydrophobicContact CE2-CB 3.52Å; Y79-F128 AromaticContact CE2-CD1 3.91Å; Y79-F128 HydrophobicContact CE2-CD1 3.91Å; Y79-F128 AromaticContact CE2-CD2 3.77Å; Y79-F128 HydrophobicContact CE2-CD2 3.77Å; Y79-F128 HydrophobicContact CE2-CE2 4.5Å; Y79-F128 AromaticContact CE2-CG 3.42Å; Y79-F128 HydrophobicContact CE2-CG 3.42Å; Y79-F128 VanDerWaalsContact CE2-CG 3.42Å; Y79-F128 HydrophobicContact CG-CD1 4.43Å; N124-F128 VanDerWaalsContact O-CB 3.29Å; N124-F128 WeakPolarHBondContact O-CB 3.31Å; N124-F128 PolarHBondContact O-N 3.06Å; F125-F128 PolarHBondContact O-N 2.92Å; F128-R130 PolarHBondContact O-N 3.2Å; F128-N131 PolarHBondContact O-N 2.83Å; F128-N131 VanDerWaalsContact O-N 3.16Å; F128-A132 HydrophobicContact CE1-CB 4.34Å; F128-A132 HydrophobicContact CZ-CB 4.22Å; F128-A132 VanDerWaalsContact O-CB 3.31Å; F128-A132 WeakPolarHBondContact O-CB 3.47Å; F128-A132 PolarHBondContact O-N 2.89Å; F128-M167 HydrophobicContact CE1-CE 4.34Å; F128-M167 HydrophobicContact CE1-SD 4.43Å; F128-M167 HydrophobicContact CZ-CE 4.19Å; F128-M167 HydrophobicContact CZ-SD 4.13Å; F128-L171 HydrophobicContact CE1-CD1 3.91Å
129	Q	95.1	Very high	95	Very high	14 Å²	14	39 Å²	39	7%	0.065	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-34.8	-176.6	65.9	75.1	32.1	0	0	111.9	F125 M126 A132 I133 F213 I220	F125-Q129 HydrophobicContact CE2-CB 4.5Å; F125-Q129 WeakPolarHBondContact O-CG 3.41Å; F125-Q129 PolarHBondContact O-N 3.36Å; M126-Q129 WeakPolarHBondContact O-CG 3.36Å; M126-Q129 PolarHBondContact O-NE2 2.88Å; Q129-A132 PolarHBondContact O-N 3.42Å; Q129-I133 VanDerWaalsContact O-CG1 3.23Å; Q129-I133 WeakPolarHBondContact O-CG1 3.41Å; Q129-I133 PolarHBondContact O-N 3.16Å; Q129-F213 HydrophobicContact CG-CE2 3.98Å; Q129-F213 HydrophobicContact CG-CZ 3.89Å; Q129-I220 HydrophobicContact CB-CD1 4.21Å; Q129-I220 HydrophobicContact CB-CG1 4.49Å; Q129-I220 HydrophobicContact CG-CD1 4.36Å; Q129-I220 HydrophobicContact CG-CG1 4.37Å
130	R	93.8	Very high	95	Very high	115 Å²	115	38.6 Å²	38.6	43%	0.434	19%	0.188	S	C	.	.	H	α-helix	trans	-65.3	-50.2	177.9	-178.9	175.1	64.5	-170.7	1.3	110.5	M126 Y127 F128 A132 I133 E134	M126-R130 PolarHBondContact O-N 3.32Å; Y127-R130 PolarHBondContact O-N 3.12Å; F128-R130 PolarHBondContact O-N 3.2Å; R130-A132 VanDerWaalsContact C-N 3.34Å; R130-I133 PolarHBondContact O-N 2.76Å; R130-E134 WeakPolarHBondContact CG-OE1 3.38Å; R130-E134 WeakPolarHBondContact O-CG 3.44Å; R130-E134 PolarHBondContact O-N 3.35Å
131	N	95.6	Very high	94.9	Very high	80 Å²	80	42.3 Å²	42.3	43%	0.428	19%	0.194	S	C	.	.	H	α-helix	trans	-63.3	-40.6	177.5	-175.5	38.6	0	0	0	111.8	Y127 F128 E134 R135	Y127-N131 WeakPolarHBondContact O-CB 3.31Å; Y127-N131 PolarHBondContact O-N 2.92Å; F128-N131 PolarHBondContact O-N 2.83Å; F128-N131 VanDerWaalsContact O-N 3.16Å; N131-E134 PolarHBondContact O-N 3.49Å; N131-R135 WeakPolarHBondContact O-CB 3.25Å; N131-R135 PolarHBondContact O-N 2.74Å
132	A	95.4	Very high	94.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.1	-43.2	178.8	0	0	0	0	0	112	M72 F128 Q129 R130 F136 M167 F168	M72-A132 HydrophobicContact CG-CB 4.41Å; M72-A132 HydrophobicContact SD-CB 3.88Å; F128-A132 HydrophobicContact CE1-CB 4.34Å; F128-A132 HydrophobicContact CZ-CB 4.22Å; F128-A132 VanDerWaalsContact O-CB 3.31Å; F128-A132 WeakPolarHBondContact O-CB 3.47Å; F128-A132 PolarHBondContact O-N 2.89Å; Q129-A132 PolarHBondContact O-N 3.42Å; R130-A132 VanDerWaalsContact C-N 3.34Å; A132-F136 VanDerWaalsContact O-CB 3.25Å; A132-F136 WeakPolarHBondContact O-CB 3.49Å; A132-F136 PolarHBondContact O-N 2.76Å; A132-M167 HydrophobicContact CB-CE 4.17Å; A132-F168 HydrophobicContact CB-CE1 3.87Å; A132-F168 HydrophobicContact CB-CZ 4.2Å
133	I	96.3	Very high	94.4	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-49.6	173.8	-67.9	168.4	0	0	0	110.2	Q129 R130 R135 F136 C137 F168 I220 L224 Q227	Q129-I133 VanDerWaalsContact O-CG1 3.23Å; Q129-I133 WeakPolarHBondContact O-CG1 3.41Å; Q129-I133 PolarHBondContact O-N 3.16Å; R130-I133 PolarHBondContact O-N 2.76Å; I133-R135 VanDerWaalsContact C-N 3.31Å; I133-R135 PolarHBondContact O-N 2.95Å; I133-F136 PolarHBondContact O-N 2.79Å; I133-C137 WeakPolarHBondContact O-CB 3.46Å; I133-C137 PolarHBondContact O-N 2.91Å; I133-C137 PolarHBondContact O-SG 3.04Å; I133-C137 VanDerWaalsContact O-SG 3.4Å; I133-F168 HydrophobicContact CG1-CD1 4.11Å; I133-F168 HydrophobicContact CG1-CE1 3.68Å; I133-F168 HydrophobicContact CG1-CZ 4.01Å; I133-I220 HydrophobicContact CD1-CG2 4.03Å; I133-L224 HydrophobicContact CG2-CD1 4.19Å; I133-Q227 HydrophobicContact CG2-CB 4.43Å; I133-Q227 HydrophobicContact CG2-CG 4.45Å
134	E	94.1	Very high	94.2	Very high	98 Å²	98	42.5 Å²	42.5	46%	0.458	19%	0.193	S	C	.	.	H	α-helix	trans	-59	-43.3	-179.9	-74.9	171.5	-165.6	0	0	111.6	R130 N131 G138	R130-E134 WeakPolarHBondContact CG-OE1 3.38Å; R130-E134 WeakPolarHBondContact O-CG 3.44Å; R130-E134 PolarHBondContact O-N 3.35Å; N131-E134 PolarHBondContact O-N 3.49Å; E134-G138 PolarHBondContact O-N 3.37Å
135	R	94.4	Very high	94	Very high	95 Å²	95	44.4 Å²	44.4	36%	0.358	20%	0.199	S	C	.	.	H	α-helix	trans	-67.1	-45.2	178.6	-172.5	141.4	-175.8	-149.4	-2.3	112.1	S68 M69 M72 N131 I133 G138 E139	S68-R135 PolarHBondContact OG-NH2 3.47Å; M69-R135 HydrophobicContact SD-CG 4.06Å; M72-R135 HydrophobicContact SD-CB 4.39Å; M72-R135 HydrophobicContact SD-CG 4.5Å; N131-R135 WeakPolarHBondContact O-CB 3.25Å; N131-R135 PolarHBondContact O-N 2.74Å; I133-R135 VanDerWaalsContact C-N 3.31Å; I133-R135 PolarHBondContact O-N 2.95Å; R135-G138 PolarHBondContact O-N 3.24Å; R135-E139 PolarHBondContact O-N 2.93Å
136	F	95.9	Very high	93.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.3	-51.4	175.2	175.9	-99.2	0	0	0	111.5	A132 I133 G138 E139 V140 L161 F164 I165 F168 L224 L228	A132-F136 VanDerWaalsContact O-CB 3.25Å; A132-F136 WeakPolarHBondContact O-CB 3.49Å; A132-F136 PolarHBondContact O-N 2.76Å; I133-F136 PolarHBondContact O-N 2.79Å; F136-G138 VanDerWaalsContact C-N 3.28Å; F136-G138 PolarHBondContact O-N 3.38Å; F136-E139 PolarHBondContact O-N 3Å; F136-E139 VanDerWaalsContact O-N 3.08Å; F136-V140 HydrophobicContact CD1-CG2 4.12Å; F136-V140 HydrophobicContact CE1-CG2 3.72Å; F136-V140 HydrophobicContact CE2-CG2 4.36Å; F136-V140 HydrophobicContact CZ-CG2 3.85Å; F136-V140 WeakPolarHBondContact O-CG2 3.49Å; F136-V140 PolarHBondContact O-N 2.72Å; F136-L161 HydrophobicContact CD2-CD2 3.98Å; F136-L161 HydrophobicContact CE2-CB 4.08Å; F136-L161 HydrophobicContact CE2-CD2 3.84Å; F136-F164 HydrophobicContact CB-CD1 4.25Å; F136-F164 HydrophobicContact CD2-CB 3.63Å; F136-F164 HydrophobicContact CD2-CD1 4.1Å; F136-F164 AromaticContact CD2-CG 3.97Å; F136-F164 HydrophobicContact CD2-CG 3.97Å; F136-F164 HydrophobicContact CE2-CB 3.82Å; F136-I165 HydrophobicContact CE1-CG2 3.95Å; F136-I165 HydrophobicContact CE2-CG2 4.14Å; F136-I165 HydrophobicContact CZ-CG2 3.46Å; F136-I165 VanDerWaalsContact CZ-CG2 3.46Å; F136-F168 HydrophobicContact CB-CE2 4.06Å; F136-F168 HydrophobicContact CB-CZ 4.09Å; F136-F168 HydrophobicContact CD1-CE2 4.05Å; F136-F168 AromaticContact CG-CE2 3.95Å; F136-F168 HydrophobicContact CG-CE2 3.95Å; F136-F168 HydrophobicContact CG-CZ 4.48Å; F136-L224 HydrophobicContact CD1-CD1 3.84Å; F136-L224 HydrophobicContact CE1-CD1 4.1Å; F136-L228 HydrophobicContact CE1-CD1 4.49Å; F136-L228 HydrophobicContact CE1-CD2 4.12Å
137	C	94.6	Very high	92.2	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.034	26%	0.261	C	S	.	.	H	α-helix	trans	-63.8	-33.4	178.2	-70.6	0	0	0	0	112.2	I133 E139 V140 R141 Q227 I231	I133-C137 WeakPolarHBondContact O-CB 3.46Å; I133-C137 PolarHBondContact O-N 2.91Å; I133-C137 PolarHBondContact O-SG 3.04Å; I133-C137 VanDerWaalsContact O-SG 3.4Å; C137-E139 VanDerWaalsContact C-N 3.34Å; C137-V140 PolarHBondContact O-N 3.19Å; C137-R141 WeakPolarHBondContact O-CB 3.45Å; C137-R141 PolarHBondContact O-N 3.33Å; C137-Q227 HydrophobicContact CB-CB 4.23Å; C137-I231 HydrophobicContact CB-CD1 4.21Å; C137-I231 VanDerWaalsContact O-CD1 3.29Å; C137-I231 WeakPolarHBondContact O-CD1 3.13Å
138	G	93.4	Very high	91.5	Very high	36 Å²	36	54.2 Å²	54.2	37%	0.371	26%	0.258	S	S	.	.	H	α-helix	trans	-59.5	-43.5	170.9	0	0	0	0	0	112.3	E134 R135 F136 R141 R142	E134-G138 PolarHBondContact O-N 3.37Å; R135-G138 PolarHBondContact O-N 3.24Å; F136-G138 VanDerWaalsContact C-N 3.28Å; F136-G138 PolarHBondContact O-N 3.38Å; G138-R141 WeakPolarHBondContact O-CB 3.48Å; G138-R141 PolarHBondContact O-N 3.08Å; G138-R142 PolarHBondContact O-N 3.4Å
139	E	92.9	Very high	90.5	Very high	31 Å²	31	58.3 Å²	58.3	15%	0.145	27%	0.273	C	S	.	.	H	α-helix	trans	-69.5	-40.7	175	-81.3	-56.2	151.9	0	0	113.3	R135 F136 C137 R141 R142 L143	R135-E139 PolarHBondContact O-N 2.93Å; F136-E139 PolarHBondContact O-N 3Å; F136-E139 VanDerWaalsContact O-N 3.08Å; C137-E139 VanDerWaalsContact C-N 3.34Å; E139-R141 VanDerWaalsContact C-N 3.29Å; E139-R141 PolarHBondContact O-N 3.36Å; E139-R142 PolarHBondContact O-N 3.4Å; E139-R142 IonicContact OE1-NE 3.18Å; E139-R142 PolarHBondContact OE1-NE 2.95Å; E139-R142 IonicContact OE1-NH2 3.69Å; E139-R142 IonicContact OE2-CZ 3.28Å; E139-R142 IonicContact OE2-NE 3.98Å; E139-R142 PolarHBondContact OE2-NE 2.98Å; E139-R142 IonicContact OE2-NH2 3.22Å; E139-R142 PolarHBondContact OE2-NH2 3.3Å; E139-L143 WeakPolarHBondContact O-CG 3.44Å; E139-L143 PolarHBondContact O-N 2.64Å
140	V	94.1	Very high	89.7	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.4	-46	172	174.7	0	0	0	0	110.2	F136 C137 R142 L143 C144 L228 I231 L237	F136-V140 HydrophobicContact CD1-CG2 4.12Å; F136-V140 HydrophobicContact CE1-CG2 3.72Å; F136-V140 HydrophobicContact CE2-CG2 4.36Å; F136-V140 HydrophobicContact CZ-CG2 3.85Å; F136-V140 WeakPolarHBondContact O-CG2 3.49Å; F136-V140 PolarHBondContact O-N 2.72Å; C137-V140 PolarHBondContact O-N 3.19Å; V140-R142 VanDerWaalsContact C-N 3.33Å; V140-R142 PolarHBondContact O-N 3.48Å; V140-L143 PolarHBondContact O-N 3.15Å; V140-C144 VanDerWaalsContact O-CB 3.22Å; V140-C144 WeakPolarHBondContact O-CB 3.16Å; V140-C144 PolarHBondContact O-N 3.23Å; V140-C144 PolarHBondContact O-SG 2.98Å; V140-C144 VanDerWaalsContact O-SG 3.32Å; V140-L228 HydrophobicContact CB-CD2 4.24Å; V140-L228 HydrophobicContact CG1-CD2 3.99Å; V140-L228 HydrophobicContact CG2-CD2 4.04Å; V140-I231 HydrophobicContact CB-CD1 4.34Å; V140-I231 HydrophobicContact CG1-CD1 4.22Å; V140-L237 HydrophobicContact CB-CD2 4.16Å; V140-L237 HydrophobicContact CG1-CD2 4.03Å; V140-L237 HydrophobicContact CG2-CD2 3.97Å
141	R	92.6	Very high	89	Confident	151 Å²	151	60.3 Å²	60.3	57%	0.57	29%	0.288	S	S	*	.	H	α-helix	trans	-59.5	-43.5	177.1	-174	-179.6	-63.5	-155.4	-0.7	111.9	C137 G138 E139 H145 I231	C137-R141 WeakPolarHBondContact O-CB 3.45Å; C137-R141 PolarHBondContact O-N 3.33Å; G138-R141 WeakPolarHBondContact O-CB 3.48Å; G138-R141 PolarHBondContact O-N 3.08Å; E139-R141 VanDerWaalsContact C-N 3.29Å; E139-R141 PolarHBondContact O-N 3.36Å; R141-H145 PolarHBondContact O-N 3.4Å; R141-I231 HydrophobicContact CB-CD1 3.95Å; R141-I231 HydrophobicContact CB-CG1 4.28Å; R141-I231 HydrophobicContact CB-CG2 4.3Å; R141-I231 HydrophobicContact CG-CG2 4.5Å
142	R	90.6	Very high	88.3	Confident	100 Å²	100	57.7 Å²	57.7	38%	0.377	27%	0.272	S	S	.	.	H	α-helix	trans	-63.1	-44.5	178.7	-169.7	-175.6	66.3	94.1	1.9	111.6	G138 E139 V140 R148	G138-R142 PolarHBondContact O-N 3.4Å; E139-R142 PolarHBondContact O-N 3.4Å; E139-R142 IonicContact OE1-NE 3.18Å; E139-R142 PolarHBondContact OE1-NE 2.95Å; E139-R142 IonicContact OE1-NH2 3.69Å; E139-R142 IonicContact OE2-CZ 3.28Å; E139-R142 IonicContact OE2-NE 3.98Å; E139-R142 PolarHBondContact OE2-NE 2.98Å; E139-R142 IonicContact OE2-NH2 3.22Å; E139-R142 PolarHBondContact OE2-NH2 3.3Å; V140-R142 VanDerWaalsContact C-N 3.33Å; V140-R142 PolarHBondContact O-N 3.48Å; R142-R148 WeakPolarHBondContact O-CG 3.37Å
143	L	89.8	Confident	87.9	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-75.4	-28.5	-178.8	-65.7	178.4	0	0	0	113.4	E139 V140 R148 R149 V153 Y157 L161 L237	E139-L143 WeakPolarHBondContact O-CG 3.44Å; E139-L143 PolarHBondContact O-N 2.64Å; V140-L143 PolarHBondContact O-N 3.15Å; L143-R148 CarbonylContact O-C 3.58Å; L143-R149 PolarHBondContact O-N 3.38Å; L143-V153 HydrophobicContact CD2-CG2 4.05Å; L143-Y157 HydrophobicContact CD1-CE1 4.04Å; L143-L161 HydrophobicContact CD1-CD1 3.88Å; L143-L237 HydrophobicContact CB-CD1 4.44Å; L143-L237 HydrophobicContact CB-CD2 4.07Å; L143-L237 HydrophobicContact CD1-CD1 4.12Å; L143-L237 HydrophobicContact CD1-CD2 3.96Å
144	C	90	Very high	87.6	Confident	7 Å²	7	59.1 Å²	59.1	5%	0.047	28%	0.281	C	S	.	.	H	α-helix	trans	-83.2	-5.9	179.6	-73.3	0	0	0	0	114.6	V140 R149 I231 G233	V140-C144 VanDerWaalsContact O-CB 3.22Å; V140-C144 WeakPolarHBondContact O-CB 3.16Å; V140-C144 PolarHBondContact O-N 3.23Å; V140-C144 PolarHBondContact O-SG 2.98Å; V140-C144 VanDerWaalsContact O-SG 3.32Å; C144-R149 PolarHBondContact O-NE 3.41Å; C144-R149 PolarHBondContact O-NH2 3.36Å; C144-I231 HydrophobicContact CB-CG2 4.23Å; C144-G233 PolarHBondContact SG-O 3.4Å
145	H	89.7	Confident	87.4	Confident	113 Å²	113	56.9 Å²	56.9	52%	0.523	27%	0.27	S	S	.	.	S	Bend	trans	-52.3	141.6	176.1	-177	-98	0	0	0	111.5	R141 E147 R148 R149	R141-H145 PolarHBondContact O-N 3.4Å; H145-E147 PolarHBondContact ND1-N 2.86Å; H145-E147 PolarHBondContact O-N 2.84Å; H145-R148 HydrophobicContact CB-CB 4.01Å; H145-R148 CarbonylContact O-C 3.58Å; H145-R148 PolarHBondContact O-N 3.41Å; H145-R149 WeakPolarHBondContact O-CB 3.49Å; H145-R149 PolarHBondContact O-N 2.9Å
146	A	79	Confident	87.1	Confident	78 Å²	78	54.1 Å²	54.1	65%	0.645	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-34.3	-168.5	0	0	0	0	0	114.5
147	E	76.4	Confident	86.9	Confident	150 Å²	150	54.3 Å²	54.3	70%	0.701	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-36.4	176.7	-161.2	164.9	-161.9	0	0	112.3	H145 K150	H145-E147 PolarHBondContact ND1-N 2.86Å; H145-E147 PolarHBondContact O-N 2.84Å; E147-K150 PolarHBondContact O-N 2.79Å
148	R	80.1	Confident	86.8	Confident	48 Å²	48	54.8 Å²	54.8	18%	0.181	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-76	-27.1	-178.9	-169.4	61.6	-175.4	-172.5	-6.7	113.2	R58 R142 L143 H145 K150 D151	R58-R148 VanDerWaalsContact CZ-NH1 3.34Å; R142-R148 WeakPolarHBondContact O-CG 3.37Å; L143-R148 CarbonylContact O-C 3.58Å; H145-R148 HydrophobicContact CB-CB 4.01Å; H145-R148 CarbonylContact O-C 3.58Å; H145-R148 PolarHBondContact O-N 3.41Å; R148-K150 PolarHBondContact O-N 3.32Å; R148-K150 VanDerWaalsContact O-N 3.13Å; R148-D151 IonicContact CZ-OD2 3.37Å; R148-D151 IonicContact NE-OD2 3.18Å; R148-D151 IonicContact NH1-OD2 2.72Å; R148-D151 PolarHBondContact NH1-OD2 2.87Å; R148-D151 VanDerWaalsContact O-CB 3.31Å; R148-D151 WeakPolarHBondContact O-CB 3.39Å; R148-D151 PolarHBondContact O-N 3.28Å
149	R	77.2	Confident	86.8	Confident	94 Å²	94	54.5 Å²	54.5	36%	0.355	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-58.8	-26.5	175.2	-174	177.3	-57.3	-155.7	1.7	112.7	L143 C144 H145 S232 G233	L143-R149 PolarHBondContact O-N 3.38Å; C144-R149 PolarHBondContact O-NE 3.41Å; C144-R149 PolarHBondContact O-NH2 3.36Å; H145-R149 WeakPolarHBondContact O-CB 3.49Å; H145-R149 PolarHBondContact O-N 2.9Å; R149-S232 PolarHBondContact NH2-O 3.43Å; R149-G233 VanDerWaalsContact NH2-CA 3.32Å; R149-G233 PolarHBondContact NH2-O 3.08Å
150	K	78	Confident	86.8	Confident	121 Å²	121	53.3 Å²	53.3	53%	0.526	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-89.7	-4.2	178.9	-48.1	-179.5	-179.4	173.6	0	113.1	E147 R148 S574 G575	E147-K150 PolarHBondContact O-N 2.79Å; R148-K150 PolarHBondContact O-N 3.32Å; R148-K150 VanDerWaalsContact O-N 3.13Å; K150-S574 CarbonylContact O-C 3.33Å; K150-S574 WeakPolarHBondContact O-CA 3.5Å; K150-G575 PolarHBondContact O-N 2.74Å
151	D	78.3	Confident	86.7	Confident	51 Å²	51	53.3 Å²	53.3	27%	0.273	26%	0.256	S	S	.	.	S	Bend	trans	-86.6	156.9	179.1	-88.5	-4.2	0	0	0	112	R58 R148	R58-D151 IonicContact CZ-OD2 2.75Å; R58-D151 IonicContact NH1-OD2 3.83Å; R58-D151 PolarHBondContact NH1-OD2 2.99Å; R58-D151 IonicContact NH2-OD2 3.99Å; R58-D151 PolarHBondContact NH2-OD2 2.93Å; R148-D151 IonicContact CZ-OD2 3.37Å; R148-D151 IonicContact NE-OD2 3.18Å; R148-D151 IonicContact NH1-OD2 2.72Å; R148-D151 PolarHBondContact NH1-OD2 2.87Å; R148-D151 VanDerWaalsContact O-CB 3.31Å; R148-D151 WeakPolarHBondContact O-CB 3.39Å; R148-D151 PolarHBondContact O-N 3.28Å
152	F	82.2	Confident	86.8	Confident	25 Å²	25	46.1 Å²	46.1	11%	0.11	23%	0.229	C	C	.	.			trans	-64.3	134.6	170.7	171.4	-102.4	0	0	0	112.1	R58 Y59 T564 E567 A571	R58-F152 PolarHBondContact NH2-O 3.03Å; Y59-F152 HydrophobicContact CE1-CE1 4.46Å; F152-T564 HydrophobicContact CE1-CG2 4.15Å; F152-E567 HydrophobicContact CE2-CB 4.18Å; F152-E567 HydrophobicContact CE2-CG 3.8Å; F152-E567 VanDerWaalsContact CE2-OE1 3.24Å; F152-E567 WeakPolarHBondContact CE2-OE1 3.4Å; F152-E567 HydrophobicContact CZ-CB 3.83Å; F152-E567 VanDerWaalsContact CZ-CD 3.47Å; F152-E567 HydrophobicContact CZ-CG 3.79Å; F152-E567 VanDerWaalsContact CZ-OE1 3.29Å; F152-E567 WeakPolarHBondContact CZ-OE1 3.29Å; F152-A571 HydrophobicContact CD2-CB 3.65Å; F152-A571 HydrophobicContact CE2-CB 4.08Å
153	V	86.5	Confident	86.9	Confident	30 Å²	30	45.4 Å²	45.4	18%	0.182	23%	0.228	C	C	.	.			trans	-124.8	135.2	168.9	-176.3	0	0	0	0	106.6	L143 Y157 L158	L143-V153 HydrophobicContact CD2-CG2 4.05Å; V153-Y157 HydrophobicContact CG1-CD1 3.97Å; V153-L158 HydrophobicContact CG1-CD2 3.87Å; V153-L158 HydrophobicContact CG1-CG 4.02Å
154	S	89.2	Confident	87.2	Confident	1 Å²	1	45 Å²	45	1%	0.007	23%	0.226	C	C	.	.			trans	-71.8	140.6	-178.6	175.2	0	0	0	0	111.3	A156 Y157 L158 E567	S154-A156 VanDerWaalsContact C-N 3.25Å; S154-A156 PolarHBondContact O-N 2.88Å; S154-A156 PolarHBondContact OG-N 3.32Å; S154-Y157 WeakPolarHBondContact O-CB 3.22Å; S154-Y157 PolarHBondContact O-N 2.79Å; S154-L158 PolarHBondContact O-N 2.89Å; S154-L158 VanDerWaalsContact O-N 3.08Å; S154-E567 VanDerWaalsContact CA-OE1 3.29Å; S154-E567 WeakPolarHBondContact CA-OE1 3.2Å; S154-E567 PolarHBondContact OG-OE2 3.34Å
155	E	91	Very high	87.4	Confident	50 Å²	50	44.8 Å²	44.8	23%	0.234	22%	0.224	C	C	.	.	H	α-helix	trans	-49	-45.9	171.3	-74.5	174.2	-157.1	0	0	112	Y157 L158 I159 L244 Y248 E567 H596	E155-Y157 VanDerWaalsContact C-N 3.25Å; E155-Y157 PolarHBondContact O-N 3.05Å; E155-L158 WeakPolarHBondContact O-CB 3.43Å; E155-L158 PolarHBondContact O-N 2.91Å; E155-L158 VanDerWaalsContact O-N 3.11Å; E155-I159 WeakPolarHBondContact O-CG1 3.43Å; E155-I159 PolarHBondContact O-N 3.4Å; E155-L244 HydrophobicContact CB-CD1 4.23Å; E155-L244 HydrophobicContact CB-CD2 3.86Å; E155-L244 HydrophobicContact CG-CD1 3.69Å; E155-L244 HydrophobicContact CG-CD2 4.08Å; E155-L244 WeakPolarHBondContact O-CD2 3.41Å; E155-Y248 PolarHBondContact OE2-OH 2.79Å; E155-E567 VanDerWaalsContact CG-OE1 3.3Å; E155-E567 WeakPolarHBondContact CG-OE1 3.32Å; E155-E567 PolarHBondContact N-OE1 2.85Å; E155-E567 PolarHBondContact N-OE2 3.36Å; E155-H596 IonicContact OE2-CE1 3.66Å
156	A	88.1	Confident	87.7	Confident	38 Å²	38	39.9 Å²	39.9	31%	0.314	20%	0.202	S	C	.	.	H	α-helix	trans	-60.3	-37.1	-179.7	0	0	0	0	0	112	S154 T160 Y560	S154-A156 VanDerWaalsContact C-N 3.25Å; S154-A156 PolarHBondContact O-N 2.88Å; S154-A156 PolarHBondContact OG-N 3.32Å; A156-T160 PolarHBondContact O-N 2.93Å; A156-T160 VanDerWaalsContact O-N 3.12Å; A156-T160 PolarHBondContact O-OG1 3.47Å; A156-Y560 HydrophobicContact CB-CE2 4.28Å
157	Y	90.7	Very high	88.5	Confident	3 Å²	3	36.8 Å²	36.8	1%	0.012	18%	0.175	C	C	.	.	H	α-helix	trans	-73.9	-36	177.6	-168.6	-121.8	0	0	0	112	V65 H66 M69 L143 V153 S154 E155 I159 T160 L161	V65-Y157 HydrophobicContact CG1-CE2 4.42Å; V65-Y157 WeakPolarHBondContact CG1-OH 3.43Å; H66-Y157 HydrophobicContact CB-CD2 3.81Å; H66-Y157 HydrophobicContact CB-CE2 4.15Å; H66-Y157 AromaticContact CD2-CD2 3.75Å; H66-Y157 AromaticContact CG-CD2 3.66Å; M69-Y157 HydrophobicContact CG-CE2 4.29Å; L143-Y157 HydrophobicContact CD1-CE1 4.04Å; V153-Y157 HydrophobicContact CG1-CD1 3.97Å; S154-Y157 WeakPolarHBondContact O-CB 3.22Å; S154-Y157 PolarHBondContact O-N 2.79Å; E155-Y157 VanDerWaalsContact C-N 3.25Å; E155-Y157 PolarHBondContact O-N 3.05Å; Y157-I159 VanDerWaalsContact C-N 3.34Å; Y157-T160 WeakPolarHBondContact O-CB 3.32Å; Y157-T160 PolarHBondContact O-N 3.24Å; Y157-L161 HydrophobicContact CD1-CD1 4.25Å; Y157-L161 HydrophobicContact CE1-CD1 4.09Å; Y157-L161 HydrophobicContact CE1-CG 4.41Å; Y157-L161 WeakPolarHBondContact O-CG 3.47Å; Y157-L161 PolarHBondContact O-N 3.16Å
158	L	92.5	Very high	89.5	Confident	16 Å²	16	29.7 Å²	29.7	8%	0.084	14%	0.141	C	C	.	.	H	α-helix	trans	-63	-40.5	173	-67.6	177.4	0	0	0	111.7	V153 S154 E155 T160 L161 G162 L237 D240 I241 L244	V153-L158 HydrophobicContact CG1-CD2 3.87Å; V153-L158 HydrophobicContact CG1-CG 4.02Å; S154-L158 PolarHBondContact O-N 2.89Å; S154-L158 VanDerWaalsContact O-N 3.08Å; E155-L158 WeakPolarHBondContact O-CB 3.43Å; E155-L158 PolarHBondContact O-N 2.91Å; E155-L158 VanDerWaalsContact O-N 3.11Å; L158-T160 VanDerWaalsContact C-N 3.34Å; L158-L161 PolarHBondContact O-N 3Å; L158-G162 PolarHBondContact O-N 3.31Å; L158-L237 HydrophobicContact CD2-CD1 3.79Å; L158-D240 HydrophobicContact CD1-CB 4.34Å; L158-I241 HydrophobicContact CB-CG1 4.23Å; L158-I241 HydrophobicContact CD2-CG1 3.96Å; L158-L244 HydrophobicContact CB-CD2 3.76Å; L158-L244 HydrophobicContact CD1-CD2 4.2Å
159	I	93.3	Very high	90.2	Very high	30 Å²	30	27.5 Å²	27.5	15%	0.154	13%	0.133	C	C	.	.	H	α-helix	trans	-62.2	-42.3	173.4	-67.2	-60.4	0	0	0	111	E155 Y157 G162 K163 L244 Y248 L263	E155-I159 WeakPolarHBondContact O-CG1 3.43Å; E155-I159 PolarHBondContact O-N 3.4Å; Y157-I159 VanDerWaalsContact C-N 3.34Å; I159-G162 CarbonylContact O-C 3.45Å; I159-G162 WeakPolarHBondContact O-CA 3.42Å; I159-G162 PolarHBondContact O-N 3.45Å; I159-G162 VanDerWaalsContact O-N 3.09Å; I159-K163 WeakPolarHBondContact O-CG 3.37Å; I159-K163 PolarHBondContact O-N 3.28Å; I159-L244 HydrophobicContact CD1-CD2 3.89Å; I159-L244 HydrophobicContact CD1-CG 4.17Å; I159-L244 HydrophobicContact CG1-CD2 3.87Å; I159-Y248 HydrophobicContact CD1-CD2 4.03Å; I159-Y248 HydrophobicContact CD1-CE2 4.1Å; I159-Y248 HydrophobicContact CG1-CD2 4.4Å; I159-Y248 HydrophobicContact CG1-CE2 3.97Å; I159-L263 HydrophobicContact CD1-CD2 4.17Å
160	T	92.9	Very high	91	Very high	6 Å²	6	23.3 Å²	23.3	4%	0.037	12%	0.118	C	C	.	.	H	α-helix	trans	-60.3	-45.7	174.8	-65.9	0	0	0	0	111.6	H66 M69 N70 L73 A156 Y157 L158 G162 K163 F164	H66-T160 PolarHBondContact NE2-OG1 2.72Å; M69-T160 HydrophobicContact CB-CG2 4.3Å; N70-T160 VanDerWaalsContact OD1-CG2 3.25Å; N70-T160 WeakPolarHBondContact OD1-CG2 3.48Å; N70-T160 PolarHBondContact OD1-OG1 3.45Å; L73-T160 HydrophobicContact CD1-CG2 3.96Å; A156-T160 PolarHBondContact O-N 2.93Å; A156-T160 VanDerWaalsContact O-N 3.12Å; A156-T160 PolarHBondContact O-OG1 3.47Å; Y157-T160 WeakPolarHBondContact O-CB 3.32Å; Y157-T160 PolarHBondContact O-N 3.24Å; L158-T160 VanDerWaalsContact C-N 3.34Å; T160-G162 VanDerWaalsContact C-N 3.25Å; T160-G162 PolarHBondContact O-N 3Å; T160-K163 WeakPolarHBondContact O-CB 3.27Å; T160-K163 PolarHBondContact O-N 3.23Å; T160-F164 HydrophobicContact CG2-CD2 4.28Å; T160-F164 HydrophobicContact CG2-CE2 4.17Å; T160-F164 WeakPolarHBondContact O-CD2 3.33Å; T160-F164 PolarHBondContact O-N 2.8Å
161	L	93.5	Very high	91.9	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.4	-34.4	173	-65.2	177	0	0	0	112.4	M69 F136 L143 Y157 L158 F164 I165 L237 I241	M69-L161 HydrophobicContact CE-CD2 3.99Å; F136-L161 HydrophobicContact CD2-CD2 3.98Å; F136-L161 HydrophobicContact CE2-CB 4.08Å; F136-L161 HydrophobicContact CE2-CD2 3.84Å; L143-L161 HydrophobicContact CD1-CD1 3.88Å; Y157-L161 HydrophobicContact CD1-CD1 4.25Å; Y157-L161 HydrophobicContact CE1-CD1 4.09Å; Y157-L161 HydrophobicContact CE1-CG 4.41Å; Y157-L161 WeakPolarHBondContact O-CG 3.47Å; Y157-L161 PolarHBondContact O-N 3.16Å; L158-L161 PolarHBondContact O-N 3Å; L161-F164 WeakPolarHBondContact O-CB 3.21Å; L161-F164 PolarHBondContact O-N 2.63Å; L161-I165 PolarHBondContact O-N 3.35Å; L161-L237 HydrophobicContact CD1-CD2 4.39Å; L161-I241 HydrophobicContact CB-CD1 3.68Å; L161-I241 HydrophobicContact CD1-CD1 4.5Å
162	G	93.9	Very high	92.7	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.9	-47.3	169	0	0	0	0	0	112.5	L158 I159 T160 F164 I165 N166 V266	L158-G162 PolarHBondContact O-N 3.31Å; I159-G162 CarbonylContact O-C 3.45Å; I159-G162 WeakPolarHBondContact O-CA 3.42Å; I159-G162 PolarHBondContact O-N 3.45Å; I159-G162 VanDerWaalsContact O-N 3.09Å; T160-G162 VanDerWaalsContact C-N 3.25Å; T160-G162 PolarHBondContact O-N 3Å; G162-F164 PolarHBondContact O-N 2.93Å; G162-I165 WeakPolarHBondContact O-CG1 3.15Å; G162-I165 PolarHBondContact O-N 2.87Å; G162-N166 PolarHBondContact O-N 2.73Å; G162-N166 VanDerWaalsContact O-N 3.1Å; G162-V266 WeakPolarHBondContact O-CG2 3.45Å
163	K	93.4	Very high	93.3	Very high	85 Å²	85	16 Å²	16	37%	0.37	9%	0.085	S	C	.	.	H	α-helix	trans	-60.3	-34.2	175.5	-67.8	178.8	-177.9	-177.8	0	112.1	L73 I159 T160 N166 M167 M262	L73-K163 HydrophobicContact CD1-CB 3.81Å; L73-K163 HydrophobicContact CD1-CD 4.21Å; L73-K163 HydrophobicContact CD2-CB 4.1Å; I159-K163 WeakPolarHBondContact O-CG 3.37Å; I159-K163 PolarHBondContact O-N 3.28Å; T160-K163 WeakPolarHBondContact O-CB 3.27Å; T160-K163 PolarHBondContact O-N 3.23Å; K163-N166 PolarHBondContact O-N 3.42Å; K163-M167 WeakPolarHBondContact O-CB 3.37Å; K163-M167 PolarHBondContact O-N 3.25Å; K163-M262 HydrophobicContact CG-CE 4.35Å; K163-M262 HydrophobicContact CG-CG 4.27Å; K163-M262 HydrophobicContact CG-SD 4.18Å
164	F	95.1	Very high	93.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.6	-47.2	174	-94.7	-98.8	0	0	0	112.4	M69 M72 L73 F136 T160 L161 G162 N166 M167 F168	M69-F164 HydrophobicContact CB-CE2 3.85Å; M69-F164 HydrophobicContact CB-CZ 4.08Å; M69-F164 HydrophobicContact CE-CD1 4.27Å; M69-F164 HydrophobicContact CE-CD2 4.03Å; M69-F164 HydrophobicContact CE-CE1 3.82Å; M69-F164 HydrophobicContact CE-CE2 3.57Å; M69-F164 HydrophobicContact CE-CG 4.36Å; M69-F164 HydrophobicContact CE-CZ 3.44Å; M69-F164 VanDerWaalsContact CE-CZ 3.44Å; M69-F164 WeakPolarHBondContact O-CE2 3.39Å; M69-F164 WeakPolarHBondContact O-CZ 3.4Å; M69-F164 HydrophobicContact SD-CE1 4.49Å; M69-F164 HydrophobicContact SD-CE2 4.35Å; M69-F164 HydrophobicContact SD-CZ 3.9Å; M72-F164 HydrophobicContact CB-CE1 4.45Å; M72-F164 HydrophobicContact CB-CZ 4.02Å; M72-F164 HydrophobicContact CG-CE1 4.12Å; M72-F164 HydrophobicContact CG-CZ 4.19Å; M72-F164 HydrophobicContact SD-CE1 3.97Å; M72-F164 HydrophobicContact SD-CZ 4.3Å; L73-F164 HydrophobicContact CD1-CD2 4.07Å; L73-F164 HydrophobicContact CD1-CE2 3.98Å; L73-F164 HydrophobicContact CD2-CD2 3.6Å; L73-F164 HydrophobicContact CD2-CE2 3.83Å; L73-F164 HydrophobicContact CD2-CG 4.01Å; L73-F164 HydrophobicContact CD2-CZ 4.43Å; L73-F164 HydrophobicContact CG-CD2 3.8Å; L73-F164 HydrophobicContact CG-CE2 3.54Å; L73-F164 HydrophobicContact CG-CZ 4.2Å; F136-F164 HydrophobicContact CB-CD1 4.25Å; F136-F164 HydrophobicContact CD2-CB 3.63Å; F136-F164 HydrophobicContact CD2-CD1 4.1Å; F136-F164 AromaticContact CD2-CG 3.97Å; F136-F164 HydrophobicContact CD2-CG 3.97Å; F136-F164 HydrophobicContact CE2-CB 3.82Å; T160-F164 HydrophobicContact CG2-CD2 4.28Å; T160-F164 HydrophobicContact CG2-CE2 4.17Å; T160-F164 WeakPolarHBondContact O-CD2 3.33Å; T160-F164 PolarHBondContact O-N 2.8Å; L161-F164 WeakPolarHBondContact O-CB 3.21Å; L161-F164 PolarHBondContact O-N 2.63Å; G162-F164 PolarHBondContact O-N 2.93Å; F164-N166 VanDerWaalsContact C-N 3.28Å; F164-N166 PolarHBondContact O-N 3.43Å; F164-M167 HydrophobicContact CD1-CE 3.97Å; F164-M167 HydrophobicContact CE1-CE 4.23Å; F164-M167 WeakPolarHBondContact O-CB 3.49Å; F164-M167 PolarHBondContact O-N 3.36Å; F164-M167 VanDerWaalsContact O-N 3.14Å; F164-F168 HydrophobicContact CB-CE2 4.36Å; F164-F168 HydrophobicContact CD1-CE2 4.32Å; F164-F168 HydrophobicContact CD1-CZ 4.16Å; F164-F168 WeakPolarHBondContact O-CD2 3.39Å; F164-F168 WeakPolarHBondContact O-CG 3.14Å; F164-F168 PolarHBondContact O-N 3.24Å
165	I	94.2	Very high	93.9	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-64.4	-36.8	177.5	62.8	162.3	0	0	0	111.3	F136 L161 G162 F168 A169 V266 F269 L273	F136-I165 HydrophobicContact CE1-CG2 3.95Å; F136-I165 HydrophobicContact CE2-CG2 4.14Å; F136-I165 HydrophobicContact CZ-CG2 3.46Å; F136-I165 VanDerWaalsContact CZ-CG2 3.46Å; L161-I165 PolarHBondContact O-N 3.35Å; G162-I165 WeakPolarHBondContact O-CG1 3.15Å; G162-I165 PolarHBondContact O-N 2.87Å; I165-F168 PolarHBondContact O-N 3.31Å; I165-A169 PolarHBondContact O-N 3.46Å; I165-A169 VanDerWaalsContact O-N 3.14Å; I165-V266 HydrophobicContact CD1-CG1 4.07Å; I165-V266 HydrophobicContact CG1-CG1 4.45Å; I165-F269 HydrophobicContact CB-CD1 4.04Å; I165-F269 HydrophobicContact CB-CE1 4.45Å; I165-F269 WeakPolarHBondContact O-CD1 3.27Å; I165-F269 WeakPolarHBondContact O-CE1 3.33Å; I165-L273 HydrophobicContact CB-CD1 4.22Å; I165-L273 HydrophobicContact CG2-CD1 4.03Å
166	N	95.4	Very high	94	Very high	11 Å²	11	13.9 Å²	13.9	6%	0.059	7%	0.073	C	C	.	.	H	α-helix	trans	-64.9	-40.4	171.9	177.5	86	0	0	0	112.4	G162 K163 F164 F168 A169 V170 M262 K265 V266	G162-N166 PolarHBondContact O-N 2.73Å; G162-N166 VanDerWaalsContact O-N 3.1Å; K163-N166 PolarHBondContact O-N 3.42Å; F164-N166 VanDerWaalsContact C-N 3.28Å; F164-N166 PolarHBondContact O-N 3.43Å; N166-F168 VanDerWaalsContact C-N 3.3Å; N166-F168 PolarHBondContact O-N 3.17Å; N166-A169 WeakPolarHBondContact O-CB 3.5Å; N166-A169 PolarHBondContact O-N 3.34Å; N166-V170 WeakPolarHBondContact O-CG2 3.31Å; N166-V170 PolarHBondContact O-N 2.72Å; N166-M262 HydrophobicContact CB-CE 4.44Å; N166-M262 HydrophobicContact CB-SD 3.55Å; N166-M262 VanDerWaalsContact CB-SD 3.55Å; N166-M262 WeakPolarHBondContact ND2-CE 3.45Å; N166-K265 WeakPolarHBondContact OD1-CB 3.47Å; N166-K265 WeakPolarHBondContact OD1-CD 3.08Å; N166-K265 WeakPolarHBondContact OD1-CE 3.48Å; N166-V266 HydrophobicContact CB-CG2 4.29Å
167	M	97.1	Very high	94	Very high	13 Å²	13	13.1 Å²	13.1	6%	0.064	6%	0.063	C	C	.	.	H	α-helix	trans	-58.1	-43.6	176.1	-179.7	-168.6	74.4	0	0	110.9	L73 F128 A132 K163 F164 V170 L171	L73-M167 HydrophobicContact CD2-CB 4.13Å; L73-M167 HydrophobicContact CD2-SD 3.94Å; F128-M167 HydrophobicContact CE1-CE 4.34Å; F128-M167 HydrophobicContact CE1-SD 4.43Å; F128-M167 HydrophobicContact CZ-CE 4.19Å; F128-M167 HydrophobicContact CZ-SD 4.13Å; A132-M167 HydrophobicContact CB-CE 4.17Å; K163-M167 WeakPolarHBondContact O-CB 3.37Å; K163-M167 PolarHBondContact O-N 3.25Å; F164-M167 HydrophobicContact CD1-CE 3.97Å; F164-M167 HydrophobicContact CE1-CE 4.23Å; F164-M167 WeakPolarHBondContact O-CB 3.49Å; F164-M167 PolarHBondContact O-N 3.36Å; F164-M167 VanDerWaalsContact O-N 3.14Å; M167-V170 PolarHBondContact O-N 3.02Å; M167-L171 HydrophobicContact CG-CD1 3.91Å; M167-L171 HydrophobicContact CG-CG 4.41Å; M167-L171 WeakPolarHBondContact O-CB 3.28Å; M167-L171 VanDerWaalsContact O-CG 3.3Å; M167-L171 WeakPolarHBondContact O-CG 3.47Å; M167-L171 PolarHBondContact O-N 3.43Å
168	F	96.9	Very high	94.2	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-62.2	-43.4	175.2	-62.1	-50.8	0	0	0	112.1	A132 I133 F136 F164 I165 N166 L171 D172 I220 L224	A132-F168 HydrophobicContact CB-CE1 3.87Å; A132-F168 HydrophobicContact CB-CZ 4.2Å; I133-F168 HydrophobicContact CG1-CD1 4.11Å; I133-F168 HydrophobicContact CG1-CE1 3.68Å; I133-F168 HydrophobicContact CG1-CZ 4.01Å; F136-F168 HydrophobicContact CB-CE2 4.06Å; F136-F168 HydrophobicContact CB-CZ 4.09Å; F136-F168 HydrophobicContact CD1-CE2 4.05Å; F136-F168 AromaticContact CG-CE2 3.95Å; F136-F168 HydrophobicContact CG-CE2 3.95Å; F136-F168 HydrophobicContact CG-CZ 4.48Å; F164-F168 HydrophobicContact CB-CE2 4.36Å; F164-F168 HydrophobicContact CD1-CE2 4.32Å; F164-F168 HydrophobicContact CD1-CZ 4.16Å; F164-F168 WeakPolarHBondContact O-CD2 3.39Å; F164-F168 WeakPolarHBondContact O-CG 3.14Å; F164-F168 PolarHBondContact O-N 3.24Å; I165-F168 PolarHBondContact O-N 3.31Å; N166-F168 VanDerWaalsContact C-N 3.3Å; N166-F168 PolarHBondContact O-N 3.17Å; F168-L171 PolarHBondContact O-N 3.42Å; F168-D172 WeakPolarHBondContact O-CB 3.38Å; F168-D172 PolarHBondContact O-N 2.98Å; F168-I220 HydrophobicContact CB-CG2 4.03Å; F168-I220 HydrophobicContact CD1-CG2 3.93Å; F168-I220 HydrophobicContact CG-CG2 4.33Å; F168-L224 HydrophobicContact CB-CD2 4.2Å; F168-L224 HydrophobicContact CD2-CD1 4.22Å; F168-L224 HydrophobicContact CD2-CD2 3.64Å; F168-L224 HydrophobicContact CE2-CD1 4.15Å; F168-L224 HydrophobicContact CE2-CD2 4.38Å; F168-L224 HydrophobicContact CG-CD2 4.16Å
169	A	94.3	Very high	94.2	Very high	2 Å²	2	15.8 Å²	15.8	2%	0.017	8%	0.083	C	C	.	.	H	α-helix	trans	-60.7	-45.1	175.1	0	0	0	0	0	112.3	I165 N166 D172 E173 F269	I165-A169 PolarHBondContact O-N 3.46Å; I165-A169 VanDerWaalsContact O-N 3.14Å; N166-A169 WeakPolarHBondContact O-CB 3.5Å; N166-A169 PolarHBondContact O-N 3.34Å; A169-D172 PolarHBondContact O-N 3.46Å; A169-E173 WeakPolarHBondContact O-CB 3.23Å; A169-E173 WeakPolarHBondContact O-CG 3.47Å; A169-E173 PolarHBondContact O-N 3.46Å; A169-F269 HydrophobicContact CB-CD1 3.86Å; A169-F269 HydrophobicContact CB-CD2 4.48Å; A169-F269 HydrophobicContact CB-CE1 3.9Å; A169-F269 HydrophobicContact CB-CG 4.16Å; A169-F269 HydrophobicContact CB-CZ 4.23Å
170	V	95.3	Very high	94.2	Very high	7 Å²	7	14.5 Å²	14.5	4%	0.042	8%	0.076	C	C	.	.	H	α-helix	trans	-59.5	-51.2	176.8	169.2	0	0	0	0	110.9	A80 N166 M167 D172 E173 L174 L307 F308	A80-V170 HydrophobicContact CB-CG1 3.96Å; N166-V170 WeakPolarHBondContact O-CG2 3.31Å; N166-V170 PolarHBondContact O-N 2.72Å; M167-V170 PolarHBondContact O-N 3.02Å; V170-D172 PolarHBondContact O-N 3.21Å; V170-E173 PolarHBondContact O-N 3.44Å; V170-L174 HydrophobicContact CG1-CD1 3.71Å; V170-L174 HydrophobicContact CG1-CG 4.33Å; V170-L174 WeakPolarHBondContact O-CB 3.2Å; V170-L174 VanDerWaalsContact O-CG 3.22Å; V170-L174 WeakPolarHBondContact O-CG 3.22Å; V170-L174 PolarHBondContact O-N 2.79Å; V170-L307 HydrophobicContact CG2-CD1 3.61Å; V170-L307 HydrophobicContact CG2-CG 4.13Å; V170-F308 HydrophobicContact CG1-CB 4.11Å; V170-F308 HydrophobicContact CG1-CD2 3.76Å; V170-F308 HydrophobicContact CG1-CG 4.23Å
171	L	96.4	Very high	94.3	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-65.3	-37.7	-177.7	-68.7	173.2	0	0	0	112.4	A80 L83 F125 F128 M167 F168 K175 I220	A80-L171 HydrophobicContact CB-CD2 3.96Å; L83-L171 HydrophobicContact CD1-CD2 4.11Å; F125-L171 HydrophobicContact CE2-CB 4.3Å; F125-L171 HydrophobicContact CE2-CD1 4.28Å; 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 3.91Å; M167-L171 HydrophobicContact CG-CD1 3.91Å; M167-L171 HydrophobicContact CG-CG 4.41Å; M167-L171 WeakPolarHBondContact O-CB 3.28Å; M167-L171 VanDerWaalsContact O-CG 3.3Å; M167-L171 WeakPolarHBondContact O-CG 3.47Å; M167-L171 PolarHBondContact O-N 3.43Å; F168-L171 PolarHBondContact O-N 3.42Å; L171-K175 WeakPolarHBondContact O-CB 3.37Å; L171-K175 PolarHBondContact O-N 3.1Å; L171-I220 HydrophobicContact CB-CD1 3.93Å
172	D	95.6	Very high	94.2	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-70.6	-43.6	179.7	-149.2	24.7	0	0	0	111.1	F168 A169 V170 K175 N176 N218 K219 I220 T221	F168-D172 WeakPolarHBondContact O-CB 3.38Å; F168-D172 PolarHBondContact O-N 2.98Å; A169-D172 PolarHBondContact O-N 3.46Å; V170-D172 PolarHBondContact O-N 3.21Å; D172-K175 PolarHBondContact O-N 3.13Å; D172-N176 VanDerWaalsContact O-CB 3.27Å; D172-N176 WeakPolarHBondContact O-CB 3.21Å; D172-N176 PolarHBondContact O-N 3.24Å; D172-N176 PolarHBondContact O-ND2 3.46Å; D172-N218 VanDerWaalsContact OD2-C 3.24Å; D172-N218 WeakPolarHBondContact OD2-CA 3.46Å; D172-K219 PolarHBondContact OD1-N 3.37Å; D172-I220 HydrophobicContact CB-CB 3.91Å; D172-I220 HydrophobicContact CB-CD1 4.38Å; D172-I220 HydrophobicContact CB-CG1 4.48Å; D172-I220 WeakPolarHBondContact OD1-CB 3.2Å; D172-I220 PolarHBondContact OD1-N 3.04Å; D172-I220 VanDerWaalsContact OD1-N 3.09Å; D172-T221 WeakPolarHBondContact OD2-CB 3.32Å; D172-T221 PolarHBondContact OD2-N 3.46Å; D172-T221 PolarHBondContact OD2-OG1 3.19Å
173	E	93.3	Very high	94.2	Very high	41 Å²	41	22.1 Å²	22.1	19%	0.192	11%	0.112	C	C	.	.	H	α-helix	trans	-69.4	-39.8	178.7	-67.4	-64.4	179.1	0	0	112.3	A169 V170 K175 N176 M177 L307 M311 R317	A169-E173 WeakPolarHBondContact O-CB 3.23Å; A169-E173 WeakPolarHBondContact O-CG 3.47Å; A169-E173 PolarHBondContact O-N 3.46Å; V170-E173 PolarHBondContact O-N 3.44Å; E173-K175 VanDerWaalsContact C-N 3.33Å; E173-K175 PolarHBondContact O-N 3.1Å; E173-N176 WeakPolarHBondContact O-CB 3.38Å; E173-N176 PolarHBondContact O-N 3.42Å; E173-N176 PolarHBondContact OE2-ND2 3.27Å; E173-M177 WeakPolarHBondContact O-CG 3.45Å; E173-M177 PolarHBondContact O-N 2.98Å; E173-L307 HydrophobicContact CB-CD2 3.94Å; E173-L307 HydrophobicContact CG-CD2 3.99Å; E173-M311 HydrophobicContact CB-CE 3.89Å; E173-M311 HydrophobicContact CB-SD 4.11Å; E173-R317 IonicContact OE1-NH2 2.86Å
174	L	94.3	Very high	94.3	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62.2	-40.4	172	-71.7	175.7	0	0	0	111.7	A80 L83 Y84 V170 M177 K178 F308 M311	A80-L174 HydrophobicContact CB-CD1 3.73Å; A80-L174 WeakPolarHBondContact O-CD1 3.29Å; L83-L174 HydrophobicContact CB-CB 3.95Å; L83-L174 HydrophobicContact CB-CD1 4.38Å; L83-L174 HydrophobicContact CD1-CB 3.99Å; Y84-L174 HydrophobicContact CD2-CD2 4Å; V170-L174 HydrophobicContact CG1-CD1 3.71Å; V170-L174 HydrophobicContact CG1-CG 4.33Å; V170-L174 WeakPolarHBondContact O-CB 3.2Å; V170-L174 VanDerWaalsContact O-CG 3.22Å; V170-L174 WeakPolarHBondContact O-CG 3.22Å; V170-L174 PolarHBondContact O-N 2.79Å; L174-M177 HydrophobicContact CD2-CE 3.29Å; L174-M177 HydrophobicContact CG-CE 4.49Å; L174-M177 WeakPolarHBondContact O-CG 3.43Å; L174-K178 WeakPolarHBondContact O-CB 3.36Å; L174-K178 WeakPolarHBondContact O-CG 3.43Å; L174-K178 PolarHBondContact O-N 3.3Å; L174-F308 HydrophobicContact CD1-CB 4.42Å; L174-F308 HydrophobicContact CD1-CD1 4.17Å; L174-F308 HydrophobicContact CD1-CD2 4.34Å; L174-F308 HydrophobicContact CD1-CG 4.06Å; L174-F308 HydrophobicContact CD2-CB 4.37Å; L174-F308 HydrophobicContact CD2-CD1 4.2Å; L174-F308 HydrophobicContact CD2-CG 4.46Å; L174-M311 HydrophobicContact CD2-CE 3.54Å; L174-M311 HydrophobicContact CD2-SD 4.3Å; L174-M311 HydrophobicContact CG-CE 3.77Å
175	K	95.8	Very high	94.3	Very high	15 Å²	15	18.3 Å²	18.3	7%	0.065	10%	0.096	C	C	.	.	H	α-helix	trans	-65.8	-40.7	174.4	175.4	-171.4	166.8	-65.3	0	111.5	F125 L171 D172 E173 F213 N216 I220	F125-K175 HydrophobicContact CE1-CD 4.33Å; L171-K175 WeakPolarHBondContact O-CB 3.37Å; L171-K175 PolarHBondContact O-N 3.1Å; D172-K175 PolarHBondContact O-N 3.13Å; E173-K175 VanDerWaalsContact C-N 3.33Å; E173-K175 PolarHBondContact O-N 3.1Å; K175-F213 HydrophobicContact CD-CE1 3.89Å; K175-F213 HydrophobicContact CD-CE2 4.1Å; K175-F213 HydrophobicContact CD-CZ 3.56Å; K175-F213 WeakPolarHBondContact CE-O 3.17Å; K175-F213 PolarHBondContact NZ-O 3.36Å; K175-N216 PolarHBondContact NZ-O 3.13Å; K175-I220 HydrophobicContact CD-CD1 4.48Å
176	N	91.6	Very high	94.3	Very high	22 Å²	22	20.6 Å²	20.6	12%	0.118	11%	0.112	C	C	.	.	H	α-helix	trans	-63.7	-42.9	-178.6	-80.1	-20	0	0	0	112	D172 E173 H217 N218	D172-N176 VanDerWaalsContact O-CB 3.27Å; D172-N176 WeakPolarHBondContact O-CB 3.21Å; D172-N176 PolarHBondContact O-N 3.24Å; D172-N176 PolarHBondContact O-ND2 3.46Å; E173-N176 WeakPolarHBondContact O-CB 3.38Å; E173-N176 PolarHBondContact O-N 3.42Å; E173-N176 PolarHBondContact OE2-ND2 3.27Å; N176-H217 VanDerWaalsContact CB-CE1 3.42Å; N176-H217 WeakPolarHBondContact CB-CE1 3.44Å; N176-H217 PolarHBondContact OD1-CE1 3.3Å; N176-H217 PolarHBondContact OD1-ND1 3.02Å; N176-H217 VanDerWaalsContact OD1-ND1 3.16Å; N176-N218 PolarHBondContact ND2-OD1 3.3Å; N176-N218 PolarHBondContact OD1-N 3.02Å
177	M	88.9	Confident	94.2	Very high	21 Å²	21	20.7 Å²	20.7	10%	0.103	11%	0.114	C	C	.	.	H	α-helix	trans	-75.6	-31.2	-178.9	66.4	107.4	167.2	0	0	112.9	Y84 E173 L174 C179 M311 F626 E629	Y84-M177 HydrophobicContact CD2-CE 4.11Å; E173-M177 WeakPolarHBondContact O-CG 3.45Å; E173-M177 PolarHBondContact O-N 2.98Å; L174-M177 HydrophobicContact CD2-CE 3.29Å; L174-M177 HydrophobicContact CG-CE 4.49Å; L174-M177 WeakPolarHBondContact O-CG 3.43Å; M177-C179 PolarHBondContact O-N 3.18Å; M177-M311 HydrophobicContact CE-SD 4.39Å; M177-M311 HydrophobicContact CG-SD 4.1Å; M177-F626 HydrophobicContact CB-CD2 4.11Å; M177-F626 HydrophobicContact CB-CE2 4.13Å; M177-F626 HydrophobicContact CE-CB 4.38Å; M177-F626 HydrophobicContact CE-CD2 4.45Å; M177-F626 HydrophobicContact CG-CD2 4.08Å; M177-F626 HydrophobicContact SD-CB 4.32Å; M177-F626 HydrophobicContact SD-CD2 3.72Å; M177-E629 VanDerWaalsContact O-CG 3.32Å; M177-E629 WeakPolarHBondContact O-CG 3.44Å; M177-E629 HydrophobicContact SD-CB 4.44Å; M177-E629 HydrophobicContact SD-CG 4.41Å
178	K	94	Very high	94.1	Very high	6 Å²	6	21.6 Å²	21.6	3%	0.026	12%	0.117	C	C	.	.			trans	-78.1	81.4	-175.4	-72.4	-73.5	174	172.3	0	113.8	L83 Y84 W86 L174 S180 V181 E629	L83-K178 WeakPolarHBondContact O-CD 3.35Å; L83-K178 WeakPolarHBondContact O-CE 3.38Å; L83-K178 WeakPolarHBondContact O-CG 3.43Å; Y84-K178 VanDerWaalsContact O-CE 3.24Å; Y84-K178 WeakPolarHBondContact O-CE 3.39Å; Y84-K178 PolarHBondContact O-NZ 3.25Å; W86-K178 PolarHBondContact O-NZ 3.35Å; L174-K178 WeakPolarHBondContact O-CB 3.36Å; L174-K178 WeakPolarHBondContact O-CG 3.43Å; L174-K178 PolarHBondContact O-N 3.3Å; K178-S180 PolarHBondContact O-N 3.03Å; K178-V181 HydrophobicContact CB-CB 4.28Å; K178-V181 HydrophobicContact CB-CG2 3.86Å; K178-V181 PolarHBondContact O-N 3.17Å; K178-E629 HydrophobicContact CD-CG 4.26Å
179	C	92.4	Very high	93.9	Very high	70 Å²	70	23.5 Å²	23.5	47%	0.473	13%	0.126	S	C	.	.	H	α-helix	trans	-61.9	-33.5	167.4	-67.4	0	0	0	0	111.8	M177 V181 K182 N183 E629	M177-C179 PolarHBondContact O-N 3.18Å; C179-V181 VanDerWaalsContact C-N 3.33Å; C179-V181 PolarHBondContact O-N 2.7Å; C179-K182 PolarHBondContact O-N 3.22Å; C179-N183 WeakPolarHBondContact O-CB 3.08Å; C179-N183 VanDerWaalsContact O-CG 3.24Å; C179-N183 PolarHBondContact O-N 3.32Å; C179-N183 PolarHBondContact O-ND2 3.31Å; C179-E629 WeakPolarHBondContact CA-OE1 3.27Å; C179-E629 WeakPolarHBondContact CB-OE1 3.49Å; C179-E629 PolarHBondContact N-OE1 2.9Å
180	S	94.3	Very high	93.8	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.021	15%	0.152	C	C	.	.	H	α-helix	trans	-50.1	-48.2	175.1	-67.4	0	0	0	0	112.9	S88 K178 K182 N183 D184 E629	S88-S180 WeakPolarHBondContact CB-OG 3.24Å; K178-S180 PolarHBondContact O-N 3.03Å; S180-K182 PolarHBondContact O-N 3.45Å; S180-N183 PolarHBondContact O-N 2.92Å; S180-D184 WeakPolarHBondContact O-CB 3.42Å; S180-D184 PolarHBondContact O-N 2.9Å; S180-E629 WeakPolarHBondContact CB-OE2 3.31Å; S180-E629 PolarHBondContact N-OE1 3.45Å; S180-E629 VanDerWaalsContact OG-CD 3.3Å; S180-E629 PolarHBondContact OG-OE1 3.41Å; S180-E629 PolarHBondContact OG-OE2 3.21Å
181	V	94.3	Very high	93.7	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.024	15%	0.15	C	C	.	.	H	α-helix	trans	-59.2	-47.4	179.2	169	0	0	0	0	111.7	L83 W86 L122 K178 C179 N183 H185 L214	L83-V181 HydrophobicContact CD2-CG2 4.24Å; W86-V181 HydrophobicContact CB-CG2 3.99Å; W86-V181 HydrophobicContact CD2-CG2 3.68Å; W86-V181 HydrophobicContact CE3-CG2 4.15Å; W86-V181 HydrophobicContact CG-CG2 3.58Å; L122-V181 HydrophobicContact CD1-CG1 3.75Å; L122-V181 HydrophobicContact CD2-CG1 3.44Å; L122-V181 VanDerWaalsContact CD2-CG1 3.44Å; L122-V181 HydrophobicContact CG-CG1 4.24Å; K178-V181 HydrophobicContact CB-CB 4.28Å; K178-V181 HydrophobicContact CB-CG2 3.86Å; K178-V181 PolarHBondContact O-N 3.17Å; C179-V181 VanDerWaalsContact C-N 3.33Å; C179-V181 PolarHBondContact O-N 2.7Å; V181-N183 PolarHBondContact O-N 3.48Å; V181-H185 PolarHBondContact O-N 3.45Å; V181-L214 HydrophobicContact CG1-CD1 4.31Å; V181-L214 HydrophobicContact CG1-CD2 3.8Å
182	K	92.7	Very high	93.4	Very high	94 Å²	94	30.9 Å²	30.9	41%	0.409	16%	0.156	S	C	.	.	H	α-helix	trans	-63.7	-41.7	179.2	179	-177.2	174.4	-175.9	0	111.8	C179 S180 S186	C179-K182 PolarHBondContact O-N 3.22Å; S180-K182 PolarHBondContact O-N 3.45Å; K182-S186 WeakPolarHBondContact O-CB 3.21Å; K182-S186 PolarHBondContact O-N 3.35Å; K182-S186 VanDerWaalsContact O-N 3.11Å; K182-S186 PolarHBondContact O-OG 3.3Å
183	N	93.8	Very high	93.1	Very high	68 Å²	68	37.2 Å²	37.2	36%	0.364	19%	0.185	S	C	.	.	H	α-helix	trans	-70.6	-41.6	-177.3	-69.7	-21.8	0	0	0	111.8	C179 S180 V181 S186 A187	C179-N183 WeakPolarHBondContact O-CB 3.08Å; C179-N183 VanDerWaalsContact O-CG 3.24Å; C179-N183 PolarHBondContact O-N 3.32Å; C179-N183 PolarHBondContact O-ND2 3.31Å; S180-N183 PolarHBondContact O-N 2.92Å; V181-N183 PolarHBondContact O-N 3.48Å; N183-S186 WeakPolarHBondContact O-CB 3.22Å; N183-S186 PolarHBondContact O-N 2.95Å; N183-A187 PolarHBondContact O-N 2.77Å
184	D	95.6	Very high	93	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-64	-46.5	178.3	-69.2	-8.7	0	0	0	111	W86 S88 C89 S90 L115 S180 S186 A187 Y188	W86-D184 PolarHBondContact NE1-OD2 3.29Å; S88-D184 WeakPolarHBondContact CA-OD2 3.47Å; S88-D184 PolarHBondContact OG-OD1 2.99Å; C89-D184 PolarHBondContact N-OD1 2.92Å; C89-D184 PolarHBondContact N-OD2 3.35Å; S90-D184 WeakPolarHBondContact CB-OD1 3.35Å; S90-D184 PolarHBondContact N-OD1 3Å; S90-D184 PolarHBondContact OG-OD1 3.17Å; L115-D184 HydrophobicContact CD2-CB 4.03Å; S180-D184 WeakPolarHBondContact O-CB 3.42Å; S180-D184 PolarHBondContact O-N 2.9Å; D184-S186 VanDerWaalsContact C-N 3.28Å; D184-S186 PolarHBondContact O-N 3.45Å; D184-A187 PolarHBondContact O-N 2.75Å; D184-Y188 PolarHBondContact O-N 2.84Å
185	H	94.6	Very high	92.8	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.019	21%	0.206	C	C	.	.	H	α-helix	trans	-60	-38.7	173.5	174.3	-109.3	0	0	0	112.4	L122 V181 Y188 K189 S211 L214	L122-H185 HydrophobicContact CD1-CB 4.19Å; V181-H185 PolarHBondContact O-N 3.45Å; H185-Y188 PolarHBondContact O-N 2.83Å; H185-K189 WeakPolarHBondContact O-CB 3.34Å; H185-K189 PolarHBondContact O-N 2.96Å; H185-S211 PolarHBondContact CE1-OG 2.7Å; H185-L214 HydrophobicContact CB-CD1 3.78Å
186	S	93.3	Very high	92.4	Very high	48 Å²	48	51.1 Å²	51.1	34%	0.336	24%	0.242	S	C	.	.	H	α-helix	trans	-67.3	-36.8	177.7	-59.1	0	0	0	0	112.4	K182 N183 D184 R190	K182-S186 WeakPolarHBondContact O-CB 3.21Å; K182-S186 PolarHBondContact O-N 3.35Å; K182-S186 VanDerWaalsContact O-N 3.11Å; K182-S186 PolarHBondContact O-OG 3.3Å; N183-S186 WeakPolarHBondContact O-CB 3.22Å; N183-S186 PolarHBondContact O-N 2.95Å; D184-S186 VanDerWaalsContact C-N 3.28Å; D184-S186 PolarHBondContact O-N 3.45Å; S186-R190 WeakPolarHBondContact O-CB 3.3Å; S186-R190 PolarHBondContact O-N 3.48Å; S186-R190 VanDerWaalsContact O-N 3.09Å
187	A	93.7	Very high	91.9	Very high	14 Å²	14	54.2 Å²	54.2	12%	0.116	25%	0.254	C	S	.	.	H	α-helix	trans	-65.8	-45.1	174.5	0	0	0	0	0	111.3	L115 N183 D184 R190 A191	L115-A187 HydrophobicContact CD1-CB 4.09Å; N183-A187 PolarHBondContact O-N 2.77Å; D184-A187 PolarHBondContact O-N 2.75Å; A187-R190 PolarHBondContact O-N 3.41Å; A187-A191 PolarHBondContact O-N 3.45Å
188	Y	95	Very high	91.2	Very high	31 Å²	31	62.3 Å²	62.3	12%	0.122	29%	0.294	C	S	.	.	H	α-helix	trans	-57.3	-52.1	172.7	171.2	-99.9	0	0	0	111.9	V112 L115 E116 V119 D184 H185 R190 A191 A192	V112-Y188 HydrophobicContact CB-CE2 4.42Å; V112-Y188 HydrophobicContact CG1-CE2 3.98Å; V112-Y188 HydrophobicContact CG2-CD2 4.43Å; V112-Y188 HydrophobicContact CG2-CE2 4.34Å; L115-Y188 HydrophobicContact CB-CD2 4.03Å; L115-Y188 HydrophobicContact CB-CG 4.38Å; E116-Y188 HydrophobicContact CB-CE2 3.75Å; E116-Y188 HydrophobicContact CG-CE2 4.33Å; V119-Y188 HydrophobicContact CB-CD1 4.28Å; V119-Y188 HydrophobicContact CB-CE1 4.46Å; V119-Y188 HydrophobicContact CG1-CD1 4.1Å; V119-Y188 HydrophobicContact CG1-CE1 4.08Å; V119-Y188 HydrophobicContact CG2-CD1 3.77Å; V119-Y188 HydrophobicContact CG2-CD2 4.4Å; V119-Y188 HydrophobicContact CG2-CE1 4.42Å; V119-Y188 HydrophobicContact CG2-CG 3.75Å; D184-Y188 PolarHBondContact O-N 2.84Å; H185-Y188 PolarHBondContact O-N 2.83Å; Y188-R190 VanDerWaalsContact C-N 3.27Å; Y188-R190 PolarHBondContact O-N 3.42Å; Y188-A191 PolarHBondContact O-N 2.93Å; Y188-A191 VanDerWaalsContact O-N 3.12Å; Y188-A192 HydrophobicContact CE1-CB 4.47Å; Y188-A192 WeakPolarHBondContact O-CB 3.46Å; Y188-A192 PolarHBondContact O-N 3.44Å
189	K	92.9	Very high	90.5	Very high	41 Å²	41	64.2 Å²	64.2	18%	0.178	31%	0.311	C	S	.	.	H	α-helix	trans	-57.4	-41.5	-178.8	-172.6	174.3	-174	177.7	0	111.5	H185 Q193 Q208 S211	H185-K189 WeakPolarHBondContact O-CB 3.34Å; H185-K189 PolarHBondContact O-N 2.96Å; K189-Q193 WeakPolarHBondContact O-CB 3.09Å; K189-Q193 WeakPolarHBondContact O-CG 3.38Å; K189-Q193 PolarHBondContact O-N 3.34Å; K189-Q193 VanDerWaalsContact O-N 3.11Å; K189-Q208 VanDerWaalsContact NZ-OE1 3.09Å; K189-S211 PolarHBondContact NZ-OG 2.96Å
190	R	92.1	Very high	90.2	Very high	149 Å²	149	65.3 Å²	65.3	56%	0.562	31%	0.312	S	S	*	.	H	α-helix	trans	-64.1	-45	177	-166.8	-172.6	-56.2	124.6	1.8	112	S186 A187 Y188 F194	S186-R190 WeakPolarHBondContact O-CB 3.3Å; S186-R190 PolarHBondContact O-N 3.48Å; S186-R190 VanDerWaalsContact O-N 3.09Å; A187-R190 PolarHBondContact O-N 3.41Å; Y188-R190 VanDerWaalsContact C-N 3.27Å; Y188-R190 PolarHBondContact O-N 3.42Å; R190-F194 WeakPolarHBondContact O-CB 3.44Å; R190-F194 PolarHBondContact O-N 3.4Å; R190-F194 VanDerWaalsContact O-N 3.15Å
191	A	92.4	Very high	89.7	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-66.5	-47.3	179.8	0	0	0	0	0	112	Y108 T111 V112 A187 Y188 Q193 F194 L195	Y108-A191 HydrophobicContact CD1-CB 3.53Å; Y108-A191 HydrophobicContact CE1-CB 4.38Å; Y108-A191 HydrophobicContact CG-CB 4.09Å; T111-A191 HydrophobicContact CG2-CB 3.73Å; V112-A191 HydrophobicContact CG2-CB 3.78Å; A187-A191 PolarHBondContact O-N 3.45Å; Y188-A191 PolarHBondContact O-N 2.93Å; Y188-A191 VanDerWaalsContact O-N 3.12Å; A191-Q193 VanDerWaalsContact C-N 3.35Å; A191-Q193 PolarHBondContact O-N 3.02Å; A191-F194 PolarHBondContact O-N 3.42Å; A191-L195 WeakPolarHBondContact O-CG 3.39Å; A191-L195 PolarHBondContact O-N 3.19Å
192	A	90.6	Very high	89.2	Confident	16 Å²	16	75.8 Å²	75.8	13%	0.132	37%	0.37	C	S	.	.	H	α-helix	trans	-62.8	-39.3	-179.9	0	0	0	0	0	112.6	V112 Y188 R196 K197	V112-A192 HydrophobicContact CG2-CB 4.15Å; Y188-A192 HydrophobicContact CE1-CB 4.47Å; Y188-A192 WeakPolarHBondContact O-CB 3.46Å; Y188-A192 PolarHBondContact O-N 3.44Å; A192-R196 PolarHBondContact O-N 3.14Å; A192-K197 PolarHBondContact O-N 2.94Å
193	Q	89.6	Confident	88.8	Confident	133 Å²	133	73.7 Å²	73.7	62%	0.621	37%	0.367	S	S	*	.	H	α-helix	trans	-66	-41.4	174.9	-75	176.4	-8.9	0	0	112.1	K189 A191 R196	K189-Q193 WeakPolarHBondContact O-CB 3.09Å; K189-Q193 WeakPolarHBondContact O-CG 3.38Å; K189-Q193 PolarHBondContact O-N 3.34Å; K189-Q193 VanDerWaalsContact O-N 3.11Å; A191-Q193 VanDerWaalsContact C-N 3.35Å; A191-Q193 PolarHBondContact O-N 3.02Å; Q193-R196 PolarHBondContact O-N 3.4Å
194	F	91.2	Very high	88.3	Confident	79 Å²	79	75.5 Å²	75.5	35%	0.346	38%	0.376	S	S	.	.	H	α-helix	trans	-63.9	-43.9	178.5	-178.8	-90.4	0	0	0	112	R104 V105 Y108 R190 A191 R196	R104-F194 HydrophobicContact CG-CE1 4.47Å; R104-F194 HydrophobicContact CG-CZ 4.35Å; V105-F194 HydrophobicContact CG2-CE1 4.42Å; Y108-F194 HydrophobicContact CD2-CB 4.12Å; Y108-F194 AromaticContact CD2-CD1 3.27Å; Y108-F194 HydrophobicContact CD2-CD1 3.27Å; Y108-F194 HydrophobicContact CD2-CD2 4.48Å; Y108-F194 AromaticContact CD2-CE1 3.75Å; Y108-F194 HydrophobicContact CD2-CE1 3.75Å; Y108-F194 AromaticContact CD2-CG 3.7Å; Y108-F194 HydrophobicContact CD2-CG 3.7Å; Y108-F194 HydrophobicContact CE2-CB 4.19Å; Y108-F194 AromaticContact CE2-CD1 3.71Å; Y108-F194 HydrophobicContact CE2-CD1 3.71Å; Y108-F194 HydrophobicContact CE2-CD2 4.09Å; Y108-F194 HydrophobicContact CE2-CE1 4.09Å; Y108-F194 HydrophobicContact CE2-CE2 4.45Å; Y108-F194 AromaticContact CE2-CG 3.7Å; Y108-F194 HydrophobicContact CE2-CG 3.7Å; Y108-F194 HydrophobicContact CE2-CZ 4.45Å; Y108-F194 HydrophobicContact CG-CD1 4.22Å; R190-F194 WeakPolarHBondContact O-CB 3.44Å; R190-F194 PolarHBondContact O-N 3.4Å; R190-F194 VanDerWaalsContact O-N 3.15Å; A191-F194 PolarHBondContact O-N 3.42Å; F194-R196 PolarHBondContact O-N 3.38Å
195	L	90.6	Very high	87.9	Confident	53 Å²	53	80.3 Å²	80.3	28%	0.277	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-4.8	178.4	-66.5	174.6	0	0	0	113.9	V105 E109 V112 A191 K197	V105-L195 HydrophobicContact CG1-CD2 4.05Å; E109-L195 HydrophobicContact CB-CD1 4.41Å; E109-L195 HydrophobicContact CG-CD1 3.87Å; E109-L195 HydrophobicContact CG-CD2 3.88Å; V112-L195 HydrophobicContact CG2-CD1 4.03Å; A191-L195 WeakPolarHBondContact O-CG 3.39Å; A191-L195 PolarHBondContact O-N 3.19Å; L195-K197 PolarHBondContact O-N 3.25Å
196	R	86.3	Confident	87.5	Confident	217 Å²	217	82.7 Å²	82.7	82%	0.819	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	41.7	-176.4	-56	179.5	179.6	179.6	-0.6	112.2	A192 Q193 F194 M198	A192-R196 PolarHBondContact O-N 3.14Å; Q193-R196 PolarHBondContact O-N 3.4Å; F194-R196 PolarHBondContact O-N 3.38Å; R196-M198 PolarHBondContact O-N 3.24Å
197	K	82.8	Confident	87.2	Confident	86 Å²	86	81.5 Å²	81.5	37%	0.374	40%	0.401	S	S	.	.			trans	-55.3	126.4	176.1	-173.3	175.9	176.6	-177.4	0	108.7	V112 E116 A192 L195 A199	V112-K197 HydrophobicContact CG1-CD 4.39Å; E116-K197 IonicContact OE1-NZ 2.6Å; E116-K197 PolarHBondContact OE1-NZ 3.13Å; E116-K197 IonicContact OE2-NZ 2.69Å; E116-K197 PolarHBondContact OE2-NZ 3.45Å; A192-K197 PolarHBondContact O-N 2.94Å; L195-K197 PolarHBondContact O-N 3.25Å; K197-A199 PolarHBondContact O-N 3.16Å
198	M	72.7	Confident	87	Confident	191 Å²	191	85 Å²	85	94%	0.941	42%	0.415	S	S	*	.			trans	-59.4	111	179.7	-70.5	-71.1	177.1	0	0	108.8	R196	R196-M198 PolarHBondContact O-N 3.24Å
199	A	80.8	Confident	86.9	Confident	47 Å²	47	86.6 Å²	86.6	39%	0.388	43%	0.426	S	S	.	.			trans	-122.1	128.8	177.8	0	0	0	0	0	108.4	K197 I204	K197-A199 PolarHBondContact O-N 3.16Å; A199-I204 HydrophobicContact CB-CG1 4.01Å
200	D	84.4	Confident	86.9	Confident	92 Å²	92	84.7 Å²	84.7	49%	0.492	42%	0.418	S	S	.	.			trans	-72.2	160.7	174.7	62.5	-62.1	0	0	0	111.1	Q202 S203 I204	D200-Q202 PolarHBondContact O-N 2.99Å; D200-Q202 VanDerWaalsContact O-N 3.13Å; D200-Q202 WeakPolarHBondContact OD2-CB 3.49Å; D200-S203 PolarHBondContact O-N 3.21Å; D200-S203 WeakPolarHBondContact OD1-CB 3.47Å; D200-S203 PolarHBondContact OD2-N 3.18Å; D200-I204 PolarHBondContact O-N 3.47Å
201	P	83.9	Confident	86.9	Confident	115 Å²	115	78.7 Å²	78.7	75%	0.747	40%	0.399	S	S	*	.	H	α-helix	trans	-56.2	-32.4	-176.9	-26.9	35.3	0	0	0	114	Q205	P201-Q205 PolarHBondContact O-N 3.04Å; P201-Q205 VanDerWaalsContact O-N 3.16Å
202	Q	84.5	Confident	86.8	Confident	113 Å²	113	83.5 Å²	83.5	53%	0.528	42%	0.422	S	S	.	.	H	α-helix	trans	-68.2	-47.7	176.2	176.9	67.1	19.8	0	0	110.6	D200 I204 Q205 E206	D200-Q202 PolarHBondContact O-N 2.99Å; D200-Q202 VanDerWaalsContact O-N 3.13Å; D200-Q202 WeakPolarHBondContact OD2-CB 3.49Å; Q202-I204 VanDerWaalsContact C-N 3.31Å; Q202-I204 PolarHBondContact O-N 2.94Å; Q202-Q205 PolarHBondContact O-N 2.73Å; Q202-Q205 VanDerWaalsContact O-N 3.14Å; Q202-E206 PolarHBondContact NE2-OE1 3.2Å; Q202-E206 WeakPolarHBondContact O-CG 3.33Å; Q202-E206 PolarHBondContact O-N 3.11Å
203	S	83.6	Confident	87	Confident	50 Å²	50	83.2 Å²	83.2	35%	0.35	42%	0.418	S	S	.	.	H	α-helix	trans	-59	-38.3	175.8	-177.3	0	0	0	0	113.4	D200 E206 S207	D200-S203 PolarHBondContact O-N 3.21Å; D200-S203 WeakPolarHBondContact OD1-CB 3.47Å; D200-S203 PolarHBondContact OD2-N 3.18Å; S203-E206 PolarHBondContact O-N 3.42Å; S203-S207 PolarHBondContact O-N 3.01Å
204	I	84.5	Confident	87.2	Confident	105 Å²	105	77.6 Å²	77.6	54%	0.538	39%	0.392	S	S	.	.	H	α-helix	trans	-63	-44.8	175.4	-64.9	169.7	0	0	0	110.8	A199 D200 Q202 S207 Q208	A199-I204 HydrophobicContact CB-CG1 4.01Å; D200-I204 PolarHBondContact O-N 3.47Å; Q202-I204 VanDerWaalsContact C-N 3.31Å; Q202-I204 PolarHBondContact O-N 2.94Å; I204-S207 PolarHBondContact O-N 3.14Å; I204-Q208 PolarHBondContact O-N 3.17Å; I204-Q208 VanDerWaalsContact O-N 3.11Å
205	Q	85.9	Confident	87.1	Confident	102 Å²	102	76.5 Å²	76.5	48%	0.477	40%	0.398	S	S	.	.	H	α-helix	trans	-66.1	-39.6	178	-174.9	63.7	13	0	0	112	P201 Q202 Q208 N209	P201-Q205 PolarHBondContact O-N 3.04Å; P201-Q205 VanDerWaalsContact O-N 3.16Å; Q202-Q205 PolarHBondContact O-N 2.73Å; Q202-Q205 VanDerWaalsContact O-N 3.14Å; Q205-Q208 PolarHBondContact O-N 3Å; Q205-N209 PolarHBondContact O-N 3.12Å; Q205-N209 PolarHBondContact O-ND2 3.23Å
206	E	86.4	Confident	87.1	Confident	54 Å²	54	77 Å²	77	25%	0.252	40%	0.401	S	S	.	.	H	α-helix	trans	-62.3	-47	176	-72.7	-174.8	-171.9	0	0	112	M123 Y127 Q202 S203 Q208 N209 L210	M123-E206 HydrophobicContact CE-CB 4.15Å; M123-E206 HydrophobicContact SD-CB 4.44Å; Y127-E206 WeakPolarHBondContact OH-CG 3.44Å; Y127-E206 PolarHBondContact OH-OE1 3.02Å; Y127-E206 PolarHBondContact OH-OE2 3.29Å; Q202-E206 PolarHBondContact NE2-OE1 3.2Å; Q202-E206 WeakPolarHBondContact O-CG 3.33Å; Q202-E206 PolarHBondContact O-N 3.11Å; S203-E206 PolarHBondContact O-N 3.42Å; E206-Q208 PolarHBondContact O-N 3.28Å; E206-N209 PolarHBondContact O-N 2.78Å; E206-L210 PolarHBondContact O-N 3.19Å
207	S	88.3	Confident	87.2	Confident	24 Å²	24	71.8 Å²	71.8	17%	0.168	39%	0.386	C	S	.	.	H	α-helix	trans	-58.6	-36.8	174.7	-176.4	0	0	0	0	112.3	S203 I204 S211	S203-S207 PolarHBondContact O-N 3.01Å; I204-S207 PolarHBondContact O-N 3.14Å; S207-S211 PolarHBondContact O-N 3.38Å; S207-S211 VanDerWaalsContact O-N 3.09Å; S207-S211 PolarHBondContact O-OG 3.22Å
208	Q	89.7	Confident	87.7	Confident	87 Å²	87	70 Å²	70	41%	0.407	38%	0.38	S	S	.	.	H	α-helix	trans	-69.2	-43.7	176.5	-172.3	59.6	17.1	0	0	112.2	K189 I204 Q205 E206 L210 S211 M212	K189-Q208 VanDerWaalsContact NZ-OE1 3.09Å; I204-Q208 PolarHBondContact O-N 3.17Å; I204-Q208 VanDerWaalsContact O-N 3.11Å; Q205-Q208 PolarHBondContact O-N 3Å; E206-Q208 PolarHBondContact O-N 3.28Å; Q208-L210 PolarHBondContact O-N 3.32Å; Q208-S211 WeakPolarHBondContact O-CB 3.47Å; Q208-S211 PolarHBondContact O-N 2.91Å; Q208-M212 PolarHBondContact O-N 3.5Å; Q208-M212 VanDerWaalsContact O-N 3.08Å
209	N	91.7	Very high	88.7	Confident	65 Å²	65	63.9 Å²	63.9	35%	0.348	35%	0.348	S	S	.	.	H	α-helix	trans	-60.4	-44.5	176	-72.2	-29.2	0	0	0	111.9	M126 Q205 E206 S211 M212 F213	M126-N209 HydrophobicContact CE-CB 4.21Å; M126-N209 HydrophobicContact SD-CB 4.1Å; Q205-N209 PolarHBondContact O-N 3.12Å; Q205-N209 PolarHBondContact O-ND2 3.23Å; E206-N209 PolarHBondContact O-N 2.78Å; N209-S211 VanDerWaalsContact C-N 3.33Å; N209-S211 PolarHBondContact O-N 3.07Å; N209-M212 PolarHBondContact O-N 3.13Å; N209-F213 WeakPolarHBondContact O-CB 3.21Å; N209-F213 PolarHBondContact O-N 2.95Å
210	L	92.8	Very high	89.4	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-40.5	177.6	-176.9	61.4	0	0	0	111.7	V119 L122 M123 M126 E206 Q208 M212 F213 L214	V119-L210 HydrophobicContact CG1-CD2 4.1Å; L122-L210 HydrophobicContact CB-CD1 4.16Å; L122-L210 HydrophobicContact CB-CD2 4.01Å; M123-L210 HydrophobicContact CE-CB 3.71Å; M123-L210 HydrophobicContact CE-CD2 3.56Å; M123-L210 HydrophobicContact CE-CG 4.25Å; M123-L210 HydrophobicContact CG-CD2 4.08Å; M123-L210 HydrophobicContact SD-CB 3.76Å; M123-L210 HydrophobicContact SD-CD1 4.5Å; M123-L210 HydrophobicContact SD-CD2 3.67Å; M123-L210 HydrophobicContact SD-CG 4.17Å; M126-L210 HydrophobicContact CB-CD1 4.13Å; M126-L210 HydrophobicContact CE-CB 4.45Å; M126-L210 VanDerWaalsContact SD-CA 3.59Å; M126-L210 HydrophobicContact SD-CB 4.13Å; M126-L210 HydrophobicContact SD-CD1 4.19Å; E206-L210 PolarHBondContact O-N 3.19Å; Q208-L210 PolarHBondContact O-N 3.32Å; L210-M212 VanDerWaalsContact C-N 3.32Å; L210-M212 PolarHBondContact O-N 3.47Å; L210-F213 HydrophobicContact CD1-CD1 4.22Å; L210-F213 PolarHBondContact O-N 3.46Å; L210-L214 HydrophobicContact CD1-CD1 4.02Å; L210-L214 HydrophobicContact CD1-CD2 4.48Å; L210-L214 HydrophobicContact CD1-CG 4Å; L210-L214 HydrophobicContact CG-CD1 3.98Å; L210-L214 HydrophobicContact CG-CG 4.34Å; L210-L214 WeakPolarHBondContact O-CG 3.4Å; L210-L214 PolarHBondContact O-N 3.28Å
211	S	91.6	Very high	89.9	Confident	24 Å²	24	57.8 Å²	57.8	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-57.5	-46.3	174.9	-55	0	0	0	0	111.5	H185 K189 S207 Q208 N209 A215	H185-S211 PolarHBondContact CE1-OG 2.7Å; K189-S211 PolarHBondContact NZ-OG 2.96Å; S207-S211 PolarHBondContact O-N 3.38Å; S207-S211 VanDerWaalsContact O-N 3.09Å; S207-S211 PolarHBondContact O-OG 3.22Å; Q208-S211 WeakPolarHBondContact O-CB 3.47Å; Q208-S211 PolarHBondContact O-N 2.91Å; N209-S211 VanDerWaalsContact C-N 3.33Å; N209-S211 PolarHBondContact O-N 3.07Å; S211-A215 VanDerWaalsContact O-CB 3.22Å; S211-A215 WeakPolarHBondContact O-CB 3.35Å; S211-A215 PolarHBondContact O-N 3.16Å
212	M	91.8	Very high	90.3	Very high	100 Å²	100	56 Å²	56	49%	0.493	29%	0.291	S	S	.	.	H	α-helix	trans	-66.5	-41.7	178.2	-69	-58.7	-64.9	0	0	111.6	Q208 N209 L210 A215 N216	Q208-M212 PolarHBondContact O-N 3.5Å; Q208-M212 VanDerWaalsContact O-N 3.08Å; N209-M212 PolarHBondContact O-N 3.13Å; L210-M212 VanDerWaalsContact C-N 3.32Å; L210-M212 PolarHBondContact O-N 3.47Å; M212-A215 PolarHBondContact O-N 2.78Å; M212-N216 PolarHBondContact O-N 3.45Å; M212-N216 PolarHBondContact O-ND2 3.3Å
213	F	94.2	Very high	90.7	Very high	10 Å²	10	51.4 Å²	51.4	4%	0.044	27%	0.272	C	S	.	.	H	α-helix	trans	-60.6	-48.5	178.2	173	-109.3	0	0	0	112.3	F125 M126 Q129 K175 N209 L210 A215 K219 I220	F125-F213 AromaticContact CD1-CE1 3.79Å; F125-F213 HydrophobicContact CD1-CE1 3.79Å; F125-F213 HydrophobicContact CD1-CZ 4.21Å; F125-F213 AromaticContact CE1-CE1 3.54Å; F125-F213 HydrophobicContact CE1-CE1 3.54Å; F125-F213 AromaticContact CE1-CZ 3.63Å; F125-F213 HydrophobicContact CE1-CZ 3.63Å; F125-F213 HydrophobicContact CZ-CE1 4.45Å; F125-F213 HydrophobicContact CZ-CZ 4.12Å; M126-F213 HydrophobicContact CB-CD1 4.11Å; M126-F213 HydrophobicContact CB-CE1 4.32Å; M126-F213 HydrophobicContact CG-CB 4.25Å; M126-F213 HydrophobicContact CG-CD1 4.12Å; M126-F213 HydrophobicContact CG-CG 4.05Å; M126-F213 HydrophobicContact SD-CB 4.06Å; M126-F213 HydrophobicContact SD-CG 4.49Å; Q129-F213 HydrophobicContact CG-CE2 3.98Å; Q129-F213 HydrophobicContact CG-CZ 3.89Å; K175-F213 HydrophobicContact CD-CE1 3.89Å; K175-F213 HydrophobicContact CD-CE2 4.1Å; K175-F213 HydrophobicContact CD-CZ 3.56Å; K175-F213 WeakPolarHBondContact CE-O 3.17Å; K175-F213 PolarHBondContact NZ-O 3.36Å; N209-F213 WeakPolarHBondContact O-CB 3.21Å; N209-F213 PolarHBondContact O-N 2.95Å; L210-F213 HydrophobicContact CD1-CD1 4.22Å; L210-F213 PolarHBondContact O-N 3.46Å; F213-A215 VanDerWaalsContact C-N 3.33Å; F213-A215 PolarHBondContact O-N 2.97Å; F213-K219 HydrophobicContact CD2-CB 4.42Å; F213-K219 HydrophobicContact CD2-CG 3.81Å; F213-K219 HydrophobicContact CE2-CG 4.21Å; F213-I220 HydrophobicContact CE2-CG1 4.09Å; F213-I220 HydrophobicContact CZ-CD1 4.36Å; F213-I220 HydrophobicContact CZ-CG1 4.31Å
214	L	92.8	Very high	91.3	Very high	16 Å²	16	49 Å²	49	8%	0.084	26%	0.255	C	S	.	.	H	α-helix	trans	-70.8	-27.2	179.9	-63.4	178.3	0	0	0	112.9	L122 V181 H185 L210	L122-L214 HydrophobicContact CD1-CD1 4.3Å; V181-L214 HydrophobicContact CG1-CD1 4.31Å; V181-L214 HydrophobicContact CG1-CD2 3.8Å; H185-L214 HydrophobicContact CB-CD1 3.78Å; L210-L214 HydrophobicContact CD1-CD1 4.02Å; L210-L214 HydrophobicContact CD1-CD2 4.48Å; L210-L214 HydrophobicContact CD1-CG 4Å; L210-L214 HydrophobicContact CG-CD1 3.98Å; L210-L214 HydrophobicContact CG-CG 4.34Å; L210-L214 WeakPolarHBondContact O-CG 3.4Å; L210-L214 PolarHBondContact O-N 3.28Å
215	A	89.9	Confident	91.7	Very high	56 Å²	56	46 Å²	46	46%	0.463	24%	0.239	S	C	.	.	H	α-helix	trans	-76.5	-30.3	178.7	0	0	0	0	0	113.8	S211 M212 F213	S211-A215 VanDerWaalsContact O-CB 3.22Å; S211-A215 WeakPolarHBondContact O-CB 3.35Å; S211-A215 PolarHBondContact O-N 3.16Å; M212-A215 PolarHBondContact O-N 2.78Å; F213-A215 VanDerWaalsContact C-N 3.33Å; F213-A215 PolarHBondContact O-N 2.97Å
216	N	90.4	Very high	92	Very high	64 Å²	64	47.3 Å²	47.3	34%	0.342	24%	0.244	S	C	.	.	S	Bend	trans	-85.1	123.9	-177.4	-74	-65.5	0	0	0	111.6	K175 M212 K219	K175-N216 PolarHBondContact NZ-O 3.13Å; M212-N216 PolarHBondContact O-N 3.45Å; M212-N216 PolarHBondContact O-ND2 3.3Å; N216-K219 HydrophobicContact CB-CB 4.01Å; N216-K219 HydrophobicContact CB-CD 4.17Å; N216-K219 HydrophobicContact CB-CG 4.28Å
217	H	89.4	Confident	92.4	Very high	107 Å²	107	47.8 Å²	47.8	50%	0.495	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	145.8	174.2	-160.9	79.8	0	0	0	110.8	N176 K219 Q222	N176-H217 VanDerWaalsContact CB-CE1 3.42Å; N176-H217 WeakPolarHBondContact CB-CE1 3.44Å; N176-H217 PolarHBondContact OD1-CE1 3.3Å; N176-H217 PolarHBondContact OD1-ND1 3.02Å; N176-H217 VanDerWaalsContact OD1-ND1 3.16Å; H217-K219 PolarHBondContact O-N 3.2Å; H217-Q222 PolarHBondContact O-NE2 2.75Å
218	N	92.4	Very high	92.7	Very high	48 Å²	48	46.7 Å²	46.7	26%	0.257	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	30.5	-176	-62.9	-29.8	0	0	0	114.6	D172 N176 I220 T221 Q222	D172-N218 VanDerWaalsContact OD2-C 3.24Å; D172-N218 WeakPolarHBondContact OD2-CA 3.46Å; N176-N218 PolarHBondContact ND2-OD1 3.3Å; N176-N218 PolarHBondContact OD1-N 3.02Å; N218-I220 VanDerWaalsContact C-N 3.35Å; N218-I220 PolarHBondContact O-N 3.03Å; N218-T221 PolarHBondContact O-N 3.19Å; N218-Q222 WeakPolarHBondContact O-CB 3.25Å; N218-Q222 WeakPolarHBondContact O-CG 3.46Å; N218-Q222 PolarHBondContact O-N 3.24Å
219	K	93.9	Very high	92.9	Very high	62 Å²	62	45 Å²	45	27%	0.27	23%	0.231	S	C	.	.	H	α-helix	trans	-67.5	-35.8	-170.1	-179.5	55.4	-175	161.7	0	112.1	D172 F213 N216 H217 S223	D172-K219 PolarHBondContact OD1-N 3.37Å; F213-K219 HydrophobicContact CD2-CB 4.42Å; F213-K219 HydrophobicContact CD2-CG 3.81Å; F213-K219 HydrophobicContact CE2-CG 4.21Å; N216-K219 HydrophobicContact CB-CB 4.01Å; N216-K219 HydrophobicContact CB-CD 4.17Å; N216-K219 HydrophobicContact CB-CG 4.28Å; H217-K219 PolarHBondContact O-N 3.2Å; K219-S223 WeakPolarHBondContact CE-OG 3.45Å; K219-S223 PolarHBondContact NZ-OG 3.06Å; K219-S223 WeakPolarHBondContact O-CB 3.18Å; K219-S223 PolarHBondContact O-N 3.44Å; K219-S223 VanDerWaalsContact O-N 3.14Å; K219-S223 PolarHBondContact O-OG 2.85Å
220	I	95.4	Very high	93	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.8	-48.6	-180	-60.2	177.6	0	0	0	108.8	F125 Q129 I133 F168 L171 D172 K175 F213 N218 Q222 S223 L224	F125-I220 HydrophobicContact CE2-CD1 4.49Å; F125-I220 HydrophobicContact CZ-CD1 3.9Å; Q129-I220 HydrophobicContact CB-CD1 4.21Å; Q129-I220 HydrophobicContact CB-CG1 4.49Å; Q129-I220 HydrophobicContact CG-CD1 4.36Å; Q129-I220 HydrophobicContact CG-CG1 4.37Å; I133-I220 HydrophobicContact CD1-CG2 4.03Å; F168-I220 HydrophobicContact CB-CG2 4.03Å; F168-I220 HydrophobicContact CD1-CG2 3.93Å; F168-I220 HydrophobicContact CG-CG2 4.33Å; L171-I220 HydrophobicContact CB-CD1 3.93Å; D172-I220 HydrophobicContact CB-CB 3.91Å; D172-I220 HydrophobicContact CB-CD1 4.38Å; D172-I220 HydrophobicContact CB-CG1 4.48Å; D172-I220 WeakPolarHBondContact OD1-CB 3.2Å; D172-I220 PolarHBondContact OD1-N 3.04Å; D172-I220 VanDerWaalsContact OD1-N 3.09Å; K175-I220 HydrophobicContact CD-CD1 4.48Å; F213-I220 HydrophobicContact CE2-CG1 4.09Å; F213-I220 HydrophobicContact CZ-CD1 4.36Å; F213-I220 HydrophobicContact CZ-CG1 4.31Å; N218-I220 VanDerWaalsContact C-N 3.35Å; N218-I220 PolarHBondContact O-N 3.03Å; I220-Q222 PolarHBondContact O-N 2.64Å; I220-S223 PolarHBondContact O-N 2.91Å; I220-L224 WeakPolarHBondContact O-CB 3.49Å; I220-L224 PolarHBondContact O-N 3.37Å
221	T	94.1	Very high	93.1	Very high	11 Å²	11	47.3 Å²	47.3	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-46	178.5	-60	0	0	0	0	112.4	D172 N218 S223 L224 Q225 F269 Y272	D172-T221 WeakPolarHBondContact OD2-CB 3.32Å; D172-T221 PolarHBondContact OD2-N 3.46Å; D172-T221 PolarHBondContact OD2-OG1 3.19Å; N218-T221 PolarHBondContact O-N 3.19Å; T221-S223 VanDerWaalsContact C-N 3.34Å; T221-S223 PolarHBondContact O-N 3.3Å; T221-L224 WeakPolarHBondContact O-CB 3.41Å; T221-L224 PolarHBondContact O-N 3.13Å; T221-Q225 WeakPolarHBondContact O-CG 3.46Å; T221-Q225 PolarHBondContact O-N 3.18Å; T221-F269 HydrophobicContact CG2-CE2 3.94Å; T221-F269 HydrophobicContact CG2-CZ 3.89Å; T221-Y272 HydrophobicContact CG2-CE1 3.77Å
222	Q	92	Very high	93.1	Very high	78 Å²	78	51.2 Å²	51.2	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-62.2	-41.5	177.9	-73.1	167.4	16.2	0	0	112.2	H217 N218 I220 L224 Q225 Q226	H217-Q222 PolarHBondContact O-NE2 2.75Å; N218-Q222 WeakPolarHBondContact O-CB 3.25Å; N218-Q222 WeakPolarHBondContact O-CG 3.46Å; N218-Q222 PolarHBondContact O-N 3.24Å; I220-Q222 PolarHBondContact O-N 2.64Å; Q222-L224 VanDerWaalsContact C-N 3.33Å; Q222-Q225 PolarHBondContact O-N 2.81Å; Q222-Q226 VanDerWaalsContact O-CG 3.28Å; Q222-Q226 WeakPolarHBondContact O-CG 3.41Å; Q222-Q226 PolarHBondContact O-N 3.38Å
223	S	94.6	Very high	93	Very high	17 Å²	17	46.8 Å²	46.8	12%	0.119	25%	0.254	C	S	.	.	H	α-helix	trans	-68.1	-37.2	179.9	-54.1	0	0	0	0	110.9	K219 I220 T221 Q227	K219-S223 WeakPolarHBondContact CE-OG 3.45Å; K219-S223 PolarHBondContact NZ-OG 3.06Å; K219-S223 WeakPolarHBondContact O-CB 3.18Å; K219-S223 PolarHBondContact O-N 3.44Å; K219-S223 VanDerWaalsContact O-N 3.14Å; K219-S223 PolarHBondContact O-OG 2.85Å; I220-S223 PolarHBondContact O-N 2.91Å; T221-S223 VanDerWaalsContact C-N 3.34Å; T221-S223 PolarHBondContact O-N 3.3Å; S223-Q227 WeakPolarHBondContact O-CG 2.95Å; S223-Q227 PolarHBondContact O-N 3.05Å
224	L	95.6	Very high	93.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-48.3	173.6	-179.3	63.9	0	0	0	111.8	I133 F136 F168 I220 T221 Q222 Q226 Q227 L228 F269 L273	I133-L224 HydrophobicContact CG2-CD1 4.19Å; F136-L224 HydrophobicContact CD1-CD1 3.84Å; F136-L224 HydrophobicContact CE1-CD1 4.1Å; F168-L224 HydrophobicContact CB-CD2 4.2Å; F168-L224 HydrophobicContact CD2-CD1 4.22Å; F168-L224 HydrophobicContact CD2-CD2 3.64Å; F168-L224 HydrophobicContact CE2-CD1 4.15Å; F168-L224 HydrophobicContact CE2-CD2 4.38Å; F168-L224 HydrophobicContact CG-CD2 4.16Å; I220-L224 WeakPolarHBondContact O-CB 3.49Å; I220-L224 PolarHBondContact O-N 3.37Å; T221-L224 WeakPolarHBondContact O-CB 3.41Å; T221-L224 PolarHBondContact O-N 3.13Å; Q222-L224 VanDerWaalsContact C-N 3.33Å; L224-Q226 PolarHBondContact O-N 3.16Å; L224-Q227 PolarHBondContact O-N 3.09Å; L224-L228 HydrophobicContact CD1-CD1 3.86Å; L224-L228 HydrophobicContact CD1-CG 4.1Å; L224-L228 HydrophobicContact CD2-CD1 4.5Å; L224-L228 HydrophobicContact CG-CD1 3.8Å; L224-L228 HydrophobicContact CG-CG 4.39Å; L224-L228 WeakPolarHBondContact O-CB 3.35Å; L224-L228 VanDerWaalsContact O-CG 3.31Å; L224-L228 WeakPolarHBondContact O-CG 3.28Å; L224-L228 PolarHBondContact O-N 3.21Å; L224-F269 HydrophobicContact CD2-CE1 4.37Å; L224-L273 HydrophobicContact CD2-CD1 3.84Å; L224-L273 HydrophobicContact CD2-CD2 4.19Å
225	Q	93.1	Very high	93.1	Very high	42 Å²	42	47.2 Å²	47.2	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-58.2	-47.7	177.6	-76.2	175.5	-39.4	0	0	111.7	T221 Q222 Q227 L228 E229 Y272 L273	T221-Q225 WeakPolarHBondContact O-CG 3.46Å; T221-Q225 PolarHBondContact O-N 3.18Å; Q222-Q225 PolarHBondContact O-N 2.81Å; Q225-Q227 VanDerWaalsContact C-N 3.33Å; Q225-Q227 PolarHBondContact O-N 3.32Å; Q225-L228 PolarHBondContact O-N 3.41Å; Q225-E229 WeakPolarHBondContact O-CB 3.42Å; Q225-E229 WeakPolarHBondContact O-CG 3.32Å; Q225-E229 PolarHBondContact O-N 3.41Å; Q225-Y272 VanDerWaalsContact NE2-CE1 3.34Å; Q225-L273 HydrophobicContact CG-CD2 3.62Å
226	Q	92.4	Very high	93.2	Very high	128 Å²	128	47 Å²	47	60%	0.598	25%	0.245	S	C	*	.	H	α-helix	trans	-58.8	-42.3	178.6	-72.4	172.3	4.1	0	0	112.5	Q222 L224	Q222-Q226 VanDerWaalsContact O-CG 3.28Å; Q222-Q226 WeakPolarHBondContact O-CG 3.41Å; Q222-Q226 PolarHBondContact O-N 3.38Å; L224-Q226 PolarHBondContact O-N 3.16Å
227	Q	94.8	Very high	93.3	Very high	65 Å²	65	44.5 Å²	44.5	30%	0.304	23%	0.232	S	C	.	.	H	α-helix	trans	-78.6	-19.9	179.6	-69.6	-165.5	40.5	0	0	114	I133 C137 S223 L224 Q225 V230 I231	I133-Q227 HydrophobicContact CG2-CB 4.43Å; I133-Q227 HydrophobicContact CG2-CG 4.45Å; C137-Q227 HydrophobicContact CB-CB 4.23Å; S223-Q227 WeakPolarHBondContact O-CG 2.95Å; S223-Q227 PolarHBondContact O-N 3.05Å; L224-Q227 PolarHBondContact O-N 3.09Å; Q225-Q227 VanDerWaalsContact C-N 3.33Å; Q225-Q227 PolarHBondContact O-N 3.32Å; Q227-V230 VanDerWaalsContact O-CG1 3.3Å; Q227-V230 WeakPolarHBondContact O-CG1 3.27Å; Q227-I231 WeakPolarHBondContact O-CD1 3.47Å
228	L	94.9	Very high	93.5	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-82.6	-46.2	173.1	-74.2	174.4	0	0	0	111.8	F136 V140 L224 Q225 V230 I231 Y234 L273	F136-L228 HydrophobicContact CE1-CD1 4.49Å; F136-L228 HydrophobicContact CE1-CD2 4.12Å; V140-L228 HydrophobicContact CB-CD2 4.24Å; V140-L228 HydrophobicContact CG1-CD2 3.99Å; V140-L228 HydrophobicContact CG2-CD2 4.04Å; L224-L228 HydrophobicContact CD1-CD1 3.86Å; L224-L228 HydrophobicContact CD1-CG 4.1Å; L224-L228 HydrophobicContact CD2-CD1 4.5Å; L224-L228 HydrophobicContact CG-CD1 3.8Å; L224-L228 HydrophobicContact CG-CG 4.39Å; L224-L228 WeakPolarHBondContact O-CB 3.35Å; L224-L228 VanDerWaalsContact O-CG 3.31Å; L224-L228 WeakPolarHBondContact O-CG 3.28Å; L224-L228 PolarHBondContact O-N 3.21Å; Q225-L228 PolarHBondContact O-N 3.41Å; L228-V230 PolarHBondContact O-N 3.41Å; L228-V230 VanDerWaalsContact O-N 3.16Å; L228-I231 WeakPolarHBondContact O-CB 3.18Å; L228-I231 PolarHBondContact O-N 2.87Å; L228-Y234 HydrophobicContact CB-CD2 3.87Å; L228-Y234 HydrophobicContact CB-CE2 4.17Å; L228-Y234 HydrophobicContact CB-CG 4.19Å; L228-Y234 HydrophobicContact CD2-CD2 4.5Å; L228-Y234 WeakPolarHBondContact O-CD1 3.07Å; L228-L273 HydrophobicContact CD1-CD1 4.34Å
229	E	93.3	Very high	93.6	Very high	51 Å²	51	37.2 Å²	37.2	24%	0.238	20%	0.196	C	C	.	.	H	α-helix	trans	-63	-24.2	-176.7	-72.9	-171.7	157.7	0	0	113.4	Q225 I231 Y234 G276 S277 V278	Q225-E229 WeakPolarHBondContact O-CB 3.42Å; Q225-E229 WeakPolarHBondContact O-CG 3.32Å; Q225-E229 PolarHBondContact O-N 3.41Å; E229-I231 PolarHBondContact O-N 3.27Å; E229-Y234 HydrophobicContact CB-CE1 4.49Å; E229-Y234 HydrophobicContact CG-CE1 4.19Å; E229-G276 WeakPolarHBondContact OE1-CA 3.49Å; E229-S277 VanDerWaalsContact CD-OG 3.27Å; E229-S277 PolarHBondContact OE1-N 2.84Å; E229-S277 PolarHBondContact OE1-OG 3.48Å; E229-S277 PolarHBondContact OE2-OG 2.91Å; E229-V278 HydrophobicContact CB-CG2 4.07Å; E229-V278 HydrophobicContact CG-CG2 4.39Å
230	V	94.5	Very high	93.5	Very high	103 Å²	103	36.1 Å²	36.1	62%	0.624	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-18.8	173.1	76.9	0	0	0	0	113	Q227 L228	Q227-V230 VanDerWaalsContact O-CG1 3.3Å; Q227-V230 WeakPolarHBondContact O-CG1 3.27Å; L228-V230 PolarHBondContact O-N 3.41Å; L228-V230 VanDerWaalsContact O-N 3.16Å
231	I	94	Very high	93.5	Very high	10 Å²	10	36.1 Å²	36.1	5%	0.051	19%	0.194	C	C	.	.	S	Bend	trans	-90.4	115.9	-178.1	-58.9	167.7	0	0	0	108.9	C137 V140 R141 C144 Q227 L228 E229 G233 Y234	C137-I231 HydrophobicContact CB-CD1 4.21Å; C137-I231 VanDerWaalsContact O-CD1 3.29Å; C137-I231 WeakPolarHBondContact O-CD1 3.13Å; V140-I231 HydrophobicContact CB-CD1 4.34Å; V140-I231 HydrophobicContact CG1-CD1 4.22Å; R141-I231 HydrophobicContact CB-CD1 3.95Å; R141-I231 HydrophobicContact CB-CG1 4.28Å; R141-I231 HydrophobicContact CB-CG2 4.3Å; R141-I231 HydrophobicContact CG-CG2 4.5Å; C144-I231 HydrophobicContact CB-CG2 4.23Å; Q227-I231 WeakPolarHBondContact O-CD1 3.47Å; L228-I231 WeakPolarHBondContact O-CB 3.18Å; L228-I231 PolarHBondContact O-N 2.87Å; E229-I231 PolarHBondContact O-N 3.27Å; I231-G233 PolarHBondContact O-N 2.89Å; I231-G233 VanDerWaalsContact O-N 3.12Å; I231-Y234 WeakPolarHBondContact O-CD1 3.25Å; I231-Y234 PolarHBondContact O-N 3.49Å
232	S	92.4	Very high	93.6	Very high	107 Å²	107	35.7 Å²	35.7	75%	0.748	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	117.2	179.7	-173.8	0	0	0	0	112.1	R149	R149-S232 PolarHBondContact NH2-O 3.43Å
233	G	90	Very high	93.7	Very high	6 Å²	6	34.3 Å²	34.3	6%	0.062	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	29.3	176.9	0	0	0	0	0	115	C144 R149 I231 E235 E236	C144-G233 PolarHBondContact SG-O 3.4Å; R149-G233 VanDerWaalsContact NH2-CA 3.32Å; R149-G233 PolarHBondContact NH2-O 3.08Å; I231-G233 PolarHBondContact O-N 2.89Å; I231-G233 VanDerWaalsContact O-N 3.12Å; G233-E235 WeakPolarHBondContact CA-OE1 3.31Å; G233-E235 WeakPolarHBondContact CA-OE2 3.43Å; G233-E235 PolarHBondContact O-N 3.27Å; G233-E236 PolarHBondContact O-N 3.08Å
234	Y	94.8	Very high	93.7	Very high	1 Å²	1	34.3 Å²	34.3	0%	0.004	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-33.5	171	76.4	-85.3	0	0	0	112	L228 E229 I231 E236 L237 L238 L273	L228-Y234 HydrophobicContact CB-CD2 3.87Å; L228-Y234 HydrophobicContact CB-CE2 4.17Å; L228-Y234 HydrophobicContact CB-CG 4.19Å; L228-Y234 HydrophobicContact CD2-CD2 4.5Å; L228-Y234 WeakPolarHBondContact O-CD1 3.07Å; E229-Y234 HydrophobicContact CB-CE1 4.49Å; E229-Y234 HydrophobicContact CG-CE1 4.19Å; I231-Y234 WeakPolarHBondContact O-CD1 3.25Å; I231-Y234 PolarHBondContact O-N 3.49Å; Y234-E236 PolarHBondContact O-N 3.32Å; Y234-L237 PolarHBondContact O-N 3.36Å; Y234-L237 VanDerWaalsContact O-N 3.12Å; Y234-L238 HydrophobicContact CD2-CD1 3.77Å; Y234-L238 HydrophobicContact CD2-CG 4.43Å; Y234-L238 HydrophobicContact CE2-CD1 3.94Å; Y234-L238 PolarHBondContact O-N 3.07Å; Y234-L238 VanDerWaalsContact O-N 3.17Å; Y234-L273 PolarHBondContact OH-O 3.46Å
235	E	92.3	Very high	93.7	Very high	34 Å²	34	34.4 Å²	34.4	16%	0.159	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-25.8	-179.1	72.4	-74.9	176.3	0	0	112.6	G233 A239 M274 S279 L284	G233-E235 WeakPolarHBondContact CA-OE1 3.31Å; G233-E235 WeakPolarHBondContact CA-OE2 3.43Å; G233-E235 PolarHBondContact O-N 3.27Å; E235-A239 WeakPolarHBondContact O-CB 3.43Å; E235-A239 PolarHBondContact O-N 3.16Å; E235-M274 HydrophobicContact CB-CG 4.47Å; E235-S279 WeakPolarHBondContact CB-OG 3.4Å; E235-S279 WeakPolarHBondContact CG-OG 3.29Å; E235-L284 HydrophobicContact CB-CD1 4.47Å; E235-L284 HydrophobicContact CG-CD1 4.34Å
236	E	92.1	Very high	93.8	Very high	53 Å²	53	32.9 Å²	32.9	25%	0.248	18%	0.178	C	C	.	.	H	α-helix	trans	-70.3	-38.5	175.8	-71.8	-67.3	162.2	0	0	111.9	G233 Y234 D240 R289	G233-E236 PolarHBondContact O-N 3.08Å; Y234-E236 PolarHBondContact O-N 3.32Å; E236-D240 PolarHBondContact O-N 3.02Å; E236-R289 PolarHBondContact O-NH2 2.79Å; E236-R289 IonicContact OE2-CZ 3.91Å; E236-R289 VanDerWaalsContact OE2-CZ 3.24Å; E236-R289 IonicContact OE2-NE 3.52Å; E236-R289 PolarHBondContact OE2-NE 3.17Å; E236-R289 IonicContact OE2-NH2 3.45Å; E236-R289 PolarHBondContact OE2-NH2 3.33Å
237	L	93.3	Very high	93.9	Very high	11 Å²	11	30.4 Å²	30.4	6%	0.058	17%	0.17	C	C	.	.	H	α-helix	trans	-70.7	-43.5	175.6	179.7	65.7	0	0	0	110.6	V140 L143 L158 L161 Y234 A239 D240 I241	V140-L237 HydrophobicContact CB-CD2 4.16Å; V140-L237 HydrophobicContact CG1-CD2 4.03Å; V140-L237 HydrophobicContact CG2-CD2 3.97Å; L143-L237 HydrophobicContact CB-CD1 4.44Å; L143-L237 HydrophobicContact CB-CD2 4.07Å; L143-L237 HydrophobicContact CD1-CD1 4.12Å; L143-L237 HydrophobicContact CD1-CD2 3.96Å; L158-L237 HydrophobicContact CD2-CD1 3.79Å; L161-L237 HydrophobicContact CD1-CD2 4.39Å; Y234-L237 PolarHBondContact O-N 3.36Å; Y234-L237 VanDerWaalsContact O-N 3.12Å; L237-A239 VanDerWaalsContact C-N 3.28Å; L237-A239 PolarHBondContact O-N 3.41Å; L237-D240 WeakPolarHBondContact O-CB 3.37Å; L237-D240 PolarHBondContact O-N 3.48Å; L237-D240 VanDerWaalsContact O-N 3.08Å; L237-I241 WeakPolarHBondContact O-CG1 3.39Å; L237-I241 PolarHBondContact O-N 3.4Å; L237-I241 VanDerWaalsContact O-N 3.09Å
238	L	93.7	Very high	93.9	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-61.5	-38.4	175.5	-64.9	-176.2	0	0	0	111.6	Y234 D240 I241 V242 L273 M274	Y234-L238 HydrophobicContact CD2-CD1 3.77Å; Y234-L238 HydrophobicContact CD2-CG 4.43Å; Y234-L238 HydrophobicContact CE2-CD1 3.94Å; Y234-L238 PolarHBondContact O-N 3.07Å; Y234-L238 VanDerWaalsContact O-N 3.17Å; L238-D240 VanDerWaalsContact C-N 3.27Å; L238-D240 PolarHBondContact O-N 3.34Å; L238-I241 HydrophobicContact CD2-CD1 4.22Å; L238-I241 PolarHBondContact O-N 2.66Å; L238-V242 WeakPolarHBondContact O-CG2 3.36Å; L238-V242 PolarHBondContact O-N 2.94Å; L238-L273 HydrophobicContact CD1-CB 3.96Å; L238-M274 HydrophobicContact CB-CG 3.53Å; L238-M274 HydrophobicContact CB-SD 3.68Å; L238-M274 HydrophobicContact CD1-CG 3.82Å; L238-M274 HydrophobicContact CG-CG 4.34Å
239	A	94.1	Very high	93.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.5	-34.7	173.9	0	0	0	0	0	112.5	E235 L237 N243 M274 R289 I290	E235-A239 WeakPolarHBondContact O-CB 3.43Å; E235-A239 PolarHBondContact O-N 3.16Å; L237-A239 VanDerWaalsContact C-N 3.28Å; L237-A239 PolarHBondContact O-N 3.41Å; A239-N243 VanDerWaalsContact O-CB 3.25Å; A239-N243 WeakPolarHBondContact O-CB 3.37Å; A239-N243 PolarHBondContact O-N 3.05Å; A239-N243 PolarHBondContact O-ND2 2.78Å; A239-M274 HydrophobicContact CB-CE 3.65Å; A239-M274 HydrophobicContact CB-SD 4.44Å; A239-R289 HydrophobicContact CB-CG 4.23Å; A239-I290 HydrophobicContact CB-CG2 3.76Å
240	D	92.6	Very high	94	Very high	39 Å²	39	30.6 Å²	30.6	21%	0.209	17%	0.169	C	C	.	.	H	α-helix	trans	-67.9	-42.4	174.3	-72.5	-16.6	0	0	0	112.2	L158 E236 L237 L238 N243 L244 R289 K573	L158-D240 HydrophobicContact CD1-CB 4.34Å; E236-D240 PolarHBondContact O-N 3.02Å; L237-D240 WeakPolarHBondContact O-CB 3.37Å; L237-D240 PolarHBondContact O-N 3.48Å; L237-D240 VanDerWaalsContact O-N 3.08Å; L238-D240 VanDerWaalsContact C-N 3.27Å; L238-D240 PolarHBondContact O-N 3.34Å; D240-N243 PolarHBondContact O-N 3.32Å; D240-L244 WeakPolarHBondContact O-CB 3.42Å; D240-L244 PolarHBondContact O-N 3.21Å; D240-R289 IonicContact OD1-CZ 2.66Å; D240-R289 IonicContact OD1-NH1 3.48Å; D240-R289 PolarHBondContact OD1-NH1 3.06Å; D240-R289 IonicContact OD1-NH2 3.93Å; D240-R289 PolarHBondContact OD1-NH2 2.74Å; D240-R289 IonicContact OD2-NH2 3.24Å; D240-K573 IonicContact OD1-NZ 2.81Å; D240-K573 PolarHBondContact OD1-NZ 2.95Å; D240-K573 IonicContact OD2-NZ 2.53Å; D240-K573 PolarHBondContact OD2-NZ 3.3Å
241	I	95.3	Very high	93.9	Very high	1 Å²	1	30 Å²	30	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-61.1	-48.1	175.1	-62.6	170.7	0	0	0	110.4	L158 L161 L237 L238 L244 C245 V266	L158-I241 HydrophobicContact CB-CG1 4.23Å; L158-I241 HydrophobicContact CD2-CG1 3.96Å; L161-I241 HydrophobicContact CB-CD1 3.68Å; L161-I241 HydrophobicContact CD1-CD1 4.5Å; L237-I241 WeakPolarHBondContact O-CG1 3.39Å; L237-I241 PolarHBondContact O-N 3.4Å; L237-I241 VanDerWaalsContact O-N 3.09Å; L238-I241 HydrophobicContact CD2-CD1 4.22Å; L238-I241 PolarHBondContact O-N 2.66Å; I241-L244 PolarHBondContact O-N 3.06Å; I241-C245 PolarHBondContact O-N 3Å; I241-C245 PolarHBondContact O-SG 3.11Å; I241-V266 HydrophobicContact CG2-CG1 3.65Å
242	V	95.8	Very high	93.8	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-63.8	-45.3	-179.9	171.5	0	0	0	0	111.2	L238 L244 C245 V246 L271 M274 I295	L238-V242 WeakPolarHBondContact O-CG2 3.36Å; L238-V242 PolarHBondContact O-N 2.94Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 3.34Å; V242-C245 PolarHBondContact O-N 3.12Å; V242-V246 WeakPolarHBondContact O-CG2 3.25Å; V242-V246 PolarHBondContact O-N 3.08Å; V242-L271 HydrophobicContact CG1-CD2 4.46Å; V242-M274 HydrophobicContact CG2-SD 4.22Å; V242-I295 HydrophobicContact CG1-CD1 3.7Å
243	N	94.4	Very high	93.9	Very high	50 Å²	50	32.1 Å²	32.1	27%	0.267	16%	0.155	S	C	.	.	H	α-helix	trans	-62.8	-39.6	178.4	-75.6	-20.7	0	0	0	112.1	A239 D240 C245 V246 D247 R289	A239-N243 VanDerWaalsContact O-CB 3.25Å; A239-N243 WeakPolarHBondContact O-CB 3.37Å; A239-N243 PolarHBondContact O-N 3.05Å; A239-N243 PolarHBondContact O-ND2 2.78Å; D240-N243 PolarHBondContact O-N 3.32Å; N243-C245 VanDerWaalsContact C-N 3.35Å; N243-V246 WeakPolarHBondContact O-CB 3.26Å; N243-V246 PolarHBondContact O-N 3.26Å; N243-D247 PolarHBondContact O-N 2.94Å; N243-R289 PolarHBondContact ND2-NH1 3.21Å; N243-R289 VanDerWaalsContact ND2-NH1 3.14Å; N243-R289 PolarHBondContact ND2-O 2.98Å
244	L	94.4	Very high	94.1	Very high	17 Å²	17	32.8 Å²	32.8	9%	0.089	16%	0.155	C	C	.	.	H	α-helix	trans	-63.1	-42.7	175	-177.2	62.8	0	0	0	111.4	E155 L158 I159 D240 I241 V242 V246 D247 Y248	E155-L244 HydrophobicContact CB-CD1 4.23Å; E155-L244 HydrophobicContact CB-CD2 3.86Å; E155-L244 HydrophobicContact CG-CD1 3.69Å; E155-L244 HydrophobicContact CG-CD2 4.08Å; E155-L244 WeakPolarHBondContact O-CD2 3.41Å; L158-L244 HydrophobicContact CB-CD2 3.76Å; L158-L244 HydrophobicContact CD1-CD2 4.2Å; I159-L244 HydrophobicContact CD1-CD2 3.89Å; I159-L244 HydrophobicContact CD1-CG 4.17Å; I159-L244 HydrophobicContact CG1-CD2 3.87Å; D240-L244 WeakPolarHBondContact O-CB 3.42Å; D240-L244 PolarHBondContact O-N 3.21Å; I241-L244 PolarHBondContact O-N 3.06Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 3.34Å; L244-V246 VanDerWaalsContact C-N 3.29Å; L244-V246 PolarHBondContact O-N 2.86Å; L244-D247 PolarHBondContact O-N 3.48Å; L244-Y248 HydrophobicContact CD1-CD1 3.68Å; L244-Y248 HydrophobicContact CD1-CE1 3.31Å; L244-Y248 HydrophobicContact CG-CD1 4.18Å; L244-Y248 HydrophobicContact CG-CE1 4.05Å; L244-Y248 WeakPolarHBondContact O-CB 3.24Å; L244-Y248 WeakPolarHBondContact O-CD1 3.37Å; L244-Y248 PolarHBondContact O-N 3.17Å
245	C	95.7	Very high	94.1	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.007	16%	0.156	C	C	.	.	H	α-helix	trans	-62.7	-39.4	176.3	-65.1	0	0	0	0	111.6	I241 V242 N243 Y248 Y249 L263 V266 M267	I241-C245 PolarHBondContact O-N 3Å; I241-C245 PolarHBondContact O-SG 3.11Å; V242-C245 PolarHBondContact O-N 3.12Å; N243-C245 VanDerWaalsContact C-N 3.35Å; C245-Y248 PolarHBondContact O-N 3.25Å; C245-Y249 WeakPolarHBondContact O-CB 3.49Å; C245-Y249 PolarHBondContact O-N 3.32Å; C245-L263 HydrophobicContact CB-CB 4.31Å; C245-L263 HydrophobicContact CB-CD2 4.17Å; C245-V266 VanDerWaalsContact SG-CG1 3.52Å; C245-M267 HydrophobicContact CB-CE 3.93Å; C245-M267 HydrophobicContact CB-CG 4.01Å; C245-M267 WeakPolarHBondContact O-CE 3.49Å
246	V	95.6	Very high	94.3	Very high	10 Å²	10	31.3 Å²	31.3	6%	0.061	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-47.1	177	164.3	0	0	0	0	110.4	V242 N243 L244 Y249 E250 M267 K294 I295 Y298	V242-V246 WeakPolarHBondContact O-CG2 3.25Å; V242-V246 PolarHBondContact O-N 3.08Å; N243-V246 WeakPolarHBondContact O-CB 3.26Å; N243-V246 PolarHBondContact O-N 3.26Å; L244-V246 VanDerWaalsContact C-N 3.29Å; L244-V246 PolarHBondContact O-N 2.86Å; V246-Y249 PolarHBondContact O-N 3.1Å; V246-E250 WeakPolarHBondContact O-CB 3.5Å; V246-E250 PolarHBondContact O-N 2.72Å; V246-M267 HydrophobicContact CG2-CE 4.1Å; V246-M267 HydrophobicContact CG2-CG 4.21Å; V246-M267 HydrophobicContact CG2-SD 3.85Å; V246-K294 HydrophobicContact CG1-CB 4.24Å; V246-K294 HydrophobicContact CG1-CD 3.8Å; V246-I295 HydrophobicContact CG2-CD1 3.96Å; V246-I295 HydrophobicContact CG2-CG1 3.63Å; V246-Y298 HydrophobicContact CG1-CE2 4.14Å
247	D	93.8	Very high	94.4	Very high	77 Å²	77	29.4 Å²	29.4	41%	0.412	14%	0.141	S	C	.	.	H	α-helix	trans	-60.4	-49	176.1	-173.3	78.8	0	0	0	111.1	N243 L244 Y249 E250 N251	N243-D247 PolarHBondContact O-N 2.94Å; L244-D247 PolarHBondContact O-N 3.48Å; D247-Y249 VanDerWaalsContact C-N 3.32Å; D247-Y249 PolarHBondContact O-N 3.3Å; D247-E250 PolarHBondContact O-N 2.82Å; D247-N251 WeakPolarHBondContact O-CB 3.33Å; D247-N251 PolarHBondContact O-N 3.32Å; D247-N251 PolarHBondContact O-OD1 2.83Å; D247-N251 VanDerWaalsContact O-OD1 3.05Å; D247-N251 PolarHBondContact OD1-OD1 2.87Å
248	Y	95.7	Very high	94.4	Very high	16 Å²	16	32.2 Å²	32.2	6%	0.063	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-39.6	180	-83.5	26	0	0	0	112.5	E155 I159 L244 C245 R252 M253 L263 F600	E155-Y248 PolarHBondContact OE2-OH 2.79Å; I159-Y248 HydrophobicContact CD1-CD2 4.03Å; I159-Y248 HydrophobicContact CD1-CE2 4.1Å; I159-Y248 HydrophobicContact CG1-CD2 4.4Å; I159-Y248 HydrophobicContact CG1-CE2 3.97Å; L244-Y248 HydrophobicContact CD1-CD1 3.68Å; L244-Y248 HydrophobicContact CD1-CE1 3.31Å; L244-Y248 HydrophobicContact CG-CD1 4.18Å; L244-Y248 HydrophobicContact CG-CE1 4.05Å; L244-Y248 WeakPolarHBondContact O-CB 3.24Å; L244-Y248 WeakPolarHBondContact O-CD1 3.37Å; L244-Y248 PolarHBondContact O-N 3.17Å; C245-Y248 PolarHBondContact O-N 3.25Å; Y248-R252 PolarHBondContact O-N 3.09Å; Y248-R252 VanDerWaalsContact O-N 3.1Å; Y248-M253 HydrophobicContact CD1-CB 3.81Å; Y248-M253 HydrophobicContact CD1-CG 4.08Å; Y248-M253 HydrophobicContact CD2-CB 3.91Å; Y248-M253 WeakPolarHBondContact CD2-O 3.44Å; Y248-M253 HydrophobicContact CE1-CB 4.27Å; Y248-M253 HydrophobicContact CE1-CG 4.47Å; Y248-M253 HydrophobicContact CE2-CB 4.38Å; Y248-M253 HydrophobicContact CG-CB 3.6Å; Y248-M253 HydrophobicContact CG-CG 4.35Å; Y248-M253 PolarHBondContact O-N 2.86Å; Y248-L263 HydrophobicContact CD2-CD2 4.49Å; Y248-F600 HydrophobicContact CD2-CE2 4.49Å; Y248-F600 AromaticContact CE2-CE2 3.74Å; Y248-F600 HydrophobicContact CE2-CE2 3.74Å; Y248-F600 HydrophobicContact CE2-CZ 4.18Å
249	Y	94.9	Very high	94.5	Very high	17 Å²	17	34.9 Å²	34.9	7%	0.067	17%	0.174	C	C	.	.	H	α-helix	trans	-69.1	-42.9	178.2	-170.9	-96.5	0	0	0	111.8	C245 V246 D247 Y254 K260 L263 L264 M267 Y298	C245-Y249 WeakPolarHBondContact O-CB 3.49Å; C245-Y249 PolarHBondContact O-N 3.32Å; V246-Y249 PolarHBondContact O-N 3.1Å; D247-Y249 VanDerWaalsContact C-N 3.32Å; D247-Y249 PolarHBondContact O-N 3.3Å; Y249-Y254 HydrophobicContact CD2-CE1 4.2Å; Y249-K260 HydrophobicContact CD2-CG 4.39Å; Y249-K260 HydrophobicContact CE2-CG 3.82Å; Y249-L263 HydrophobicContact CD2-CD1 4.44Å; Y249-L264 HydrophobicContact CD1-CD2 4.43Å; Y249-L264 HydrophobicContact CD2-CD2 4.01Å; Y249-L264 HydrophobicContact CD2-CG 4.16Å; Y249-L264 HydrophobicContact CE1-CD2 4.32Å; Y249-L264 HydrophobicContact CE2-CD1 3.87Å; Y249-L264 HydrophobicContact CE2-CD2 3.88Å; Y249-L264 HydrophobicContact CE2-CG 3.9Å; Y249-L264 HydrophobicContact CG-CD2 4.29Å; Y249-M267 HydrophobicContact CG-CE 4.32Å; Y249-Y298 AromaticContact CD1-CD1 3.85Å; Y249-Y298 HydrophobicContact CD1-CD1 3.85Å; Y249-Y298 AromaticContact CD1-CD2 3.75Å; Y249-Y298 HydrophobicContact CD1-CD2 3.75Å; Y249-Y298 HydrophobicContact CD1-CE1 4.04Å; Y249-Y298 AromaticContact CD1-CE2 3.93Å; Y249-Y298 HydrophobicContact CD1-CE2 3.93Å; Y249-Y298 AromaticContact CD1-CG 3.73Å; Y249-Y298 HydrophobicContact CD1-CG 3.73Å; Y249-Y298 AromaticContact CE1-CD1 3.74Å; Y249-Y298 HydrophobicContact CE1-CD1 3.74Å; Y249-Y298 HydrophobicContact CE1-CD2 4.25Å; Y249-Y298 HydrophobicContact CE1-CE1 4.27Å; Y249-Y298 AromaticContact CE1-CG 3.75Å; Y249-Y298 HydrophobicContact CE1-CG 3.75Å
250	E	94.4	Very high	94.6	Very high	87 Å²	87	36.2 Å²	36.2	41%	0.407	18%	0.18	S	C	.	.	H	α-helix	trans	-64.5	-42.8	179.1	-168.5	170.1	-143.9	0	0	112.1	V246 D247 K294 Y298	V246-E250 WeakPolarHBondContact O-CB 3.5Å; V246-E250 PolarHBondContact O-N 2.72Å; D247-E250 PolarHBondContact O-N 2.82Å; E250-K294 VanDerWaalsContact OE1-CE 3.26Å; E250-K294 WeakPolarHBondContact OE1-CE 3.01Å; E250-K294 IonicContact OE1-NZ 2.82Å; E250-K294 PolarHBondContact OE1-NZ 2.87Å; E250-K294 IonicContact OE2-NZ 3.66Å; E250-K294 PolarHBondContact OE2-NZ 3.08Å; E250-Y298 WeakPolarHBondContact CB-OH 3.41Å
251	N	92.4	Very high	94.8	Very high	91 Å²	91	34.8 Å²	34.8	49%	0.487	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	7.8	-174.5	-64.9	98.1	0	0	0	114.2	D247 M253	D247-N251 WeakPolarHBondContact O-CB 3.33Å; D247-N251 PolarHBondContact O-N 3.32Å; D247-N251 PolarHBondContact O-OD1 2.83Å; D247-N251 VanDerWaalsContact O-OD1 3.05Å; D247-N251 PolarHBondContact OD1-OD1 2.87Å; N251-M253 VanDerWaalsContact C-N 3.31Å; N251-M253 HydrophobicContact CB-CG 4.15Å; N251-M253 PolarHBondContact O-N 2.84Å
252	R	92.8	Very high	94.9	Very high	140 Å²	140	36.7 Å²	36.7	53%	0.528	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	37.3	179.5	-53.1	-64.3	-167.7	129.8	8.7	113.4	Y248 Y254	Y248-R252 PolarHBondContact O-N 3.09Å; Y248-R252 VanDerWaalsContact O-N 3.1Å; R252-Y254 WeakPolarHBondContact CD-OH 3.36Å; R252-Y254 PolarHBondContact NH1-OH 2.83Å; R252-Y254 PolarHBondContact O-N 3.34Å
253	M	93.3	Very high	94.9	Very high	21 Å²	21	37.1 Å²	37.1	10%	0.103	18%	0.184	C	C	.	.			trans	-82.6	58.9	174.1	-54	-59	-63.9	0	0	110.7	Y248 N251 R597 F600	Y248-M253 HydrophobicContact CD1-CB 3.81Å; Y248-M253 HydrophobicContact CD1-CG 4.08Å; Y248-M253 HydrophobicContact CD2-CB 3.91Å; Y248-M253 WeakPolarHBondContact CD2-O 3.44Å; Y248-M253 HydrophobicContact CE1-CB 4.27Å; Y248-M253 HydrophobicContact CE1-CG 4.47Å; Y248-M253 HydrophobicContact CE2-CB 4.38Å; Y248-M253 HydrophobicContact CG-CB 3.6Å; Y248-M253 HydrophobicContact CG-CG 4.35Å; Y248-M253 PolarHBondContact O-N 2.86Å; N251-M253 VanDerWaalsContact C-N 3.31Å; N251-M253 HydrophobicContact CB-CG 4.15Å; N251-M253 PolarHBondContact O-N 2.84Å; M253-R597 HydrophobicContact CE-CG 4.24Å; M253-R597 HydrophobicContact SD-CG 4.2Å; M253-F600 VanDerWaalsContact C-CE1 3.49Å; M253-F600 HydrophobicContact CB-CE1 4.25Å; M253-F600 HydrophobicContact CB-CE2 4.33Å; M253-F600 HydrophobicContact CB-CZ 4.04Å; M253-F600 HydrophobicContact CE-CB 3.6Å; M253-F600 HydrophobicContact CE-CD1 3.82Å; M253-F600 HydrophobicContact CE-CD2 3.57Å; M253-F600 HydrophobicContact CE-CE1 4.39Å; M253-F600 HydrophobicContact CE-CE2 4.16Å; M253-F600 HydrophobicContact CE-CG 3.38Å; M253-F600 WeakPolarHBondContact O-CZ 3.43Å
254	Y	95.6	Very high	95	Very high	20 Å²	20	34.8 Å²	34.8	8%	0.078	17%	0.171	C	C	.	.			trans	-157.8	159.8	175.1	56.7	-96.9	0	0	0	108.2	Y249 R252 K260 L263	Y249-Y254 HydrophobicContact CD2-CE1 4.2Å; R252-Y254 WeakPolarHBondContact CD-OH 3.36Å; R252-Y254 PolarHBondContact NH1-OH 2.83Å; R252-Y254 PolarHBondContact O-N 3.34Å; Y254-K260 HydrophobicContact CD2-CB 3.69Å; Y254-K260 HydrophobicContact CD2-CG 4.26Å; Y254-K260 HydrophobicContact CE1-CG 4.41Å; Y254-K260 HydrophobicContact CE2-CB 3.72Å; Y254-K260 HydrophobicContact CE2-CD 4.06Å; Y254-K260 HydrophobicContact CE2-CG 3.79Å; Y254-K260 HydrophobicContact CG-CB 4.19Å; Y254-L263 HydrophobicContact CD1-CD1 3.83Å; Y254-L263 HydrophobicContact CG-CD1 4.5Å
255	L	93.4	Very high	95.1	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.016	17%	0.17	C	C	.	.			trans	-122.8	-49.8	177	-172	58.8	0	0	0	112.4	E259 L395 L398 Q399 S402 F601 H604 T611	L255-E259 PolarHBondContact N-OE2 3.04Å; L255-L395 HydrophobicContact CD1-CD1 4.03Å; L255-L398 HydrophobicContact CD1-CB 4.12Å; L255-L398 HydrophobicContact CD2-CB 4.43Å; L255-L398 HydrophobicContact CD2-CD1 4.27Å; L255-Q399 HydrophobicContact CD1-CB 4.48Å; L255-Q399 HydrophobicContact CD1-CG 3.54Å; L255-S402 WeakPolarHBondContact O-CB 3.49Å; L255-S402 PolarHBondContact O-OG 3.45Å; L255-F601 HydrophobicContact CB-CD1 4.38Å; L255-F601 HydrophobicContact CB-CE1 4.34Å; L255-H604 HydrophobicContact CD2-CB 3.52Å; L255-T611 HydrophobicContact CD2-CG2 3.43Å; L255-T611 VanDerWaalsContact CD2-CG2 3.43Å; L255-T611 HydrophobicContact CG-CG2 4.25Å
256	T	95.8	Very high	95.2	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	17%	0.171	C	C	.	.	S	Bend	trans	-86.9	157.7	-175.6	66.1	0	0	0	0	112.4	S258 E259 K260 Q614	T256-S258 VanDerWaalsContact C-N 3.29Å; T256-S258 PolarHBondContact O-N 2.97Å; T256-S258 PolarHBondContact OG1-OG 3.05Å; T256-S258 VanDerWaalsContact OG1-OG 3.07Å; T256-E259 PolarHBondContact N-OE2 3.1Å; T256-E259 PolarHBondContact O-N 3.49Å; T256-E259 WeakPolarHBondContact OG1-CG 3.21Å; T256-E259 PolarHBondContact OG1-N 2.99Å; T256-E259 PolarHBondContact OG1-OE2 3.39Å; T256-K260 PolarHBondContact O-N 2.98Å; T256-K260 VanDerWaalsContact O-N 3.12Å; T256-Q614 HydrophobicContact CG2-CB 3.72Å
257	P	95.9	Very high	95.2	Very high	13 Å²	13	34.4 Å²	34.4	8%	0.084	17%	0.168	C	C	.	.	H	α-helix	trans	-58.1	-40.5	175.2	-25.1	35.2	0	0	0	112.5	E259 K260 H261 S402 A406	P257-E259 VanDerWaalsContact C-N 3.34Å; P257-E259 PolarHBondContact O-N 3.08Å; P257-K260 WeakPolarHBondContact O-CB 3.48Å; P257-K260 PolarHBondContact O-N 3.32Å; P257-H261 VanDerWaalsContact O-CG 3.23Å; P257-H261 PolarHBondContact O-N 2.97Å; P257-H261 PolarHBondContact O-ND1 2.84Å; P257-S402 WeakPolarHBondContact CD-OG 3.25Å; P257-A406 HydrophobicContact CB-CB 4.14Å; P257-A406 HydrophobicContact CG-CB 4.35Å
258	S	93.3	Very high	95.3	Very high	71 Å²	71	30.7 Å²	30.7	50%	0.497	15%	0.148	S	C	.	.	H	α-helix	trans	-62.4	-38	177.7	45.2	0	0	0	0	113.1	T256 M262	T256-S258 VanDerWaalsContact C-N 3.29Å; T256-S258 PolarHBondContact O-N 2.97Å; T256-S258 PolarHBondContact OG1-OG 3.05Å; T256-S258 VanDerWaalsContact OG1-OG 3.07Å; S258-M262 VanDerWaalsContact O-CB 3.27Å; S258-M262 WeakPolarHBondContact O-CB 3.46Å; S258-M262 PolarHBondContact O-N 3.34Å
259	E	94.8	Very high	95.3	Very high	57 Å²	57	30.2 Å²	30.2	27%	0.266	15%	0.146	S	C	.	.	H	α-helix	trans	-65.8	-46.3	174.8	-73.9	168	161.4	0	0	110.9	L255 T256 P257 H261 M262 L263 H604	L255-E259 PolarHBondContact N-OE2 3.04Å; T256-E259 PolarHBondContact N-OE2 3.1Å; T256-E259 PolarHBondContact O-N 3.49Å; T256-E259 WeakPolarHBondContact OG1-CG 3.21Å; T256-E259 PolarHBondContact OG1-N 2.99Å; T256-E259 PolarHBondContact OG1-OE2 3.39Å; P257-E259 VanDerWaalsContact C-N 3.34Å; P257-E259 PolarHBondContact O-N 3.08Å; E259-H261 VanDerWaalsContact C-N 3.34Å; E259-H261 PolarHBondContact O-N 3.47Å; E259-M262 WeakPolarHBondContact O-CB 3.3Å; E259-M262 PolarHBondContact O-N 2.94Å; E259-L263 WeakPolarHBondContact O-CG 3.48Å; E259-L263 PolarHBondContact O-N 3.17Å; E259-H604 IonicContact OE1-CD2 2.73Å; E259-H604 IonicContact OE1-CE1 2.85Å; E259-H604 IonicContact OE1-NE2 2.83Å; E259-H604 PolarHBondContact OE1-NE2 3.17Å; E259-H604 IonicContact OE2-NE2 2.69Å
260	K	96.8	Very high	95.4	Very high	27 Å²	27	29.4 Å²	29.4	12%	0.117	14%	0.144	C	C	.	.	H	α-helix	trans	-54.4	-50	175.2	179.4	-169.1	173.9	-165.1	0	111.2	Y249 Y254 T256 P257 L263 E410	Y249-K260 HydrophobicContact CD2-CG 4.39Å; Y249-K260 HydrophobicContact CE2-CG 3.82Å; Y254-K260 HydrophobicContact CD2-CB 3.69Å; Y254-K260 HydrophobicContact CD2-CG 4.26Å; Y254-K260 HydrophobicContact CE1-CG 4.41Å; Y254-K260 HydrophobicContact CE2-CB 3.72Å; Y254-K260 HydrophobicContact CE2-CD 4.06Å; Y254-K260 HydrophobicContact CE2-CG 3.79Å; Y254-K260 HydrophobicContact CG-CB 4.19Å; T256-K260 PolarHBondContact O-N 2.98Å; T256-K260 VanDerWaalsContact O-N 3.12Å; P257-K260 WeakPolarHBondContact O-CB 3.48Å; P257-K260 PolarHBondContact O-N 3.32Å; K260-L263 PolarHBondContact O-N 3.21Å; K260-E410 IonicContact NZ-OE1 2.67Å; K260-E410 PolarHBondContact NZ-OE1 3.27Å; K260-E410 IonicContact NZ-OE2 3.51Å; K260-E410 PolarHBondContact NZ-OE2 3.24Å
261	H	96.8	Very high	95.5	Very high	9 Å²	9	25.3 Å²	25.3	4%	0.042	12%	0.124	C	C	.	.	H	α-helix	trans	-69.7	-32.9	-178.3	-59.9	158.6	0	0	0	112.4	P257 E259 L263 L264 K265 V305 E410	P257-H261 VanDerWaalsContact O-CG 3.23Å; P257-H261 PolarHBondContact O-N 2.97Å; P257-H261 PolarHBondContact O-ND1 2.84Å; E259-H261 VanDerWaalsContact C-N 3.34Å; E259-H261 PolarHBondContact O-N 3.47Å; H261-L263 VanDerWaalsContact C-N 3.34Å; H261-L263 PolarHBondContact O-N 3.09Å; H261-L264 PolarHBondContact O-N 2.87Å; H261-K265 WeakPolarHBondContact O-CG 3.31Å; H261-K265 PolarHBondContact O-N 2.71Å; H261-K265 VanDerWaalsContact O-N 3.08Å; H261-V305 HydrophobicContact CB-CB 4.08Å; H261-V305 HydrophobicContact CB-CG1 4.24Å; H261-V305 HydrophobicContact CB-CG2 4.44Å; H261-E410 IonicContact CD2-OE1 3.48Å; H261-E410 IonicContact CE1-OE1 2.72Å; H261-E410 IonicContact NE2-OE1 3.5Å; H261-E410 PolarHBondContact NE2-OE1 2.89Å
262	M	96.3	Very high	95.7	Very high	41 Å²	41	23.3 Å²	23.3	20%	0.202	11%	0.11	C	C	.	.	H	α-helix	trans	-57.8	-45.4	175.2	-179.2	65.1	67	0	0	111.5	K163 N166 S258 E259 L264 K265 V266	K163-M262 HydrophobicContact CG-CE 4.35Å; K163-M262 HydrophobicContact CG-CG 4.27Å; K163-M262 HydrophobicContact CG-SD 4.18Å; N166-M262 HydrophobicContact CB-CE 4.44Å; N166-M262 HydrophobicContact CB-SD 3.55Å; N166-M262 VanDerWaalsContact CB-SD 3.55Å; N166-M262 WeakPolarHBondContact ND2-CE 3.45Å; S258-M262 VanDerWaalsContact O-CB 3.27Å; S258-M262 WeakPolarHBondContact O-CB 3.46Å; S258-M262 PolarHBondContact O-N 3.34Å; E259-M262 WeakPolarHBondContact O-CB 3.3Å; E259-M262 PolarHBondContact O-N 2.94Å; M262-L264 VanDerWaalsContact C-N 3.28Å; M262-L264 PolarHBondContact O-N 3.36Å; M262-K265 PolarHBondContact O-N 2.88Å; M262-V266 HydrophobicContact CG-CG2 4.2Å; M262-V266 WeakPolarHBondContact O-CB 3.37Å; M262-V266 VanDerWaalsContact O-CG2 3.27Å; M262-V266 WeakPolarHBondContact O-CG2 3.37Å; M262-V266 PolarHBondContact O-N 2.68Å; M262-V266 HydrophobicContact SD-CG2 4Å
263	L	96.8	Very high	95.8	Very high	11 Å²	11	16.8 Å²	16.8	6%	0.058	9%	0.086	C	C	.	.	H	α-helix	trans	-55.9	-44.5	179.6	-59.6	176.8	0	0	0	111.6	I159 C245 Y248 Y249 Y254 E259 K260 H261 V266 M267	I159-L263 HydrophobicContact CD1-CD2 4.17Å; C245-L263 HydrophobicContact CB-CB 4.31Å; C245-L263 HydrophobicContact CB-CD2 4.17Å; Y248-L263 HydrophobicContact CD2-CD2 4.49Å; Y249-L263 HydrophobicContact CD2-CD1 4.44Å; Y254-L263 HydrophobicContact CD1-CD1 3.83Å; Y254-L263 HydrophobicContact CG-CD1 4.5Å; E259-L263 WeakPolarHBondContact O-CG 3.48Å; E259-L263 PolarHBondContact O-N 3.17Å; K260-L263 PolarHBondContact O-N 3.21Å; H261-L263 VanDerWaalsContact C-N 3.34Å; H261-L263 PolarHBondContact O-N 3.09Å; L263-V266 PolarHBondContact O-N 3.22Å; L263-M267 HydrophobicContact CB-CE 4.2Å; L263-M267 VanDerWaalsContact O-CG 3.28Å; L263-M267 WeakPolarHBondContact O-CG 3.46Å; L263-M267 PolarHBondContact O-N 3.4Å
264	L	96.8	Very high	95.9	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.8	-39.7	179.9	-62.6	175.5	0	0	0	112.5	Y249 H261 M262 M267 G268 F299 L302 V305 L315	Y249-L264 HydrophobicContact CD1-CD2 4.43Å; Y249-L264 HydrophobicContact CD2-CD2 4.01Å; Y249-L264 HydrophobicContact CD2-CG 4.16Å; Y249-L264 HydrophobicContact CE1-CD2 4.32Å; Y249-L264 HydrophobicContact CE2-CD1 3.87Å; Y249-L264 HydrophobicContact CE2-CD2 3.88Å; Y249-L264 HydrophobicContact CE2-CG 3.9Å; Y249-L264 HydrophobicContact CG-CD2 4.29Å; H261-L264 PolarHBondContact O-N 2.87Å; M262-L264 VanDerWaalsContact C-N 3.28Å; M262-L264 PolarHBondContact O-N 3.36Å; L264-M267 HydrophobicContact CD2-CE 4.16Å; L264-M267 HydrophobicContact CD2-SD 4.1Å; L264-M267 PolarHBondContact O-N 3.08Å; L264-G268 PolarHBondContact O-N 3.1Å; L264-F299 HydrophobicContact CB-CE1 4.2Å; L264-F299 HydrophobicContact CD2-CD1 4.36Å; L264-F299 HydrophobicContact CD2-CE1 4.18Å; L264-L302 HydrophobicContact CD1-CB 4.33Å; L264-L302 HydrophobicContact CD1-CD2 3.64Å; L264-L302 HydrophobicContact CD1-CG 4.16Å; L264-V305 HydrophobicContact CD1-CG1 4.42Å; L264-L315 HydrophobicContact CB-CD1 3.84Å; L264-L315 HydrophobicContact CB-CD2 4.13Å; L264-L315 HydrophobicContact CD1-CD1 4.04Å; L264-L315 HydrophobicContact CG-CD1 4.48Å
265	K	96.1	Very high	95.9	Very high	17 Å²	17	15 Å²	15	7%	0.074	8%	0.078	C	C	.	.	H	α-helix	trans	-62.9	-42.8	175.3	-70.4	-176.4	-68.2	-164.9	0	111.6	N166 H261 M262 G268 F269 V305 P306 L307 I313 L315	N166-K265 WeakPolarHBondContact OD1-CB 3.47Å; N166-K265 WeakPolarHBondContact OD1-CD 3.08Å; N166-K265 WeakPolarHBondContact OD1-CE 3.48Å; H261-K265 WeakPolarHBondContact O-CG 3.31Å; H261-K265 PolarHBondContact O-N 2.71Å; H261-K265 VanDerWaalsContact O-N 3.08Å; M262-K265 PolarHBondContact O-N 2.88Å; K265-G268 PolarHBondContact O-N 2.69Å; K265-F269 PolarHBondContact O-N 2.92Å; K265-V305 HydrophobicContact CD-CG2 4.24Å; K265-V305 HydrophobicContact CG-CG2 3.9Å; K265-P306 PolarHBondContact NZ-O 3.26Å; K265-L307 HydrophobicContact CD-CD1 3.99Å; K265-I313 HydrophobicContact CD-CG2 4.04Å; K265-I313 HydrophobicContact CG-CG2 4.05Å; K265-L315 HydrophobicContact CG-CD2 4.37Å
266	V	97.1	Very high	95.8	Very high	3 Å²	3	15.3 Å²	15.3	2%	0.018	8%	0.082	C	C	.	.	H	α-helix	trans	-64.9	-41.4	176.4	174.3	0	0	0	0	111.4	G162 I165 N166 I241 C245 M262 L263 G270	G162-V266 WeakPolarHBondContact O-CG2 3.45Å; I165-V266 HydrophobicContact CD1-CG1 4.07Å; I165-V266 HydrophobicContact CG1-CG1 4.45Å; N166-V266 HydrophobicContact CB-CG2 4.29Å; I241-V266 HydrophobicContact CG2-CG1 3.65Å; C245-V266 VanDerWaalsContact SG-CG1 3.52Å; M262-V266 HydrophobicContact CG-CG2 4.2Å; M262-V266 WeakPolarHBondContact O-CB 3.37Å; M262-V266 VanDerWaalsContact O-CG2 3.27Å; M262-V266 WeakPolarHBondContact O-CG2 3.37Å; M262-V266 PolarHBondContact O-N 2.68Å; M262-V266 HydrophobicContact SD-CG2 4Å; L263-V266 PolarHBondContact O-N 3.22Å; V266-G270 WeakPolarHBondContact O-CA 3.24Å; V266-G270 PolarHBondContact O-N 2.94Å
267	M	97.2	Very high	95.5	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-57.6	-50	172.6	-69.9	174.3	-148.5	0	0	111.4	C245 V246 Y249 L263 L264 L271 I295 Y298 F299	C245-M267 HydrophobicContact CB-CE 3.93Å; C245-M267 HydrophobicContact CB-CG 4.01Å; C245-M267 WeakPolarHBondContact O-CE 3.49Å; V246-M267 HydrophobicContact CG2-CE 4.1Å; V246-M267 HydrophobicContact CG2-CG 4.21Å; V246-M267 HydrophobicContact CG2-SD 3.85Å; Y249-M267 HydrophobicContact CG-CE 4.32Å; L263-M267 HydrophobicContact CB-CE 4.2Å; L263-M267 VanDerWaalsContact O-CG 3.28Å; L263-M267 WeakPolarHBondContact O-CG 3.46Å; L263-M267 PolarHBondContact O-N 3.4Å; L264-M267 HydrophobicContact CD2-CE 4.16Å; L264-M267 HydrophobicContact CD2-SD 4.1Å; L264-M267 PolarHBondContact O-N 3.08Å; M267-L271 WeakPolarHBondContact O-CB 3.47Å; M267-L271 VanDerWaalsContact O-CG 3.29Å; M267-L271 WeakPolarHBondContact O-CG 3.44Å; M267-L271 PolarHBondContact O-N 3.43Å; M267-I295 HydrophobicContact CB-CG2 4.31Å; M267-I295 HydrophobicContact SD-CG1 4.2Å; M267-I295 HydrophobicContact SD-CG2 4.46Å; M267-Y298 HydrophobicContact CE-CD2 4.36Å; M267-Y298 HydrophobicContact SD-CD2 4.13Å; M267-F299 HydrophobicContact CB-CE1 4.41Å; M267-F299 HydrophobicContact CB-CZ 4.23Å
268	G	94.9	Very high	95.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.6	-54.4	-175.4	0	0	0	0	0	112.2	L264 K265 L271 Y272 Y318	L264-G268 PolarHBondContact O-N 3.1Å; K265-G268 PolarHBondContact O-N 2.69Å; G268-L271 PolarHBondContact O-N 2.76Å; G268-Y272 PolarHBondContact O-N 3.44Å; G268-Y272 VanDerWaalsContact O-N 3.07Å; G268-Y318 WeakPolarHBondContact O-CB 3.37Å
269	F	96.7	Very high	95.4	Very high	5 Å²	5	20.9 Å²	20.9	2%	0.022	12%	0.117	C	C	.	.	H	α-helix	trans	-72.3	-30.8	-178.7	-164.4	-131.1	0	0	0	112.5	I165 A169 T221 L224 K265 Y272 L273 Y318	I165-F269 HydrophobicContact CB-CD1 4.04Å; I165-F269 HydrophobicContact CB-CE1 4.45Å; I165-F269 WeakPolarHBondContact O-CD1 3.27Å; I165-F269 WeakPolarHBondContact O-CE1 3.33Å; A169-F269 HydrophobicContact CB-CD1 3.86Å; A169-F269 HydrophobicContact CB-CD2 4.48Å; A169-F269 HydrophobicContact CB-CE1 3.9Å; A169-F269 HydrophobicContact CB-CG 4.16Å; A169-F269 HydrophobicContact CB-CZ 4.23Å; T221-F269 HydrophobicContact CG2-CE2 3.94Å; T221-F269 HydrophobicContact CG2-CZ 3.89Å; L224-F269 HydrophobicContact CD2-CE1 4.37Å; K265-F269 PolarHBondContact O-N 2.92Å; F269-Y272 AromaticContact CD2-CD1 3.82Å; F269-Y272 HydrophobicContact CD2-CD1 3.82Å; F269-Y272 HydrophobicContact CD2-CG 4.35Å; F269-Y272 AromaticContact CE2-CD1 3.65Å; F269-Y272 HydrophobicContact CE2-CD1 3.65Å; F269-Y272 HydrophobicContact CE2-CE1 4.11Å; F269-Y272 WeakPolarHBondContact O-CB 3.42Å; F269-Y272 PolarHBondContact O-N 2.71Å; F269-L273 HydrophobicContact CD1-CD1 4Å; F269-L273 HydrophobicContact CD1-CG 4.44Å; F269-L273 HydrophobicContact CE1-CD1 3.86Å; F269-L273 HydrophobicContact CE1-CD2 4.49Å; F269-L273 HydrophobicContact CE1-CG 4.28Å; F269-L273 HydrophobicContact CE2-CD2 4.41Å; F269-L273 HydrophobicContact CE2-CG 4.43Å; F269-L273 HydrophobicContact CZ-CD1 4.32Å; F269-L273 HydrophobicContact CZ-CD2 4.14Å; F269-L273 HydrophobicContact CZ-CG 4.29Å; F269-L273 WeakPolarHBondContact O-CG 3.25Å; F269-L273 PolarHBondContact O-N 2.99Å; F269-Y318 HydrophobicContact CB-CD1 4.41Å; F269-Y318 HydrophobicContact CB-CE1 4.01Å; F269-Y318 HydrophobicContact CB-CE2 4.4Å; F269-Y318 AromaticContact CD2-CD1 3.94Å; F269-Y318 HydrophobicContact CD2-CD1 3.94Å; F269-Y318 AromaticContact CD2-CE1 3.5Å; F269-Y318 HydrophobicContact CD2-CE1 3.5Å; F269-Y318 HydrophobicContact CE2-CE1 4.35Å; F269-Y318 HydrophobicContact CG-CE1 4.12Å
270	G	96.1	Very high	95.4	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-61.1	-47.1	172.2	0	0	0	0	0	112.2	V266 Y272 L273 M274	V266-G270 WeakPolarHBondContact O-CA 3.24Å; V266-G270 PolarHBondContact O-N 2.94Å; G270-Y272 VanDerWaalsContact C-N 3.32Å; G270-Y272 PolarHBondContact O-N 3.41Å; G270-L273 PolarHBondContact O-N 3.14Å; G270-M274 WeakPolarHBondContact O-CB 3.5Å; G270-M274 WeakPolarHBondContact O-CG 3.36Å; G270-M274 PolarHBondContact O-N 3.39Å
271	L	95.9	Very high	95.3	Very high	1 Å²	1	18 Å²	18	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-61.8	-40.5	173.8	-71.8	-178.7	0	0	0	112.1	V242 M267 G268 L273 M274 D275 I281 I290 L292 I295 I319 W332	V242-L271 HydrophobicContact CG1-CD2 4.46Å; M267-L271 WeakPolarHBondContact O-CB 3.47Å; M267-L271 VanDerWaalsContact O-CG 3.29Å; M267-L271 WeakPolarHBondContact O-CG 3.44Å; M267-L271 PolarHBondContact O-N 3.43Å; G268-L271 PolarHBondContact O-N 2.76Å; L271-L273 PolarHBondContact O-N 2.8Å; L271-M274 PolarHBondContact O-N 2.93Å; L271-D275 WeakPolarHBondContact O-CB 3.35Å; L271-D275 PolarHBondContact O-N 3.23Å; L271-D275 VanDerWaalsContact O-N 3.13Å; L271-I281 HydrophobicContact CB-CD1 4.49Å; L271-I281 HydrophobicContact CD2-CG2 4.18Å; L271-I290 HydrophobicContact CD2-CD1 3.8Å; L271-L292 HydrophobicContact CD1-CD2 3.92Å; L271-L292 HydrophobicContact CD2-CD2 3.71Å; L271-L292 HydrophobicContact CG-CD2 4.49Å; L271-I295 HydrophobicContact CD1-CD1 3.78Å; L271-I295 HydrophobicContact CD1-CG2 3.95Å; L271-I295 HydrophobicContact CD2-CD1 4.31Å; L271-I295 HydrophobicContact CG-CD1 4.24Å; L271-I319 HydrophobicContact CD1-CD1 3.86Å; L271-W332 HydrophobicContact CD1-CH2 4.14Å
272	Y	96.6	Very high	95.2	Very high	48 Å²	48	18.2 Å²	18.2	19%	0.188	11%	0.105	C	C	.	.	H	α-helix	trans	-60.9	-43.1	176.6	178.2	-95.9	0	0	0	112.4	T221 Q225 G268 F269 G270 D275 Y318 T321	T221-Y272 HydrophobicContact CG2-CE1 3.77Å; Q225-Y272 VanDerWaalsContact NE2-CE1 3.34Å; G268-Y272 PolarHBondContact O-N 3.44Å; G268-Y272 VanDerWaalsContact O-N 3.07Å; F269-Y272 AromaticContact CD2-CD1 3.82Å; F269-Y272 HydrophobicContact CD2-CD1 3.82Å; F269-Y272 HydrophobicContact CD2-CG 4.35Å; F269-Y272 AromaticContact CE2-CD1 3.65Å; F269-Y272 HydrophobicContact CE2-CD1 3.65Å; F269-Y272 HydrophobicContact CE2-CE1 4.11Å; F269-Y272 WeakPolarHBondContact O-CB 3.42Å; F269-Y272 PolarHBondContact O-N 2.71Å; G270-Y272 VanDerWaalsContact C-N 3.32Å; G270-Y272 PolarHBondContact O-N 3.41Å; Y272-D275 PolarHBondContact O-N 3.02Å; Y272-Y318 HydrophobicContact CG-CD1 4.45Å; Y272-T321 WeakPolarHBondContact CE2-O 3.29Å
273	L	95.3	Very high	95.1	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-72.2	-27.8	177.2	-68	175.2	0	0	0	113.2	I165 L224 Q225 L228 Y234 L238 F269 G270 L271 D275	I165-L273 HydrophobicContact CB-CD1 4.22Å; I165-L273 HydrophobicContact CG2-CD1 4.03Å; L224-L273 HydrophobicContact CD2-CD1 3.84Å; L224-L273 HydrophobicContact CD2-CD2 4.19Å; Q225-L273 HydrophobicContact CG-CD2 3.62Å; L228-L273 HydrophobicContact CD1-CD1 4.34Å; Y234-L273 PolarHBondContact OH-O 3.46Å; L238-L273 HydrophobicContact CD1-CB 3.96Å; F269-L273 HydrophobicContact CD1-CD1 4Å; F269-L273 HydrophobicContact CD1-CG 4.44Å; F269-L273 HydrophobicContact CE1-CD1 3.86Å; F269-L273 HydrophobicContact CE1-CD2 4.49Å; F269-L273 HydrophobicContact CE1-CG 4.28Å; F269-L273 HydrophobicContact CE2-CD2 4.41Å; F269-L273 HydrophobicContact CE2-CG 4.43Å; F269-L273 HydrophobicContact CZ-CD1 4.32Å; F269-L273 HydrophobicContact CZ-CD2 4.14Å; F269-L273 HydrophobicContact CZ-CG 4.29Å; F269-L273 WeakPolarHBondContact O-CG 3.25Å; F269-L273 PolarHBondContact O-N 2.99Å; G270-L273 PolarHBondContact O-N 3.14Å; L271-L273 PolarHBondContact O-N 2.8Å; L273-D275 VanDerWaalsContact C-N 3.34Å
274	M	95.3	Very high	94.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-79.5	-15.8	177.3	-71.4	169.2	62.6	0	0	113.6	E235 L238 A239 V242 G270 L271 S279 I281 L284 I290	E235-M274 HydrophobicContact CB-CG 4.47Å; L238-M274 HydrophobicContact CB-CG 3.53Å; L238-M274 HydrophobicContact CB-SD 3.68Å; L238-M274 HydrophobicContact CD1-CG 3.82Å; L238-M274 HydrophobicContact CG-CG 4.34Å; A239-M274 HydrophobicContact CB-CE 3.65Å; A239-M274 HydrophobicContact CB-SD 4.44Å; V242-M274 HydrophobicContact CG2-SD 4.22Å; G270-M274 WeakPolarHBondContact O-CB 3.5Å; G270-M274 WeakPolarHBondContact O-CG 3.36Å; G270-M274 PolarHBondContact O-N 3.39Å; L271-M274 PolarHBondContact O-N 2.93Å; M274-S279 CarbonylContact O-C 3.57Å; M274-S279 WeakPolarHBondContact O-CB 3.23Å; M274-S279 PolarHBondContact O-OG 3.28Å; M274-I281 HydrophobicContact CB-CG2 3.62Å; M274-L284 HydrophobicContact CE-CD1 3.46Å; M274-L284 VanDerWaalsContact CE-CD1 3.46Å; M274-I290 HydrophobicContact CE-CD1 4.23Å; M274-I290 HydrophobicContact CE-CG2 4.15Å
275	D	95.1	Very high	94.7	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.016	13%	0.132	C	C	.	.	S	Bend	trans	-104.6	84.9	-178.1	-159.8	44.3	0	0	0	110.8	L271 Y272 L273 I281 S322 A323 H324	L271-D275 WeakPolarHBondContact O-CB 3.35Å; L271-D275 PolarHBondContact O-N 3.23Å; L271-D275 VanDerWaalsContact O-N 3.13Å; Y272-D275 PolarHBondContact O-N 3.02Å; L273-D275 VanDerWaalsContact C-N 3.34Å; D275-I281 HydrophobicContact CB-CB 4.48Å; D275-I281 HydrophobicContact CB-CD1 4.12Å; D275-I281 HydrophobicContact CB-CG1 4Å; D275-I281 HydrophobicContact CB-CG2 3.85Å; D275-I281 PolarHBondContact OD1-N 2.75Å; D275-S322 VanDerWaalsContact OD2-CB 3.32Å; D275-S322 WeakPolarHBondContact OD2-CB 3.3Å; D275-S322 PolarHBondContact OD2-OG 3.2Å; D275-A323 VanDerWaalsContact O-CB 3.31Å; D275-A323 WeakPolarHBondContact O-CB 3.29Å; D275-A323 PolarHBondContact OD2-N 3.19Å; D275-H324 VanDerWaalsContact CG-ND1 3.32Å; D275-H324 IonicContact OD1-CE1 3.31Å; D275-H324 IonicContact OD1-CG 3.66Å; D275-H324 IonicContact OD1-ND1 2.98Å; D275-H324 PolarHBondContact OD1-ND1 2.95Å; D275-H324 IonicContact OD2-CG 3.9Å; D275-H324 PolarHBondContact OD2-N 3.23Å; D275-H324 IonicContact OD2-ND1 3.76Å; D275-H324 PolarHBondContact OD2-ND1 3.5Å
276	G	92.4	Very high	94.5	Very high	10 Å²	10	27.2 Å²	27.2	10%	0.103	16%	0.16	C	C	.	.	S	Bend	trans	-140	-155.7	-170.7	0	0	0	0	0	113.2	E229 V278 S279 H324	E229-G276 WeakPolarHBondContact OE1-CA 3.49Å; G276-V278 VanDerWaalsContact C-N 3.35Å; G276-V278 PolarHBondContact O-N 2.9Å; G276-S279 PolarHBondContact N-O 2.88Å; G276-H324 PolarHBondContact O-CE1 3.18Å; G276-H324 VanDerWaalsContact O-CE1 3.24Å
277	S	90.4	Very high	94.3	Very high	99 Å²	99	34.8 Å²	34.8	69%	0.692	19%	0.192	S	C	*	.	S	Bend	trans	-72.4	-29.7	-176.8	70.9	0	0	0	0	113.1	E229	E229-S277 VanDerWaalsContact CD-OG 3.27Å; E229-S277 PolarHBondContact OE1-N 2.84Å; E229-S277 PolarHBondContact OE1-OG 3.48Å; E229-S277 PolarHBondContact OE2-OG 2.91Å
278	V	91.9	Very high	94.1	Very high	93 Å²	93	44 Å²	44	56%	0.564	23%	0.232	S	C	*	.	S	Bend	trans	-99.9	-31.2	-174.5	-177.8	0	0	0	0	112.9	E229 G276	E229-V278 HydrophobicContact CB-CG2 4.07Å; E229-V278 HydrophobicContact CG-CG2 4.39Å; G276-V278 VanDerWaalsContact C-N 3.35Å; G276-V278 PolarHBondContact O-N 2.9Å
279	S	93.5	Very high	94	Very high	9 Å²	9	46.1 Å²	46.1	6%	0.063	24%	0.24	C	C	.	.			trans	-125.3	151.7	-174	170.7	0	0	0	0	111.1	E235 M274 G276	E235-S279 WeakPolarHBondContact CB-OG 3.4Å; E235-S279 WeakPolarHBondContact CG-OG 3.29Å; M274-S279 CarbonylContact O-C 3.57Å; M274-S279 WeakPolarHBondContact O-CB 3.23Å; M274-S279 PolarHBondContact O-OG 3.28Å; G276-S279 PolarHBondContact N-O 2.88Å
280	N	95.1	Very high	93.9	Very high	23 Å²	23	46.1 Å²	46.1	12%	0.123	24%	0.241	C	C	.	.			trans	-138.6	120.5	-179.5	178.2	-68.6	0	0	0	110.1	Y282 K283 L284 H324	N280-Y282 VanDerWaalsContact C-N 3.33Å; N280-Y282 PolarHBondContact O-N 3.24Å; N280-Y282 WeakPolarHBondContact OD1-CB 3.3Å; N280-Y282 PolarHBondContact OD1-N 3.25Å; N280-K283 HydrophobicContact CB-CB 4.39Å; N280-K283 HydrophobicContact CB-CD 4.14Å; N280-K283 HydrophobicContact CB-CG 4.29Å; N280-K283 PolarHBondContact O-N 3.43Å; N280-K283 PolarHBondContact OD1-N 2.81Å; N280-L284 PolarHBondContact O-N 3.13Å; N280-H324 PolarHBondContact ND2-CD2 2.94Å; N280-H324 PolarHBondContact ND2-CE1 3.21Å; N280-H324 PolarHBondContact ND2-ND1 3.42Å
281	I	95.6	Very high	93.8	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-66.8	-31.9	-173	58.7	174.4	0	0	0	113.1	L271 M274 D275 K283 L284 D285 I290 L292	L271-I281 HydrophobicContact CB-CD1 4.49Å; L271-I281 HydrophobicContact CD2-CG2 4.18Å; M274-I281 HydrophobicContact CB-CG2 3.62Å; D275-I281 HydrophobicContact CB-CB 4.48Å; D275-I281 HydrophobicContact CB-CD1 4.12Å; D275-I281 HydrophobicContact CB-CG1 4Å; D275-I281 HydrophobicContact CB-CG2 3.85Å; D275-I281 PolarHBondContact OD1-N 2.75Å; I281-K283 PolarHBondContact O-N 2.98Å; I281-L284 WeakPolarHBondContact O-CB 3.07Å; I281-L284 PolarHBondContact O-N 3.19Å; I281-D285 WeakPolarHBondContact O-CB 3.48Å; I281-D285 PolarHBondContact O-N 2.69Å; I281-I290 HydrophobicContact CB-CD1 4.06Å; I281-I290 HydrophobicContact CG2-CD1 4.39Å; I281-L292 HydrophobicContact CD1-CD2 4.41Å
282	Y	94.4	Very high	93.8	Very high	13 Å²	13	49.3 Å²	49.3	5%	0.051	26%	0.257	C	S	.	.	H	α-helix	trans	-70.8	-33.3	179.9	-54.5	-81.8	0	0	0	112	N280 A286 L292 H324 N328 R331 W332	N280-Y282 VanDerWaalsContact C-N 3.33Å; N280-Y282 PolarHBondContact O-N 3.24Å; N280-Y282 WeakPolarHBondContact OD1-CB 3.3Å; N280-Y282 PolarHBondContact OD1-N 3.25Å; Y282-A286 WeakPolarHBondContact O-CB 3.48Å; Y282-A286 PolarHBondContact O-N 2.88Å; Y282-L292 HydrophobicContact CD1-CD1 3.87Å; Y282-L292 HydrophobicContact CE1-CD1 4.23Å; Y282-H324 HydrophobicContact CD2-CB 4.15Å; Y282-H324 HydrophobicContact CE2-CB 3.89Å; Y282-H324 WeakPolarHBondContact CE2-O 3.26Å; Y282-N328 HydrophobicContact CD1-CB 3.8Å; Y282-N328 HydrophobicContact CD2-CB 4.22Å; Y282-N328 HydrophobicContact CE1-CB 3.3Å; Y282-N328 HydrophobicContact CE2-CB 3.81Å; Y282-N328 HydrophobicContact CG-CB 4.2Å; Y282-R331 HydrophobicContact CD1-CG 4.35Å; Y282-R331 HydrophobicContact CE1-CB 4.34Å; Y282-R331 HydrophobicContact CE1-CG 4.3Å; Y282-W332 HydrophobicContact CE1-CZ2 4.44Å; Y282-W332 AromaticContact CE1-NE1 3.58Å; Y282-W332 AromaticContact CZ-NE1 3.74Å; Y282-W332 PolarHBondContact OH-NE1 3.28Å
283	K	93.6	Very high	93.7	Very high	145 Å²	145	50.5 Å²	50.5	63%	0.63	27%	0.273	S	S	*	.	H	α-helix	trans	-70.8	-36.1	171.5	-68.4	179.7	-175.6	167.9	0	111.8	N280 I281 A286 K287	N280-K283 HydrophobicContact CB-CB 4.39Å; N280-K283 HydrophobicContact CB-CD 4.14Å; N280-K283 HydrophobicContact CB-CG 4.29Å; N280-K283 PolarHBondContact O-N 3.43Å; N280-K283 PolarHBondContact OD1-N 2.81Å; I281-K283 PolarHBondContact O-N 2.98Å; K283-A286 PolarHBondContact O-N 3.1Å; K283-K287 WeakPolarHBondContact O-CG 3.45Å; K283-K287 PolarHBondContact O-N 3.05Å
284	L	93.1	Very high	93.7	Very high	10 Å²	10	53.4 Å²	53.4	5%	0.052	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-41.7	173.9	-68.2	173.3	0	0	0	111.2	E235 M274 N280 I281 K287 K288 R289 I290	E235-L284 HydrophobicContact CB-CD1 4.47Å; E235-L284 HydrophobicContact CG-CD1 4.34Å; M274-L284 HydrophobicContact CE-CD1 3.46Å; M274-L284 VanDerWaalsContact CE-CD1 3.46Å; N280-L284 PolarHBondContact O-N 3.13Å; I281-L284 WeakPolarHBondContact O-CB 3.07Å; I281-L284 PolarHBondContact O-N 3.19Å; L284-K287 CarbonylContact O-C 3.6Å; L284-K287 WeakPolarHBondContact O-CB 3.34Å; L284-K287 PolarHBondContact O-N 3.03Å; L284-K288 PolarHBondContact O-N 2.96Å; L284-R289 HydrophobicContact CB-CB 4.24Å; L284-R289 HydrophobicContact CD2-CB 4.37Å; L284-R289 HydrophobicContact CD2-CG 4.23Å; L284-R289 VanDerWaalsContact O-CB 3.3Å; L284-R289 WeakPolarHBondContact O-CB 3.49Å; L284-R289 PolarHBondContact O-N 3.35Å; L284-I290 HydrophobicContact CB-CD1 4.1Å; L284-I290 HydrophobicContact CB-CG1 4.07Å
285	D	93.4	Very high	93.8	Very high	23 Å²	23	53.5 Å²	53.5	12%	0.123	29%	0.286	C	S	.	.	H	α-helix	trans	-62.9	-41.6	173.8	-178.2	82.2	0	0	0	112.4	I281 K287 K288 I290 L292 R331	I281-D285 WeakPolarHBondContact O-CB 3.48Å; I281-D285 PolarHBondContact O-N 2.69Å; D285-K287 PolarHBondContact O-N 3.32Å; D285-K288 VanDerWaalsContact O-CA 3.32Å; D285-K288 WeakPolarHBondContact O-CA 3.43Å; D285-K288 PolarHBondContact O-N 3.48Å; D285-I290 HydrophobicContact CB-CG1 4.24Å; D285-L292 HydrophobicContact CB-CD1 3.62Å; D285-L292 HydrophobicContact CB-CG 3.79Å; D285-L292 PolarHBondContact OD1-N 2.9Å; D285-R331 IonicContact OD2-CZ 3.4Å; D285-R331 IonicContact OD2-NH1 2.66Å; D285-R331 IonicContact OD2-NH2 3.62Å; D285-R331 PolarHBondContact OD2-NH2 3.26Å
286	A	92	Very high	93.8	Very high	81 Å²	81	54 Å²	54	67%	0.669	29%	0.288	S	S	*	.	H	α-helix	trans	-60.6	-31.8	174.1	0	0	0	0	0	112.7	Y282 K283 K288	Y282-A286 WeakPolarHBondContact O-CB 3.48Å; Y282-A286 PolarHBondContact O-N 2.88Å; K283-A286 PolarHBondContact O-N 3.1Å; A286-K288 PolarHBondContact O-N 3.46Å
287	K	92.5	Very high	93.9	Very high	161 Å²	161	60 Å²	60	70%	0.7	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	2.4	172.3	-66.7	174.5	-175.8	177.1	0	113.3	K283 L284 D285 R289	K283-K287 WeakPolarHBondContact O-CG 3.45Å; K283-K287 PolarHBondContact O-N 3.05Å; L284-K287 CarbonylContact O-C 3.6Å; L284-K287 WeakPolarHBondContact O-CB 3.34Å; L284-K287 PolarHBondContact O-N 3.03Å; D285-K287 PolarHBondContact O-N 3.32Å; K287-R289 PolarHBondContact O-N 2.65Å
288	K	92.7	Very high	94.1	Very high	194 Å²	194	55.9 Å²	55.9	84%	0.843	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	28.8	-172.6	-55.1	-176.2	178.5	-176.3	0	113.1	L284 D285 A286	L284-K288 PolarHBondContact O-N 2.96Å; D285-K288 VanDerWaalsContact O-CA 3.32Å; D285-K288 WeakPolarHBondContact O-CA 3.43Å; D285-K288 PolarHBondContact O-N 3.48Å; A286-K288 PolarHBondContact O-N 3.46Å
289	R	92.9	Very high	94.2	Very high	44 Å²	44	51.5 Å²	51.5	17%	0.166	26%	0.255	C	S	.	.	S	Bend	trans	-76.9	-33	179.5	-179.4	53.6	176.6	98.5	-3.1	112.2	E236 A239 D240 N243 L284 K287	E236-R289 PolarHBondContact O-NH2 2.79Å; E236-R289 IonicContact OE2-CZ 3.91Å; E236-R289 VanDerWaalsContact OE2-CZ 3.24Å; E236-R289 IonicContact OE2-NE 3.52Å; E236-R289 PolarHBondContact OE2-NE 3.17Å; E236-R289 IonicContact OE2-NH2 3.45Å; E236-R289 PolarHBondContact OE2-NH2 3.33Å; A239-R289 HydrophobicContact CB-CG 4.23Å; D240-R289 IonicContact OD1-CZ 2.66Å; D240-R289 IonicContact OD1-NH1 3.48Å; D240-R289 PolarHBondContact OD1-NH1 3.06Å; D240-R289 IonicContact OD1-NH2 3.93Å; D240-R289 PolarHBondContact OD1-NH2 2.74Å; D240-R289 IonicContact OD2-NH2 3.24Å; N243-R289 PolarHBondContact ND2-NH1 3.21Å; N243-R289 VanDerWaalsContact ND2-NH1 3.14Å; N243-R289 PolarHBondContact ND2-O 2.98Å; L284-R289 HydrophobicContact CB-CB 4.24Å; L284-R289 HydrophobicContact CD2-CB 4.37Å; L284-R289 HydrophobicContact CD2-CG 4.23Å; L284-R289 VanDerWaalsContact O-CB 3.3Å; L284-R289 WeakPolarHBondContact O-CB 3.49Å; L284-R289 PolarHBondContact O-N 3.35Å; K287-R289 PolarHBondContact O-N 2.65Å
290	I	94.3	Very high	94.1	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.026	27%	0.272	C	S	.	.	S	Bend	trans	-132.2	166.5	171.5	59	177.6	0	0	0	108.1	A239 L271 M274 I281 L284 D285 L292	A239-I290 HydrophobicContact CB-CG2 3.76Å; L271-I290 HydrophobicContact CD2-CD1 3.8Å; M274-I290 HydrophobicContact CE-CD1 4.23Å; M274-I290 HydrophobicContact CE-CG2 4.15Å; I281-I290 HydrophobicContact CB-CD1 4.06Å; I281-I290 HydrophobicContact CG2-CD1 4.39Å; L284-I290 HydrophobicContact CB-CD1 4.1Å; L284-I290 HydrophobicContact CB-CG1 4.07Å; D285-I290 HydrophobicContact CB-CG1 4.24Å; I290-L292 HydrophobicContact CD1-CD2 3.73Å; I290-L292 HydrophobicContact CD1-CG 4.27Å; I290-L292 HydrophobicContact CG1-CD2 4.38Å
291	N	94.9	Very high	93.9	Very high	64 Å²	64	59 Å²	59	34%	0.342	29%	0.286	S	S	.	.			trans	-123.5	93	178.1	-172	-27.7	0	0	0	110.3	S293 K294	N291-S293 VanDerWaalsContact C-N 3.25Å; N291-S293 PolarHBondContact O-N 2.73Å; N291-S293 WeakPolarHBondContact OD1-CB 3.38Å; N291-S293 PolarHBondContact OD1-N 3.45Å; N291-K294 PolarHBondContact O-N 3.24Å; N291-K294 PolarHBondContact OD1-N 2.68Å; N291-K294 VanDerWaalsContact OD1-N 3.16Å
292	L	94.8	Very high	93.7	Very high	5 Å²	5	59.3 Å²	59.3	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-66.2	-30.2	-178.1	-62.3	177.2	0	0	0	111.9	L271 I281 Y282 D285 I290 K294 I295 D296 W332	L271-L292 HydrophobicContact CD1-CD2 3.92Å; L271-L292 HydrophobicContact CD2-CD2 3.71Å; L271-L292 HydrophobicContact CG-CD2 4.49Å; I281-L292 HydrophobicContact CD1-CD2 4.41Å; Y282-L292 HydrophobicContact CD1-CD1 3.87Å; Y282-L292 HydrophobicContact CE1-CD1 4.23Å; D285-L292 HydrophobicContact CB-CD1 3.62Å; D285-L292 HydrophobicContact CB-CG 3.79Å; D285-L292 PolarHBondContact OD1-N 2.9Å; I290-L292 HydrophobicContact CD1-CD2 3.73Å; I290-L292 HydrophobicContact CD1-CG 4.27Å; I290-L292 HydrophobicContact CG1-CD2 4.38Å; L292-K294 PolarHBondContact O-N 2.89Å; L292-I295 PolarHBondContact O-N 3.04Å; L292-D296 WeakPolarHBondContact O-CB 3.48Å; L292-D296 PolarHBondContact O-N 2.98Å; L292-W332 HydrophobicContact CB-CH2 4.04Å; L292-W332 HydrophobicContact CB-CZ2 4.36Å; L292-W332 HydrophobicContact CD1-CZ2 4.25Å; L292-W332 HydrophobicContact CD2-CH2 3.92Å; L292-W332 HydrophobicContact CD2-CZ2 4.16Å; L292-W332 HydrophobicContact CG-CH2 4.41Å; L292-W332 HydrophobicContact CG-CZ2 4.49Å
293	S	95	Very high	93.6	Very high	74 Å²	74	59.7 Å²	59.7	52%	0.517	29%	0.29	S	S	.	.	H	α-helix	trans	-64.3	-36.5	179.9	-55	0	0	0	0	113.1	N291 K297	N291-S293 VanDerWaalsContact C-N 3.25Å; N291-S293 PolarHBondContact O-N 2.73Å; N291-S293 WeakPolarHBondContact OD1-CB 3.38Å; N291-S293 PolarHBondContact OD1-N 3.45Å; S293-K297 PolarHBondContact O-N 2.71Å; S293-K297 VanDerWaalsContact O-N 3.12Å
294	K	95.6	Very high	93.6	Very high	65 Å²	65	52.8 Å²	52.8	28%	0.283	26%	0.26	S	S	.	.	H	α-helix	trans	-65.7	-45.9	174.1	-79.5	-173.4	174.4	-174.5	0	111.2	V246 E250 N291 L292 K297 Y298	V246-K294 HydrophobicContact CG1-CB 4.24Å; V246-K294 HydrophobicContact CG1-CD 3.8Å; E250-K294 VanDerWaalsContact OE1-CE 3.26Å; E250-K294 WeakPolarHBondContact OE1-CE 3.01Å; E250-K294 IonicContact OE1-NZ 2.82Å; E250-K294 PolarHBondContact OE1-NZ 2.87Å; E250-K294 IonicContact OE2-NZ 3.66Å; E250-K294 PolarHBondContact OE2-NZ 3.08Å; N291-K294 PolarHBondContact O-N 3.24Å; N291-K294 PolarHBondContact OD1-N 2.68Å; N291-K294 VanDerWaalsContact OD1-N 3.16Å; L292-K294 PolarHBondContact O-N 2.89Å; K294-K297 WeakPolarHBondContact O-CB 3.49Å; K294-K297 PolarHBondContact O-N 3.14Å; K294-Y298 HydrophobicContact CB-CE2 4.12Å; K294-Y298 WeakPolarHBondContact O-CD2 3.29Å; K294-Y298 VanDerWaalsContact O-CG 3.22Å; K294-Y298 PolarHBondContact O-N 3.06Å
295	I	96.1	Very high	93.7	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-43.1	-179.7	-59.1	171.5	0	0	0	110.5	V242 V246 M267 L271 L292 K297 Y298 F299	V242-I295 HydrophobicContact CG1-CD1 3.7Å; V246-I295 HydrophobicContact CG2-CD1 3.96Å; V246-I295 HydrophobicContact CG2-CG1 3.63Å; M267-I295 HydrophobicContact CB-CG2 4.31Å; M267-I295 HydrophobicContact SD-CG1 4.2Å; M267-I295 HydrophobicContact SD-CG2 4.46Å; L271-I295 HydrophobicContact CD1-CD1 3.78Å; L271-I295 HydrophobicContact CD1-CG2 3.95Å; L271-I295 HydrophobicContact CD2-CD1 4.31Å; L271-I295 HydrophobicContact CG-CD1 4.24Å; L292-I295 PolarHBondContact O-N 3.04Å; I295-K297 VanDerWaalsContact C-N 3.33Å; I295-K297 PolarHBondContact O-N 3.36Å; I295-Y298 PolarHBondContact O-N 3.4Å; I295-F299 HydrophobicContact CG2-CD1 4.39Å; I295-F299 HydrophobicContact CG2-CD2 4.29Å; I295-F299 HydrophobicContact CG2-CE1 4.14Å; I295-F299 HydrophobicContact CG2-CE2 4.04Å; I295-F299 HydrophobicContact CG2-CG 4.47Å; I295-F299 HydrophobicContact CG2-CZ 3.96Å; I295-F299 PolarHBondContact O-N 2.86Å
296	D	95	Very high	93.8	Very high	13 Å²	13	52.8 Å²	52.8	7%	0.07	26%	0.262	C	S	.	.	H	α-helix	trans	-56.1	-46.5	173.4	-176.8	59.6	0	0	0	111.5	L292 Y298 F299 K300 W332 T333 C334	L292-D296 WeakPolarHBondContact O-CB 3.48Å; L292-D296 PolarHBondContact O-N 2.98Å; D296-Y298 PolarHBondContact O-N 2.65Å; D296-F299 PolarHBondContact O-N 3.46Å; D296-K300 VanDerWaalsContact O-CB 3.3Å; D296-K300 WeakPolarHBondContact O-CB 3.01Å; D296-K300 PolarHBondContact O-N 3.13Å; D296-W332 HydrophobicContact CB-CE3 3.68Å; D296-W332 HydrophobicContact CB-CZ3 3.82Å; D296-W332 WeakPolarHBondContact OD1-CA 3.42Å; D296-T333 VanDerWaalsContact CG-N 3.34Å; D296-T333 PolarHBondContact OD1-N 2.9Å; D296-T333 WeakPolarHBondContact OD2-CB 3.33Å; D296-T333 PolarHBondContact OD2-N 2.91Å; D296-T333 VanDerWaalsContact OD2-N 3.14Å; D296-T333 PolarHBondContact OD2-OG1 2.92Å; D296-C334 WeakPolarHBondContact OD1-CB 3.37Å; D296-C334 PolarHBondContact OD1-N 2.6Å; D296-C334 PolarHBondContact OD1-SG 3.2Å
297	K	94.7	Very high	93.9	Very high	136 Å²	136	49.4 Å²	49.4	59%	0.591	23%	0.232	S	C	*	.	H	α-helix	trans	-60.5	-44.2	176.4	-178.2	-176.3	173.2	-175.1	0	111.8	S293 K294 I295 K300 Q301	S293-K297 PolarHBondContact O-N 2.71Å; S293-K297 VanDerWaalsContact O-N 3.12Å; K294-K297 WeakPolarHBondContact O-CB 3.49Å; K294-K297 PolarHBondContact O-N 3.14Å; I295-K297 VanDerWaalsContact C-N 3.33Å; I295-K297 PolarHBondContact O-N 3.36Å; K297-K300 PolarHBondContact O-N 3.22Å; K297-Q301 WeakPolarHBondContact O-CB 3.34Å; K297-Q301 PolarHBondContact O-N 3.09Å
298	Y	95	Very high	94	Very high	14 Å²	14	42.5 Å²	42.5	6%	0.055	20%	0.203	C	C	.	.	H	α-helix	trans	-65.8	-43.4	179.5	-57.3	-27.5	0	0	0	111.8	V246 Y249 E250 M267 K294 I295 D296 K300 Q301 L302	V246-Y298 HydrophobicContact CG1-CE2 4.14Å; Y249-Y298 AromaticContact CD1-CD1 3.85Å; Y249-Y298 HydrophobicContact CD1-CD1 3.85Å; Y249-Y298 AromaticContact CD1-CD2 3.75Å; Y249-Y298 HydrophobicContact CD1-CD2 3.75Å; Y249-Y298 HydrophobicContact CD1-CE1 4.04Å; Y249-Y298 AromaticContact CD1-CE2 3.93Å; Y249-Y298 HydrophobicContact CD1-CE2 3.93Å; Y249-Y298 AromaticContact CD1-CG 3.73Å; Y249-Y298 HydrophobicContact CD1-CG 3.73Å; Y249-Y298 AromaticContact CE1-CD1 3.74Å; Y249-Y298 HydrophobicContact CE1-CD1 3.74Å; Y249-Y298 HydrophobicContact CE1-CD2 4.25Å; Y249-Y298 HydrophobicContact CE1-CE1 4.27Å; Y249-Y298 AromaticContact CE1-CG 3.75Å; Y249-Y298 HydrophobicContact CE1-CG 3.75Å; E250-Y298 WeakPolarHBondContact CB-OH 3.41Å; M267-Y298 HydrophobicContact CE-CD2 4.36Å; M267-Y298 HydrophobicContact SD-CD2 4.13Å; K294-Y298 HydrophobicContact CB-CE2 4.12Å; K294-Y298 WeakPolarHBondContact O-CD2 3.29Å; K294-Y298 VanDerWaalsContact O-CG 3.22Å; K294-Y298 PolarHBondContact O-N 3.06Å; I295-Y298 PolarHBondContact O-N 3.4Å; D296-Y298 PolarHBondContact O-N 2.65Å; Y298-K300 VanDerWaalsContact C-N 3.31Å; Y298-K300 PolarHBondContact O-N 3.49Å; Y298-Q301 CarbonylContact O-C 3.17Å; Y298-Q301 PolarHBondContact O-N 2.96Å; Y298-Q301 VanDerWaalsContact O-N 3.1Å; Y298-L302 PolarHBondContact O-N 3.05Å
299	F	94.8	Very high	94.1	Very high	1 Å²	1	33.6 Å²	33.6	0%	0.004	17%	0.166	C	C	.	.	H	α-helix	trans	-69	-30.2	176.9	-72.8	5.4	0	0	0	112.3	L264 M267 I295 D296 Q301 L302 Q303 L315 I319 C334	L264-F299 HydrophobicContact CB-CE1 4.2Å; L264-F299 HydrophobicContact CD2-CD1 4.36Å; L264-F299 HydrophobicContact CD2-CE1 4.18Å; M267-F299 HydrophobicContact CB-CE1 4.41Å; M267-F299 HydrophobicContact CB-CZ 4.23Å; I295-F299 HydrophobicContact CG2-CD1 4.39Å; I295-F299 HydrophobicContact CG2-CD2 4.29Å; I295-F299 HydrophobicContact CG2-CE1 4.14Å; I295-F299 HydrophobicContact CG2-CE2 4.04Å; I295-F299 HydrophobicContact CG2-CG 4.47Å; I295-F299 HydrophobicContact CG2-CZ 3.96Å; I295-F299 PolarHBondContact O-N 2.86Å; D296-F299 PolarHBondContact O-N 3.46Å; F299-Q301 VanDerWaalsContact C-N 3.31Å; F299-L302 WeakPolarHBondContact CA-O 3.27Å; F299-L302 CarbonylContact O-C 3.5Å; F299-L302 VanDerWaalsContact O-O 3.13Å; F299-Q303 WeakPolarHBondContact O-CA 3.26Å; F299-Q303 WeakPolarHBondContact O-CG 3.36Å; F299-Q303 PolarHBondContact O-N 2.88Å; F299-L315 HydrophobicContact CD1-CB 3.85Å; F299-L315 HydrophobicContact CD1-CD1 3.82Å; F299-L315 HydrophobicContact CD1-CG 4.36Å; F299-L315 HydrophobicContact CD2-CB 3.85Å; F299-L315 HydrophobicContact CE1-CB 3.91Å; F299-L315 HydrophobicContact CE1-CD1 3.93Å; F299-L315 HydrophobicContact CE1-CD2 4.19Å; F299-L315 HydrophobicContact CE1-CG 4.23Å; F299-L315 HydrophobicContact CE2-CB 3.9Å; F299-L315 WeakPolarHBondContact CE2-O 3.28Å; F299-L315 HydrophobicContact CG-CB 3.82Å; F299-L315 HydrophobicContact CZ-CB 3.93Å; F299-L315 HydrophobicContact CZ-CD2 4.27Å; F299-I319 HydrophobicContact CD2-CG1 4.27Å; F299-I319 HydrophobicContact CE2-CD1 4.43Å; F299-I319 HydrophobicContact CE2-CG1 4.25Å; F299-C334 HydrophobicContact CB-CB 3.73Å
300	K	91.2	Very high	94.1	Very high	98 Å²	98	31.6 Å²	31.6	43%	0.426	16%	0.158	S	C	.	.	H	α-helix	trans	-72.5	-26.9	171.2	-163.7	-169.7	-170.9	71.7	0	112.3	D296 K297 Y298 T333 C334 Q342	D296-K300 VanDerWaalsContact O-CB 3.3Å; D296-K300 WeakPolarHBondContact O-CB 3.01Å; D296-K300 PolarHBondContact O-N 3.13Å; K297-K300 PolarHBondContact O-N 3.22Å; Y298-K300 VanDerWaalsContact C-N 3.31Å; Y298-K300 PolarHBondContact O-N 3.49Å; K300-T333 WeakPolarHBondContact CD-OG1 3.24Å; K300-T333 PolarHBondContact NZ-O 3.13Å; K300-C334 HydrophobicContact CB-CB 4.05Å; K300-Q342 PolarHBondContact O-NE2 2.86Å
301	Q	90	Very high	94.1	Very high	91 Å²	91	31.8 Å²	31.8	43%	0.425	16%	0.159	S	C	.	.	H	α-helix	trans	-83.3	-36.4	176.1	-176.2	179.4	-0.5	0	0	111.7	K297 Y298 F299 Q342 Y343	K297-Q301 WeakPolarHBondContact O-CB 3.34Å; K297-Q301 PolarHBondContact O-N 3.09Å; Y298-Q301 CarbonylContact O-C 3.17Å; Y298-Q301 PolarHBondContact O-N 2.96Å; Y298-Q301 VanDerWaalsContact O-N 3.1Å; F299-Q301 VanDerWaalsContact C-N 3.31Å; Q301-Q342 PolarHBondContact O-NE2 3.34Å; Q301-Y343 WeakPolarHBondContact CG-OH 3.49Å; Q301-Y343 WeakPolarHBondContact O-CE2 3.41Å; Q301-Y343 PolarHBondContact O-OH 3.42Å
302	L	92.6	Very high	94.1	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.037	15%	0.148	C	C	.	.			trans	-136	105.9	176.2	177.8	54.9	0	0	0	107.6	L264 Y298 F299 V304 V305 L315 E410	L264-L302 HydrophobicContact CD1-CB 4.33Å; L264-L302 HydrophobicContact CD1-CD2 3.64Å; L264-L302 HydrophobicContact CD1-CG 4.16Å; Y298-L302 PolarHBondContact O-N 3.05Å; F299-L302 WeakPolarHBondContact CA-O 3.27Å; F299-L302 CarbonylContact O-C 3.5Å; F299-L302 VanDerWaalsContact O-O 3.13Å; L302-V304 WeakPolarHBondContact CD1-O 3.41Å; L302-V305 HydrophobicContact CD1-CG1 4.28Å; L302-V305 HydrophobicContact CD2-CG1 3.73Å; L302-V305 HydrophobicContact CG-CG1 3.83Å; L302-L315 VanDerWaalsContact O-CD1 3.3Å; L302-L315 WeakPolarHBondContact O-CD1 3.49Å; L302-E410 HydrophobicContact CD1-CB 4.06Å; L302-E410 HydrophobicContact CD1-CG 3.75Å; L302-E410 HydrophobicContact CD2-CG 4.26Å; L302-E410 WeakPolarHBondContact CD2-OE1 3.17Å
303	Q	91.3	Very high	94	Very high	21 Å²	21	29.9 Å²	29.9	10%	0.098	15%	0.148	C	C	.	.			trans	-87.8	-35.4	-169.9	-75.4	172.3	-11	0	0	113.4	F299 L315 S337	F299-Q303 WeakPolarHBondContact O-CA 3.26Å; F299-Q303 WeakPolarHBondContact O-CG 3.36Å; F299-Q303 PolarHBondContact O-N 2.88Å; Q303-L315 PolarHBondContact O-N 2.69Å; Q303-S337 PolarHBondContact NE2-OG 3.36Å; Q303-S337 PolarHBondContact OE1-OG 3.25Å
304	V	93.8	Very high	94	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133.5	-170.1	-164.5	0	0	0	0	108.5	L302 Q312 I313 S413 V417	L302-V304 WeakPolarHBondContact CD1-O 3.41Å; V304-Q312 HydrophobicContact CG1-CB 3.91Å; V304-I313 WeakPolarHBondContact CA-O 3.39Å; V304-S413 WeakPolarHBondContact CG1-OG 3.38Å; V304-V417 HydrophobicContact CB-CG2 4.26Å; V304-V417 HydrophobicContact CG1-CG1 4.02Å; V304-V417 HydrophobicContact CG1-CG2 3.7Å; V304-V417 HydrophobicContact CG2-CG2 3.61Å
305	V	94.6	Very high	93.9	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	158.1	175.1	-64.5	0	0	0	0	110.4	H261 L264 K265 L302 L307 I313 L315	H261-V305 HydrophobicContact CB-CB 4.08Å; H261-V305 HydrophobicContact CB-CG1 4.24Å; H261-V305 HydrophobicContact CB-CG2 4.44Å; L264-V305 HydrophobicContact CD1-CG1 4.42Å; K265-V305 HydrophobicContact CD-CG2 4.24Å; K265-V305 HydrophobicContact CG-CG2 3.9Å; L302-V305 HydrophobicContact CD1-CG1 4.28Å; L302-V305 HydrophobicContact CD2-CG1 3.73Å; L302-V305 HydrophobicContact CG-CG1 3.83Å; V305-L307 PolarHBondContact O-N 3.04Å; V305-I313 HydrophobicContact CG2-CG2 3.72Å; V305-I313 PolarHBondContact N-O 2.94Å; V305-I313 WeakPolarHBondContact O-CG2 3.43Å; V305-I313 PolarHBondContact O-N 3.25Å; V305-L315 HydrophobicContact CG1-CD1 4.29Å; V305-L315 HydrophobicContact CG2-CD1 4.27Å; V305-L315 HydrophobicContact CG2-CD2 3.94Å; V305-L315 HydrophobicContact CG2-CG 4.18Å
306	P	95.9	Very high	93.8	Very high	32 Å²	32	26.1 Å²	26.1	21%	0.208	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	128.9	173.5	-23.5	34.6	0	0	0	112.7	K265	K265-P306 PolarHBondContact NZ-O 3.26Å
307	L	94	Very high	93.7	Very high	10 Å²	10	31 Å²	31	5%	0.052	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-58.6	170.4	-174.2	55.1	0	0	0	109.7	V170 E173 K265 V305 M311 I313	V170-L307 HydrophobicContact CG2-CD1 3.61Å; V170-L307 HydrophobicContact CG2-CG 4.13Å; E173-L307 HydrophobicContact CB-CD2 3.94Å; E173-L307 HydrophobicContact CG-CD2 3.99Å; K265-L307 HydrophobicContact CD-CD1 3.99Å; V305-L307 PolarHBondContact O-N 3.04Å; L307-M311 HydrophobicContact CB-CE 4.41Å; L307-M311 WeakPolarHBondContact CB-O 3.24Å; L307-M311 HydrophobicContact CD2-CE 3.75Å; L307-M311 HydrophobicContact CG-CE 4.04Å; L307-M311 PolarHBondContact N-O 2.76Å; L307-I313 HydrophobicContact CB-CB 4.02Å; L307-I313 HydrophobicContact CB-CG2 3.97Å; L307-I313 HydrophobicContact CD1-CG2 4.33Å; L307-I313 HydrophobicContact CD2-CB 4.27Å
308	F	95.1	Very high	93.7	Very high	17 Å²	17	25 Å²	25	8%	0.075	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	127.2	174.6	-166.5	-78.8	0	0	0	110.6	A80 V81 Y84 V170 L174 M311 F682	A80-F308 HydrophobicContact CB-CD2 4.03Å; A80-F308 HydrophobicContact CB-CE2 3.47Å; A80-F308 VanDerWaalsContact CB-CE2 3.47Å; A80-F308 HydrophobicContact CB-CZ 3.97Å; V81-F308 HydrophobicContact CG2-CZ 3.96Å; Y84-F308 HydrophobicContact CD1-CD1 4.25Å; Y84-F308 AromaticContact CD1-CE1 3.8Å; Y84-F308 HydrophobicContact CD1-CE1 3.8Å; Y84-F308 AromaticContact CD2-CD1 3.76Å; Y84-F308 HydrophobicContact CD2-CD1 3.76Å; Y84-F308 HydrophobicContact CD2-CE1 4.1Å; Y84-F308 HydrophobicContact CE2-CD1 4.39Å; Y84-F308 AromaticContact CG-CD1 3.67Å; Y84-F308 HydrophobicContact CG-CD1 3.67Å; Y84-F308 AromaticContact CG-CE1 3.5Å; Y84-F308 HydrophobicContact CG-CE1 3.5Å; V170-F308 HydrophobicContact CG1-CB 4.11Å; V170-F308 HydrophobicContact CG1-CD2 3.76Å; V170-F308 HydrophobicContact CG1-CG 4.23Å; L174-F308 HydrophobicContact CD1-CB 4.42Å; L174-F308 HydrophobicContact CD1-CD1 4.17Å; L174-F308 HydrophobicContact CD1-CD2 4.34Å; L174-F308 HydrophobicContact CD1-CG 4.06Å; L174-F308 HydrophobicContact CD2-CB 4.37Å; L174-F308 HydrophobicContact CD2-CD1 4.2Å; L174-F308 HydrophobicContact CD2-CG 4.46Å; F308-M311 HydrophobicContact CB-CE 4.37Å; F308-M311 PolarHBondContact N-O 3.35Å; F308-M311 VanDerWaalsContact N-O 3.1Å; F308-M311 VanDerWaalsContact O-CB 3.24Å; F308-M311 WeakPolarHBondContact O-CB 3.48Å; F308-M311 PolarHBondContact O-N 3.31Å; F308-F682 AromaticContact CE1-CE1 3.93Å; F308-F682 HydrophobicContact CE1-CE1 3.93Å; F308-F682 HydrophobicContact CZ-CE1 4.16Å
309	G	93.6	Very high	93.7	Very high	7 Å²	7	24.4 Å²	24.4	7%	0.072	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	-136.4	-177.5	0	0	0	0	0	112.7	M311 Q312	G309-M311 VanDerWaalsContact C-N 3.25Å; G309-M311 PolarHBondContact O-N 2.88Å; G309-Q312 PolarHBondContact O-NE2 2.69Å
310	D	94.3	Very high	93.6	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-4.8	171.7	65.8	-44.8	0	0	0	113.9	Y84 Q312 L416 F623 R624 E625 F626 F627	Y84-D310 VanDerWaalsContact CE2-OD1 3.24Å; Y84-D310 WeakPolarHBondContact CE2-OD1 3.28Å; Y84-D310 PolarHBondContact OH-N 2.73Å; Y84-D310 PolarHBondContact OH-OD1 3.2Å; D310-Q312 PolarHBondContact O-N 3.48Å; D310-Q312 PolarHBondContact O-NE2 2.75Å; D310-L416 HydrophobicContact CB-CD1 4.44Å; D310-F623 WeakPolarHBondContact CB-O 3.34Å; D310-R624 WeakPolarHBondContact OD2-CA 3.21Å; D310-E625 PolarHBondContact OD1-N 3.43Å; D310-F626 VanDerWaalsContact OD1-CB 3.31Å; D310-F626 WeakPolarHBondContact OD1-CB 3.3Å; D310-F626 PolarHBondContact OD1-N 3.43Å; D310-F626 WeakPolarHBondContact OD2-CB 3.29Å; D310-F626 PolarHBondContact OD2-N 3.06Å; D310-F627 HydrophobicContact CB-CD2 4.47Å; D310-F627 VanDerWaalsContact OD2-CD2 3.23Å; D310-F627 WeakPolarHBondContact OD2-CD2 3.33Å; D310-F627 PolarHBondContact OD2-N 3.45Å
311	M	94.3	Very high	93.6	Very high	9 Å²	9	26.8 Å²	26.8	4%	0.044	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	115.5	173.6	-168.5	178.3	63	0	0	110.4	E173 L174 M177 L307 F308 G309 F626	E173-M311 HydrophobicContact CB-CE 3.89Å; E173-M311 HydrophobicContact CB-SD 4.11Å; L174-M311 HydrophobicContact CD2-CE 3.54Å; L174-M311 HydrophobicContact CD2-SD 4.3Å; L174-M311 HydrophobicContact CG-CE 3.77Å; M177-M311 HydrophobicContact CE-SD 4.39Å; M177-M311 HydrophobicContact CG-SD 4.1Å; L307-M311 HydrophobicContact CB-CE 4.41Å; L307-M311 WeakPolarHBondContact CB-O 3.24Å; L307-M311 HydrophobicContact CD2-CE 3.75Å; L307-M311 HydrophobicContact CG-CE 4.04Å; L307-M311 PolarHBondContact N-O 2.76Å; F308-M311 HydrophobicContact CB-CE 4.37Å; F308-M311 PolarHBondContact N-O 3.35Å; F308-M311 VanDerWaalsContact N-O 3.1Å; F308-M311 VanDerWaalsContact O-CB 3.24Å; F308-M311 WeakPolarHBondContact O-CB 3.48Å; F308-M311 PolarHBondContact O-N 3.31Å; G309-M311 VanDerWaalsContact C-N 3.25Å; G309-M311 PolarHBondContact O-N 2.88Å; M311-F626 HydrophobicContact CB-CB 4.1Å; M311-F626 HydrophobicContact CB-CD2 4.17Å; M311-F626 HydrophobicContact CB-CG 4.07Å; M311-F626 HydrophobicContact CG-CD2 3.9Å; M311-F626 HydrophobicContact CG-CE2 4.15Å; M311-F626 HydrophobicContact CG-CG 4.25Å; M311-F626 HydrophobicContact SD-CD2 4.18Å; M311-F626 HydrophobicContact SD-CE2 4.45Å
312	Q	94	Very high	93.8	Very high	24 Å²	24	22.9 Å²	22.9	11%	0.112	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	160.8	-178.5	-47	-52	-52.1	0	0	111.3	V304 G309 D310 S413 L416 V417	V304-Q312 HydrophobicContact CG1-CB 3.91Å; G309-Q312 PolarHBondContact O-NE2 2.69Å; D310-Q312 PolarHBondContact O-N 3.48Å; D310-Q312 PolarHBondContact O-NE2 2.75Å; Q312-S413 VanDerWaalsContact OE1-CB 3.25Å; Q312-S413 PolarHBondContact OE1-OG 2.83Å; Q312-L416 HydrophobicContact CG-CB 3.99Å; Q312-L416 HydrophobicContact CG-CD1 3.94Å; Q312-V417 HydrophobicContact CB-CG1 3.61Å; Q312-V417 HydrophobicContact CG-CG1 4.07Å
313	I	93.9	Very high	93.9	Very high	6 Å²	6	25.6 Å²	25.6	3%	0.031	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.5	170.6	-177.5	62.7	0	0	0	110.7	K265 V304 V305 L307 L315 Y318	K265-I313 HydrophobicContact CD-CG2 4.04Å; K265-I313 HydrophobicContact CG-CG2 4.05Å; V304-I313 WeakPolarHBondContact CA-O 3.39Å; V305-I313 HydrophobicContact CG2-CG2 3.72Å; V305-I313 PolarHBondContact N-O 2.94Å; V305-I313 WeakPolarHBondContact O-CG2 3.43Å; V305-I313 PolarHBondContact O-N 3.25Å; L307-I313 HydrophobicContact CB-CB 4.02Å; L307-I313 HydrophobicContact CB-CG2 3.97Å; L307-I313 HydrophobicContact CD1-CG2 4.33Å; L307-I313 HydrophobicContact CD2-CB 4.27Å; I313-L315 PolarHBondContact O-N 3.17Å; I313-Y318 HydrophobicContact CD1-CE2 4.05Å; I313-Y318 HydrophobicContact CG1-CE2 3.7Å
314	E	94.3	Very high	94.1	Very high	58 Å²	58	27 Å²	27	27%	0.271	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	110.7	165.7	-171.5	-167.7	157.2	0	0	108.1	A316 R317 K320	E314-A316 HydrophobicContact CG-CB 4.48Å; E314-A316 PolarHBondContact O-N 3.28Å; E314-R317 HydrophobicContact CB-CB 4.43Å; E314-R317 WeakPolarHBondContact O-CB 3.24Å; E314-R317 PolarHBondContact O-N 3.44Å; E314-K320 IonicContact OE1-NZ 3.46Å; E314-K320 PolarHBondContact OE1-NZ 3.18Å
315	L	94.1	Very high	94.1	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-33.8	-172.9	-67.4	168.2	0	0	0	112.4	L264 K265 F299 L302 Q303 V305 I313 R317 Y318	L264-L315 HydrophobicContact CB-CD1 3.84Å; L264-L315 HydrophobicContact CB-CD2 4.13Å; L264-L315 HydrophobicContact CD1-CD1 4.04Å; L264-L315 HydrophobicContact CG-CD1 4.48Å; K265-L315 HydrophobicContact CG-CD2 4.37Å; F299-L315 HydrophobicContact CD1-CB 3.85Å; F299-L315 HydrophobicContact CD1-CD1 3.82Å; F299-L315 HydrophobicContact CD1-CG 4.36Å; F299-L315 HydrophobicContact CD2-CB 3.85Å; F299-L315 HydrophobicContact CE1-CB 3.91Å; F299-L315 HydrophobicContact CE1-CD1 3.93Å; F299-L315 HydrophobicContact CE1-CD2 4.19Å; F299-L315 HydrophobicContact CE1-CG 4.23Å; F299-L315 HydrophobicContact CE2-CB 3.9Å; F299-L315 WeakPolarHBondContact CE2-O 3.28Å; F299-L315 HydrophobicContact CG-CB 3.82Å; F299-L315 HydrophobicContact CZ-CB 3.93Å; F299-L315 HydrophobicContact CZ-CD2 4.27Å; L302-L315 VanDerWaalsContact O-CD1 3.3Å; L302-L315 WeakPolarHBondContact O-CD1 3.49Å; Q303-L315 PolarHBondContact O-N 2.69Å; V305-L315 HydrophobicContact CG1-CD1 4.29Å; V305-L315 HydrophobicContact CG2-CD1 4.27Å; V305-L315 HydrophobicContact CG2-CD2 3.94Å; V305-L315 HydrophobicContact CG2-CG 4.18Å; I313-L315 PolarHBondContact O-N 3.17Å; L315-R317 PolarHBondContact O-N 3.49Å; L315-Y318 PolarHBondContact O-N 2.91Å
316	A	93.5	Very high	94	Very high	2 Å²	2	33.9 Å²	33.9	2%	0.017	17%	0.174	C	C	.	.	H	α-helix	trans	-65.5	-17.6	175.5	0	0	0	0	0	113.3	E314 Y318 I319 K320 T335	E314-A316 HydrophobicContact CG-CB 4.48Å; E314-A316 PolarHBondContact O-N 3.28Å; A316-Y318 VanDerWaalsContact C-N 3.34Å; A316-Y318 PolarHBondContact O-N 2.91Å; A316-I319 WeakPolarHBondContact O-CB 3.31Å; A316-I319 PolarHBondContact O-N 3.28Å; A316-K320 WeakPolarHBondContact O-CG 3.49Å; A316-K320 PolarHBondContact O-N 2.83Å; A316-T335 HydrophobicContact CB-CG2 4.41Å
317	R	93.8	Very high	93.9	Very high	115 Å²	115	38.8 Å²	38.8	43%	0.434	19%	0.194	S	C	.	.	H	α-helix	trans	-58.9	-45.2	175.6	-178.4	178.9	165.2	125.1	-12.1	111.2	E173 E314 L315 I319 K320 T321	E173-R317 IonicContact OE1-NH2 2.86Å; E314-R317 HydrophobicContact CB-CB 4.43Å; E314-R317 WeakPolarHBondContact O-CB 3.24Å; E314-R317 PolarHBondContact O-N 3.44Å; L315-R317 PolarHBondContact O-N 3.49Å; R317-I319 PolarHBondContact O-N 3.39Å; R317-K320 PolarHBondContact O-N 3Å; R317-K320 VanDerWaalsContact O-N 3.13Å; R317-T321 HydrophobicContact CG-CG2 4.31Å; R317-T321 PolarHBondContact O-N 3.39Å; R317-T321 PolarHBondContact O-OG1 3.29Å
318	Y	94.4	Very high	93.9	Very high	12 Å²	12	40.2 Å²	40.2	5%	0.047	20%	0.201	C	C	.	.	H	α-helix	trans	-57.5	-35.7	178.5	-68.2	-57.2	0	0	0	112.7	G268 F269 Y272 I313 L315 A316 S322	G268-Y318 WeakPolarHBondContact O-CB 3.37Å; F269-Y318 HydrophobicContact CB-CD1 4.41Å; F269-Y318 HydrophobicContact CB-CE1 4.01Å; F269-Y318 HydrophobicContact CB-CE2 4.4Å; F269-Y318 AromaticContact CD2-CD1 3.94Å; F269-Y318 HydrophobicContact CD2-CD1 3.94Å; F269-Y318 AromaticContact CD2-CE1 3.5Å; F269-Y318 HydrophobicContact CD2-CE1 3.5Å; F269-Y318 HydrophobicContact CE2-CE1 4.35Å; F269-Y318 HydrophobicContact CG-CE1 4.12Å; Y272-Y318 HydrophobicContact CG-CD1 4.45Å; I313-Y318 HydrophobicContact CD1-CE2 4.05Å; I313-Y318 HydrophobicContact CG1-CE2 3.7Å; L315-Y318 PolarHBondContact O-N 2.91Å; A316-Y318 VanDerWaalsContact C-N 3.34Å; A316-Y318 PolarHBondContact O-N 2.91Å; Y318-S322 PolarHBondContact O-N 3.31Å
319	I	94.3	Very high	93.6	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-72.5	-49.9	176	-55	-52.8	0	0	0	110.4	L271 F299 A316 R317 T321 S322 Y325 W332 T335	L271-I319 HydrophobicContact CD1-CD1 3.86Å; F299-I319 HydrophobicContact CD2-CG1 4.27Å; F299-I319 HydrophobicContact CE2-CD1 4.43Å; F299-I319 HydrophobicContact CE2-CG1 4.25Å; A316-I319 WeakPolarHBondContact O-CB 3.31Å; A316-I319 PolarHBondContact O-N 3.28Å; R317-I319 PolarHBondContact O-N 3.39Å; I319-T321 PolarHBondContact O-N 3.08Å; I319-S322 PolarHBondContact O-N 3.45Å; I319-S322 VanDerWaalsContact O-N 3.16Å; I319-S322 PolarHBondContact O-OG 3.44Å; I319-Y325 HydrophobicContact CG2-CD2 3.84Å; I319-Y325 HydrophobicContact CG2-CE2 4.03Å; I319-Y325 VanDerWaalsContact O-CB 3.28Å; I319-Y325 WeakPolarHBondContact O-CB 3.48Å; I319-Y325 WeakPolarHBondContact O-CD2 3.41Å; I319-W332 HydrophobicContact CD1-CH2 3.59Å; I319-W332 HydrophobicContact CD1-CZ2 3.88Å; I319-W332 HydrophobicContact CD1-CZ3 3.99Å; I319-W332 HydrophobicContact CG1-CE3 4.35Å; I319-W332 HydrophobicContact CG1-CH2 4.21Å; I319-W332 HydrophobicContact CG1-CZ2 4.47Å; I319-W332 HydrophobicContact CG1-CZ3 4.15Å; I319-W332 HydrophobicContact CG2-CD2 3.48Å; I319-W332 VanDerWaalsContact CG2-CD2 3.48Å; I319-W332 HydrophobicContact CG2-CE3 4.02Å; I319-W332 HydrophobicContact CG2-CG 3.73Å; I319-W332 HydrophobicContact CG2-CH2 4.37Å; I319-W332 HydrophobicContact CG2-CZ2 3.87Å; I319-W332 HydrophobicContact CG2-CZ3 4.43Å; I319-T335 HydrophobicContact CB-CG2 4.47Å; I319-T335 HydrophobicContact CG2-CG2 4.15Å
320	K	92.7	Very high	93.5	Very high	74 Å²	74	49.1 Å²	49.1	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-59.7	-30	-178.7	-69.3	168.3	-176.3	171.8	0	112.7	E314 A316 R317 Y325 T335	E314-K320 IonicContact OE1-NZ 3.46Å; E314-K320 PolarHBondContact OE1-NZ 3.18Å; A316-K320 WeakPolarHBondContact O-CG 3.49Å; A316-K320 PolarHBondContact O-N 2.83Å; R317-K320 PolarHBondContact O-N 3Å; R317-K320 VanDerWaalsContact O-N 3.13Å; K320-Y325 HydrophobicContact CB-CE1 4.37Å; K320-Y325 HydrophobicContact CG-CE1 4.35Å; K320-Y325 WeakPolarHBondContact O-CD1 3.43Å; K320-T335 WeakPolarHBondContact CE-O 3.32Å; K320-T335 HydrophobicContact CG-CG2 3.88Å
321	T	92.3	Very high	93.3	Very high	74 Å²	74	53.8 Å²	53.8	45%	0.454	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	3.2	-178.6	60.8	0	0	0	0	114.1	Y272 R317 I319	Y272-T321 WeakPolarHBondContact CE2-O 3.29Å; R317-T321 HydrophobicContact CG-CG2 4.31Å; R317-T321 PolarHBondContact O-N 3.39Å; R317-T321 PolarHBondContact O-OG1 3.29Å; I319-T321 PolarHBondContact O-N 3.08Å
322	S	93.6	Very high	93.2	Very high	9 Å²	9	53.9 Å²	53.9	6%	0.063	27%	0.27	C	S	.	.	S	Bend	trans	-70.5	153.9	179	93	0	0	0	0	111.4	D275 Y318 I319 H324 Y325	D275-S322 VanDerWaalsContact OD2-CB 3.32Å; D275-S322 WeakPolarHBondContact OD2-CB 3.3Å; D275-S322 PolarHBondContact OD2-OG 3.2Å; Y318-S322 PolarHBondContact O-N 3.31Å; I319-S322 PolarHBondContact O-N 3.45Å; I319-S322 VanDerWaalsContact O-N 3.16Å; I319-S322 PolarHBondContact O-OG 3.44Å; S322-H324 VanDerWaalsContact C-N 3.25Å; S322-H324 PolarHBondContact O-N 3.46Å; S322-H324 VanDerWaalsContact O-N 3.17Å; S322-Y325 PolarHBondContact O-N 2.97Å
323	A	93.4	Very high	93.1	Very high	65 Å²	65	55.8 Å²	55.8	54%	0.537	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-33	-170	0	0	0	0	0	114	D275	D275-A323 VanDerWaalsContact O-CB 3.31Å; D275-A323 WeakPolarHBondContact O-CB 3.29Å; D275-A323 PolarHBondContact OD2-N 3.19Å
324	H	95.6	Very high	92.9	Very high	51 Å²	51	55.5 Å²	55.5	24%	0.236	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	23.5	-175.5	-50.8	99.9	0	0	0	113.5	D275 G276 N280 Y282 S322 E327 N328	D275-H324 VanDerWaalsContact CG-ND1 3.32Å; D275-H324 IonicContact OD1-CE1 3.31Å; D275-H324 IonicContact OD1-CG 3.66Å; D275-H324 IonicContact OD1-ND1 2.98Å; D275-H324 PolarHBondContact OD1-ND1 2.95Å; D275-H324 IonicContact OD2-CG 3.9Å; D275-H324 PolarHBondContact OD2-N 3.23Å; D275-H324 IonicContact OD2-ND1 3.76Å; D275-H324 PolarHBondContact OD2-ND1 3.5Å; G276-H324 PolarHBondContact O-CE1 3.18Å; G276-H324 VanDerWaalsContact O-CE1 3.24Å; N280-H324 PolarHBondContact ND2-CD2 2.94Å; N280-H324 PolarHBondContact ND2-CE1 3.21Å; N280-H324 PolarHBondContact ND2-ND1 3.42Å; Y282-H324 HydrophobicContact CD2-CB 4.15Å; Y282-H324 HydrophobicContact CE2-CB 3.89Å; Y282-H324 WeakPolarHBondContact CE2-O 3.26Å; S322-H324 VanDerWaalsContact C-N 3.25Å; S322-H324 PolarHBondContact O-N 3.46Å; S322-H324 VanDerWaalsContact O-N 3.17Å; H324-E327 VanDerWaalsContact CA-OE2 3.28Å; H324-E327 WeakPolarHBondContact CA-OE2 3.24Å; H324-N328 PolarHBondContact O-ND2 3.28Å
325	Y	94.3	Very high	92.6	Very high	22 Å²	22	53.7 Å²	53.7	9%	0.086	28%	0.275	C	S	.	.	S	Bend	trans	-66	-43.8	-179	171.7	-110.2	0	0	0	112.8	I319 K320 S322 E327 N328 K329 W332 T335	I319-Y325 HydrophobicContact CG2-CD2 3.84Å; I319-Y325 HydrophobicContact CG2-CE2 4.03Å; I319-Y325 VanDerWaalsContact O-CB 3.28Å; I319-Y325 WeakPolarHBondContact O-CB 3.48Å; I319-Y325 WeakPolarHBondContact O-CD2 3.41Å; K320-Y325 HydrophobicContact CB-CE1 4.37Å; K320-Y325 HydrophobicContact CG-CE1 4.35Å; K320-Y325 WeakPolarHBondContact O-CD1 3.43Å; S322-Y325 PolarHBondContact O-N 2.97Å; Y325-E327 VanDerWaalsContact C-N 3.32Å; Y325-E327 PolarHBondContact O-N 3.37Å; Y325-N328 CarbonylContact O-C 3.38Å; Y325-N328 WeakPolarHBondContact O-CA 3.27Å; Y325-N328 PolarHBondContact O-N 2.98Å; Y325-K329 HydrophobicContact CD1-CG 4.35Å; Y325-K329 HydrophobicContact CE1-CD 4.24Å; Y325-K329 HydrophobicContact CE1-CG 3.88Å; Y325-K329 HydrophobicContact CE2-CG 4.24Å; Y325-K329 PolarHBondContact O-N 3.01Å; Y325-W332 AromaticContact CE2-CD1 3.92Å; Y325-W332 HydrophobicContact CE2-CG 4.48Å; Y325-T335 HydrophobicContact CE2-CG2 3.93Å; Y325-T335 PolarHBondContact OH-OG1 3.43Å
326	E	92.9	Very high	92	Very high	123 Å²	123	58 Å²	58	58%	0.575	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-59.1	-39.9	-171.9	-77.1	-67.1	141.9	0	0	112.7	N328 K329	E326-N328 PolarHBondContact O-N 2.96Å; E326-K329 WeakPolarHBondContact OE1-CE 3.5Å; E326-K329 IonicContact OE1-NZ 3.58Å; E326-K329 PolarHBondContact OE1-NZ 3.48Å; E326-K329 WeakPolarHBondContact OE2-CE 3.49Å; E326-K329 IonicContact OE2-NZ 2.77Å; E326-K329 PolarHBondContact OE2-NZ 3.08Å
327	E	92.8	Very high	90.8	Very high	135 Å²	135	60.2 Å²	60.2	63%	0.631	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-76	-13.9	177.4	-49	85.1	-163.8	0	0	113.1	H324 Y325	H324-E327 VanDerWaalsContact CA-OE2 3.28Å; H324-E327 WeakPolarHBondContact CA-OE2 3.24Å; Y325-E327 VanDerWaalsContact C-N 3.32Å; Y325-E327 PolarHBondContact O-N 3.37Å
328	N	93.8	Very high	89.3	Confident	39 Å²	39	57 Å²	57	21%	0.209	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-124.2	20.4	-169.3	-65.6	-80.2	0	0	0	113.7	Y282 H324 Y325 E326 S330 R331	Y282-N328 HydrophobicContact CD1-CB 3.8Å; Y282-N328 HydrophobicContact CD2-CB 4.22Å; Y282-N328 HydrophobicContact CE1-CB 3.3Å; Y282-N328 HydrophobicContact CE2-CB 3.81Å; Y282-N328 HydrophobicContact CG-CB 4.2Å; H324-N328 PolarHBondContact O-ND2 3.28Å; Y325-N328 CarbonylContact O-C 3.38Å; Y325-N328 WeakPolarHBondContact O-CA 3.27Å; Y325-N328 PolarHBondContact O-N 2.98Å; E326-N328 PolarHBondContact O-N 2.96Å; N328-S330 PolarHBondContact O-N 3.08Å; N328-S330 VanDerWaalsContact O-N 3.13Å; N328-R331 HydrophobicContact CB-CG 4.3Å; N328-R331 WeakPolarHBondContact O-CB 3.34Å; N328-R331 WeakPolarHBondContact O-CG 3.39Å; N328-R331 PolarHBondContact O-N 3.42Å
329	K	90.6	Very high	87.9	Confident	93 Å²	93	60.8 Å²	60.8	40%	0.404	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-52.1	-37.5	-179.2	-69.1	-172.9	175.7	177	0	113.9	Y325 E326 R331 W332	Y325-K329 HydrophobicContact CD1-CG 4.35Å; Y325-K329 HydrophobicContact CE1-CD 4.24Å; Y325-K329 HydrophobicContact CE1-CG 3.88Å; Y325-K329 HydrophobicContact CE2-CG 4.24Å; Y325-K329 PolarHBondContact O-N 3.01Å; E326-K329 WeakPolarHBondContact OE1-CE 3.5Å; E326-K329 IonicContact OE1-NZ 3.58Å; E326-K329 PolarHBondContact OE1-NZ 3.48Å; E326-K329 WeakPolarHBondContact OE2-CE 3.49Å; E326-K329 IonicContact OE2-NZ 2.77Å; E326-K329 PolarHBondContact OE2-NZ 3.08Å; K329-R331 PolarHBondContact O-N 2.92Å; K329-R331 VanDerWaalsContact O-N 3.1Å; K329-W332 PolarHBondContact O-N 3.49Å
330	S	91.4	Very high	86.7	Confident	118 Å²	118	64.6 Å²	64.6	83%	0.825	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-63.9	-13.9	-178.4	58	0	0	0	0	114.4	N328 W332	N328-S330 PolarHBondContact O-N 3.08Å; N328-S330 VanDerWaalsContact O-N 3.13Å; S330-W332 VanDerWaalsContact C-N 3.33Å
331	R	89.1	Confident	85.7	Confident	99 Å²	99	64.3 Å²	64.3	37%	0.374	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-79.1	-14.5	178.1	-61.5	-63.5	-57.8	-87.1	-3	113.5	Y282 D285 N328 K329	Y282-R331 HydrophobicContact CD1-CG 4.35Å; Y282-R331 HydrophobicContact CE1-CB 4.34Å; Y282-R331 HydrophobicContact CE1-CG 4.3Å; D285-R331 IonicContact OD2-CZ 3.4Å; D285-R331 IonicContact OD2-NH1 2.66Å; D285-R331 IonicContact OD2-NH2 3.62Å; D285-R331 PolarHBondContact OD2-NH2 3.26Å; N328-R331 HydrophobicContact CB-CG 4.3Å; N328-R331 WeakPolarHBondContact O-CB 3.34Å; N328-R331 WeakPolarHBondContact O-CG 3.39Å; N328-R331 PolarHBondContact O-N 3.42Å; K329-R331 PolarHBondContact O-N 2.92Å; K329-R331 VanDerWaalsContact O-N 3.1Å
332	W	92.9	Very high	84.4	Confident	11 Å²	11	63.2 Å²	63.2	4%	0.042	37%	0.374	C	S	.	.			trans	-119.7	130.9	-168.1	-61.3	104.5	0	0	0	111.8	L271 Y282 L292 D296 I319 Y325 K329 S330 T335	L271-W332 HydrophobicContact CD1-CH2 4.14Å; Y282-W332 HydrophobicContact CE1-CZ2 4.44Å; Y282-W332 AromaticContact CE1-NE1 3.58Å; Y282-W332 AromaticContact CZ-NE1 3.74Å; Y282-W332 PolarHBondContact OH-NE1 3.28Å; L292-W332 HydrophobicContact CB-CH2 4.04Å; L292-W332 HydrophobicContact CB-CZ2 4.36Å; L292-W332 HydrophobicContact CD1-CZ2 4.25Å; L292-W332 HydrophobicContact CD2-CH2 3.92Å; L292-W332 HydrophobicContact CD2-CZ2 4.16Å; L292-W332 HydrophobicContact CG-CH2 4.41Å; L292-W332 HydrophobicContact CG-CZ2 4.49Å; D296-W332 HydrophobicContact CB-CE3 3.68Å; D296-W332 HydrophobicContact CB-CZ3 3.82Å; D296-W332 WeakPolarHBondContact OD1-CA 3.42Å; I319-W332 HydrophobicContact CD1-CH2 3.59Å; I319-W332 HydrophobicContact CD1-CZ2 3.88Å; I319-W332 HydrophobicContact CD1-CZ3 3.99Å; I319-W332 HydrophobicContact CG1-CE3 4.35Å; I319-W332 HydrophobicContact CG1-CH2 4.21Å; I319-W332 HydrophobicContact CG1-CZ2 4.47Å; I319-W332 HydrophobicContact CG1-CZ3 4.15Å; I319-W332 HydrophobicContact CG2-CD2 3.48Å; I319-W332 VanDerWaalsContact CG2-CD2 3.48Å; I319-W332 HydrophobicContact CG2-CE3 4.02Å; I319-W332 HydrophobicContact CG2-CG 3.73Å; I319-W332 HydrophobicContact CG2-CH2 4.37Å; I319-W332 HydrophobicContact CG2-CZ2 3.87Å; I319-W332 HydrophobicContact CG2-CZ3 4.43Å; Y325-W332 AromaticContact CE2-CD1 3.92Å; Y325-W332 HydrophobicContact CE2-CG 4.48Å; K329-W332 PolarHBondContact O-N 3.49Å; S330-W332 VanDerWaalsContact C-N 3.33Å; W332-T335 HydrophobicContact CB-CG2 4.02Å
333	T	91.8	Very high	83.1	Confident	65 Å²	65	66.7 Å²	66.7	40%	0.399	39%	0.386	S	S	.	.	S	Bend	trans	-110.7	-15.3	175	71.5	0	0	0	0	112.6	D296 K300 T335	D296-T333 VanDerWaalsContact CG-N 3.34Å; D296-T333 PolarHBondContact OD1-N 2.9Å; D296-T333 WeakPolarHBondContact OD2-CB 3.33Å; D296-T333 PolarHBondContact OD2-N 2.91Å; D296-T333 VanDerWaalsContact OD2-N 3.14Å; D296-T333 PolarHBondContact OD2-OG1 2.92Å; K300-T333 WeakPolarHBondContact CD-OG1 3.24Å; K300-T333 PolarHBondContact NZ-O 3.13Å; T333-T335 VanDerWaalsContact C-N 3.25Å; T333-T335 PolarHBondContact O-N 3.39Å
334	C	89.5	Confident	82.2	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-14.8	175	70.9	0	0	0	0	113.6	D296 F299 K300	D296-C334 WeakPolarHBondContact OD1-CB 3.37Å; D296-C334 PolarHBondContact OD1-N 2.6Å; D296-C334 PolarHBondContact OD1-SG 3.2Å; F299-C334 HydrophobicContact CB-CB 3.73Å; K300-C334 HydrophobicContact CB-CB 4.05Å
335	T	88.1	Confident	81.3	Confident	20 Å²	20	65.1 Å²	65.1	12%	0.123	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-13.6	-177.8	58.1	0	0	0	0	114	A316 I319 K320 Y325 W332 T333	A316-T335 HydrophobicContact CB-CG2 4.41Å; I319-T335 HydrophobicContact CB-CG2 4.47Å; I319-T335 HydrophobicContact CG2-CG2 4.15Å; K320-T335 WeakPolarHBondContact CE-O 3.32Å; K320-T335 HydrophobicContact CG-CG2 3.88Å; Y325-T335 HydrophobicContact CE2-CG2 3.93Å; Y325-T335 PolarHBondContact OH-OG1 3.43Å; W332-T335 HydrophobicContact CB-CG2 4.02Å; T333-T335 VanDerWaalsContact C-N 3.25Å; T333-T335 PolarHBondContact O-N 3.39Å
336	S	81.6	Confident	80.5	Confident	90 Å²	90	66.3 Å²	66.3	63%	0.629	38%	0.381	S	S	*	.			trans	-98	102.4	175	-58.4	0	0	0	0	110.3
337	S	68.6	Low	79.9	Confident	48 Å²	48	67.6 Å²	67.6	34%	0.336	39%	0.387	S	S	.	.			trans	-128.5	135.4	175.3	-55.4	0	0	0	0	109.8	Q303	Q303-S337 PolarHBondContact NE2-OG 3.36Å; Q303-S337 PolarHBondContact OE1-OG 3.25Å
338	G	62.3	Low	79.5	Confident	48 Å²	48	63.2 Å²	63.2	50%	0.495	37%	0.367	S	S	.	.			trans	-95.5	176.3	167.6	0	0	0	0	0	111.3	S340	G338-S340 PolarHBondContact O-N 3.07Å; G338-S340 VanDerWaalsContact O-N 3.1Å
339	S	64.7	Low	79.3	Confident	91 Å²	91	61.7 Å²	61.7	64%	0.636	36%	0.358	S	S	*	.	S	Bend	trans	-69.5	4	172.7	54.2	0	0	0	0	114.3
340	S	69.3	Low	79.3	Confident	81 Å²	81	62.5 Å²	62.5	57%	0.566	37%	0.366	S	S	*	.	S	Bend	trans	-79.1	134.3	177.5	56.7	0	0	0	0	111.2	G338 Q342 W414	G338-S340 PolarHBondContact O-N 3.07Å; G338-S340 VanDerWaalsContact O-N 3.1Å; S340-Q342 PolarHBondContact O-N 3.24Å; S340-W414 VanDerWaalsContact O-CZ2 3.25Å; S340-W414 WeakPolarHBondContact O-CZ2 3.43Å
341	P	70.7	Confident	79.3	Confident	68 Å²	68	61.5 Å²	61.5	44%	0.442	35%	0.348	S	S	.	.			trans	-59.8	131.7	179.9	25.1	-33.5	0	0	0	111.3	Y343 W414	P341-Y343 VanDerWaalsContact C-N 3.25Å; P341-Y343 PolarHBondContact O-N 3.21Å; P341-W414 VanDerWaalsContact CA-CH2 3.49Å; P341-W414 HydrophobicContact CB-CH2 4.25Å; P341-W414 HydrophobicContact CB-CZ3 4.21Å
342	Q	65.1	Low	79.5	Confident	51 Å²	51	57.1 Å²	57.1	24%	0.238	33%	0.332	C	S	.	.	S	Bend	trans	-66.3	-29.9	-179.9	-172.5	178.5	14.5	0	0	112.5	K300 Q301 S340	K300-Q342 PolarHBondContact O-NE2 2.86Å; Q301-Q342 PolarHBondContact O-NE2 3.34Å; S340-Q342 PolarHBondContact O-N 3.24Å
343	Y	67.3	Low	79.4	Confident	83 Å²	83	62.4 Å²	62.4	33%	0.325	35%	0.352	S	S	.	.			trans	-133.5	133	179.2	-70.8	-76	0	0	0	110.5	Q301 P341 Q348	Q301-Y343 WeakPolarHBondContact CG-OH 3.49Å; Q301-Y343 WeakPolarHBondContact O-CE2 3.41Å; Q301-Y343 PolarHBondContact O-OH 3.42Å; P341-Y343 VanDerWaalsContact C-N 3.25Å; P341-Y343 PolarHBondContact O-N 3.21Å; Y343-Q348 VanDerWaalsContact CD1-NE2 3.31Å
344	N	72.9	Confident	79.4	Confident	80 Å²	80	63.7 Å²	63.7	43%	0.428	35%	0.354	S	S	.	.			trans	-88.5	110.2	166.3	-171.3	-67	0	0	0	108.5	C346 E347 Q348	N344-C346 PolarHBondContact O-N 3.48Å; N344-C346 WeakPolarHBondContact OD1-CA 3.2Å; N344-C346 WeakPolarHBondContact OD1-CB 3.45Å; N344-C346 PolarHBondContact OD1-N 2.85Å; N344-E347 HydrophobicContact CB-CB 4.34Å; N344-E347 HydrophobicContact CB-CG 4.17Å; N344-E347 PolarHBondContact O-N 3.44Å; N344-E347 PolarHBondContact OD1-N 3.18Å; N344-Q348 PolarHBondContact O-N 2.88Å
345	I	77.6	Confident	79.6	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-61.2	-34.1	179.8	-171.9	62.6	0	0	0	111.5	E347 Q348 M349 V411 E447 A450	I345-E347 VanDerWaalsContact C-N 3.33Å; I345-E347 PolarHBondContact O-N 3.41Å; I345-Q348 PolarHBondContact O-N 2.91Å; I345-Q348 VanDerWaalsContact O-N 3.08Å; I345-M349 HydrophobicContact CG1-SD 4.48Å; I345-M349 WeakPolarHBondContact O-CG 3.41Å; I345-M349 PolarHBondContact O-N 3.16Å; I345-V411 HydrophobicContact CD1-CG2 4.48Å; I345-E447 HydrophobicContact CG2-CB 4.31Å; I345-E447 HydrophobicContact CG2-CG 3.9Å; I345-A450 HydrophobicContact CG1-CB 4.17Å; I345-A450 HydrophobicContact CG2-CB 4.03Å
346	C	77.1	Confident	79.7	Confident	47 Å²	47	66.8 Å²	66.8	32%	0.318	37%	0.368	S	S	.	.	H	α-helix	trans	-64.5	-35.1	179.7	-55.9	0	0	0	0	112.5	N344 Q348 M349	N344-C346 PolarHBondContact O-N 3.48Å; N344-C346 WeakPolarHBondContact OD1-CA 3.2Å; N344-C346 WeakPolarHBondContact OD1-CB 3.45Å; N344-C346 PolarHBondContact OD1-N 2.85Å; C346-Q348 VanDerWaalsContact C-N 3.32Å; C346-M349 WeakPolarHBondContact O-CB 3.23Å; C346-M349 PolarHBondContact O-N 3.25Å
347	E	81.4	Confident	79.9	Confident	151 Å²	151	68.5 Å²	68.5	71%	0.706	37%	0.367	S	S	*	.	H	α-helix	trans	-67.5	-34.5	172.9	-72.3	-171.5	155.4	0	0	112	N344 I345 M349	N344-E347 HydrophobicContact CB-CB 4.34Å; N344-E347 HydrophobicContact CB-CG 4.17Å; N344-E347 PolarHBondContact O-N 3.44Å; N344-E347 PolarHBondContact OD1-N 3.18Å; I345-E347 VanDerWaalsContact C-N 3.33Å; I345-E347 PolarHBondContact O-N 3.41Å; E347-M349 VanDerWaalsContact C-N 3.34Å
348	Q	84.5	Confident	80.9	Confident	42 Å²	42	73.1 Å²	73.1	20%	0.196	38%	0.378	C	S	.	.	H	α-helix	trans	-75.8	-22.2	178.6	-62.8	-166.3	63.1	0	0	113.2	Y343 N344 I345 C346 I350 Q351 I352 H407	Y343-Q348 VanDerWaalsContact CD1-NE2 3.31Å; N344-Q348 PolarHBondContact O-N 2.88Å; I345-Q348 PolarHBondContact O-N 2.91Å; I345-Q348 VanDerWaalsContact O-N 3.08Å; C346-Q348 VanDerWaalsContact C-N 3.32Å; Q348-I350 PolarHBondContact O-N 3.26Å; Q348-Q351 PolarHBondContact O-N 3.43Å; Q348-I352 HydrophobicContact CB-CD1 4.43Å; Q348-I352 WeakPolarHBondContact O-CG1 3.5Å; Q348-I352 PolarHBondContact O-N 2.94Å; Q348-I352 VanDerWaalsContact O-N 3.1Å; Q348-H407 PolarHBondContact OE1-CE1 3.07Å; Q348-H407 PolarHBondContact OE1-ND1 3.15Å
349	M	88.3	Confident	82.3	Confident	7 Å²	7	71 Å²	71	3%	0.034	36%	0.355	C	S	.	.	H	α-helix	trans	-57	-33.4	179.4	-72.8	-51.9	-65.8	0	0	113.1	I345 C346 E347 I352 R353 A450 E453 V454 M457	I345-M349 HydrophobicContact CG1-SD 4.48Å; I345-M349 WeakPolarHBondContact O-CG 3.41Å; I345-M349 PolarHBondContact O-N 3.16Å; C346-M349 WeakPolarHBondContact O-CB 3.23Å; C346-M349 PolarHBondContact O-N 3.25Å; E347-M349 VanDerWaalsContact C-N 3.34Å; M349-I352 PolarHBondContact O-N 3.41Å; M349-R353 WeakPolarHBondContact O-CB 3.38Å; M349-R353 VanDerWaalsContact O-CG 3.22Å; M349-R353 WeakPolarHBondContact O-CG 3.2Å; M349-R353 PolarHBondContact O-N 3.18Å; M349-A450 HydrophobicContact CG-CB 3.74Å; M349-A450 HydrophobicContact SD-CB 3.82Å; M349-E453 HydrophobicContact CE-CB 3.55Å; M349-E453 HydrophobicContact CE-CG 4.33Å; M349-E453 VanDerWaalsContact CE-OE2 3.25Å; M349-E453 WeakPolarHBondContact CE-OE2 3.28Å; M349-V454 HydrophobicContact CE-CG2 3.92Å; M349-V454 HydrophobicContact SD-CG2 3.41Å; M349-V454 WeakPolarHBondContact SD-CG2 3.33Å; M349-M457 HydrophobicContact CE-CE 3.86Å
350	I	90.6	Very high	83.2	Confident	110 Å²	110	68.3 Å²	68.3	56%	0.564	33%	0.333	S	S	*	.	H	α-helix	trans	-61.6	-53.1	-179.9	-61.4	173	0	0	0	109.7	Q348 I352 R353 E354	Q348-I350 PolarHBondContact O-N 3.26Å; I350-I352 PolarHBondContact O-N 3.37Å; I350-R353 PolarHBondContact O-N 2.98Å; I350-E354 WeakPolarHBondContact O-CG 3.38Å; I350-E354 PolarHBondContact O-N 2.9Å
351	Q	91.4	Very high	83.7	Confident	97 Å²	97	67.4 Å²	67.4	45%	0.453	33%	0.327	S	S	.	.	H	α-helix	trans	-62.4	-43.4	179.9	-173.4	61.5	55.4	0	0	111.6	Q348 R353 E354 D355	Q348-Q351 PolarHBondContact O-N 3.43Å; Q351-R353 PolarHBondContact O-N 3.5Å; Q351-E354 PolarHBondContact O-N 3.48Å; Q351-D355 PolarHBondContact NE2-OD1 2.81Å; Q351-D355 PolarHBondContact NE2-OD2 3.29Å; Q351-D355 PolarHBondContact O-N 3.21Å
352	I	93.5	Very high	84.5	Confident	7 Å²	7	66.6 Å²	66.6	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-60.1	-46.1	179.1	-66.4	172.1	0	0	0	110.8	Q348 M349 I350 D355 H356 W404 V454 M457	Q348-I352 HydrophobicContact CB-CD1 4.43Å; Q348-I352 WeakPolarHBondContact O-CG1 3.5Å; Q348-I352 PolarHBondContact O-N 2.94Å; Q348-I352 VanDerWaalsContact O-N 3.1Å; M349-I352 PolarHBondContact O-N 3.41Å; I350-I352 PolarHBondContact O-N 3.37Å; I352-D355 PolarHBondContact O-N 3.01Å; I352-H356 VanDerWaalsContact O-CB 3.26Å; I352-H356 WeakPolarHBondContact O-CB 3.44Å; I352-H356 PolarHBondContact O-N 3.07Å; I352-W404 HydrophobicContact CG2-CD2 4.32Å; I352-W404 HydrophobicContact CG2-CG 4.33Å; I352-W404 HydrophobicContact CG2-CZ2 4.4Å; I352-V454 HydrophobicContact CD1-CG2 3.95Å; I352-V454 HydrophobicContact CG2-CG2 4.4Å; I352-M457 HydrophobicContact CB-CE 4.48Å; I352-M457 HydrophobicContact CG2-CE 3.37Å; I352-M457 HydrophobicContact CG2-SD 4.03Å
353	R	91.6	Very high	85.3	Confident	122 Å²	122	64.4 Å²	64.4	46%	0.46	31%	0.307	S	S	.	.	H	α-helix	trans	-65	-39.2	178.5	-72.1	175.3	-175.4	174.4	6.9	112	M349 I350 Q351 M357 E453 M457	M349-R353 WeakPolarHBondContact O-CB 3.38Å; M349-R353 VanDerWaalsContact O-CG 3.22Å; M349-R353 WeakPolarHBondContact O-CG 3.2Å; M349-R353 PolarHBondContact O-N 3.18Å; I350-R353 PolarHBondContact O-N 2.98Å; Q351-R353 PolarHBondContact O-N 3.5Å; R353-M357 WeakPolarHBondContact O-CB 3.38Å; R353-M357 PolarHBondContact O-N 3.22Å; R353-E453 IonicContact CZ-OE1 3.74Å; R353-E453 IonicContact CZ-OE2 2.79Å; R353-E453 IonicContact NE-OE2 2.78Å; R353-E453 PolarHBondContact NE-OE2 3.37Å; R353-E453 IonicContact NH2-OE1 3.88Å; R353-E453 PolarHBondContact NH2-OE1 3.32Å; R353-E453 IonicContact NH2-OE2 3.36Å; R353-E453 PolarHBondContact NH2-OE2 3.07Å; R353-M457 HydrophobicContact CG-CE 4.38Å; R353-M457 HydrophobicContact CG-SD 4.39Å
354	E	92.1	Very high	85.7	Confident	93 Å²	93	62.2 Å²	62.2	44%	0.435	31%	0.306	S	S	.	.	H	α-helix	trans	-63.9	-46	176.2	-76.1	-176.3	-171.6	0	0	112.2	I350 Q351 M357 R358	I350-E354 WeakPolarHBondContact O-CG 3.38Å; I350-E354 PolarHBondContact O-N 2.9Å; Q351-E354 PolarHBondContact O-N 3.48Å; E354-M357 PolarHBondContact O-N 2.91Å; E354-R358 WeakPolarHBondContact O-CB 3.3Å; E354-R358 PolarHBondContact O-N 3.23Å
355	D	92.6	Very high	85.8	Confident	34 Å²	34	67 Å²	67	18%	0.182	32%	0.318	C	S	.	.	H	α-helix	trans	-69.7	-38	179.9	-67.7	-29.2	0	0	0	111.6	Q351 I352 R358 F359 L400	Q351-D355 PolarHBondContact NE2-OD1 2.81Å; Q351-D355 PolarHBondContact NE2-OD2 3.29Å; Q351-D355 PolarHBondContact O-N 3.21Å; I352-D355 PolarHBondContact O-N 3.01Å; D355-R358 PolarHBondContact O-N 2.88Å; D355-R358 IonicContact OD1-CZ 3.85Å; D355-R358 IonicContact OD1-NH1 3.14Å; D355-R358 PolarHBondContact OD1-NH1 2.69Å; D355-F359 VanDerWaalsContact O-CB 3.27Å; D355-F359 WeakPolarHBondContact O-CB 3.48Å; D355-F359 PolarHBondContact O-N 2.99Å; D355-L400 HydrophobicContact CB-CD1 3.92Å
356	H	90.9	Very high	85.7	Confident	51 Å²	51	70.2 Å²	70.2	24%	0.236	33%	0.331	C	S	.	.	H	α-helix	trans	-57.9	-50.4	171.7	175.9	-90.2	0	0	0	111.2	I352 I360 W404 M457	I352-H356 VanDerWaalsContact O-CB 3.26Å; I352-H356 WeakPolarHBondContact O-CB 3.44Å; I352-H356 PolarHBondContact O-N 3.07Å; H356-I360 VanDerWaalsContact CD2-CD1 3.43Å; H356-I360 WeakPolarHBondContact CD2-CD1 3.44Å; H356-I360 WeakPolarHBondContact NE2-CD1 3.46Å; H356-I360 WeakPolarHBondContact O-CB 3.32Å; H356-I360 WeakPolarHBondContact O-CG1 3.34Å; H356-I360 PolarHBondContact O-N 2.71Å; H356-W404 HydrophobicContact CB-CH2 3.61Å; H356-W404 HydrophobicContact CB-CZ2 3.78Å; H356-W404 AromaticContact CD2-CH2 3.63Å; H356-W404 AromaticContact CD2-CZ3 3.98Å; H356-M457 HydrophobicContact CB-SD 3.76Å; H356-M457 VanDerWaalsContact CD2-CG 3.48Å; H356-M457 WeakPolarHBondContact CD2-CG 3.38Å
357	M	86	Confident	85.2	Confident	125 Å²	125	69.8 Å²	69.8	62%	0.616	33%	0.328	S	S	*	.	H	α-helix	trans	-59.2	-49.4	177.6	178.9	62.6	74.3	0	0	111.5	R353 E354 S361	R353-M357 WeakPolarHBondContact O-CB 3.38Å; R353-M357 PolarHBondContact O-N 3.22Å; E354-M357 PolarHBondContact O-N 2.91Å; M357-S361 WeakPolarHBondContact O-CB 3.48Å; M357-S361 PolarHBondContact O-N 3.35Å; M357-S361 VanDerWaalsContact O-N 3.16Å; M357-S361 PolarHBondContact O-OG 3.36Å
358	R	90.1	Very high	84.3	Confident	146 Å²	146	67.4 Å²	67.4	55%	0.551	32%	0.32	S	S	*	.	H	α-helix	trans	-63.8	-49.9	-176.3	-168.1	-175.4	-60.6	127.3	5.1	111.5	E354 D355 E362	E354-R358 WeakPolarHBondContact O-CB 3.3Å; E354-R358 PolarHBondContact O-N 3.23Å; D355-R358 PolarHBondContact O-N 2.88Å; D355-R358 IonicContact OD1-CZ 3.85Å; D355-R358 IonicContact OD1-NH1 3.14Å; D355-R358 PolarHBondContact OD1-NH1 2.69Å; R358-E362 PolarHBondContact O-N 3.19Å
359	F	91.9	Very high	83	Confident	4 Å²	4	67.9 Å²	67.9	2%	0.018	33%	0.328	C	S	.	.	H	α-helix	trans	-71.1	-46	-175.1	-177.6	-104	0	0	0	112.7	D355 S361 E362 L363 L393 Q396 G397 L400 L461 M465	D355-F359 VanDerWaalsContact O-CB 3.27Å; D355-F359 WeakPolarHBondContact O-CB 3.48Å; D355-F359 PolarHBondContact O-N 2.99Å; F359-S361 VanDerWaalsContact C-N 3.3Å; F359-S361 PolarHBondContact O-N 2.66Å; F359-E362 PolarHBondContact O-N 3.32Å; F359-E362 VanDerWaalsContact O-N 3.14Å; F359-L363 HydrophobicContact CE1-CB 4.41Å; F359-L363 HydrophobicContact CE1-CD2 4.06Å; F359-L363 WeakPolarHBondContact O-CB 3.32Å; F359-L363 PolarHBondContact O-N 2.96Å; F359-L393 HydrophobicContact CE2-CD2 3.9Å; F359-L393 WeakPolarHBondContact CZ-O 3.22Å; F359-Q396 HydrophobicContact CD2-CG 3.89Å; F359-Q396 HydrophobicContact CE2-CB 3.88Å; F359-Q396 HydrophobicContact CE2-CG 3.73Å; F359-G397 VanDerWaalsContact CE1-CA 3.47Å; F359-L400 HydrophobicContact CB-CD2 3.73Å; F359-L400 HydrophobicContact CD1-CD2 3.91Å; F359-L400 HydrophobicContact CG-CD2 3.88Å; F359-L461 HydrophobicContact CD1-CD1 4.06Å; F359-L461 HydrophobicContact CD1-CD2 4.02Å; F359-L461 HydrophobicContact CE1-CD1 3.89Å; F359-L461 HydrophobicContact CE1-CD2 4.17Å; F359-M465 HydrophobicContact CE1-SD 4.14Å; F359-M465 HydrophobicContact CZ-SD 4.34Å
360	I	82.7	Confident	81.5	Confident	33 Å²	33	70 Å²	70	17%	0.169	34%	0.338	C	S	.	.	H	α-helix	trans	-65	-37.8	179.6	-71.5	-179.3	0	0	0	111.1	H356 E362 L363 A364 L461 L464	H356-I360 VanDerWaalsContact CD2-CD1 3.43Å; H356-I360 WeakPolarHBondContact CD2-CD1 3.44Å; H356-I360 WeakPolarHBondContact NE2-CD1 3.46Å; H356-I360 WeakPolarHBondContact O-CB 3.32Å; H356-I360 WeakPolarHBondContact O-CG1 3.34Å; H356-I360 PolarHBondContact O-N 2.71Å; I360-E362 VanDerWaalsContact C-N 3.26Å; I360-E362 PolarHBondContact O-N 2.83Å; I360-L363 PolarHBondContact O-N 2.99Å; I360-A364 WeakPolarHBondContact O-CB 3.4Å; I360-A364 PolarHBondContact O-N 3.01Å; I360-L461 HydrophobicContact CD1-CB 4.34Å; I360-L461 HydrophobicContact CD1-CD1 4.3Å; I360-L461 HydrophobicContact CG1-CD1 3.91Å; I360-L464 HydrophobicContact CD1-CD1 4.12Å; I360-L464 HydrophobicContact CG1-CD1 4.28Å; I360-L464 HydrophobicContact CG2-CD1 3.92Å
361	S	80.2	Confident	79.6	Confident	63 Å²	63	69.9 Å²	69.9	44%	0.441	34%	0.342	S	S	.	.	H	α-helix	trans	-59.6	-39.7	174.9	-63.1	0	0	0	0	111.7	M357 F359 R365	M357-S361 WeakPolarHBondContact O-CB 3.48Å; M357-S361 PolarHBondContact O-N 3.35Å; M357-S361 VanDerWaalsContact O-N 3.16Å; M357-S361 PolarHBondContact O-OG 3.36Å; F359-S361 VanDerWaalsContact C-N 3.3Å; F359-S361 PolarHBondContact O-N 2.66Å; S361-R365 WeakPolarHBondContact O-CG 3.38Å
362	E	86.4	Confident	77.3	Confident	51 Å²	51	70.5 Å²	70.5	24%	0.238	35%	0.352	C	S	.	.	H	α-helix	trans	-70.6	-50.7	175.4	-169.6	173.9	179.5	0	0	111.7	R358 F359 I360 A364 R365 Y366 K389 L393	R358-E362 PolarHBondContact O-N 3.19Å; F359-E362 PolarHBondContact O-N 3.32Å; F359-E362 VanDerWaalsContact O-N 3.14Å; I360-E362 VanDerWaalsContact C-N 3.26Å; I360-E362 PolarHBondContact O-N 2.83Å; E362-A364 VanDerWaalsContact C-N 3.32Å; E362-A364 PolarHBondContact O-N 3.34Å; E362-R365 WeakPolarHBondContact O-CB 3.46Å; E362-R365 PolarHBondContact O-N 3.04Å; E362-R365 VanDerWaalsContact O-N 3.1Å; E362-Y366 HydrophobicContact CG-CE2 4.09Å; E362-Y366 WeakPolarHBondContact O-CD2 3.39Å; E362-K389 WeakPolarHBondContact OE1-CE 2.81Å; E362-K389 IonicContact OE1-NZ 3.21Å; E362-K389 PolarHBondContact OE1-NZ 3.37Å; E362-L393 HydrophobicContact CG-CD2 4.15Å
363	L	83.2	Confident	75.1	Confident	4 Å²	4	74.6 Å²	74.6	2%	0.021	38%	0.378	C	S	.	.	H	α-helix	trans	-56.2	-44.2	179.9	178.2	63	0	0	0	112.3	F359 I360 R365 Y366 S367 L461 L464 M465 M468 F472	F359-L363 HydrophobicContact CE1-CB 4.41Å; F359-L363 HydrophobicContact CE1-CD2 4.06Å; F359-L363 WeakPolarHBondContact O-CB 3.32Å; F359-L363 PolarHBondContact O-N 2.96Å; I360-L363 PolarHBondContact O-N 2.99Å; L363-R365 PolarHBondContact O-N 3.27Å; L363-Y366 PolarHBondContact O-N 3.06Å; L363-Y366 VanDerWaalsContact O-N 3.08Å; L363-S367 PolarHBondContact O-N 3.36Å; L363-S367 VanDerWaalsContact O-N 3.1Å; L363-L461 HydrophobicContact CD2-CD1 3.85Å; L363-L464 HydrophobicContact CD2-CB 4.2Å; L363-M465 HydrophobicContact CD1-SD 4.38Å; L363-M465 HydrophobicContact CD2-CG 4.48Å; L363-M465 HydrophobicContact CD2-SD 3.65Å; L363-M468 HydrophobicContact CD1-SD 3.94Å; L363-F472 HydrophobicContact CD1-CE2 4.48Å; L363-F472 HydrophobicContact CD1-CZ 3.66Å
364	A	74.5	Confident	72.9	Confident	38 Å²	38	72 Å²	72	31%	0.314	39%	0.389	S	S	.	.	H	α-helix	trans	-60.5	-31.9	-179.9	0	0	0	0	0	112.6	I360 E362 Y366 S367 N368	I360-A364 WeakPolarHBondContact O-CB 3.4Å; I360-A364 PolarHBondContact O-N 3.01Å; E362-A364 VanDerWaalsContact C-N 3.32Å; E362-A364 PolarHBondContact O-N 3.34Å; A364-Y366 VanDerWaalsContact C-N 3.33Å; A364-Y366 PolarHBondContact O-N 3.41Å; A364-S367 PolarHBondContact O-N 2.94Å; A364-N368 WeakPolarHBondContact O-CB 3.5Å; A364-N368 VanDerWaalsContact O-CG 3.25Å; A364-N368 PolarHBondContact O-N 2.87Å; A364-N368 PolarHBondContact O-ND2 2.95Å
365	R	75.1	Confident	70.3	Confident	179 Å²	179	72.8 Å²	72.8	68%	0.675	41%	0.405	S	S	*	.	H	α-helix	trans	-64.1	-38.2	176.2	-66.9	168.8	67.1	-167.4	0.5	111.9	S361 E362 L363 S369	S361-R365 WeakPolarHBondContact O-CG 3.38Å; E362-R365 WeakPolarHBondContact O-CB 3.46Å; E362-R365 PolarHBondContact O-N 3.04Å; E362-R365 VanDerWaalsContact O-N 3.1Å; L363-R365 PolarHBondContact O-N 3.27Å; R365-S369 WeakPolarHBondContact O-CB 3.3Å; R365-S369 PolarHBondContact O-N 3.06Å; R365-S369 VanDerWaalsContact O-N 3.15Å; R365-S369 PolarHBondContact O-OG 3.03Å
366	Y	74.8	Confident	67.7	Low	71 Å²	71	74.4 Å²	74.4	28%	0.278	43%	0.43	S	S	.	.	H	α-helix	trans	-78	-30	179	-70.7	-89.1	0	0	0	112.6	E362 L363 A364 S369 E370 K389 L390 L393	E362-Y366 HydrophobicContact CG-CE2 4.09Å; E362-Y366 WeakPolarHBondContact O-CD2 3.39Å; L363-Y366 PolarHBondContact O-N 3.06Å; L363-Y366 VanDerWaalsContact O-N 3.08Å; A364-Y366 VanDerWaalsContact C-N 3.33Å; A364-Y366 PolarHBondContact O-N 3.41Å; Y366-S369 PolarHBondContact O-OG 3.23Å; Y366-S369 VanDerWaalsContact O-OG 3.06Å; Y366-E370 WeakPolarHBondContact O-CG 3.28Å; Y366-E370 PolarHBondContact O-N 2.93Å; Y366-K389 HydrophobicContact CE1-CG 3.93Å; Y366-K389 WeakPolarHBondContact OH-CE 3.32Å; Y366-K389 WeakPolarHBondContact OH-CG 3.5Å; Y366-L390 HydrophobicContact CD1-CD2 3.96Å; Y366-L390 HydrophobicContact CG-CD2 4.24Å; Y366-L393 HydrophobicContact CD1-CD1 4.34Å; Y366-L393 HydrophobicContact CD2-CD1 3.39Å; Y366-L393 HydrophobicContact CE2-CD1 3.69Å; Y366-L393 HydrophobicContact CG-CD1 3.77Å
367	S	68.4	Low	65.1	Low	37 Å²	37	82.7 Å²	82.7	26%	0.259	46%	0.459	S	S	.	.	H	α-helix	trans	-68	-44.2	170.7	-171.6	0	0	0	0	111.9	L363 A364 E370 V371	L363-S367 PolarHBondContact O-N 3.36Å; L363-S367 VanDerWaalsContact O-N 3.1Å; A364-S367 PolarHBondContact O-N 2.94Å; S367-E370 PolarHBondContact O-N 2.98Å; S367-V371 WeakPolarHBondContact O-CG2 3.12Å; S367-V371 PolarHBondContact O-N 3.42Å
368	N	60.9	Low	62.8	Low	101 Å²	101	86.1 Å²	86.1	54%	0.54	47%	0.473	S	S	.	.	H	α-helix	trans	-70.7	-34.5	-177.3	-70.1	-19.5	0	0	0	112.1	A364 V371 V372	A364-N368 WeakPolarHBondContact O-CB 3.5Å; A364-N368 VanDerWaalsContact O-CG 3.25Å; A364-N368 PolarHBondContact O-N 2.87Å; A364-N368 PolarHBondContact O-ND2 2.95Å; N368-V371 PolarHBondContact O-N 2.87Å; N368-V372 WeakPolarHBondContact O-CB 3.43Å; N368-V372 VanDerWaalsContact O-CG2 3.26Å; N368-V372 WeakPolarHBondContact O-CG2 3.46Å; N368-V372 PolarHBondContact O-N 2.91Å
369	S	58	Low	60.5	Low	53 Å²	53	88.5 Å²	88.5	37%	0.371	49%	0.491	S	S	.	.	H	α-helix	trans	-66.8	-36.2	176.4	64.3	0	0	0	0	112.7	R365 Y366 T373	R365-S369 WeakPolarHBondContact O-CB 3.3Å; R365-S369 PolarHBondContact O-N 3.06Å; R365-S369 VanDerWaalsContact O-N 3.15Å; R365-S369 PolarHBondContact O-OG 3.03Å; Y366-S369 PolarHBondContact O-OG 3.23Å; Y366-S369 VanDerWaalsContact O-OG 3.06Å; S369-T373 WeakPolarHBondContact O-CB 3.05Å; S369-T373 WeakPolarHBondContact O-CG2 3.5Å; S369-T373 PolarHBondContact O-N 3.46Å; S369-T373 PolarHBondContact O-OG1 3.28Å
370	E	57.3	Low	58.8	Low	51 Å²	51	92.6 Å²	92.6	24%	0.238	53%	0.525	C	S	.	.	H	α-helix	trans	-63	-46.5	172.6	-71.6	-101.1	164.6	0	0	111.9	Y366 S367 T373 G374 K382 M468 V471	Y366-E370 WeakPolarHBondContact O-CG 3.28Å; Y366-E370 PolarHBondContact O-N 2.93Å; S367-E370 PolarHBondContact O-N 2.98Å; E370-T373 PolarHBondContact O-OG1 3.43Å; E370-G374 PolarHBondContact O-N 3.18Å; E370-K382 IonicContact OE1-NZ 3.66Å; E370-K382 PolarHBondContact OE1-NZ 2.98Å; E370-M468 HydrophobicContact CG-CE 4.27Å; E370-V471 VanDerWaalsContact CD-CG1 3.44Å; E370-V471 HydrophobicContact CG-CG1 4.22Å; E370-V471 HydrophobicContact CG-CG2 4.26Å; E370-V471 WeakPolarHBondContact OE1-CG1 3.11Å; E370-V471 WeakPolarHBondContact OE2-CG2 3.46Å
371	V	49.6	Very low	58.1	Low	108 Å²	108	97.9 Å²	97.9	66%	0.655	55%	0.549	S	S	*	.	H	α-helix	trans	-68.7	-38	-178.1	177.7	0	0	0	0	112.2	S367 N368	S367-V371 WeakPolarHBondContact O-CG2 3.12Å; S367-V371 PolarHBondContact O-N 3.42Å; N368-V371 PolarHBondContact O-N 2.87Å
372	V	43	Very low	58.1	Low	109 Å²	109	97.7 Å²	97.7	66%	0.661	54%	0.54	S	S	*	.	H	α-helix	trans	-72.7	-34.5	-179.7	173.2	0	0	0	0	112.1	N368 S375	N368-V372 WeakPolarHBondContact O-CB 3.43Å; N368-V372 VanDerWaalsContact O-CG2 3.26Å; N368-V372 WeakPolarHBondContact O-CG2 3.46Å; N368-V372 PolarHBondContact O-N 2.91Å; V372-S375 PolarHBondContact O-OG 3.37Å
373	T	48.6	Very low	58.1	Low	93 Å²	93	99 Å²	99	57%	0.571	55%	0.552	S	S	*	*	H	α-helix	trans	-82.4	-19.8	-177.7	52.2	0	0	0	0	114.2	S369 E370 S375	S369-T373 WeakPolarHBondContact O-CB 3.05Å; S369-T373 WeakPolarHBondContact O-CG2 3.5Å; S369-T373 PolarHBondContact O-N 3.46Å; S369-T373 PolarHBondContact O-OG1 3.28Å; E370-T373 PolarHBondContact O-OG1 3.43Å; T373-S375 VanDerWaalsContact C-N 3.29Å; T373-S375 PolarHBondContact O-N 3.43Å
374	G	44.6	Very low	58.2	Low	69 Å²	69	102 Å²	102	71%	0.711	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-9.7	-179.6	0	0	0	0	0	116.2	E370	E370-G374 PolarHBondContact O-N 3.18Å
375	S	36.6	Very low	58.7	Low	109 Å²	109	103.6 Å²	103.6	76%	0.762	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	4.4	-171.8	59.9	0	0	0	0	115.9	V372 T373	V372-S375 PolarHBondContact O-OG 3.37Å; T373-S375 VanDerWaalsContact C-N 3.29Å; T373-S375 PolarHBondContact O-N 3.43Å
376	G	37.9	Very low	59.1	Low	68 Å²	68	99.6 Å²	99.6	70%	0.701	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.4	9.2	-176.1	0	0	0	0	0	120.4
377	R	38.2	Very low	59.7	Low	225 Å²	225	96.9 Å²	96.9	85%	0.849	56%	0.56	S	S	*	*			trans	-131.5	121	172.5	-74.8	-173.9	175.3	173.7	-0.5	111.7	E379	R377-E379 PolarHBondContact O-N 3.21Å
378	Q	36.8	Very low	60.7	Low	196 Å²	196	98.6 Å²	98.6	92%	0.916	56%	0.561	S	S	*	*			trans	-51.4	124.7	162.6	-75.6	168.6	-32.9	0	0	109.6	A380	Q378-A380 PolarHBondContact O-N 3.34Å
379	E	42	Very low	62.1	Low	197 Å²	197	96.5 Å²	96.5	92%	0.921	55%	0.547	S	S	*	.			trans	30.6	74.1	153.7	-63.9	178.2	163.6	0	0	117.5	R377	R377-E379 PolarHBondContact O-N 3.21Å
380	A	56.7	Low	63.5	Low	89 Å²	89	94.1 Å²	94.1	74%	0.736	53%	0.53	S	S	*	.			trans	-98.9	107.2	156.3	0	0	0	0	0	108.5	Q378 K382	Q378-A380 PolarHBondContact O-N 3.34Å; A380-K382 PolarHBondContact O-N 3.13Å
381	Q	67.2	Low	65.2	Low	145 Å²	145	92 Å²	92	68%	0.678	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-63.3	128.2	175.3	-167.7	175.8	7.9	0	0	109.5
382	K	79.6	Confident	67.2	Low	58 Å²	58	89.6 Å²	89.6	25%	0.252	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-65.4	159	177.7	-59.8	-177.9	172.2	-168.8	0	111.8	E370 A380 E386 Y387	E370-K382 IonicContact OE1-NZ 3.66Å; E370-K382 PolarHBondContact OE1-NZ 2.98Å; A380-K382 PolarHBondContact O-N 3.13Å; K382-E386 HydrophobicContact CB-CB 4.18Å; K382-Y387 HydrophobicContact CB-CD1 4.37Å; K382-Y387 HydrophobicContact CB-CD2 4.22Å; K382-Y387 HydrophobicContact CB-CE1 3.89Å; K382-Y387 HydrophobicContact CB-CE2 3.76Å; K382-Y387 HydrophobicContact CD-CD1 4.46Å; K382-Y387 HydrophobicContact CD-CE1 4Å; K382-Y387 HydrophobicContact CG-CE1 4.29Å; K382-Y387 VanDerWaalsContact O-CE2 3.23Å; K382-Y387 WeakPolarHBondContact O-CE2 3.44Å
383	T	87.3	Confident	69.6	Low	79 Å²	79	84.4 Å²	84.4	49%	0.485	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-76	159.7	176.9	64.6	0	0	0	0	112.2	A385 E386 Y387	T383-A385 PolarHBondContact O-N 3.18Å; T383-E386 WeakPolarHBondContact CB-OE2 3.49Å; T383-E386 PolarHBondContact N-OE2 2.99Å; T383-E386 PolarHBondContact O-N 2.8Å; T383-E386 WeakPolarHBondContact OG1-CG 3.35Å; T383-E386 PolarHBondContact OG1-N 3.32Å; T383-E386 PolarHBondContact OG1-OE2 2.88Å; T383-Y387 WeakPolarHBondContact O-CD2 3.41Å; T383-Y387 PolarHBondContact O-N 3.44Å; T383-Y387 VanDerWaalsContact O-N 3.15Å
384	D	85.2	Confident	71.7	Confident	67 Å²	67	80 Å²	80	36%	0.358	44%	0.444	S	S	.	.	H	α-helix	trans	-57.8	-34	177.1	-73.9	-5.3	0	0	0	112.5	R388 H478 R549	D384-R388 WeakPolarHBondContact O-CB 3.14Å; D384-R388 PolarHBondContact O-N 3.28Å; D384-H478 IonicContact OD1-CD2 3.8Å; D384-H478 IonicContact OD1-CE1 3.91Å; D384-H478 IonicContact OD1-NE2 3.96Å; D384-H478 PolarHBondContact OD1-NE2 3.26Å; D384-R549 IonicContact OD1-NE 3.56Å; D384-R549 PolarHBondContact OD1-NE 2.99Å; D384-R549 IonicContact OD2-CZ 3.75Å; D384-R549 VanDerWaalsContact OD2-CZ 3.31Å; D384-R549 IonicContact OD2-NE 3.74Å; D384-R549 PolarHBondContact OD2-NE 3.45Å; D384-R549 IonicContact OD2-NH2 3.26Å; D384-R549 PolarHBondContact OD2-NH2 2.69Å
385	A	84.5	Confident	74.1	Confident	72 Å²	72	77.8 Å²	77.8	60%	0.595	42%	0.417	S	S	*	.	H	α-helix	trans	-68.6	-40.6	178.5	0	0	0	0	0	112.4	T383 R388 K389	T383-A385 PolarHBondContact O-N 3.18Å; A385-R388 PolarHBondContact O-N 3.45Å; A385-K389 PolarHBondContact O-N 3.27Å
386	E	83.3	Confident	76.8	Confident	94 Å²	94	76.4 Å²	76.4	44%	0.439	40%	0.398	S	S	.	.	H	α-helix	trans	-66.7	-42.7	177	-70.3	166.4	127.8	0	0	111.4	K382 T383 K389 L390	K382-E386 HydrophobicContact CB-CB 4.18Å; T383-E386 WeakPolarHBondContact CB-OE2 3.49Å; T383-E386 PolarHBondContact N-OE2 2.99Å; T383-E386 PolarHBondContact O-N 2.8Å; T383-E386 WeakPolarHBondContact OG1-CG 3.35Å; T383-E386 PolarHBondContact OG1-N 3.32Å; T383-E386 PolarHBondContact OG1-OE2 2.88Å; E386-K389 PolarHBondContact O-N 2.88Å; E386-L390 PolarHBondContact O-N 3.47Å
387	Y	86.9	Confident	79.5	Confident	15 Å²	15	73.2 Å²	73.2	6%	0.059	37%	0.365	C	S	.	.	H	α-helix	trans	-64.7	-41	174.2	-70.5	-51.8	0	0	0	112.1	K382 T383 K389 L390 F391 H474 A475 H478 T479	K382-Y387 HydrophobicContact CB-CD1 4.37Å; K382-Y387 HydrophobicContact CB-CD2 4.22Å; K382-Y387 HydrophobicContact CB-CE1 3.89Å; K382-Y387 HydrophobicContact CB-CE2 3.76Å; K382-Y387 HydrophobicContact CD-CD1 4.46Å; K382-Y387 HydrophobicContact CD-CE1 4Å; K382-Y387 HydrophobicContact CG-CE1 4.29Å; K382-Y387 VanDerWaalsContact O-CE2 3.23Å; K382-Y387 WeakPolarHBondContact O-CE2 3.44Å; T383-Y387 WeakPolarHBondContact O-CD2 3.41Å; T383-Y387 PolarHBondContact O-N 3.44Å; T383-Y387 VanDerWaalsContact O-N 3.15Å; Y387-K389 VanDerWaalsContact C-N 3.3Å; Y387-K389 PolarHBondContact O-N 3.49Å; Y387-L390 PolarHBondContact O-N 2.95Å; Y387-F391 PolarHBondContact O-N 3.36Å; Y387-H474 AromaticContact CE1-CD2 3.49Å; Y387-H474 VanDerWaalsContact CE1-CD2 3.49Å; Y387-H474 WeakPolarHBondContact CE1-CD2 3.18Å; Y387-H474 AromaticContact CE1-NE2 3.75Å; Y387-H474 AromaticContact CZ-CD2 3.87Å; Y387-H474 AromaticContact CZ-NE2 3.6Å; Y387-H474 PolarHBondContact OH-NE2 3.44Å; Y387-H474 VanDerWaalsContact OH-NE2 3.13Å; Y387-A475 HydrophobicContact CD1-CB 3.73Å; Y387-H478 HydrophobicContact CD2-CB 4.2Å; Y387-H478 AromaticContact CD2-CD2 3.3Å; Y387-H478 WeakPolarHBondContact CD2-CD2 3.38Å; Y387-H478 AromaticContact CD2-CE1 3.79Å; Y387-H478 AromaticContact CD2-CG 3.55Å; Y387-H478 AromaticContact CD2-ND1 3.88Å; Y387-H478 AromaticContact CD2-NE2 3.48Å; Y387-H478 WeakPolarHBondContact CD2-NE2 3.46Å; Y387-H478 AromaticContact CE2-CD2 3.97Å; Y387-H478 AromaticContact CE2-CE1 3.73Å; Y387-H478 AromaticContact CE2-CG 3.85Å; Y387-H478 AromaticContact CE2-ND1 3.73Å; Y387-H478 AromaticContact CE2-NE2 3.9Å; Y387-H478 HydrophobicContact CG-CB 4.25Å; Y387-H478 AromaticContact CG-CD2 3.89Å; Y387-T479 VanDerWaalsContact C-OG1 3.28Å; Y387-T479 PolarHBondContact O-OG1 2.89Å
388	R	90.6	Very high	82.2	Confident	73 Å²	73	62.5 Å²	62.5	28%	0.275	32%	0.324	S	S	.	.	H	α-helix	trans	-61	-40.6	175.8	178.9	56.4	-175.4	-135.9	-9.3	111.7	D384 A385 L390 F391 D392 T479 E598	D384-R388 WeakPolarHBondContact O-CB 3.14Å; D384-R388 PolarHBondContact O-N 3.28Å; A385-R388 PolarHBondContact O-N 3.45Å; R388-L390 VanDerWaalsContact C-N 3.34Å; R388-L390 PolarHBondContact O-N 2.93Å; R388-F391 WeakPolarHBondContact O-CB 3.31Å; R388-F391 PolarHBondContact O-N 2.92Å; R388-D392 IonicContact CZ-OD1 2.98Å; R388-D392 IonicContact NE-OD1 3.3Å; R388-D392 PolarHBondContact NE-OD1 3.34Å; R388-D392 IonicContact NE-OD2 2.76Å; R388-D392 IonicContact NH2-OD1 3.9Å; R388-D392 VanDerWaalsContact O-CG 3.24Å; R388-D392 PolarHBondContact O-N 2.7Å; R388-T479 HydrophobicContact CB-CG2 4.36Å; R388-T479 PolarHBondContact N-OG1 3.43Å; R388-E598 IonicContact CZ-OE2 2.82Å; R388-E598 IonicContact NH1-OE2 3.29Å; R388-E598 PolarHBondContact NH1-OE2 3.35Å; R388-E598 IonicContact NH2-OE2 3.66Å; R388-E598 PolarHBondContact NH2-OE2 2.98Å; R388-E598 VanDerWaalsContact NH2-OE2 3.12Å
389	K	89.3	Confident	84.9	Confident	57 Å²	57	56.2 Å²	56.2	25%	0.248	30%	0.295	C	S	.	.	H	α-helix	trans	-63.5	-39.5	178.2	-177.8	55.3	-179.3	173.9	0	112.5	E362 Y366 A385 E386 Y387 D392 L393	E362-K389 WeakPolarHBondContact OE1-CE 2.81Å; E362-K389 IonicContact OE1-NZ 3.21Å; E362-K389 PolarHBondContact OE1-NZ 3.37Å; Y366-K389 HydrophobicContact CE1-CG 3.93Å; Y366-K389 WeakPolarHBondContact OH-CE 3.32Å; Y366-K389 WeakPolarHBondContact OH-CG 3.5Å; A385-K389 PolarHBondContact O-N 3.27Å; E386-K389 PolarHBondContact O-N 2.88Å; Y387-K389 VanDerWaalsContact C-N 3.3Å; Y387-K389 PolarHBondContact O-N 3.49Å; K389-D392 PolarHBondContact O-N 2.82Å; K389-L393 WeakPolarHBondContact O-CG 3.5Å; K389-L393 PolarHBondContact O-N 3.21Å
390	L	87.4	Confident	87.4	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-66.9	-37.2	174.3	-69.5	170.6	0	0	0	112.2	Y366 E386 Y387 R388 L393 A394 V471 F472 A475	Y366-L390 HydrophobicContact CD1-CD2 3.96Å; Y366-L390 HydrophobicContact CG-CD2 4.24Å; E386-L390 PolarHBondContact O-N 3.47Å; Y387-L390 PolarHBondContact O-N 2.95Å; R388-L390 VanDerWaalsContact C-N 3.34Å; R388-L390 PolarHBondContact O-N 2.93Å; L390-L393 PolarHBondContact O-N 3.37Å; L390-A394 WeakPolarHBondContact O-CB 3.42Å; L390-A394 PolarHBondContact O-N 3.44Å; L390-V471 HydrophobicContact CD1-CG1 3.86Å; L390-V471 HydrophobicContact CD2-CG1 4.36Å; L390-F472 WeakPolarHBondContact O-CD1 3.47Å; L390-F472 WeakPolarHBondContact O-CE1 3.37Å; L390-A475 HydrophobicContact CB-CB 3.62Å; L390-A475 HydrophobicContact CD1-CB 3.93Å; L390-A475 HydrophobicContact CG-CB 4.45Å
391	F	93.9	Very high	89.2	Confident	5 Å²	5	43.2 Å²	43.2	2%	0.022	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-45.3	170.8	169.4	-79.3	0	0	0	111.5	Y387 R388 A394 L395 I476 T479 V480 Y602 L605	Y387-F391 PolarHBondContact O-N 3.36Å; R388-F391 WeakPolarHBondContact O-CB 3.31Å; R388-F391 PolarHBondContact O-N 2.92Å; F391-A394 PolarHBondContact O-N 3.11Å; F391-L395 PolarHBondContact O-N 2.75Å; F391-L395 VanDerWaalsContact O-N 3.11Å; F391-I476 HydrophobicContact CB-CG1 4.45Å; F391-I476 HydrophobicContact CD2-CB 4.27Å; F391-I476 HydrophobicContact CD2-CG1 4.01Å; F391-I476 HydrophobicContact CD2-CG2 4.13Å; F391-I476 HydrophobicContact CE2-CG2 4.41Å; F391-T479 HydrophobicContact CB-CG2 4.09Å; F391-T479 HydrophobicContact CD1-CG2 4.35Å; F391-T479 HydrophobicContact CD2-CG2 4.04Å; F391-T479 HydrophobicContact CG-CG2 3.92Å; F391-V480 HydrophobicContact CD2-CG2 4.46Å; F391-V480 HydrophobicContact CE2-CG2 3.92Å; F391-Y602 HydrophobicContact CE2-CD1 4.08Å; F391-Y602 HydrophobicContact CE2-CE1 4.06Å; F391-Y602 AromaticContact CZ-CD1 3.94Å; F391-Y602 HydrophobicContact CZ-CD1 3.94Å; F391-Y602 AromaticContact CZ-CE1 3.7Å; F391-Y602 HydrophobicContact CZ-CE1 3.7Å; F391-L605 HydrophobicContact CD2-CD1 3.95Å; F391-L605 HydrophobicContact CE1-CD1 3.99Å; F391-L605 HydrophobicContact CE2-CB 4.44Å; F391-L605 HydrophobicContact CE2-CD1 3.25Å; F391-L605 HydrophobicContact CE2-CG 4.45Å; F391-L605 HydrophobicContact CZ-CD1 3.25Å
392	D	92.3	Very high	90.6	Very high	58 Å²	58	36.7 Å²	36.7	31%	0.31	19%	0.19	S	C	.	.	H	α-helix	trans	-64.9	-41	179.4	-63.7	-31.6	0	0	0	111.2	R388 K389 L395 Q396	R388-D392 IonicContact CZ-OD1 2.98Å; R388-D392 IonicContact NE-OD1 3.3Å; R388-D392 PolarHBondContact NE-OD1 3.34Å; R388-D392 IonicContact NE-OD2 2.76Å; R388-D392 IonicContact NH2-OD1 3.9Å; R388-D392 VanDerWaalsContact O-CG 3.24Å; R388-D392 PolarHBondContact O-N 2.7Å; K389-D392 PolarHBondContact O-N 2.82Å; D392-L395 PolarHBondContact O-N 3.08Å; D392-Q396 VanDerWaalsContact O-CB 3.27Å; D392-Q396 WeakPolarHBondContact O-CB 3.49Å; D392-Q396 PolarHBondContact O-N 3.45Å
393	L	92.3	Very high	91.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.1	-40.8	175.4	-73.3	171.8	0	0	0	112.4	F359 E362 Y366 K389 L390 Q396 G397 F472	F359-L393 HydrophobicContact CE2-CD2 3.9Å; F359-L393 WeakPolarHBondContact CZ-O 3.22Å; E362-L393 HydrophobicContact CG-CD2 4.15Å; Y366-L393 HydrophobicContact CD1-CD1 4.34Å; Y366-L393 HydrophobicContact CD2-CD1 3.39Å; Y366-L393 HydrophobicContact CE2-CD1 3.69Å; Y366-L393 HydrophobicContact CG-CD1 3.77Å; K389-L393 WeakPolarHBondContact O-CG 3.5Å; K389-L393 PolarHBondContact O-N 3.21Å; L390-L393 PolarHBondContact O-N 3.37Å; L393-Q396 PolarHBondContact O-N 3.47Å; L393-G397 PolarHBondContact O-N 3.33Å; L393-F472 HydrophobicContact CB-CE1 4.26Å
394	A	92.8	Very high	91.7	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.7	-47.6	176.2	0	0	0	0	0	111.1	L390 F391 L398 F472 I476 L605 F608	L390-A394 WeakPolarHBondContact O-CB 3.42Å; L390-A394 PolarHBondContact O-N 3.44Å; F391-A394 PolarHBondContact O-N 3.11Å; A394-L398 VanDerWaalsContact O-CG 3.3Å; A394-L398 WeakPolarHBondContact O-CG 3.3Å; A394-L398 PolarHBondContact O-N 3.39Å; A394-L398 VanDerWaalsContact O-N 3.16Å; A394-F472 HydrophobicContact CB-CB 4.31Å; A394-F472 HydrophobicContact CB-CD1 3.71Å; A394-F472 HydrophobicContact CB-CD2 4.37Å; A394-F472 HydrophobicContact CB-CE1 4.01Å; A394-F472 HydrophobicContact CB-CG 3.91Å; A394-F472 HydrophobicContact CB-CZ 4.43Å; A394-I476 HydrophobicContact CB-CD1 3.86Å; A394-I476 HydrophobicContact CB-CG1 4.42Å; A394-L605 HydrophobicContact CB-CD2 4.17Å; A394-F608 HydrophobicContact CB-CD2 4.3Å; A394-F608 HydrophobicContact CB-CE2 3.92Å
395	L	94.9	Very high	92.2	Very high	24 Å²	24	30.9 Å²	30.9	13%	0.126	16%	0.156	C	C	.	.	H	α-helix	trans	-65.1	-46.5	178	-178	58.3	0	0	0	112	L255 F391 D392 G397 L398 Q399 F601 L605	L255-L395 HydrophobicContact CD1-CD1 4.03Å; F391-L395 PolarHBondContact O-N 2.75Å; F391-L395 VanDerWaalsContact O-N 3.11Å; D392-L395 PolarHBondContact O-N 3.08Å; L395-G397 VanDerWaalsContact C-N 3.34Å; L395-G397 PolarHBondContact O-N 2.96Å; L395-L398 PolarHBondContact O-N 2.92Å; L395-Q399 HydrophobicContact CD1-CG 4.31Å; L395-Q399 VanDerWaalsContact O-CG 3.31Å; L395-Q399 WeakPolarHBondContact O-CG 3.25Å; L395-Q399 PolarHBondContact O-N 3.24Å; L395-F601 HydrophobicContact CD1-CB 4.02Å; L395-F601 HydrophobicContact CD1-CD1 4.02Å; L395-F601 HydrophobicContact CD1-CD2 4.46Å; L395-F601 HydrophobicContact CD1-CG 3.92Å; L395-F601 HydrophobicContact CD2-CB 4.42Å; L395-F601 HydrophobicContact CD2-CD2 4.11Å; L395-F601 HydrophobicContact CD2-CG 4.29Å; L395-L605 HydrophobicContact CB-CD1 4.14Å; L395-L605 HydrophobicContact CB-CD2 4Å; L395-L605 HydrophobicContact CD1-CD1 4.31Å; L395-L605 HydrophobicContact CD1-CD2 4.32Å; L395-L605 HydrophobicContact CD1-CG 4.48Å; L395-L605 HydrophobicContact CD2-CD1 4.5Å
396	Q	94	Very high	92.7	Very high	80 Å²	80	27.6 Å²	27.6	37%	0.374	13%	0.129	S	C	.	.	H	α-helix	trans	-61.4	-42.5	180	-175.8	-178.8	4.2	0	0	111.6	F359 D392 L393 Q399 L400	F359-Q396 HydrophobicContact CD2-CG 3.89Å; F359-Q396 HydrophobicContact CE2-CB 3.88Å; F359-Q396 HydrophobicContact CE2-CG 3.73Å; D392-Q396 VanDerWaalsContact O-CB 3.27Å; D392-Q396 WeakPolarHBondContact O-CB 3.49Å; D392-Q396 PolarHBondContact O-N 3.45Å; L393-Q396 PolarHBondContact O-N 3.47Å; Q396-Q399 PolarHBondContact O-N 2.87Å; Q396-L400 WeakPolarHBondContact O-CB 3.3Å; Q396-L400 PolarHBondContact O-N 2.58Å
397	G	93.9	Very high	93.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.3	-42.2	177.5	0	0	0	0	0	112.7	F359 L393 L395 L400 L401	F359-G397 VanDerWaalsContact CE1-CA 3.47Å; L393-G397 PolarHBondContact O-N 3.33Å; L395-G397 VanDerWaalsContact C-N 3.34Å; L395-G397 PolarHBondContact O-N 2.96Å; G397-L400 PolarHBondContact O-N 3.48Å; G397-L401 WeakPolarHBondContact O-CB 3.42Å; G397-L401 VanDerWaalsContact O-CG 3.3Å; G397-L401 WeakPolarHBondContact O-CG 3.46Å; G397-L401 PolarHBondContact O-N 2.95Å
398	L	95.3	Very high	93.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.6	-41	174.8	-70.2	171.8	0	0	0	112.3	L255 A394 L395 S402 L605 F608 T611 L612 C615	L255-L398 HydrophobicContact CD1-CB 4.12Å; L255-L398 HydrophobicContact CD2-CB 4.43Å; L255-L398 HydrophobicContact CD2-CD1 4.27Å; A394-L398 VanDerWaalsContact O-CG 3.3Å; A394-L398 WeakPolarHBondContact O-CG 3.3Å; A394-L398 PolarHBondContact O-N 3.39Å; A394-L398 VanDerWaalsContact O-N 3.16Å; L395-L398 PolarHBondContact O-N 2.92Å; L398-S402 VanDerWaalsContact O-CB 3.27Å; L398-S402 WeakPolarHBondContact O-CB 3.39Å; L398-S402 PolarHBondContact O-N 2.97Å; L398-L605 HydrophobicContact CD1-CD2 3.96Å; L398-F608 HydrophobicContact CD1-CD2 3.79Å; L398-F608 HydrophobicContact CD1-CE2 3.78Å; L398-F608 HydrophobicContact CD2-CE2 4.15Å; L398-F608 HydrophobicContact CG-CD2 4.39Å; L398-F608 HydrophobicContact CG-CE2 3.91Å; L398-T611 HydrophobicContact CD1-CG2 3.9Å; L398-T611 HydrophobicContact CD2-CG2 4.24Å; L398-L612 HydrophobicContact CD2-CB 3.93Å; L398-L612 HydrophobicContact CD2-CD1 3.83Å; L398-C615 HydrophobicContact CD2-CB 4.47Å; L398-C615 PolarHBondContact O-SG 3.03Å
399	Q	93.9	Very high	93.6	Very high	64 Å²	64	21.8 Å²	21.8	30%	0.299	11%	0.105	S	C	.	.	H	α-helix	trans	-64.5	-40.2	176	-73.8	173.8	-18.5	0	0	111.9	L255 L395 Q396 S402 Q403	L255-Q399 HydrophobicContact CD1-CB 4.48Å; L255-Q399 HydrophobicContact CD1-CG 3.54Å; L395-Q399 HydrophobicContact CD1-CG 4.31Å; L395-Q399 VanDerWaalsContact O-CG 3.31Å; L395-Q399 WeakPolarHBondContact O-CG 3.25Å; L395-Q399 PolarHBondContact O-N 3.24Å; Q396-Q399 PolarHBondContact O-N 2.87Å; Q399-S402 PolarHBondContact O-N 3.05Å; Q399-Q403 VanDerWaalsContact O-CG 3.25Å; Q399-Q403 WeakPolarHBondContact O-CG 3.32Å; Q399-Q403 PolarHBondContact O-N 3.36Å; Q399-Q403 PolarHBondContact O-NE2 2.85Å
400	L	94.6	Very high	93.9	Very high	14 Å²	14	19.9 Å²	19.9	7%	0.073	10%	0.097	C	C	.	.	H	α-helix	trans	-67.6	-46.9	179.4	-172.1	63.7	0	0	0	111.4	D355 F359 Q396 G397 S402 Q403 W404 L461	D355-L400 HydrophobicContact CB-CD1 3.92Å; F359-L400 HydrophobicContact CB-CD2 3.73Å; F359-L400 HydrophobicContact CD1-CD2 3.91Å; F359-L400 HydrophobicContact CG-CD2 3.88Å; Q396-L400 WeakPolarHBondContact O-CB 3.3Å; Q396-L400 PolarHBondContact O-N 2.58Å; G397-L400 PolarHBondContact O-N 3.48Å; L400-S402 VanDerWaalsContact C-N 3.32Å; L400-S402 PolarHBondContact O-N 3.05Å; L400-Q403 WeakPolarHBondContact O-CB 3.28Å; L400-Q403 PolarHBondContact O-N 2.82Å; L400-W404 HydrophobicContact CD1-CZ2 3.63Å; L400-W404 HydrophobicContact CD2-CH2 3.61Å; L400-W404 HydrophobicContact CD2-CZ2 3.45Å; L400-W404 VanDerWaalsContact CD2-CZ2 3.45Å; L400-W404 HydrophobicContact CG-CD2 4.25Å; L400-W404 HydrophobicContact CG-CH2 3.8Å; L400-W404 HydrophobicContact CG-CZ2 3.35Å; L400-W404 HydrophobicContact CG-CZ3 4.42Å; L400-W404 PolarHBondContact O-N 3.31Å; L400-W404 VanDerWaalsContact O-N 3.1Å; L400-L461 HydrophobicContact CD2-CD2 4.19Å
401	L	94.4	Very high	94.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-57.4	-45.6	173.6	-73.9	168.1	0	0	0	111.7	G397 Q403 W404 S405 I458 L461 M465 L612 C615	G397-L401 WeakPolarHBondContact O-CB 3.42Å; G397-L401 VanDerWaalsContact O-CG 3.3Å; G397-L401 WeakPolarHBondContact O-CG 3.46Å; G397-L401 PolarHBondContact O-N 2.95Å; L401-Q403 VanDerWaalsContact C-N 3.35Å; L401-Q403 PolarHBondContact O-N 3.21Å; L401-W404 HydrophobicContact CD2-CE3 4.33Å; L401-W404 HydrophobicContact CD2-CZ3 4.45Å; L401-W404 PolarHBondContact O-N 3.24Å; L401-S405 PolarHBondContact O-N 3.3Å; L401-S405 PolarHBondContact O-OG 3.04Å; L401-S405 VanDerWaalsContact O-OG 3.07Å; L401-I458 HydrophobicContact CD2-CB 4.45Å; L401-I458 HydrophobicContact CD2-CG2 4.18Å; L401-I458 WeakPolarHBondContact CD2-O 3.38Å; L401-L461 HydrophobicContact CD1-CD2 4.4Å; L401-L461 HydrophobicContact CD1-CG 4.23Å; L401-L461 HydrophobicContact CD2-CB 3.84Å; L401-L461 HydrophobicContact CD2-CD2 3.79Å; L401-L461 HydrophobicContact CD2-CG 3.84Å; L401-L461 HydrophobicContact CG-CD2 3.8Å; L401-L461 HydrophobicContact CG-CG 4.07Å; L401-M465 HydrophobicContact CD1-CG 4.15Å; L401-L612 HydrophobicContact CD1-CD1 3.48Å; L401-L612 VanDerWaalsContact CD1-CD1 3.48Å; L401-C615 CarbonylContact C-O 3.53Å; L401-C615 HydrophobicContact CB-CB 4.2Å
402	S	96.4	Very high	94.2	Very high	7 Å²	7	20.7 Å²	20.7	5%	0.049	10%	0.102	C	C	.	.	H	α-helix	trans	-60.3	-42.2	176.9	177.8	0	0	0	0	112.6	L255 P257 L398 Q399 L400 W404 A406	L255-S402 WeakPolarHBondContact O-CB 3.49Å; L255-S402 PolarHBondContact O-OG 3.45Å; P257-S402 WeakPolarHBondContact CD-OG 3.25Å; L398-S402 VanDerWaalsContact O-CB 3.27Å; L398-S402 WeakPolarHBondContact O-CB 3.39Å; L398-S402 PolarHBondContact O-N 2.97Å; Q399-S402 PolarHBondContact O-N 3.05Å; L400-S402 VanDerWaalsContact C-N 3.32Å; L400-S402 PolarHBondContact O-N 3.05Å; S402-W404 PolarHBondContact O-N 3.04Å; S402-A406 WeakPolarHBondContact O-CB 3.34Å; S402-A406 PolarHBondContact O-N 2.51Å
403	Q	93.6	Very high	94.3	Very high	78 Å²	78	17.9 Å²	17.9	36%	0.364	9%	0.087	S	C	.	.	H	α-helix	trans	-60.8	-46.1	176.3	-73.6	168.2	45.3	0	0	111.7	Q399 L400 L401 A406 H407	Q399-Q403 VanDerWaalsContact O-CG 3.25Å; Q399-Q403 WeakPolarHBondContact O-CG 3.32Å; Q399-Q403 PolarHBondContact O-N 3.36Å; Q399-Q403 PolarHBondContact O-NE2 2.85Å; L400-Q403 WeakPolarHBondContact O-CB 3.28Å; L400-Q403 PolarHBondContact O-N 2.82Å; L401-Q403 VanDerWaalsContact C-N 3.35Å; L401-Q403 PolarHBondContact O-N 3.21Å; Q403-A406 PolarHBondContact O-N 3.16Å; Q403-H407 PolarHBondContact O-CD2 3.35Å; Q403-H407 PolarHBondContact O-N 3.28Å
404	W	95.9	Very high	94.3	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.015	9%	0.09	C	C	.	.	H	α-helix	trans	-66.6	-46.5	-179.8	-60.6	-14.5	0	0	0	112.2	I352 H356 L400 L401 S402 A406 H407 V408 V454 M457 I458 L461	I352-W404 HydrophobicContact CG2-CD2 4.32Å; I352-W404 HydrophobicContact CG2-CG 4.33Å; I352-W404 HydrophobicContact CG2-CZ2 4.4Å; H356-W404 HydrophobicContact CB-CH2 3.61Å; H356-W404 HydrophobicContact CB-CZ2 3.78Å; H356-W404 AromaticContact CD2-CH2 3.63Å; H356-W404 AromaticContact CD2-CZ3 3.98Å; L400-W404 HydrophobicContact CD1-CZ2 3.63Å; L400-W404 HydrophobicContact CD2-CH2 3.61Å; L400-W404 HydrophobicContact CD2-CZ2 3.45Å; L400-W404 VanDerWaalsContact CD2-CZ2 3.45Å; L400-W404 HydrophobicContact CG-CD2 4.25Å; L400-W404 HydrophobicContact CG-CH2 3.8Å; L400-W404 HydrophobicContact CG-CZ2 3.35Å; L400-W404 HydrophobicContact CG-CZ3 4.42Å; L400-W404 PolarHBondContact O-N 3.31Å; L400-W404 VanDerWaalsContact O-N 3.1Å; L401-W404 HydrophobicContact CD2-CE3 4.33Å; L401-W404 HydrophobicContact CD2-CZ3 4.45Å; L401-W404 PolarHBondContact O-N 3.24Å; S402-W404 PolarHBondContact O-N 3.04Å; W404-A406 VanDerWaalsContact C-N 3.29Å; W404-A406 PolarHBondContact O-N 3.32Å; W404-H407 WeakPolarHBondContact O-CB 3.48Å; W404-H407 PolarHBondContact O-N 3.41Å; W404-H407 VanDerWaalsContact O-N 3.12Å; W404-V408 PolarHBondContact O-N 2.91Å; W404-V408 VanDerWaalsContact O-N 3.1Å; W404-V454 HydrophobicContact CB-CG1 3.93Å; W404-M457 HydrophobicContact CE3-CB 4.24Å; W404-M457 HydrophobicContact CZ3-CB 4.02Å; W404-I458 HydrophobicContact CB-CD1 3.82Å; W404-I458 HydrophobicContact CB-CG1 3.56Å; W404-I458 HydrophobicContact CE3-CG1 4.03Å; W404-L461 HydrophobicContact CH2-CD2 3.94Å; W404-L461 HydrophobicContact CZ3-CB 4.23Å; W404-L461 HydrophobicContact CZ3-CD2 3.68Å
405	S	95.7	Very high	94.4	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.007	9%	0.093	C	C	.	.	H	α-helix	trans	-60.9	-41	176.6	-58.4	0	0	0	0	111.3	L401 H407 V408 M409 C615	L401-S405 PolarHBondContact O-N 3.3Å; L401-S405 PolarHBondContact O-OG 3.04Å; L401-S405 VanDerWaalsContact O-OG 3.07Å; S405-H407 PolarHBondContact O-N 3.12Å; S405-V408 PolarHBondContact O-N 2.99Å; S405-M409 WeakPolarHBondContact O-CG 3.42Å; S405-M409 PolarHBondContact O-N 3.12Å; S405-C615 VanDerWaalsContact CB-O 3.27Å; S405-C615 WeakPolarHBondContact CB-O 3.42Å; S405-C615 PolarHBondContact OG-O 3.04Å
406	A	94.4	Very high	94.4	Very high	3 Å²	3	18.4 Å²	18.4	3%	0.025	9%	0.088	C	C	.	.	H	α-helix	trans	-59.9	-44.6	173.8	0	0	0	0	0	111.4	P257 S402 Q403 W404 V408 M409 E410	P257-A406 HydrophobicContact CB-CB 4.14Å; P257-A406 HydrophobicContact CG-CB 4.35Å; S402-A406 WeakPolarHBondContact O-CB 3.34Å; S402-A406 PolarHBondContact O-N 2.51Å; Q403-A406 PolarHBondContact O-N 3.16Å; W404-A406 VanDerWaalsContact C-N 3.29Å; W404-A406 PolarHBondContact O-N 3.32Å; A406-V408 PolarHBondContact O-N 3.17Å; A406-M409 PolarHBondContact O-N 3.25Å; A406-E410 WeakPolarHBondContact O-CB 3.17Å; A406-E410 VanDerWaalsContact O-CD 3.3Å; A406-E410 WeakPolarHBondContact O-CG 3.33Å; A406-E410 PolarHBondContact O-N 3.31Å
407	H	91.9	Very high	94.3	Very high	43 Å²	43	17.3 Å²	17.3	20%	0.199	9%	0.087	C	C	.	.	H	α-helix	trans	-58.7	-45.3	176.8	-74.6	-50.5	0	0	0	112.9	Q348 Q403 W404 S405 V411	Q348-H407 PolarHBondContact OE1-CE1 3.07Å; Q348-H407 PolarHBondContact OE1-ND1 3.15Å; Q403-H407 PolarHBondContact O-CD2 3.35Å; Q403-H407 PolarHBondContact O-N 3.28Å; W404-H407 WeakPolarHBondContact O-CB 3.48Å; W404-H407 PolarHBondContact O-N 3.41Å; W404-H407 VanDerWaalsContact O-N 3.12Å; S405-H407 PolarHBondContact O-N 3.12Å; H407-V411 WeakPolarHBondContact O-CB 3.34Å; H407-V411 VanDerWaalsContact O-CG2 3.3Å; H407-V411 WeakPolarHBondContact O-CG2 3.26Å; H407-V411 PolarHBondContact O-N 3.29Å
408	V	94.8	Very high	94.3	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.012	10%	0.096	C	C	.	.	H	α-helix	trans	-62	-50.1	178.1	180	0	0	0	0	110.4	W404 S405 A406 E410 Y412 L451 V454 I455 I458 L618 L621	W404-V408 PolarHBondContact O-N 2.91Å; W404-V408 VanDerWaalsContact O-N 3.1Å; S405-V408 PolarHBondContact O-N 2.99Å; A406-V408 PolarHBondContact O-N 3.17Å; V408-E410 PolarHBondContact O-N 3.36Å; V408-Y412 WeakPolarHBondContact O-CB 3.43Å; V408-Y412 PolarHBondContact O-N 3.41Å; V408-L451 HydrophobicContact CG1-CD2 4.12Å; V408-L451 HydrophobicContact CG2-CD2 4.49Å; V408-V454 HydrophobicContact CG2-CB 4Å; V408-V454 HydrophobicContact CG2-CG1 3.53Å; V408-I455 HydrophobicContact CG1-CG1 4.33Å; V408-I455 HydrophobicContact CG2-CG1 4.44Å; V408-I458 HydrophobicContact CG2-CD1 4.19Å; V408-L618 HydrophobicContact CB-CD2 4.21Å; V408-L618 HydrophobicContact CG1-CD2 4.18Å; V408-L621 HydrophobicContact CG1-CD1 4.43Å
409	M	94.9	Very high	94.2	Very high	14 Å²	14	21 Å²	21	7%	0.069	11%	0.106	C	C	.	.	H	α-helix	trans	-67.4	-36.1	-178	-66.3	-55.7	92.3	0	0	112.7	S405 A406 Y412 S413 L618 L621	S405-M409 WeakPolarHBondContact O-CG 3.42Å; S405-M409 PolarHBondContact O-N 3.12Å; A406-M409 PolarHBondContact O-N 3.25Å; M409-Y412 PolarHBondContact O-N 3.4Å; M409-S413 WeakPolarHBondContact O-CB 3.32Å; M409-S413 PolarHBondContact O-N 3.05Å; M409-L618 HydrophobicContact CE-CB 4.44Å; M409-L618 HydrophobicContact CE-CD2 3.51Å; M409-L618 HydrophobicContact SD-CD2 4.45Å; M409-L621 HydrophobicContact CE-CD1 3.87Å; M409-L621 HydrophobicContact CE-CD2 3.57Å; M409-L621 HydrophobicContact CE-CG 3.59Å; M409-L621 HydrophobicContact SD-CD2 4.47Å; M409-L621 HydrophobicContact SD-CG 4.48Å
410	E	93.9	Very high	94.2	Very high	17 Å²	17	18.4 Å²	18.4	8%	0.079	10%	0.095	C	C	.	.	H	α-helix	trans	-70.4	-40.6	179.6	-71.3	165.9	-171.8	0	0	111.4	K260 H261 L302 A406 V408 S413 W414	K260-E410 IonicContact NZ-OE1 2.67Å; K260-E410 PolarHBondContact NZ-OE1 3.27Å; K260-E410 IonicContact NZ-OE2 3.51Å; K260-E410 PolarHBondContact NZ-OE2 3.24Å; H261-E410 IonicContact CD2-OE1 3.48Å; H261-E410 IonicContact CE1-OE1 2.72Å; H261-E410 IonicContact NE2-OE1 3.5Å; H261-E410 PolarHBondContact NE2-OE1 2.89Å; L302-E410 HydrophobicContact CD1-CB 4.06Å; L302-E410 HydrophobicContact CD1-CG 3.75Å; L302-E410 HydrophobicContact CD2-CG 4.26Å; L302-E410 WeakPolarHBondContact CD2-OE1 3.17Å; A406-E410 WeakPolarHBondContact O-CB 3.17Å; A406-E410 VanDerWaalsContact O-CD 3.3Å; A406-E410 WeakPolarHBondContact O-CG 3.33Å; A406-E410 PolarHBondContact O-N 3.31Å; V408-E410 PolarHBondContact O-N 3.36Å; E410-S413 PolarHBondContact O-N 3.02Å; E410-W414 WeakPolarHBondContact O-CB 3.28Å; E410-W414 PolarHBondContact O-N 3.18Å
411	V	92.7	Very high	94.1	Very high	18 Å²	18	20.4 Å²	20.4	11%	0.109	11%	0.106	C	C	.	.	H	α-helix	trans	-63	-46.5	172.7	170.3	0	0	0	0	110.4	I345 H407 W414 K415 Y443	I345-V411 HydrophobicContact CD1-CG2 4.48Å; H407-V411 WeakPolarHBondContact O-CB 3.34Å; H407-V411 VanDerWaalsContact O-CG2 3.3Å; H407-V411 WeakPolarHBondContact O-CG2 3.26Å; H407-V411 PolarHBondContact O-N 3.29Å; V411-W414 PolarHBondContact O-N 3Å; V411-K415 HydrophobicContact CG1-CG 4.49Å; V411-K415 WeakPolarHBondContact O-CG 3.24Å; V411-K415 PolarHBondContact O-N 3.21Å; V411-K415 VanDerWaalsContact O-N 3.1Å; V411-Y443 HydrophobicContact CG1-CE1 4.29Å
412	Y	94.8	Very high	94	Very high	7 Å²	7	24.4 Å²	24.4	3%	0.027	12%	0.124	C	C	.	.	H	α-helix	trans	-59.9	-48.8	176.4	172.8	-110.5	0	0	0	112.5	V408 M409 W414 K415 L416 L621 M644	V408-Y412 WeakPolarHBondContact O-CB 3.43Å; V408-Y412 PolarHBondContact O-N 3.41Å; M409-Y412 PolarHBondContact O-N 3.4Å; Y412-W414 VanDerWaalsContact C-N 3.34Å; Y412-W414 PolarHBondContact O-N 3.37Å; Y412-K415 PolarHBondContact O-N 2.63Å; Y412-K415 VanDerWaalsContact O-N 3.16Å; Y412-L416 HydrophobicContact CD1-CD1 4.19Å; Y412-L416 HydrophobicContact CD2-CG 4.39Å; Y412-L416 HydrophobicContact CE1-CD1 3.54Å; Y412-L416 HydrophobicContact CE1-CG 4.23Å; Y412-L416 HydrophobicContact CE2-CD1 4.1Å; Y412-L416 HydrophobicContact CE2-CD2 3.93Å; Y412-L416 HydrophobicContact CE2-CG 3.98Å; Y412-L416 PolarHBondContact O-N 2.92Å; Y412-L621 HydrophobicContact CD1-CD2 3.77Å; Y412-L621 HydrophobicContact CD2-CD2 3.75Å; Y412-L621 HydrophobicContact CE1-CD2 4.15Å; Y412-L621 HydrophobicContact CE2-CD2 4.14Å; Y412-L621 HydrophobicContact CG-CD2 3.53Å; Y412-M644 HydrophobicContact CD2-CE 4.36Å; Y412-M644 HydrophobicContact CD2-CG 4.17Å; Y412-M644 HydrophobicContact CE2-CG 3.64Å; Y412-M644 HydrophobicContact CE2-SD 4.35Å
413	S	94.4	Very high	93.7	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.6	-44.9	178.3	-174.7	0	0	0	0	112	V304 Q312 M409 E410 K415 L416	V304-S413 WeakPolarHBondContact CG1-OG 3.38Å; Q312-S413 VanDerWaalsContact OE1-CB 3.25Å; Q312-S413 PolarHBondContact OE1-OG 2.83Å; M409-S413 WeakPolarHBondContact O-CB 3.32Å; M409-S413 PolarHBondContact O-N 3.05Å; E410-S413 PolarHBondContact O-N 3.02Å; S413-K415 PolarHBondContact O-N 3.23Å; S413-L416 PolarHBondContact O-N 2.82Å
414	W	93.9	Very high	93.5	Very high	16 Å²	16	32.7 Å²	32.7	6%	0.061	16%	0.162	C	C	.	.	H	α-helix	trans	-63.2	-41	177.4	-171.8	95.5	0	0	0	112.2	S340 P341 E410 V411 Y412 V417 H418	S340-W414 VanDerWaalsContact O-CZ2 3.25Å; S340-W414 WeakPolarHBondContact O-CZ2 3.43Å; P341-W414 VanDerWaalsContact CA-CH2 3.49Å; P341-W414 HydrophobicContact CB-CH2 4.25Å; P341-W414 HydrophobicContact CB-CZ3 4.21Å; E410-W414 WeakPolarHBondContact O-CB 3.28Å; E410-W414 PolarHBondContact O-N 3.18Å; V411-W414 PolarHBondContact O-N 3Å; Y412-W414 VanDerWaalsContact C-N 3.34Å; Y412-W414 PolarHBondContact O-N 3.37Å; W414-V417 WeakPolarHBondContact O-CG2 3.34Å; W414-V417 PolarHBondContact O-N 3.37Å; W414-H418 AromaticContact CD1-CE1 3.88Å; W414-H418 AromaticContact CD1-ND1 3.88Å; W414-H418 AromaticContact CD2-ND1 3.49Å; W414-H418 AromaticContact CE2-CE1 3.61Å; W414-H418 AromaticContact CE2-CG 3.94Å; W414-H418 AromaticContact CE2-ND1 3.3Å; W414-H418 VanDerWaalsContact CE2-ND1 3.3Å; W414-H418 HydrophobicContact CE3-CB 4.23Å; W414-H418 AromaticContact CG-ND1 3.84Å; W414-H418 HydrophobicContact CH2-CB 3.87Å; W414-H418 AromaticContact CH2-CG 3.97Å; W414-H418 HydrophobicContact CZ2-CB 4.23Å; W414-H418 AromaticContact CZ2-CG 3.8Å; W414-H418 AromaticContact CZ2-ND1 3.66Å; W414-H418 HydrophobicContact CZ3-CB 3.88Å; W414-H418 AromaticContact NE1-CE1 3.44Å; W414-H418 PolarHBondContact NE1-CE1 3.46Å; W414-H418 AromaticContact NE1-ND1 3.57Å; W414-H418 PolarHBondContact O-N 2.93Å; W414-H418 PolarHBondContact O-ND1 3.43Å
415	K	93.7	Very high	93.3	Very high	14 Å²	14	34.4 Å²	34.4	6%	0.061	17%	0.172	C	C	.	.	H	α-helix	trans	-69.2	-33.6	-179.9	-66.8	-82.3	-176.6	164.6	0	112.4	V411 Y412 S413 V417 H418 N442 Y443 E447	V411-K415 HydrophobicContact CG1-CG 4.49Å; V411-K415 WeakPolarHBondContact O-CG 3.24Å; V411-K415 PolarHBondContact O-N 3.21Å; V411-K415 VanDerWaalsContact O-N 3.1Å; Y412-K415 PolarHBondContact O-N 2.63Å; Y412-K415 VanDerWaalsContact O-N 3.16Å; S413-K415 PolarHBondContact O-N 3.23Å; K415-V417 VanDerWaalsContact C-N 3.32Å; K415-V417 PolarHBondContact O-N 2.94Å; K415-H418 CarbonylContact O-C 3.47Å; K415-H418 PolarHBondContact O-N 3.32Å; K415-N442 HydrophobicContact CD-CB 4.14Å; K415-N442 WeakPolarHBondContact CD-O 3.35Å; K415-N442 PolarHBondContact NZ-O 2.85Å; K415-N442 PolarHBondContact O-ND2 3.4Å; K415-Y443 HydrophobicContact CD-CE1 4.4Å; K415-Y443 HydrophobicContact CG-CE1 3.94Å; K415-E447 WeakPolarHBondContact CE-OE1 3.39Å; K415-E447 IonicContact NZ-OE1 2.92Å; K415-E447 PolarHBondContact NZ-OE1 3.02Å; K415-E447 IonicContact NZ-OE2 2.68Å
416	L	94.9	Very high	93.2	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-37.3	177	-74.6	-175.7	0	0	0	113.3	D310 Q312 Y412 S413 Y435 A438 T439 F627	D310-L416 HydrophobicContact CB-CD1 4.44Å; Q312-L416 HydrophobicContact CG-CB 3.99Å; Q312-L416 HydrophobicContact CG-CD1 3.94Å; Y412-L416 HydrophobicContact CD1-CD1 4.19Å; Y412-L416 HydrophobicContact CD2-CG 4.39Å; Y412-L416 HydrophobicContact CE1-CD1 3.54Å; Y412-L416 HydrophobicContact CE1-CG 4.23Å; Y412-L416 HydrophobicContact CE2-CD1 4.1Å; Y412-L416 HydrophobicContact CE2-CD2 3.93Å; Y412-L416 HydrophobicContact CE2-CG 3.98Å; Y412-L416 PolarHBondContact O-N 2.92Å; S413-L416 PolarHBondContact O-N 2.82Å; L416-Y435 HydrophobicContact CD2-CE2 4.13Å; L416-A438 HydrophobicContact CD2-CB 4.18Å; L416-T439 HydrophobicContact CD2-CG2 4.15Å; L416-F627 HydrophobicContact CB-CE2 4.31Å; L416-F627 HydrophobicContact CB-CZ 4.43Å; L416-F627 HydrophobicContact CD1-CE2 4.33Å; L416-F627 HydrophobicContact CD2-CE2 3.85Å; L416-F627 HydrophobicContact CD2-CZ 4.34Å; L416-F627 HydrophobicContact CG-CE2 4.39Å
417	V	93.3	Very high	93.2	Very high	57 Å²	57	49.7 Å²	49.7	35%	0.345	24%	0.244	S	C	.	.	H	α-helix	trans	-90.4	-11.6	179.7	-55.6	0	0	0	0	113.6	V304 Q312 W414 K415 P419	V304-V417 HydrophobicContact CB-CG2 4.26Å; V304-V417 HydrophobicContact CG1-CG1 4.02Å; V304-V417 HydrophobicContact CG1-CG2 3.7Å; V304-V417 HydrophobicContact CG2-CG2 3.61Å; Q312-V417 HydrophobicContact CB-CG1 3.61Å; Q312-V417 HydrophobicContact CG-CG1 4.07Å; W414-V417 WeakPolarHBondContact O-CG2 3.34Å; W414-V417 PolarHBondContact O-N 3.37Å; K415-V417 VanDerWaalsContact C-N 3.32Å; K415-V417 PolarHBondContact O-N 2.94Å; V417-P419 WeakPolarHBondContact O-CD 3.48Å
418	H	93.3	Very high	93.3	Very high	44 Å²	44	48 Å²	48	20%	0.204	24%	0.237	C	C	.	.	S	Bend	trans	-119.2	68.9	175.3	-57.9	97.6	0	0	0	110.6	W414 K415 N442	W414-H418 AromaticContact CD1-CE1 3.88Å; W414-H418 AromaticContact CD1-ND1 3.88Å; W414-H418 AromaticContact CD2-ND1 3.49Å; W414-H418 AromaticContact CE2-CE1 3.61Å; W414-H418 AromaticContact CE2-CG 3.94Å; W414-H418 AromaticContact CE2-ND1 3.3Å; W414-H418 VanDerWaalsContact CE2-ND1 3.3Å; W414-H418 HydrophobicContact CE3-CB 4.23Å; W414-H418 AromaticContact CG-ND1 3.84Å; W414-H418 HydrophobicContact CH2-CB 3.87Å; W414-H418 AromaticContact CH2-CG 3.97Å; W414-H418 HydrophobicContact CZ2-CB 4.23Å; W414-H418 AromaticContact CZ2-CG 3.8Å; W414-H418 AromaticContact CZ2-ND1 3.66Å; W414-H418 HydrophobicContact CZ3-CB 3.88Å; W414-H418 AromaticContact NE1-CE1 3.44Å; W414-H418 PolarHBondContact NE1-CE1 3.46Å; W414-H418 AromaticContact NE1-ND1 3.57Å; W414-H418 PolarHBondContact O-N 2.93Å; W414-H418 PolarHBondContact O-ND1 3.43Å; K415-H418 CarbonylContact O-C 3.47Å; K415-H418 PolarHBondContact O-N 3.32Å; H418-N442 PolarHBondContact O-ND2 2.97Å
419	P	93.6	Very high	93.3	Very high	33 Å²	33	50.3 Å²	50.3	21%	0.214	25%	0.252	C	S	.	.			trans	-62	139.4	176.7	27.3	-34.6	0	0	0	110.4	V417 E434 R437 A438	V417-P419 WeakPolarHBondContact O-CD 3.48Å; P419-E434 HydrophobicContact CB-CG 4.45Å; P419-E434 HydrophobicContact CG-CG 4.21Å; P419-R437 HydrophobicContact CB-CB 3.92Å; P419-A438 HydrophobicContact CB-CB 4.19Å
420	T	93.1	Very high	93.2	Very high	11 Å²	11	54.9 Å²	54.9	7%	0.067	28%	0.277	C	S	.	.			trans	-70.6	172	179.7	-158.9	0	0	0	0	111.8	S424 N425 C428 R437	T420-S424 WeakPolarHBondContact OG1-CB 3.35Å; T420-N425 HydrophobicContact CG2-CB 4.24Å; T420-C428 HydrophobicContact CG2-CB 4.05Å; T420-R437 HydrophobicContact CG2-CB 4.49Å; T420-R437 PolarHBondContact N-O 2.86Å; T420-R437 WeakPolarHBondContact O-CB 3.46Å; T420-R437 WeakPolarHBondContact O-CD 3.41Å; T420-R437 PolarHBondContact O-NH1 2.65Å
421	D	92.3	Very high	93.1	Very high	56 Å²	56	59.5 Å²	59.5	30%	0.299	31%	0.311	S	S	.	.			trans	-147.3	177.9	177.6	60.7	22.2	0	0	0	110.4	Y423 S424 N425	D421-Y423 HydrophobicContact CB-CD2 4.44Å; D421-Y423 PolarHBondContact O-N 3.41Å; D421-Y423 VanDerWaalsContact O-N 3.14Å; D421-Y423 WeakPolarHBondContact OD1-CB 3.34Å; D421-Y423 PolarHBondContact OD1-N 3.02Å; D421-Y423 WeakPolarHBondContact OD2-CD2 3.47Å; D421-S424 PolarHBondContact O-N 2.85Å; D421-S424 PolarHBondContact OD1-N 3.14Å; D421-S424 PolarHBondContact OD1-OG 3.39Å; D421-N425 PolarHBondContact O-N 3.32Å
422	K	91.8	Very high	93.2	Very high	84 Å²	84	59.1 Å²	59.1	37%	0.365	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-22	178.1	64	171.2	161.8	-156.5	0	114.6	N425 D430	K422-N425 WeakPolarHBondContact CA-O 3.35Å; K422-D430 WeakPolarHBondContact CD-OD1 3.41Å; K422-D430 WeakPolarHBondContact CD-OD2 3.25Å; K422-D430 WeakPolarHBondContact CE-OD1 3.34Å; K422-D430 WeakPolarHBondContact CE-OD2 3.09Å; K422-D430 VanDerWaalsContact CG-OD1 3.28Å; K422-D430 WeakPolarHBondContact CG-OD1 3.39Å; K422-D430 IonicContact NZ-OD1 3.85Å; K422-D430 PolarHBondContact NZ-OD1 2.8Å; K422-D430 IonicContact NZ-OD2 3.62Å; K422-D430 PolarHBondContact NZ-OD2 3.16Å
423	Y	90.5	Very high	93.2	Very high	187 Å²	187	60 Å²	60	73%	0.733	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-38.7	-177.4	-55.2	-75.5	0	0	0	110.1	D421	D421-Y423 HydrophobicContact CB-CD2 4.44Å; D421-Y423 PolarHBondContact O-N 3.41Å; D421-Y423 VanDerWaalsContact O-N 3.14Å; D421-Y423 WeakPolarHBondContact OD1-CB 3.34Å; D421-Y423 PolarHBondContact OD1-N 3.02Å; D421-Y423 WeakPolarHBondContact OD2-CD2 3.47Å
424	S	89.9	Confident	93.3	Very high	71 Å²	71	64.5 Å²	64.5	50%	0.497	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-38.4	178.1	-55	0	0	0	0	112.5	T420 D421	T420-S424 WeakPolarHBondContact OG1-CB 3.35Å; D421-S424 PolarHBondContact O-N 2.85Å; D421-S424 PolarHBondContact OD1-N 3.14Å; D421-S424 PolarHBondContact OD1-OG 3.39Å
425	N	92.6	Very high	93.4	Very high	41 Å²	41	63.9 Å²	63.9	22%	0.219	33%	0.333	C	S	.	.			trans	-131.5	114.9	177.9	-175.3	-9.1	0	0	0	111	T420 D421 K422 D427 C428 Y441	T420-N425 HydrophobicContact CG2-CB 4.24Å; D421-N425 PolarHBondContact O-N 3.32Å; K422-N425 WeakPolarHBondContact CA-O 3.35Å; N425-D427 PolarHBondContact O-N 3.01Å; N425-D427 PolarHBondContact OD1-N 3.47Å; N425-C428 HydrophobicContact CB-CB 4.01Å; N425-C428 VanDerWaalsContact O-CB 3.29Å; N425-C428 WeakPolarHBondContact O-CB 3.14Å; N425-C428 PolarHBondContact O-N 3.49Å; N425-C428 VanDerWaalsContact O-N 3.11Å; N425-Y441 PolarHBondContact ND2-O 3.45Å
426	K	93	Very high	93.5	Very high	195 Å²	195	64.3 Å²	64.3	85%	0.848	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-25.8	-178.5	-68.5	176	179.3	160.8	0	113.8	C428	K426-C428 VanDerWaalsContact C-N 3.29Å
427	D	93.1	Very high	93.6	Very high	130 Å²	130	66.8 Å²	66.8	70%	0.695	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.2	-179.7	-58.5	-38.6	0	0	0	112.2	N425 P429 Y441	N425-D427 PolarHBondContact O-N 3.01Å; N425-D427 PolarHBondContact OD1-N 3.47Å; D427-P429 WeakPolarHBondContact O-CD 3.18Å; D427-Y441 WeakPolarHBondContact O-CE1 3.3Å
428	C	94.8	Very high	93.7	Very high	6 Å²	6	64 Å²	64	4%	0.041	33%	0.327	C	S	.	.	S	Bend	trans	-86.8	115.5	178.1	-176.4	0	0	0	0	111.2	T420 N425 K426 Y441	T420-C428 HydrophobicContact CG2-CB 4.05Å; N425-C428 HydrophobicContact CB-CB 4.01Å; N425-C428 VanDerWaalsContact O-CB 3.29Å; N425-C428 WeakPolarHBondContact O-CB 3.14Å; N425-C428 PolarHBondContact O-N 3.49Å; N425-C428 VanDerWaalsContact O-N 3.11Å; K426-C428 VanDerWaalsContact C-N 3.29Å; C428-Y441 HydrophobicContact CB-CD1 4.46Å; C428-Y441 HydrophobicContact CB-CG 4.27Å
429	P	94.4	Very high	93.8	Very high	52 Å²	52	62 Å²	62	34%	0.338	32%	0.318	S	S	.	.			trans	-70.7	144	176.1	-17.3	31.9	0	0	0	112.6	D427 S431 A432	D427-P429 WeakPolarHBondContact O-CD 3.18Å; P429-S431 PolarHBondContact O-N 3.39Å; P429-A432 HydrophobicContact CB-CB 4.45Å; P429-A432 VanDerWaalsContact O-CB 3.3Å; P429-A432 WeakPolarHBondContact O-CB 3.39Å; P429-A432 PolarHBondContact O-N 2.96Å
430	D	92.8	Very high	93.9	Very high	109 Å²	109	65 Å²	65	58%	0.583	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.7	172	-74.1	-33.8	0	0	0	113	K422 A432	K422-D430 WeakPolarHBondContact CD-OD1 3.41Å; K422-D430 WeakPolarHBondContact CD-OD2 3.25Å; K422-D430 WeakPolarHBondContact CE-OD1 3.34Å; K422-D430 WeakPolarHBondContact CE-OD2 3.09Å; K422-D430 VanDerWaalsContact CG-OD1 3.28Å; K422-D430 WeakPolarHBondContact CG-OD1 3.39Å; K422-D430 IonicContact NZ-OD1 3.85Å; K422-D430 PolarHBondContact NZ-OD1 2.8Å; K422-D430 IonicContact NZ-OD2 3.62Å; K422-D430 PolarHBondContact NZ-OD2 3.16Å; D430-A432 VanDerWaalsContact C-N 3.33Å
431	S	93.1	Very high	94	Very high	114 Å²	114	66.7 Å²	66.7	80%	0.797	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.5	178.7	60.3	0	0	0	0	113.9	P429	P429-S431 PolarHBondContact O-N 3.39Å
432	A	94.1	Very high	94.1	Very high	10 Å²	10	64.7 Å²	64.7	8%	0.083	32%	0.32	C	S	.	.	S	Bend	trans	-67.3	133.6	179	0	0	0	0	0	110.5	P429 D430 R437 Y441	P429-A432 HydrophobicContact CB-CB 4.45Å; P429-A432 VanDerWaalsContact O-CB 3.3Å; P429-A432 WeakPolarHBondContact O-CB 3.39Å; P429-A432 PolarHBondContact O-N 2.96Å; D430-A432 VanDerWaalsContact C-N 3.33Å; A432-R437 HydrophobicContact CB-CG 3.67Å; A432-R437 WeakPolarHBondContact O-CD 3.37Å; A432-R437 PolarHBondContact O-NE 3.44Å; A432-Y441 HydrophobicContact CB-CD2 4.42Å; A432-Y441 HydrophobicContact CB-CE2 4.14Å
433	E	95.1	Very high	94.3	Very high	25 Å²	25	61.2 Å²	61.2	12%	0.117	30%	0.304	C	S	.	.			trans	-68	156.2	-179.8	61.3	-173	92.4	0	0	111.7	Y435 E436 R437 R634 R635 F638 M642	E433-Y435 VanDerWaalsContact C-N 3.31Å; E433-Y435 PolarHBondContact O-N 3.02Å; E433-E436 HydrophobicContact CG-CB 4.06Å; E433-E436 PolarHBondContact O-N 2.87Å; E433-E436 VanDerWaalsContact O-N 3.08Å; E433-R437 PolarHBondContact O-N 2.98Å; E433-R634 IonicContact OE1-CZ 2.81Å; E433-R634 IonicContact OE1-NH1 3.5Å; E433-R634 PolarHBondContact OE1-NH1 3.47Å; E433-R634 IonicContact OE1-NH2 3.3Å; E433-R634 PolarHBondContact OE1-NH2 3.41Å; E433-R634 IonicContact OE2-CZ 2.64Å; E433-R634 IonicContact OE2-NH2 3.71Å; E433-R634 PolarHBondContact OE2-NH2 3.37Å; E433-R635 IonicContact OE1-CZ 3.7Å; E433-R635 IonicContact OE1-NE 3.68Å; E433-R635 PolarHBondContact OE1-NE 2.94Å; E433-R635 VanDerWaalsContact OE1-NE 3.1Å; E433-R635 IonicContact OE1-NH2 2.73Å; E433-R635 PolarHBondContact OE1-NH2 3Å; E433-R635 IonicContact OE2-NE 2.75Å; E433-F638 WeakPolarHBondContact OE2-CE1 3.22Å; E433-M642 HydrophobicContact CG-CE 4.07Å; E433-M642 HydrophobicContact CG-SD 4.35Å
434	E	95.4	Very high	94.4	Very high	95 Å²	95	56.2 Å²	56.2	44%	0.444	29%	0.293	S	S	.	.	H	α-helix	trans	-56.1	-42.6	-170.2	-172.1	170.4	-150.6	0	0	113.4	P419 E436 R437 A438 F627	P419-E434 HydrophobicContact CB-CG 4.45Å; P419-E434 HydrophobicContact CG-CG 4.21Å; E434-E436 PolarHBondContact O-N 2.99Å; E434-R437 CarbonylContact O-C 3.34Å; E434-R437 PolarHBondContact O-N 2.87Å; E434-A438 VanDerWaalsContact O-CB 3.32Å; E434-A438 WeakPolarHBondContact O-CB 3.47Å; E434-A438 PolarHBondContact O-N 2.6Å; E434-F627 HydrophobicContact CG-CE1 4.3Å
435	Y	96.9	Very high	94.7	Very high	3 Å²	3	54.9 Å²	54.9	1%	0.012	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-38.9	178.7	-169.4	-114.6	0	0	0	112.7	L416 E433 R437 A438 T439 R624 F627 F638 M642	L416-Y435 HydrophobicContact CD2-CE2 4.13Å; E433-Y435 VanDerWaalsContact C-N 3.31Å; E433-Y435 PolarHBondContact O-N 3.02Å; Y435-R437 VanDerWaalsContact C-N 3.3Å; Y435-R437 PolarHBondContact O-N 2.78Å; Y435-A438 WeakPolarHBondContact O-CB 3.48Å; Y435-A438 PolarHBondContact O-N 3.19Å; Y435-A438 VanDerWaalsContact O-N 3.13Å; Y435-T439 HydrophobicContact CD2-CG2 4.35Å; Y435-T439 HydrophobicContact CE1-CG2 4.24Å; Y435-T439 HydrophobicContact CE2-CG2 3.88Å; Y435-T439 PolarHBondContact O-N 3.12Å; Y435-T439 PolarHBondContact O-OG1 3.3Å; Y435-T439 VanDerWaalsContact O-OG1 3.08Å; Y435-R624 HydrophobicContact CE1-CB 4.34Å; Y435-R624 HydrophobicContact CE2-CB 4.15Å; Y435-R624 WeakPolarHBondContact OH-CB 3.44Å; Y435-R624 WeakPolarHBondContact OH-CD 3.31Å; Y435-F627 HydrophobicContact CD2-CB 3.68Å; Y435-F627 AromaticContact CD2-CD1 3.84Å; Y435-F627 HydrophobicContact CD2-CD1 3.84Å; Y435-F627 AromaticContact CD2-CD2 3.38Å; Y435-F627 HydrophobicContact CD2-CD2 3.38Å; Y435-F627 HydrophobicContact CD2-CE1 4.31Å; Y435-F627 AromaticContact CD2-CE2 3.93Å; Y435-F627 HydrophobicContact CD2-CE2 3.93Å; Y435-F627 AromaticContact CD2-CG 3.34Å; Y435-F627 HydrophobicContact CD2-CG 3.34Å; Y435-F627 HydrophobicContact CD2-CZ 4.35Å; Y435-F627 HydrophobicContact CE2-CB 4.27Å; Y435-F627 AromaticContact CE2-CD2 3.63Å; Y435-F627 HydrophobicContact CE2-CD2 3.63Å; Y435-F627 HydrophobicContact CE2-CE2 4.18Å; Y435-F627 HydrophobicContact CE2-CG 4.02Å; Y435-F627 HydrophobicContact CG-CB 4.09Å; Y435-F627 HydrophobicContact CG-CD1 4.4Å; Y435-F627 HydrophobicContact CG-CG 4.1Å; Y435-F638 HydrophobicContact CD1-CB 4.28Å; Y435-F638 AromaticContact CD1-CD1 3.84Å; Y435-F638 HydrophobicContact CD1-CD1 3.84Å; Y435-F638 AromaticContact CD1-CD2 3.65Å; Y435-F638 HydrophobicContact CD1-CD2 3.65Å; Y435-F638 HydrophobicContact CD1-CE1 4.02Å; Y435-F638 AromaticContact CD1-CE2 3.82Å; Y435-F638 HydrophobicContact CD1-CE2 3.82Å; Y435-F638 AromaticContact CD1-CG 3.65Å; Y435-F638 HydrophobicContact CD1-CG 3.65Å; Y435-F638 HydrophobicContact CD1-CZ 4.01Å; Y435-F638 HydrophobicContact CE1-CB 4.35Å; Y435-F638 AromaticContact CE1-CD2 3.85Å; Y435-F638 HydrophobicContact CE1-CD2 3.85Å; Y435-F638 HydrophobicContact CE1-CE2 4.28Å; Y435-F638 HydrophobicContact CE1-CG 4.05Å; Y435-F638 HydrophobicContact CG-CD1 4.49Å; Y435-F638 HydrophobicContact CG-CD2 4.33Å; Y435-F638 HydrophobicContact CG-CE1 4.21Å; Y435-F638 HydrophobicContact CG-CE2 4.02Å; Y435-F638 AromaticContact CG-CZ 3.97Å; Y435-F638 HydrophobicContact CG-CZ 3.97Å; Y435-M642 HydrophobicContact CD1-CB 4.03Å; Y435-M642 HydrophobicContact CD1-SD 4.39Å; Y435-M642 HydrophobicContact CE1-CB 4.09Å
436	E	96.4	Very high	94.8	Very high	23 Å²	23	58.5 Å²	58.5	11%	0.107	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-36.5	176.1	-165.9	175.5	-155.7	0	0	111.8	E433 E434 A438 R440 Y441 M642	E433-E436 HydrophobicContact CG-CB 4.06Å; E433-E436 PolarHBondContact O-N 2.87Å; E433-E436 VanDerWaalsContact O-N 3.08Å; E434-E436 PolarHBondContact O-N 2.99Å; E436-A438 VanDerWaalsContact C-N 3.33Å; E436-R440 HydrophobicContact CG-CB 4.02Å; E436-R440 PolarHBondContact O-N 3.48Å; E436-R440 VanDerWaalsContact O-N 3.14Å; E436-R440 WeakPolarHBondContact OE1-CD 2.97Å; E436-R440 IonicContact OE1-CZ 2.79Å; E436-R440 IonicContact OE1-NH1 3.6Å; E436-R440 PolarHBondContact OE1-NH1 2.8Å; E436-Y441 HydrophobicContact CG-CD2 3.79Å; E436-Y441 HydrophobicContact CG-CE2 3.59Å; E436-Y441 PolarHBondContact O-N 3.1Å; E436-M642 HydrophobicContact CB-CE 3.71Å; E436-M642 HydrophobicContact CB-CG 4.13Å; E436-M642 HydrophobicContact CB-SD 3.76Å; E436-M642 VanDerWaalsContact CD-CE 3.5Å; E436-M642 HydrophobicContact CG-CE 3.8Å; E436-M642 HydrophobicContact CG-CG 4Å; E436-M642 HydrophobicContact CG-SD 4.17Å
437	R	95.4	Very high	94.9	Very high	56 Å²	56	50.4 Å²	50.4	21%	0.211	27%	0.265	C	S	.	.	H	α-helix	trans	-73.1	-25.2	173.8	-64.5	-170.9	-66.5	105.2	1.9	113	P419 T420 A432 E433 E434 Y435 N442	P419-R437 HydrophobicContact CB-CB 3.92Å; T420-R437 HydrophobicContact CG2-CB 4.49Å; T420-R437 PolarHBondContact N-O 2.86Å; T420-R437 WeakPolarHBondContact O-CB 3.46Å; T420-R437 WeakPolarHBondContact O-CD 3.41Å; T420-R437 PolarHBondContact O-NH1 2.65Å; A432-R437 HydrophobicContact CB-CG 3.67Å; A432-R437 WeakPolarHBondContact O-CD 3.37Å; A432-R437 PolarHBondContact O-NE 3.44Å; E433-R437 PolarHBondContact O-N 2.98Å; E434-R437 CarbonylContact O-C 3.34Å; E434-R437 PolarHBondContact O-N 2.87Å; Y435-R437 VanDerWaalsContact C-N 3.3Å; Y435-R437 PolarHBondContact O-N 2.78Å; R437-N442 WeakPolarHBondContact O-CB 3.44Å
438	A	95.3	Very high	95	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-79.4	-33.2	176.3	0	0	0	0	0	112.5	L416 P419 E434 Y435 E436 N442	L416-A438 HydrophobicContact CD2-CB 4.18Å; P419-A438 HydrophobicContact CB-CB 4.19Å; E434-A438 VanDerWaalsContact O-CB 3.32Å; E434-A438 WeakPolarHBondContact O-CB 3.47Å; E434-A438 PolarHBondContact O-N 2.6Å; Y435-A438 WeakPolarHBondContact O-CB 3.48Å; Y435-A438 PolarHBondContact O-N 3.19Å; Y435-A438 VanDerWaalsContact O-N 3.13Å; E436-A438 VanDerWaalsContact C-N 3.33Å; A438-N442 VanDerWaalsContact O-CB 3.25Å; A438-N442 WeakPolarHBondContact O-CB 3.4Å; A438-N442 PolarHBondContact O-ND2 3.46Å
439	T	96.3	Very high	95.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-90	179.8	63	0	0	0	0	111.9	L416 Y435 Y441 N442 Y443 M642 M644	L416-T439 HydrophobicContact CD2-CG2 4.15Å; Y435-T439 HydrophobicContact CD2-CG2 4.35Å; Y435-T439 HydrophobicContact CE1-CG2 4.24Å; Y435-T439 HydrophobicContact CE2-CG2 3.88Å; Y435-T439 PolarHBondContact O-N 3.12Å; Y435-T439 PolarHBondContact O-OG1 3.3Å; Y435-T439 VanDerWaalsContact O-OG1 3.08Å; T439-Y441 VanDerWaalsContact C-N 3.34Å; T439-Y441 PolarHBondContact O-N 2.92Å; T439-Y441 VanDerWaalsContact O-N 3.12Å; T439-N442 PolarHBondContact O-N 3.37Å; T439-Y443 WeakPolarHBondContact O-CD2 3.17Å; T439-M642 PolarHBondContact OG1-O 2.95Å; T439-M644 HydrophobicContact CG2-CG 4.25Å; T439-M644 HydrophobicContact CG2-SD 3.93Å
440	R	95.4	Very high	95.1	Very high	98 Å²	98	44 Å²	44	37%	0.37	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-44.6	-50.8	-168.7	-175.3	-174.2	-178.9	-175.8	4.5	114.3	E436 E641 I647	E436-R440 HydrophobicContact CG-CB 4.02Å; E436-R440 PolarHBondContact O-N 3.48Å; E436-R440 VanDerWaalsContact O-N 3.14Å; E436-R440 WeakPolarHBondContact OE1-CD 2.97Å; E436-R440 IonicContact OE1-CZ 2.79Å; E436-R440 IonicContact OE1-NH1 3.6Å; E436-R440 PolarHBondContact OE1-NH1 2.8Å; R440-E641 WeakPolarHBondContact CB-O 3.31Å; R440-E641 WeakPolarHBondContact CD-O 3.05Å; R440-E641 WeakPolarHBondContact CG-O 3.27Å; R440-I647 HydrophobicContact CB-CD1 4.19Å
441	Y	95.4	Very high	95.3	Very high	45 Å²	45	39 Å²	39	18%	0.176	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-86.8	-9.3	-175.6	-66.6	-67.8	0	0	0	113.8	N425 D427 C428 A432 E436 T439	N425-Y441 PolarHBondContact ND2-O 3.45Å; D427-Y441 WeakPolarHBondContact O-CE1 3.3Å; C428-Y441 HydrophobicContact CB-CD1 4.46Å; C428-Y441 HydrophobicContact CB-CG 4.27Å; A432-Y441 HydrophobicContact CB-CD2 4.42Å; A432-Y441 HydrophobicContact CB-CE2 4.14Å; E436-Y441 HydrophobicContact CG-CD2 3.79Å; E436-Y441 HydrophobicContact CG-CE2 3.59Å; E436-Y441 PolarHBondContact O-N 3.1Å; T439-Y441 VanDerWaalsContact C-N 3.34Å; T439-Y441 PolarHBondContact O-N 2.92Å; T439-Y441 VanDerWaalsContact O-N 3.12Å
442	N	95.3	Very high	95.4	Very high	15 Å²	15	33.7 Å²	33.7	8%	0.08	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-89.9	-2.4	-172.8	-142	-1.8	0	0	0	113.8	K415 H418 R437 A438 T439	K415-N442 HydrophobicContact CD-CB 4.14Å; K415-N442 WeakPolarHBondContact CD-O 3.35Å; K415-N442 PolarHBondContact NZ-O 2.85Å; K415-N442 PolarHBondContact O-ND2 3.4Å; H418-N442 PolarHBondContact O-ND2 2.97Å; R437-N442 WeakPolarHBondContact O-CB 3.44Å; A438-N442 VanDerWaalsContact O-CB 3.25Å; A438-N442 WeakPolarHBondContact O-CB 3.4Å; A438-N442 PolarHBondContact O-ND2 3.46Å; T439-N442 PolarHBondContact O-N 3.37Å
443	Y	94.9	Very high	95.4	Very high	11 Å²	11	34 Å²	34	4%	0.043	16%	0.161	C	C	.	.			trans	-120.6	125.9	178.1	-59.3	-85.9	0	0	0	111.5	V411 K415 T439 E447 L451 M644	V411-Y443 HydrophobicContact CG1-CE1 4.29Å; K415-Y443 HydrophobicContact CD-CE1 4.4Å; K415-Y443 HydrophobicContact CG-CE1 3.94Å; T439-Y443 WeakPolarHBondContact O-CD2 3.17Å; Y443-E447 HydrophobicContact CD1-CB 4.27Å; Y443-L451 HydrophobicContact CD1-CD1 3.86Å; Y443-L451 HydrophobicContact CE1-CD1 3.72Å; Y443-M644 HydrophobicContact CD2-CE 4.13Å; Y443-M644 HydrophobicContact CD2-SD 4.41Å; Y443-M644 HydrophobicContact CE1-CE 4.45Å; Y443-M644 HydrophobicContact CE2-CE 3.5Å; Y443-M644 VanDerWaalsContact CE2-CE 3.5Å; Y443-M644 HydrophobicContact CE2-SD 3.76Å
444	T	94	Very high	95.4	Very high	81 Å²	81	32.8 Å²	32.8	50%	0.497	16%	0.155	S	C	.	.			trans	-69	168.1	168	61.5	0	0	0	0	111.3	E446 E447 K448	T444-E446 VanDerWaalsContact C-N 3.32Å; T444-E446 PolarHBondContact O-N 3.23Å; T444-E447 WeakPolarHBondContact CB-OE2 3.49Å; T444-E447 WeakPolarHBondContact CG2-OE2 3.41Å; T444-E447 PolarHBondContact N-OE2 3.14Å; T444-E447 PolarHBondContact O-N 3.12Å; T444-E447 VanDerWaalsContact OG1-CG 3.3Å; T444-E447 WeakPolarHBondContact OG1-CG 3.44Å; T444-E447 PolarHBondContact OG1-N 3.11Å; T444-E447 PolarHBondContact OG1-OE2 3.25Å; T444-K448 WeakPolarHBondContact O-CE 3.46Å; T444-K448 WeakPolarHBondContact O-CG 3.24Å; T444-K448 PolarHBondContact O-N 3.14Å; T444-K448 VanDerWaalsContact O-N 3.15Å
445	S	95.6	Very high	95.4	Very high	43 Å²	43	28.3 Å²	28.3	30%	0.301	14%	0.135	S	C	.	.	H	α-helix	trans	-56.7	-46.4	176.1	-174.8	0	0	0	0	112.1	K448 F449 H651	S445-K448 PolarHBondContact O-N 3.02Å; S445-F449 VanDerWaalsContact O-CD2 3.31Å; S445-F449 WeakPolarHBondContact O-CD2 3.12Å; S445-F449 PolarHBondContact O-N 2.89Å; S445-F449 VanDerWaalsContact O-N 3.12Å; S445-F449 VanDerWaalsContact OG-CE2 3.29Å; S445-F449 WeakPolarHBondContact OG-CE2 3.38Å; S445-H651 PolarHBondContact OG-CE1 2.93Å; S445-H651 VanDerWaalsContact OG-CE1 3.25Å; S445-H651 PolarHBondContact OG-NE2 3.34Å
446	E	93.8	Very high	95.1	Very high	118 Å²	118	28.4 Å²	28.4	55%	0.551	14%	0.136	S	C	*	.	H	α-helix	trans	-67.7	-39.2	-178.2	-57.4	-51.1	127.5	0	0	112.4	T444 K448 F449 A450	T444-E446 VanDerWaalsContact C-N 3.32Å; T444-E446 PolarHBondContact O-N 3.23Å; E446-K448 VanDerWaalsContact C-N 3.31Å; E446-K448 PolarHBondContact O-N 2.84Å; E446-F449 PolarHBondContact O-N 2.89Å; E446-A450 VanDerWaalsContact O-CB 3.3Å; E446-A450 WeakPolarHBondContact O-CB 3.49Å; E446-A450 PolarHBondContact O-N 2.92Å
447	E	94.6	Very high	94.9	Very high	25 Å²	25	27.9 Å²	27.9	12%	0.117	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-40.7	174.9	-75.4	168.9	123.5	0	0	111.3	I345 K415 Y443 T444 A450 L451	I345-E447 HydrophobicContact CG2-CB 4.31Å; I345-E447 HydrophobicContact CG2-CG 3.9Å; K415-E447 WeakPolarHBondContact CE-OE1 3.39Å; K415-E447 IonicContact NZ-OE1 2.92Å; K415-E447 PolarHBondContact NZ-OE1 3.02Å; K415-E447 IonicContact NZ-OE2 2.68Å; Y443-E447 HydrophobicContact CD1-CB 4.27Å; T444-E447 WeakPolarHBondContact CB-OE2 3.49Å; T444-E447 WeakPolarHBondContact CG2-OE2 3.41Å; T444-E447 PolarHBondContact N-OE2 3.14Å; T444-E447 PolarHBondContact O-N 3.12Å; T444-E447 VanDerWaalsContact OG1-CG 3.3Å; T444-E447 WeakPolarHBondContact OG1-CG 3.44Å; T444-E447 PolarHBondContact OG1-N 3.11Å; T444-E447 PolarHBondContact OG1-OE2 3.25Å; E447-A450 PolarHBondContact O-N 3.1Å; E447-L451 WeakPolarHBondContact O-CB 3.48Å; E447-L451 VanDerWaalsContact O-CG 3.25Å; E447-L451 WeakPolarHBondContact O-CG 3.4Å; E447-L451 PolarHBondContact O-N 2.64Å
448	K	96.1	Very high	94.8	Very high	33 Å²	33	25.2 Å²	25.2	14%	0.143	12%	0.124	C	C	.	.	H	α-helix	trans	-63.5	-44.9	177	-72	-178	-75.4	177.6	0	111.7	T444 S445 E446 L451 V452 I647 L648 H651	T444-K448 WeakPolarHBondContact O-CE 3.46Å; T444-K448 WeakPolarHBondContact O-CG 3.24Å; T444-K448 PolarHBondContact O-N 3.14Å; T444-K448 VanDerWaalsContact O-N 3.15Å; S445-K448 PolarHBondContact O-N 3.02Å; E446-K448 VanDerWaalsContact C-N 3.31Å; E446-K448 PolarHBondContact O-N 2.84Å; K448-L451 PolarHBondContact O-N 3.27Å; K448-V452 WeakPolarHBondContact O-CG2 3.35Å; K448-V452 PolarHBondContact O-N 3.11Å; K448-V452 VanDerWaalsContact O-N 3.11Å; K448-I647 HydrophobicContact CD-CG2 3.8Å; K448-L648 HydrophobicContact CB-CD2 4.03Å; K448-L648 HydrophobicContact CG-CD2 4.05Å; K448-H651 HydrophobicContact CD-CB 4.12Å; K448-H651 WeakPolarHBondContact CE-ND1 3.37Å; K448-H651 PolarHBondContact NZ-CE1 3.15Å; K448-H651 PolarHBondContact NZ-ND1 3.49Å
449	F	96.3	Very high	94.6	Very high	16 Å²	16	25.5 Å²	25.5	7%	0.07	13%	0.125	C	C	.	.	H	α-helix	trans	-63.9	-45.7	176.2	-64.7	-41.6	0	0	0	112.2	S445 E446 L451 V452 E453 H651 V652 T655 E657 M660	S445-F449 VanDerWaalsContact O-CD2 3.31Å; S445-F449 WeakPolarHBondContact O-CD2 3.12Å; S445-F449 PolarHBondContact O-N 2.89Å; S445-F449 VanDerWaalsContact O-N 3.12Å; S445-F449 VanDerWaalsContact OG-CE2 3.29Å; S445-F449 WeakPolarHBondContact OG-CE2 3.38Å; E446-F449 PolarHBondContact O-N 2.89Å; F449-L451 VanDerWaalsContact C-N 3.32Å; F449-L451 PolarHBondContact O-N 3.19Å; F449-V452 PolarHBondContact O-N 3.44Å; F449-V452 VanDerWaalsContact O-N 3.15Å; F449-E453 PolarHBondContact O-N 3.46Å; F449-H651 AromaticContact CD1-CD2 3.77Å; F449-H651 AromaticContact CE1-CD2 3.33Å; F449-H651 WeakPolarHBondContact CE1-CD2 3.49Å; F449-H651 AromaticContact CE1-NE2 3.53Å; F449-H651 AromaticContact CE2-NE2 3.7Å; F449-H651 AromaticContact CZ-CD2 3.66Å; F449-H651 AromaticContact CZ-NE2 3.31Å; F449-H651 VanDerWaalsContact CZ-NE2 3.31Å; F449-H651 WeakPolarHBondContact CZ-NE2 3.23Å; F449-V652 HydrophobicContact CD1-CG2 4.37Å; F449-V652 HydrophobicContact CE1-CG2 4.25Å; F449-T655 HydrophobicContact CZ-CG2 4.15Å; F449-T655 WeakPolarHBondContact CZ-OG1 3.41Å; F449-E657 HydrophobicContact CE1-CB 3.9Å; F449-E657 HydrophobicContact CE1-CG 4.15Å; F449-E657 HydrophobicContact CE2-CB 4.49Å; F449-E657 HydrophobicContact CE2-CG 4.25Å; F449-E657 HydrophobicContact CZ-CB 3.69Å; F449-E657 HydrophobicContact CZ-CG 3.9Å; F449-M660 HydrophobicContact CB-CG 4.22Å; F449-M660 HydrophobicContact CB-SD 4.17Å; F449-M660 HydrophobicContact CD1-CB 4.26Å; F449-M660 HydrophobicContact CD1-CG 3.59Å; F449-M660 HydrophobicContact CD1-SD 4.46Å; F449-M660 HydrophobicContact CE1-CB 4.44Å; F449-M660 HydrophobicContact CE1-CG 4.09Å; F449-M660 HydrophobicContact CG-CG 4.01Å
450	A	95.4	Very high	94	Very high	4 Å²	4	26.4 Å²	26.4	3%	0.033	14%	0.135	C	C	.	.	H	α-helix	trans	-57.8	-43.5	177	0	0	0	0	0	112	I345 M349 E446 E447 E453 V454	I345-A450 HydrophobicContact CG1-CB 4.17Å; I345-A450 HydrophobicContact CG2-CB 4.03Å; M349-A450 HydrophobicContact CG-CB 3.74Å; M349-A450 HydrophobicContact SD-CB 3.82Å; E446-A450 VanDerWaalsContact O-CB 3.3Å; E446-A450 WeakPolarHBondContact O-CB 3.49Å; E446-A450 PolarHBondContact O-N 2.92Å; E447-A450 PolarHBondContact O-N 3.1Å; A450-E453 PolarHBondContact O-N 3.3Å; A450-V454 WeakPolarHBondContact O-CG2 3.46Å; A450-V454 PolarHBondContact O-N 2.62Å
451	L	95.8	Very high	93.7	Very high	5 Å²	5	21.8 Å²	21.8	3%	0.026	12%	0.117	C	C	.	.	H	α-helix	trans	-61.4	-46.2	175.6	-72.2	170.2	0	0	0	111.9	V408 Y443 E447 K448 F449 E453 V454 I455 L648	V408-L451 HydrophobicContact CG1-CD2 4.12Å; V408-L451 HydrophobicContact CG2-CD2 4.49Å; Y443-L451 HydrophobicContact CD1-CD1 3.86Å; Y443-L451 HydrophobicContact CE1-CD1 3.72Å; E447-L451 WeakPolarHBondContact O-CB 3.48Å; E447-L451 VanDerWaalsContact O-CG 3.25Å; E447-L451 WeakPolarHBondContact O-CG 3.4Å; E447-L451 PolarHBondContact O-N 2.64Å; K448-L451 PolarHBondContact O-N 3.27Å; F449-L451 VanDerWaalsContact C-N 3.32Å; F449-L451 PolarHBondContact O-N 3.19Å; L451-E453 VanDerWaalsContact C-N 3.3Å; L451-E453 PolarHBondContact O-N 3.23Å; L451-V454 PolarHBondContact O-N 3.12Å; L451-I455 WeakPolarHBondContact O-CB 3.43Å; L451-I455 WeakPolarHBondContact O-CD1 3.35Å; L451-I455 WeakPolarHBondContact O-CG1 3.25Å; L451-I455 PolarHBondContact O-N 2.78Å; L451-L648 HydrophobicContact CB-CD2 4.21Å; L451-L648 HydrophobicContact CD1-CD2 4.26Å
452	V	95.8	Very high	93.4	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-60	-41.1	177.8	171.3	0	0	0	0	111.3	K448 F449 I455 A456 L648	K448-V452 WeakPolarHBondContact O-CG2 3.35Å; K448-V452 PolarHBondContact O-N 3.11Å; K448-V452 VanDerWaalsContact O-N 3.11Å; F449-V452 PolarHBondContact O-N 3.44Å; F449-V452 VanDerWaalsContact O-N 3.15Å; V452-I455 PolarHBondContact O-N 2.89Å; V452-A456 WeakPolarHBondContact O-CB 3.17Å; V452-A456 PolarHBondContact O-N 3.23Å; V452-L648 HydrophobicContact CG2-CB 3.8Å; V452-L648 HydrophobicContact CG2-CD2 4.27Å; V452-L648 HydrophobicContact CG2-CG 4.42Å
453	E	93.4	Very high	92.6	Very high	16 Å²	16	22.7 Å²	22.7	8%	0.075	12%	0.124	C	C	.	.	H	α-helix	trans	-61.6	-47.7	175.2	-74.9	-173.5	-137	0	0	112.6	M349 R353 F449 A450 L451 I455 A456 M457 M660 Y663	M349-E453 HydrophobicContact CE-CB 3.55Å; M349-E453 HydrophobicContact CE-CG 4.33Å; M349-E453 VanDerWaalsContact CE-OE2 3.25Å; M349-E453 WeakPolarHBondContact CE-OE2 3.28Å; R353-E453 IonicContact CZ-OE1 3.74Å; R353-E453 IonicContact CZ-OE2 2.79Å; R353-E453 IonicContact NE-OE2 2.78Å; R353-E453 PolarHBondContact NE-OE2 3.37Å; R353-E453 IonicContact NH2-OE1 3.88Å; R353-E453 PolarHBondContact NH2-OE1 3.32Å; R353-E453 IonicContact NH2-OE2 3.36Å; R353-E453 PolarHBondContact NH2-OE2 3.07Å; F449-E453 PolarHBondContact O-N 3.46Å; A450-E453 PolarHBondContact O-N 3.3Å; L451-E453 VanDerWaalsContact C-N 3.3Å; L451-E453 PolarHBondContact O-N 3.23Å; E453-I455 VanDerWaalsContact C-N 3.33Å; E453-I455 PolarHBondContact O-N 3.06Å; E453-A456 PolarHBondContact O-N 3.04Å; E453-M457 HydrophobicContact CB-CE 4.31Å; E453-M457 WeakPolarHBondContact O-CG 3.39Å; E453-M457 PolarHBondContact O-N 2.93Å; E453-M660 HydrophobicContact CG-CE 3.66Å; E453-M660 HydrophobicContact CG-SD 3.64Å; E453-M660 WeakPolarHBondContact OE1-CE 3.31Å; E453-Y663 HydrophobicContact CG-CD1 4.41Å; E453-Y663 HydrophobicContact CG-CE1 4.32Å
454	V	95.6	Very high	91.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.2	-42.3	179	-178.7	0	0	0	0	110.7	M349 I352 W404 V408 A450 L451 A456 M457 I458	M349-V454 HydrophobicContact CE-CG2 3.92Å; M349-V454 HydrophobicContact SD-CG2 3.41Å; M349-V454 WeakPolarHBondContact SD-CG2 3.33Å; I352-V454 HydrophobicContact CD1-CG2 3.95Å; I352-V454 HydrophobicContact CG2-CG2 4.4Å; W404-V454 HydrophobicContact CB-CG1 3.93Å; V408-V454 HydrophobicContact CG2-CB 4Å; V408-V454 HydrophobicContact CG2-CG1 3.53Å; A450-V454 WeakPolarHBondContact O-CG2 3.46Å; A450-V454 PolarHBondContact O-N 2.62Å; L451-V454 PolarHBondContact O-N 3.12Å; V454-A456 VanDerWaalsContact C-N 3.33Å; V454-A456 PolarHBondContact O-N 3.19Å; V454-M457 HydrophobicContact CG2-CE 4.21Å; V454-M457 PolarHBondContact O-N 3.43Å; V454-I458 HydrophobicContact CG1-CD1 3.9Å; V454-I458 HydrophobicContact CG1-CG1 4.4Å; V454-I458 WeakPolarHBondContact O-CD1 3.38Å; V454-I458 VanDerWaalsContact O-CG1 3.24Å; V454-I458 WeakPolarHBondContact O-CG1 3.48Å; V454-I458 PolarHBondContact O-N 3.31Å
455	I	94.9	Very high	91.3	Very high	1 Å²	1	21 Å²	21	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-60.1	-44.1	176.5	-67.8	161.8	0	0	0	110.9	V408 L451 V452 E453 I458 K459 L618 L648 L670	V408-I455 HydrophobicContact CG1-CG1 4.33Å; V408-I455 HydrophobicContact CG2-CG1 4.44Å; L451-I455 WeakPolarHBondContact O-CB 3.43Å; L451-I455 WeakPolarHBondContact O-CD1 3.35Å; L451-I455 WeakPolarHBondContact O-CG1 3.25Å; L451-I455 PolarHBondContact O-N 2.78Å; V452-I455 PolarHBondContact O-N 2.89Å; E453-I455 VanDerWaalsContact C-N 3.33Å; E453-I455 PolarHBondContact O-N 3.06Å; I455-I458 PolarHBondContact O-N 3.47Å; I455-K459 HydrophobicContact CG2-CD 4.1Å; I455-K459 PolarHBondContact O-N 2.82Å; I455-L618 HydrophobicContact CB-CD1 4.42Å; I455-L618 HydrophobicContact CG1-CD1 4.04Å; I455-L618 HydrophobicContact CG2-CD1 4.06Å; I455-L648 HydrophobicContact CD1-CD1 3.83Å; I455-L670 HydrophobicContact CD1-CD1 4.13Å; I455-L670 HydrophobicContact CG2-CD2 4.01Å; I455-L670 HydrophobicContact CG2-CG 4.44Å
456	A	91.4	Very high	90.4	Very high	6 Å²	6	20.2 Å²	20.2	5%	0.05	11%	0.112	C	C	.	.	H	α-helix	trans	-66.8	-38.5	177	0	0	0	0	0	112.8	V452 E453 V454 G460 Y663 Y666	V452-A456 WeakPolarHBondContact O-CB 3.17Å; V452-A456 PolarHBondContact O-N 3.23Å; E453-A456 PolarHBondContact O-N 3.04Å; V454-A456 VanDerWaalsContact C-N 3.33Å; V454-A456 PolarHBondContact O-N 3.19Å; A456-G460 WeakPolarHBondContact O-CA 3.46Å; A456-G460 PolarHBondContact O-N 3.47Å; A456-Y663 HydrophobicContact CB-CD1 3.3Å; A456-Y663 HydrophobicContact CB-CE1 3.89Å; A456-Y663 HydrophobicContact CB-CG 4.3Å; A456-Y666 HydrophobicContact CB-CD1 4.43Å; A456-Y666 HydrophobicContact CB-CD2 3.39Å; A456-Y666 HydrophobicContact CB-CE2 3.97Å; A456-Y666 HydrophobicContact CB-CG 3.66Å
457	M	92.4	Very high	89.5	Confident	12 Å²	12	20.9 Å²	20.9	6%	0.059	11%	0.109	C	C	.	.	H	α-helix	trans	-64.2	-40.3	174.5	-74.3	-173.1	-74.9	0	0	111.5	M349 I352 R353 H356 W404 E453 V454 L461	M349-M457 HydrophobicContact CE-CE 3.86Å; I352-M457 HydrophobicContact CB-CE 4.48Å; I352-M457 HydrophobicContact CG2-CE 3.37Å; I352-M457 HydrophobicContact CG2-SD 4.03Å; R353-M457 HydrophobicContact CG-CE 4.38Å; R353-M457 HydrophobicContact CG-SD 4.39Å; H356-M457 HydrophobicContact CB-SD 3.76Å; H356-M457 VanDerWaalsContact CD2-CG 3.48Å; H356-M457 WeakPolarHBondContact CD2-CG 3.38Å; W404-M457 HydrophobicContact CE3-CB 4.24Å; W404-M457 HydrophobicContact CZ3-CB 4.02Å; E453-M457 HydrophobicContact CB-CE 4.31Å; E453-M457 WeakPolarHBondContact O-CG 3.39Å; E453-M457 PolarHBondContact O-N 2.93Å; V454-M457 HydrophobicContact CG2-CE 4.21Å; V454-M457 PolarHBondContact O-N 3.43Å; M457-L461 VanDerWaalsContact O-CB 3.28Å; M457-L461 WeakPolarHBondContact O-CB 3.34Å; M457-L461 PolarHBondContact O-N 2.87Å
458	I	94.2	Very high	88.7	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.7	-57.7	173.9	-68.4	161.7	0	0	0	110.1	L401 W404 V408 V454 I455 G460 L461 Q462 C616 L618	L401-I458 HydrophobicContact CD2-CB 4.45Å; L401-I458 HydrophobicContact CD2-CG2 4.18Å; L401-I458 WeakPolarHBondContact CD2-O 3.38Å; W404-I458 HydrophobicContact CB-CD1 3.82Å; W404-I458 HydrophobicContact CB-CG1 3.56Å; W404-I458 HydrophobicContact CE3-CG1 4.03Å; V408-I458 HydrophobicContact CG2-CD1 4.19Å; V454-I458 HydrophobicContact CG1-CD1 3.9Å; V454-I458 HydrophobicContact CG1-CG1 4.4Å; V454-I458 WeakPolarHBondContact O-CD1 3.38Å; V454-I458 VanDerWaalsContact O-CG1 3.24Å; V454-I458 WeakPolarHBondContact O-CG1 3.48Å; V454-I458 PolarHBondContact O-N 3.31Å; I455-I458 PolarHBondContact O-N 3.47Å; I458-G460 PolarHBondContact O-N 2.87Å; I458-L461 PolarHBondContact O-N 3.18Å; I458-Q462 VanDerWaalsContact O-CB 3.29Å; I458-Q462 WeakPolarHBondContact O-CB 3.44Å; I458-Q462 PolarHBondContact O-N 2.73Å; I458-C616 HydrophobicContact CG2-CB 3.92Å; I458-L618 HydrophobicContact CD1-CD1 4.19Å; I458-L618 HydrophobicContact CD1-CD2 4.4Å; I458-L618 HydrophobicContact CG2-CD1 4.45Å
459	K	90.2	Very high	88	Confident	6 Å²	6	21 Å²	21	3%	0.026	11%	0.11	C	C	.	.	H	α-helix	trans	-65.9	-38	-175.9	-72.2	179.7	173.2	-68.5	0	112	I455 Q462 V463 Y666 D669 D673	I455-K459 HydrophobicContact CG2-CD 4.1Å; I455-K459 PolarHBondContact O-N 2.82Å; K459-Q462 PolarHBondContact O-N 3.12Å; K459-V463 VanDerWaalsContact O-CG2 3.27Å; K459-V463 WeakPolarHBondContact O-CG2 3.25Å; K459-V463 PolarHBondContact O-N 3.37Å; K459-V463 VanDerWaalsContact O-N 3.11Å; K459-Y666 HydrophobicContact CB-CD1 3.69Å; K459-Y666 HydrophobicContact CB-CE1 4.18Å; K459-Y666 HydrophobicContact CD-CD1 4.26Å; K459-D669 HydrophobicContact CD-CB 4.06Å; K459-D669 VanDerWaalsContact CD-OD2 3.29Å; K459-D669 WeakPolarHBondContact CD-OD2 3.49Å; K459-D669 VanDerWaalsContact CE-OD2 3.25Å; K459-D669 WeakPolarHBondContact CE-OD2 3.48Å; K459-D669 IonicContact NZ-OD2 3.23Å; K459-D669 PolarHBondContact NZ-OD2 2.86Å; K459-D673 WeakPolarHBondContact CE-OD2 3.47Å; K459-D673 IonicContact NZ-OD1 3.68Å; K459-D673 PolarHBondContact NZ-OD1 2.98Å; K459-D673 IonicContact NZ-OD2 3.11Å; K459-D673 PolarHBondContact NZ-OD2 3.02Å
460	G	83.4	Confident	87.1	Confident	19 Å²	19	24.8 Å²	24.8	20%	0.196	14%	0.139	C	C	.	.	H	α-helix	trans	-61.7	-48.1	174.7	0	0	0	0	0	112.4	A456 I458 V463 L464	A456-G460 WeakPolarHBondContact O-CA 3.46Å; A456-G460 PolarHBondContact O-N 3.47Å; I458-G460 PolarHBondContact O-N 2.87Å; G460-V463 PolarHBondContact O-N 3.05Å; G460-L464 PolarHBondContact O-N 3.21Å
461	L	89.4	Confident	86.3	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-69.7	-36.4	176.8	176.3	59.4	0	0	0	112.1	F359 I360 L363 L400 L401 W404 M457 I458 V463 L464 M465	F359-L461 HydrophobicContact CD1-CD1 4.06Å; F359-L461 HydrophobicContact CD1-CD2 4.02Å; F359-L461 HydrophobicContact CE1-CD1 3.89Å; F359-L461 HydrophobicContact CE1-CD2 4.17Å; I360-L461 HydrophobicContact CD1-CB 4.34Å; I360-L461 HydrophobicContact CD1-CD1 4.3Å; I360-L461 HydrophobicContact CG1-CD1 3.91Å; L363-L461 HydrophobicContact CD2-CD1 3.85Å; L400-L461 HydrophobicContact CD2-CD2 4.19Å; L401-L461 HydrophobicContact CD1-CD2 4.4Å; L401-L461 HydrophobicContact CD1-CG 4.23Å; L401-L461 HydrophobicContact CD2-CB 3.84Å; L401-L461 HydrophobicContact CD2-CD2 3.79Å; L401-L461 HydrophobicContact CD2-CG 3.84Å; L401-L461 HydrophobicContact CG-CD2 3.8Å; L401-L461 HydrophobicContact CG-CG 4.07Å; W404-L461 HydrophobicContact CH2-CD2 3.94Å; W404-L461 HydrophobicContact CZ3-CB 4.23Å; W404-L461 HydrophobicContact CZ3-CD2 3.68Å; M457-L461 VanDerWaalsContact O-CB 3.28Å; M457-L461 WeakPolarHBondContact O-CB 3.34Å; M457-L461 PolarHBondContact O-N 2.87Å; I458-L461 PolarHBondContact O-N 3.18Å; L461-V463 VanDerWaalsContact C-N 3.25Å; L461-V463 PolarHBondContact O-N 3.38Å; L461-L464 HydrophobicContact CD1-CB 4.49Å; L461-L464 PolarHBondContact O-N 3.04Å; L461-L464 VanDerWaalsContact O-N 3.1Å; L461-M465 HydrophobicContact CD1-CG 3.87Å; L461-M465 HydrophobicContact CD1-SD 4.26Å; L461-M465 HydrophobicContact CG-CG 4.08Å; L461-M465 VanDerWaalsContact O-CG 3.29Å; L461-M465 WeakPolarHBondContact O-CG 3.29Å; L461-M465 PolarHBondContact O-N 3.49Å
462	Q	88.3	Confident	85.9	Confident	47 Å²	47	25.7 Å²	25.7	22%	0.22	14%	0.144	C	C	.	.	H	α-helix	trans	-55.3	-42.7	174.3	-173.6	-175.7	13.2	0	0	111.5	I458 K459 M465 G466 L612 C616	I458-Q462 VanDerWaalsContact O-CB 3.29Å; I458-Q462 WeakPolarHBondContact O-CB 3.44Å; I458-Q462 PolarHBondContact O-N 2.73Å; K459-Q462 PolarHBondContact O-N 3.12Å; Q462-M465 PolarHBondContact O-N 3.32Å; Q462-G466 PolarHBondContact O-N 3.39Å; Q462-L612 HydrophobicContact CG-CD1 4.3Å; Q462-L612 HydrophobicContact CG-CD2 4.41Å; Q462-L612 HydrophobicContact CG-CG 4.15Å; Q462-C616 HydrophobicContact CG-CB 4.17Å
463	V	79.5	Confident	85.2	Confident	32 Å²	32	26.8 Å²	26.8	19%	0.194	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-44.7	175.9	170	0	0	0	0	111.6	P31 K459 G460 L461 G466 R467	P31-V463 HydrophobicContact CB-CG1 4.34Å; P31-V463 HydrophobicContact CB-CG2 3.59Å; K459-V463 VanDerWaalsContact O-CG2 3.27Å; K459-V463 WeakPolarHBondContact O-CG2 3.25Å; K459-V463 PolarHBondContact O-N 3.37Å; K459-V463 VanDerWaalsContact O-N 3.11Å; G460-V463 PolarHBondContact O-N 3.05Å; L461-V463 VanDerWaalsContact C-N 3.25Å; L461-V463 PolarHBondContact O-N 3.38Å; V463-G466 PolarHBondContact O-N 2.89Å; V463-R467 WeakPolarHBondContact O-CG 3.3Å; V463-R467 PolarHBondContact O-N 3.28Å
464	L	76.8	Confident	84.6	Confident	58 Å²	58	30 Å²	30	30%	0.304	17%	0.165	S	C	.	.	H	α-helix	trans	-64.9	-44.3	178.7	-64.4	177.5	0	0	0	111.7	I360 L363 G460 L461 G466 R467 M468	I360-L464 HydrophobicContact CD1-CD1 4.12Å; I360-L464 HydrophobicContact CG1-CD1 4.28Å; I360-L464 HydrophobicContact CG2-CD1 3.92Å; L363-L464 HydrophobicContact CD2-CB 4.2Å; G460-L464 PolarHBondContact O-N 3.21Å; L461-L464 HydrophobicContact CD1-CB 4.49Å; L461-L464 PolarHBondContact O-N 3.04Å; L461-L464 VanDerWaalsContact O-N 3.1Å; L464-G466 VanDerWaalsContact C-N 3.35Å; L464-R467 PolarHBondContact O-N 3.47Å; L464-M468 PolarHBondContact O-N 3.36Å
465	M	83.3	Confident	84.1	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63	-41.2	176.9	-66.7	-64.1	-73.8	0	0	111.5	F359 L363 L401 L461 Q462 M468 E469 F472 F608 L612	F359-M465 HydrophobicContact CE1-SD 4.14Å; F359-M465 HydrophobicContact CZ-SD 4.34Å; L363-M465 HydrophobicContact CD1-SD 4.38Å; L363-M465 HydrophobicContact CD2-CG 4.48Å; L363-M465 HydrophobicContact CD2-SD 3.65Å; L401-M465 HydrophobicContact CD1-CG 4.15Å; L461-M465 HydrophobicContact CD1-CG 3.87Å; L461-M465 HydrophobicContact CD1-SD 4.26Å; L461-M465 HydrophobicContact CG-CG 4.08Å; L461-M465 VanDerWaalsContact O-CG 3.29Å; L461-M465 WeakPolarHBondContact O-CG 3.29Å; L461-M465 PolarHBondContact O-N 3.49Å; Q462-M465 PolarHBondContact O-N 3.32Å; M465-M468 CarbonylContact O-C 3.51Å; M465-M468 PolarHBondContact O-N 3.43Å; M465-E469 PolarHBondContact O-N 2.7Å; M465-F472 HydrophobicContact CE-CE2 3.77Å; M465-F472 HydrophobicContact CE-CZ 4.11Å; M465-F472 HydrophobicContact SD-CE2 3.89Å; M465-F472 HydrophobicContact SD-CZ 4.15Å; M465-F608 HydrophobicContact CB-CZ 4.18Å; M465-F608 HydrophobicContact CE-CE2 3.96Å; M465-F608 HydrophobicContact CE-CZ 3.74Å; M465-L612 HydrophobicContact CB-CD1 3.81Å; M465-L612 HydrophobicContact CB-CD2 4Å; M465-L612 HydrophobicContact CG-CD1 4.39Å
466	G	78.4	Confident	83.8	Confident	26 Å²	26	30 Å²	30	27%	0.268	17%	0.165	S	C	.	.	H	α-helix	trans	-65	-38.9	175.7	0	0	0	0	0	113.2	Q462 V463 L464 M468 E469	Q462-G466 PolarHBondContact O-N 3.39Å; V463-G466 PolarHBondContact O-N 2.89Å; L464-G466 VanDerWaalsContact C-N 3.35Å; G466-M468 VanDerWaalsContact C-N 3.26Å; G466-M468 PolarHBondContact O-N 2.92Å; G466-E469 WeakPolarHBondContact O-CB 3.48Å; G466-E469 PolarHBondContact O-N 3.3Å; G466-E469 VanDerWaalsContact O-N 3.1Å
467	R	74.7	Confident	83.7	Confident	131 Å²	131	32.9 Å²	32.9	49%	0.494	17%	0.174	S	C	.	.	H	α-helix	trans	-63.1	-32.2	173.6	-73.8	176.9	-178.7	-168.1	1.2	112.8	E30 V463 L464 E469	E30-R467 PolarHBondContact O-NH2 3.3Å; V463-R467 WeakPolarHBondContact O-CG 3.3Å; V463-R467 PolarHBondContact O-N 3.28Å; L464-R467 PolarHBondContact O-N 3.47Å; R467-E469 VanDerWaalsContact C-N 3.3Å
468	M	76.8	Confident	83.5	Confident	7 Å²	7	32.4 Å²	32.4	3%	0.034	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	0.7	176.5	-67.9	-124.8	72.9	0	0	113.4	L363 E370 L464 M465 G466 S470 V471 F472	L363-M468 HydrophobicContact CD1-SD 3.94Å; E370-M468 HydrophobicContact CG-CE 4.27Å; L464-M468 PolarHBondContact O-N 3.36Å; M465-M468 CarbonylContact O-C 3.51Å; M465-M468 PolarHBondContact O-N 3.43Å; G466-M468 VanDerWaalsContact C-N 3.26Å; G466-M468 PolarHBondContact O-N 2.92Å; M468-S470 VanDerWaalsContact C-N 3.32Å; M468-S470 PolarHBondContact O-N 3.48Å; M468-V471 HydrophobicContact CE-CB 3.9Å; M468-V471 HydrophobicContact CE-CG1 3.97Å; M468-V471 HydrophobicContact CE-CG2 3.89Å; M468-V471 WeakPolarHBondContact O-CB 3.47Å; M468-V471 PolarHBondContact O-N 3.02Å; M468-F472 HydrophobicContact CB-CD2 3.67Å; M468-F472 HydrophobicContact CB-CE2 3.39Å; M468-F472 HydrophobicContact CB-CG 4.43Å; M468-F472 HydrophobicContact CB-CZ 3.95Å; M468-F472 HydrophobicContact CG-CE2 4.38Å; M468-F472 WeakPolarHBondContact O-CD2 3.37Å; M468-F472 PolarHBondContact O-N 3.45Å; M468-F472 HydrophobicContact SD-CZ 4.48Å
469	E	82.4	Confident	83.5	Confident	53 Å²	53	32.8 Å²	32.8	25%	0.248	17%	0.174	C	C	.	.	H	α-helix	trans	-51.9	-48.1	-172.9	175.2	175.4	164.9	0	0	112	M465 G466 R467 V471 F472 N473 F608 S609	M465-E469 PolarHBondContact O-N 2.7Å; G466-E469 WeakPolarHBondContact O-CB 3.48Å; G466-E469 PolarHBondContact O-N 3.3Å; G466-E469 VanDerWaalsContact O-N 3.1Å; R467-E469 VanDerWaalsContact C-N 3.3Å; E469-V471 VanDerWaalsContact C-N 3.31Å; E469-V471 PolarHBondContact O-N 3.4Å; E469-F472 PolarHBondContact O-N 2.82Å; E469-N473 VanDerWaalsContact CG-ND2 3.34Å; E469-N473 WeakPolarHBondContact CG-ND2 3.42Å; E469-N473 WeakPolarHBondContact O-CB 3.41Å; E469-N473 PolarHBondContact O-N 3.31Å; E469-N473 PolarHBondContact O-ND2 3.38Å; E469-N473 PolarHBondContact OE1-ND2 2.96Å; E469-F608 HydrophobicContact CB-CD1 4.36Å; E469-F608 HydrophobicContact CB-CE1 4.4Å; E469-F608 HydrophobicContact CG-CD1 4.08Å; E469-S609 WeakPolarHBondContact OE1-CB 3.46Å; E469-S609 PolarHBondContact OE1-OG 3.25Å; E469-S609 PolarHBondContact OE2-OG 2.78Å
470	S	76.8	Confident	83.7	Confident	97 Å²	97	32.5 Å²	32.5	68%	0.678	17%	0.173	S	C	*	.	H	α-helix	trans	-59.8	-40.5	-178.8	-173	0	0	0	0	112.8	M468 H474	M468-S470 VanDerWaalsContact C-N 3.32Å; M468-S470 PolarHBondContact O-N 3.48Å; S470-H474 PolarHBondContact O-N 2.86Å
471	V	79.7	Confident	84.2	Confident	27 Å²	27	32.2 Å²	32.2	16%	0.164	17%	0.166	C	C	.	.	H	α-helix	trans	-69.1	-47.9	179.8	173.5	0	0	0	0	110.2	E370 L390 M468 E469 N473 H474 A475	E370-V471 VanDerWaalsContact CD-CG1 3.44Å; E370-V471 HydrophobicContact CG-CG1 4.22Å; E370-V471 HydrophobicContact CG-CG2 4.26Å; E370-V471 WeakPolarHBondContact OE1-CG1 3.11Å; E370-V471 WeakPolarHBondContact OE2-CG2 3.46Å; L390-V471 HydrophobicContact CD1-CG1 3.86Å; L390-V471 HydrophobicContact CD2-CG1 4.36Å; M468-V471 HydrophobicContact CE-CB 3.9Å; M468-V471 HydrophobicContact CE-CG1 3.97Å; M468-V471 HydrophobicContact CE-CG2 3.89Å; M468-V471 WeakPolarHBondContact O-CB 3.47Å; M468-V471 PolarHBondContact O-N 3.02Å; E469-V471 VanDerWaalsContact C-N 3.31Å; E469-V471 PolarHBondContact O-N 3.4Å; V471-N473 VanDerWaalsContact C-N 3.33Å; V471-N473 PolarHBondContact O-N 3.42Å; V471-H474 PolarHBondContact O-N 3.48Å; V471-A475 WeakPolarHBondContact O-CB 3.4Å; V471-A475 PolarHBondContact O-N 3.33Å
472	F	86.3	Confident	84.4	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.7	-46.1	176.2	-70.9	-40.4	0	0	0	111.3	L363 L390 L393 A394 M465 M468 E469 H474 A475 I476 F608	L363-F472 HydrophobicContact CD1-CE2 4.48Å; L363-F472 HydrophobicContact CD1-CZ 3.66Å; L390-F472 WeakPolarHBondContact O-CD1 3.47Å; L390-F472 WeakPolarHBondContact O-CE1 3.37Å; L393-F472 HydrophobicContact CB-CE1 4.26Å; A394-F472 HydrophobicContact CB-CB 4.31Å; A394-F472 HydrophobicContact CB-CD1 3.71Å; A394-F472 HydrophobicContact CB-CD2 4.37Å; A394-F472 HydrophobicContact CB-CE1 4.01Å; A394-F472 HydrophobicContact CB-CG 3.91Å; A394-F472 HydrophobicContact CB-CZ 4.43Å; M465-F472 HydrophobicContact CE-CE2 3.77Å; M465-F472 HydrophobicContact CE-CZ 4.11Å; M465-F472 HydrophobicContact SD-CE2 3.89Å; M465-F472 HydrophobicContact SD-CZ 4.15Å; M468-F472 HydrophobicContact CB-CD2 3.67Å; M468-F472 HydrophobicContact CB-CE2 3.39Å; M468-F472 HydrophobicContact CB-CG 4.43Å; M468-F472 HydrophobicContact CB-CZ 3.95Å; M468-F472 HydrophobicContact CG-CE2 4.38Å; M468-F472 WeakPolarHBondContact O-CD2 3.37Å; M468-F472 PolarHBondContact O-N 3.45Å; M468-F472 HydrophobicContact SD-CZ 4.48Å; E469-F472 PolarHBondContact O-N 2.82Å; F472-H474 VanDerWaalsContact C-N 3.29Å; F472-H474 PolarHBondContact O-N 3.21Å; F472-A475 PolarHBondContact O-N 3.42Å; F472-I476 HydrophobicContact CB-CD1 4.01Å; F472-I476 WeakPolarHBondContact O-CB 3.4Å; F472-I476 WeakPolarHBondContact O-CD1 3.46Å; F472-I476 WeakPolarHBondContact O-CG1 3.21Å; F472-I476 PolarHBondContact O-N 3.28Å; F472-F608 AromaticContact CD2-CE1 3.94Å; F472-F608 HydrophobicContact CD2-CE1 3.94Å; F472-F608 HydrophobicContact CD2-CE2 4.06Å; F472-F608 AromaticContact CD2-CZ 3.57Å; F472-F608 HydrophobicContact CD2-CZ 3.57Å; F472-F608 AromaticContact CE2-CZ 3.98Å; F472-F608 HydrophobicContact CE2-CZ 3.98Å; F472-F608 HydrophobicContact CG-CZ 4.46Å
473	N	81.6	Confident	84.7	Confident	25 Å²	25	31.5 Å²	31.5	13%	0.134	17%	0.168	C	C	.	.	H	α-helix	trans	-54.2	-43.4	178.3	-96.4	-26	0	0	0	112.7	E469 V471 R477	E469-N473 VanDerWaalsContact CG-ND2 3.34Å; E469-N473 WeakPolarHBondContact CG-ND2 3.42Å; E469-N473 WeakPolarHBondContact O-CB 3.41Å; E469-N473 PolarHBondContact O-N 3.31Å; E469-N473 PolarHBondContact O-ND2 3.38Å; E469-N473 PolarHBondContact OE1-ND2 2.96Å; V471-N473 VanDerWaalsContact C-N 3.33Å; V471-N473 PolarHBondContact O-N 3.42Å; N473-R477 WeakPolarHBondContact O-CB 3.47Å; N473-R477 VanDerWaalsContact O-CG 3.23Å; N473-R477 WeakPolarHBondContact O-CG 3.49Å; N473-R477 PolarHBondContact O-N 2.77Å; N473-R477 PolarHBondContact O-NH1 3.14Å
474	H	81	Confident	85.4	Confident	83 Å²	83	30.2 Å²	30.2	38%	0.384	16%	0.16	S	C	.	.	H	α-helix	trans	-71.9	-48.4	177.8	-178.9	77.6	0	0	0	111.9	Y387 S470 V471 F472 I476 R477 H478 A551	Y387-H474 AromaticContact CE1-CD2 3.49Å; Y387-H474 VanDerWaalsContact CE1-CD2 3.49Å; Y387-H474 WeakPolarHBondContact CE1-CD2 3.18Å; Y387-H474 AromaticContact CE1-NE2 3.75Å; Y387-H474 AromaticContact CZ-CD2 3.87Å; Y387-H474 AromaticContact CZ-NE2 3.6Å; Y387-H474 PolarHBondContact OH-NE2 3.44Å; Y387-H474 VanDerWaalsContact OH-NE2 3.13Å; S470-H474 PolarHBondContact O-N 2.86Å; V471-H474 PolarHBondContact O-N 3.48Å; F472-H474 VanDerWaalsContact C-N 3.29Å; F472-H474 PolarHBondContact O-N 3.21Å; H474-I476 PolarHBondContact O-N 2.93Å; H474-R477 PolarHBondContact O-N 3.01Å; H474-H478 PolarHBondContact O-N 3.16Å; H474-A551 WeakPolarHBondContact CE1-CB 3.25Å; H474-A551 WeakPolarHBondContact ND1-CB 3.31Å
475	A	84.9	Confident	86.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-44.3	-179.4	0	0	0	0	0	112.5	Y387 L390 V471 F472 H478 T479	Y387-A475 HydrophobicContact CD1-CB 3.73Å; L390-A475 HydrophobicContact CB-CB 3.62Å; L390-A475 HydrophobicContact CD1-CB 3.93Å; L390-A475 HydrophobicContact CG-CB 4.45Å; V471-A475 WeakPolarHBondContact O-CB 3.4Å; V471-A475 PolarHBondContact O-N 3.33Å; F472-A475 PolarHBondContact O-N 3.42Å; A475-H478 PolarHBondContact O-N 3.08Å; A475-T479 WeakPolarHBondContact O-CB 3.37Å; A475-T479 PolarHBondContact O-N 3.43Å; A475-T479 PolarHBondContact O-OG1 3.46Å; A475-T479 VanDerWaalsContact O-OG1 3.09Å
476	I	89.3	Confident	86.8	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-60.8	-49.2	178.3	-69.4	163.2	0	0	0	110.2	F391 A394 F472 H474 H478 T479 V480 L605 I606 F608	F391-I476 HydrophobicContact CB-CG1 4.45Å; F391-I476 HydrophobicContact CD2-CB 4.27Å; F391-I476 HydrophobicContact CD2-CG1 4.01Å; F391-I476 HydrophobicContact CD2-CG2 4.13Å; F391-I476 HydrophobicContact CE2-CG2 4.41Å; A394-I476 HydrophobicContact CB-CD1 3.86Å; A394-I476 HydrophobicContact CB-CG1 4.42Å; F472-I476 HydrophobicContact CB-CD1 4.01Å; F472-I476 WeakPolarHBondContact O-CB 3.4Å; F472-I476 WeakPolarHBondContact O-CD1 3.46Å; F472-I476 WeakPolarHBondContact O-CG1 3.21Å; F472-I476 PolarHBondContact O-N 3.28Å; H474-I476 PolarHBondContact O-N 2.93Å; I476-H478 VanDerWaalsContact C-N 3.31Å; I476-H478 PolarHBondContact O-N 2.86Å; I476-T479 PolarHBondContact O-N 2.75Å; I476-V480 HydrophobicContact CG2-CG2 4.12Å; I476-V480 WeakPolarHBondContact O-CB 3.42Å; I476-V480 VanDerWaalsContact O-CG2 3.23Å; I476-V480 WeakPolarHBondContact O-CG2 3.24Å; I476-V480 PolarHBondContact O-N 2.95Å; I476-L605 HydrophobicContact CD1-CB 4.1Å; I476-L605 HydrophobicContact CD1-CD2 4.25Å; I476-L605 WeakPolarHBondContact CD1-O 3.29Å; I476-L605 HydrophobicContact CG1-CB 4.43Å; I476-L605 HydrophobicContact CG2-CB 3.73Å; I476-I606 HydrophobicContact CG2-CD1 4.03Å; I476-I606 HydrophobicContact CG2-CG1 4.44Å; I476-F608 HydrophobicContact CD1-CD2 4.28Å
477	R	87.8	Confident	87.7	Confident	66 Å²	66	29.4 Å²	29.4	25%	0.249	15%	0.15	C	C	.	.	H	α-helix	trans	-60.7	-41.9	179.8	-74.2	-179.4	-172.4	91.3	4.1	111.7	N473 H474 Y481 A551 I606	N473-R477 WeakPolarHBondContact O-CB 3.47Å; N473-R477 VanDerWaalsContact O-CG 3.23Å; N473-R477 WeakPolarHBondContact O-CG 3.49Å; N473-R477 PolarHBondContact O-N 2.77Å; N473-R477 PolarHBondContact O-NH1 3.14Å; H474-R477 PolarHBondContact O-N 3.01Å; R477-Y481 VanDerWaalsContact O-CB 3.28Å; R477-Y481 WeakPolarHBondContact O-CB 3.22Å; R477-Y481 PolarHBondContact O-N 3.39Å; R477-A551 WeakPolarHBondContact CB-O 3.41Å; R477-I606 HydrophobicContact CG-CD1 3.74Å
478	H	89.5	Confident	88.6	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.009	13%	0.126	C	C	.	.	H	α-helix	trans	-62.7	-50.1	175.5	-175.3	103.7	0	0	0	112.2	D384 Y387 H474 A475 I476 V480 Y481 A482 R550	D384-H478 IonicContact OD1-CD2 3.8Å; D384-H478 IonicContact OD1-CE1 3.91Å; D384-H478 IonicContact OD1-NE2 3.96Å; D384-H478 PolarHBondContact OD1-NE2 3.26Å; Y387-H478 HydrophobicContact CD2-CB 4.2Å; Y387-H478 AromaticContact CD2-CD2 3.3Å; Y387-H478 WeakPolarHBondContact CD2-CD2 3.38Å; Y387-H478 AromaticContact CD2-CE1 3.79Å; Y387-H478 AromaticContact CD2-CG 3.55Å; Y387-H478 AromaticContact CD2-ND1 3.88Å; Y387-H478 AromaticContact CD2-NE2 3.48Å; Y387-H478 WeakPolarHBondContact CD2-NE2 3.46Å; Y387-H478 AromaticContact CE2-CD2 3.97Å; Y387-H478 AromaticContact CE2-CE1 3.73Å; Y387-H478 AromaticContact CE2-CG 3.85Å; Y387-H478 AromaticContact CE2-ND1 3.73Å; Y387-H478 AromaticContact CE2-NE2 3.9Å; Y387-H478 HydrophobicContact CG-CB 4.25Å; Y387-H478 AromaticContact CG-CD2 3.89Å; H474-H478 PolarHBondContact O-N 3.16Å; A475-H478 PolarHBondContact O-N 3.08Å; I476-H478 VanDerWaalsContact C-N 3.31Å; I476-H478 PolarHBondContact O-N 2.86Å; H478-V480 PolarHBondContact O-N 3.47Å; H478-Y481 PolarHBondContact O-N 3.15Å; H478-A482 VanDerWaalsContact O-CB 3.3Å; H478-A482 WeakPolarHBondContact O-CB 3.3Å; H478-A482 PolarHBondContact O-N 3.23Å; H478-R550 WeakPolarHBondContact CA-O 3.41Å
479	T	93.9	Very high	89.4	Confident	9 Å²	9	22.9 Å²	22.9	6%	0.055	12%	0.124	C	C	.	.	H	α-helix	trans	-63.5	-42.9	-179.3	-63.2	0	0	0	0	112.2	Y387 R388 F391 A475 I476 A482 A483	Y387-T479 VanDerWaalsContact C-OG1 3.28Å; Y387-T479 PolarHBondContact O-OG1 2.89Å; R388-T479 HydrophobicContact CB-CG2 4.36Å; R388-T479 PolarHBondContact N-OG1 3.43Å; F391-T479 HydrophobicContact CB-CG2 4.09Å; F391-T479 HydrophobicContact CD1-CG2 4.35Å; F391-T479 HydrophobicContact CD2-CG2 4.04Å; F391-T479 HydrophobicContact CG-CG2 3.92Å; A475-T479 WeakPolarHBondContact O-CB 3.37Å; A475-T479 PolarHBondContact O-N 3.43Å; A475-T479 PolarHBondContact O-OG1 3.46Å; A475-T479 VanDerWaalsContact O-OG1 3.09Å; I476-T479 PolarHBondContact O-N 2.75Å; T479-A482 PolarHBondContact O-N 3.07Å; T479-A483 VanDerWaalsContact O-CB 3.31Å; T479-A483 WeakPolarHBondContact O-CB 3.23Å; T479-A483 PolarHBondContact O-N 3.4Å
480	V	94.3	Very high	89.9	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.4	-44.2	178	170.5	0	0	0	0	110.6	F391 I476 H478 L484 P554 Y602	F391-V480 HydrophobicContact CD2-CG2 4.46Å; F391-V480 HydrophobicContact CE2-CG2 3.92Å; I476-V480 HydrophobicContact CG2-CG2 4.12Å; I476-V480 WeakPolarHBondContact O-CB 3.42Å; I476-V480 VanDerWaalsContact O-CG2 3.23Å; I476-V480 WeakPolarHBondContact O-CG2 3.24Å; I476-V480 PolarHBondContact O-N 2.95Å; H478-V480 PolarHBondContact O-N 3.47Å; V480-L484 VanDerWaalsContact O-CB 3.26Å; V480-L484 WeakPolarHBondContact O-CB 3.46Å; V480-L484 PolarHBondContact O-N 2.9Å; V480-P554 VanDerWaalsContact CG1-CD 3.48Å; V480-P554 HydrophobicContact CG1-CG 4.23Å; V480-Y602 HydrophobicContact CB-CD2 4.4Å; V480-Y602 HydrophobicContact CG1-CD2 3.65Å; V480-Y602 HydrophobicContact CG1-CE2 4.05Å; V480-Y602 HydrophobicContact CG1-CG 4.1Å; V480-Y602 HydrophobicContact CG2-CD1 3.88Å; V480-Y602 HydrophobicContact CG2-CD2 4.08Å; V480-Y602 HydrophobicContact CG2-CE1 4.21Å; V480-Y602 HydrophobicContact CG2-CE2 4.38Å; V480-Y602 HydrophobicContact CG2-CG 3.82Å
481	Y	92.9	Very high	90.8	Very high	13 Å²	13	21 Å²	21	5%	0.051	11%	0.113	C	C	.	.	H	α-helix	trans	-60.7	-50.3	175.6	-176.4	-91.3	0	0	0	111.6	R477 H478 A483 L484 Q485 D520 P548 R550 V552	R477-Y481 VanDerWaalsContact O-CB 3.28Å; R477-Y481 WeakPolarHBondContact O-CB 3.22Å; R477-Y481 PolarHBondContact O-N 3.39Å; H478-Y481 PolarHBondContact O-N 3.15Å; Y481-A483 PolarHBondContact O-N 3.42Å; Y481-L484 PolarHBondContact O-N 2.69Å; Y481-Q485 HydrophobicContact CD1-CG 3.94Å; Y481-Q485 HydrophobicContact CD2-CG 4.31Å; Y481-Q485 HydrophobicContact CE1-CB 4.47Å; Y481-Q485 HydrophobicContact CE1-CG 3.54Å; Y481-Q485 HydrophobicContact CE2-CG 3.94Å; Y481-Q485 HydrophobicContact CG-CG 4.31Å; Y481-Q485 WeakPolarHBondContact O-CG 3.47Å; Y481-Q485 PolarHBondContact O-N 3.5Å; Y481-D520 WeakPolarHBondContact OH-CB 3.37Å; Y481-D520 PolarHBondContact OH-OD2 3.41Å; Y481-P548 HydrophobicContact CE1-CB 4.37Å; Y481-P548 HydrophobicContact CE1-CG 4.36Å; Y481-P548 WeakPolarHBondContact CE1-O 3.28Å; Y481-P548 WeakPolarHBondContact OH-CG 3.39Å; Y481-R550 VanDerWaalsContact CB-O 3.3Å; Y481-R550 WeakPolarHBondContact CB-O 3.27Å; Y481-R550 HydrophobicContact CD1-CB 3.96Å; Y481-R550 VanDerWaalsContact CD1-N 3.33Å; Y481-R550 HydrophobicContact CD2-CB 4.05Å; Y481-R550 HydrophobicContact CE1-CB 3.81Å; Y481-R550 HydrophobicContact CE1-CG 3.9Å; Y481-R550 HydrophobicContact CE2-CB 3.92Å; Y481-R550 HydrophobicContact CE2-CG 4.13Å; Y481-R550 HydrophobicContact CG-CB 4.06Å; Y481-V552 WeakPolarHBondContact CB-O 3.07Å; Y481-V552 HydrophobicContact CD2-CG1 4.35Å; Y481-V552 WeakPolarHBondContact CD2-O 3.34Å
482	A	93.5	Very high	91.5	Very high	7 Å²	7	19.8 Å²	19.8	6%	0.058	11%	0.105	C	C	.	.	H	α-helix	trans	-57.6	-50.7	-179.4	0	0	0	0	0	111.4	H478 T479 L484 Q485 D486 R549	H478-A482 VanDerWaalsContact O-CB 3.3Å; H478-A482 WeakPolarHBondContact O-CB 3.3Å; H478-A482 PolarHBondContact O-N 3.23Å; T479-A482 PolarHBondContact O-N 3.07Å; A482-L484 VanDerWaalsContact C-N 3.34Å; A482-L484 PolarHBondContact O-N 3.46Å; A482-Q485 PolarHBondContact O-N 2.84Å; A482-D486 VanDerWaalsContact O-CB 3.29Å; A482-D486 WeakPolarHBondContact O-CB 3.08Å; A482-D486 PolarHBondContact O-N 3.31Å; A482-R549 VanDerWaalsContact CB-CZ 3.49Å
483	A	94.9	Very high	91.9	Very high	25 Å²	25	20.8 Å²	20.8	21%	0.207	11%	0.109	C	C	.	.	H	α-helix	trans	-61.1	-41.7	178.4	0	0	0	0	0	112.3	T479 Y481 F487 F595	T479-A483 VanDerWaalsContact O-CB 3.31Å; T479-A483 WeakPolarHBondContact O-CB 3.23Å; T479-A483 PolarHBondContact O-N 3.4Å; Y481-A483 PolarHBondContact O-N 3.42Å; A483-F487 WeakPolarHBondContact O-CB 3.31Å; A483-F487 PolarHBondContact O-N 3.27Å; A483-F487 VanDerWaalsContact O-N 3.11Å; A483-F595 HydrophobicContact CB-CE2 4.44Å
484	L	94.9	Very high	92.3	Very high	5 Å²	5	23.2 Å²	23.2	3%	0.026	12%	0.12	C	C	.	.	H	α-helix	trans	-65.1	-47.5	178.5	-179.7	63.8	0	0	0	111.6	V480 Y481 A482 S488 V518 P554 V562 F595	V480-L484 VanDerWaalsContact O-CB 3.26Å; V480-L484 WeakPolarHBondContact O-CB 3.46Å; V480-L484 PolarHBondContact O-N 2.9Å; Y481-L484 PolarHBondContact O-N 2.69Å; A482-L484 VanDerWaalsContact C-N 3.34Å; A482-L484 PolarHBondContact O-N 3.46Å; L484-S488 WeakPolarHBondContact O-CB 3.27Å; L484-S488 PolarHBondContact O-N 3.48Å; L484-S488 PolarHBondContact O-OG 2.58Å; L484-V518 HydrophobicContact CD1-CB 4.5Å; L484-V518 HydrophobicContact CD1-CG2 4.11Å; L484-V518 HydrophobicContact CD2-CB 4.14Å; L484-V518 HydrophobicContact CD2-CG1 4.29Å; L484-V518 HydrophobicContact CG-CB 4.39Å; L484-V518 HydrophobicContact CG-CG2 4.31Å; L484-P554 HydrophobicContact CD2-CB 3.74Å; L484-P554 HydrophobicContact CD2-CG 3.93Å; L484-V562 HydrophobicContact CD1-CG1 4.32Å; L484-F595 HydrophobicContact CB-CZ 4.45Å; L484-F595 HydrophobicContact CD1-CE1 4.36Å; L484-F595 HydrophobicContact CD1-CZ 3.73Å
485	Q	94.8	Very high	92.9	Very high	5 Å²	5	19.5 Å²	19.5	2%	0.023	10%	0.103	C	C	.	.	H	α-helix	trans	-71.2	-41.6	-177.8	-64.6	-54.3	-37.8	0	0	112.5	Y481 A482 F487 S488 Q489 V518 V547	Y481-Q485 HydrophobicContact CD1-CG 3.94Å; Y481-Q485 HydrophobicContact CD2-CG 4.31Å; Y481-Q485 HydrophobicContact CE1-CB 4.47Å; Y481-Q485 HydrophobicContact CE1-CG 3.54Å; Y481-Q485 HydrophobicContact CE2-CG 3.94Å; Y481-Q485 HydrophobicContact CG-CG 4.31Å; Y481-Q485 WeakPolarHBondContact O-CG 3.47Å; Y481-Q485 PolarHBondContact O-N 3.5Å; A482-Q485 PolarHBondContact O-N 2.84Å; Q485-F487 VanDerWaalsContact C-N 3.28Å; Q485-F487 PolarHBondContact O-N 3.28Å; Q485-S488 PolarHBondContact O-N 3.24Å; Q485-S488 PolarHBondContact O-OG 2.92Å; Q485-Q489 WeakPolarHBondContact O-CB 3.45Å; Q485-Q489 WeakPolarHBondContact O-CG 3.36Å; Q485-Q489 PolarHBondContact O-N 3.44Å; Q485-V518 PolarHBondContact NE2-O 3.45Å; Q485-V518 PolarHBondContact OE1-O 3.35Å; Q485-V547 HydrophobicContact CB-CG1 3.38Å; Q485-V547 HydrophobicContact CG-CG1 4.43Å
486	D	95	Very high	93.2	Very high	53 Å²	53	19.5 Å²	19.5	28%	0.283	10%	0.103	S	C	.	.	H	α-helix	trans	-60.9	-42.9	176.4	-68.1	-8.7	0	0	0	110.2	A482 V490 T491 V547 R549	A482-D486 VanDerWaalsContact O-CB 3.29Å; A482-D486 WeakPolarHBondContact O-CB 3.08Å; A482-D486 PolarHBondContact O-N 3.31Å; D486-V490 WeakPolarHBondContact O-CA 3.24Å; D486-V490 WeakPolarHBondContact O-CB 3.2Å; D486-V490 PolarHBondContact O-N 2.9Å; D486-T491 PolarHBondContact O-N 3.43Å; D486-T491 PolarHBondContact O-OG1 3.45Å; D486-V547 WeakPolarHBondContact OD1-CG1 3.18Å; D486-R549 VanDerWaalsContact CG-NH2 3.3Å; D486-R549 IonicContact OD1-CZ 3.9Å; D486-R549 IonicContact OD1-NH1 3.65Å; D486-R549 PolarHBondContact OD1-NH1 3.39Å; D486-R549 IonicContact OD1-NH2 2.77Å; D486-R549 PolarHBondContact OD1-NH2 3.21Å; D486-R549 VanDerWaalsContact OD1-NH2 3.08Å; D486-R549 IonicContact OD2-CZ 3.61Å; D486-R549 IonicContact OD2-NH1 2.75Å; D486-R549 IonicContact OD2-NH2 3.55Å; D486-R549 PolarHBondContact OD2-NH2 2.72Å
487	F	96.4	Very high	93.4	Very high	9 Å²	9	20.2 Å²	20.2	4%	0.039	11%	0.105	C	C	.	.	I	π-helix	trans	-63.7	-51.5	176.2	-177.7	-98.5	0	0	0	111.9	A483 Q485 T491 L492 L566 I592 F595	A483-F487 WeakPolarHBondContact O-CB 3.31Å; A483-F487 PolarHBondContact O-N 3.27Å; A483-F487 VanDerWaalsContact O-N 3.11Å; Q485-F487 VanDerWaalsContact C-N 3.28Å; Q485-F487 PolarHBondContact O-N 3.28Å; F487-T491 HydrophobicContact CD2-CG2 3.95Å; F487-T491 HydrophobicContact CE2-CG2 4.14Å; F487-T491 WeakPolarHBondContact O-CB 3.48Å; F487-T491 PolarHBondContact O-N 2.91Å; F487-L492 HydrophobicContact CD1-CD1 4.31Å; F487-L492 HydrophobicContact CD1-CG 4.18Å; F487-L492 HydrophobicContact CE1-CD1 3.91Å; F487-L492 HydrophobicContact CE1-CD2 3.75Å; F487-L492 HydrophobicContact CE1-CG 3.82Å; F487-L492 HydrophobicContact CE2-CD2 4.29Å; F487-L492 HydrophobicContact CZ-CD2 3.62Å; F487-L492 HydrophobicContact CZ-CG 4.16Å; F487-L492 WeakPolarHBondContact O-CG 3.29Å; F487-L492 PolarHBondContact O-N 3.23Å; F487-L566 HydrophobicContact CE1-CD1 3.61Å; F487-L566 HydrophobicContact CE1-CD2 3.77Å; F487-L566 HydrophobicContact CE1-CG 4.33Å; F487-L566 HydrophobicContact CZ-CD1 4.04Å; F487-L566 HydrophobicContact CZ-CD2 3.87Å; F487-I592 HydrophobicContact CZ-CG1 4.16Å; F487-F595 HydrophobicContact CB-CD2 3.83Å; F487-F595 HydrophobicContact CB-CE2 3.98Å; F487-F595 HydrophobicContact CB-CG 4.31Å; F487-F595 AromaticContact CD1-CD1 3.87Å; F487-F595 HydrophobicContact CD1-CD1 3.87Å; F487-F595 HydrophobicContact CD1-CD2 4.27Å; F487-F595 HydrophobicContact CD1-CE1 4.1Å; F487-F595 HydrophobicContact CD1-CE2 4.49Å; F487-F595 AromaticContact CD1-CG 3.96Å; F487-F595 HydrophobicContact CD1-CG 3.96Å; F487-F595 HydrophobicContact CD1-CZ 4.41Å; F487-F595 HydrophobicContact CD2-CB 3.69Å; F487-F595 HydrophobicContact CD2-CD1 4.47Å; F487-F595 HydrophobicContact CD2-CD2 4.07Å; F487-F595 AromaticContact CD2-CG 3.81Å; F487-F595 HydrophobicContact CD2-CG 3.81Å; F487-F595 AromaticContact CE1-CD1 3.92Å; F487-F595 HydrophobicContact CE1-CD1 3.92Å; F487-F595 HydrophobicContact CE1-CE1 4.41Å; F487-F595 HydrophobicContact CE1-CG 4.21Å; F487-F595 HydrophobicContact CE2-CB 3.63Å; F487-F595 HydrophobicContact CE2-CG 4.06Å; F487-F595 HydrophobicContact CG-CB 4.17Å; F487-F595 HydrophobicContact CG-CD1 4.15Å; F487-F595 AromaticContact CG-CD2 3.79Å; F487-F595 HydrophobicContact CG-CD2 3.79Å; F487-F595 HydrophobicContact CG-CE2 4.23Å; F487-F595 AromaticContact CG-CG 3.75Å; F487-F595 HydrophobicContact CG-CG 3.75Å; F487-F595 HydrophobicContact CZ-CB 4.07Å; F487-F595 HydrophobicContact CZ-CD1 4.23Å; F487-F595 HydrophobicContact CZ-CG 4.25Å
488	S	94.3	Very high	93.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.097	C	C	.	.	I	π-helix	trans	-73.7	-36.9	-174.4	63.3	0	0	0	0	113.8	L484 Q485 R515 C519	L484-S488 WeakPolarHBondContact O-CB 3.27Å; L484-S488 PolarHBondContact O-N 3.48Å; L484-S488 PolarHBondContact O-OG 2.58Å; Q485-S488 PolarHBondContact O-N 3.24Å; Q485-S488 PolarHBondContact O-OG 2.92Å; S488-R515 WeakPolarHBondContact O-CG 3.26Å; S488-C519 PolarHBondContact OG-SG 2.89Å; S488-C519 VanDerWaalsContact OG-SG 3.39Å
489	Q	93	Very high	93.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.098	C	C	.	.	I	π-helix	trans	-87.1	-35.7	-176.3	-61.8	-170.2	29.4	0	0	112.9	Q485 R493 C519 D520 W521 V547	Q485-Q489 WeakPolarHBondContact O-CB 3.45Å; Q485-Q489 WeakPolarHBondContact O-CG 3.36Å; Q485-Q489 PolarHBondContact O-N 3.44Å; Q489-R493 VanDerWaalsContact O-CG 3.28Å; Q489-R493 WeakPolarHBondContact O-CG 3.38Å; Q489-C519 HydrophobicContact CG-CB 4.13Å; Q489-D520 VanDerWaalsContact NE2-C 3.35Å; Q489-D520 PolarHBondContact NE2-O 2.99Å; Q489-W521 HydrophobicContact CB-CE3 4.48Å; Q489-W521 HydrophobicContact CB-CH2 3.81Å; Q489-W521 HydrophobicContact CB-CZ3 3.65Å; Q489-W521 HydrophobicContact CG-CE3 4.03Å; Q489-W521 HydrophobicContact CG-CH2 3.72Å; Q489-W521 HydrophobicContact CG-CZ2 4.31Å; Q489-W521 HydrophobicContact CG-CZ3 3.59Å; Q489-V547 HydrophobicContact CB-CG2 4.32Å
490	V	94.3	Very high	93.4	Very high	60 Å²	60	19.1 Å²	19.1	36%	0.364	10%	0.104	S	C	.	.	I	π-helix	trans	-111.2	-57.8	-172.8	-174.3	0	0	0	0	111.6	D486 L492 R493 I545 V547	D486-V490 WeakPolarHBondContact O-CA 3.24Å; D486-V490 WeakPolarHBondContact O-CB 3.2Å; D486-V490 PolarHBondContact O-N 2.9Å; V490-L492 PolarHBondContact O-N 2.85Å; V490-R493 VanDerWaalsContact O-CB 3.25Å; V490-R493 WeakPolarHBondContact O-CB 3.2Å; V490-R493 VanDerWaalsContact O-CG 3.27Å; V490-R493 WeakPolarHBondContact O-CG 3.39Å; V490-R493 PolarHBondContact O-N 2.83Å; V490-R493 VanDerWaalsContact O-N 3.09Å; V490-I545 HydrophobicContact CG2-CB 4.45Å; V490-V547 HydrophobicContact CG2-CG2 3.67Å
491	T	94.5	Very high	93.2	Very high	51 Å²	51	25.4 Å²	25.4	31%	0.313	13%	0.131	S	C	.	.	I	π-helix	trans	-62.2	-40.6	-174.3	-50.1	0	0	0	0	112.4	D486 F487 R493 P495 D591	D486-T491 PolarHBondContact O-N 3.43Å; D486-T491 PolarHBondContact O-OG1 3.45Å; F487-T491 HydrophobicContact CD2-CG2 3.95Å; F487-T491 HydrophobicContact CE2-CG2 4.14Å; F487-T491 WeakPolarHBondContact O-CB 3.48Å; F487-T491 PolarHBondContact O-N 2.91Å; T491-R493 PolarHBondContact O-N 3.42Å; T491-P495 WeakPolarHBondContact O-CD 3.08Å; T491-D591 HydrophobicContact CG2-CB 3.98Å
492	L	94.5	Very high	93	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-5.4	178.9	-69.1	-171.4	0	0	0	114.7	F487 V490 P495 L496 L511 I514	F487-L492 HydrophobicContact CD1-CD1 4.31Å; F487-L492 HydrophobicContact CD1-CG 4.18Å; F487-L492 HydrophobicContact CE1-CD1 3.91Å; F487-L492 HydrophobicContact CE1-CD2 3.75Å; F487-L492 HydrophobicContact CE1-CG 3.82Å; F487-L492 HydrophobicContact CE2-CD2 4.29Å; F487-L492 HydrophobicContact CZ-CD2 3.62Å; F487-L492 HydrophobicContact CZ-CG 4.16Å; F487-L492 WeakPolarHBondContact O-CG 3.29Å; F487-L492 PolarHBondContact O-N 3.23Å; V490-L492 PolarHBondContact O-N 2.85Å; L492-P495 HydrophobicContact CD2-CG 4.36Å; L492-L496 WeakPolarHBondContact O-CB 3.48Å; L492-L496 PolarHBondContact O-N 2.99Å; L492-L496 VanDerWaalsContact O-N 3.1Å; L492-L511 HydrophobicContact CD1-CD2 4.31Å; L492-L511 HydrophobicContact CD2-CD2 3.86Å; L492-I514 HydrophobicContact CD1-CB 4.33Å; L492-I514 HydrophobicContact CD1-CG2 3.73Å
493	R	93.9	Very high	92.8	Very high	22 Å²	22	37.3 Å²	37.3	8%	0.083	18%	0.182	C	C	.	.	H	α-helix	trans	-60.8	-47.2	175.9	-68	176.7	68	-122.1	-6.6	112	Q489 V490 T491 L496 R497 D530 A532 D538	Q489-R493 VanDerWaalsContact O-CG 3.28Å; Q489-R493 WeakPolarHBondContact O-CG 3.38Å; V490-R493 VanDerWaalsContact O-CB 3.25Å; V490-R493 WeakPolarHBondContact O-CB 3.2Å; V490-R493 VanDerWaalsContact O-CG 3.27Å; V490-R493 WeakPolarHBondContact O-CG 3.39Å; V490-R493 PolarHBondContact O-N 2.83Å; V490-R493 VanDerWaalsContact O-N 3.09Å; T491-R493 PolarHBondContact O-N 3.42Å; R493-L496 PolarHBondContact O-N 2.7Å; R493-R497 VanDerWaalsContact O-CB 3.31Å; R493-R497 WeakPolarHBondContact O-CB 3.45Å; R493-R497 PolarHBondContact O-N 3Å; R493-D530 IonicContact CZ-OD1 3.68Å; R493-D530 IonicContact NE-OD1 2.65Å; R493-D530 PolarHBondContact NE-OD1 3.09Å; R493-D530 IonicContact NE-OD2 3.67Å; R493-D530 IonicContact NH2-OD1 3.69Å; R493-D530 PolarHBondContact NH2-OD1 3.21Å; R493-A532 HydrophobicContact CB-CB 4.22Å; R493-D538 IonicContact CZ-OD1 2.69Å; R493-D538 IonicContact CZ-OD2 3.72Å; R493-D538 IonicContact NH1-OD1 2.69Å; R493-D538 IonicContact NH1-OD2 2.75Å; R493-D538 PolarHBondContact NH1-OD2 2.74Å; R493-D538 IonicContact NH2-OD1 3.68Å; R493-D538 PolarHBondContact NH2-OD1 2.81Å; R493-D538 IonicContact NH2-OD2 3.58Å; R493-D538 PolarHBondContact NH2-OD2 3.39Å
494	E	91.8	Very high	92.4	Very high	76 Å²	76	39.2 Å²	39.2	36%	0.355	19%	0.185	S	C	.	.	H	α-helix	trans	-68.4	-48.5	-176.2	179.1	59.3	-157.7	0	0	112.6	L496 R497 Q498 T588	E494-L496 VanDerWaalsContact C-N 3.27Å; E494-L496 PolarHBondContact O-N 3.15Å; E494-R497 PolarHBondContact O-N 3.42Å; E494-R497 IonicContact OE1-CZ 3.62Å; E494-R497 IonicContact OE1-NE 2.76Å; E494-R497 IonicContact OE1-NH2 3.78Å; E494-R497 PolarHBondContact OE1-NH2 3.4Å; E494-R497 IonicContact OE2-CZ 3.32Å; E494-R497 IonicContact OE2-NE 3.89Å; E494-R497 PolarHBondContact OE2-NE 2.8Å; E494-R497 IonicContact OE2-NH2 3.1Å; E494-R497 PolarHBondContact OE2-NH2 3.44Å; E494-Q498 WeakPolarHBondContact O-CG 3.03Å; E494-Q498 PolarHBondContact O-N 2.9Å; E494-Q498 PolarHBondContact OE1-NE2 3.32Å; E494-T588 HydrophobicContact CG-CG2 4.49Å
495	P	92.3	Very high	92	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.032	21%	0.212	C	C	.	.	H	α-helix	trans	-55.4	-40.8	171.4	-21.1	27.5	0	0	0	112.8	T491 L492 Q498 A499 L511 T588	T491-P495 WeakPolarHBondContact O-CD 3.08Å; L492-P495 HydrophobicContact CD2-CG 4.36Å; P495-Q498 PolarHBondContact O-N 2.84Å; P495-A499 WeakPolarHBondContact O-CB 3.16Å; P495-A499 PolarHBondContact O-N 3.27Å; P495-L511 HydrophobicContact CB-CD1 3.74Å; P495-L511 HydrophobicContact CB-CD2 4.47Å; P495-T588 HydrophobicContact CB-CG2 4.39Å; P495-T588 HydrophobicContact CG-CG2 3.72Å
496	L	91.9	Very high	91.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-69.1	-44.3	179.8	-178.8	64.8	0	0	0	112	L492 R493 E494 Q498 A499 I500 Q508 L511 Q512	L492-L496 WeakPolarHBondContact O-CB 3.48Å; L492-L496 PolarHBondContact O-N 2.99Å; L492-L496 VanDerWaalsContact O-N 3.1Å; R493-L496 PolarHBondContact O-N 2.7Å; E494-L496 VanDerWaalsContact C-N 3.27Å; E494-L496 PolarHBondContact O-N 3.15Å; L496-Q498 VanDerWaalsContact C-N 3.28Å; L496-Q498 PolarHBondContact O-N 3.11Å; L496-A499 WeakPolarHBondContact O-CB 3.45Å; L496-A499 PolarHBondContact O-N 3.35Å; L496-A499 VanDerWaalsContact O-N 3.12Å; L496-I500 HydrophobicContact CD1-CD1 4.16Å; L496-I500 HydrophobicContact CD1-CG1 4.41Å; L496-I500 HydrophobicContact CG-CD1 3.97Å; L496-I500 WeakPolarHBondContact O-CG1 3.12Å; L496-I500 PolarHBondContact O-N 3.1Å; L496-Q508 HydrophobicContact CD1-CB 4.43Å; L496-Q508 HydrophobicContact CD1-CG 3.85Å; L496-L511 HydrophobicContact CB-CD1 4.19Å; L496-L511 HydrophobicContact CD1-CB 4.07Å; L496-L511 HydrophobicContact CD1-CD1 4.49Å; L496-Q512 HydrophobicContact CD1-CG 3.88Å; L496-Q512 HydrophobicContact CD2-CG 4.44Å
497	R	93.4	Very high	91.1	Very high	15 Å²	15	45.9 Å²	45.9	6%	0.057	22%	0.224	C	C	.	.	H	α-helix	trans	-54.9	-46.8	174.7	-174.2	-172.3	73.8	73.1	2.5	110.9	R493 E494 I500 K501 A532 E536	R493-R497 VanDerWaalsContact O-CB 3.31Å; R493-R497 WeakPolarHBondContact O-CB 3.45Å; R493-R497 PolarHBondContact O-N 3Å; E494-R497 PolarHBondContact O-N 3.42Å; E494-R497 IonicContact OE1-CZ 3.62Å; E494-R497 IonicContact OE1-NE 2.76Å; E494-R497 IonicContact OE1-NH2 3.78Å; E494-R497 PolarHBondContact OE1-NH2 3.4Å; E494-R497 IonicContact OE2-CZ 3.32Å; E494-R497 IonicContact OE2-NE 3.89Å; E494-R497 PolarHBondContact OE2-NE 2.8Å; E494-R497 IonicContact OE2-NH2 3.1Å; E494-R497 PolarHBondContact OE2-NH2 3.44Å; R497-I500 PolarHBondContact O-N 3.05Å; R497-K501 VanDerWaalsContact O-CB 3.22Å; R497-K501 WeakPolarHBondContact O-CB 3.33Å; R497-K501 PolarHBondContact O-N 3.04Å; R497-A532 WeakPolarHBondContact CA-O 3.38Å; R497-A532 HydrophobicContact CB-CB 3.79Å; R497-A532 HydrophobicContact CG-CB 4.16Å; R497-E536 WeakPolarHBondContact CD-O 3.27Å
498	Q	88.9	Confident	90.8	Very high	16 Å²	16	47.5 Å²	47.5	8%	0.075	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-39.6	178.3	-67.7	-164.7	20.4	0	0	112.1	E494 P495 L496 K501 K502 E585	E494-Q498 WeakPolarHBondContact O-CG 3.03Å; E494-Q498 PolarHBondContact O-N 2.9Å; E494-Q498 PolarHBondContact OE1-NE2 3.32Å; P495-Q498 PolarHBondContact O-N 2.84Å; L496-Q498 VanDerWaalsContact C-N 3.28Å; L496-Q498 PolarHBondContact O-N 3.11Å; Q498-K501 PolarHBondContact O-N 3.1Å; Q498-K502 VanDerWaalsContact O-CB 3.24Å; Q498-K502 WeakPolarHBondContact O-CB 3.37Å; Q498-K502 WeakPolarHBondContact O-CG 3.16Å; Q498-K502 PolarHBondContact O-N 3.35Å; Q498-K502 VanDerWaalsContact OE1-NZ 3.08Å; Q498-E585 VanDerWaalsContact NE2-CD 3.32Å; Q498-E585 PolarHBondContact NE2-OE2 3.32Å; Q498-E585 VanDerWaalsContact OE1-CG 3.25Å; Q498-E585 PolarHBondContact OE1-OE1 3.48Å
499	A	90.3	Very high	90.5	Very high	4 Å²	4	49.6 Å²	49.6	3%	0.033	25%	0.247	C	C	.	.	H	α-helix	trans	-61	-44.5	176.2	0	0	0	0	0	111.4	P495 L496 K503 K504 I507 Q508	P495-A499 WeakPolarHBondContact O-CB 3.16Å; P495-A499 PolarHBondContact O-N 3.27Å; L496-A499 WeakPolarHBondContact O-CB 3.45Å; L496-A499 PolarHBondContact O-N 3.35Å; L496-A499 VanDerWaalsContact O-N 3.12Å; A499-K503 CarbonylContact O-C 3.53Å; A499-K503 PolarHBondContact O-N 3.02Å; A499-K503 VanDerWaalsContact O-N 3.08Å; A499-K504 HydrophobicContact CB-CB 4.15Å; A499-K504 PolarHBondContact O-N 3.07Å; A499-I507 HydrophobicContact CB-CB 4.24Å; A499-I507 HydrophobicContact CB-CG2 3.97Å; A499-Q508 HydrophobicContact CB-CB 4.05Å
500	I	90.6	Very high	90.3	Very high	34 Å²	34	49.8 Å²	49.8	17%	0.174	25%	0.248	C	C	.	.	H	α-helix	trans	-66.1	-51	177	-65.2	169.5	0	0	0	110.5	L496 R497 K502 K503 Q508 L533	L496-I500 HydrophobicContact CD1-CD1 4.16Å; L496-I500 HydrophobicContact CD1-CG1 4.41Å; L496-I500 HydrophobicContact CG-CD1 3.97Å; L496-I500 WeakPolarHBondContact O-CG1 3.12Å; L496-I500 PolarHBondContact O-N 3.1Å; R497-I500 PolarHBondContact O-N 3.05Å; I500-K502 VanDerWaalsContact C-N 3.34Å; I500-K502 PolarHBondContact O-N 2.89Å; I500-K503 PolarHBondContact O-N 3.24Å; I500-K503 VanDerWaalsContact O-N 3.13Å; I500-Q508 HydrophobicContact CG1-CG 3.98Å; I500-L533 WeakPolarHBondContact CD1-O 3.34Å
501	K	90.9	Very high	90.1	Very high	133 Å²	133	46.9 Å²	46.9	58%	0.578	23%	0.23	S	C	*	.	H	α-helix	trans	-58.2	-43.1	-179.9	-179.1	178.4	177.4	179	0	112.8	R497 Q498 K503	R497-K501 VanDerWaalsContact O-CB 3.22Å; R497-K501 WeakPolarHBondContact O-CB 3.33Å; R497-K501 PolarHBondContact O-N 3.04Å; Q498-K501 PolarHBondContact O-N 3.1Å; K501-K503 VanDerWaalsContact C-N 3.33Å
502	K	88.6	Confident	89.8	Confident	94 Å²	94	47.3 Å²	47.3	41%	0.409	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	9	-178.1	-61.1	173.8	-178.4	164.8	0	112.5	Q498 I500 K504 E585	Q498-K502 VanDerWaalsContact O-CB 3.24Å; Q498-K502 WeakPolarHBondContact O-CB 3.37Å; Q498-K502 WeakPolarHBondContact O-CG 3.16Å; Q498-K502 PolarHBondContact O-N 3.35Å; Q498-K502 VanDerWaalsContact OE1-NZ 3.08Å; I500-K502 VanDerWaalsContact C-N 3.34Å; I500-K502 PolarHBondContact O-N 2.89Å; K502-K504 VanDerWaalsContact C-N 3.32Å; K502-K504 HydrophobicContact CB-CG 4.07Å; K502-K504 PolarHBondContact O-N 3.42Å; K502-E585 IonicContact NZ-OE1 3.2Å; K502-E585 PolarHBondContact NZ-OE1 3.49Å
503	K	88.8	Confident	89.5	Confident	175 Å²	175	47.5 Å²	47.5	76%	0.761	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	41.6	-179	-59.2	-174.3	178.8	-176.3	0	114.1	A499 I500 K501 N505	A499-K503 CarbonylContact O-C 3.53Å; A499-K503 PolarHBondContact O-N 3.02Å; A499-K503 VanDerWaalsContact O-N 3.08Å; I500-K503 PolarHBondContact O-N 3.24Å; I500-K503 VanDerWaalsContact O-N 3.13Å; K501-K503 VanDerWaalsContact C-N 3.33Å; K503-N505 VanDerWaalsContact C-N 3.35Å; K503-N505 PolarHBondContact O-N 2.69Å
504	K	87.6	Confident	89.3	Confident	65 Å²	65	46.4 Å²	46.4	28%	0.283	23%	0.226	S	C	.	.			trans	-88.6	68.5	176.6	-57.7	-64.2	-172.8	163.3	0	110.6	A499 K502 V506 I507 Q508 S583	A499-K504 HydrophobicContact CB-CB 4.15Å; A499-K504 PolarHBondContact O-N 3.07Å; K502-K504 VanDerWaalsContact C-N 3.32Å; K502-K504 HydrophobicContact CB-CG 4.07Å; K502-K504 PolarHBondContact O-N 3.42Å; K504-V506 PolarHBondContact O-N 2.8Å; K504-V506 VanDerWaalsContact O-N 3.13Å; K504-I507 HydrophobicContact CB-CB 4.19Å; K504-I507 HydrophobicContact CB-CD1 4.13Å; K504-I507 HydrophobicContact CB-CG1 4.48Å; K504-I507 HydrophobicContact CG-CD1 4.43Å; K504-I507 PolarHBondContact O-N 3.41Å; K504-I507 VanDerWaalsContact O-N 3.11Å; K504-Q508 PolarHBondContact O-N 2.53Å; K504-S583 PolarHBondContact NZ-OG 2.75Å; K504-S583 VanDerWaalsContact NZ-OG 3.12Å
505	N	85.8	Confident	89.3	Confident	109 Å²	109	43 Å²	43	58%	0.583	21%	0.21	S	C	*	.	H	α-helix	trans	-55.2	-35.1	-172.5	-60.1	-22	0	0	0	113.9	K503 S509	K503-N505 VanDerWaalsContact C-N 3.35Å; K503-N505 PolarHBondContact O-N 2.69Å; N505-S509 WeakPolarHBondContact O-CB 3.13Å; N505-S509 PolarHBondContact O-N 2.91Å; N505-S509 PolarHBondContact O-OG 3.37Å
506	V	85.1	Confident	89.1	Confident	89 Å²	89	47.5 Å²	47.5	54%	0.539	23%	0.229	S	C	.	.	H	α-helix	trans	-67	-49.7	177.9	-178.5	0	0	0	0	111.2	K504 Q508 S509 V510 L580	K504-V506 PolarHBondContact O-N 2.8Å; K504-V506 VanDerWaalsContact O-N 3.13Å; V506-Q508 VanDerWaalsContact C-N 3.33Å; V506-Q508 PolarHBondContact O-N 2.82Å; V506-S509 PolarHBondContact O-N 2.87Å; V506-S509 PolarHBondContact O-OG 2.84Å; V506-V510 WeakPolarHBondContact O-CG2 3.41Å; V506-V510 PolarHBondContact O-N 3.09Å; V506-L580 HydrophobicContact CB-CD2 4.34Å; V506-L580 HydrophobicContact CG1-CD2 3.78Å
507	I	86.9	Confident	88.9	Confident	5 Å²	5	48 Å²	48	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-62.1	-44.5	177	-65.5	168.3	0	0	0	109.9	A499 K504 S509 V510 L511 L569 L580 L584	A499-I507 HydrophobicContact CB-CB 4.24Å; A499-I507 HydrophobicContact CB-CG2 3.97Å; K504-I507 HydrophobicContact CB-CB 4.19Å; K504-I507 HydrophobicContact CB-CD1 4.13Å; K504-I507 HydrophobicContact CB-CG1 4.48Å; K504-I507 HydrophobicContact CG-CD1 4.43Å; K504-I507 PolarHBondContact O-N 3.41Å; K504-I507 VanDerWaalsContact O-N 3.11Å; I507-S509 VanDerWaalsContact C-N 3.3Å; I507-S509 PolarHBondContact O-N 2.98Å; I507-V510 PolarHBondContact O-N 3.26Å; I507-L511 HydrophobicContact CG2-CD1 3.62Å; I507-L511 HydrophobicContact CG2-CG 4.03Å; I507-L511 WeakPolarHBondContact O-CB 3.16Å; I507-L511 VanDerWaalsContact O-CG 3.32Å; I507-L511 WeakPolarHBondContact O-CG 3.36Å; I507-L511 PolarHBondContact O-N 2.72Å; I507-L569 HydrophobicContact CG1-CD2 4.33Å; I507-L569 HydrophobicContact CG2-CD2 4.21Å; I507-L580 HydrophobicContact CG1-CD2 4.16Å; I507-L584 HydrophobicContact CD1-CD2 4.25Å; I507-L584 HydrophobicContact CD1-CG 4.33Å; I507-L584 HydrophobicContact CG2-CD2 3.92Å
508	Q	88.8	Confident	88.7	Confident	44 Å²	44	47.7 Å²	47.7	21%	0.206	23%	0.232	C	C	.	.	H	α-helix	trans	-55.7	-45.8	175.7	-179.5	-174.6	-9.2	0	0	111.4	L496 A499 I500 K504 V506 V510 L511 Q512	L496-Q508 HydrophobicContact CD1-CB 4.43Å; L496-Q508 HydrophobicContact CD1-CG 3.85Å; A499-Q508 HydrophobicContact CB-CB 4.05Å; I500-Q508 HydrophobicContact CG1-CG 3.98Å; K504-Q508 PolarHBondContact O-N 2.53Å; V506-Q508 VanDerWaalsContact C-N 3.33Å; V506-Q508 PolarHBondContact O-N 2.82Å; Q508-V510 PolarHBondContact O-N 3.39Å; Q508-L511 PolarHBondContact O-N 2.84Å; Q508-Q512 HydrophobicContact CG-CG 4.38Å; Q508-Q512 VanDerWaalsContact O-CB 3.31Å; Q508-Q512 WeakPolarHBondContact O-CB 3.5Å; Q508-Q512 VanDerWaalsContact O-CG 3.32Å; Q508-Q512 WeakPolarHBondContact O-CG 3.3Å; Q508-Q512 PolarHBondContact O-N 2.79Å
509	S	87.9	Confident	88.9	Confident	44 Å²	44	47.9 Å²	47.9	31%	0.308	24%	0.235	S	C	.	.	H	α-helix	trans	-63.1	-38.9	-178.5	71.7	0	0	0	0	113.1	N505 V506 I507 A513	N505-S509 WeakPolarHBondContact O-CB 3.13Å; N505-S509 PolarHBondContact O-N 2.91Å; N505-S509 PolarHBondContact O-OG 3.37Å; V506-S509 PolarHBondContact O-N 2.87Å; V506-S509 PolarHBondContact O-OG 2.84Å; I507-S509 VanDerWaalsContact C-N 3.3Å; I507-S509 PolarHBondContact O-N 2.98Å; S509-A513 VanDerWaalsContact O-CB 3.25Å; S509-A513 WeakPolarHBondContact O-CB 3.47Å; S509-A513 PolarHBondContact O-N 3.39Å
510	V	88.6	Confident	89	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.018	25%	0.247	C	C	.	.	H	α-helix	trans	-72.3	-47.2	177.7	178.6	0	0	0	0	110.9	I56 V506 I507 Q508 Q512 A513 I514 M565 L569	I56-V510 HydrophobicContact CD1-CG2 3.67Å; V506-V510 WeakPolarHBondContact O-CG2 3.41Å; V506-V510 PolarHBondContact O-N 3.09Å; I507-V510 PolarHBondContact O-N 3.26Å; Q508-V510 PolarHBondContact O-N 3.39Å; V510-Q512 VanDerWaalsContact C-N 3.33Å; V510-Q512 PolarHBondContact O-N 2.9Å; V510-A513 WeakPolarHBondContact O-CA 3.26Å; V510-A513 WeakPolarHBondContact O-CB 3.49Å; V510-A513 PolarHBondContact O-N 3.03Å; V510-I514 HydrophobicContact CG1-CD1 4.22Å; V510-I514 WeakPolarHBondContact O-CG1 3.09Å; V510-I514 PolarHBondContact O-N 3.3Å; V510-M565 HydrophobicContact CG1-CB 3.89Å; V510-M565 HydrophobicContact CG1-CG 4.37Å; V510-L569 HydrophobicContact CB-CD2 4.2Å; V510-L569 HydrophobicContact CG1-CD1 4.07Å; V510-L569 HydrophobicContact CG1-CD2 4.09Å; V510-L569 HydrophobicContact CG1-CG 3.99Å
511	L	90.7	Very high	88.9	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.4	-42	177.8	-71.7	178.1	0	0	0	111.9	L492 P495 L496 I507 Q508 R515 L569	L492-L511 HydrophobicContact CD1-CD2 4.31Å; L492-L511 HydrophobicContact CD2-CD2 3.86Å; P495-L511 HydrophobicContact CB-CD1 3.74Å; P495-L511 HydrophobicContact CB-CD2 4.47Å; L496-L511 HydrophobicContact CB-CD1 4.19Å; L496-L511 HydrophobicContact CD1-CB 4.07Å; L496-L511 HydrophobicContact CD1-CD1 4.49Å; I507-L511 HydrophobicContact CG2-CD1 3.62Å; I507-L511 HydrophobicContact CG2-CG 4.03Å; I507-L511 WeakPolarHBondContact O-CB 3.16Å; I507-L511 VanDerWaalsContact O-CG 3.32Å; I507-L511 WeakPolarHBondContact O-CG 3.36Å; I507-L511 PolarHBondContact O-N 2.72Å; Q508-L511 PolarHBondContact O-N 2.84Å; L511-R515 WeakPolarHBondContact O-CG 3.35Å; L511-R515 PolarHBondContact O-N 3.2Å; L511-L569 HydrophobicContact CD2-CD1 3.66Å; L511-L569 HydrophobicContact CG-CD1 4.26Å
512	Q	88.9	Confident	88.8	Confident	60 Å²	60	48.8 Å²	48.8	28%	0.28	24%	0.24	S	C	.	.	H	α-helix	trans	-63.1	-46.2	171.6	-74.2	-178.7	-7.9	0	0	110.1	L496 Q508 V510 I514 R515 K516	L496-Q512 HydrophobicContact CD1-CG 3.88Å; L496-Q512 HydrophobicContact CD2-CG 4.44Å; Q508-Q512 HydrophobicContact CG-CG 4.38Å; Q508-Q512 VanDerWaalsContact O-CB 3.31Å; Q508-Q512 WeakPolarHBondContact O-CB 3.5Å; Q508-Q512 VanDerWaalsContact O-CG 3.32Å; Q508-Q512 WeakPolarHBondContact O-CG 3.3Å; Q508-Q512 PolarHBondContact O-N 2.79Å; V510-Q512 VanDerWaalsContact C-N 3.33Å; V510-Q512 PolarHBondContact O-N 2.9Å; Q512-I514 VanDerWaalsContact C-N 3.26Å; Q512-I514 PolarHBondContact O-N 3.05Å; Q512-R515 PolarHBondContact O-N 3.05Å; Q512-K516 VanDerWaalsContact C-CE 3.41Å; Q512-K516 WeakPolarHBondContact O-CE 3.33Å; Q512-K516 WeakPolarHBondContact O-CG 3.09Å; Q512-K516 PolarHBondContact O-N 2.85Å
513	A	87.8	Confident	88.7	Confident	4 Å²	4	49.6 Å²	49.6	3%	0.033	25%	0.253	C	S	.	.	H	α-helix	trans	-54.6	-41.2	179.7	0	0	0	0	0	112.7	S509 V510 K516 T517 M565	S509-A513 VanDerWaalsContact O-CB 3.25Å; S509-A513 WeakPolarHBondContact O-CB 3.47Å; S509-A513 PolarHBondContact O-N 3.39Å; V510-A513 WeakPolarHBondContact O-CA 3.26Å; V510-A513 WeakPolarHBondContact O-CB 3.49Å; V510-A513 PolarHBondContact O-N 3.03Å; A513-K516 VanDerWaalsContact N-CE 3.32Å; A513-T517 WeakPolarHBondContact O-CB 3.29Å; A513-T517 PolarHBondContact O-N 3.04Å; A513-T517 PolarHBondContact O-OG1 3.43Å; A513-M565 HydrophobicContact CB-CE 4.41Å; A513-M565 HydrophobicContact CB-SD 3.66Å
514	I	90.8	Very high	88.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.4	-54.2	172.1	-67.7	160	0	0	0	110.3	L492 V510 Q512 K516 T517 V518 V562 M565 L566 L569	L492-I514 HydrophobicContact CD1-CB 4.33Å; L492-I514 HydrophobicContact CD1-CG2 3.73Å; V510-I514 HydrophobicContact CG1-CD1 4.22Å; V510-I514 WeakPolarHBondContact O-CG1 3.09Å; V510-I514 PolarHBondContact O-N 3.3Å; Q512-I514 VanDerWaalsContact C-N 3.26Å; Q512-I514 PolarHBondContact O-N 3.05Å; I514-K516 PolarHBondContact O-N 3.35Å; I514-T517 WeakPolarHBondContact O-CB 3.23Å; I514-T517 PolarHBondContact O-N 3.23Å; I514-V518 WeakPolarHBondContact O-CG2 3.06Å; I514-V518 PolarHBondContact O-N 2.82Å; I514-V562 HydrophobicContact CG2-CG1 4.17Å; I514-V562 HydrophobicContact CG2-CG2 4.18Å; I514-M565 HydrophobicContact CB-CE 4.49Å; I514-M565 HydrophobicContact CD1-CB 3.91Å; I514-M565 HydrophobicContact CG1-CB 3.78Å; I514-M565 HydrophobicContact CG1-CE 3.72Å; I514-M565 HydrophobicContact CG1-SD 4.11Å; I514-L566 HydrophobicContact CD1-CD2 3.54Å; I514-L566 HydrophobicContact CD1-CG 3.82Å; I514-L569 HydrophobicContact CD1-CD1 4.47Å
515	R	91.5	Very high	88.1	Confident	5 Å²	5	47.1 Å²	47.1	2%	0.019	26%	0.259	C	S	.	.	H	α-helix	trans	-57	-46.2	-178.2	-68.5	-178.8	69.6	-173.1	-3.6	113.1	S488 L511 Q512 T517 V518 C519 E526	S488-R515 WeakPolarHBondContact O-CG 3.26Å; L511-R515 WeakPolarHBondContact O-CG 3.35Å; L511-R515 PolarHBondContact O-N 3.2Å; Q512-R515 PolarHBondContact O-N 3.05Å; R515-T517 VanDerWaalsContact C-N 3.26Å; R515-T517 PolarHBondContact O-N 2.89Å; R515-V518 PolarHBondContact O-N 2.98Å; R515-C519 WeakPolarHBondContact O-CB 3.44Å; R515-C519 PolarHBondContact O-N 3.37Å; R515-C519 PolarHBondContact O-SG 3.27Å; R515-E526 IonicContact CZ-OE1 3.33Å; R515-E526 VanDerWaalsContact CZ-OE1 3.26Å; R515-E526 IonicContact NE-OE1 3.73Å; R515-E526 IonicContact NH1-OE1 3.61Å; R515-E526 IonicContact NH2-OE1 3.8Å; R515-E526 PolarHBondContact NH2-OE1 2.81Å; R515-E526 VanDerWaalsContact NH2-OE1 3.07Å
516	K	86.8	Confident	88.2	Confident	99 Å²	99	44.8 Å²	44.8	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-65.6	-25.2	177	12.8	162.1	163.5	150.5	0	113.8	T54 Q512 A513 I514	T54-K516 HydrophobicContact CG2-CD 4.16Å; T54-K516 PolarHBondContact O-NZ 3.1Å; T54-K516 VanDerWaalsContact OG1-CD 3.27Å; T54-K516 WeakPolarHBondContact OG1-CD 3.16Å; Q512-K516 VanDerWaalsContact C-CE 3.41Å; Q512-K516 WeakPolarHBondContact O-CE 3.33Å; Q512-K516 WeakPolarHBondContact O-CG 3.09Å; Q512-K516 PolarHBondContact O-N 2.85Å; A513-K516 VanDerWaalsContact N-CE 3.32Å; I514-K516 PolarHBondContact O-N 3.35Å
517	T	87.5	Confident	88.4	Confident	10 Å²	10	41.7 Å²	41.7	6%	0.061	23%	0.227	C	C	.	.	H	α-helix	trans	-78.2	-34.1	-178.2	-56.6	0	0	0	0	111.9	F52 A513 I514 R515 Q558	F52-T517 HydrophobicContact CD1-CG2 3.98Å; F52-T517 HydrophobicContact CG-CG2 4.38Å; A513-T517 WeakPolarHBondContact O-CB 3.29Å; A513-T517 PolarHBondContact O-N 3.04Å; A513-T517 PolarHBondContact O-OG1 3.43Å; I514-T517 WeakPolarHBondContact O-CB 3.23Å; I514-T517 PolarHBondContact O-N 3.23Å; R515-T517 VanDerWaalsContact C-N 3.26Å; R515-T517 PolarHBondContact O-N 2.89Å; T517-Q558 HydrophobicContact CG2-CG 4.19Å; T517-Q558 PolarHBondContact O-NE2 3.19Å; T517-Q558 VanDerWaalsContact O-NE2 3.12Å
518	V	90.9	Very high	88.4	Confident	8 Å²	8	49.2 Å²	49.2	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-131.1	-17.3	-168.5	-60.7	0	0	0	0	116.6	L484 Q485 I514 R515 D520 Q558 V562	L484-V518 HydrophobicContact CD1-CB 4.5Å; L484-V518 HydrophobicContact CD1-CG2 4.11Å; L484-V518 HydrophobicContact CD2-CB 4.14Å; L484-V518 HydrophobicContact CD2-CG1 4.29Å; L484-V518 HydrophobicContact CG-CB 4.39Å; L484-V518 HydrophobicContact CG-CG2 4.31Å; Q485-V518 PolarHBondContact NE2-O 3.45Å; Q485-V518 PolarHBondContact OE1-O 3.35Å; I514-V518 WeakPolarHBondContact O-CG2 3.06Å; I514-V518 PolarHBondContact O-N 2.82Å; R515-V518 PolarHBondContact O-N 2.98Å; V518-D520 PolarHBondContact O-N 3.38Å; V518-D520 VanDerWaalsContact O-N 3.11Å; V518-Q558 HydrophobicContact CG1-CB 3.87Å; V518-Q558 HydrophobicContact CG1-CG 4.09Å; V518-V562 HydrophobicContact CB-CG2 4.35Å; V518-V562 HydrophobicContact CG1-CG2 3.44Å; V518-V562 VanDerWaalsContact CG1-CG2 3.44Å; V518-V562 HydrophobicContact CG2-CG2 3.96Å
519	C	93.1	Very high	88.3	Confident	21 Å²	21	52.2 Å²	52.2	14%	0.142	28%	0.277	C	S	.	.			trans	-66.2	115	-178.2	-72.8	0	0	0	0	111.1	S488 Q489 R515 W521	S488-C519 PolarHBondContact OG-SG 2.89Å; S488-C519 VanDerWaalsContact OG-SG 3.39Å; Q489-C519 HydrophobicContact CG-CB 4.13Å; R515-C519 WeakPolarHBondContact O-CB 3.44Å; R515-C519 PolarHBondContact O-N 3.37Å; R515-C519 PolarHBondContact O-SG 3.27Å; C519-W521 HydrophobicContact CB-CD2 4.33Å; C519-W521 HydrophobicContact CB-CZ2 3.7Å
520	D	91.2	Very high	88.3	Confident	53 Å²	53	50.1 Å²	50.1	28%	0.283	26%	0.262	S	S	.	.			trans	-99.6	92.9	167.9	-177.7	28.7	0	0	0	108.6	Y481 Q489 V518 P548 R550	Y481-D520 WeakPolarHBondContact OH-CB 3.37Å; Y481-D520 PolarHBondContact OH-OD2 3.41Å; Q489-D520 VanDerWaalsContact NE2-C 3.35Å; Q489-D520 PolarHBondContact NE2-O 2.99Å; V518-D520 PolarHBondContact O-N 3.38Å; V518-D520 VanDerWaalsContact O-N 3.11Å; D520-P548 WeakPolarHBondContact O-CG 3.33Å; D520-R550 IonicContact OD2-CZ 3.09Å; D520-R550 IonicContact OD2-NE 3.82Å; D520-R550 PolarHBondContact OD2-NE 3.25Å; D520-R550 IonicContact OD2-NH2 2.7Å; D520-R550 PolarHBondContact OD2-NH2 3.11Å
521	W	89.5	Confident	88.3	Confident	28 Å²	28	50.3 Å²	50.3	11%	0.106	26%	0.264	C	S	.	.			trans	-72.5	134.9	-177.9	-58.2	102.3	0	0	0	110.5	Q489 C519 T523 G524 H525 E526 P527 I545	Q489-W521 HydrophobicContact CB-CE3 4.48Å; Q489-W521 HydrophobicContact CB-CH2 3.81Å; Q489-W521 HydrophobicContact CB-CZ3 3.65Å; Q489-W521 HydrophobicContact CG-CE3 4.03Å; Q489-W521 HydrophobicContact CG-CH2 3.72Å; Q489-W521 HydrophobicContact CG-CZ2 4.31Å; Q489-W521 HydrophobicContact CG-CZ3 3.59Å; C519-W521 HydrophobicContact CB-CD2 4.33Å; C519-W521 HydrophobicContact CB-CZ2 3.7Å; W521-T523 PolarHBondContact O-N 3.44Å; W521-T523 VanDerWaalsContact O-N 3.1Å; W521-G524 WeakPolarHBondContact O-CA 3.35Å; W521-G524 PolarHBondContact O-N 3.35Å; W521-H525 WeakPolarHBondContact CB-O 3.37Å; W521-E526 HydrophobicContact CZ2-CB 4.34Å; W521-E526 HydrophobicContact CZ2-CG 3.79Å; W521-P527 VanDerWaalsContact CE3-CD 3.49Å; W521-P527 HydrophobicContact CE3-CG 4.21Å; W521-P527 HydrophobicContact CH2-CG 4.46Å; W521-P527 HydrophobicContact CZ3-CG 3.98Å; W521-I545 HydrophobicContact CZ3-CD1 4.3Å; W521-I545 HydrophobicContact CZ3-CG2 4.12Å
522	E	88.4	Confident	88.2	Confident	109 Å²	109	50.4 Å²	50.4	51%	0.509	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-37.1	179.1	-178.3	71.5	-169.9	0	0	112.8	G524 P548	E522-G524 VanDerWaalsContact C-N 3.31Å; E522-P548 VanDerWaalsContact OE2-CB 3.29Å; E522-P548 WeakPolarHBondContact OE2-CB 3.42Å
523	T	85.6	Confident	88.3	Confident	110 Å²	110	49.8 Å²	49.8	68%	0.675	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	4.2	179.8	56.2	0	0	0	0	113.8	W521 H525	W521-T523 PolarHBondContact O-N 3.44Å; W521-T523 VanDerWaalsContact O-N 3.1Å; T523-H525 PolarHBondContact O-N 2.93Å; T523-H525 PolarHBondContact O-ND1 3.42Å; T523-H525 VanDerWaalsContact O-ND1 3.09Å; T523-H525 PolarHBondContact OG1-O 3.01Å
524	G	82.4	Confident	88.2	Confident	54 Å²	54	57.1 Å²	57.1	56%	0.557	29%	0.29	S	S	*	.	S	Bend	trans	73.9	-2.8	-175	0	0	0	0	0	115.3	W521 E522	W521-G524 WeakPolarHBondContact O-CA 3.35Å; W521-G524 PolarHBondContact O-N 3.35Å; E522-G524 VanDerWaalsContact C-N 3.31Å
525	H	81.7	Confident	88	Confident	134 Å²	134	57.6 Å²	57.6	62%	0.62	30%	0.295	S	S	*	.	S	Bend	trans	-141	149.3	-176.5	-52.8	84.8	0	0	0	111.3	W521 T523	W521-H525 WeakPolarHBondContact CB-O 3.37Å; T523-H525 PolarHBondContact O-N 2.93Å; T523-H525 PolarHBondContact O-ND1 3.42Å; T523-H525 VanDerWaalsContact O-ND1 3.09Å; T523-H525 PolarHBondContact OG1-O 3.01Å
526	E	89.1	Confident	87.9	Confident	60 Å²	60	62.7 Å²	62.7	28%	0.28	32%	0.319	S	S	.	.			trans	-64.4	138.2	177.7	-174.5	174.8	-151.5	0	0	111.4	R515 W521 F528	R515-E526 IonicContact CZ-OE1 3.33Å; R515-E526 VanDerWaalsContact CZ-OE1 3.26Å; R515-E526 IonicContact NE-OE1 3.73Å; R515-E526 IonicContact NH1-OE1 3.61Å; R515-E526 IonicContact NH2-OE1 3.8Å; R515-E526 PolarHBondContact NH2-OE1 2.81Å; R515-E526 VanDerWaalsContact NH2-OE1 3.07Å; W521-E526 HydrophobicContact CZ2-CB 4.34Å; W521-E526 HydrophobicContact CZ2-CG 3.79Å; E526-F528 VanDerWaalsContact O-CD2 3.26Å; E526-F528 WeakPolarHBondContact O-CD2 3.44Å; E526-F528 PolarHBondContact O-N 3.36Å
527	P	89.4	Confident	88	Confident	25 Å²	25	65.3 Å²	65.3	16%	0.162	33%	0.33	C	S	.	.			trans	-71.4	89.9	177.9	28.1	-34.8	0	0	0	111.5	W521 N529 D530 I545	W521-P527 VanDerWaalsContact CE3-CD 3.49Å; W521-P527 HydrophobicContact CE3-CG 4.21Å; W521-P527 HydrophobicContact CH2-CG 4.46Å; W521-P527 HydrophobicContact CZ3-CG 3.98Å; P527-N529 WeakPolarHBondContact CB-OD1 3.36Å; P527-N529 PolarHBondContact O-N 3.28Å; P527-D530 VanDerWaalsContact O-CB 3.29Å; P527-D530 WeakPolarHBondContact O-CB 3.21Å; P527-D530 PolarHBondContact O-N 2.94Å; P527-I545 HydrophobicContact CG-CD1 4.2Å
528	F	85.6	Confident	88	Confident	162 Å²	162	68 Å²	68	71%	0.711	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-14.5	178.2	-62.6	-71.4	0	0	0	114.2	E526 D530	E526-F528 VanDerWaalsContact O-CD2 3.26Å; E526-F528 WeakPolarHBondContact O-CD2 3.44Å; E526-F528 PolarHBondContact O-N 3.36Å; F528-D530 VanDerWaalsContact C-N 3.31Å
529	N	87.3	Confident	87.8	Confident	107 Å²	107	70.7 Å²	70.7	57%	0.572	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	0.2	175.6	63.2	-38.1	0	0	0	114.1	P527	P527-N529 WeakPolarHBondContact CB-OD1 3.36Å; P527-N529 PolarHBondContact O-N 3.28Å
530	D	88.6	Confident	86.8	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	40%	0.403	C	S	.	.			trans	-62.8	120.8	178	176.9	23.6	0	0	0	112.3	R493 P527 F528 A532 L533 F543	R493-D530 IonicContact CZ-OD1 3.68Å; R493-D530 IonicContact NE-OD1 2.65Å; R493-D530 PolarHBondContact NE-OD1 3.09Å; R493-D530 IonicContact NE-OD2 3.67Å; R493-D530 IonicContact NH2-OD1 3.69Å; R493-D530 PolarHBondContact NH2-OD1 3.21Å; P527-D530 VanDerWaalsContact O-CB 3.29Å; P527-D530 WeakPolarHBondContact O-CB 3.21Å; P527-D530 PolarHBondContact O-N 2.94Å; F528-D530 VanDerWaalsContact C-N 3.31Å; D530-A532 PolarHBondContact O-N 2.94Å; D530-A532 WeakPolarHBondContact OD1-CB 3.32Å; D530-A532 PolarHBondContact OD1-N 3.5Å; D530-A532 VanDerWaalsContact OD1-N 3.1Å; D530-L533 HydrophobicContact CB-CB 4.31Å; D530-L533 WeakPolarHBondContact O-CB 3.23Å; D530-L533 PolarHBondContact O-N 2.69Å; D530-F543 HydrophobicContact CB-CE1 4.01Å; D530-F543 HydrophobicContact CB-CZ 4.09Å
531	P	87.6	Confident	86	Confident	8 Å²	8	83.6 Å²	83.6	5%	0.052	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-61.5	-29.9	177.4	26	-35.4	0	0	0	112.7	L533 R534 G535 E536 D538 F543	P531-L533 VanDerWaalsContact C-N 3.27Å; P531-L533 PolarHBondContact O-N 3.46Å; P531-R534 PolarHBondContact O-N 3.28Å; P531-G535 PolarHBondContact O-N 3.1Å; P531-E536 CarbonylContact C-O 3.5Å; P531-E536 HydrophobicContact CB-CB 4.3Å; P531-E536 PolarHBondContact O-N 3.05Å; P531-D538 VanDerWaalsContact CG-OD1 3.31Å; P531-D538 WeakPolarHBondContact CG-OD1 3.17Å; P531-F543 HydrophobicContact CG-CB 4.32Å; P531-F543 HydrophobicContact CG-CD2 4.4Å; P531-F543 HydrophobicContact CG-CG 4.31Å
532	A	89.4	Confident	85.3	Confident	2 Å²	2	84.3 Å²	84.3	2%	0.017	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-63.7	-33.4	178.5	0	0	0	0	0	112.4	R493 R497 D530 R534 G535	R493-A532 HydrophobicContact CB-CB 4.22Å; R497-A532 WeakPolarHBondContact CA-O 3.38Å; R497-A532 HydrophobicContact CB-CB 3.79Å; R497-A532 HydrophobicContact CG-CB 4.16Å; D530-A532 PolarHBondContact O-N 2.94Å; D530-A532 WeakPolarHBondContact OD1-CB 3.32Å; D530-A532 PolarHBondContact OD1-N 3.5Å; D530-A532 VanDerWaalsContact OD1-N 3.1Å; A532-R534 PolarHBondContact O-N 3.45Å; A532-G535 PolarHBondContact O-N 2.91Å
533	L	89.8	Confident	85.3	Confident	46 Å²	46	81.3 Å²	81.3	24%	0.241	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-67.7	-19.4	175.5	-134.3	168.3	0	0	0	112.6	I500 D530 P531	I500-L533 WeakPolarHBondContact CD1-O 3.34Å; D530-L533 HydrophobicContact CB-CB 4.31Å; D530-L533 WeakPolarHBondContact O-CB 3.23Å; D530-L533 PolarHBondContact O-N 2.69Å; P531-L533 VanDerWaalsContact C-N 3.27Å; P531-L533 PolarHBondContact O-N 3.46Å
534	R	87.3	Confident	85.4	Confident	158 Å²	158	83.1 Å²	83.1	60%	0.596	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-97.4	-2.4	172.6	-63.1	-176.1	-70.3	-176.9	-0.3	113.4	P531 A532 E536	P531-R534 PolarHBondContact O-N 3.28Å; A532-R534 PolarHBondContact O-N 3.45Å; R534-E536 VanDerWaalsContact C-N 3.32Å
535	G	85.5	Confident	85.8	Confident	10 Å²	10	81.7 Å²	81.7	10%	0.103	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	82	5.8	-176.8	0	0	0	0	0	114.6	P531 A532	P531-G535 PolarHBondContact O-N 3.1Å; A532-G535 PolarHBondContact O-N 2.91Å
536	E	88.8	Confident	86.2	Confident	112 Å²	112	82.7 Å²	82.7	52%	0.523	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-92	153.9	-179.4	-63.5	-179.7	-179	0	0	111.3	R497 P531 R534	R497-E536 WeakPolarHBondContact CD-O 3.27Å; P531-E536 CarbonylContact C-O 3.5Å; P531-E536 HydrophobicContact CB-CB 4.3Å; P531-E536 PolarHBondContact O-N 3.05Å; R534-E536 VanDerWaalsContact C-N 3.32Å
537	K	88.9	Confident	86.4	Confident	155 Å²	155	80.9 Å²	80.9	67%	0.674	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-75.6	158.6	175.3	-74.6	-171.3	172.2	-168.7	0	110.8
538	D	88.8	Confident	86.5	Confident	67 Å²	67	80.1 Å²	80.1	36%	0.358	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-59.1	146.3	173.2	-66	-10.6	0	0	0	111.2	R493 P531 F543	R493-D538 IonicContact CZ-OD1 2.69Å; R493-D538 IonicContact CZ-OD2 3.72Å; R493-D538 IonicContact NH1-OD1 2.69Å; R493-D538 IonicContact NH1-OD2 2.75Å; R493-D538 PolarHBondContact NH1-OD2 2.74Å; R493-D538 IonicContact NH2-OD1 3.68Å; R493-D538 PolarHBondContact NH2-OD1 2.81Å; R493-D538 IonicContact NH2-OD2 3.58Å; R493-D538 PolarHBondContact NH2-OD2 3.39Å; P531-D538 VanDerWaalsContact CG-OD1 3.31Å; P531-D538 WeakPolarHBondContact CG-OD1 3.17Å; D538-F543 HydrophobicContact CB-CB 4.33Å
539	P	85.7	Confident	86.7	Confident	64 Å²	64	75.8 Å²	75.8	42%	0.416	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-62.6	162.5	177.4	28.5	-35	0	0	0	110.6	S541 G542	P539-S541 PolarHBondContact O-N 3.25Å; P539-G542 WeakPolarHBondContact CG-O 3.26Å; P539-G542 PolarHBondContact O-N 2.88Å
540	K	72.9	Confident	86.5	Confident	230 Å²	230	76.7 Å²	76.7	100%	1	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.2	179.1	-70.8	-174.4	173.7	-179.7	0	113.6
541	S	73.4	Confident	86.3	Confident	114 Å²	114	78.7 Å²	78.7	80%	0.797	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-3.4	174.3	56.6	0	0	0	0	114.5	P539	P539-S541 PolarHBondContact O-N 3.25Å
542	G	76.3	Confident	86.1	Confident	44 Å²	44	81.9 Å²	81.9	45%	0.454	42%	0.415	S	S	.	.			trans	81.6	158.9	-173.7	0	0	0	0	0	114	P539	P539-G542 WeakPolarHBondContact CG-O 3.26Å; P539-G542 PolarHBondContact O-N 2.88Å
543	F	87.5	Confident	85.9	Confident	45 Å²	45	82.7 Å²	82.7	20%	0.197	42%	0.423	C	S	.	.			trans	-122.7	117.7	167.9	-173.3	-90.1	0	0	0	108	D530 P531 D538 I545	D530-F543 HydrophobicContact CB-CE1 4.01Å; D530-F543 HydrophobicContact CB-CZ 4.09Å; P531-F543 HydrophobicContact CG-CB 4.32Å; P531-F543 HydrophobicContact CG-CD2 4.4Å; P531-F543 HydrophobicContact CG-CG 4.31Å; D538-F543 HydrophobicContact CB-CB 4.33Å; F543-I545 HydrophobicContact CD1-CG1 4.18Å; F543-I545 HydrophobicContact CE1-CD1 4.14Å; F543-I545 HydrophobicContact CE1-CG1 3.82Å
544	D	87.8	Confident	85.8	Confident	148 Å²	148	81.6 Å²	81.6	79%	0.791	42%	0.418	S	S	*	.			trans	-110.4	141.4	-173.3	-173.8	29.8	0	0	0	111.4
545	I	90.9	Very high	85.7	Confident	25 Å²	25	75.8 Å²	75.8	13%	0.128	40%	0.402	C	S	.	.			trans	-124.2	114.6	176.8	-58.9	-176.8	0	0	0	107.5	V490 W521 P527 F543 V547	V490-I545 HydrophobicContact CG2-CB 4.45Å; W521-I545 HydrophobicContact CZ3-CD1 4.3Å; W521-I545 HydrophobicContact CZ3-CG2 4.12Å; P527-I545 HydrophobicContact CG-CD1 4.2Å; F543-I545 HydrophobicContact CD1-CG1 4.18Å; F543-I545 HydrophobicContact CE1-CD1 4.14Å; F543-I545 HydrophobicContact CE1-CG1 3.82Å; I545-V547 PolarHBondContact O-N 3.37Å
546	K	90.2	Very high	85.5	Confident	155 Å²	155	76.6 Å²	76.6	67%	0.674	41%	0.406	S	S	*	.			trans	-75.1	110.9	172	-172.8	-175.3	177.5	-166.9	0	109.7
547	V	92.9	Very high	85.2	Confident	22 Å²	22	71.3 Å²	71.3	13%	0.133	38%	0.382	C	S	.	.			trans	-87	133.9	178.8	-173.7	0	0	0	0	110.2	Q485 D486 Q489 V490 I545	Q485-V547 HydrophobicContact CB-CG1 3.38Å; Q485-V547 HydrophobicContact CG-CG1 4.43Å; D486-V547 WeakPolarHBondContact OD1-CG1 3.18Å; Q489-V547 HydrophobicContact CB-CG2 4.32Å; V490-V547 HydrophobicContact CG2-CG2 3.67Å; I545-V547 PolarHBondContact O-N 3.37Å
548	P	90.8	Very high	85.1	Confident	8 Å²	8	66.1 Å²	66.1	5%	0.052	36%	0.36	C	S	.	.			trans	-64.8	163	175.4	19.1	-27.4	0	0	0	112.9	Y481 D520 E522	Y481-P548 HydrophobicContact CE1-CB 4.37Å; Y481-P548 HydrophobicContact CE1-CG 4.36Å; Y481-P548 WeakPolarHBondContact CE1-O 3.28Å; Y481-P548 WeakPolarHBondContact OH-CG 3.39Å; D520-P548 WeakPolarHBondContact O-CG 3.33Å; E522-P548 VanDerWaalsContact OE2-CB 3.29Å; E522-P548 WeakPolarHBondContact OE2-CB 3.42Å
549	R	89.6	Confident	85.2	Confident	71 Å²	71	63.4 Å²	63.4	27%	0.268	35%	0.345	S	S	.	.			trans	-124.6	120	168	-66.1	-61.7	178.2	-127.3	10.6	110.5	D384 A482 D486	D384-R549 IonicContact OD1-NE 3.56Å; D384-R549 PolarHBondContact OD1-NE 2.99Å; D384-R549 IonicContact OD2-CZ 3.75Å; D384-R549 VanDerWaalsContact OD2-CZ 3.31Å; D384-R549 IonicContact OD2-NE 3.74Å; D384-R549 PolarHBondContact OD2-NE 3.45Å; D384-R549 IonicContact OD2-NH2 3.26Å; D384-R549 PolarHBondContact OD2-NH2 2.69Å; A482-R549 VanDerWaalsContact CB-CZ 3.49Å; D486-R549 VanDerWaalsContact CG-NH2 3.3Å; D486-R549 IonicContact OD1-CZ 3.9Å; D486-R549 IonicContact OD1-NH1 3.65Å; D486-R549 PolarHBondContact OD1-NH1 3.39Å; D486-R549 IonicContact OD1-NH2 2.77Å; D486-R549 PolarHBondContact OD1-NH2 3.21Å; D486-R549 VanDerWaalsContact OD1-NH2 3.08Å; D486-R549 IonicContact OD2-CZ 3.61Å; D486-R549 IonicContact OD2-NH1 2.75Å; D486-R549 IonicContact OD2-NH2 3.55Å; D486-R549 PolarHBondContact OD2-NH2 2.72Å
550	R	83.6	Confident	85.3	Confident	126 Å²	126	61.5 Å²	61.5	48%	0.475	33%	0.33	S	S	.	.			trans	-130.1	146.8	177.5	-61.7	-173.2	-178.3	-84	2.4	110.4	H478 Y481 D520 V552	H478-R550 WeakPolarHBondContact CA-O 3.41Å; Y481-R550 VanDerWaalsContact CB-O 3.3Å; Y481-R550 WeakPolarHBondContact CB-O 3.27Å; Y481-R550 HydrophobicContact CD1-CB 3.96Å; Y481-R550 VanDerWaalsContact CD1-N 3.33Å; Y481-R550 HydrophobicContact CD2-CB 4.05Å; Y481-R550 HydrophobicContact CE1-CB 3.81Å; Y481-R550 HydrophobicContact CE1-CG 3.9Å; Y481-R550 HydrophobicContact CE2-CB 3.92Å; Y481-R550 HydrophobicContact CE2-CG 4.13Å; Y481-R550 HydrophobicContact CG-CB 4.06Å; D520-R550 IonicContact OD2-CZ 3.09Å; D520-R550 IonicContact OD2-NE 3.82Å; D520-R550 PolarHBondContact OD2-NE 3.25Å; D520-R550 IonicContact OD2-NH2 2.7Å; D520-R550 PolarHBondContact OD2-NH2 3.11Å; R550-V552 VanDerWaalsContact C-N 3.26Å; R550-V552 HydrophobicContact CB-CG1 4.03Å; R550-V552 PolarHBondContact O-N 2.76Å
551	A	83.8	Confident	85.9	Confident	42 Å²	42	51.5 Å²	51.5	35%	0.347	29%	0.287	S	S	.	.	S	Bend	trans	-90	51.6	175.4	0	0	0	0	0	111.9	H474 R477	H474-A551 WeakPolarHBondContact CE1-CB 3.25Å; H474-A551 WeakPolarHBondContact ND1-CB 3.31Å; R477-A551 WeakPolarHBondContact CB-O 3.41Å
552	V	84.1	Confident	86.7	Confident	76 Å²	76	46.1 Å²	46.1	46%	0.461	25%	0.249	S	C	.	.			trans	-141	129.7	177.7	66.7	0	0	0	0	111	Y481 R550	Y481-V552 WeakPolarHBondContact CB-O 3.07Å; Y481-V552 HydrophobicContact CD2-CG1 4.35Å; Y481-V552 WeakPolarHBondContact CD2-O 3.34Å; R550-V552 VanDerWaalsContact C-N 3.26Å; R550-V552 HydrophobicContact CB-CG1 4.03Å; R550-V552 PolarHBondContact O-N 2.76Å
553	G	86.1	Confident	87.4	Confident	18 Å²	18	45.8 Å²	45.8	19%	0.186	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-74.4	165.3	174.9	0	0	0	0	0	112.5
554	P	87.4	Confident	87.5	Confident	23 Å²	23	43.8 Å²	43.8	15%	0.149	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-64.7	156.1	168.4	31.1	-36.4	0	0	0	110.8	V480 L484 Q558 L559	V480-P554 VanDerWaalsContact CG1-CD 3.48Å; V480-P554 HydrophobicContact CG1-CG 4.23Å; L484-P554 HydrophobicContact CD2-CB 3.74Å; L484-P554 HydrophobicContact CD2-CG 3.93Å; P554-Q558 HydrophobicContact CB-CB 3.97Å; P554-L559 HydrophobicContact CB-CB 4.46Å; P554-L559 HydrophobicContact CG-CB 4.03Å; P554-L559 HydrophobicContact CG-CD1 4.33Å
555	S	84.6	Confident	87.6	Confident	36 Å²	36	36.9 Å²	36.9	25%	0.252	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-62.7	159.7	165.2	55.3	0	0	0	0	111.4	T557 Q558 L559	S555-T557 VanDerWaalsContact C-N 3.27Å; S555-T557 PolarHBondContact O-N 3.24Å; S555-T557 PolarHBondContact OG-OG1 2.97Å; S555-Q558 PolarHBondContact O-N 3.4Å; S555-Q558 WeakPolarHBondContact OG-CB 3.29Å; S555-Q558 VanDerWaalsContact OG-CD 3.26Å; S555-Q558 WeakPolarHBondContact OG-CG 3.43Å; S555-Q558 PolarHBondContact OG-N 2.87Å; S555-Q558 PolarHBondContact OG-OE1 3.48Å; S555-L559 PolarHBondContact O-N 2.7Å
556	S	82.1	Confident	87.7	Confident	28 Å²	28	35.7 Å²	35.7	20%	0.196	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-35.7	178.5	56.6	0	0	0	0	112.2	N43 T44 Y560	N43-S556 WeakPolarHBondContact OD1-CB 3.4Å; N43-S556 PolarHBondContact OD1-OG 2.92Å; N43-S556 VanDerWaalsContact OD1-OG 3.06Å; T44-S556 PolarHBondContact OG1-OG 3.15Å; S556-Y560 VanDerWaalsContact O-CB 3.25Å; S556-Y560 WeakPolarHBondContact O-CB 3.39Å; S556-Y560 PolarHBondContact O-N 3.31Å
557	T	82.4	Confident	87.7	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.006	15%	0.153	C	C	.	.	H	α-helix	trans	-59.9	-53.4	170.4	45.1	0	0	0	0	112.5	F46 D48 R49 F52 S555 L559 Y560 M561	F46-T557 VanDerWaalsContact CA-CG2 3.5Å; F46-T557 HydrophobicContact CB-CG2 4.03Å; F46-T557 HydrophobicContact CD1-CG2 3.86Å; F46-T557 HydrophobicContact CG-CG2 4.45Å; D48-T557 WeakPolarHBondContact OD1-CG2 3.37Å; D48-T557 PolarHBondContact OD2-OG1 3.49Å; R49-T557 HydrophobicContact CB-CG2 4.47Å; F52-T557 WeakPolarHBondContact CE2-OG1 3.32Å; S555-T557 VanDerWaalsContact C-N 3.27Å; S555-T557 PolarHBondContact O-N 3.24Å; S555-T557 PolarHBondContact OG-OG1 2.97Å; T557-L559 VanDerWaalsContact C-N 3.34Å; T557-L559 PolarHBondContact O-N 3.33Å; T557-Y560 PolarHBondContact O-N 3.47Å; T557-M561 VanDerWaalsContact O-CB 3.3Å; T557-M561 WeakPolarHBondContact O-CB 3.3Å; T557-M561 WeakPolarHBondContact O-CG 3.49Å; T557-M561 PolarHBondContact O-N 3.48Å
558	Q	86.4	Confident	87.5	Confident	46 Å²	46	28.2 Å²	28.2	22%	0.215	15%	0.149	C	C	.	.	H	α-helix	trans	-56.9	-49	-179.5	-78.9	172.7	-46.6	0	0	111.1	F52 T517 V518 P554 S555 M561 V562	F52-Q558 HydrophobicContact CE1-CG 3.8Å; F52-Q558 HydrophobicContact CZ-CG 3.75Å; T517-Q558 HydrophobicContact CG2-CG 4.19Å; T517-Q558 PolarHBondContact O-NE2 3.19Å; T517-Q558 VanDerWaalsContact O-NE2 3.12Å; V518-Q558 HydrophobicContact CG1-CB 3.87Å; V518-Q558 HydrophobicContact CG1-CG 4.09Å; P554-Q558 HydrophobicContact CB-CB 3.97Å; S555-Q558 PolarHBondContact O-N 3.4Å; S555-Q558 WeakPolarHBondContact OG-CB 3.29Å; S555-Q558 VanDerWaalsContact OG-CD 3.26Å; S555-Q558 WeakPolarHBondContact OG-CG 3.43Å; S555-Q558 PolarHBondContact OG-N 2.87Å; S555-Q558 PolarHBondContact OG-OE1 3.48Å; Q558-M561 PolarHBondContact O-N 2.91Å; Q558-V562 WeakPolarHBondContact O-CB 3.17Å; Q558-V562 VanDerWaalsContact O-CG2 3.28Å; Q558-V562 WeakPolarHBondContact O-CG2 3.37Å; Q558-V562 PolarHBondContact O-N 2.97Å
559	L	90.6	Very high	87.4	Confident	10 Å²	10	27.8 Å²	27.8	5%	0.052	15%	0.147	C	C	.	.	H	α-helix	trans	-64.9	-44.1	-178.7	-173.8	60.8	0	0	0	111.9	P554 S555 T557 R563 Y602	P554-L559 HydrophobicContact CB-CB 4.46Å; P554-L559 HydrophobicContact CG-CB 4.03Å; P554-L559 HydrophobicContact CG-CD1 4.33Å; S555-L559 PolarHBondContact O-N 2.7Å; T557-L559 VanDerWaalsContact C-N 3.34Å; T557-L559 PolarHBondContact O-N 3.33Å; L559-R563 HydrophobicContact CD1-CG 4.2Å; L559-R563 HydrophobicContact CG-CG 4.49Å; L559-R563 WeakPolarHBondContact O-CB 3.22Å; L559-R563 VanDerWaalsContact O-CG 3.24Å; L559-R563 WeakPolarHBondContact O-CG 3.37Å; L559-R563 PolarHBondContact O-N 3.06Å; L559-Y602 HydrophobicContact CD1-CD2 4.16Å
560	Y	87.2	Confident	87.5	Confident	24 Å²	24	25.4 Å²	25.4	9%	0.094	14%	0.139	C	C	.	.	H	α-helix	trans	-61.9	-45.8	176.7	177.7	-93.1	0	0	0	112.3	F46 A63 H66 A156 S556 T557 R563 T564	F46-Y560 HydrophobicContact CD1-CD1 4.41Å; F46-Y560 HydrophobicContact CD1-CG 4.41Å; F46-Y560 VanDerWaalsContact CE1-CB 3.42Å; F46-Y560 AromaticContact CE1-CD1 3.87Å; F46-Y560 HydrophobicContact CE1-CD1 3.87Å; F46-Y560 AromaticContact CE1-CD2 3.97Å; F46-Y560 HydrophobicContact CE1-CD2 3.97Å; F46-Y560 AromaticContact CE1-CG 3.47Å; F46-Y560 HydrophobicContact CE1-CG 3.47Å; F46-Y560 VanDerWaalsContact CE1-CG 3.47Å; F46-Y560 HydrophobicContact CZ-CD1 4.28Å; F46-Y560 AromaticContact CZ-CD2 3.75Å; F46-Y560 HydrophobicContact CZ-CD2 3.75Å; F46-Y560 HydrophobicContact CZ-CE2 4.24Å; F46-Y560 AromaticContact CZ-CG 3.77Å; F46-Y560 HydrophobicContact CZ-CG 3.77Å; A63-Y560 HydrophobicContact CB-CD1 4.31Å; A63-Y560 HydrophobicContact CB-CE1 3.72Å; H66-Y560 AromaticContact ND1-CE2 3.6Å; H66-Y560 AromaticContact ND1-CZ 3.67Å; H66-Y560 PolarHBondContact ND1-OH 3.09Å; A156-Y560 HydrophobicContact CB-CE2 4.28Å; S556-Y560 VanDerWaalsContact O-CB 3.25Å; S556-Y560 WeakPolarHBondContact O-CB 3.39Å; S556-Y560 PolarHBondContact O-N 3.31Å; T557-Y560 PolarHBondContact O-N 3.47Å; Y560-R563 PolarHBondContact O-N 3.47Å; Y560-T564 VanDerWaalsContact O-CB 3.24Å; Y560-T564 WeakPolarHBondContact O-CB 3.46Å; Y560-T564 PolarHBondContact O-N 3.04Å; Y560-T564 PolarHBondContact O-OG1 3.28Å
561	M	85.7	Confident	87.5	Confident	19 Å²	19	20.5 Å²	20.5	9%	0.094	13%	0.125	C	C	.	.	H	α-helix	trans	-64.5	-45.3	-179.5	-71.3	-64.8	-70.7	0	0	111.2	I60 T557 Q558 M565	I60-M561 HydrophobicContact CG1-CE 4Å; T557-M561 VanDerWaalsContact O-CB 3.3Å; T557-M561 WeakPolarHBondContact O-CB 3.3Å; T557-M561 WeakPolarHBondContact O-CG 3.49Å; T557-M561 PolarHBondContact O-N 3.48Å; Q558-M561 PolarHBondContact O-N 2.91Å; M561-M565 HydrophobicContact CB-CE 4.19Å; M561-M565 VanDerWaalsContact O-CB 3.3Å; M561-M565 WeakPolarHBondContact O-CB 3.25Å; M561-M565 VanDerWaalsContact O-CE 3.32Å; M561-M565 WeakPolarHBondContact O-CE 3.29Å; M561-M565 VanDerWaalsContact O-CG 3.26Å; M561-M565 WeakPolarHBondContact O-CG 3.38Å; M561-M565 PolarHBondContact O-N 3.48Å
562	V	91	Very high	86.7	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-61.1	-51	176.4	169.9	0	0	0	0	110.8	L484 I514 V518 Q558 T564 M565 L566 F595	L484-V562 HydrophobicContact CD1-CG1 4.32Å; I514-V562 HydrophobicContact CG2-CG1 4.17Å; I514-V562 HydrophobicContact CG2-CG2 4.18Å; V518-V562 HydrophobicContact CB-CG2 4.35Å; V518-V562 HydrophobicContact CG1-CG2 3.44Å; V518-V562 VanDerWaalsContact CG1-CG2 3.44Å; V518-V562 HydrophobicContact CG2-CG2 3.96Å; Q558-V562 WeakPolarHBondContact O-CB 3.17Å; Q558-V562 VanDerWaalsContact O-CG2 3.28Å; Q558-V562 WeakPolarHBondContact O-CG2 3.37Å; Q558-V562 PolarHBondContact O-N 2.97Å; V562-T564 PolarHBondContact O-N 3.43Å; V562-M565 PolarHBondContact O-N 3.08Å; V562-L566 HydrophobicContact CG1-CD1 3.69Å; V562-L566 HydrophobicContact CG1-CG 4.32Å; V562-L566 WeakPolarHBondContact O-CB 3.3Å; V562-L566 VanDerWaalsContact O-CG 3.26Å; V562-L566 WeakPolarHBondContact O-CG 3.47Å; V562-L566 PolarHBondContact O-N 3.42Å; V562-F595 HydrophobicContact CG1-CE1 4.22Å
563	R	91.8	Very high	85.4	Confident	37 Å²	37	25.5 Å²	25.5	14%	0.14	14%	0.139	C	C	.	.	H	α-helix	trans	-59.8	-49.4	-179.9	-72.4	175.3	56.7	69.2	8.3	111.6	L559 Y560 M565 L566 E567 H596 S599 F600	L559-R563 HydrophobicContact CD1-CG 4.2Å; L559-R563 HydrophobicContact CG-CG 4.49Å; L559-R563 WeakPolarHBondContact O-CB 3.22Å; L559-R563 VanDerWaalsContact O-CG 3.24Å; L559-R563 WeakPolarHBondContact O-CG 3.37Å; L559-R563 PolarHBondContact O-N 3.06Å; Y560-R563 PolarHBondContact O-N 3.47Å; R563-M565 VanDerWaalsContact C-N 3.34Å; R563-M565 PolarHBondContact O-N 2.84Å; R563-L566 PolarHBondContact O-N 3.2Å; R563-E567 VanDerWaalsContact O-CB 3.28Å; R563-E567 WeakPolarHBondContact O-CB 3.27Å; R563-E567 PolarHBondContact O-N 3.26Å; R563-H596 PolarHBondContact NH1-O 2.94Å; R563-S599 PolarHBondContact NH1-O 3.45Å; R563-S599 PolarHBondContact NH1-OG 3.33Å; R563-F600 VanDerWaalsContact NH1-N 3.15Å
564	T	89.7	Confident	83.5	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.018	14%	0.144	C	C	.	.	H	α-helix	trans	-60.9	-40.8	-179.9	-55.6	0	0	0	0	112.2	Y59 F152 Y560 V562 S568	Y59-T564 HydrophobicContact CD1-CG2 3.86Å; Y59-T564 HydrophobicContact CE1-CG2 4.19Å; F152-T564 HydrophobicContact CE1-CG2 4.15Å; Y560-T564 VanDerWaalsContact O-CB 3.24Å; Y560-T564 WeakPolarHBondContact O-CB 3.46Å; Y560-T564 PolarHBondContact O-N 3.04Å; Y560-T564 PolarHBondContact O-OG1 3.28Å; V562-T564 PolarHBondContact O-N 3.43Å; T564-S568 PolarHBondContact O-N 3.31Å; T564-S568 VanDerWaalsContact O-N 3.14Å
565	M	89.2	Confident	81.5	Confident	4 Å²	4	27.8 Å²	27.8	2%	0.02	16%	0.16	C	C	.	.	H	α-helix	trans	-68.7	-41.6	177.1	-76.4	-170.2	-73.5	0	0	112	Y59 V510 A513 I514 M561 V562 R563 S568 L569	Y59-M565 HydrophobicContact CD2-CG 3.82Å; Y59-M565 HydrophobicContact CD2-SD 4.36Å; Y59-M565 HydrophobicContact CE2-CG 3.78Å; Y59-M565 HydrophobicContact CG-CG 4.4Å; V510-M565 HydrophobicContact CG1-CB 3.89Å; V510-M565 HydrophobicContact CG1-CG 4.37Å; A513-M565 HydrophobicContact CB-CE 4.41Å; A513-M565 HydrophobicContact CB-SD 3.66Å; I514-M565 HydrophobicContact CB-CE 4.49Å; I514-M565 HydrophobicContact CD1-CB 3.91Å; I514-M565 HydrophobicContact CG1-CB 3.78Å; I514-M565 HydrophobicContact CG1-CE 3.72Å; I514-M565 HydrophobicContact CG1-SD 4.11Å; M561-M565 HydrophobicContact CB-CE 4.19Å; M561-M565 VanDerWaalsContact O-CB 3.3Å; M561-M565 WeakPolarHBondContact O-CB 3.25Å; M561-M565 VanDerWaalsContact O-CE 3.32Å; M561-M565 WeakPolarHBondContact O-CE 3.29Å; M561-M565 VanDerWaalsContact O-CG 3.26Å; M561-M565 WeakPolarHBondContact O-CG 3.38Å; M561-M565 PolarHBondContact O-N 3.48Å; V562-M565 PolarHBondContact O-N 3.08Å; R563-M565 VanDerWaalsContact C-N 3.34Å; R563-M565 PolarHBondContact O-N 2.84Å; M565-S568 PolarHBondContact O-N 3.13Å; M565-S568 PolarHBondContact O-OG 2.95Å; M565-L569 PolarHBondContact O-N 2.67Å
566	L	91.8	Very high	79.9	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-43.4	175.3	-71.5	172.8	0	0	0	111.7	F487 I514 V562 R563 S568 L569 I570 I592 F595	F487-L566 HydrophobicContact CE1-CD1 3.61Å; F487-L566 HydrophobicContact CE1-CD2 3.77Å; F487-L566 HydrophobicContact CE1-CG 4.33Å; F487-L566 HydrophobicContact CZ-CD1 4.04Å; F487-L566 HydrophobicContact CZ-CD2 3.87Å; I514-L566 HydrophobicContact CD1-CD2 3.54Å; I514-L566 HydrophobicContact CD1-CG 3.82Å; V562-L566 HydrophobicContact CG1-CD1 3.69Å; V562-L566 HydrophobicContact CG1-CG 4.32Å; V562-L566 WeakPolarHBondContact O-CB 3.3Å; V562-L566 VanDerWaalsContact O-CG 3.26Å; V562-L566 WeakPolarHBondContact O-CG 3.47Å; V562-L566 PolarHBondContact O-N 3.42Å; R563-L566 PolarHBondContact O-N 3.2Å; L566-S568 VanDerWaalsContact C-N 3.25Å; L566-S568 PolarHBondContact O-N 3.46Å; L566-L569 HydrophobicContact CD2-CD1 4.36Å; L566-L569 WeakPolarHBondContact O-CB 3.33Å; L566-L569 PolarHBondContact O-N 3.11Å; L566-I570 PolarHBondContact O-N 2.9Å; L566-I592 HydrophobicContact CB-CG2 3.96Å; L566-I592 HydrophobicContact CD2-CG1 4.36Å; L566-I592 HydrophobicContact CD2-CG2 3.9Å; L566-I592 HydrophobicContact CG-CG2 4.42Å; L566-F595 HydrophobicContact CD1-CD1 3.67Å; L566-F595 HydrophobicContact CD1-CE1 4Å
567	E	91.6	Very high	78.5	Confident	12 Å²	12	39 Å²	39	6%	0.056	21%	0.21	C	C	.	.	H	α-helix	trans	-54.9	-42.9	175.7	-162.1	-163.8	136.5	0	0	110.7	F152 S154 E155 R563 L569 I570 A571	F152-E567 HydrophobicContact CE2-CB 4.18Å; F152-E567 HydrophobicContact CE2-CG 3.8Å; F152-E567 VanDerWaalsContact CE2-OE1 3.24Å; F152-E567 WeakPolarHBondContact CE2-OE1 3.4Å; F152-E567 HydrophobicContact CZ-CB 3.83Å; F152-E567 VanDerWaalsContact CZ-CD 3.47Å; F152-E567 HydrophobicContact CZ-CG 3.79Å; F152-E567 VanDerWaalsContact CZ-OE1 3.29Å; F152-E567 WeakPolarHBondContact CZ-OE1 3.29Å; S154-E567 VanDerWaalsContact CA-OE1 3.29Å; S154-E567 WeakPolarHBondContact CA-OE1 3.2Å; S154-E567 PolarHBondContact OG-OE2 3.34Å; E155-E567 VanDerWaalsContact CG-OE1 3.3Å; E155-E567 WeakPolarHBondContact CG-OE1 3.32Å; E155-E567 PolarHBondContact N-OE1 2.85Å; E155-E567 PolarHBondContact N-OE2 3.36Å; R563-E567 VanDerWaalsContact O-CB 3.28Å; R563-E567 WeakPolarHBondContact O-CB 3.27Å; R563-E567 PolarHBondContact O-N 3.26Å; E567-L569 VanDerWaalsContact C-N 3.25Å; E567-L569 PolarHBondContact O-N 3.01Å; E567-I570 WeakPolarHBondContact O-CG1 3.27Å; E567-I570 PolarHBondContact O-N 3.5Å; E567-A571 WeakPolarHBondContact O-CB 3.41Å; E567-A571 PolarHBondContact O-N 2.8Å
568	S	88.8	Confident	77.8	Confident	7 Å²	7	45.8 Å²	45.8	5%	0.049	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-28.5	176.6	82.2	0	0	0	0	114.1	Y59 T564 M565 L566	Y59-S568 WeakPolarHBondContact OH-CB 3.18Å; Y59-S568 PolarHBondContact OH-OG 3.18Å; Y59-S568 VanDerWaalsContact OH-OG 3.06Å; T564-S568 PolarHBondContact O-N 3.31Å; T564-S568 VanDerWaalsContact O-N 3.14Å; M565-S568 PolarHBondContact O-N 3.13Å; M565-S568 PolarHBondContact O-OG 2.95Å; L566-S568 VanDerWaalsContact C-N 3.25Å; L566-S568 PolarHBondContact O-N 3.46Å
569	L	88.8	Confident	77.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-75.9	-33.7	178.8	-68.6	173.6	0	0	0	112	I507 V510 L511 I514 M565 L566 E567 L580 R581 L584 I592	I507-L569 HydrophobicContact CG1-CD2 4.33Å; I507-L569 HydrophobicContact CG2-CD2 4.21Å; V510-L569 HydrophobicContact CB-CD2 4.2Å; V510-L569 HydrophobicContact CG1-CD1 4.07Å; V510-L569 HydrophobicContact CG1-CD2 4.09Å; V510-L569 HydrophobicContact CG1-CG 3.99Å; L511-L569 HydrophobicContact CD2-CD1 3.66Å; L511-L569 HydrophobicContact CG-CD1 4.26Å; I514-L569 HydrophobicContact CD1-CD1 4.47Å; M565-L569 PolarHBondContact O-N 2.67Å; L566-L569 HydrophobicContact CD2-CD1 4.36Å; L566-L569 WeakPolarHBondContact O-CB 3.33Å; L566-L569 PolarHBondContact O-N 3.11Å; E567-L569 VanDerWaalsContact C-N 3.25Å; E567-L569 PolarHBondContact O-N 3.01Å; L569-L580 HydrophobicContact CD2-CB 4.47Å; L569-L580 HydrophobicContact CD2-CD1 4.24Å; L569-R581 VanDerWaalsContact O-CA 3.25Å; L569-R581 WeakPolarHBondContact O-CA 3.41Å; L569-R581 PolarHBondContact O-N 2.9Å; L569-L584 HydrophobicContact CB-CD1 4.13Å; L569-I592 HydrophobicContact CD1-CD1 4.44Å
570	I	90.3	Very high	77.2	Confident	21 Å²	21	46.6 Å²	46.6	11%	0.108	25%	0.246	C	C	.	.	H	α-helix	trans	-96.8	-4.8	-178.1	59.8	171.6	0	0	0	113.6	L566 E567 R581 I589 I592 E593 H596	L566-I570 PolarHBondContact O-N 2.9Å; E567-I570 WeakPolarHBondContact O-CG1 3.27Å; E567-I570 PolarHBondContact O-N 3.5Å; I570-R581 WeakPolarHBondContact O-CD 3.25Å; I570-R581 PolarHBondContact O-NH1 3.46Å; I570-I589 HydrophobicContact CG2-CG2 4.39Å; I570-I592 HydrophobicContact CD1-CG2 4.38Å; I570-I592 HydrophobicContact CG2-CB 3.88Å; I570-I592 HydrophobicContact CG2-CD1 4.45Å; I570-I592 HydrophobicContact CG2-CG2 3.49Å; I570-I592 VanDerWaalsContact CG2-CG2 3.49Å; I570-E593 HydrophobicContact CD1-CG 3.93Å; I570-E593 HydrophobicContact CG2-CG 4.32Å; I570-H596 HydrophobicContact CD1-CB 4.43Å
571	A	84.8	Confident	77.1	Confident	22 Å²	22	48.3 Å²	48.3	18%	0.182	25%	0.252	C	S	.	.			trans	-66	134.7	178.6	0	0	0	0	0	113.3	F152 E567	F152-A571 HydrophobicContact CD2-CB 3.65Å; F152-A571 HydrophobicContact CE2-CB 4.08Å; E567-A571 WeakPolarHBondContact O-CB 3.41Å; E567-A571 PolarHBondContact O-N 2.8Å
572	D	65.9	Low	77	Confident	122 Å²	122	50.9 Å²	50.9	65%	0.652	27%	0.272	S	S	*	.	S	Bend	trans	-83.5	-8.8	177.4	-76.2	-39.3	0	0	0	113.9	T579 R581	D572-T579 WeakPolarHBondContact O-CG2 3.27Å; D572-R581 WeakPolarHBondContact OD1-CD 3.39Å; D572-R581 IonicContact OD1-NE 2.86Å
573	K	57.3	Low	76.5	Confident	101 Å²	101	52.1 Å²	52.1	44%	0.439	28%	0.281	S	S	.	.			trans	-101.2	113.6	179	-66.7	-170.7	-175.9	-171.4	0	111.5	D240	D240-K573 IonicContact OD1-NZ 2.81Å; D240-K573 PolarHBondContact OD1-NZ 2.95Å; D240-K573 IonicContact OD2-NZ 2.53Å; D240-K573 PolarHBondContact OD2-NZ 3.3Å
574	S	47.2	Very low	76.2	Confident	42 Å²	42	51.4 Å²	51.4	29%	0.294	28%	0.28	S	S	.	.			trans	-145.7	143.4	162.8	88	0	0	0	0	109.9	K150 S576 T579	K150-S574 CarbonylContact O-C 3.33Å; K150-S574 WeakPolarHBondContact O-CA 3.5Å; S574-S576 PolarHBondContact O-N 2.68Å; S574-S576 PolarHBondContact OG-OG 2.96Å; S574-T579 WeakPolarHBondContact OG-CA 3.24Å
575	G	45	Very low	75.9	Confident	47 Å²	47	55.3 Å²	55.3	49%	0.485	30%	0.298	S	S	.	.	S	Bend	trans	-69.6	8.2	-179.2	0	0	0	0	0	117.1	K150	K150-G575 PolarHBondContact O-N 2.74Å
576	S	50.7	Low	75.5	Confident	73 Å²	73	57.4 Å²	57.4	51%	0.51	32%	0.32	S	S	.	.	S	Bend	trans	-111.3	158.7	178.3	80.8	0	0	0	0	111.4	S574 K578	S574-S576 PolarHBondContact O-N 2.68Å; S574-S576 PolarHBondContact OG-OG 2.96Å; S576-K578 PolarHBondContact O-N 3.07Å; S576-K578 PolarHBondContact OG-N 3.43Å; S576-K578 PolarHBondContact OG-O 3.48Å
577	K	51.4	Low	75.3	Confident	226 Å²	226	61.7 Å²	61.7	98%	0.983	35%	0.348	S	S	*	.	S	Bend	trans	-59.7	-6.8	174.1	-85.3	-177.8	174.5	178.6	0	114.2
578	K	68.6	Low	75.2	Confident	145 Å²	145	61.5 Å²	61.5	63%	0.63	35%	0.348	S	S	*	.	S	Bend	trans	-137.7	111.1	178.6	-73.7	-167	176.7	-173.5	0	111.5	S576	S576-K578 PolarHBondContact O-N 3.07Å; S576-K578 PolarHBondContact OG-N 3.43Å; S576-K578 PolarHBondContact OG-O 3.48Å
579	T	80.1	Confident	75.1	Confident	26 Å²	26	62 Å²	62	16%	0.16	35%	0.35	C	S	.	.			trans	-70.5	162.1	171.7	58.7	0	0	0	0	111.7	D572 S574 R581 S582	D572-T579 WeakPolarHBondContact O-CG2 3.27Å; S574-T579 WeakPolarHBondContact OG-CA 3.24Å; T579-R581 VanDerWaalsContact C-N 3.27Å; T579-R581 PolarHBondContact O-N 3.26Å; T579-S582 PolarHBondContact N-OG 3.27Å; T579-S582 PolarHBondContact O-N 3.44Å; T579-S582 PolarHBondContact O-OG 2.92Å; T579-S582 WeakPolarHBondContact OG1-CB 3.45Å; T579-S582 PolarHBondContact OG1-N 3.38Å; T579-S582 VanDerWaalsContact OG1-N 3.17Å
580	L	83.5	Confident	75.2	Confident	47 Å²	47	67.3 Å²	67.3	25%	0.246	38%	0.378	C	S	.	.	S	Bend	trans	-60.2	-40.9	172.5	-61.7	-177.8	0	0	0	110.8	V506 I507 L569 S582 S583	V506-L580 HydrophobicContact CB-CD2 4.34Å; V506-L580 HydrophobicContact CG1-CD2 3.78Å; I507-L580 HydrophobicContact CG1-CD2 4.16Å; L569-L580 HydrophobicContact CD2-CB 4.47Å; L569-L580 HydrophobicContact CD2-CD1 4.24Å; L580-S582 VanDerWaalsContact C-N 3.34Å; L580-S582 PolarHBondContact O-N 3Å; L580-S583 PolarHBondContact O-N 3.35Å
581	R	85.3	Confident	75.2	Confident	59 Å²	59	69.8 Å²	69.8	22%	0.223	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-53.4	-46.3	174.2	-169.4	-169.8	-178.9	77.2	3.4	112.8	L569 I570 D572 T579 S583 L584 I589 E593	L569-R581 VanDerWaalsContact O-CA 3.25Å; L569-R581 WeakPolarHBondContact O-CA 3.41Å; L569-R581 PolarHBondContact O-N 2.9Å; I570-R581 WeakPolarHBondContact O-CD 3.25Å; I570-R581 PolarHBondContact O-NH1 3.46Å; D572-R581 WeakPolarHBondContact OD1-CD 3.39Å; D572-R581 IonicContact OD1-NE 2.86Å; T579-R581 VanDerWaalsContact C-N 3.27Å; T579-R581 PolarHBondContact O-N 3.26Å; R581-S583 PolarHBondContact O-N 2.66Å; R581-L584 PolarHBondContact O-N 3.31Å; R581-I589 HydrophobicContact CG-CD1 3.94Å; R581-I589 VanDerWaalsContact CZ-CG2 3.48Å; R581-I589 VanDerWaalsContact NH1-CG2 3.35Å; R581-E593 IonicContact CZ-OE1 3.53Å; R581-E593 IonicContact NH1-OE1 2.95Å; R581-E593 PolarHBondContact NH1-OE1 3.38Å; R581-E593 IonicContact NH2-OE1 2.7Å; R581-E593 PolarHBondContact NH2-OE1 3.45Å
582	S	83.4	Confident	75.6	Confident	73 Å²	73	68.8 Å²	68.8	51%	0.51	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-63.2	-13.2	-179.9	73.3	0	0	0	0	114.7	T579 L580	T579-S582 PolarHBondContact N-OG 3.27Å; T579-S582 PolarHBondContact O-N 3.44Å; T579-S582 PolarHBondContact O-OG 2.92Å; T579-S582 WeakPolarHBondContact OG1-CB 3.45Å; T579-S582 PolarHBondContact OG1-N 3.38Å; T579-S582 VanDerWaalsContact OG1-N 3.17Å; L580-S582 VanDerWaalsContact C-N 3.34Å; L580-S582 PolarHBondContact O-N 3Å
583	S	81.9	Confident	76.8	Confident	28 Å²	28	64.9 Å²	64.9	20%	0.196	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-103	1.6	178.6	-69.6	0	0	0	0	113.7	K504 L580 R581	K504-S583 PolarHBondContact NZ-OG 2.75Å; K504-S583 VanDerWaalsContact NZ-OG 3.12Å; L580-S583 PolarHBondContact O-N 3.35Å; R581-S583 PolarHBondContact O-N 2.66Å
584	L	85.8	Confident	78.5	Confident	21 Å²	21	65.7 Å²	65.7	11%	0.11	36%	0.364	C	S	.	.	S	Bend	trans	-99.7	160.7	173.3	-67.5	171.4	0	0	0	110.8	I507 L569 R581 I589 I592	I507-L584 HydrophobicContact CD1-CD2 4.25Å; I507-L584 HydrophobicContact CD1-CG 4.33Å; I507-L584 HydrophobicContact CG2-CD2 3.92Å; L569-L584 HydrophobicContact CB-CD1 4.13Å; R581-L584 PolarHBondContact O-N 3.31Å; L584-I589 HydrophobicContact CB-CD1 4.01Å; L584-I589 HydrophobicContact CB-CG1 3.68Å; L584-I589 HydrophobicContact CD1-CG1 4.37Å; L584-I592 HydrophobicContact CD1-CD1 4.11Å
585	E	81.8	Confident	80.7	Confident	86 Å²	86	64.4 Å²	64.4	40%	0.402	35%	0.353	S	S	.	.			trans	-91.6	152.4	177.1	-77.4	-170.4	-176.4	0	0	111.9	Q498 K502 T588 I589	Q498-E585 VanDerWaalsContact NE2-CD 3.32Å; Q498-E585 PolarHBondContact NE2-OE2 3.32Å; Q498-E585 VanDerWaalsContact OE1-CG 3.25Å; Q498-E585 PolarHBondContact OE1-OE1 3.48Å; K502-E585 IonicContact NZ-OE1 3.2Å; K502-E585 PolarHBondContact NZ-OE1 3.49Å; E585-T588 PolarHBondContact N-OG1 2.78Å; E585-T588 PolarHBondContact O-N 3.36Å; E585-T588 VanDerWaalsContact O-N 3.11Å; E585-T588 PolarHBondContact O-OG1 3.25Å; E585-I589 WeakPolarHBondContact O-CG1 3.2Å; E585-I589 PolarHBondContact O-N 3.15Å; E585-I589 VanDerWaalsContact O-N 3.08Å
586	G	82.4	Confident	83	Confident	48 Å²	48	62.9 Å²	62.9	50%	0.495	33%	0.333	S	S	.	.	H	α-helix	trans	-48.7	-53.1	-174.4	0	0	0	0	0	114.5	T588 I589 L590	G586-T588 PolarHBondContact O-N 3.21Å; G586-I589 PolarHBondContact O-N 2.93Å; G586-L590 PolarHBondContact O-N 3.41Å
587	P	87.4	Confident	85	Confident	89 Å²	89	66 Å²	66	58%	0.578	33%	0.334	S	S	*	.	H	α-helix	trans	-60.1	-43.1	178.9	-25.2	35.2	0	0	0	113.2	I589 L590 D591	P587-I589 VanDerWaalsContact C-N 3.27Å; P587-I589 PolarHBondContact O-N 3.26Å; P587-L590 WeakPolarHBondContact O-CB 3.46Å; P587-L590 PolarHBondContact O-N 3.25Å; P587-L590 VanDerWaalsContact O-N 3.13Å; P587-D591 PolarHBondContact O-N 3.1Å
588	T	88.3	Confident	86.9	Confident	8 Å²	8	58.2 Å²	58.2	5%	0.049	30%	0.301	C	S	.	.	H	α-helix	trans	-65.7	-30.4	-179.4	58.1	0	0	0	0	113.3	E494 P495 E585 G586 I592	E494-T588 HydrophobicContact CG-CG2 4.49Å; P495-T588 HydrophobicContact CB-CG2 4.39Å; P495-T588 HydrophobicContact CG-CG2 3.72Å; E585-T588 PolarHBondContact N-OG1 2.78Å; E585-T588 PolarHBondContact O-N 3.36Å; E585-T588 VanDerWaalsContact O-N 3.11Å; E585-T588 PolarHBondContact O-OG1 3.25Å; G586-T588 PolarHBondContact O-N 3.21Å; T588-I592 WeakPolarHBondContact O-CD1 3.33Å; T588-I592 VanDerWaalsContact O-CG1 3.29Å; T588-I592 WeakPolarHBondContact O-CG1 3.32Å; T588-I592 PolarHBondContact O-N 2.97Å
589	I	87.7	Confident	88.1	Confident	19 Å²	19	51.3 Å²	51.3	10%	0.097	27%	0.271	C	S	.	.	H	α-helix	trans	-67.9	-44.2	174.5	-67.9	169.3	0	0	0	109.8	I570 R581 L584 E585 G586 P587 D591 I592 E593	I570-I589 HydrophobicContact CG2-CG2 4.39Å; R581-I589 HydrophobicContact CG-CD1 3.94Å; R581-I589 VanDerWaalsContact CZ-CG2 3.48Å; R581-I589 VanDerWaalsContact NH1-CG2 3.35Å; L584-I589 HydrophobicContact CB-CD1 4.01Å; L584-I589 HydrophobicContact CB-CG1 3.68Å; L584-I589 HydrophobicContact CD1-CG1 4.37Å; E585-I589 WeakPolarHBondContact O-CG1 3.2Å; E585-I589 PolarHBondContact O-N 3.15Å; E585-I589 VanDerWaalsContact O-N 3.08Å; G586-I589 PolarHBondContact O-N 2.93Å; P587-I589 VanDerWaalsContact C-N 3.27Å; P587-I589 PolarHBondContact O-N 3.26Å; I589-D591 VanDerWaalsContact C-N 3.31Å; I589-D591 PolarHBondContact O-N 3.12Å; I589-I592 PolarHBondContact O-N 3.49Å; I589-E593 HydrophobicContact CG2-CG 4.37Å; I589-E593 WeakPolarHBondContact CG2-OE1 3.45Å; I589-E593 WeakPolarHBondContact O-CB 3.17Å; I589-E593 WeakPolarHBondContact O-CG 3.46Å; I589-E593 PolarHBondContact O-N 3.33Å
590	L	89.8	Confident	88.8	Confident	111 Å²	111	51.7 Å²	51.7	58%	0.581	27%	0.27	S	S	*	.	H	α-helix	trans	-62.4	-38.5	177.9	-65.8	173.1	0	0	0	111.9	G586 P587 E593 K594	G586-L590 PolarHBondContact O-N 3.41Å; P587-L590 WeakPolarHBondContact O-CB 3.46Å; P587-L590 PolarHBondContact O-N 3.25Å; P587-L590 VanDerWaalsContact O-N 3.13Å; L590-E593 PolarHBondContact O-N 2.82Å; L590-K594 VanDerWaalsContact O-CB 3.22Å; L590-K594 WeakPolarHBondContact O-CB 3.29Å; L590-K594 PolarHBondContact O-N 3.45Å
591	D	91.9	Very high	89.3	Confident	72 Å²	72	50.5 Å²	50.5	39%	0.385	26%	0.263	S	S	.	.	H	α-helix	trans	-63.8	-43	176.3	-67.2	-32.3	0	0	0	111.9	T491 P587 I589 K594 F595	T491-D591 HydrophobicContact CG2-CB 3.98Å; P587-D591 PolarHBondContact O-N 3.1Å; I589-D591 VanDerWaalsContact C-N 3.31Å; I589-D591 PolarHBondContact O-N 3.12Å; D591-K594 PolarHBondContact O-N 3.15Å; D591-F595 PolarHBondContact O-N 3.29Å
592	I	92.6	Very high	89.7	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-66.2	-45.6	176.8	-64.5	164.3	0	0	0	110.6	F487 L566 L569 I570 L584 T588 I589 K594 F595 H596	F487-I592 HydrophobicContact CZ-CG1 4.16Å; L566-I592 HydrophobicContact CB-CG2 3.96Å; L566-I592 HydrophobicContact CD2-CG1 4.36Å; L566-I592 HydrophobicContact CD2-CG2 3.9Å; L566-I592 HydrophobicContact CG-CG2 4.42Å; L569-I592 HydrophobicContact CD1-CD1 4.44Å; I570-I592 HydrophobicContact CD1-CG2 4.38Å; I570-I592 HydrophobicContact CG2-CB 3.88Å; I570-I592 HydrophobicContact CG2-CD1 4.45Å; I570-I592 HydrophobicContact CG2-CG2 3.49Å; I570-I592 VanDerWaalsContact CG2-CG2 3.49Å; L584-I592 HydrophobicContact CD1-CD1 4.11Å; T588-I592 WeakPolarHBondContact O-CD1 3.33Å; T588-I592 VanDerWaalsContact O-CG1 3.29Å; T588-I592 WeakPolarHBondContact O-CG1 3.32Å; T588-I592 PolarHBondContact O-N 2.97Å; I589-I592 PolarHBondContact O-N 3.49Å; I592-K594 VanDerWaalsContact C-N 3.32Å; I592-K594 PolarHBondContact O-N 3.06Å; I592-F595 PolarHBondContact O-N 2.85Å; I592-H596 WeakPolarHBondContact O-CB 3.21Å; I592-H596 PolarHBondContact O-N 3.46Å
593	E	91	Very high	90.1	Very high	40 Å²	40	47.4 Å²	47.4	19%	0.187	25%	0.248	C	C	.	.	H	α-helix	trans	-61.6	-40.4	177.3	-76.1	175.7	-177.2	0	0	112	I570 R581 I589 L590 H596 R597	I570-E593 HydrophobicContact CD1-CG 3.93Å; I570-E593 HydrophobicContact CG2-CG 4.32Å; R581-E593 IonicContact CZ-OE1 3.53Å; R581-E593 IonicContact NH1-OE1 2.95Å; R581-E593 PolarHBondContact NH1-OE1 3.38Å; R581-E593 IonicContact NH2-OE1 2.7Å; R581-E593 PolarHBondContact NH2-OE1 3.45Å; I589-E593 HydrophobicContact CG2-CG 4.37Å; I589-E593 WeakPolarHBondContact CG2-OE1 3.45Å; I589-E593 WeakPolarHBondContact O-CB 3.17Å; I589-E593 WeakPolarHBondContact O-CG 3.46Å; I589-E593 PolarHBondContact O-N 3.33Å; L590-E593 PolarHBondContact O-N 2.82Å; E593-H596 PolarHBondContact O-N 2.96Å; E593-R597 VanDerWaalsContact O-CB 3.27Å; E593-R597 WeakPolarHBondContact O-CB 3.46Å; E593-R597 PolarHBondContact O-N 3.35Å
594	K	92.4	Very high	90.5	Very high	119 Å²	119	47.4 Å²	47.4	52%	0.517	24%	0.244	S	C	.	.	H	α-helix	trans	-61.4	-53.5	177.1	-177	179.1	178.2	-175.9	0	110.8	L590 D591 I592 H596 R597 E598	L590-K594 VanDerWaalsContact O-CB 3.22Å; L590-K594 WeakPolarHBondContact O-CB 3.29Å; L590-K594 PolarHBondContact O-N 3.45Å; D591-K594 PolarHBondContact O-N 3.15Å; I592-K594 VanDerWaalsContact C-N 3.32Å; I592-K594 PolarHBondContact O-N 3.06Å; K594-H596 PolarHBondContact O-N 3.36Å; K594-R597 PolarHBondContact O-N 3.38Å; K594-E598 WeakPolarHBondContact CE-OE1 3.25Å; K594-E598 WeakPolarHBondContact CG-OE1 3.48Å; K594-E598 WeakPolarHBondContact O-CG 3.47Å; K594-E598 PolarHBondContact O-N 2.79Å
595	F	94.6	Very high	90.8	Very high	14 Å²	14	46.4 Å²	46.4	6%	0.061	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-41.2	178.7	-177.6	-94.8	0	0	0	112	A483 L484 F487 V562 L566 D591 I592 R597 E598 S599 Y602	A483-F595 HydrophobicContact CB-CE2 4.44Å; L484-F595 HydrophobicContact CB-CZ 4.45Å; L484-F595 HydrophobicContact CD1-CE1 4.36Å; L484-F595 HydrophobicContact CD1-CZ 3.73Å; F487-F595 HydrophobicContact CB-CD2 3.83Å; F487-F595 HydrophobicContact CB-CE2 3.98Å; F487-F595 HydrophobicContact CB-CG 4.31Å; F487-F595 AromaticContact CD1-CD1 3.87Å; F487-F595 HydrophobicContact CD1-CD1 3.87Å; F487-F595 HydrophobicContact CD1-CD2 4.27Å; F487-F595 HydrophobicContact CD1-CE1 4.1Å; F487-F595 HydrophobicContact CD1-CE2 4.49Å; F487-F595 AromaticContact CD1-CG 3.96Å; F487-F595 HydrophobicContact CD1-CG 3.96Å; F487-F595 HydrophobicContact CD1-CZ 4.41Å; F487-F595 HydrophobicContact CD2-CB 3.69Å; F487-F595 HydrophobicContact CD2-CD1 4.47Å; F487-F595 HydrophobicContact CD2-CD2 4.07Å; F487-F595 AromaticContact CD2-CG 3.81Å; F487-F595 HydrophobicContact CD2-CG 3.81Å; F487-F595 AromaticContact CE1-CD1 3.92Å; F487-F595 HydrophobicContact CE1-CD1 3.92Å; F487-F595 HydrophobicContact CE1-CE1 4.41Å; F487-F595 HydrophobicContact CE1-CG 4.21Å; F487-F595 HydrophobicContact CE2-CB 3.63Å; F487-F595 HydrophobicContact CE2-CG 4.06Å; F487-F595 HydrophobicContact CG-CB 4.17Å; F487-F595 HydrophobicContact CG-CD1 4.15Å; F487-F595 AromaticContact CG-CD2 3.79Å; F487-F595 HydrophobicContact CG-CD2 3.79Å; F487-F595 HydrophobicContact CG-CE2 4.23Å; F487-F595 AromaticContact CG-CG 3.75Å; F487-F595 HydrophobicContact CG-CG 3.75Å; F487-F595 HydrophobicContact CZ-CB 4.07Å; F487-F595 HydrophobicContact CZ-CD1 4.23Å; F487-F595 HydrophobicContact CZ-CG 4.25Å; V562-F595 HydrophobicContact CG1-CE1 4.22Å; L566-F595 HydrophobicContact CD1-CD1 3.67Å; L566-F595 HydrophobicContact CD1-CE1 4Å; D591-F595 PolarHBondContact O-N 3.29Å; I592-F595 PolarHBondContact O-N 2.85Å; F595-R597 VanDerWaalsContact C-N 3.31Å; F595-R597 PolarHBondContact O-N 2.8Å; F595-E598 PolarHBondContact O-N 3.34Å; F595-S599 VanDerWaalsContact O-CB 3.23Å; F595-S599 WeakPolarHBondContact O-CB 3.42Å; F595-S599 PolarHBondContact O-N 3.43Å; F595-S599 PolarHBondContact O-OG 3.1Å; F595-Y602 HydrophobicContact CE2-CE2 4.42Å; F595-Y602 HydrophobicContact CZ-CE2 4.46Å
596	H	93.1	Very high	91	Very high	15 Å²	15	44.1 Å²	44.1	7%	0.069	23%	0.229	C	C	.	.	H	α-helix	trans	-62.9	-37.3	177.4	-174	-103.7	0	0	0	112	E155 R563 I570 I592 E593 K594 S599	E155-H596 IonicContact OE2-CE1 3.66Å; R563-H596 PolarHBondContact NH1-O 2.94Å; I570-H596 HydrophobicContact CD1-CB 4.43Å; I592-H596 WeakPolarHBondContact O-CB 3.21Å; I592-H596 PolarHBondContact O-N 3.46Å; E593-H596 PolarHBondContact O-N 2.96Å; K594-H596 PolarHBondContact O-N 3.36Å; H596-S599 PolarHBondContact O-OG 3.17Å
597	R	90.9	Very high	91.3	Very high	138 Å²	138	44.1 Å²	44.1	52%	0.521	22%	0.218	S	C	.	.	H	α-helix	trans	-72.4	-47.2	177.1	-164	-177.7	-53.1	122.1	7.8	112.1	M253 E593 K594 F595 S599 F600	M253-R597 HydrophobicContact CE-CG 4.24Å; M253-R597 HydrophobicContact SD-CG 4.2Å; E593-R597 VanDerWaalsContact O-CB 3.27Å; E593-R597 WeakPolarHBondContact O-CB 3.46Å; E593-R597 PolarHBondContact O-N 3.35Å; K594-R597 PolarHBondContact O-N 3.38Å; F595-R597 VanDerWaalsContact C-N 3.31Å; F595-R597 PolarHBondContact O-N 2.8Å; R597-S599 PolarHBondContact O-N 3.43Å; R597-F600 VanDerWaalsContact O-CB 3.24Å; R597-F600 WeakPolarHBondContact O-CB 3.43Å; R597-F600 PolarHBondContact O-N 3.23Å
598	E	91.4	Very high	91.3	Very high	63 Å²	63	39.9 Å²	39.9	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-65.2	-39	-180	-70.8	-173.5	-142.4	0	0	112.4	R388 K594 F595 F600 Y602	R388-E598 IonicContact CZ-OE2 2.82Å; R388-E598 IonicContact NH1-OE2 3.29Å; R388-E598 PolarHBondContact NH1-OE2 3.35Å; R388-E598 IonicContact NH2-OE2 3.66Å; R388-E598 PolarHBondContact NH2-OE2 2.98Å; R388-E598 VanDerWaalsContact NH2-OE2 3.12Å; K594-E598 WeakPolarHBondContact CE-OE1 3.25Å; K594-E598 WeakPolarHBondContact CG-OE1 3.48Å; K594-E598 WeakPolarHBondContact O-CG 3.47Å; K594-E598 PolarHBondContact O-N 2.79Å; F595-E598 PolarHBondContact O-N 3.34Å; E598-F600 PolarHBondContact O-N 3.2Å; E598-F600 VanDerWaalsContact O-N 3.15Å; E598-Y602 WeakPolarHBondContact O-CE1 3.3Å
599	S	94.5	Very high	91.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-72.2	-2.2	-180	61.2	0	0	0	0	114.7	R563 F595 H596 R597 F601 Y602	R563-S599 PolarHBondContact NH1-O 3.45Å; R563-S599 PolarHBondContact NH1-OG 3.33Å; F595-S599 VanDerWaalsContact O-CB 3.23Å; F595-S599 WeakPolarHBondContact O-CB 3.42Å; F595-S599 PolarHBondContact O-N 3.43Å; F595-S599 PolarHBondContact O-OG 3.1Å; H596-S599 PolarHBondContact O-OG 3.17Å; R597-S599 PolarHBondContact O-N 3.43Å; S599-F601 VanDerWaalsContact C-N 3.35Å; S599-Y602 VanDerWaalsContact CB-CE2 3.45Å; S599-Y602 PolarHBondContact O-N 3.28Å
600	F	94.3	Very high	91	Very high	34 Å²	34	43 Å²	43	15%	0.149	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-61.1	-43.9	176.6	179.3	-94.5	0	0	0	111.6	Y248 M253 R563 R597 E598 Y602	Y248-F600 HydrophobicContact CD2-CE2 4.49Å; Y248-F600 AromaticContact CE2-CE2 3.74Å; Y248-F600 HydrophobicContact CE2-CE2 3.74Å; Y248-F600 HydrophobicContact CE2-CZ 4.18Å; M253-F600 VanDerWaalsContact C-CE1 3.49Å; M253-F600 HydrophobicContact CB-CE1 4.25Å; M253-F600 HydrophobicContact CB-CE2 4.33Å; M253-F600 HydrophobicContact CB-CZ 4.04Å; M253-F600 HydrophobicContact CE-CB 3.6Å; M253-F600 HydrophobicContact CE-CD1 3.82Å; M253-F600 HydrophobicContact CE-CD2 3.57Å; M253-F600 HydrophobicContact CE-CE1 4.39Å; M253-F600 HydrophobicContact CE-CE2 4.16Å; M253-F600 HydrophobicContact CE-CG 3.38Å; M253-F600 WeakPolarHBondContact O-CZ 3.43Å; R563-F600 VanDerWaalsContact NH1-N 3.15Å; R597-F600 VanDerWaalsContact O-CB 3.24Å; R597-F600 WeakPolarHBondContact O-CB 3.43Å; R597-F600 PolarHBondContact O-N 3.23Å; E598-F600 PolarHBondContact O-N 3.2Å; E598-F600 VanDerWaalsContact O-N 3.15Å; F600-Y602 VanDerWaalsContact C-N 3.33Å; F600-Y602 PolarHBondContact O-N 2.74Å
601	F	94.7	Very high	91.1	Very high	23 Å²	23	37.9 Å²	37.9	10%	0.101	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-84.5	-1.7	-176.6	-60.4	-71.9	0	0	0	114.1	L255 L395 S599 T603 H604 L605	L255-F601 HydrophobicContact CB-CD1 4.38Å; L255-F601 HydrophobicContact CB-CE1 4.34Å; L395-F601 HydrophobicContact CD1-CB 4.02Å; L395-F601 HydrophobicContact CD1-CD1 4.02Å; L395-F601 HydrophobicContact CD1-CD2 4.46Å; L395-F601 HydrophobicContact CD1-CG 3.92Å; L395-F601 HydrophobicContact CD2-CB 4.42Å; L395-F601 HydrophobicContact CD2-CD2 4.11Å; L395-F601 HydrophobicContact CD2-CG 4.29Å; S599-F601 VanDerWaalsContact C-N 3.35Å; F601-T603 VanDerWaalsContact C-N 3.33Å; F601-T603 PolarHBondContact O-N 3.28Å; F601-H604 PolarHBondContact O-N 3.1Å; F601-L605 HydrophobicContact CB-CD1 4.17Å; F601-L605 WeakPolarHBondContact O-CG 3.47Å; F601-L605 PolarHBondContact O-N 3.46Å
602	Y	94.3	Very high	91	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-63.3	-38.7	-174	-71.9	0.8	0	0	0	112.2	F391 V480 L559 F595 E598 S599 F600 L605 I606	F391-Y602 HydrophobicContact CE2-CD1 4.08Å; F391-Y602 HydrophobicContact CE2-CE1 4.06Å; F391-Y602 AromaticContact CZ-CD1 3.94Å; F391-Y602 HydrophobicContact CZ-CD1 3.94Å; F391-Y602 AromaticContact CZ-CE1 3.7Å; F391-Y602 HydrophobicContact CZ-CE1 3.7Å; V480-Y602 HydrophobicContact CB-CD2 4.4Å; V480-Y602 HydrophobicContact CG1-CD2 3.65Å; V480-Y602 HydrophobicContact CG1-CE2 4.05Å; V480-Y602 HydrophobicContact CG1-CG 4.1Å; V480-Y602 HydrophobicContact CG2-CD1 3.88Å; V480-Y602 HydrophobicContact CG2-CD2 4.08Å; V480-Y602 HydrophobicContact CG2-CE1 4.21Å; V480-Y602 HydrophobicContact CG2-CE2 4.38Å; V480-Y602 HydrophobicContact CG2-CG 3.82Å; L559-Y602 HydrophobicContact CD1-CD2 4.16Å; F595-Y602 HydrophobicContact CE2-CE2 4.42Å; F595-Y602 HydrophobicContact CZ-CE2 4.46Å; E598-Y602 WeakPolarHBondContact O-CE1 3.3Å; S599-Y602 VanDerWaalsContact CB-CE2 3.45Å; S599-Y602 PolarHBondContact O-N 3.28Å; F600-Y602 VanDerWaalsContact C-N 3.33Å; F600-Y602 PolarHBondContact O-N 2.74Å; Y602-L605 PolarHBondContact O-N 3.21Å; Y602-I606 WeakPolarHBondContact O-CB 3.45Å; Y602-I606 WeakPolarHBondContact O-CG1 3.49Å; Y602-I606 PolarHBondContact O-N 3.34Å
603	T	90.4	Very high	90.8	Very high	64 Å²	64	38.8 Å²	38.8	39%	0.393	18%	0.181	S	C	.	.	H	α-helix	trans	-63.1	-45	178.3	-51.8	0	0	0	0	111.2	F601 I606 N607	F601-T603 VanDerWaalsContact C-N 3.33Å; F601-T603 PolarHBondContact O-N 3.28Å; T603-I606 PolarHBondContact O-N 3.36Å; T603-N607 WeakPolarHBondContact O-CB 3.35Å; T603-N607 PolarHBondContact O-N 2.8Å; T603-N607 PolarHBondContact O-ND2 3.31Å
604	H	92.1	Very high	90.7	Very high	28 Å²	28	39.8 Å²	39.8	13%	0.13	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-44.8	176.6	-61.7	93.4	0	0	0	112.2	L255 E259 F601 N607 F608 T611	L255-H604 HydrophobicContact CD2-CB 3.52Å; E259-H604 IonicContact OE1-CD2 2.73Å; E259-H604 IonicContact OE1-CE1 2.85Å; E259-H604 IonicContact OE1-NE2 2.83Å; E259-H604 PolarHBondContact OE1-NE2 3.17Å; E259-H604 IonicContact OE2-NE2 2.69Å; F601-H604 PolarHBondContact O-N 3.1Å; H604-N607 CarbonylContact O-C 3.59Å; H604-N607 PolarHBondContact O-N 3.2Å; H604-F608 PolarHBondContact O-N 3.34Å; H604-T611 HydrophobicContact CB-CG2 4.03Å; H604-T611 PolarHBondContact O-OG1 3.04Å
605	L	90.4	Very high	90.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-71.2	-34.6	-178.3	-69.5	170.1	0	0	0	112.4	F391 A394 L395 L398 I476 F601 Y602 N607 F608	F391-L605 HydrophobicContact CD2-CD1 3.95Å; F391-L605 HydrophobicContact CE1-CD1 3.99Å; F391-L605 HydrophobicContact CE2-CB 4.44Å; F391-L605 HydrophobicContact CE2-CD1 3.25Å; F391-L605 HydrophobicContact CE2-CG 4.45Å; F391-L605 HydrophobicContact CZ-CD1 3.25Å; A394-L605 HydrophobicContact CB-CD2 4.17Å; L395-L605 HydrophobicContact CB-CD1 4.14Å; L395-L605 HydrophobicContact CB-CD2 4Å; L395-L605 HydrophobicContact CD1-CD1 4.31Å; L395-L605 HydrophobicContact CD1-CD2 4.32Å; L395-L605 HydrophobicContact CD1-CG 4.48Å; L395-L605 HydrophobicContact CD2-CD1 4.5Å; L398-L605 HydrophobicContact CD1-CD2 3.96Å; I476-L605 HydrophobicContact CD1-CB 4.1Å; I476-L605 HydrophobicContact CD1-CD2 4.25Å; I476-L605 WeakPolarHBondContact CD1-O 3.29Å; I476-L605 HydrophobicContact CG1-CB 4.43Å; I476-L605 HydrophobicContact CG2-CB 3.73Å; F601-L605 HydrophobicContact CB-CD1 4.17Å; F601-L605 WeakPolarHBondContact O-CG 3.47Å; F601-L605 PolarHBondContact O-N 3.46Å; Y602-L605 PolarHBondContact O-N 3.21Å; L605-N607 VanDerWaalsContact C-N 3.29Å; L605-F608 WeakPolarHBondContact O-CB 3.43Å; L605-F608 PolarHBondContact O-N 3.46Å
606	I	87.1	Confident	90.7	Very high	38 Å²	38	33.6 Å²	33.6	20%	0.195	16%	0.16	C	C	.	.	H	α-helix	trans	-65.9	-36.5	172.1	-68.5	-70.7	0	0	0	110.6	I476 R477 Y602 T603 F608	I476-I606 HydrophobicContact CG2-CD1 4.03Å; I476-I606 HydrophobicContact CG2-CG1 4.44Å; R477-I606 HydrophobicContact CG-CD1 3.74Å; Y602-I606 WeakPolarHBondContact O-CB 3.45Å; Y602-I606 WeakPolarHBondContact O-CG1 3.49Å; Y602-I606 PolarHBondContact O-N 3.34Å; T603-I606 PolarHBondContact O-N 3.36Å; I606-F608 VanDerWaalsContact C-N 3.3Å; I606-F608 PolarHBondContact O-N 3.33Å
607	N	88.4	Confident	90.6	Very high	48 Å²	48	35.7 Å²	35.7	26%	0.257	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	47.4	174.1	-61.5	-26.7	0	0	0	111.4	T603 H604 L605 S609 E610 T611	T603-N607 WeakPolarHBondContact O-CB 3.35Å; T603-N607 PolarHBondContact O-N 2.8Å; T603-N607 PolarHBondContact O-ND2 3.31Å; H604-N607 CarbonylContact O-C 3.59Å; H604-N607 PolarHBondContact O-N 3.2Å; L605-N607 VanDerWaalsContact C-N 3.29Å; N607-S609 PolarHBondContact O-N 3.28Å; N607-E610 PolarHBondContact O-N 3.36Å; N607-T611 WeakPolarHBondContact O-CB 3.49Å; N607-T611 PolarHBondContact O-N 3.09Å; N607-T611 PolarHBondContact O-OG1 3.38Å
608	F	86.7	Confident	90.9	Very high	1 Å²	1	29.2 Å²	29.2	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-55.2	-46.2	-170.9	-179.2	-97	0	0	0	113.2	A394 L398 M465 E469 F472 I476 H604 L605 I606 E610 T611 L612	A394-F608 HydrophobicContact CB-CD2 4.3Å; A394-F608 HydrophobicContact CB-CE2 3.92Å; L398-F608 HydrophobicContact CD1-CD2 3.79Å; L398-F608 HydrophobicContact CD1-CE2 3.78Å; L398-F608 HydrophobicContact CD2-CE2 4.15Å; L398-F608 HydrophobicContact CG-CD2 4.39Å; L398-F608 HydrophobicContact CG-CE2 3.91Å; M465-F608 HydrophobicContact CB-CZ 4.18Å; M465-F608 HydrophobicContact CE-CE2 3.96Å; M465-F608 HydrophobicContact CE-CZ 3.74Å; E469-F608 HydrophobicContact CB-CD1 4.36Å; E469-F608 HydrophobicContact CB-CE1 4.4Å; E469-F608 HydrophobicContact CG-CD1 4.08Å; F472-F608 AromaticContact CD2-CE1 3.94Å; F472-F608 HydrophobicContact CD2-CE1 3.94Å; F472-F608 HydrophobicContact CD2-CE2 4.06Å; F472-F608 AromaticContact CD2-CZ 3.57Å; F472-F608 HydrophobicContact CD2-CZ 3.57Å; F472-F608 AromaticContact CE2-CZ 3.98Å; F472-F608 HydrophobicContact CE2-CZ 3.98Å; F472-F608 HydrophobicContact CG-CZ 4.46Å; I476-F608 HydrophobicContact CD1-CD2 4.28Å; H604-F608 PolarHBondContact O-N 3.34Å; L605-F608 WeakPolarHBondContact O-CB 3.43Å; L605-F608 PolarHBondContact O-N 3.46Å; I606-F608 VanDerWaalsContact C-N 3.3Å; I606-F608 PolarHBondContact O-N 3.33Å; F608-E610 PolarHBondContact O-N 2.87Å; F608-T611 PolarHBondContact O-N 2.89Å; F608-L612 HydrophobicContact CE1-CD2 4.04Å; F608-L612 HydrophobicContact CZ-CD2 4.49Å; F608-L612 VanDerWaalsContact O-CB 3.29Å; F608-L612 WeakPolarHBondContact O-CB 3.41Å; F608-L612 PolarHBondContact O-N 3.03Å
609	S	84.1	Confident	91	Very high	14 Å²	14	26.2 Å²	26.2	10%	0.098	13%	0.133	C	C	.	.	H	α-helix	trans	-62.2	-45.7	-175.3	-156.4	0	0	0	0	112.6	Q39 E469 N607 L612 Q613	Q39-S609 VanDerWaalsContact NE2-CB 3.33Å; Q39-S609 PolarHBondContact NE2-OG 3.34Å; E469-S609 WeakPolarHBondContact OE1-CB 3.46Å; E469-S609 PolarHBondContact OE1-OG 3.25Å; E469-S609 PolarHBondContact OE2-OG 2.78Å; N607-S609 PolarHBondContact O-N 3.28Å; S609-L612 PolarHBondContact O-N 3.5Å; S609-Q613 PolarHBondContact O-N 2.94Å
610	E	87	Confident	91.1	Very high	77 Å²	77	27.6 Å²	27.6	36%	0.36	14%	0.139	S	C	.	.	H	α-helix	trans	-66.9	-44.1	176.8	-175.2	179.1	-169.2	0	0	111.1	N607 F608 L612 Q613 Q614	N607-E610 PolarHBondContact O-N 3.36Å; F608-E610 PolarHBondContact O-N 2.87Å; E610-L612 VanDerWaalsContact C-N 3.29Å; E610-L612 PolarHBondContact O-N 3.31Å; E610-Q613 PolarHBondContact O-N 3.4Å; E610-Q614 WeakPolarHBondContact O-CG 3.3Å; E610-Q614 PolarHBondContact O-N 3.47Å; E610-Q614 PolarHBondContact OE1-NE2 2.74Å
611	T	90.6	Very high	91.2	Very high	4 Å²	4	26.1 Å²	26.1	3%	0.025	13%	0.133	C	C	.	.	H	α-helix	trans	-61.8	-38.8	178.2	-55.9	0	0	0	0	111.5	L255 L398 H604 N607 F608 Q613 Q614 C615	L255-T611 HydrophobicContact CD2-CG2 3.43Å; L255-T611 VanDerWaalsContact CD2-CG2 3.43Å; L255-T611 HydrophobicContact CG-CG2 4.25Å; L398-T611 HydrophobicContact CD1-CG2 3.9Å; L398-T611 HydrophobicContact CD2-CG2 4.24Å; H604-T611 HydrophobicContact CB-CG2 4.03Å; H604-T611 PolarHBondContact O-OG1 3.04Å; N607-T611 WeakPolarHBondContact O-CB 3.49Å; N607-T611 PolarHBondContact O-N 3.09Å; N607-T611 PolarHBondContact O-OG1 3.38Å; F608-T611 PolarHBondContact O-N 2.89Å; T611-Q613 VanDerWaalsContact C-N 3.34Å; T611-Q613 PolarHBondContact O-N 3.45Å; T611-Q614 PolarHBondContact O-N 3.47Å; T611-C615 WeakPolarHBondContact O-CB 3.28Å; T611-C615 PolarHBondContact O-N 3.08Å; T611-C615 PolarHBondContact O-SG 3.33Å; T611-C615 VanDerWaalsContact O-SG 3.39Å
612	L	90.8	Very high	91.3	Very high	9 Å²	9	25.1 Å²	25.1	5%	0.047	13%	0.128	C	C	.	.	H	α-helix	trans	-60.1	-44.4	176.7	179.9	62.2	0	0	0	111.3	L398 L401 Q462 M465 F608 S609 E610 C615 C616	L398-L612 HydrophobicContact CD2-CB 3.93Å; L398-L612 HydrophobicContact CD2-CD1 3.83Å; L401-L612 HydrophobicContact CD1-CD1 3.48Å; L401-L612 VanDerWaalsContact CD1-CD1 3.48Å; Q462-L612 HydrophobicContact CG-CD1 4.3Å; Q462-L612 HydrophobicContact CG-CD2 4.41Å; Q462-L612 HydrophobicContact CG-CG 4.15Å; M465-L612 HydrophobicContact CB-CD1 3.81Å; M465-L612 HydrophobicContact CB-CD2 4Å; M465-L612 HydrophobicContact CG-CD1 4.39Å; F608-L612 HydrophobicContact CE1-CD2 4.04Å; F608-L612 HydrophobicContact CZ-CD2 4.49Å; F608-L612 VanDerWaalsContact O-CB 3.29Å; F608-L612 WeakPolarHBondContact O-CB 3.41Å; F608-L612 PolarHBondContact O-N 3.03Å; S609-L612 PolarHBondContact O-N 3.5Å; E610-L612 VanDerWaalsContact C-N 3.29Å; E610-L612 PolarHBondContact O-N 3.31Å; L612-C615 PolarHBondContact O-N 3.45Å; L612-C616 PolarHBondContact O-N 3.35Å; L612-C616 PolarHBondContact O-SG 3.48Å; L612-C616 VanDerWaalsContact O-SG 3.33Å
613	Q	87.8	Confident	91.5	Very high	83 Å²	83	25 Å²	25	39%	0.388	13%	0.128	S	C	.	.	H	α-helix	trans	-63.5	-44.8	175.7	-66.4	177.2	6.2	0	0	111.6	S609 E610 T611 C615 C616 D617	S609-Q613 PolarHBondContact O-N 2.94Å; E610-Q613 PolarHBondContact O-N 3.4Å; T611-Q613 VanDerWaalsContact C-N 3.34Å; T611-Q613 PolarHBondContact O-N 3.45Å; Q613-C615 VanDerWaalsContact C-N 3.31Å; Q613-C615 PolarHBondContact O-N 2.89Å; Q613-C616 CarbonylContact O-C 3.25Å; Q613-C616 PolarHBondContact O-N 2.77Å; Q613-C616 VanDerWaalsContact O-N 3.07Å; Q613-D617 PolarHBondContact O-N 2.74Å; Q613-D617 VanDerWaalsContact O-N 3.14Å
614	Q	89.6	Confident	91.8	Very high	61 Å²	61	22 Å²	22	29%	0.285	11%	0.109	S	C	.	.	H	α-helix	trans	-65.5	-32.2	179.5	-66.5	174.6	4.6	0	0	113	T256 E610 T611 C616	T256-Q614 HydrophobicContact CG2-CB 3.72Å; E610-Q614 WeakPolarHBondContact O-CG 3.3Å; E610-Q614 PolarHBondContact O-N 3.47Å; E610-Q614 PolarHBondContact OE1-NE2 2.74Å; T611-Q614 PolarHBondContact O-N 3.47Å; Q614-C616 VanDerWaalsContact C-N 3.26Å; Q614-C616 PolarHBondContact O-N 2.87Å
615	C	93.8	Very high	92	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-73	-17	173.8	-73.6	0	0	0	0	113.5	L398 L401 S405 T611 L612 Q613	L398-C615 HydrophobicContact CD2-CB 4.47Å; L398-C615 PolarHBondContact O-SG 3.03Å; L401-C615 CarbonylContact C-O 3.53Å; L401-C615 HydrophobicContact CB-CB 4.2Å; S405-C615 VanDerWaalsContact CB-O 3.27Å; S405-C615 WeakPolarHBondContact CB-O 3.42Å; S405-C615 PolarHBondContact OG-O 3.04Å; T611-C615 WeakPolarHBondContact O-CB 3.28Å; T611-C615 PolarHBondContact O-N 3.08Å; T611-C615 PolarHBondContact O-SG 3.33Å; T611-C615 VanDerWaalsContact O-SG 3.39Å; L612-C615 PolarHBondContact O-N 3.45Å; Q613-C615 VanDerWaalsContact C-N 3.31Å; Q613-C615 PolarHBondContact O-N 2.89Å
616	C	92.7	Very high	92.3	Very high	4 Å²	4	22.9 Å²	22.9	3%	0.027	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	13.3	-176.7	-62.4	0	0	0	0	113.2	I458 Q462 L612 Q613 Q614 L618	I458-C616 HydrophobicContact CG2-CB 3.92Å; Q462-C616 HydrophobicContact CG-CB 4.17Å; L612-C616 PolarHBondContact O-N 3.35Å; L612-C616 PolarHBondContact O-SG 3.48Å; L612-C616 VanDerWaalsContact O-SG 3.33Å; Q613-C616 CarbonylContact O-C 3.25Å; Q613-C616 PolarHBondContact O-N 2.77Å; Q613-C616 VanDerWaalsContact O-N 3.07Å; Q614-C616 VanDerWaalsContact C-N 3.26Å; Q614-C616 PolarHBondContact O-N 2.87Å; C616-L618 PolarHBondContact O-N 2.99Å
617	D	92.1	Very high	92.7	Very high	59 Å²	59	21.6 Å²	21.6	32%	0.316	11%	0.106	S	C	.	.			trans	-73.1	113.3	-175.2	-175.1	15.7	0	0	0	111.9	Q613 S619	Q613-D617 PolarHBondContact O-N 2.74Å; Q613-D617 VanDerWaalsContact O-N 3.14Å; D617-S619 WeakPolarHBondContact OD1-CB 3.31Å; D617-S619 PolarHBondContact OD1-N 3.2Å; D617-S619 PolarHBondContact OD1-OG 3.32Å
618	L	95.8	Very high	93	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	10%	0.096	C	C	.	.			trans	-120.9	13	176.4	-57.7	173.3	0	0	0	112	V408 M409 I455 I458 C616 Q620 L621 L670	V408-L618 HydrophobicContact CB-CD2 4.21Å; V408-L618 HydrophobicContact CG1-CD2 4.18Å; M409-L618 HydrophobicContact CE-CB 4.44Å; M409-L618 HydrophobicContact CE-CD2 3.51Å; M409-L618 HydrophobicContact SD-CD2 4.45Å; I455-L618 HydrophobicContact CB-CD1 4.42Å; I455-L618 HydrophobicContact CG1-CD1 4.04Å; I455-L618 HydrophobicContact CG2-CD1 4.06Å; I458-L618 HydrophobicContact CD1-CD1 4.19Å; I458-L618 HydrophobicContact CD1-CD2 4.4Å; I458-L618 HydrophobicContact CG2-CD1 4.45Å; C616-L618 PolarHBondContact O-N 2.99Å; L618-Q620 PolarHBondContact O-N 3.17Å; L618-Q620 VanDerWaalsContact O-N 3.15Å; L618-L621 HydrophobicContact CB-CD1 4.45Å; L618-L621 PolarHBondContact O-N 3.45Å; L618-L670 HydrophobicContact CB-CD2 3.72Å; L618-L670 HydrophobicContact CD1-CD2 4Å
619	S	93.9	Very high	93.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-61	-24.5	-175.2	60.2	0	0	0	0	114.2	D617 L621 F623 D673 S674 Y677	D617-S619 WeakPolarHBondContact OD1-CB 3.31Å; D617-S619 PolarHBondContact OD1-N 3.2Å; D617-S619 PolarHBondContact OD1-OG 3.32Å; S619-L621 PolarHBondContact O-N 2.86Å; S619-F623 VanDerWaalsContact O-CD2 3.26Å; S619-F623 WeakPolarHBondContact O-CD2 3.11Å; S619-F623 WeakPolarHBondContact O-CE2 3.35Å; S619-D673 WeakPolarHBondContact CB-O 3.19Å; S619-S674 PolarHBondContact O-OG 3.23Å; S619-Y677 WeakPolarHBondContact OG-CD2 3.35Å
620	Q	95.9	Very high	93.9	Very high	30 Å²	30	23.7 Å²	23.7	14%	0.14	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-74.7	-11	-173.4	-56.3	-53.7	-60.7	0	0	114	L618 W622	L618-Q620 PolarHBondContact O-N 3.17Å; L618-Q620 VanDerWaalsContact O-N 3.15Å; Q620-W622 VanDerWaalsContact C-N 3.27Å; Q620-W622 PolarHBondContact O-N 2.85Å
621	L	96.6	Very high	94.2	Very high	3 Å²	3	20.9 Å²	20.9	2%	0.016	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-65.2	-26.8	-178.9	-70	175.6	0	0	0	113.9	V408 M409 Y412 L618 S619 M644 L670	V408-L621 HydrophobicContact CG1-CD1 4.43Å; M409-L621 HydrophobicContact CE-CD1 3.87Å; M409-L621 HydrophobicContact CE-CD2 3.57Å; M409-L621 HydrophobicContact CE-CG 3.59Å; M409-L621 HydrophobicContact SD-CD2 4.47Å; M409-L621 HydrophobicContact SD-CG 4.48Å; Y412-L621 HydrophobicContact CD1-CD2 3.77Å; Y412-L621 HydrophobicContact CD2-CD2 3.75Å; Y412-L621 HydrophobicContact CE1-CD2 4.15Å; Y412-L621 HydrophobicContact CE2-CD2 4.14Å; Y412-L621 HydrophobicContact CG-CD2 3.53Å; L618-L621 HydrophobicContact CB-CD1 4.45Å; L618-L621 PolarHBondContact O-N 3.45Å; S619-L621 PolarHBondContact O-N 2.86Å; L621-M644 HydrophobicContact CB-CB 4.21Å; L621-M644 WeakPolarHBondContact O-CB 3.42Å; L621-L670 HydrophobicContact CD1-CD1 3.83Å; L621-L670 HydrophobicContact CD1-CD2 4.1Å
622	W	98.1	Very high	94.3	Very high	1 Å²	1	27.7 Å²	27.7	0%	0.004	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-38	-177.9	-177.1	84.6	0	0	0	113.4	Q620 R624 P645 Y671 S674 L687 E690 I691 E694	Q620-W622 VanDerWaalsContact C-N 3.27Å; Q620-W622 PolarHBondContact O-N 2.85Å; W622-R624 WeakPolarHBondContact O-CD 3.17Å; W622-R624 PolarHBondContact O-NH1 3.26Å; W622-P645 HydrophobicContact CB-CG 4.16Å; W622-Y671 AromaticContact CD1-CE1 3.66Å; W622-Y671 AromaticContact NE1-CE1 3.92Å; W622-S674 WeakPolarHBondContact CB-OG 3.07Å; W622-L687 HydrophobicContact CZ3-CD2 4.48Å; W622-E690 HydrophobicContact CH2-CB 3.89Å; W622-E690 HydrophobicContact CZ2-CB 4.19Å; W622-I691 HydrophobicContact CD2-CD1 4.3Å; W622-I691 HydrophobicContact CD2-CG1 3.69Å; W622-I691 HydrophobicContact CE3-CD1 3.8Å; W622-I691 HydrophobicContact CE3-CG1 3.56Å; W622-I691 HydrophobicContact CH2-CD1 4.27Å; W622-I691 HydrophobicContact CH2-CG1 3.44Å; W622-I691 VanDerWaalsContact CH2-CG1 3.44Å; W622-I691 HydrophobicContact CZ2-CB 4.38Å; W622-I691 HydrophobicContact CZ2-CG1 3.54Å; W622-I691 HydrophobicContact CZ3-CD1 3.79Å; W622-I691 HydrophobicContact CZ3-CG1 3.44Å; W622-I691 VanDerWaalsContact CZ3-CG1 3.44Å; W622-E694 PolarHBondContact NE1-OE1 3.24Å; W622-E694 VanDerWaalsContact NE1-OE1 3.16Å; W622-E694 PolarHBondContact NE1-OE2 3.48Å
623	F	97.6	Very high	94.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.157	C	C	.	.			trans	-66	146.2	-174.3	-61.8	-70.6	0	0	0	112	Y84 D310 S619 S674 Y677 A678 F682 L687 I691	Y84-F623 WeakPolarHBondContact OH-CB 3.12Å; D310-F623 WeakPolarHBondContact CB-O 3.34Å; S619-F623 VanDerWaalsContact O-CD2 3.26Å; S619-F623 WeakPolarHBondContact O-CD2 3.11Å; S619-F623 WeakPolarHBondContact O-CE2 3.35Å; F623-S674 WeakPolarHBondContact CZ-O 3.1Å; F623-Y677 HydrophobicContact CE2-CD1 4.06Å; F623-Y677 HydrophobicContact CE2-CG 4.33Å; F623-Y677 HydrophobicContact CZ-CD1 4.34Å; F623-A678 HydrophobicContact CE1-CB 4.22Å; F623-A678 HydrophobicContact CZ-CB 4.1Å; F623-F682 HydrophobicContact CD1-CD2 4.21Å; F623-F682 AromaticContact CD1-CE2 3.73Å; F623-F682 HydrophobicContact CD1-CE2 3.73Å; F623-F682 AromaticContact CD2-CE2 3.79Å; F623-F682 HydrophobicContact CD2-CE2 3.79Å; F623-F682 AromaticContact CE1-CD2 3.7Å; F623-F682 HydrophobicContact CE1-CD2 3.7Å; F623-F682 AromaticContact CE1-CE2 3.62Å; F623-F682 HydrophobicContact CE1-CE2 3.62Å; F623-F682 HydrophobicContact CE2-CD2 4.25Å; F623-F682 AromaticContact CE2-CE2 3.68Å; F623-F682 HydrophobicContact CE2-CE2 3.68Å; F623-F682 AromaticContact CG-CE2 3.82Å; F623-F682 HydrophobicContact CG-CE2 3.82Å; F623-F682 AromaticContact CZ-CD2 3.72Å; F623-F682 HydrophobicContact CZ-CD2 3.72Å; F623-F682 AromaticContact CZ-CE2 3.58Å; F623-F682 HydrophobicContact CZ-CE2 3.58Å; F623-L687 HydrophobicContact CE1-CD1 4.16Å; F623-I691 HydrophobicContact CE1-CD1 4.31Å; F623-I691 HydrophobicContact CZ-CD1 4.47Å
624	R	97.2	Very high	94.5	Very high	1 Å²	1	32.8 Å²	32.8	0%	0.004	17%	0.166	C	C	.	.			trans	-157.1	31.1	-168.8	53.6	-152.9	-179.9	-143.9	6.1	114.6	D310 Y435 W622 F626 F627 L628 F638 S643 E694	D310-R624 WeakPolarHBondContact OD2-CA 3.21Å; Y435-R624 HydrophobicContact CE1-CB 4.34Å; Y435-R624 HydrophobicContact CE2-CB 4.15Å; Y435-R624 WeakPolarHBondContact OH-CB 3.44Å; Y435-R624 WeakPolarHBondContact OH-CD 3.31Å; W622-R624 WeakPolarHBondContact O-CD 3.17Å; W622-R624 PolarHBondContact O-NH1 3.26Å; R624-F626 VanDerWaalsContact C-N 3.33Å; R624-F626 PolarHBondContact O-N 3.29Å; R624-F627 PolarHBondContact O-N 3.11Å; R624-L628 VanDerWaalsContact O-CG 3.3Å; R624-L628 WeakPolarHBondContact O-CG 3.5Å; R624-L628 PolarHBondContact O-N 3.43Å; R624-F638 HydrophobicContact CB-CD2 4.26Å; R624-F638 HydrophobicContact CB-CE2 4.36Å; R624-F638 HydrophobicContact CG-CD2 3.85Å; R624-F638 HydrophobicContact CG-CE2 4.37Å; R624-S643 VanDerWaalsContact NH1-CB 3.28Å; R624-S643 PolarHBondContact NH1-OG 3.24Å; R624-E694 IonicContact CZ-OE2 2.77Å; R624-E694 IonicContact NH1-OE2 3.21Å; R624-E694 IonicContact NH2-OE2 3.68Å; R624-E694 PolarHBondContact NH2-OE2 2.88Å
625	E	96.3	Very high	94.6	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.009	17%	0.167	C	C	.	.	H	α-helix	trans	-69.9	-29.9	-173.5	-65.9	-60.7	125.4	0	0	112.8	Y84 R87 D310 E629	Y84-E625 HydrophobicContact CD1-CB 4.37Å; Y84-E625 HydrophobicContact CD1-CG 4.3Å; Y84-E625 HydrophobicContact CD2-CB 4.27Å; Y84-E625 HydrophobicContact CE1-CB 3.96Å; Y84-E625 HydrophobicContact CE1-CG 3.81Å; Y84-E625 HydrophobicContact CE2-CB 3.84Å; R87-E625 IonicContact CZ-OE1 2.73Å; R87-E625 IonicContact CZ-OE2 3.79Å; R87-E625 IonicContact NE-OE1 3.29Å; R87-E625 PolarHBondContact NE-OE1 3.45Å; R87-E625 IonicContact NE-OE2 3.11Å; R87-E625 PolarHBondContact NE-OE2 3.33Å; R87-E625 IonicContact NH2-OE1 2.8Å; R87-E625 PolarHBondContact NH2-OE1 3.11Å; R87-E625 IonicContact NH2-OE2 2.72Å; D310-E625 PolarHBondContact OD1-N 3.43Å; E625-E629 PolarHBondContact O-N 2.99Å
626	F	96.1	Very high	94.5	Very high	44 Å²	44	40.4 Å²	40.4	19%	0.193	20%	0.201	C	C	.	.	H	α-helix	trans	-66.9	-50.3	175.2	164.3	-97.5	0	0	0	110.7	M177 D310 M311 R624 L628 E629 L630	M177-F626 HydrophobicContact CB-CD2 4.11Å; M177-F626 HydrophobicContact CB-CE2 4.13Å; M177-F626 HydrophobicContact CE-CB 4.38Å; M177-F626 HydrophobicContact CE-CD2 4.45Å; M177-F626 HydrophobicContact CG-CD2 4.08Å; M177-F626 HydrophobicContact SD-CB 4.32Å; M177-F626 HydrophobicContact SD-CD2 3.72Å; D310-F626 VanDerWaalsContact OD1-CB 3.31Å; D310-F626 WeakPolarHBondContact OD1-CB 3.3Å; D310-F626 PolarHBondContact OD1-N 3.43Å; D310-F626 WeakPolarHBondContact OD2-CB 3.29Å; D310-F626 PolarHBondContact OD2-N 3.06Å; M311-F626 HydrophobicContact CB-CB 4.1Å; M311-F626 HydrophobicContact CB-CD2 4.17Å; M311-F626 HydrophobicContact CB-CG 4.07Å; M311-F626 HydrophobicContact CG-CD2 3.9Å; M311-F626 HydrophobicContact CG-CE2 4.15Å; M311-F626 HydrophobicContact CG-CG 4.25Å; M311-F626 HydrophobicContact SD-CD2 4.18Å; M311-F626 HydrophobicContact SD-CE2 4.45Å; R624-F626 VanDerWaalsContact C-N 3.33Å; R624-F626 PolarHBondContact O-N 3.29Å; F626-L628 VanDerWaalsContact C-N 3.28Å; F626-L628 PolarHBondContact O-N 3.32Å; F626-E629 WeakPolarHBondContact O-CB 3.38Å; F626-E629 PolarHBondContact O-N 3.32Å; F626-L630 HydrophobicContact CD1-CD1 4.18Å; F626-L630 HydrophobicContact CE1-CD1 3.53Å; F626-L630 HydrophobicContact CE1-CG 4.36Å; F626-L630 HydrophobicContact CE2-CD1 4.21Å; F626-L630 HydrophobicContact CE2-CD2 4.41Å; F626-L630 HydrophobicContact CE2-CG 4.34Å; F626-L630 HydrophobicContact CZ-CD1 3.55Å; F626-L630 HydrophobicContact CZ-CD2 4.44Å; F626-L630 HydrophobicContact CZ-CG 4.17Å; F626-L630 WeakPolarHBondContact O-CG 3.33Å; F626-L630 PolarHBondContact O-N 2.77Å; F626-L630 VanDerWaalsContact O-N 3.08Å
627	F	95.6	Very high	94.6	Very high	11 Å²	11	42 Å²	42	5%	0.048	21%	0.208	C	C	.	.	H	α-helix	trans	-63.7	-32.9	176.7	-78.4	-79.2	0	0	0	112.7	D310 L416 E434 Y435 R624 L630 T631 F638	D310-F627 HydrophobicContact CB-CD2 4.47Å; D310-F627 VanDerWaalsContact OD2-CD2 3.23Å; D310-F627 WeakPolarHBondContact OD2-CD2 3.33Å; D310-F627 PolarHBondContact OD2-N 3.45Å; L416-F627 HydrophobicContact CB-CE2 4.31Å; L416-F627 HydrophobicContact CB-CZ 4.43Å; L416-F627 HydrophobicContact CD1-CE2 4.33Å; L416-F627 HydrophobicContact CD2-CE2 3.85Å; L416-F627 HydrophobicContact CD2-CZ 4.34Å; L416-F627 HydrophobicContact CG-CE2 4.39Å; E434-F627 HydrophobicContact CG-CE1 4.3Å; Y435-F627 HydrophobicContact CD2-CB 3.68Å; Y435-F627 AromaticContact CD2-CD1 3.84Å; Y435-F627 HydrophobicContact CD2-CD1 3.84Å; Y435-F627 AromaticContact CD2-CD2 3.38Å; Y435-F627 HydrophobicContact CD2-CD2 3.38Å; Y435-F627 HydrophobicContact CD2-CE1 4.31Å; Y435-F627 AromaticContact CD2-CE2 3.93Å; Y435-F627 HydrophobicContact CD2-CE2 3.93Å; Y435-F627 AromaticContact CD2-CG 3.34Å; Y435-F627 HydrophobicContact CD2-CG 3.34Å; Y435-F627 HydrophobicContact CD2-CZ 4.35Å; Y435-F627 HydrophobicContact CE2-CB 4.27Å; Y435-F627 AromaticContact CE2-CD2 3.63Å; Y435-F627 HydrophobicContact CE2-CD2 3.63Å; Y435-F627 HydrophobicContact CE2-CE2 4.18Å; Y435-F627 HydrophobicContact CE2-CG 4.02Å; Y435-F627 HydrophobicContact CG-CB 4.09Å; Y435-F627 HydrophobicContact CG-CD1 4.4Å; Y435-F627 HydrophobicContact CG-CG 4.1Å; R624-F627 PolarHBondContact O-N 3.11Å; F627-L630 HydrophobicContact CD1-CD1 4.35Å; F627-L630 PolarHBondContact O-N 2.88Å; F627-T631 VanDerWaalsContact O-CG2 3.23Å; F627-T631 WeakPolarHBondContact O-CG2 3.34Å; F627-T631 PolarHBondContact O-N 2.95Å; F627-F638 HydrophobicContact CB-CE2 3.83Å; F627-F638 HydrophobicContact CB-CZ 3.9Å
628	L	95.4	Very high	94.8	Very high	11 Å²	11	39.6 Å²	39.6	6%	0.058	20%	0.195	C	C	.	.	H	α-helix	trans	-62.9	-44.8	172.9	-75.1	173.4	0	0	0	112.2	R624 F626 L630 T631 R635 F638	R624-L628 VanDerWaalsContact O-CG 3.3Å; R624-L628 WeakPolarHBondContact O-CG 3.5Å; R624-L628 PolarHBondContact O-N 3.43Å; F626-L628 VanDerWaalsContact C-N 3.28Å; F626-L628 PolarHBondContact O-N 3.32Å; L628-L630 VanDerWaalsContact C-N 3.31Å; L628-L630 PolarHBondContact O-N 3.41Å; L628-T631 WeakPolarHBondContact O-CB 3.46Å; L628-T631 PolarHBondContact O-N 2.82Å; L628-T631 VanDerWaalsContact O-N 3.11Å; L628-T631 PolarHBondContact O-OG1 3.34Å; L628-R635 HydrophobicContact CD2-CB 4.08Å; L628-F638 HydrophobicContact CB-CE2 4.47Å; L628-F638 HydrophobicContact CD2-CD2 3.64Å; L628-F638 HydrophobicContact CD2-CE2 3.5Å; L628-F638 VanDerWaalsContact CD2-CE2 3.5Å; L628-F638 HydrophobicContact CD2-CG 4.34Å; L628-F638 HydrophobicContact CD2-CZ 4.07Å; L628-F638 HydrophobicContact CG-CD2 3.99Å; L628-F638 HydrophobicContact CG-CE2 3.65Å; L628-F638 HydrophobicContact CG-CZ 4.49Å
629	E	95.6	Very high	94.9	Very high	20 Å²	20	41.2 Å²	41.2	9%	0.093	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-42.2	176.1	-177.4	66.8	-160.7	0	0	111.1	M177 K178 C179 S180 E625 F626 T631 M632	M177-E629 VanDerWaalsContact O-CG 3.32Å; M177-E629 WeakPolarHBondContact O-CG 3.44Å; M177-E629 HydrophobicContact SD-CB 4.44Å; M177-E629 HydrophobicContact SD-CG 4.41Å; K178-E629 HydrophobicContact CD-CG 4.26Å; C179-E629 WeakPolarHBondContact CA-OE1 3.27Å; C179-E629 WeakPolarHBondContact CB-OE1 3.49Å; C179-E629 PolarHBondContact N-OE1 2.9Å; S180-E629 WeakPolarHBondContact CB-OE2 3.31Å; S180-E629 PolarHBondContact N-OE1 3.45Å; S180-E629 VanDerWaalsContact OG-CD 3.3Å; S180-E629 PolarHBondContact OG-OE1 3.41Å; S180-E629 PolarHBondContact OG-OE2 3.21Å; E625-E629 PolarHBondContact O-N 2.99Å; F626-E629 WeakPolarHBondContact O-CB 3.38Å; F626-E629 PolarHBondContact O-N 3.32Å; E629-T631 PolarHBondContact O-N 3.16Å; E629-M632 PolarHBondContact O-N 3.44Å
630	L	93.9	Very high	95	Very high	77 Å²	77	42.4 Å²	42.4	40%	0.403	21%	0.211	S	C	.	.	H	α-helix	trans	-62.6	-23.1	177.2	-67.5	-176.3	0	0	0	113.7	F626 F627 L628 M632	F626-L630 HydrophobicContact CD1-CD1 4.18Å; F626-L630 HydrophobicContact CE1-CD1 3.53Å; F626-L630 HydrophobicContact CE1-CG 4.36Å; F626-L630 HydrophobicContact CE2-CD1 4.21Å; F626-L630 HydrophobicContact CE2-CD2 4.41Å; F626-L630 HydrophobicContact CE2-CG 4.34Å; F626-L630 HydrophobicContact CZ-CD1 3.55Å; F626-L630 HydrophobicContact CZ-CD2 4.44Å; F626-L630 HydrophobicContact CZ-CG 4.17Å; F626-L630 WeakPolarHBondContact O-CG 3.33Å; F626-L630 PolarHBondContact O-N 2.77Å; F626-L630 VanDerWaalsContact O-N 3.08Å; F627-L630 HydrophobicContact CD1-CD1 4.35Å; F627-L630 PolarHBondContact O-N 2.88Å; L628-L630 VanDerWaalsContact C-N 3.31Å; L628-L630 PolarHBondContact O-N 3.41Å; L630-M632 PolarHBondContact O-N 3.4Å
631	T	93.9	Very high	95	Very high	18 Å²	18	44.7 Å²	44.7	11%	0.11	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-6.9	174.2	78	0	0	0	0	113.6	F627 L628 E629 G633 R634 R635 F638	F627-T631 VanDerWaalsContact O-CG2 3.23Å; F627-T631 WeakPolarHBondContact O-CG2 3.34Å; F627-T631 PolarHBondContact O-N 2.95Å; L628-T631 WeakPolarHBondContact O-CB 3.46Å; L628-T631 PolarHBondContact O-N 2.82Å; L628-T631 VanDerWaalsContact O-N 3.11Å; L628-T631 PolarHBondContact O-OG1 3.34Å; E629-T631 PolarHBondContact O-N 3.16Å; T631-G633 PolarHBondContact O-N 3.12Å; T631-G633 VanDerWaalsContact O-N 3.16Å; T631-R634 VanDerWaalsContact O-CB 3.25Å; T631-R634 WeakPolarHBondContact O-CB 3Å; T631-R634 PolarHBondContact O-N 2.96Å; T631-R635 HydrophobicContact CG2-CB 3.95Å; T631-R635 HydrophobicContact CG2-CG 3.99Å; T631-R635 PolarHBondContact OG1-N 3.42Å; T631-F638 HydrophobicContact CG2-CE1 4.1Å; T631-F638 HydrophobicContact CG2-CZ 3.85Å
632	M	92.7	Very high	95	Very high	146 Å²	146	44.7 Å²	44.7	72%	0.719	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	36.3	179	-60.7	-179.6	-75.7	0	0	113.3	R91 E629 L630	R91-M632 VanDerWaalsContact CZ-C 3.47Å; R91-M632 PolarHBondContact NH1-O 3.23Å; R91-M632 PolarHBondContact NH2-O 3.41Å; E629-M632 PolarHBondContact O-N 3.44Å; L630-M632 PolarHBondContact O-N 3.4Å
633	G	90.5	Very high	95	Very high	46 Å²	46	44.7 Å²	44.7	47%	0.474	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	7.4	178.9	0	0	0	0	0	115.1	T631 R635	T631-G633 PolarHBondContact O-N 3.12Å; T631-G633 VanDerWaalsContact O-N 3.16Å; G633-R635 VanDerWaalsContact C-N 3.35Å
634	R	91.6	Very high	95	Very high	153 Å²	153	44.8 Å²	44.8	58%	0.577	22%	0.222	S	C	*	.	S	Bend	trans	-68.3	-35.6	171.2	-175.4	177.7	65.3	97.9	9.2	111.6	E433 T631	E433-R634 IonicContact OE1-CZ 2.81Å; E433-R634 IonicContact OE1-NH1 3.5Å; E433-R634 PolarHBondContact OE1-NH1 3.47Å; E433-R634 IonicContact OE1-NH2 3.3Å; E433-R634 PolarHBondContact OE1-NH2 3.41Å; E433-R634 IonicContact OE2-CZ 2.64Å; E433-R634 IonicContact OE2-NH2 3.71Å; E433-R634 PolarHBondContact OE2-NH2 3.37Å; T631-R634 VanDerWaalsContact O-CB 3.25Å; T631-R634 WeakPolarHBondContact O-CB 3Å; T631-R634 PolarHBondContact O-N 2.96Å
635	R	91.6	Very high	95	Very high	84 Å²	84	44.7 Å²	44.7	32%	0.317	22%	0.222	S	C	.	.			trans	-113.7	134	175.6	-66.9	-70.2	-168.5	172.5	-0	109.3	E433 L628 T631 G633 F638	E433-R635 IonicContact OE1-CZ 3.7Å; E433-R635 IonicContact OE1-NE 3.68Å; E433-R635 PolarHBondContact OE1-NE 2.94Å; E433-R635 VanDerWaalsContact OE1-NE 3.1Å; E433-R635 IonicContact OE1-NH2 2.73Å; E433-R635 PolarHBondContact OE1-NH2 3Å; E433-R635 IonicContact OE2-NE 2.75Å; L628-R635 HydrophobicContact CD2-CB 4.08Å; T631-R635 HydrophobicContact CG2-CB 3.95Å; T631-R635 HydrophobicContact CG2-CG 3.99Å; T631-R635 PolarHBondContact OG1-N 3.42Å; G633-R635 VanDerWaalsContact C-N 3.35Å; R635-F638 HydrophobicContact CG-CD1 4.35Å; R635-F638 HydrophobicContact CG-CE1 4.15Å
636	I	92.1	Very high	95.1	Very high	138 Å²	138	45 Å²	45	71%	0.708	22%	0.223	S	C	*	.	S	Bend	trans	-88	-32.2	165.9	-168.6	61.7	0	0	0	111.1
637	Q	95.1	Very high	95.2	Very high	36 Å²	36	43.7 Å²	43.7	17%	0.168	22%	0.218	C	C	.	.	S	Bend	trans	-154.3	159.6	171.2	-168	45.5	-85.7	0	0	108.8	E690	Q637-E690 PolarHBondContact NE2-OE2 3.48Å
638	F	96.3	Very high	95.3	Very high	9 Å²	9	43.2 Å²	43.2	4%	0.039	22%	0.216	C	C	.	.			trans	-86.7	148.8	172.3	-65.6	-72.5	0	0	0	111.5	E433 Y435 R624 F627 L628 T631 R635 M642	E433-F638 WeakPolarHBondContact OE2-CE1 3.22Å; Y435-F638 HydrophobicContact CD1-CB 4.28Å; Y435-F638 AromaticContact CD1-CD1 3.84Å; Y435-F638 HydrophobicContact CD1-CD1 3.84Å; Y435-F638 AromaticContact CD1-CD2 3.65Å; Y435-F638 HydrophobicContact CD1-CD2 3.65Å; Y435-F638 HydrophobicContact CD1-CE1 4.02Å; Y435-F638 AromaticContact CD1-CE2 3.82Å; Y435-F638 HydrophobicContact CD1-CE2 3.82Å; Y435-F638 AromaticContact CD1-CG 3.65Å; Y435-F638 HydrophobicContact CD1-CG 3.65Å; Y435-F638 HydrophobicContact CD1-CZ 4.01Å; Y435-F638 HydrophobicContact CE1-CB 4.35Å; Y435-F638 AromaticContact CE1-CD2 3.85Å; Y435-F638 HydrophobicContact CE1-CD2 3.85Å; Y435-F638 HydrophobicContact CE1-CE2 4.28Å; Y435-F638 HydrophobicContact CE1-CG 4.05Å; Y435-F638 HydrophobicContact CG-CD1 4.49Å; Y435-F638 HydrophobicContact CG-CD2 4.33Å; Y435-F638 HydrophobicContact CG-CE1 4.21Å; Y435-F638 HydrophobicContact CG-CE2 4.02Å; Y435-F638 AromaticContact CG-CZ 3.97Å; Y435-F638 HydrophobicContact CG-CZ 3.97Å; R624-F638 HydrophobicContact CB-CD2 4.26Å; R624-F638 HydrophobicContact CB-CE2 4.36Å; R624-F638 HydrophobicContact CG-CD2 3.85Å; R624-F638 HydrophobicContact CG-CE2 4.37Å; F627-F638 HydrophobicContact CB-CE2 3.83Å; F627-F638 HydrophobicContact CB-CZ 3.9Å; L628-F638 HydrophobicContact CB-CE2 4.47Å; L628-F638 HydrophobicContact CD2-CD2 3.64Å; L628-F638 HydrophobicContact CD2-CE2 3.5Å; L628-F638 VanDerWaalsContact CD2-CE2 3.5Å; L628-F638 HydrophobicContact CD2-CG 4.34Å; L628-F638 HydrophobicContact CD2-CZ 4.07Å; L628-F638 HydrophobicContact CG-CD2 3.99Å; L628-F638 HydrophobicContact CG-CE2 3.65Å; L628-F638 HydrophobicContact CG-CZ 4.49Å; T631-F638 HydrophobicContact CG2-CE1 4.1Å; T631-F638 HydrophobicContact CG2-CZ 3.85Å; R635-F638 HydrophobicContact CG-CD1 4.35Å; R635-F638 HydrophobicContact CG-CE1 4.15Å; F638-M642 HydrophobicContact CB-CB 4.29Å; F638-M642 HydrophobicContact CB-SD 4.32Å; F638-M642 HydrophobicContact CD1-SD 3.77Å; F638-M642 HydrophobicContact CG-SD 4.4Å
639	P	96.8	Very high	95.4	Very high	35 Å²	35	42.7 Å²	42.7	23%	0.227	21%	0.214	C	C	.	.			trans	-74.5	164.1	178	35.9	-38.6	0	0	0	111.9	E641 M642	P639-E641 VanDerWaalsContact C-N 3.27Å; P639-E641 WeakPolarHBondContact CB-OE1 3.29Å; P639-E641 WeakPolarHBondContact CB-OE2 3.29Å; P639-E641 HydrophobicContact CG-CG 4.32Å; P639-E641 WeakPolarHBondContact CG-OE1 3.28Å; P639-E641 PolarHBondContact O-N 2.98Å; P639-M642 HydrophobicContact CG-CE 3.79Å; P639-M642 HydrophobicContact CG-CG 4.04Å; P639-M642 HydrophobicContact CG-SD 4.11Å; P639-M642 PolarHBondContact O-N 2.91Å
640	I	96.8	Very high	95.5	Very high	25 Å²	25	43.4 Å²	43.4	13%	0.128	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-63.8	-29.1	-169.4	66.5	177.6	0	0	0	113.4	M642 S643 W646 E694 L697	I640-M642 PolarHBondContact O-N 3.08Å; I640-S643 VanDerWaalsContact O-CB 3.3Å; I640-S643 WeakPolarHBondContact O-CB 3.35Å; I640-S643 PolarHBondContact O-N 3.43Å; I640-W646 HydrophobicContact CB-CG 4.25Å; I640-E694 HydrophobicContact CG2-CG 3.85Å; I640-L697 HydrophobicContact CD1-CD2 4.06Å; I640-L697 HydrophobicContact CD1-CG 4.37Å; I640-L697 HydrophobicContact CG2-CD2 4.14Å
641	E	94.8	Very high	95.7	Very high	79 Å²	79	40.9 Å²	40.9	37%	0.369	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-67.5	-11.6	176.2	64.7	-86.8	-164.5	0	0	114	R440 P639 I647	R440-E641 WeakPolarHBondContact CB-O 3.31Å; R440-E641 WeakPolarHBondContact CD-O 3.05Å; R440-E641 WeakPolarHBondContact CG-O 3.27Å; P639-E641 VanDerWaalsContact C-N 3.27Å; P639-E641 WeakPolarHBondContact CB-OE1 3.29Å; P639-E641 WeakPolarHBondContact CB-OE2 3.29Å; P639-E641 HydrophobicContact CG-CG 4.32Å; P639-E641 WeakPolarHBondContact CG-OE1 3.28Å; P639-E641 PolarHBondContact O-N 2.98Å; E641-I647 WeakPolarHBondContact O-CD1 3.22Å; E641-I647 VanDerWaalsContact O-CG1 3.24Å; E641-I647 WeakPolarHBondContact O-CG1 3.38Å
642	M	97.5	Very high	95.8	Very high	3 Å²	3	40 Å²	40	2%	0.015	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-99.6	-7.6	171.9	-55.3	-172.4	-169.2	0	0	112.7	E433 Y435 E436 T439 F638 P639 I640	E433-M642 HydrophobicContact CG-CE 4.07Å; E433-M642 HydrophobicContact CG-SD 4.35Å; Y435-M642 HydrophobicContact CD1-CB 4.03Å; Y435-M642 HydrophobicContact CD1-SD 4.39Å; Y435-M642 HydrophobicContact CE1-CB 4.09Å; E436-M642 HydrophobicContact CB-CE 3.71Å; E436-M642 HydrophobicContact CB-CG 4.13Å; E436-M642 HydrophobicContact CB-SD 3.76Å; E436-M642 VanDerWaalsContact CD-CE 3.5Å; E436-M642 HydrophobicContact CG-CE 3.8Å; E436-M642 HydrophobicContact CG-CG 4Å; E436-M642 HydrophobicContact CG-SD 4.17Å; T439-M642 PolarHBondContact OG1-O 2.95Å; F638-M642 HydrophobicContact CB-CB 4.29Å; F638-M642 HydrophobicContact CB-SD 4.32Å; F638-M642 HydrophobicContact CD1-SD 3.77Å; F638-M642 HydrophobicContact CG-SD 4.4Å; P639-M642 HydrophobicContact CG-CE 3.79Å; P639-M642 HydrophobicContact CG-CG 4.04Å; P639-M642 HydrophobicContact CG-SD 4.11Å; P639-M642 PolarHBondContact O-N 2.91Å; I640-M642 PolarHBondContact O-N 3.08Å
643	S	97.6	Very high	95.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.165	C	C	.	.			trans	-85.9	122.4	-175.9	-171.3	0	0	0	0	111.3	R624 I640 W646 I647 E694	R624-S643 VanDerWaalsContact NH1-CB 3.28Å; R624-S643 PolarHBondContact NH1-OG 3.24Å; I640-S643 VanDerWaalsContact O-CB 3.3Å; I640-S643 WeakPolarHBondContact O-CB 3.35Å; I640-S643 PolarHBondContact O-N 3.43Å; S643-W646 PolarHBondContact O-N 3.44Å; S643-W646 VanDerWaalsContact O-N 3.15Å; S643-I647 VanDerWaalsContact O-CG1 3.27Å; S643-I647 WeakPolarHBondContact O-CG1 3.21Å; S643-I647 PolarHBondContact O-N 2.9Å; S643-E694 WeakPolarHBondContact CB-OE1 3.16Å; S643-E694 PolarHBondContact OG-OE1 3.11Å
644	M	97	Very high	96.2	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-57.8	-46.9	-174	-71.4	-58.7	-65.3	0	0	114.3	Y412 T439 Y443 L621 W646 I647 L648	Y412-M644 HydrophobicContact CD2-CE 4.36Å; Y412-M644 HydrophobicContact CD2-CG 4.17Å; Y412-M644 HydrophobicContact CE2-CG 3.64Å; Y412-M644 HydrophobicContact CE2-SD 4.35Å; T439-M644 HydrophobicContact CG2-CG 4.25Å; T439-M644 HydrophobicContact CG2-SD 3.93Å; Y443-M644 HydrophobicContact CD2-CE 4.13Å; Y443-M644 HydrophobicContact CD2-SD 4.41Å; Y443-M644 HydrophobicContact CE1-CE 4.45Å; Y443-M644 HydrophobicContact CE2-CE 3.5Å; Y443-M644 VanDerWaalsContact CE2-CE 3.5Å; Y443-M644 HydrophobicContact CE2-SD 3.76Å; L621-M644 HydrophobicContact CB-CB 4.21Å; L621-M644 WeakPolarHBondContact O-CB 3.42Å; M644-W646 PolarHBondContact O-N 3.28Å; M644-I647 PolarHBondContact O-N 2.97Å; M644-I647 HydrophobicContact SD-CD1 4.09Å; M644-L648 WeakPolarHBondContact O-CG 3.09Å; M644-L648 PolarHBondContact O-N 2.9Å; M644-L648 VanDerWaalsContact O-N 3.11Å
645	P	97.7	Very high	96.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56.8	-39.2	177.5	-26.6	36.1	0	0	0	113	W622 T649 L670 Y671	W622-P645 HydrophobicContact CB-CG 4.16Å; P645-T649 WeakPolarHBondContact O-CB 3.43Å; P645-T649 PolarHBondContact O-N 3.1Å; P645-T649 VanDerWaalsContact O-N 3.15Å; P645-T649 PolarHBondContact O-OG1 2.92Å; P645-L670 HydrophobicContact CB-CB 4.15Å; P645-L670 HydrophobicContact CB-CD1 4.32Å; P645-L670 HydrophobicContact CG-CB 4.1Å; P645-L670 HydrophobicContact CG-CD1 4.36Å; P645-Y671 HydrophobicContact CB-CD1 4.36Å; P645-Y671 HydrophobicContact CB-CD2 4.17Å; P645-Y671 HydrophobicContact CB-CE1 3.95Å; P645-Y671 HydrophobicContact CB-CE2 3.73Å; P645-Y671 HydrophobicContact CB-CG 4.47Å; P645-Y671 HydrophobicContact CG-CD1 4.47Å; P645-Y671 HydrophobicContact CG-CE1 4.18Å
646	W	98.2	Very high	96.6	Very high	7 Å²	7	32.5 Å²	32.5	3%	0.027	16%	0.162	C	C	.	.	H	α-helix	trans	-76.7	-41.4	178.5	-170.8	-118.4	0	0	0	113	I640 S643 M644 L648 T649 D650 L653 C698 Q701 F702	I640-W646 HydrophobicContact CB-CG 4.25Å; S643-W646 PolarHBondContact O-N 3.44Å; S643-W646 VanDerWaalsContact O-N 3.15Å; M644-W646 PolarHBondContact O-N 3.28Å; W646-L648 PolarHBondContact O-N 2.94Å; W646-T649 HydrophobicContact CE3-CG2 4.27Å; W646-T649 HydrophobicContact CZ3-CG2 4.05Å; W646-T649 PolarHBondContact O-N 3.38Å; W646-D650 HydrophobicContact CD2-CB 4.06Å; W646-D650 HydrophobicContact CG-CB 4.45Å; W646-D650 HydrophobicContact CH2-CB 4.45Å; W646-D650 HydrophobicContact CZ2-CB 3.91Å; W646-D650 WeakPolarHBondContact CZ2-OD1 3.4Å; W646-D650 WeakPolarHBondContact O-CB 3.49Å; W646-D650 PolarHBondContact O-N 3.16Å; W646-L653 HydrophobicContact CH2-CD1 4.31Å; W646-C698 HydrophobicContact CD2-CB 3.94Å; W646-C698 HydrophobicContact CE3-CB 3.47Å; W646-C698 VanDerWaalsContact CE3-CB 3.47Å; W646-C698 HydrophobicContact CH2-CB 4.25Å; W646-C698 WeakPolarHBondContact CH2-O 3.47Å; W646-C698 HydrophobicContact CZ3-CB 3.65Å; W646-C698 VanDerWaalsContact CZ3-O 3.29Å; W646-C698 WeakPolarHBondContact CZ3-O 3.1Å; W646-Q701 HydrophobicContact CH2-CB 3.8Å; W646-Q701 HydrophobicContact CZ2-CB 3.83Å; W646-F702 HydrophobicContact CH2-CB 4.49Å; W646-F702 HydrophobicContact CZ3-CB 4.43Å
647	I	98.1	Very high	96.8	Very high	17 Å²	17	29 Å²	29	9%	0.087	14%	0.143	C	C	.	.	H	α-helix	trans	-53.3	-44.2	175.3	-71.1	162.5	0	0	0	110.8	R440 K448 E641 S643 M644 H651	R440-I647 HydrophobicContact CB-CD1 4.19Å; K448-I647 HydrophobicContact CD-CG2 3.8Å; E641-I647 WeakPolarHBondContact O-CD1 3.22Å; E641-I647 VanDerWaalsContact O-CG1 3.24Å; E641-I647 WeakPolarHBondContact O-CG1 3.38Å; S643-I647 VanDerWaalsContact O-CG1 3.27Å; S643-I647 WeakPolarHBondContact O-CG1 3.21Å; S643-I647 PolarHBondContact O-N 2.9Å; M644-I647 PolarHBondContact O-N 2.97Å; M644-I647 HydrophobicContact SD-CD1 4.09Å; I647-H651 WeakPolarHBondContact O-CB 3.3Å; I647-H651 PolarHBondContact O-N 2.98Å
648	L	97.8	Very high	96.6	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-70.6	-45.6	-179.9	-64.8	178.2	0	0	0	111.9	K448 L451 V452 I455 M644 W646 L670	K448-L648 HydrophobicContact CB-CD2 4.03Å; K448-L648 HydrophobicContact CG-CD2 4.05Å; L451-L648 HydrophobicContact CB-CD2 4.21Å; L451-L648 HydrophobicContact CD1-CD2 4.26Å; V452-L648 HydrophobicContact CG2-CB 3.8Å; V452-L648 HydrophobicContact CG2-CD2 4.27Å; V452-L648 HydrophobicContact CG2-CG 4.42Å; I455-L648 HydrophobicContact CD1-CD1 3.83Å; M644-L648 WeakPolarHBondContact O-CG 3.09Å; M644-L648 PolarHBondContact O-N 2.9Å; M644-L648 VanDerWaalsContact O-N 3.11Å; W646-L648 PolarHBondContact O-N 2.94Å; L648-L670 HydrophobicContact CD1-CD1 4.34Å
649	T	97.1	Very high	96.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.3	-49.5	-177.7	-58.4	0	0	0	0	111.9	P645 W646 H651 V652 L653 V664 S667 L668 F702	P645-T649 WeakPolarHBondContact O-CB 3.43Å; P645-T649 PolarHBondContact O-N 3.1Å; P645-T649 VanDerWaalsContact O-N 3.15Å; P645-T649 PolarHBondContact O-OG1 2.92Å; W646-T649 HydrophobicContact CE3-CG2 4.27Å; W646-T649 HydrophobicContact CZ3-CG2 4.05Å; W646-T649 PolarHBondContact O-N 3.38Å; T649-H651 VanDerWaalsContact C-N 3.27Å; T649-H651 PolarHBondContact O-N 3.21Å; T649-V652 PolarHBondContact O-N 3.33Å; T649-L653 PolarHBondContact O-N 2.92Å; T649-V664 HydrophobicContact CG2-CG2 3.85Å; T649-S667 WeakPolarHBondContact OG1-CB 3.49Å; T649-S667 PolarHBondContact OG1-OG 2.8Å; T649-L668 HydrophobicContact CG2-CD1 4.21Å; T649-F702 HydrophobicContact CG2-CD2 3.93Å; T649-F702 HydrophobicContact CG2-CE2 4.3Å
650	D	97.7	Very high	96.2	Very high	35 Å²	35	30.2 Å²	30.2	19%	0.187	16%	0.158	C	C	.	.	H	α-helix	trans	-64.8	-33.4	-177.8	-166.2	50.4	0	0	0	111.8	W646 V652 L653 E654 K705	W646-D650 HydrophobicContact CD2-CB 4.06Å; W646-D650 HydrophobicContact CG-CB 4.45Å; W646-D650 HydrophobicContact CH2-CB 4.45Å; W646-D650 HydrophobicContact CZ2-CB 3.91Å; W646-D650 WeakPolarHBondContact CZ2-OD1 3.4Å; W646-D650 WeakPolarHBondContact O-CB 3.49Å; W646-D650 PolarHBondContact O-N 3.16Å; D650-V652 VanDerWaalsContact C-N 3.32Å; D650-V652 PolarHBondContact O-N 3.12Å; D650-L653 PolarHBondContact O-N 3.11Å; D650-L653 VanDerWaalsContact O-N 3.15Å; D650-E654 VanDerWaalsContact O-CB 3.29Å; D650-E654 WeakPolarHBondContact O-CB 3.47Å; D650-E654 PolarHBondContact O-N 3.15Å; D650-K705 WeakPolarHBondContact OD1-CE 3.45Å; D650-K705 IonicContact OD1-NZ 3.43Å; D650-K705 PolarHBondContact OD1-NZ 3.05Å; D650-K705 IonicContact OD2-NZ 2.71Å; D650-K705 PolarHBondContact OD2-NZ 3.37Å
651	H	97.9	Very high	95.9	Very high	23 Å²	23	29 Å²	29	11%	0.106	15%	0.152	C	C	.	.	H	α-helix	trans	-60.4	-40.1	176.8	-174.5	66.2	0	0	0	112.5	S445 K448 F449 I647 T649 T655	S445-H651 PolarHBondContact OG-CE1 2.93Å; S445-H651 VanDerWaalsContact OG-CE1 3.25Å; S445-H651 PolarHBondContact OG-NE2 3.34Å; K448-H651 HydrophobicContact CD-CB 4.12Å; K448-H651 WeakPolarHBondContact CE-ND1 3.37Å; K448-H651 PolarHBondContact NZ-CE1 3.15Å; K448-H651 PolarHBondContact NZ-ND1 3.49Å; F449-H651 AromaticContact CD1-CD2 3.77Å; F449-H651 AromaticContact CE1-CD2 3.33Å; F449-H651 WeakPolarHBondContact CE1-CD2 3.49Å; F449-H651 AromaticContact CE1-NE2 3.53Å; F449-H651 AromaticContact CE2-NE2 3.7Å; F449-H651 AromaticContact CZ-CD2 3.66Å; F449-H651 AromaticContact CZ-NE2 3.31Å; F449-H651 VanDerWaalsContact CZ-NE2 3.31Å; F449-H651 WeakPolarHBondContact CZ-NE2 3.23Å; I647-H651 WeakPolarHBondContact O-CB 3.3Å; I647-H651 PolarHBondContact O-N 2.98Å; T649-H651 VanDerWaalsContact C-N 3.27Å; T649-H651 PolarHBondContact O-N 3.21Å; H651-T655 WeakPolarHBondContact O-CB 3.35Å; H651-T655 VanDerWaalsContact O-CG2 3.3Å; H651-T655 WeakPolarHBondContact O-CG2 3.36Å; H651-T655 PolarHBondContact O-N 3.04Å; H651-T655 PolarHBondContact O-OG1 2.67Å
652	V	97	Very high	95.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.6	-41.9	174.7	179.6	0	0	0	0	111	F449 T649 D650 T655 K656 M660 M661 V664	F449-V652 HydrophobicContact CD1-CG2 4.37Å; F449-V652 HydrophobicContact CE1-CG2 4.25Å; T649-V652 PolarHBondContact O-N 3.33Å; D650-V652 VanDerWaalsContact C-N 3.32Å; D650-V652 PolarHBondContact O-N 3.12Å; V652-T655 PolarHBondContact O-OG1 3.44Å; V652-K656 WeakPolarHBondContact O-CA 3.45Å; V652-K656 PolarHBondContact O-N 3.15Å; V652-M660 HydrophobicContact CG1-CB 3.95Å; V652-M660 HydrophobicContact CG2-CB 4.08Å; V652-M661 HydrophobicContact CG1-CE 4.35Å; V652-V664 HydrophobicContact CB-CB 4.43Å; V652-V664 HydrophobicContact CB-CG2 4.02Å; V652-V664 HydrophobicContact CG1-CB 4.07Å; V652-V664 HydrophobicContact CG1-CG2 4.11Å
653	L	95.2	Very high	95.3	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-67.2	-38	-179.9	-66.3	175.2	0	0	0	112.9	W646 T649 D650 V664 F702 K705 L706 Q709	W646-L653 HydrophobicContact CH2-CD1 4.31Å; T649-L653 PolarHBondContact O-N 2.92Å; D650-L653 PolarHBondContact O-N 3.11Å; D650-L653 VanDerWaalsContact O-N 3.15Å; L653-V664 HydrophobicContact CD2-CG2 4.42Å; L653-V664 HydrophobicContact CG-CG2 4.41Å; L653-F702 HydrophobicContact CD1-CB 4.29Å; L653-F702 HydrophobicContact CD1-CD2 3.72Å; L653-F702 HydrophobicContact CD1-CE2 4.43Å; L653-F702 HydrophobicContact CD1-CG 4.3Å; L653-F702 HydrophobicContact CD2-CD2 4.24Å; L653-F702 HydrophobicContact CD2-CE2 4.19Å; L653-F702 HydrophobicContact CG-CD2 4.39Å; L653-K705 HydrophobicContact CB-CB 4.34Å; L653-K705 HydrophobicContact CB-CD 4.21Å; L653-K705 HydrophobicContact CD1-CB 4.33Å; L653-K705 HydrophobicContact CD1-CD 4.43Å; L653-L706 HydrophobicContact CD2-CB 4.28Å; L653-Q709 PolarHBondContact O-NE2 3.47Å; L653-Q709 VanDerWaalsContact O-NE2 3.12Å
654	E	96	Very high	95.1	Very high	116 Å²	116	31.9 Å²	31.9	54%	0.542	16%	0.163	S	C	.	.	H	α-helix	trans	-77.3	-43.6	-176.8	-164.3	63.8	-148.7	0	0	111.5	D650 K656 K705	D650-E654 VanDerWaalsContact O-CB 3.29Å; D650-E654 WeakPolarHBondContact O-CB 3.47Å; D650-E654 PolarHBondContact O-N 3.15Å; E654-K656 VanDerWaalsContact C-N 3.31Å; E654-K705 IonicContact OE2-NZ 3.44Å; E654-K705 PolarHBondContact OE2-NZ 2.72Å
655	T	96	Very high	94.9	Very high	62 Å²	62	33.2 Å²	33.2	38%	0.38	17%	0.17	S	C	.	.	H	α-helix	trans	-74.6	-22.7	177.1	57.8	0	0	0	0	112.8	F449 H651 V652 E657	F449-T655 HydrophobicContact CZ-CG2 4.15Å; F449-T655 WeakPolarHBondContact CZ-OG1 3.41Å; H651-T655 WeakPolarHBondContact O-CB 3.35Å; H651-T655 VanDerWaalsContact O-CG2 3.3Å; H651-T655 WeakPolarHBondContact O-CG2 3.36Å; H651-T655 PolarHBondContact O-N 3.04Å; H651-T655 PolarHBondContact O-OG1 2.67Å; V652-T655 PolarHBondContact O-OG1 3.44Å; T655-E657 PolarHBondContact O-N 2.95Å
656	K	96.6	Very high	94.5	Very high	91 Å²	91	37 Å²	37	40%	0.396	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	31.4	-176.4	-44.1	-174.1	-177	-150.3	0	111.9	V652 E654 A658 Q709 N744	V652-K656 WeakPolarHBondContact O-CA 3.45Å; V652-K656 PolarHBondContact O-N 3.15Å; E654-K656 VanDerWaalsContact C-N 3.31Å; K656-A658 PolarHBondContact O-N 3.06Å; K656-Q709 HydrophobicContact CD-CB 4.07Å; K656-N744 PolarHBondContact O-ND2 3.31Å
657	E	94.8	Very high	94.2	Very high	66 Å²	66	36.7 Å²	36.7	31%	0.308	18%	0.184	S	C	.	.			trans	-63.3	115.4	-173.7	177.5	46.5	-123.3	0	0	110.9	F449 T655 S659 M660 M661	F449-E657 HydrophobicContact CE1-CB 3.9Å; F449-E657 HydrophobicContact CE1-CG 4.15Å; F449-E657 HydrophobicContact CE2-CB 4.49Å; F449-E657 HydrophobicContact CE2-CG 4.25Å; F449-E657 HydrophobicContact CZ-CB 3.69Å; F449-E657 HydrophobicContact CZ-CG 3.9Å; T655-E657 PolarHBondContact O-N 2.95Å; E657-S659 VanDerWaalsContact C-N 3.32Å; E657-S659 WeakPolarHBondContact CG-OG 3.3Å; E657-S659 PolarHBondContact O-N 2.88Å; E657-S659 WeakPolarHBondContact OE1-CB 3.37Å; E657-S659 PolarHBondContact OE1-N 3.36Å; E657-S659 PolarHBondContact OE1-OG 3.12Å; E657-M660 HydrophobicContact CB-CB 4.21Å; E657-M660 HydrophobicContact CB-CG 4.4Å; E657-M660 HydrophobicContact CG-CB 3.97Å; E657-M660 HydrophobicContact CG-CG 3.7Å; E657-M660 PolarHBondContact O-N 3.43Å; E657-M661 PolarHBondContact O-N 3.01Å; E657-M661 VanDerWaalsContact O-N 3.12Å
658	A	91.4	Very high	93.9	Very high	28 Å²	28	36 Å²	36	23%	0.231	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-34.3	-171.1	0	0	0	0	0	112.8	K656 M660 S743 N744	K656-A658 PolarHBondContact O-N 3.06Å; A658-M660 VanDerWaalsContact C-N 3.3Å; A658-S743 WeakPolarHBondContact CB-O 3.46Å; A658-N744 HydrophobicContact CB-CB 4.35Å
659	S	92.2	Very high	93.7	Very high	68 Å²	68	38.2 Å²	38.2	48%	0.476	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-27.2	178.4	59.6	0	0	0	0	112.8	E657 Y663	E657-S659 VanDerWaalsContact C-N 3.32Å; E657-S659 WeakPolarHBondContact CG-OG 3.3Å; E657-S659 PolarHBondContact O-N 2.88Å; E657-S659 WeakPolarHBondContact OE1-CB 3.37Å; E657-S659 PolarHBondContact OE1-N 3.36Å; E657-S659 PolarHBondContact OE1-OG 3.12Å; S659-Y663 WeakPolarHBondContact O-CD2 3.31Å; S659-Y663 WeakPolarHBondContact O-CE2 3.3Å
660	M	92.8	Very high	93.6	Very high	9 Å²	9	38.2 Å²	38.2	4%	0.044	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-9.6	-174.3	-63.6	-62.9	115.4	0	0	113.7	F449 E453 V652 E657 A658 E662 Y663 V664	F449-M660 HydrophobicContact CB-CG 4.22Å; F449-M660 HydrophobicContact CB-SD 4.17Å; F449-M660 HydrophobicContact CD1-CB 4.26Å; F449-M660 HydrophobicContact CD1-CG 3.59Å; F449-M660 HydrophobicContact CD1-SD 4.46Å; F449-M660 HydrophobicContact CE1-CB 4.44Å; F449-M660 HydrophobicContact CE1-CG 4.09Å; F449-M660 HydrophobicContact CG-CG 4.01Å; E453-M660 HydrophobicContact CG-CE 3.66Å; E453-M660 HydrophobicContact CG-SD 3.64Å; E453-M660 WeakPolarHBondContact OE1-CE 3.31Å; V652-M660 HydrophobicContact CG1-CB 3.95Å; V652-M660 HydrophobicContact CG2-CB 4.08Å; E657-M660 HydrophobicContact CB-CB 4.21Å; E657-M660 HydrophobicContact CB-CG 4.4Å; E657-M660 HydrophobicContact CG-CB 3.97Å; E657-M660 HydrophobicContact CG-CG 3.7Å; E657-M660 PolarHBondContact O-N 3.43Å; A658-M660 VanDerWaalsContact C-N 3.3Å; M660-E662 PolarHBondContact O-N 3.18Å; M660-Y663 WeakPolarHBondContact O-CA 3.33Å; M660-Y663 WeakPolarHBondContact O-CB 3.37Å; M660-Y663 PolarHBondContact O-N 3.25Å; M660-V664 PolarHBondContact O-N 3.08Å
661	M	91.6	Very high	93.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.6	-176.2	-163.7	57.1	58.7	0	0	113.2	V652 E657 Y663 V664 L706 Y746 L749	V652-M661 HydrophobicContact CG1-CE 4.35Å; E657-M661 PolarHBondContact O-N 3.01Å; E657-M661 VanDerWaalsContact O-N 3.12Å; M661-Y663 PolarHBondContact O-N 2.96Å; M661-V664 WeakPolarHBondContact O-CG1 3.25Å; M661-L706 HydrophobicContact SD-CD1 4.17Å; M661-Y746 HydrophobicContact CE-CD1 4.43Å; M661-Y746 HydrophobicContact CE-CE1 3.62Å; M661-Y746 HydrophobicContact CG-CD1 3.64Å; M661-Y746 HydrophobicContact CG-CE1 3.79Å; M661-Y746 HydrophobicContact SD-CD1 3.88Å; M661-Y746 HydrophobicContact SD-CE1 3.6Å; M661-L749 HydrophobicContact CG-CD1 3.7Å; M661-L749 HydrophobicContact SD-CD1 3.66Å
662	E	90.4	Very high	93.2	Very high	68 Å²	68	37 Å²	37	32%	0.318	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-11.3	175.9	-55.9	-168.8	174	0	0	113.1	M660 R745 T748	M660-E662 PolarHBondContact O-N 3.18Å; E662-R745 HydrophobicContact CG-CB 3.95Å; E662-R745 IonicContact OE1-CZ 2.96Å; E662-R745 IonicContact OE1-NE 3.58Å; E662-R745 PolarHBondContact OE1-NE 3.1Å; E662-R745 IonicContact OE1-NH2 3.43Å; E662-R745 PolarHBondContact OE1-NH2 3.23Å; E662-T748 HydrophobicContact CG-CG2 4.2Å
663	Y	89.3	Confident	93	Very high	74 Å²	74	38.6 Å²	38.6	29%	0.29	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-16.9	-174.7	-64.5	-107.4	0	0	0	113.3	E453 A456 S659 M660 M661 L665 Y666	E453-Y663 HydrophobicContact CG-CD1 4.41Å; E453-Y663 HydrophobicContact CG-CE1 4.32Å; A456-Y663 HydrophobicContact CB-CD1 3.3Å; A456-Y663 HydrophobicContact CB-CE1 3.89Å; A456-Y663 HydrophobicContact CB-CG 4.3Å; S659-Y663 WeakPolarHBondContact O-CD2 3.31Å; S659-Y663 WeakPolarHBondContact O-CE2 3.3Å; M660-Y663 WeakPolarHBondContact O-CA 3.33Å; M660-Y663 WeakPolarHBondContact O-CB 3.37Å; M660-Y663 PolarHBondContact O-N 3.25Å; M661-Y663 PolarHBondContact O-N 2.96Å; Y663-L665 PolarHBondContact O-N 3.4Å; Y663-L665 VanDerWaalsContact O-N 3.08Å; Y663-Y666 WeakPolarHBondContact O-CB 3.36Å; Y663-Y666 WeakPolarHBondContact O-CD2 3.38Å; Y663-Y666 PolarHBondContact O-N 3.13Å
664	V	93.6	Very high	93	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.6	-25.1	-169.1	73.8	0	0	0	0	114.6	T649 V652 L653 M660 M661 S667 L668 F702 L749	T649-V664 HydrophobicContact CG2-CG2 3.85Å; V652-V664 HydrophobicContact CB-CB 4.43Å; V652-V664 HydrophobicContact CB-CG2 4.02Å; V652-V664 HydrophobicContact CG1-CB 4.07Å; V652-V664 HydrophobicContact CG1-CG2 4.11Å; L653-V664 HydrophobicContact CD2-CG2 4.42Å; L653-V664 HydrophobicContact CG-CG2 4.41Å; M660-V664 PolarHBondContact O-N 3.08Å; M661-V664 WeakPolarHBondContact O-CG1 3.25Å; V664-S667 PolarHBondContact O-OG 3.43Å; V664-L668 PolarHBondContact O-N 3.27Å; V664-F702 HydrophobicContact CG1-CE2 3.95Å; V664-F702 HydrophobicContact CG1-CZ 4.11Å; V664-F702 HydrophobicContact CG2-CE2 3.84Å; V664-L749 HydrophobicContact CG1-CD1 3.98Å; V664-L749 HydrophobicContact CG1-CD2 3.84Å
665	L	90.8	Very high	92.8	Very high	30 Å²	30	33.1 Å²	33.1	16%	0.157	17%	0.17	C	C	.	.	H	α-helix	trans	-74.8	-27.6	177.1	-66.4	176.6	0	0	0	112.6	Y663 L668 D669 F702 L749 Q752 V755 L764	Y663-L665 PolarHBondContact O-N 3.4Å; Y663-L665 VanDerWaalsContact O-N 3.08Å; L665-L668 PolarHBondContact O-N 3.07Å; L665-D669 PolarHBondContact O-N 3.28Å; L665-F702 HydrophobicContact CD2-CE1 4.33Å; L665-F702 HydrophobicContact CD2-CE2 4.45Å; L665-F702 HydrophobicContact CD2-CZ 3.75Å; L665-L749 HydrophobicContact CD1-CD2 3.67Å; L665-L749 HydrophobicContact CD2-CD2 4.36Å; L665-L749 HydrophobicContact CG-CD2 3.72Å; L665-Q752 HydrophobicContact CD1-CG 3.75Å; L665-V755 HydrophobicContact CD1-CG2 4.47Å; L665-L764 HydrophobicContact CD2-CD2 4.5Å
666	Y	90.6	Very high	92.6	Very high	80 Å²	80	35.1 Å²	35.1	31%	0.314	18%	0.175	S	C	.	.	H	α-helix	trans	-71.5	-34.1	178.7	-63.5	-75.9	0	0	0	112.3	A456 K459 Y663 L668 D669	A456-Y666 HydrophobicContact CB-CD1 4.43Å; A456-Y666 HydrophobicContact CB-CD2 3.39Å; A456-Y666 HydrophobicContact CB-CE2 3.97Å; A456-Y666 HydrophobicContact CB-CG 3.66Å; K459-Y666 HydrophobicContact CB-CD1 3.69Å; K459-Y666 HydrophobicContact CB-CE1 4.18Å; K459-Y666 HydrophobicContact CD-CD1 4.26Å; Y663-Y666 WeakPolarHBondContact O-CB 3.36Å; Y663-Y666 WeakPolarHBondContact O-CD2 3.38Å; Y663-Y666 PolarHBondContact O-N 3.13Å; Y666-L668 VanDerWaalsContact C-N 3.32Å; Y666-D669 WeakPolarHBondContact O-CB 3.36Å; Y666-D669 PolarHBondContact O-N 3.22Å
667	S	92.5	Very high	92.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-69.3	-32.4	171.8	51.7	0	0	0	0	112.1	T649 V664 D669 L670	T649-S667 WeakPolarHBondContact OG1-CB 3.49Å; T649-S667 PolarHBondContact OG1-OG 2.8Å; V664-S667 PolarHBondContact O-OG 3.43Å; S667-D669 VanDerWaalsContact C-N 3.34Å; S667-L670 WeakPolarHBondContact O-CB 3.23Å; S667-L670 WeakPolarHBondContact O-CD1 3.4Å; S667-L670 VanDerWaalsContact O-CG 3.32Å; S667-L670 WeakPolarHBondContact O-CG 3.29Å; S667-L670 PolarHBondContact O-N 2.78Å
668	L	91.2	Very high	92.3	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-71.4	-31.2	174.9	-164	72.6	0	0	0	111.9	T649 V664 L665 Y666 L670 Y671 F699 L757	T649-L668 HydrophobicContact CG2-CD1 4.21Å; V664-L668 PolarHBondContact O-N 3.27Å; L665-L668 PolarHBondContact O-N 3.07Å; Y666-L668 VanDerWaalsContact C-N 3.32Å; L668-L670 PolarHBondContact O-N 3.18Å; L668-Y671 HydrophobicContact CD1-CD2 4.05Å; L668-Y671 HydrophobicContact CD1-CE2 3.97Å; L668-Y671 VanDerWaalsContact O-CD2 3.3Å; L668-Y671 WeakPolarHBondContact O-CD2 3.17Å; L668-Y671 PolarHBondContact O-N 2.95Å; L668-F699 HydrophobicContact CD2-CD2 3.95Å; L668-F699 HydrophobicContact CD2-CE2 4.2Å; L668-L757 HydrophobicContact CD2-CD2 3.94Å; L668-L757 HydrophobicContact CG-CD2 4.24Å
669	D	92.7	Very high	92.2	Very high	48 Å²	48	32.5 Å²	32.5	26%	0.257	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-15.4	176.7	-168.2	57.7	0	0	0	113.5	K459 L665 Y666 S667 Y671 N672 D673	K459-D669 HydrophobicContact CD-CB 4.06Å; K459-D669 VanDerWaalsContact CD-OD2 3.29Å; K459-D669 WeakPolarHBondContact CD-OD2 3.49Å; K459-D669 VanDerWaalsContact CE-OD2 3.25Å; K459-D669 WeakPolarHBondContact CE-OD2 3.48Å; K459-D669 IonicContact NZ-OD2 3.23Å; K459-D669 PolarHBondContact NZ-OD2 2.86Å; L665-D669 PolarHBondContact O-N 3.28Å; Y666-D669 WeakPolarHBondContact O-CB 3.36Å; Y666-D669 PolarHBondContact O-N 3.22Å; S667-D669 VanDerWaalsContact C-N 3.34Å; D669-Y671 PolarHBondContact O-N 3.24Å; D669-Y671 VanDerWaalsContact O-N 3.16Å; D669-N672 VanDerWaalsContact O-CB 3.31Å; D669-N672 WeakPolarHBondContact O-CB 3.37Å; D669-N672 PolarHBondContact O-N 3.01Å; D669-N672 PolarHBondContact OD1-ND2 3.34Å; D669-D673 PolarHBondContact O-N 3.34Å
670	L	94.7	Very high	91.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58.6	-26.3	172.1	-65.2	176.3	0	0	0	113.2	I455 L618 L621 P645 L648 S667 L668 N672 D673 S674	I455-L670 HydrophobicContact CD1-CD1 4.13Å; I455-L670 HydrophobicContact CG2-CD2 4.01Å; I455-L670 HydrophobicContact CG2-CG 4.44Å; L618-L670 HydrophobicContact CB-CD2 3.72Å; L618-L670 HydrophobicContact CD1-CD2 4Å; L621-L670 HydrophobicContact CD1-CD1 3.83Å; L621-L670 HydrophobicContact CD1-CD2 4.1Å; P645-L670 HydrophobicContact CB-CB 4.15Å; P645-L670 HydrophobicContact CB-CD1 4.32Å; P645-L670 HydrophobicContact CG-CB 4.1Å; P645-L670 HydrophobicContact CG-CD1 4.36Å; L648-L670 HydrophobicContact CD1-CD1 4.34Å; S667-L670 WeakPolarHBondContact O-CB 3.23Å; S667-L670 WeakPolarHBondContact O-CD1 3.4Å; S667-L670 VanDerWaalsContact O-CG 3.32Å; S667-L670 WeakPolarHBondContact O-CG 3.29Å; S667-L670 PolarHBondContact O-N 2.78Å; L668-L670 PolarHBondContact O-N 3.18Å; L670-N672 VanDerWaalsContact C-N 3.3Å; L670-D673 PolarHBondContact O-N 2.92Å; L670-S674 PolarHBondContact O-N 2.84Å; L670-S674 VanDerWaalsContact O-N 3.08Å; L670-S674 PolarHBondContact O-OG 3.03Å
671	Y	96.3	Very high	91.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.6	-31.5	173.5	-70.9	-67	0	0	0	112.2	W622 P645 L668 D669 S674 A675 I691 E694 V695	W622-Y671 AromaticContact CD1-CE1 3.66Å; W622-Y671 AromaticContact NE1-CE1 3.92Å; P645-Y671 HydrophobicContact CB-CD1 4.36Å; P645-Y671 HydrophobicContact CB-CD2 4.17Å; P645-Y671 HydrophobicContact CB-CE1 3.95Å; P645-Y671 HydrophobicContact CB-CE2 3.73Å; P645-Y671 HydrophobicContact CB-CG 4.47Å; P645-Y671 HydrophobicContact CG-CD1 4.47Å; P645-Y671 HydrophobicContact CG-CE1 4.18Å; L668-Y671 HydrophobicContact CD1-CD2 4.05Å; L668-Y671 HydrophobicContact CD1-CE2 3.97Å; L668-Y671 VanDerWaalsContact O-CD2 3.3Å; L668-Y671 WeakPolarHBondContact O-CD2 3.17Å; L668-Y671 PolarHBondContact O-N 2.95Å; D669-Y671 PolarHBondContact O-N 3.24Å; D669-Y671 VanDerWaalsContact O-N 3.16Å; Y671-S674 PolarHBondContact O-N 3.18Å; Y671-A675 WeakPolarHBondContact O-CB 3.44Å; Y671-A675 PolarHBondContact O-N 3.47Å; Y671-I691 HydrophobicContact CD1-CG2 4.16Å; Y671-E694 HydrophobicContact CE1-CG 4.21Å; Y671-E694 PolarHBondContact OH-OE1 2.86Å; Y671-V695 HydrophobicContact CD1-CG2 3.59Å; Y671-V695 HydrophobicContact CD2-CG2 3.64Å; Y671-V695 HydrophobicContact CE1-CG2 4.11Å; Y671-V695 HydrophobicContact CE2-CG2 4.16Å; Y671-V695 HydrophobicContact CG-CG2 3.32Å
672	N	92.2	Very high	91.8	Very high	33 Å²	33	39.3 Å²	39.3	18%	0.176	18%	0.183	C	C	.	.	H	α-helix	trans	-65.6	-44.7	174.4	-73.8	-37.7	0	0	0	110.9	D669 L670 S674 A675 H676 Q756 L757 L758	D669-N672 VanDerWaalsContact O-CB 3.31Å; D669-N672 WeakPolarHBondContact O-CB 3.37Å; D669-N672 PolarHBondContact O-N 3.01Å; D669-N672 PolarHBondContact OD1-ND2 3.34Å; L670-N672 VanDerWaalsContact C-N 3.3Å; N672-S674 VanDerWaalsContact C-N 3.32Å; N672-S674 PolarHBondContact O-N 3.08Å; N672-A675 PolarHBondContact O-N 3.33Å; N672-H676 VanDerWaalsContact O-CB 3.3Å; N672-H676 WeakPolarHBondContact O-CB 3.3Å; N672-H676 PolarHBondContact O-N 2.96Å; N672-Q756 PolarHBondContact ND2-O 3.04Å; N672-L757 WeakPolarHBondContact OD1-CA 3.22Å; N672-L758 PolarHBondContact OD1-N 2.66Å
673	D	91.9	Very high	92	Very high	33 Å²	33	42 Å²	42	18%	0.176	20%	0.199	C	C	.	.	H	α-helix	trans	-58.1	-48.5	176.8	-56.5	-16.1	0	0	0	110.4	K459 S619 D669 L670 Y677	K459-D673 WeakPolarHBondContact CE-OD2 3.47Å; K459-D673 IonicContact NZ-OD1 3.68Å; K459-D673 PolarHBondContact NZ-OD1 2.98Å; K459-D673 IonicContact NZ-OD2 3.11Å; K459-D673 PolarHBondContact NZ-OD2 3.02Å; S619-D673 WeakPolarHBondContact CB-O 3.19Å; D669-D673 PolarHBondContact O-N 3.34Å; L670-D673 PolarHBondContact O-N 2.92Å; D673-Y677 WeakPolarHBondContact O-CB 3.44Å; D673-Y677 PolarHBondContact O-N 3.4Å
674	S	94.9	Very high	92.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.3	-44.2	-179.7	-52.6	0	0	0	0	111.8	S619 W622 F623 L670 Y671 N672 Y677 A678	S619-S674 PolarHBondContact O-OG 3.23Å; W622-S674 WeakPolarHBondContact CB-OG 3.07Å; F623-S674 WeakPolarHBondContact CZ-O 3.1Å; L670-S674 PolarHBondContact O-N 2.84Å; L670-S674 VanDerWaalsContact O-N 3.08Å; L670-S674 PolarHBondContact O-OG 3.03Å; Y671-S674 PolarHBondContact O-N 3.18Å; N672-S674 VanDerWaalsContact C-N 3.32Å; N672-S674 PolarHBondContact O-N 3.08Å; S674-Y677 PolarHBondContact O-N 2.68Å; S674-A678 WeakPolarHBondContact O-CB 3.36Å; S674-A678 PolarHBondContact O-N 2.84Å
675	A	92.8	Very high	92.1	Very high	4 Å²	4	49 Å²	49	3%	0.033	23%	0.234	C	C	.	.	H	α-helix	trans	-66.1	-44.8	179.4	0	0	0	0	0	112.1	Y671 N672 Y677 A678 L679 Y688 I691 L758	Y671-A675 WeakPolarHBondContact O-CB 3.44Å; Y671-A675 PolarHBondContact O-N 3.47Å; N672-A675 PolarHBondContact O-N 3.33Å; A675-Y677 VanDerWaalsContact C-N 3.3Å; A675-Y677 PolarHBondContact O-N 3.49Å; A675-A678 PolarHBondContact O-N 3.22Å; A675-L679 WeakPolarHBondContact O-CG 3.37Å; A675-L679 PolarHBondContact O-N 3.27Å; A675-Y688 HydrophobicContact CB-CD2 3.96Å; A675-Y688 HydrophobicContact CB-CE2 3.92Å; A675-I691 HydrophobicContact CB-CG2 4.14Å; A675-L758 HydrophobicContact CB-CD2 3.42Å; A675-L758 VanDerWaalsContact CB-CD2 3.42Å
676	H	90.8	Very high	92.3	Very high	104 Å²	104	50.7 Å²	50.7	48%	0.481	24%	0.24	S	C	.	.	H	α-helix	trans	-60.2	-43.1	175.3	179.2	-94.1	0	0	0	111	N672 L679 T680	N672-H676 VanDerWaalsContact O-CB 3.3Å; N672-H676 WeakPolarHBondContact O-CB 3.3Å; N672-H676 PolarHBondContact O-N 2.96Å; H676-L679 PolarHBondContact O-N 3.01Å; H676-T680 PolarHBondContact CE1-OG1 3.33Å; H676-T680 WeakPolarHBondContact O-CB 3.3Å; H676-T680 WeakPolarHBondContact O-CG2 3.41Å; H676-T680 PolarHBondContact O-N 3.17Å; H676-T680 PolarHBondContact O-OG1 2.64Å
677	Y	92.1	Very high	92.6	Very high	46 Å²	46	46.9 Å²	46.9	18%	0.18	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-42.2	176.8	-157.4	-79.6	0	0	0	112.2	S619 F623 D673 S674 A675 L679 R681 F682	S619-Y677 WeakPolarHBondContact OG-CD2 3.35Å; F623-Y677 HydrophobicContact CE2-CD1 4.06Å; F623-Y677 HydrophobicContact CE2-CG 4.33Å; F623-Y677 HydrophobicContact CZ-CD1 4.34Å; D673-Y677 WeakPolarHBondContact O-CB 3.44Å; D673-Y677 PolarHBondContact O-N 3.4Å; S674-Y677 PolarHBondContact O-N 2.68Å; A675-Y677 VanDerWaalsContact C-N 3.3Å; A675-Y677 PolarHBondContact O-N 3.49Å; Y677-L679 VanDerWaalsContact C-N 3.3Å; Y677-L679 PolarHBondContact O-N 3.24Å; Y677-R681 HydrophobicContact CD1-CB 3.68Å; Y677-R681 HydrophobicContact CD1-CG 4.26Å; Y677-R681 HydrophobicContact CD2-CB 4.24Å; Y677-R681 HydrophobicContact CD2-CG 3.9Å; Y677-R681 HydrophobicContact CE1-CB 3.53Å; Y677-R681 HydrophobicContact CE1-CG 4.15Å; Y677-R681 HydrophobicContact CE2-CB 4.15Å; Y677-R681 HydrophobicContact CE2-CG 3.83Å; Y677-R681 HydrophobicContact CG-CB 4.02Å; Y677-R681 HydrophobicContact CG-CG 4.11Å; Y677-R681 WeakPolarHBondContact O-CA 3.39Å; Y677-R681 WeakPolarHBondContact O-CB 3.35Å; Y677-R681 PolarHBondContact O-N 2.98Å; Y677-F682 HydrophobicContact CD1-CD1 4.48Å; Y677-F682 AromaticContact CD1-CD2 3.78Å; Y677-F682 HydrophobicContact CD1-CD2 3.78Å; Y677-F682 HydrophobicContact CD1-CE1 4.4Å; Y677-F682 AromaticContact CD1-CE2 3.68Å; Y677-F682 HydrophobicContact CD1-CE2 3.68Å; Y677-F682 HydrophobicContact CD1-CG 4.19Å; Y677-F682 HydrophobicContact CD1-CZ 4.01Å; Y677-F682 HydrophobicContact CE1-CD1 4.09Å; Y677-F682 HydrophobicContact CE1-CD2 4.12Å; Y677-F682 AromaticContact CE1-CE1 3.76Å; Y677-F682 HydrophobicContact CE1-CE1 3.76Å; Y677-F682 AromaticContact CE1-CE2 3.79Å; Y677-F682 HydrophobicContact CE1-CE2 3.79Å; Y677-F682 HydrophobicContact CE1-CG 4.26Å; Y677-F682 AromaticContact CE1-CZ 3.61Å; Y677-F682 HydrophobicContact CE1-CZ 3.61Å; Y677-F682 PolarHBondContact O-N 2.88Å
678	A	92.8	Very high	92.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-60.8	-39.1	176.8	0	0	0	0	0	112.5	F623 S674 A675 N683 K684 L687 I691	F623-A678 HydrophobicContact CE1-CB 4.22Å; F623-A678 HydrophobicContact CZ-CB 4.1Å; S674-A678 WeakPolarHBondContact O-CB 3.36Å; S674-A678 PolarHBondContact O-N 2.84Å; A675-A678 PolarHBondContact O-N 3.22Å; A678-N683 WeakPolarHBondContact O-CA 3.48Å; A678-N683 PolarHBondContact O-N 3.43Å; A678-K684 PolarHBondContact O-N 3.1Å; A678-L687 HydrophobicContact CB-CB 3.99Å; A678-I691 HydrophobicContact CB-CD1 4.03Å
679	L	90.1	Very high	93	Very high	84 Å²	84	52.7 Å²	52.7	44%	0.44	25%	0.254	S	S	.	.	I	π-helix	trans	-79.1	-40	-179	-68.5	173.9	0	0	0	113.3	A675 H676 Y677 Y688	A675-L679 WeakPolarHBondContact O-CG 3.37Å; A675-L679 PolarHBondContact O-N 3.27Å; H676-L679 PolarHBondContact O-N 3.01Å; Y677-L679 VanDerWaalsContact C-N 3.3Å; Y677-L679 PolarHBondContact O-N 3.24Å; L679-Y688 HydrophobicContact CD1-CD2 3.68Å; L679-Y688 HydrophobicContact CD1-CE2 3.75Å; L679-Y688 HydrophobicContact CD1-CG 4.44Å; L679-Y688 HydrophobicContact CD2-CD2 3.95Å; L679-Y688 HydrophobicContact CD2-CG 3.92Å; L679-Y688 HydrophobicContact CG-CD2 3.74Å; L679-Y688 HydrophobicContact CG-CE2 4.34Å; L679-Y688 HydrophobicContact CG-CG 4.22Å
680	T	86.3	Confident	93.2	Very high	75 Å²	75	52.5 Å²	52.5	46%	0.46	25%	0.251	S	S	.	.	I	π-helix	trans	-101.6	-32.2	-170	61.9	0	0	0	0	114.3	H676	H676-T680 PolarHBondContact CE1-OG1 3.33Å; H676-T680 WeakPolarHBondContact O-CB 3.3Å; H676-T680 WeakPolarHBondContact O-CG2 3.41Å; H676-T680 PolarHBondContact O-N 3.17Å; H676-T680 PolarHBondContact O-OG1 2.64Å
681	R	89.1	Confident	93.3	Very high	143 Å²	143	52.5 Å²	52.5	54%	0.54	25%	0.251	S	S	.	.	I	π-helix	trans	-102.5	-53.8	-178	-62.1	-63.9	-172.5	-177.2	-1.3	111.8	Y677	Y677-R681 HydrophobicContact CD1-CB 3.68Å; Y677-R681 HydrophobicContact CD1-CG 4.26Å; Y677-R681 HydrophobicContact CD2-CB 4.24Å; Y677-R681 HydrophobicContact CD2-CG 3.9Å; Y677-R681 HydrophobicContact CE1-CB 3.53Å; Y677-R681 HydrophobicContact CE1-CG 4.15Å; Y677-R681 HydrophobicContact CE2-CB 4.15Å; Y677-R681 HydrophobicContact CE2-CG 3.83Å; Y677-R681 HydrophobicContact CG-CB 4.02Å; Y677-R681 HydrophobicContact CG-CG 4.11Å; Y677-R681 WeakPolarHBondContact O-CA 3.39Å; Y677-R681 WeakPolarHBondContact O-CB 3.35Å; Y677-R681 PolarHBondContact O-N 2.98Å
682	F	92.3	Very high	93.2	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.009	27%	0.265	C	S	.	.	I	π-helix	trans	-75.2	-30.9	176.3	-68.5	-37.8	0	0	0	112.6	V81 Y84 T85 F308 F623 Y677 K684 L687	V81-F682 HydrophobicContact CB-CD1 4.5Å; V81-F682 HydrophobicContact CG1-CB 4.36Å; V81-F682 HydrophobicContact CG1-CD1 3.97Å; V81-F682 WeakPolarHBondContact CG1-O 3.49Å; V81-F682 HydrophobicContact CG2-CD1 4.01Å; V81-F682 HydrophobicContact CG2-CE1 4.47Å; Y84-F682 AromaticContact CD1-CE1 3.99Å; Y84-F682 HydrophobicContact CD1-CE1 3.99Å; Y84-F682 AromaticContact CD1-CZ 3.93Å; Y84-F682 HydrophobicContact CD1-CZ 3.93Å; Y84-F682 HydrophobicContact CE1-CE1 4.22Å; Y84-F682 HydrophobicContact CE1-CE2 4.13Å; Y84-F682 AromaticContact CE1-CZ 3.67Å; Y84-F682 HydrophobicContact CE1-CZ 3.67Å; T85-F682 HydrophobicContact CG2-CB 4.37Å; T85-F682 HydrophobicContact CG2-CD1 4.3Å; T85-F682 HydrophobicContact CG2-CG 4.27Å; F308-F682 AromaticContact CE1-CE1 3.93Å; F308-F682 HydrophobicContact CE1-CE1 3.93Å; F308-F682 HydrophobicContact CZ-CE1 4.16Å; F623-F682 HydrophobicContact CD1-CD2 4.21Å; F623-F682 AromaticContact CD1-CE2 3.73Å; F623-F682 HydrophobicContact CD1-CE2 3.73Å; F623-F682 AromaticContact CD2-CE2 3.79Å; F623-F682 HydrophobicContact CD2-CE2 3.79Å; F623-F682 AromaticContact CE1-CD2 3.7Å; F623-F682 HydrophobicContact CE1-CD2 3.7Å; F623-F682 AromaticContact CE1-CE2 3.62Å; F623-F682 HydrophobicContact CE1-CE2 3.62Å; F623-F682 HydrophobicContact CE2-CD2 4.25Å; F623-F682 AromaticContact CE2-CE2 3.68Å; F623-F682 HydrophobicContact CE2-CE2 3.68Å; F623-F682 AromaticContact CG-CE2 3.82Å; F623-F682 HydrophobicContact CG-CE2 3.82Å; F623-F682 AromaticContact CZ-CD2 3.72Å; F623-F682 HydrophobicContact CZ-CD2 3.72Å; F623-F682 AromaticContact CZ-CE2 3.58Å; F623-F682 HydrophobicContact CZ-CE2 3.58Å; Y677-F682 HydrophobicContact CD1-CD1 4.48Å; Y677-F682 AromaticContact CD1-CD2 3.78Å; Y677-F682 HydrophobicContact CD1-CD2 3.78Å; Y677-F682 HydrophobicContact CD1-CE1 4.4Å; Y677-F682 AromaticContact CD1-CE2 3.68Å; Y677-F682 HydrophobicContact CD1-CE2 3.68Å; Y677-F682 HydrophobicContact CD1-CG 4.19Å; Y677-F682 HydrophobicContact CD1-CZ 4.01Å; Y677-F682 HydrophobicContact CE1-CD1 4.09Å; Y677-F682 HydrophobicContact CE1-CD2 4.12Å; Y677-F682 AromaticContact CE1-CE1 3.76Å; Y677-F682 HydrophobicContact CE1-CE1 3.76Å; Y677-F682 AromaticContact CE1-CE2 3.79Å; Y677-F682 HydrophobicContact CE1-CE2 3.79Å; Y677-F682 HydrophobicContact CE1-CG 4.26Å; Y677-F682 AromaticContact CE1-CZ 3.61Å; Y677-F682 HydrophobicContact CE1-CZ 3.61Å; Y677-F682 PolarHBondContact O-N 2.88Å; F682-K684 HydrophobicContact CB-CG 4.47Å; F682-K684 PolarHBondContact O-N 3.33Å; F682-K684 PolarHBondContact O-NZ 2.98Å; F682-L687 HydrophobicContact CB-CD1 4.05Å; F682-L687 HydrophobicContact CD2-CD1 3.73Å; F682-L687 HydrophobicContact CG-CD1 4.16Å
683	N	94.8	Very high	93.4	Very high	124 Å²	124	56.8 Å²	56.8	66%	0.663	28%	0.281	S	S	*	.			trans	50.3	56.7	-177.5	-168.5	20.5	0	0	0	111.3	A678	A678-N683 WeakPolarHBondContact O-CA 3.48Å; A678-N683 PolarHBondContact O-N 3.43Å
684	K	93.1	Very high	93.7	Very high	62 Å²	62	56 Å²	56	27%	0.27	28%	0.276	S	S	.	.			trans	-133.4	123.6	178.5	-61.7	-63.8	165	-69.4	0	110.7	T85 A678 F682 F686 L687	T85-K684 HydrophobicContact CG2-CG 4.04Å; T85-K684 WeakPolarHBondContact OG1-CE 3.4Å; A678-K684 PolarHBondContact O-N 3.1Å; F682-K684 HydrophobicContact CB-CG 4.47Å; F682-K684 PolarHBondContact O-N 3.33Å; F682-K684 PolarHBondContact O-NZ 2.98Å; K684-F686 HydrophobicContact CB-CD1 4.11Å; K684-F686 HydrophobicContact CB-CE1 3.86Å; K684-F686 HydrophobicContact CB-CZ 4.46Å; K684-F686 HydrophobicContact CD-CE1 4.12Å; K684-F686 HydrophobicContact CG-CE1 4.05Å; K684-L687 HydrophobicContact CB-CB 4.45Å; K684-L687 HydrophobicContact CB-CD1 4.03Å; K684-L687 HydrophobicContact CB-CG 4.15Å; K684-L687 HydrophobicContact CG-CD1 4.41Å
685	Q	92.6	Very high	93.8	Very high	160 Å²	160	56.5 Å²	56.5	75%	0.748	28%	0.279	S	S	*	.	H	α-helix	trans	-64.8	-49.1	179.7	-69.5	177.2	-9.3	0	0	112	L687 Y688 D689	Q685-L687 PolarHBondContact O-N 3.44Å; Q685-L687 VanDerWaalsContact O-N 3.08Å; Q685-Y688 CarbonylContact O-C 3.45Å; Q685-Y688 WeakPolarHBondContact O-CA 3.25Å; Q685-Y688 WeakPolarHBondContact O-CB 3.37Å; Q685-Y688 PolarHBondContact O-N 3.19Å; Q685-D689 VanDerWaalsContact O-CG 3.28Å; Q685-D689 PolarHBondContact O-N 3.32Å
686	F	95.6	Very high	93.9	Very high	64 Å²	64	61.5 Å²	61.5	28%	0.281	31%	0.306	S	S	.	.	H	α-helix	trans	-58.5	-30.4	-175.7	74.9	-95.7	0	0	0	113.8	K684 E690	K684-F686 HydrophobicContact CB-CD1 4.11Å; K684-F686 HydrophobicContact CB-CE1 3.86Å; K684-F686 HydrophobicContact CB-CZ 4.46Å; K684-F686 HydrophobicContact CD-CE1 4.12Å; K684-F686 HydrophobicContact CG-CE1 4.05Å; F686-E690 WeakPolarHBondContact O-CB 3.31Å; F686-E690 VanDerWaalsContact O-CG 3.28Å; F686-E690 WeakPolarHBondContact O-CG 3.48Å; F686-E690 PolarHBondContact O-N 3.35Å; F686-E690 VanDerWaalsContact O-N 3.09Å
687	L	95.9	Very high	94.1	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-67.9	-42.6	174.4	-70.3	178.5	0	0	0	111	T85 W622 F623 A678 F682 K684 Q685 E690 I691	T85-L687 HydrophobicContact CG2-CD1 3.93Å; W622-L687 HydrophobicContact CZ3-CD2 4.48Å; F623-L687 HydrophobicContact CE1-CD1 4.16Å; A678-L687 HydrophobicContact CB-CB 3.99Å; F682-L687 HydrophobicContact CB-CD1 4.05Å; F682-L687 HydrophobicContact CD2-CD1 3.73Å; F682-L687 HydrophobicContact CG-CD1 4.16Å; K684-L687 HydrophobicContact CB-CB 4.45Å; K684-L687 HydrophobicContact CB-CD1 4.03Å; K684-L687 HydrophobicContact CB-CG 4.15Å; K684-L687 HydrophobicContact CG-CD1 4.41Å; Q685-L687 PolarHBondContact O-N 3.44Å; Q685-L687 VanDerWaalsContact O-N 3.08Å; L687-E690 PolarHBondContact O-N 2.97Å; L687-I691 WeakPolarHBondContact O-CD1 3.41Å; L687-I691 VanDerWaalsContact O-CG1 3.24Å; L687-I691 WeakPolarHBondContact O-CG1 3.39Å; L687-I691 PolarHBondContact O-N 2.97Å
688	Y	95.8	Very high	94.3	Very high	39 Å²	39	58.6 Å²	58.6	15%	0.153	30%	0.296	C	S	.	.	H	α-helix	trans	-65.7	-42.8	174.7	-179.7	-93.2	0	0	0	111.4	A675 L679 Q685 E690 I691 E692 R760	A675-Y688 HydrophobicContact CB-CD2 3.96Å; A675-Y688 HydrophobicContact CB-CE2 3.92Å; L679-Y688 HydrophobicContact CD1-CD2 3.68Å; L679-Y688 HydrophobicContact CD1-CE2 3.75Å; L679-Y688 HydrophobicContact CD1-CG 4.44Å; L679-Y688 HydrophobicContact CD2-CD2 3.95Å; L679-Y688 HydrophobicContact CD2-CG 3.92Å; L679-Y688 HydrophobicContact CG-CD2 3.74Å; L679-Y688 HydrophobicContact CG-CE2 4.34Å; L679-Y688 HydrophobicContact CG-CG 4.22Å; Q685-Y688 CarbonylContact O-C 3.45Å; Q685-Y688 WeakPolarHBondContact O-CA 3.25Å; Q685-Y688 WeakPolarHBondContact O-CB 3.37Å; Q685-Y688 PolarHBondContact O-N 3.19Å; Y688-E690 VanDerWaalsContact C-N 3.26Å; Y688-E690 PolarHBondContact O-N 3.43Å; Y688-I691 PolarHBondContact O-N 3.25Å; Y688-E692 HydrophobicContact CE1-CB 4.26Å; Y688-E692 WeakPolarHBondContact O-CB 3.41Å; Y688-E692 PolarHBondContact O-N 3.21Å; Y688-R760 PolarHBondContact OH-NH1 2.99Å
689	D	95.7	Very high	94.5	Very high	86 Å²	86	59.7 Å²	59.7	46%	0.46	30%	0.301	S	S	.	.	H	α-helix	trans	-58	-40.7	178.3	-58.5	-24	0	0	0	111.2	Q685 A693	Q685-D689 VanDerWaalsContact O-CG 3.28Å; Q685-D689 PolarHBondContact O-N 3.32Å; D689-A693 VanDerWaalsContact O-CB 3.31Å; D689-A693 WeakPolarHBondContact O-CB 3.45Å; D689-A693 PolarHBondContact O-N 3.4Å
690	E	97.2	Very high	94.7	Very high	43 Å²	43	60.1 Å²	60.1	20%	0.201	30%	0.304	C	S	.	.	H	α-helix	trans	-69.7	-42.1	176.2	-73.7	172.7	-173.5	0	0	112.8	R87 W622 Q637 F686 L687 Y688 E692 A693 E694	R87-E690 IonicContact CZ-OE1 2.86Å; R87-E690 IonicContact CZ-OE2 3.41Å; R87-E690 IonicContact NH1-OE1 2.94Å; R87-E690 PolarHBondContact NH1-OE1 2.89Å; R87-E690 IonicContact NH1-OE2 2.7Å; R87-E690 IonicContact NH2-OE1 3.91Å; R87-E690 PolarHBondContact NH2-OE1 3.39Å; R87-E690 IonicContact NH2-OE2 3.88Å; R87-E690 PolarHBondContact NH2-OE2 3.23Å; W622-E690 HydrophobicContact CH2-CB 3.89Å; W622-E690 HydrophobicContact CZ2-CB 4.19Å; Q637-E690 PolarHBondContact NE2-OE2 3.48Å; F686-E690 WeakPolarHBondContact O-CB 3.31Å; F686-E690 VanDerWaalsContact O-CG 3.28Å; F686-E690 WeakPolarHBondContact O-CG 3.48Å; F686-E690 PolarHBondContact O-N 3.35Å; F686-E690 VanDerWaalsContact O-N 3.09Å; L687-E690 PolarHBondContact O-N 2.97Å; Y688-E690 VanDerWaalsContact C-N 3.26Å; Y688-E690 PolarHBondContact O-N 3.43Å; E690-E692 VanDerWaalsContact C-N 3.34Å; E690-A693 PolarHBondContact O-N 2.88Å; E690-E694 WeakPolarHBondContact O-CB 3.43Å; E690-E694 PolarHBondContact O-N 3.07Å
691	I	96.8	Very high	95.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-45.9	174.1	-68.1	164.8	0	0	0	110.2	W622 F623 Y671 A675 A678 L687 Y688 E694 V695 L758	W622-I691 HydrophobicContact CD2-CD1 4.3Å; W622-I691 HydrophobicContact CD2-CG1 3.69Å; W622-I691 HydrophobicContact CE3-CD1 3.8Å; W622-I691 HydrophobicContact CE3-CG1 3.56Å; W622-I691 HydrophobicContact CH2-CD1 4.27Å; W622-I691 HydrophobicContact CH2-CG1 3.44Å; W622-I691 VanDerWaalsContact CH2-CG1 3.44Å; W622-I691 HydrophobicContact CZ2-CB 4.38Å; W622-I691 HydrophobicContact CZ2-CG1 3.54Å; W622-I691 HydrophobicContact CZ3-CD1 3.79Å; W622-I691 HydrophobicContact CZ3-CG1 3.44Å; W622-I691 VanDerWaalsContact CZ3-CG1 3.44Å; F623-I691 HydrophobicContact CE1-CD1 4.31Å; F623-I691 HydrophobicContact CZ-CD1 4.47Å; Y671-I691 HydrophobicContact CD1-CG2 4.16Å; A675-I691 HydrophobicContact CB-CG2 4.14Å; A678-I691 HydrophobicContact CB-CD1 4.03Å; L687-I691 WeakPolarHBondContact O-CD1 3.41Å; L687-I691 VanDerWaalsContact O-CG1 3.24Å; L687-I691 WeakPolarHBondContact O-CG1 3.39Å; L687-I691 PolarHBondContact O-N 2.97Å; Y688-I691 PolarHBondContact O-N 3.25Å; I691-E694 PolarHBondContact O-N 2.81Å; I691-V695 HydrophobicContact CG2-CG2 4.38Å; I691-V695 WeakPolarHBondContact O-CB 3.42Å; I691-V695 WeakPolarHBondContact O-CG2 3.42Å; I691-V695 PolarHBondContact O-N 2.96Å; I691-L758 HydrophobicContact CG2-CD2 4.2Å
692	E	95.7	Very high	95.5	Very high	61 Å²	61	52.7 Å²	52.7	29%	0.285	27%	0.27	S	S	.	.	H	α-helix	trans	-63.4	-45	-179.7	-177.6	174.1	-107	0	0	111.6	Y688 E690 E694 V695 N696 L758 R760	Y688-E692 HydrophobicContact CE1-CB 4.26Å; Y688-E692 WeakPolarHBondContact O-CB 3.41Å; Y688-E692 PolarHBondContact O-N 3.21Å; E690-E692 VanDerWaalsContact C-N 3.34Å; E692-E694 VanDerWaalsContact C-N 3.34Å; E692-E694 PolarHBondContact O-N 2.92Å; E692-V695 PolarHBondContact O-N 3.41Å; E692-N696 WeakPolarHBondContact O-CB 3.44Å; E692-N696 PolarHBondContact O-N 3.16Å; E692-L758 HydrophobicContact CB-CD1 4.14Å; E692-L758 HydrophobicContact CG-CD1 4.23Å; E692-R760 IonicContact OE1-CZ 2.71Å; E692-R760 IonicContact OE1-NH1 3.28Å; E692-R760 PolarHBondContact OE1-NH1 3.43Å; E692-R760 IonicContact OE1-NH2 2.88Å; E692-R760 PolarHBondContact OE1-NH2 3.21Å
693	A	95.8	Very high	95.7	Very high	63 Å²	63	52.7 Å²	52.7	52%	0.521	27%	0.27	S	S	.	.	H	α-helix	trans	-62.5	-40.7	176	0	0	0	0	0	112.2	D689 E690 N696 L697	D689-A693 VanDerWaalsContact O-CB 3.31Å; D689-A693 WeakPolarHBondContact O-CB 3.45Å; D689-A693 PolarHBondContact O-N 3.4Å; E690-A693 PolarHBondContact O-N 2.88Å; A693-N696 PolarHBondContact O-N 2.91Å; A693-L697 PolarHBondContact O-N 3.44Å
694	E	97.8	Very high	95.8	Very high	15 Å²	15	53.8 Å²	53.8	7%	0.07	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-45.9	176.6	-172.4	170.4	137.3	0	0	111.6	W622 R624 I640 S643 Y671 E690 I691 E692 N696 L697 C698	W622-E694 PolarHBondContact NE1-OE1 3.24Å; W622-E694 VanDerWaalsContact NE1-OE1 3.16Å; W622-E694 PolarHBondContact NE1-OE2 3.48Å; R624-E694 IonicContact CZ-OE2 2.77Å; R624-E694 IonicContact NH1-OE2 3.21Å; R624-E694 IonicContact NH2-OE2 3.68Å; R624-E694 PolarHBondContact NH2-OE2 2.88Å; I640-E694 HydrophobicContact CG2-CG 3.85Å; S643-E694 WeakPolarHBondContact CB-OE1 3.16Å; S643-E694 PolarHBondContact OG-OE1 3.11Å; Y671-E694 HydrophobicContact CE1-CG 4.21Å; Y671-E694 PolarHBondContact OH-OE1 2.86Å; E690-E694 WeakPolarHBondContact O-CB 3.43Å; E690-E694 PolarHBondContact O-N 3.07Å; I691-E694 PolarHBondContact O-N 2.81Å; E692-E694 VanDerWaalsContact C-N 3.34Å; E692-E694 PolarHBondContact O-N 2.92Å; E694-N696 VanDerWaalsContact C-N 3.31Å; E694-N696 PolarHBondContact O-N 3Å; E694-L697 PolarHBondContact O-N 2.88Å; E694-C698 VanDerWaalsContact O-CB 3.27Å; E694-C698 WeakPolarHBondContact O-CB 3.31Å; E694-C698 PolarHBondContact O-N 3.49Å; E694-C698 PolarHBondContact O-SG 2.93Å
695	V	96.6	Very high	96	Very high	12 Å²	12	52.9 Å²	52.9	7%	0.073	26%	0.262	C	S	.	.	H	α-helix	trans	-59.7	-42.6	175.5	167.6	0	0	0	0	111	Y671 I691 E692 L697 C698 F699 L757 L758	Y671-V695 HydrophobicContact CD1-CG2 3.59Å; Y671-V695 HydrophobicContact CD2-CG2 3.64Å; Y671-V695 HydrophobicContact CE1-CG2 4.11Å; Y671-V695 HydrophobicContact CE2-CG2 4.16Å; Y671-V695 HydrophobicContact CG-CG2 3.32Å; I691-V695 HydrophobicContact CG2-CG2 4.38Å; I691-V695 WeakPolarHBondContact O-CB 3.42Å; I691-V695 WeakPolarHBondContact O-CG2 3.42Å; I691-V695 PolarHBondContact O-N 2.96Å; E692-V695 PolarHBondContact O-N 3.41Å; V695-L697 VanDerWaalsContact C-N 3.34Å; V695-L697 PolarHBondContact O-N 3.2Å; V695-C698 PolarHBondContact O-N 3Å; V695-F699 WeakPolarHBondContact O-CB 3.35Å; V695-F699 PolarHBondContact O-N 3.41Å; V695-L757 HydrophobicContact CG1-CD2 3.66Å; V695-L757 HydrophobicContact CG1-CG 4.09Å; V695-L758 HydrophobicContact CB-CD1 3.75Å; V695-L758 HydrophobicContact CG1-CD1 3.84Å; V695-L758 HydrophobicContact CG1-CG 4.34Å; V695-L758 HydrophobicContact CG2-CD1 3.86Å; V695-L758 HydrophobicContact CG2-CG 4.36Å
696	N	94.6	Very high	96.2	Very high	109 Å²	109	45.3 Å²	45.3	58%	0.583	23%	0.226	S	C	*	.	H	α-helix	trans	-59.3	-46	-179.8	-165.8	44.5	0	0	0	111.6	E692 A693 E694 D700	E692-N696 WeakPolarHBondContact O-CB 3.44Å; E692-N696 PolarHBondContact O-N 3.16Å; A693-N696 PolarHBondContact O-N 2.91Å; E694-N696 VanDerWaalsContact C-N 3.31Å; E694-N696 PolarHBondContact O-N 3Å; N696-D700 PolarHBondContact O-N 3.39Å
697	L	96	Very high	96.3	Very high	88 Å²	88	42.4 Å²	42.4	46%	0.461	21%	0.214	S	C	.	.	H	α-helix	trans	-66.6	-48.6	176.6	177	61	0	0	0	112.5	I640 A693 E694 V695 F699 D700 Q701	I640-L697 HydrophobicContact CD1-CD2 4.06Å; I640-L697 HydrophobicContact CD1-CG 4.37Å; I640-L697 HydrophobicContact CG2-CD2 4.14Å; A693-L697 PolarHBondContact O-N 3.44Å; E694-L697 PolarHBondContact O-N 2.88Å; V695-L697 VanDerWaalsContact C-N 3.34Å; V695-L697 PolarHBondContact O-N 3.2Å; L697-F699 VanDerWaalsContact C-N 3.34Å; L697-F699 PolarHBondContact O-N 2.72Å; L697-D700 PolarHBondContact O-N 2.9Å; L697-Q701 PolarHBondContact O-N 3.04Å
698	C	96.6	Very high	96.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.4	-37.2	-177.8	-72.1	0	0	0	0	111.8	W646 E694 V695 Q701 F702	W646-C698 HydrophobicContact CD2-CB 3.94Å; W646-C698 HydrophobicContact CE3-CB 3.47Å; W646-C698 VanDerWaalsContact CE3-CB 3.47Å; W646-C698 HydrophobicContact CH2-CB 4.25Å; W646-C698 WeakPolarHBondContact CH2-O 3.47Å; W646-C698 HydrophobicContact CZ3-CB 3.65Å; W646-C698 VanDerWaalsContact CZ3-O 3.29Å; W646-C698 WeakPolarHBondContact CZ3-O 3.1Å; E694-C698 VanDerWaalsContact O-CB 3.27Å; E694-C698 WeakPolarHBondContact O-CB 3.31Å; E694-C698 PolarHBondContact O-N 3.49Å; E694-C698 PolarHBondContact O-SG 2.93Å; V695-C698 PolarHBondContact O-N 3Å; C698-Q701 PolarHBondContact O-N 3.41Å; C698-F702 WeakPolarHBondContact O-CB 3.4Å; C698-F702 PolarHBondContact O-N 3.04Å
699	F	95.5	Very high	96.3	Very high	23 Å²	23	42.5 Å²	42.5	10%	0.101	22%	0.218	C	C	.	.	H	α-helix	trans	-71.1	-37.2	-179.7	-168.1	-102.2	0	0	0	112.3	L668 V695 L697 Q701 F702 V703 L757 I762 L764 L767	L668-F699 HydrophobicContact CD2-CD2 3.95Å; L668-F699 HydrophobicContact CD2-CE2 4.2Å; V695-F699 WeakPolarHBondContact O-CB 3.35Å; V695-F699 PolarHBondContact O-N 3.41Å; L697-F699 VanDerWaalsContact C-N 3.34Å; L697-F699 PolarHBondContact O-N 2.72Å; F699-Q701 VanDerWaalsContact C-N 3.33Å; F699-Q701 PolarHBondContact O-N 3.35Å; F699-F702 HydrophobicContact CD2-CD1 4.42Å; F699-F702 HydrophobicContact CE2-CD1 4.22Å; F699-F702 WeakPolarHBondContact O-CB 3.43Å; F699-F702 PolarHBondContact O-N 3.12Å; F699-V703 HydrophobicContact CD1-CG2 4.07Å; F699-V703 HydrophobicContact CE1-CG2 3.65Å; F699-V703 HydrophobicContact CZ-CG2 3.91Å; F699-V703 WeakPolarHBondContact O-CG2 3.48Å; F699-V703 PolarHBondContact O-N 3.19Å; F699-L757 HydrophobicContact CD2-CD2 4.04Å; F699-L757 HydrophobicContact CE2-CD2 4.46Å; F699-I762 HydrophobicContact CE1-CG2 3.76Å; F699-I762 HydrophobicContact CZ-CB 4.36Å; F699-I762 HydrophobicContact CZ-CG2 3.59Å; F699-L764 HydrophobicContact CZ-CD1 4.35Å; F699-L767 HydrophobicContact CE1-CD1 3.72Å; F699-L767 HydrophobicContact CZ-CD1 4.23Å
700	D	95.5	Very high	96.4	Very high	94 Å²	94	38.4 Å²	38.4	50%	0.503	20%	0.196	S	C	.	.	H	α-helix	trans	-60.7	-44.2	171.5	-86	-13.7	0	0	0	111.4	N696 L697 V703 Y704	N696-D700 PolarHBondContact O-N 3.39Å; L697-D700 PolarHBondContact O-N 2.9Å; D700-V703 PolarHBondContact O-N 3.43Å; D700-Y704 WeakPolarHBondContact O-CB 3.35Å; D700-Y704 PolarHBondContact O-N 2.88Å
701	Q	95.7	Very high	96.5	Very high	62 Å²	62	36.5 Å²	36.5	29%	0.29	19%	0.187	S	C	.	.	H	α-helix	trans	-64.2	-40.8	174.1	-68.2	-172.2	35.3	0	0	112.1	W646 L697 C698 F699 Y704 K705	W646-Q701 HydrophobicContact CH2-CB 3.8Å; W646-Q701 HydrophobicContact CZ2-CB 3.83Å; L697-Q701 PolarHBondContact O-N 3.04Å; C698-Q701 PolarHBondContact O-N 3.41Å; F699-Q701 VanDerWaalsContact C-N 3.33Å; F699-Q701 PolarHBondContact O-N 3.35Å; Q701-Y704 PolarHBondContact O-N 2.93Å; Q701-K705 WeakPolarHBondContact O-CB 3.48Å; Q701-K705 WeakPolarHBondContact O-CG 3.27Å; Q701-K705 PolarHBondContact O-N 2.94Å
702	F	96.8	Very high	96.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-56.8	-53.2	176.4	176.6	-85.4	0	0	0	110.9	W646 T649 L653 V664 L665 C698 F699 Y704 L706 L764	W646-F702 HydrophobicContact CH2-CB 4.49Å; W646-F702 HydrophobicContact CZ3-CB 4.43Å; T649-F702 HydrophobicContact CG2-CD2 3.93Å; T649-F702 HydrophobicContact CG2-CE2 4.3Å; L653-F702 HydrophobicContact CD1-CB 4.29Å; L653-F702 HydrophobicContact CD1-CD2 3.72Å; L653-F702 HydrophobicContact CD1-CE2 4.43Å; L653-F702 HydrophobicContact CD1-CG 4.3Å; L653-F702 HydrophobicContact CD2-CD2 4.24Å; L653-F702 HydrophobicContact CD2-CE2 4.19Å; L653-F702 HydrophobicContact CG-CD2 4.39Å; V664-F702 HydrophobicContact CG1-CE2 3.95Å; V664-F702 HydrophobicContact CG1-CZ 4.11Å; V664-F702 HydrophobicContact CG2-CE2 3.84Å; L665-F702 HydrophobicContact CD2-CE1 4.33Å; L665-F702 HydrophobicContact CD2-CE2 4.45Å; L665-F702 HydrophobicContact CD2-CZ 3.75Å; C698-F702 WeakPolarHBondContact O-CB 3.4Å; C698-F702 PolarHBondContact O-N 3.04Å; F699-F702 HydrophobicContact CD2-CD1 4.42Å; F699-F702 HydrophobicContact CE2-CD1 4.22Å; F699-F702 WeakPolarHBondContact O-CB 3.43Å; F699-F702 PolarHBondContact O-N 3.12Å; F702-Y704 VanDerWaalsContact C-N 3.33Å; F702-Y704 PolarHBondContact O-N 3.31Å; F702-L706 HydrophobicContact CD1-CD2 4.46Å; F702-L706 HydrophobicContact CE1-CD2 3.64Å; F702-L706 HydrophobicContact CZ-CD2 3.85Å; F702-L706 WeakPolarHBondContact O-CB 3.45Å; F702-L706 PolarHBondContact O-N 2.73Å; F702-L764 HydrophobicContact CD1-CD1 4.4Å; F702-L764 HydrophobicContact CE1-CD1 3.94Å; F702-L764 HydrophobicContact CE1-CD2 4.02Å
703	V	96.9	Very high	96.7	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-62.4	-41.9	179.8	173.6	0	0	0	0	110.9	F699 D700 A707 L764 L767	F699-V703 HydrophobicContact CD1-CG2 4.07Å; F699-V703 HydrophobicContact CE1-CG2 3.65Å; F699-V703 HydrophobicContact CZ-CG2 3.91Å; F699-V703 WeakPolarHBondContact O-CG2 3.48Å; F699-V703 PolarHBondContact O-N 3.19Å; D700-V703 PolarHBondContact O-N 3.43Å; V703-A707 WeakPolarHBondContact O-CB 3.35Å; V703-A707 PolarHBondContact O-N 3.42Å; V703-L764 HydrophobicContact CG2-CD1 4.06Å; V703-L767 HydrophobicContact CG1-CB 3.93Å; V703-L767 HydrophobicContact CG2-CB 4.45Å; V703-L767 HydrophobicContact CG2-CD1 4.07Å
704	Y	96	Very high	96.8	Very high	147 Å²	147	33 Å²	33	58%	0.576	16%	0.161	S	C	*	.	H	α-helix	trans	-62.6	-56.7	178.3	-179.9	-91.2	0	0	0	111.8	D700 Q701 F702 L706 A707 D708	D700-Y704 WeakPolarHBondContact O-CB 3.35Å; D700-Y704 PolarHBondContact O-N 2.88Å; Q701-Y704 PolarHBondContact O-N 2.93Å; F702-Y704 VanDerWaalsContact C-N 3.33Å; F702-Y704 PolarHBondContact O-N 3.31Å; Y704-L706 VanDerWaalsContact C-N 3.3Å; Y704-L706 PolarHBondContact O-N 3.31Å; Y704-A707 PolarHBondContact O-N 3.09Å; Y704-D708 VanDerWaalsContact O-CB 3.22Å; Y704-D708 WeakPolarHBondContact O-CB 3.43Å; Y704-D708 PolarHBondContact O-N 3.34Å
705	K	97.1	Very high	96.8	Very high	43 Å²	43	32.3 Å²	32.3	19%	0.187	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-39.3	-178.2	-71	-169.9	179.7	-163.9	0	111.5	D650 L653 E654 Q701 Q709	D650-K705 WeakPolarHBondContact OD1-CE 3.45Å; D650-K705 IonicContact OD1-NZ 3.43Å; D650-K705 PolarHBondContact OD1-NZ 3.05Å; D650-K705 IonicContact OD2-NZ 2.71Å; D650-K705 PolarHBondContact OD2-NZ 3.37Å; L653-K705 HydrophobicContact CB-CB 4.34Å; L653-K705 HydrophobicContact CB-CD 4.21Å; L653-K705 HydrophobicContact CD1-CB 4.33Å; L653-K705 HydrophobicContact CD1-CD 4.43Å; E654-K705 IonicContact OE2-NZ 3.44Å; E654-K705 PolarHBondContact OE2-NZ 2.72Å; Q701-K705 WeakPolarHBondContact O-CB 3.48Å; Q701-K705 WeakPolarHBondContact O-CG 3.27Å; Q701-K705 PolarHBondContact O-N 2.94Å; K705-Q709 VanDerWaalsContact O-CG 3.23Å; K705-Q709 WeakPolarHBondContact O-CG 3.26Å; K705-Q709 PolarHBondContact O-N 3.18Å; K705-Q709 VanDerWaalsContact O-N 3.16Å; K705-Q709 PolarHBondContact O-NE2 2.67Å
706	L	96.6	Very high	96.9	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-68.9	-48.1	179.4	-177.4	59.9	0	0	0	111.9	L653 M661 F702 Y704 D708 Q709 I710 Y746 L749 L764 I768	L653-L706 HydrophobicContact CD2-CB 4.28Å; M661-L706 HydrophobicContact SD-CD1 4.17Å; F702-L706 HydrophobicContact CD1-CD2 4.46Å; F702-L706 HydrophobicContact CE1-CD2 3.64Å; F702-L706 HydrophobicContact CZ-CD2 3.85Å; F702-L706 WeakPolarHBondContact O-CB 3.45Å; F702-L706 PolarHBondContact O-N 2.73Å; Y704-L706 VanDerWaalsContact C-N 3.3Å; Y704-L706 PolarHBondContact O-N 3.31Å; L706-D708 PolarHBondContact O-N 3.33Å; L706-Q709 VanDerWaalsContact O-CG 3.31Å; L706-Q709 WeakPolarHBondContact O-CG 3.14Å; L706-I710 HydrophobicContact CD1-CD1 3.77Å; L706-I710 HydrophobicContact CD1-CG1 4.21Å; L706-I710 HydrophobicContact CG-CD1 3.74Å; L706-I710 WeakPolarHBondContact O-CB 3.22Å; L706-I710 WeakPolarHBondContact O-CD1 3.33Å; L706-I710 WeakPolarHBondContact O-CG1 3.21Å; L706-I710 PolarHBondContact O-N 2.8Å; L706-Y746 HydrophobicContact CD1-CD1 3.97Å; L706-Y746 HydrophobicContact CD1-CE1 4.12Å; L706-L749 HydrophobicContact CD1-CD1 3.66Å; L706-L749 HydrophobicContact CD2-CB 4.35Å; L706-L749 HydrophobicContact CD2-CD1 3.99Å; L706-L749 HydrophobicContact CG-CD1 4.49Å; L706-L764 HydrophobicContact CD2-CD2 4.25Å; L706-I768 HydrophobicContact CD2-CD1 3.9Å; L706-I768 HydrophobicContact CG-CD1 4.34Å
707	A	97.6	Very high	97	Very high	3 Å²	3	29.8 Å²	29.8	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-65.8	-39.5	179.3	0	0	0	0	0	112.2	V703 Y704 I710 F711 I768 R771	V703-A707 WeakPolarHBondContact O-CB 3.35Å; V703-A707 PolarHBondContact O-N 3.42Å; Y704-A707 PolarHBondContact O-N 3.09Å; A707-I710 PolarHBondContact O-N 3.01Å; A707-F711 PolarHBondContact O-N 3.27Å; A707-I768 HydrophobicContact CB-CG2 4.33Å; A707-R771 HydrophobicContact CB-CB 3.65Å; A707-R771 HydrophobicContact CB-CG 4.28Å
708	D	96.5	Very high	97.1	Very high	39 Å²	39	25.6 Å²	25.6	21%	0.209	12%	0.122	C	C	.	.	H	α-helix	trans	-60.2	-50	177.5	-175.1	69.4	0	0	0	111.5	Y704 L706 I710 F711 A712 Q886	Y704-D708 VanDerWaalsContact O-CB 3.22Å; Y704-D708 WeakPolarHBondContact O-CB 3.43Å; Y704-D708 PolarHBondContact O-N 3.34Å; L706-D708 PolarHBondContact O-N 3.33Å; D708-I710 PolarHBondContact O-N 2.95Å; D708-F711 PolarHBondContact O-N 3.41Å; D708-A712 WeakPolarHBondContact O-CB 3.36Å; D708-A712 PolarHBondContact O-N 3.44Å; D708-Q886 PolarHBondContact OD1-NE2 2.88Å
709	Q	96.5	Very high	97.2	Very high	3 Å²	3	25.6 Å²	25.6	1%	0.014	12%	0.122	C	C	.	.	H	α-helix	trans	-69.4	-33.3	178.9	72.4	-170.4	-86.9	0	0	113.4	L653 K656 K705 L706 Y713 Y746	L653-Q709 PolarHBondContact O-NE2 3.47Å; L653-Q709 VanDerWaalsContact O-NE2 3.12Å; K656-Q709 HydrophobicContact CD-CB 4.07Å; K705-Q709 VanDerWaalsContact O-CG 3.23Å; K705-Q709 WeakPolarHBondContact O-CG 3.26Å; K705-Q709 PolarHBondContact O-N 3.18Å; K705-Q709 VanDerWaalsContact O-N 3.16Å; K705-Q709 PolarHBondContact O-NE2 2.67Å; L706-Q709 VanDerWaalsContact O-CG 3.31Å; L706-Q709 WeakPolarHBondContact O-CG 3.14Å; Q709-Y713 WeakPolarHBondContact O-CB 3.42Å; Q709-Y713 PolarHBondContact O-N 3.15Å; Q709-Y746 HydrophobicContact CG-CE1 3.85Å; Q709-Y746 PolarHBondContact OE1-OH 3.03Å
710	I	97.9	Very high	97.2	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.1	-49	174.8	-76	170.3	0	0	0	110.6	L706 A707 D708 Y713 Y714 Y746 L750 I768 L812	L706-I710 HydrophobicContact CD1-CD1 3.77Å; L706-I710 HydrophobicContact CD1-CG1 4.21Å; L706-I710 HydrophobicContact CG-CD1 3.74Å; L706-I710 WeakPolarHBondContact O-CB 3.22Å; L706-I710 WeakPolarHBondContact O-CD1 3.33Å; L706-I710 WeakPolarHBondContact O-CG1 3.21Å; L706-I710 PolarHBondContact O-N 2.8Å; A707-I710 PolarHBondContact O-N 3.01Å; D708-I710 PolarHBondContact O-N 2.95Å; I710-Y713 PolarHBondContact O-N 3.45Å; I710-Y714 HydrophobicContact CG2-CD2 3.92Å; I710-Y714 HydrophobicContact CG2-CE2 4.01Å; I710-Y714 VanDerWaalsContact O-CD2 3.3Å; I710-Y714 WeakPolarHBondContact O-CD2 3.4Å; I710-Y714 PolarHBondContact O-N 3.47Å; I710-Y746 HydrophobicContact CD1-CD1 4.13Å; I710-Y746 HydrophobicContact CD1-CG 4.29Å; I710-Y746 HydrophobicContact CG1-CD1 3.59Å; I710-Y746 HydrophobicContact CG1-CD2 4.1Å; I710-Y746 HydrophobicContact CG1-CE1 4.07Å; I710-Y746 HydrophobicContact CG1-CG 3.61Å; I710-L750 HydrophobicContact CD1-CD2 3.99Å; I710-L750 HydrophobicContact CD1-CG 4.2Å; I710-L750 HydrophobicContact CG2-CD2 4.3Å; I710-I768 HydrophobicContact CD1-CD1 4.1Å; I710-I768 HydrophobicContact CD1-CG2 4.26Å; I710-L812 HydrophobicContact CG2-CD2 4.28Å
711	F	98.4	Very high	97.2	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.009	12%	0.119	C	C	.	.	H	α-helix	trans	-61.8	-47	178.6	179	-102.2	0	0	0	111.2	A707 D708 Y713 Y714 K715 V772 A775 M776 T808 L812 Q886 Y887	A707-F711 PolarHBondContact O-N 3.27Å; D708-F711 PolarHBondContact O-N 3.41Å; F711-Y713 VanDerWaalsContact C-N 3.32Å; F711-Y713 PolarHBondContact O-N 2.8Å; F711-Y714 PolarHBondContact O-N 3.29Å; F711-K715 WeakPolarHBondContact O-CB 3.48Å; F711-K715 PolarHBondContact O-N 3.23Å; F711-V772 HydrophobicContact CD2-CG1 4.33Å; F711-A775 HydrophobicContact CB-CB 4.4Å; F711-A775 HydrophobicContact CD1-CB 3.75Å; F711-A775 HydrophobicContact CD2-CB 3.71Å; F711-A775 HydrophobicContact CE1-CB 3.82Å; F711-A775 HydrophobicContact CE2-CB 3.78Å; F711-A775 HydrophobicContact CG-CB 3.68Å; F711-A775 HydrophobicContact CZ-CB 3.83Å; F711-A775 WeakPolarHBondContact CZ-O 3.34Å; F711-M776 HydrophobicContact CE2-CG 3.95Å; F711-M776 HydrophobicContact CE2-SD 3.74Å; F711-M776 HydrophobicContact CZ-SD 4.49Å; F711-T808 HydrophobicContact CE2-CG2 4.33Å; F711-L812 HydrophobicContact CD2-CD1 4.18Å; F711-Q886 HydrophobicContact CD1-CB 4.45Å; F711-Q886 HydrophobicContact CD1-CG 4.49Å; F711-Q886 VanDerWaalsContact CE1-O 3.28Å; F711-Q886 WeakPolarHBondContact CE1-O 3.48Å; F711-Y887 AromaticContact CE1-CD1 3.91Å; F711-Y887 HydrophobicContact CE1-CD1 3.91Å; F711-Y887 HydrophobicContact CE1-CE1 4.09Å
712	A	98.1	Very high	97.3	Very high	15 Å²	15	25.5 Å²	25.5	12%	0.124	12%	0.124	C	C	.	.	H	α-helix	trans	-58.1	-44.1	176.6	0	0	0	0	0	112.1	D708 K715 V716 Q886	D708-A712 WeakPolarHBondContact O-CB 3.36Å; D708-A712 PolarHBondContact O-N 3.44Å; A712-K715 PolarHBondContact O-N 3.46Å; A712-V716 WeakPolarHBondContact O-CB 3.12Å; A712-V716 VanDerWaalsContact O-CG2 3.23Å; A712-V716 WeakPolarHBondContact O-CG2 3.36Å; A712-V716 PolarHBondContact O-N 2.53Å; A712-Q886 HydrophobicContact CB-CB 3.84Å
713	Y	98.1	Very high	97.3	Very high	32 Å²	32	25.6 Å²	25.6	13%	0.125	13%	0.125	C	C	.	.	H	α-helix	trans	-58.7	-53.2	178.3	173.1	-100.9	0	0	0	112	Q709 I710 F711 K715 V716 M717 P742 N744 Y746	Q709-Y713 WeakPolarHBondContact O-CB 3.42Å; Q709-Y713 PolarHBondContact O-N 3.15Å; I710-Y713 PolarHBondContact O-N 3.45Å; F711-Y713 VanDerWaalsContact C-N 3.32Å; F711-Y713 PolarHBondContact O-N 2.8Å; Y713-K715 VanDerWaalsContact C-N 3.32Å; Y713-K715 PolarHBondContact O-N 3.24Å; Y713-V716 PolarHBondContact O-N 3.03Å; Y713-M717 HydrophobicContact CD1-CE 4.41Å; Y713-M717 HydrophobicContact CE1-CE 3.45Å; Y713-M717 VanDerWaalsContact CE1-CE 3.45Å; Y713-M717 HydrophobicContact CE2-CE 4.28Å; Y713-M717 WeakPolarHBondContact O-CB 3.3Å; Y713-M717 PolarHBondContact O-N 3.4Å; Y713-M717 WeakPolarHBondContact OH-CE 3.49Å; Y713-P742 WeakPolarHBondContact CE2-O 3.39Å; Y713-N744 HydrophobicContact CD2-CB 4.07Å; Y713-N744 HydrophobicContact CE2-CB 3.69Å; Y713-N744 PolarHBondContact OH-N 3.45Å; Y713-Y746 AromaticContact CD1-CD2 3.88Å; Y713-Y746 HydrophobicContact CD1-CD2 3.88Å; Y713-Y746 HydrophobicContact CD1-CE2 4Å; Y713-Y746 HydrophobicContact CD2-CE2 4.11Å; Y713-Y746 HydrophobicContact CE1-CD2 4.31Å; Y713-Y746 HydrophobicContact CG-CD2 4.09Å; Y713-Y746 AromaticContact CG-CE2 3.71Å; Y713-Y746 HydrophobicContact CG-CE2 3.71Å
714	Y	98.2	Very high	97.3	Very high	5 Å²	5	29.4 Å²	29.4	2%	0.02	15%	0.145	C	C	.	.	H	α-helix	trans	-70.5	-27.9	-179.2	-74	-68.4	0	0	0	112.9	I710 F711 M717 A718 L750 L811 L812 Y815	I710-Y714 HydrophobicContact CG2-CD2 3.92Å; I710-Y714 HydrophobicContact CG2-CE2 4.01Å; I710-Y714 VanDerWaalsContact O-CD2 3.3Å; I710-Y714 WeakPolarHBondContact O-CD2 3.4Å; I710-Y714 PolarHBondContact O-N 3.47Å; F711-Y714 PolarHBondContact O-N 3.29Å; Y714-M717 HydrophobicContact CD1-SD 4.12Å; Y714-M717 HydrophobicContact CE1-CE 4.49Å; Y714-M717 HydrophobicContact CE1-SD 4.37Å; Y714-A718 WeakPolarHBondContact O-CB 3.22Å; Y714-A718 PolarHBondContact O-N 3.19Å; Y714-L750 HydrophobicContact CE2-CD1 4.14Å; Y714-L811 HydrophobicContact CD1-CB 3.89Å; Y714-L811 HydrophobicContact CD1-CD1 4.45Å; Y714-L812 HydrophobicContact CD2-CD2 3.46Å; Y714-L812 VanDerWaalsContact CD2-CD2 3.46Å; Y714-L812 HydrophobicContact CD2-CG 4.4Å; Y714-L812 HydrophobicContact CE2-CD2 4.23Å; Y714-L812 HydrophobicContact CG-CD2 3.9Å; Y714-L812 HydrophobicContact CG-CG 4.38Å; Y714-Y815 HydrophobicContact CE1-CE2 4.13Å; Y714-Y815 AromaticContact CZ-CE2 3.77Å; Y714-Y815 WeakPolarHBondContact OH-CE2 3.41Å
715	K	98.3	Very high	97.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.6	-48.9	170.9	-178.3	64.9	63	70.8	0	111.9	F711 A712 Y713 M717 A718 G719 S779 I804 N805 T808 Q886 L888	F711-K715 WeakPolarHBondContact O-CB 3.48Å; F711-K715 PolarHBondContact O-N 3.23Å; A712-K715 PolarHBondContact O-N 3.46Å; Y713-K715 VanDerWaalsContact C-N 3.32Å; Y713-K715 PolarHBondContact O-N 3.24Å; K715-M717 PolarHBondContact O-N 2.79Å; K715-A718 PolarHBondContact O-N 2.6Å; K715-G719 PolarHBondContact O-N 3.48Å; K715-S779 PolarHBondContact NZ-OG 3.46Å; K715-I804 HydrophobicContact CD-CG2 3.72Å; K715-N805 WeakPolarHBondContact CE-OD1 3.2Å; K715-N805 PolarHBondContact NZ-OD1 2.95Å; K715-N805 VanDerWaalsContact NZ-OD1 3.08Å; K715-T808 HydrophobicContact CB-CG2 4.3Å; K715-T808 HydrophobicContact CD-CG2 4.41Å; K715-T808 VanDerWaalsContact CD-OG1 3.28Å; K715-T808 WeakPolarHBondContact CD-OG1 3.5Å; K715-T808 WeakPolarHBondContact CE-OG1 3.38Å; K715-Q886 WeakPolarHBondContact CG-O 3.31Å; K715-Q886 PolarHBondContact NZ-O 3.33Å; K715-L888 WeakPolarHBondContact CD-O 3.36Å; K715-L888 PolarHBondContact NZ-O 3.06Å
716	V	98.2	Very high	97.1	Very high	27 Å²	27	34.1 Å²	34.1	16%	0.164	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-36.2	177.9	176.7	0	0	0	0	110.5	A712 Y713 S720 P741 G890 L894	A712-V716 WeakPolarHBondContact O-CB 3.12Å; A712-V716 VanDerWaalsContact O-CG2 3.23Å; A712-V716 WeakPolarHBondContact O-CG2 3.36Å; A712-V716 PolarHBondContact O-N 2.53Å; Y713-V716 PolarHBondContact O-N 3.03Å; V716-S720 WeakPolarHBondContact O-CB 3.42Å; V716-S720 PolarHBondContact O-N 2.72Å; V716-S720 PolarHBondContact O-OG 3.1Å; V716-P741 HydrophobicContact CG1-CB 3.68Å; V716-P741 HydrophobicContact CG1-CG 4Å; V716-G890 VanDerWaalsContact CG2-C 3.44Å; V716-G890 WeakPolarHBondContact CG2-O 3.39Å; V716-L894 HydrophobicContact CG1-CD1 4Å
717	M	97.3	Very high	97	Very high	41 Å²	41	36.6 Å²	36.6	20%	0.202	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-49.8	172.2	-175.9	-179.8	-68.7	0	0	111.4	Y713 Y714 K715 S720 L721 L811	Y713-M717 HydrophobicContact CD1-CE 4.41Å; Y713-M717 HydrophobicContact CE1-CE 3.45Å; Y713-M717 VanDerWaalsContact CE1-CE 3.45Å; Y713-M717 HydrophobicContact CE2-CE 4.28Å; Y713-M717 WeakPolarHBondContact O-CB 3.3Å; Y713-M717 PolarHBondContact O-N 3.4Å; Y713-M717 WeakPolarHBondContact OH-CE 3.49Å; Y714-M717 HydrophobicContact CD1-SD 4.12Å; Y714-M717 HydrophobicContact CE1-CE 4.49Å; Y714-M717 HydrophobicContact CE1-SD 4.37Å; K715-M717 PolarHBondContact O-N 2.79Å; M717-S720 PolarHBondContact O-N 3.24Å; M717-S720 VanDerWaalsContact O-N 3.12Å; M717-L721 HydrophobicContact CG-CD1 3.97Å; M717-L721 HydrophobicContact CG-CG 4.35Å; M717-L721 WeakPolarHBondContact O-CB 3.41Å; M717-L721 VanDerWaalsContact O-CG 3.28Å; M717-L721 WeakPolarHBondContact O-CG 3.28Å; M717-L721 PolarHBondContact O-N 3.08Å; M717-L811 HydrophobicContact CB-CD1 4.21Å; M717-L811 HydrophobicContact CG-CD1 3.94Å; M717-L811 HydrophobicContact SD-CD1 3.93Å; M717-L811 HydrophobicContact SD-CD2 4.27Å
718	A	97.8	Very high	96.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.9	-51.2	178	0	0	0	0	0	112.2	Y714 K715 S720 L721 L722 I804 M807 T808 L811	Y714-A718 WeakPolarHBondContact O-CB 3.22Å; Y714-A718 PolarHBondContact O-N 3.19Å; K715-A718 PolarHBondContact O-N 2.6Å; A718-S720 PolarHBondContact O-N 3.06Å; A718-L721 PolarHBondContact O-N 3.46Å; A718-L722 PolarHBondContact O-N 3.34Å; A718-L722 VanDerWaalsContact O-N 3.13Å; A718-I804 HydrophobicContact CB-CG2 4.22Å; A718-M807 HydrophobicContact CB-CB 4.01Å; A718-M807 HydrophobicContact CB-CG 3.89Å; A718-T808 VanDerWaalsContact CB-OG1 3.28Å; A718-T808 WeakPolarHBondContact CB-OG1 3.36Å; A718-L811 HydrophobicContact CB-CD1 4.12Å
719	G	97.6	Very high	96.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-32.3	175.8	0	0	0	0	0	112.4	K715 L723 Y898	K715-G719 PolarHBondContact O-N 3.48Å; G719-L723 WeakPolarHBondContact O-CB 3.49Å; G719-L723 PolarHBondContact O-N 3.31Å; G719-L723 VanDerWaalsContact O-N 3.14Å; G719-Y898 PolarHBondContact O-OH 2.97Å
720	S	96.6	Very high	96.6	Very high	11 Å²	11	41 Å²	41	8%	0.077	20%	0.2	C	C	.	.	H	α-helix	trans	-74.1	-38.3	177.8	-64.7	0	0	0	0	113.6	V716 M717 A718 R728 P741	V716-S720 WeakPolarHBondContact O-CB 3.42Å; V716-S720 PolarHBondContact O-N 2.72Å; V716-S720 PolarHBondContact O-OG 3.1Å; M717-S720 PolarHBondContact O-N 3.24Å; M717-S720 VanDerWaalsContact O-N 3.12Å; A718-S720 PolarHBondContact O-N 3.06Å; S720-R728 VanDerWaalsContact CA-NH2 3.26Å; S720-R728 PolarHBondContact O-NH2 2.84Å; S720-P741 VanDerWaalsContact OG-CD 3.28Å; S720-P741 WeakPolarHBondContact OG-CD 3.5Å
721	L	96.1	Very high	96.4	Very high	89 Å²	89	42 Å²	42	47%	0.466	21%	0.207	S	C	.	.	H	α-helix	trans	-64.7	-44.1	178.2	-73.6	171.5	0	0	0	111.2	M717 A718 K725 M807 L811	M717-L721 HydrophobicContact CG-CD1 3.97Å; M717-L721 HydrophobicContact CG-CG 4.35Å; M717-L721 WeakPolarHBondContact O-CB 3.41Å; M717-L721 VanDerWaalsContact O-CG 3.28Å; M717-L721 WeakPolarHBondContact O-CG 3.28Å; M717-L721 PolarHBondContact O-N 3.08Å; A718-L721 PolarHBondContact O-N 3.46Å; L721-K725 PolarHBondContact O-NZ 3.25Å; L721-M807 HydrophobicContact CD1-CE 3.52Å; L721-L811 HydrophobicContact CD1-CD1 4.25Å
722	L	96.9	Very high	96.2	Very high	77 Å²	77	48.4 Å²	48.4	40%	0.403	24%	0.235	S	C	.	.	H	α-helix	trans	-82.5	-14.5	-177.5	-62.7	179.3	0	0	0	113.9	A718 D724 E803 I804 M807 Y898	A718-L722 PolarHBondContact O-N 3.34Å; A718-L722 VanDerWaalsContact O-N 3.13Å; L722-D724 PolarHBondContact O-N 3.39Å; L722-E803 HydrophobicContact CD1-CG 4.49Å; L722-I804 HydrophobicContact CD1-CG1 3.94Å; L722-M807 HydrophobicContact CD1-CB 3.94Å; L722-M807 HydrophobicContact CD1-CG 4.35Å; L722-Y898 WeakPolarHBondContact CB-OH 3.36Å
723	L	97.1	Very high	96	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.005	26%	0.26	C	S	.	.	S	Bend	trans	-66	134	178.4	-171.1	66.5	0	0	0	110.9	G719 K725 L727 R728 I738 L894 A897 Y898 I901	G719-L723 WeakPolarHBondContact O-CB 3.49Å; G719-L723 PolarHBondContact O-N 3.31Å; G719-L723 VanDerWaalsContact O-N 3.14Å; L723-K725 PolarHBondContact O-N 2.95Å; L723-K725 PolarHBondContact O-NZ 3.32Å; L723-L727 HydrophobicContact CD1-CD2 4.32Å; L723-R728 HydrophobicContact CD2-CG 3.91Å; L723-R728 HydrophobicContact CG-CG 4.35Å; L723-I738 HydrophobicContact CD2-CD1 3.84Å; L723-I738 HydrophobicContact CD2-CG2 4.13Å; L723-L894 HydrophobicContact CD2-CD2 3.97Å; L723-A897 HydrophobicContact CD1-CB 4.17Å; L723-A897 HydrophobicContact CD2-CB 4.33Å; L723-Y898 WeakPolarHBondContact CA-OH 3.45Å; L723-Y898 HydrophobicContact CB-CE2 4.46Å; L723-Y898 HydrophobicContact CD1-CD1 4.49Å; L723-Y898 HydrophobicContact CD1-CD2 4.34Å; L723-Y898 HydrophobicContact CD1-CE1 4.16Å; L723-Y898 HydrophobicContact CD1-CE2 3.98Å; L723-Y898 PolarHBondContact N-OH 2.99Å; L723-I901 HydrophobicContact CD1-CD1 3.63Å
724	D	96.4	Very high	95.9	Very high	83 Å²	83	59 Å²	59	44%	0.444	29%	0.287	S	S	.	.			trans	-55.3	131.1	-178.7	177.8	54.6	0	0	0	112	L722 R726 L727 R728	L722-D724 PolarHBondContact O-N 3.39Å; D724-R726 WeakPolarHBondContact OD2-CA 3.25Å; D724-R726 WeakPolarHBondContact OD2-CB 3.47Å; D724-R726 PolarHBondContact OD2-N 2.9Å; D724-R726 VanDerWaalsContact OD2-N 3.14Å; D724-L727 HydrophobicContact CB-CB 4.15Å; D724-L727 PolarHBondContact OD2-N 3.46Å; D724-R728 WeakPolarHBondContact O-CG 3.34Å; D724-R728 PolarHBondContact O-N 3.01Å
725	K	94.5	Very high	95.6	Very high	124 Å²	124	62.1 Å²	62.1	54%	0.539	32%	0.32	S	S	.	.	H	α-helix	trans	-76	-31.8	-173.6	-59.2	-66.6	174.7	-79.9	0	111.2	L721 L723 R728 S729	L721-K725 PolarHBondContact O-NZ 3.25Å; L723-K725 PolarHBondContact O-N 2.95Å; L723-K725 PolarHBondContact O-NZ 3.32Å; K725-R728 PolarHBondContact O-N 2.98Å; K725-S729 PolarHBondContact O-N 3.05Å
726	R	94.9	Very high	95.4	Very high	164 Å²	164	65 Å²	65	62%	0.619	34%	0.344	S	S	*	.	H	α-helix	trans	-67.8	-47	177.3	-178.5	60.8	-176.9	-99.3	1.4	110.3	D724 R728 S729 E730	D724-R726 WeakPolarHBondContact OD2-CA 3.25Å; D724-R726 WeakPolarHBondContact OD2-CB 3.47Å; D724-R726 PolarHBondContact OD2-N 2.9Å; D724-R726 VanDerWaalsContact OD2-N 3.14Å; R726-R728 VanDerWaalsContact C-N 3.3Å; R726-R728 PolarHBondContact O-N 3.34Å; R726-S729 PolarHBondContact O-N 3.33Å; R726-S729 PolarHBondContact O-OG 3.26Å; R726-E730 HydrophobicContact CG-CG 4.44Å; R726-E730 IonicContact CZ-OE1 3.66Å; R726-E730 VanDerWaalsContact CZ-OE1 3.27Å; R726-E730 IonicContact NE-OE1 3.71Å; R726-E730 PolarHBondContact NE-OE1 3.13Å; R726-E730 IonicContact NH2-OE1 2.99Å; R726-E730 PolarHBondContact NH2-OE1 3.25Å; R726-E730 WeakPolarHBondContact O-CG 3.21Å; R726-E730 PolarHBondContact O-N 3.38Å
727	L	94.5	Very high	95.2	Very high	52 Å²	52	66.6 Å²	66.6	27%	0.272	35%	0.354	S	S	.	.	H	α-helix	trans	-53.5	-46.5	174.3	179.5	63.2	0	0	0	111.9	L723 D724 S729 E730 C731 I901	L723-L727 HydrophobicContact CD1-CD2 4.32Å; D724-L727 HydrophobicContact CB-CB 4.15Å; D724-L727 PolarHBondContact OD2-N 3.46Å; L727-S729 VanDerWaalsContact C-N 3.29Å; L727-S729 PolarHBondContact O-N 2.93Å; L727-E730 PolarHBondContact O-N 3.26Å; L727-C731 WeakPolarHBondContact O-CB 3.43Å; L727-C731 PolarHBondContact O-N 2.81Å; L727-C731 PolarHBondContact O-SG 2.73Å; L727-I901 HydrophobicContact CD2-CD1 3.64Å; L727-I901 HydrophobicContact CD2-CG1 3.7Å
728	R	92.3	Very high	95.1	Very high	28 Å²	28	65.8 Å²	65.8	11%	0.106	35%	0.35	C	S	.	.	H	α-helix	trans	-56.6	-42.7	175.8	-74	179.9	175.5	-80.2	1.9	112.5	S720 L723 D724 K725 R726 K732 I738	S720-R728 VanDerWaalsContact CA-NH2 3.26Å; S720-R728 PolarHBondContact O-NH2 2.84Å; L723-R728 HydrophobicContact CD2-CG 3.91Å; L723-R728 HydrophobicContact CG-CG 4.35Å; D724-R728 WeakPolarHBondContact O-CG 3.34Å; D724-R728 PolarHBondContact O-N 3.01Å; K725-R728 PolarHBondContact O-N 2.98Å; R726-R728 VanDerWaalsContact C-N 3.3Å; R726-R728 PolarHBondContact O-N 3.34Å; R728-K732 WeakPolarHBondContact O-CB 3.33Å; R728-K732 PolarHBondContact O-N 2.87Å; R728-I738 PolarHBondContact NH1-O 3.09Å; R728-I738 VanDerWaalsContact NH1-O 3.1Å
729	S	93.9	Very high	94.7	Very high	48 Å²	48	73.4 Å²	73.4	34%	0.336	39%	0.385	S	S	.	.	H	α-helix	trans	-68.1	-40.1	178.4	68	0	0	0	0	112.7	K725 R726 L727 K732 N733	K725-S729 PolarHBondContact O-N 3.05Å; R726-S729 PolarHBondContact O-N 3.33Å; R726-S729 PolarHBondContact O-OG 3.26Å; L727-S729 VanDerWaalsContact C-N 3.29Å; L727-S729 PolarHBondContact O-N 2.93Å; S729-K732 WeakPolarHBondContact O-CB 3.36Å; S729-K732 PolarHBondContact O-N 2.83Å; S729-N733 PolarHBondContact O-N 2.73Å; S729-N733 PolarHBondContact O-ND2 3.38Å; S729-N733 PolarHBondContact O-OD1 2.84Å
730	E	95	Very high	94.4	Very high	61 Å²	61	79.7 Å²	79.7	29%	0.285	42%	0.418	S	S	.	.	H	α-helix	trans	-65.8	-46.3	176.9	-65.7	-61.3	159.6	0	0	111.3	R726 L727 K732 N733 Q734	R726-E730 HydrophobicContact CG-CG 4.44Å; R726-E730 IonicContact CZ-OE1 3.66Å; R726-E730 VanDerWaalsContact CZ-OE1 3.27Å; R726-E730 IonicContact NE-OE1 3.71Å; R726-E730 PolarHBondContact NE-OE1 3.13Å; R726-E730 IonicContact NH2-OE1 2.99Å; R726-E730 PolarHBondContact NH2-OE1 3.25Å; R726-E730 WeakPolarHBondContact O-CG 3.21Å; R726-E730 PolarHBondContact O-N 3.38Å; L727-E730 PolarHBondContact O-N 3.26Å; E730-K732 VanDerWaalsContact C-N 3.26Å; E730-K732 PolarHBondContact O-N 3.1Å; E730-N733 PolarHBondContact O-N 2.66Å; E730-N733 VanDerWaalsContact O-N 3.11Å; E730-Q734 WeakPolarHBondContact O-CG 3.48Å; E730-Q734 PolarHBondContact O-N 3.48Å
731	C	94	Very high	94.2	Very high	21 Å²	21	81.1 Å²	81.1	14%	0.142	43%	0.427	C	S	.	.	H	α-helix	trans	-59.2	-38.4	174.8	-70	0	0	0	0	111.8	L727 Q734 G735 A736 I738	L727-C731 WeakPolarHBondContact O-CB 3.43Å; L727-C731 PolarHBondContact O-N 2.81Å; L727-C731 PolarHBondContact O-SG 2.73Å; C731-Q734 PolarHBondContact O-N 2.85Å; C731-G735 PolarHBondContact O-N 3.39Å; C731-A736 WeakPolarHBondContact CB-O 3.36Å; C731-A736 CarbonylContact O-C 3.6Å; C731-A736 VanDerWaalsContact O-C 3.25Å; C731-A736 WeakPolarHBondContact O-CA 3.11Å; C731-A736 PolarHBondContact O-N 2.99Å; C731-I738 HydrophobicContact CB-CD1 4.47Å; C731-I738 HydrophobicContact CB-CG1 4.34Å
732	K	93.9	Very high	94	Very high	138 Å²	138	82.1 Å²	82.1	60%	0.6	44%	0.439	S	S	*	.	H	α-helix	trans	-63.2	-45.2	174	-176.5	177.8	-178.1	-176.5	0	111.9	R728 S729 E730 Q734 G735 T737	R728-K732 WeakPolarHBondContact O-CB 3.33Å; R728-K732 PolarHBondContact O-N 2.87Å; S729-K732 WeakPolarHBondContact O-CB 3.36Å; S729-K732 PolarHBondContact O-N 2.83Å; E730-K732 VanDerWaalsContact C-N 3.26Å; E730-K732 PolarHBondContact O-N 3.1Å; K732-Q734 PolarHBondContact O-N 2.85Å; K732-G735 PolarHBondContact O-N 3.46Å; K732-G735 VanDerWaalsContact O-N 3.09Å; K732-T737 HydrophobicContact CB-CG2 4.48Å; K732-T737 HydrophobicContact CG-CG2 4.44Å
733	N	95.1	Very high	93.9	Very high	124 Å²	124	82.8 Å²	82.8	66%	0.663	45%	0.45	S	S	*	.	H	α-helix	trans	-64.1	-29.8	178.7	-65	-17	0	0	0	112.5	S729 E730 G735	S729-N733 PolarHBondContact O-N 2.73Å; S729-N733 PolarHBondContact O-ND2 3.38Å; S729-N733 PolarHBondContact O-OD1 2.84Å; E730-N733 PolarHBondContact O-N 2.66Å; E730-N733 VanDerWaalsContact O-N 3.11Å; N733-G735 VanDerWaalsContact C-N 3.3Å
734	Q	94.6	Very high	93.8	Very high	146 Å²	146	83.7 Å²	83.7	68%	0.682	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	3.3	176.5	-66.1	172.5	3.9	0	0	113.7	E730 C731 K732 A736	E730-Q734 WeakPolarHBondContact O-CG 3.48Å; E730-Q734 PolarHBondContact O-N 3.48Å; C731-Q734 PolarHBondContact O-N 2.85Å; K732-Q734 PolarHBondContact O-N 2.85Å; Q734-A736 VanDerWaalsContact C-N 3.29Å; Q734-A736 PolarHBondContact O-N 3.4Å
735	G	92.4	Very high	93.5	Very high	70 Å²	70	85.1 Å²	85.1	72%	0.722	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	7.5	-178	0	0	0	0	0	115	C731 K732 N733	C731-G735 PolarHBondContact O-N 3.39Å; K732-G735 PolarHBondContact O-N 3.46Å; K732-G735 VanDerWaalsContact O-N 3.09Å; N733-G735 VanDerWaalsContact C-N 3.3Å
736	A	94	Very high	93.5	Very high	60 Å²	60	79.5 Å²	79.5	50%	0.496	43%	0.43	S	S	.	.			trans	-107.4	49.7	180	0	0	0	0	0	111.8	C731 Q734 I738	C731-A736 WeakPolarHBondContact CB-O 3.36Å; C731-A736 CarbonylContact O-C 3.6Å; C731-A736 VanDerWaalsContact O-C 3.25Å; C731-A736 WeakPolarHBondContact O-CA 3.11Å; C731-A736 PolarHBondContact O-N 2.99Å; Q734-A736 VanDerWaalsContact C-N 3.29Å; Q734-A736 PolarHBondContact O-N 3.4Å; A736-I738 PolarHBondContact O-N 2.88Å
737	T	94.2	Very high	93.2	Very high	60 Å²	60	74.5 Å²	74.5	37%	0.368	41%	0.413	S	S	.	.			trans	-59.1	124.5	-172.3	-57.6	0	0	0	0	112.5	K732 H739	K732-T737 HydrophobicContact CB-CG2 4.48Å; K732-T737 HydrophobicContact CG-CG2 4.44Å; T737-H739 PolarHBondContact O-N 3.17Å
738	I	94.4	Very high	92.7	Very high	25 Å²	25	73.7 Å²	73.7	13%	0.128	41%	0.41	C	S	.	.			trans	-80.8	98.9	170.8	-54	172.8	0	0	0	108.3	L723 R728 C731 A736 L894 A897	L723-I738 HydrophobicContact CD2-CD1 3.84Å; L723-I738 HydrophobicContact CD2-CG2 4.13Å; R728-I738 PolarHBondContact NH1-O 3.09Å; R728-I738 VanDerWaalsContact NH1-O 3.1Å; C731-I738 HydrophobicContact CB-CD1 4.47Å; C731-I738 HydrophobicContact CB-CG1 4.34Å; A736-I738 PolarHBondContact O-N 2.88Å; I738-L894 HydrophobicContact CG2-CD2 4.45Å; I738-A897 HydrophobicContact CD1-CB 3.85Å
739	H	90.8	Very high	92.5	Very high	160 Å²	160	72.4 Å²	72.4	74%	0.741	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-56.6	140.4	-177.8	-66.5	-77.5	0	0	0	112.6	T737	T737-H739 PolarHBondContact O-N 3.17Å
740	L	90.4	Very high	92.3	Very high	131 Å²	131	70.1 Å²	70.1	69%	0.686	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-74.1	142.3	171.6	-126.5	69.3	0	0	0	109.2
741	P	92.9	Very high	91.9	Very high	41 Å²	41	73.2 Å²	73.2	27%	0.266	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-63.6	140	174.5	25.1	-34	0	0	0	111.3	V716 S720	V716-P741 HydrophobicContact CG1-CB 3.68Å; V716-P741 HydrophobicContact CG1-CG 4Å; S720-P741 VanDerWaalsContact OG-CD 3.28Å; S720-P741 WeakPolarHBondContact OG-CD 3.5Å
742	P	92.7	Very high	91.4	Very high	111 Å²	111	73.7 Å²	73.7	72%	0.721	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-58.1	141.6	168.5	-22	33.2	0	0	0	111	Y713	Y713-P742 WeakPolarHBondContact CE2-O 3.39Å
743	S	94.2	Very high	90.7	Very high	91 Å²	91	73.5 Å²	73.5	64%	0.636	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-72.3	154.5	171.2	-166.7	0	0	0	0	110.7	A658	A658-S743 WeakPolarHBondContact CB-O 3.46Å
744	N	94.1	Very high	90.2	Very high	20 Å²	20	71.2 Å²	71.2	11%	0.107	38%	0.383	C	S	.	.			trans	-144.9	168.9	179.8	-149.7	-52.4	0	0	0	110.9	K656 A658 Y713 Y746	K656-N744 PolarHBondContact O-ND2 3.31Å; A658-N744 HydrophobicContact CB-CB 4.35Å; Y713-N744 HydrophobicContact CD2-CB 4.07Å; Y713-N744 HydrophobicContact CE2-CB 3.69Å; Y713-N744 PolarHBondContact OH-N 3.45Å; N744-Y746 HydrophobicContact CB-CD2 4.01Å; N744-Y746 HydrophobicContact CB-CE2 3.56Å; N744-Y746 PolarHBondContact ND2-OH 2.76Å
745	R	90.7	Very high	89.7	Confident	113 Å²	113	65.1 Å²	65.1	43%	0.426	36%	0.356	S	S	.	.			trans	-121.9	56.8	-168.8	-64.1	-65.2	-62.4	178.4	-2.9	112.5	E662 E747	E662-R745 HydrophobicContact CG-CB 3.95Å; E662-R745 IonicContact OE1-CZ 2.96Å; E662-R745 IonicContact OE1-NE 3.58Å; E662-R745 PolarHBondContact OE1-NE 3.1Å; E662-R745 IonicContact OE1-NH2 3.43Å; E662-R745 PolarHBondContact OE1-NH2 3.23Å; R745-E747 VanDerWaalsContact C-N 3.32Å
746	Y	94.1	Very high	89.3	Confident	5 Å²	5	64.8 Å²	64.8	2%	0.02	34%	0.335	C	S	.	.			trans	-79.9	-10.4	178.1	-60.9	-65.8	0	0	0	114.6	M661 L706 Q709 I710 Y713 N744 T748 L749 L750	M661-Y746 HydrophobicContact CE-CD1 4.43Å; M661-Y746 HydrophobicContact CE-CE1 3.62Å; M661-Y746 HydrophobicContact CG-CD1 3.64Å; M661-Y746 HydrophobicContact CG-CE1 3.79Å; M661-Y746 HydrophobicContact SD-CD1 3.88Å; M661-Y746 HydrophobicContact SD-CE1 3.6Å; L706-Y746 HydrophobicContact CD1-CD1 3.97Å; L706-Y746 HydrophobicContact CD1-CE1 4.12Å; Q709-Y746 HydrophobicContact CG-CE1 3.85Å; Q709-Y746 PolarHBondContact OE1-OH 3.03Å; I710-Y746 HydrophobicContact CD1-CD1 4.13Å; I710-Y746 HydrophobicContact CD1-CG 4.29Å; I710-Y746 HydrophobicContact CG1-CD1 3.59Å; I710-Y746 HydrophobicContact CG1-CD2 4.1Å; I710-Y746 HydrophobicContact CG1-CE1 4.07Å; I710-Y746 HydrophobicContact CG1-CG 3.61Å; Y713-Y746 AromaticContact CD1-CD2 3.88Å; Y713-Y746 HydrophobicContact CD1-CD2 3.88Å; Y713-Y746 HydrophobicContact CD1-CE2 4Å; Y713-Y746 HydrophobicContact CD2-CE2 4.11Å; Y713-Y746 HydrophobicContact CE1-CD2 4.31Å; Y713-Y746 HydrophobicContact CG-CD2 4.09Å; Y713-Y746 AromaticContact CG-CE2 3.71Å; Y713-Y746 HydrophobicContact CG-CE2 3.71Å; N744-Y746 HydrophobicContact CB-CD2 4.01Å; N744-Y746 HydrophobicContact CB-CE2 3.56Å; N744-Y746 PolarHBondContact ND2-OH 2.76Å; Y746-T748 VanDerWaalsContact C-N 3.35Å; Y746-T748 PolarHBondContact O-N 2.82Å; Y746-L749 PolarHBondContact O-N 3.16Å; Y746-L750 WeakPolarHBondContact O-CG 3.23Å; Y746-L750 PolarHBondContact O-N 3.46Å
747	E	88.1	Confident	89	Confident	60 Å²	60	62.3 Å²	62.3	28%	0.28	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-37.9	-169.3	-54.7	-169.9	159.9	0	0	113.5	R745 L750 K751 Y815	R745-E747 VanDerWaalsContact C-N 3.32Å; E747-L750 PolarHBondContact O-N 3.47Å; E747-K751 WeakPolarHBondContact O-CD 3.37Å; E747-K751 VanDerWaalsContact O-CG 3.25Å; E747-K751 WeakPolarHBondContact O-CG 3.38Å; E747-K751 PolarHBondContact O-N 3.45Å; E747-K751 VanDerWaalsContact O-N 3.13Å; E747-Y815 HydrophobicContact CB-CE1 4.11Å; E747-Y815 HydrophobicContact CG-CE1 3.72Å; E747-Y815 PolarHBondContact OE1-OH 2.77Å
748	T	84.4	Confident	88.8	Confident	34 Å²	34	60.3 Å²	60.3	21%	0.209	30%	0.301	C	S	.	.	H	α-helix	trans	-66.5	-41.5	178.9	50.5	0	0	0	0	111.1	E662 Y746 K751 Q752	E662-T748 HydrophobicContact CG-CG2 4.2Å; Y746-T748 VanDerWaalsContact C-N 3.35Å; Y746-T748 PolarHBondContact O-N 2.82Å; T748-K751 PolarHBondContact O-N 3.06Å; T748-Q752 WeakPolarHBondContact O-CG 3.37Å; T748-Q752 PolarHBondContact O-NE2 2.77Å; T748-Q752 VanDerWaalsContact O-NE2 3.11Å
749	L	88.9	Confident	88.2	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-42.9	175.1	-62.2	177.8	0	0	0	111.9	M661 V664 L665 L706 Y746 K751 Q752	M661-L749 HydrophobicContact CG-CD1 3.7Å; M661-L749 HydrophobicContact SD-CD1 3.66Å; V664-L749 HydrophobicContact CG1-CD1 3.98Å; V664-L749 HydrophobicContact CG1-CD2 3.84Å; L665-L749 HydrophobicContact CD1-CD2 3.67Å; L665-L749 HydrophobicContact CD2-CD2 4.36Å; L665-L749 HydrophobicContact CG-CD2 3.72Å; L706-L749 HydrophobicContact CD1-CD1 3.66Å; L706-L749 HydrophobicContact CD2-CB 4.35Å; L706-L749 HydrophobicContact CD2-CD1 3.99Å; L706-L749 HydrophobicContact CG-CD1 4.49Å; Y746-L749 PolarHBondContact O-N 3.16Å; L749-K751 PolarHBondContact O-N 2.95Å; L749-Q752 WeakPolarHBondContact O-CB 3.45Å; L749-Q752 WeakPolarHBondContact O-CG 3.25Å; L749-Q752 PolarHBondContact O-N 3.32Å; L749-Q752 VanDerWaalsContact O-N 3.17Å
750	L	89.4	Confident	87.8	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63.5	-23.8	175.9	-72.9	166.2	0	0	0	112.4	I710 Y714 Y746 E747 N765 I768 Y815 L816	I710-L750 HydrophobicContact CD1-CD2 3.99Å; I710-L750 HydrophobicContact CD1-CG 4.2Å; I710-L750 HydrophobicContact CG2-CD2 4.3Å; Y714-L750 HydrophobicContact CE2-CD1 4.14Å; Y746-L750 WeakPolarHBondContact O-CG 3.23Å; Y746-L750 PolarHBondContact O-N 3.46Å; E747-L750 PolarHBondContact O-N 3.47Å; L750-N765 WeakPolarHBondContact O-CB 3.5Å; L750-N765 PolarHBondContact O-ND2 2.97Å; L750-I768 HydrophobicContact CD2-CD1 4.25Å; L750-I768 HydrophobicContact CD2-CG2 3.84Å; L750-Y815 HydrophobicContact CD1-CD2 4.06Å; L750-Y815 HydrophobicContact CD1-CG 4.05Å; L750-L816 HydrophobicContact CD2-CD1 4.19Å; L750-L816 HydrophobicContact CD2-CD2 3.54Å; L750-L816 HydrophobicContact CD2-CG 4.07Å
751	K	87.4	Confident	87.6	Confident	126 Å²	126	57.6 Å²	57.6	55%	0.548	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-11.1	178.2	-73.8	167.9	-176.2	173.9	0	113.7	E747 T748 L749 R753	E747-K751 WeakPolarHBondContact O-CD 3.37Å; E747-K751 VanDerWaalsContact O-CG 3.25Å; E747-K751 WeakPolarHBondContact O-CG 3.38Å; E747-K751 PolarHBondContact O-N 3.45Å; E747-K751 VanDerWaalsContact O-N 3.13Å; T748-K751 PolarHBondContact O-N 3.06Å; L749-K751 PolarHBondContact O-N 2.95Å; K751-R753 WeakPolarHBondContact O-CG 3.45Å; K751-R753 PolarHBondContact O-N 2.79Å
752	Q	83.4	Confident	87.2	Confident	30 Å²	30	57.7 Å²	57.7	14%	0.14	31%	0.306	C	S	.	.			trans	-68.8	117.2	-176.3	-61.6	-59.3	-58.2	0	0	111.7	L665 T748 L749 V755 L764 N765	L665-Q752 HydrophobicContact CD1-CG 3.75Å; T748-Q752 WeakPolarHBondContact O-CG 3.37Å; T748-Q752 PolarHBondContact O-NE2 2.77Å; T748-Q752 VanDerWaalsContact O-NE2 3.11Å; L749-Q752 WeakPolarHBondContact O-CB 3.45Å; L749-Q752 WeakPolarHBondContact O-CG 3.25Å; L749-Q752 PolarHBondContact O-N 3.32Å; L749-Q752 VanDerWaalsContact O-N 3.17Å; Q752-V755 HydrophobicContact CB-CG2 3.88Å; Q752-V755 HydrophobicContact CG-CG2 4.36Å; Q752-L764 HydrophobicContact CB-CB 4.08Å; Q752-L764 HydrophobicContact CB-CD2 4.25Å; Q752-L764 PolarHBondContact O-N 3.4Å; Q752-N765 PolarHBondContact O-N 2.93Å
753	R	79.4	Confident	87.1	Confident	134 Å²	134	54.3 Å²	54.3	51%	0.506	28%	0.282	S	S	.	.	S	Bend	trans	-107.3	-17.1	-179.5	-53.6	-51.6	-63.5	-83	-6	113.8	K751 D763	K751-R753 WeakPolarHBondContact O-CG 3.45Å; K751-R753 PolarHBondContact O-N 2.79Å; R753-D763 IonicContact CZ-OD2 3.71Å; R753-D763 IonicContact NE-OD1 3.07Å; R753-D763 PolarHBondContact NE-OD1 3.14Å; R753-D763 IonicContact NE-OD2 3.5Å; R753-D763 PolarHBondContact NE-OD2 3.02Å; R753-D763 IonicContact NH2-OD2 2.74Å; R753-D763 PolarHBondContact NH2-OD2 2.92Å; R753-D763 VanDerWaalsContact O-CA 3.22Å; R753-D763 WeakPolarHBondContact O-CA 3.47Å; R753-D763 WeakPolarHBondContact O-CB 3.32Å
754	H	84.4	Confident	86.9	Confident	77 Å²	77	50 Å²	50	36%	0.356	25%	0.252	S	S	.	.			trans	-153.4	66.6	-176	50.7	71.6	0	0	0	112.3	E30 Q756 S761 I762	E30-H754 IonicContact OE1-CE1 2.6Å; E30-H754 IonicContact OE1-ND1 2.78Å; E30-H754 IonicContact OE1-NE2 3.86Å; E30-H754 IonicContact OE2-CE1 3.69Å; E30-H754 PolarHBondContact OE2-CE1 3.25Å; E30-H754 IonicContact OE2-ND1 3.02Å; E30-H754 IonicContact OE2-NE2 2.82Å; E30-H754 PolarHBondContact OE2-NE2 3.41Å; H754-Q756 PolarHBondContact O-N 3.16Å; H754-S761 WeakPolarHBondContact CB-OG 3.19Å; H754-I762 CarbonylContact C-O 3.6Å; H754-I762 WeakPolarHBondContact CA-O 3.24Å
755	V	83	Confident	86.9	Confident	18 Å²	18	49.7 Å²	49.7	11%	0.109	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	121.9	171.8	-178.1	0	0	0	0	108.6	L665 Q752 L757 I762 L764	L665-V755 HydrophobicContact CD1-CG2 4.47Å; Q752-V755 HydrophobicContact CB-CG2 3.88Å; Q752-V755 HydrophobicContact CG-CG2 4.36Å; V755-L757 PolarHBondContact O-N 2.9Å; V755-I762 HydrophobicContact CB-CB 4.41Å; V755-I762 PolarHBondContact N-O 2.98Å; V755-I762 PolarHBondContact O-N 3.47Å; V755-L764 HydrophobicContact CG2-CB 4.13Å; V755-L764 HydrophobicContact CG2-CD2 4.49Å
756	Q	83.9	Confident	87.1	Confident	62 Å²	62	51.8 Å²	51.8	29%	0.29	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	110.4	178.7	-61.2	-60.4	-32	0	0	109.5	P33 N672 H754 R760	P33-Q756 HydrophobicContact CB-CG 4.26Å; N672-Q756 PolarHBondContact ND2-O 3.04Å; H754-Q756 PolarHBondContact O-N 3.16Å; Q756-R760 WeakPolarHBondContact CA-O 3.3Å
757	L	87.1	Confident	87.2	Confident	9 Å²	9	53.5 Å²	53.5	5%	0.047	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	122.4	-178.9	-166.9	62.6	0	0	0	110.6	L668 N672 V695 F699 V755 G759 R760	L668-L757 HydrophobicContact CD2-CD2 3.94Å; L668-L757 HydrophobicContact CG-CD2 4.24Å; N672-L757 WeakPolarHBondContact OD1-CA 3.22Å; V695-L757 HydrophobicContact CG1-CD2 3.66Å; V695-L757 HydrophobicContact CG1-CG 4.09Å; F699-L757 HydrophobicContact CD2-CD2 4.04Å; F699-L757 HydrophobicContact CE2-CD2 4.46Å; V755-L757 PolarHBondContact O-N 2.9Å; L757-G759 PolarHBondContact O-N 3.17Å; L757-R760 PolarHBondContact N-O 3.13Å; L757-R760 WeakPolarHBondContact O-CB 3.28Å; L757-R760 PolarHBondContact O-N 3.14Å
758	L	90.3	Very high	87.6	Confident	18 Å²	18	50.6 Å²	50.6	9%	0.094	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	36.1	-175.2	-54.6	-175.2	0	0	0	113.5	N672 A675 I691 E692 V695 R760	N672-L758 PolarHBondContact OD1-N 2.66Å; A675-L758 HydrophobicContact CB-CD2 3.42Å; A675-L758 VanDerWaalsContact CB-CD2 3.42Å; I691-L758 HydrophobicContact CG2-CD2 4.2Å; E692-L758 HydrophobicContact CB-CD1 4.14Å; E692-L758 HydrophobicContact CG-CD1 4.23Å; V695-L758 HydrophobicContact CB-CD1 3.75Å; V695-L758 HydrophobicContact CG1-CD1 3.84Å; V695-L758 HydrophobicContact CG1-CG 4.34Å; V695-L758 HydrophobicContact CG2-CD1 3.86Å; V695-L758 HydrophobicContact CG2-CG 4.36Å; L758-R760 VanDerWaalsContact C-N 3.28Å; L758-R760 WeakPolarHBondContact O-CD 3.33Å; L758-R760 PolarHBondContact O-N 3.34Å; L758-R760 PolarHBondContact O-NH1 3.35Å
759	G	82.3	Confident	88.2	Confident	76 Å²	76	50 Å²	50	78%	0.784	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	0.9	-176.7	0	0	0	0	0	115.2	L757	L757-G759 PolarHBondContact O-N 3.17Å
760	R	82	Confident	88.6	Confident	109 Å²	109	54.3 Å²	54.3	41%	0.411	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	147.5	173.5	-68.6	70.5	171.3	-172	-4.7	109.9	Y688 E692 Q756 L757 L758 I762	Y688-R760 PolarHBondContact OH-NH1 2.99Å; E692-R760 IonicContact OE1-CZ 2.71Å; E692-R760 IonicContact OE1-NH1 3.28Å; E692-R760 PolarHBondContact OE1-NH1 3.43Å; E692-R760 IonicContact OE1-NH2 2.88Å; E692-R760 PolarHBondContact OE1-NH2 3.21Å; Q756-R760 WeakPolarHBondContact CA-O 3.3Å; L757-R760 PolarHBondContact N-O 3.13Å; L757-R760 WeakPolarHBondContact O-CB 3.28Å; L757-R760 PolarHBondContact O-N 3.14Å; L758-R760 VanDerWaalsContact C-N 3.28Å; L758-R760 WeakPolarHBondContact O-CD 3.33Å; L758-R760 PolarHBondContact O-N 3.34Å; L758-R760 PolarHBondContact O-NH1 3.35Å; R760-I762 HydrophobicContact CB-CD1 3.74Å; R760-I762 HydrophobicContact CB-CG1 4.26Å
761	S	86.6	Confident	88.9	Confident	73 Å²	73	58.8 Å²	58.8	51%	0.51	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	105.1	168.9	172.5	0	0	0	0	109.3	H754	H754-S761 WeakPolarHBondContact CB-OG 3.19Å
762	I	84.6	Confident	89.5	Confident	43 Å²	43	52.9 Å²	52.9	22%	0.221	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124	-174.3	-51.1	-62.4	0	0	0	111.4	F699 H754 V755 R760 L764 L767	F699-I762 HydrophobicContact CE1-CG2 3.76Å; F699-I762 HydrophobicContact CZ-CB 4.36Å; F699-I762 HydrophobicContact CZ-CG2 3.59Å; H754-I762 CarbonylContact C-O 3.6Å; H754-I762 WeakPolarHBondContact CA-O 3.24Å; V755-I762 HydrophobicContact CB-CB 4.41Å; V755-I762 PolarHBondContact N-O 2.98Å; V755-I762 PolarHBondContact O-N 3.47Å; R760-I762 HydrophobicContact CB-CD1 3.74Å; R760-I762 HydrophobicContact CB-CG1 4.26Å; I762-L764 PolarHBondContact O-N 2.87Å; I762-L764 VanDerWaalsContact O-N 3.17Å; I762-L767 HydrophobicContact CG2-CD1 3.67Å
763	D	91.1	Very high	90.1	Very high	41 Å²	41	52.3 Å²	52.3	22%	0.219	26%	0.261	C	S	.	.			trans	-82	89.8	170.8	-168.6	-20.3	0	0	0	110.2	R753 N765 R766 L767	R753-D763 IonicContact CZ-OD2 3.71Å; R753-D763 IonicContact NE-OD1 3.07Å; R753-D763 PolarHBondContact NE-OD1 3.14Å; R753-D763 IonicContact NE-OD2 3.5Å; R753-D763 PolarHBondContact NE-OD2 3.02Å; R753-D763 IonicContact NH2-OD2 2.74Å; R753-D763 PolarHBondContact NH2-OD2 2.92Å; R753-D763 VanDerWaalsContact O-CA 3.22Å; R753-D763 WeakPolarHBondContact O-CA 3.47Å; R753-D763 WeakPolarHBondContact O-CB 3.32Å; D763-N765 WeakPolarHBondContact OD1-CB 3.23Å; D763-N765 PolarHBondContact OD1-N 3.38Å; D763-R766 HydrophobicContact CB-CB 3.9Å; D763-R766 PolarHBondContact O-N 2.99Å; D763-R766 PolarHBondContact OD1-N 3.39Å; D763-L767 WeakPolarHBondContact O-CG 3.19Å; D763-L767 PolarHBondContact O-N 3.24Å
764	L	90.4	Very high	91	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.4	-38.1	-179.9	-177.6	62.5	0	0	0	111.7	L665 F699 F702 V703 L706 Q752 V755 I762 R766 L767 I768	L665-L764 HydrophobicContact CD2-CD2 4.5Å; F699-L764 HydrophobicContact CZ-CD1 4.35Å; F702-L764 HydrophobicContact CD1-CD1 4.4Å; F702-L764 HydrophobicContact CE1-CD1 3.94Å; F702-L764 HydrophobicContact CE1-CD2 4.02Å; V703-L764 HydrophobicContact CG2-CD1 4.06Å; L706-L764 HydrophobicContact CD2-CD2 4.25Å; Q752-L764 HydrophobicContact CB-CB 4.08Å; Q752-L764 HydrophobicContact CB-CD2 4.25Å; Q752-L764 PolarHBondContact O-N 3.4Å; V755-L764 HydrophobicContact CG2-CB 4.13Å; V755-L764 HydrophobicContact CG2-CD2 4.49Å; I762-L764 PolarHBondContact O-N 2.87Å; I762-L764 VanDerWaalsContact O-N 3.17Å; L764-R766 VanDerWaalsContact C-N 3.31Å; L764-R766 PolarHBondContact O-N 2.91Å; L764-L767 PolarHBondContact O-N 2.93Å; L764-I768 HydrophobicContact CD1-CD1 4.16Å; L764-I768 HydrophobicContact CD1-CG1 4.24Å; L764-I768 HydrophobicContact CD2-CD1 4.37Å; L764-I768 HydrophobicContact CG-CD1 3.79Å; L764-I768 HydrophobicContact CG-CG1 4.33Å; L764-I768 VanDerWaalsContact O-CG1 3.31Å; L764-I768 WeakPolarHBondContact O-CG1 3.15Å; L764-I768 PolarHBondContact O-N 3.34Å
765	N	93.9	Very high	91.7	Very high	14 Å²	14	45.6 Å²	45.6	8%	0.075	25%	0.247	C	C	.	.	H	α-helix	trans	-55.8	-46.5	174	176	-79.3	0	0	0	111	L750 Q752 D763 L767 I768 T769 Y815 L816	L750-N765 WeakPolarHBondContact O-CB 3.5Å; L750-N765 PolarHBondContact O-ND2 2.97Å; Q752-N765 PolarHBondContact O-N 2.93Å; D763-N765 WeakPolarHBondContact OD1-CB 3.23Å; D763-N765 PolarHBondContact OD1-N 3.38Å; N765-L767 PolarHBondContact O-N 3.3Å; N765-I768 PolarHBondContact O-N 2.92Å; N765-T769 VanDerWaalsContact O-CB 3.3Å; N765-T769 WeakPolarHBondContact O-CB 3.41Å; N765-T769 PolarHBondContact O-N 3.4Å; N765-T769 PolarHBondContact O-OG1 2.89Å; N765-T769 PolarHBondContact OD1-OG1 3.32Å; N765-Y815 PolarHBondContact ND2-O 3.35Å; N765-L816 VanDerWaalsContact ND2-CD2 3.3Å; N765-L816 WeakPolarHBondContact ND2-CD2 3.4Å
766	R	94.3	Very high	92.4	Very high	157 Å²	157	44.7 Å²	44.7	59%	0.592	24%	0.242	S	C	*	.	H	α-helix	trans	-60.4	-46.4	177.3	177.3	-177.9	171.5	122.1	-1.2	111.9	D763 L764 T769 Q770	D763-R766 HydrophobicContact CB-CB 3.9Å; D763-R766 PolarHBondContact O-N 2.99Å; D763-R766 PolarHBondContact OD1-N 3.39Å; L764-R766 VanDerWaalsContact C-N 3.31Å; L764-R766 PolarHBondContact O-N 2.91Å; R766-T769 PolarHBondContact O-N 3.27Å; R766-Q770 WeakPolarHBondContact O-CG 3.44Å; R766-Q770 PolarHBondContact O-N 3.28Å; R766-Q770 VanDerWaalsContact O-N 3.08Å
767	L	95.6	Very high	93	Very high	40 Å²	40	44.2 Å²	44.2	21%	0.209	24%	0.238	C	C	.	.	H	α-helix	trans	-64.3	-42.6	-179.1	-67.1	175.6	0	0	0	112	F699 V703 I762 D763 L764 N765 Q770 R771	F699-L767 HydrophobicContact CE1-CD1 3.72Å; F699-L767 HydrophobicContact CZ-CD1 4.23Å; V703-L767 HydrophobicContact CG1-CB 3.93Å; V703-L767 HydrophobicContact CG2-CB 4.45Å; V703-L767 HydrophobicContact CG2-CD1 4.07Å; I762-L767 HydrophobicContact CG2-CD1 3.67Å; D763-L767 WeakPolarHBondContact O-CG 3.19Å; D763-L767 PolarHBondContact O-N 3.24Å; L764-L767 PolarHBondContact O-N 2.93Å; N765-L767 PolarHBondContact O-N 3.3Å; L767-Q770 PolarHBondContact O-N 3.2Å; L767-R771 WeakPolarHBondContact O-CD 3.44Å; L767-R771 PolarHBondContact O-NH1 3.41Å
768	I	96.7	Very high	93.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-48	174.1	-66.4	168.2	0	0	0	110.1	L706 A707 I710 L750 L764 N765 Q770 R771 V772 L816	L706-I768 HydrophobicContact CD2-CD1 3.9Å; L706-I768 HydrophobicContact CG-CD1 4.34Å; A707-I768 HydrophobicContact CB-CG2 4.33Å; I710-I768 HydrophobicContact CD1-CD1 4.1Å; I710-I768 HydrophobicContact CD1-CG2 4.26Å; L750-I768 HydrophobicContact CD2-CD1 4.25Å; L750-I768 HydrophobicContact CD2-CG2 3.84Å; L764-I768 HydrophobicContact CD1-CD1 4.16Å; L764-I768 HydrophobicContact CD1-CG1 4.24Å; L764-I768 HydrophobicContact CD2-CD1 4.37Å; L764-I768 HydrophobicContact CG-CD1 3.79Å; L764-I768 HydrophobicContact CG-CG1 4.33Å; L764-I768 VanDerWaalsContact O-CG1 3.31Å; L764-I768 WeakPolarHBondContact O-CG1 3.15Å; L764-I768 PolarHBondContact O-N 3.34Å; N765-I768 PolarHBondContact O-N 2.92Å; I768-Q770 VanDerWaalsContact C-N 3.25Å; I768-Q770 PolarHBondContact O-N 3.34Å; I768-R771 PolarHBondContact O-N 2.7Å; I768-V772 HydrophobicContact CG2-CG2 3.76Å; I768-V772 WeakPolarHBondContact O-CB 3.36Å; I768-V772 WeakPolarHBondContact O-CG2 3.35Å; I768-V772 PolarHBondContact O-N 3.23Å; I768-L816 HydrophobicContact CG2-CD1 4.23Å
769	T	97.7	Very high	93.9	Very high	21 Å²	21	48 Å²	48	13%	0.129	25%	0.253	C	S	.	.	H	α-helix	trans	-52.4	-43.8	179	-59.4	0	0	0	0	111.8	N765 R766 R771 V772 S773 L816 T817 L818	N765-T769 VanDerWaalsContact O-CB 3.3Å; N765-T769 WeakPolarHBondContact O-CB 3.41Å; N765-T769 PolarHBondContact O-N 3.4Å; N765-T769 PolarHBondContact O-OG1 2.89Å; N765-T769 PolarHBondContact OD1-OG1 3.32Å; R766-T769 PolarHBondContact O-N 3.27Å; T769-R771 PolarHBondContact O-N 3.05Å; T769-V772 PolarHBondContact O-N 2.74Å; T769-S773 VanDerWaalsContact O-CB 3.25Å; T769-S773 WeakPolarHBondContact O-CB 3.37Å; T769-S773 PolarHBondContact O-N 3.3Å; T769-L816 WeakPolarHBondContact OG1-CD2 3.44Å; T769-T817 WeakPolarHBondContact CG2-O 3.29Å; T769-L818 HydrophobicContact CG2-CD2 4.04Å
770	Q	96.7	Very high	94.6	Very high	92 Å²	92	44.3 Å²	44.3	43%	0.43	22%	0.216	S	C	.	.	H	α-helix	trans	-58.8	-46.5	177.9	-71.1	169.9	-15.6	0	0	112.7	R766 L767 I768 A774	R766-Q770 WeakPolarHBondContact O-CG 3.44Å; R766-Q770 PolarHBondContact O-N 3.28Å; R766-Q770 VanDerWaalsContact O-N 3.08Å; L767-Q770 PolarHBondContact O-N 3.2Å; I768-Q770 VanDerWaalsContact C-N 3.25Å; I768-Q770 PolarHBondContact O-N 3.34Å; Q770-A774 PolarHBondContact O-N 3.43Å; Q770-A774 VanDerWaalsContact O-N 3.16Å
771	R	97.3	Very high	95.4	Very high	95 Å²	95	42.6 Å²	42.6	36%	0.358	21%	0.212	S	C	.	.	H	α-helix	trans	-72.9	-39.6	-178.9	-77.8	79.4	179.2	167.6	-0.4	111.4	A707 L767 I768 T769 A774 A775	A707-R771 HydrophobicContact CB-CB 3.65Å; A707-R771 HydrophobicContact CB-CG 4.28Å; L767-R771 WeakPolarHBondContact O-CD 3.44Å; L767-R771 PolarHBondContact O-NH1 3.41Å; I768-R771 PolarHBondContact O-N 2.7Å; T769-R771 PolarHBondContact O-N 3.05Å; R771-A774 PolarHBondContact O-N 3.33Å; R771-A775 WeakPolarHBondContact O-CB 3.39Å; R771-A775 PolarHBondContact O-N 3.41Å
772	V	98.1	Very high	95.8	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-66.1	-40.7	177.5	170.1	0	0	0	0	111.3	F711 I768 T769 A775 M776 L812 L816 L818	F711-V772 HydrophobicContact CD2-CG1 4.33Å; I768-V772 HydrophobicContact CG2-CG2 3.76Å; I768-V772 WeakPolarHBondContact O-CB 3.36Å; I768-V772 WeakPolarHBondContact O-CG2 3.35Å; I768-V772 PolarHBondContact O-N 3.23Å; T769-V772 PolarHBondContact O-N 2.74Å; V772-A775 PolarHBondContact O-N 3.21Å; V772-M776 PolarHBondContact O-N 3.04Å; V772-L812 HydrophobicContact CG1-CD1 3.58Å; V772-L812 HydrophobicContact CG1-CD2 3.98Å; V772-L812 HydrophobicContact CG1-CG 4.27Å; V772-L816 HydrophobicContact CB-CD1 4.01Å; V772-L816 HydrophobicContact CG1-CD1 3.88Å; V772-L816 HydrophobicContact CG2-CD1 4.05Å; V772-L818 HydrophobicContact CG1-CD2 4.31Å
773	S	97.8	Very high	96.4	Very high	19 Å²	19	38.2 Å²	38.2	13%	0.133	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-50.3	173.8	-176	0	0	0	0	110.5	T769 A775 M776 Y777 M824	T769-S773 VanDerWaalsContact O-CB 3.25Å; T769-S773 WeakPolarHBondContact O-CB 3.37Å; T769-S773 PolarHBondContact O-N 3.3Å; S773-A775 VanDerWaalsContact C-N 3.26Å; S773-A775 PolarHBondContact O-N 3.36Å; S773-M776 WeakPolarHBondContact O-CB 3.26Å; S773-M776 PolarHBondContact O-N 2.91Å; S773-Y777 VanDerWaalsContact O-CD2 3.28Å; S773-Y777 WeakPolarHBondContact O-CD2 3.36Å; S773-Y777 PolarHBondContact O-N 3.45Å; S773-M824 WeakPolarHBondContact OG-CE 3.47Å
774	A	97.7	Very high	96.7	Very high	57 Å²	57	36.2 Å²	36.2	47%	0.471	17%	0.173	S	C	.	.	H	α-helix	trans	-58.2	-37.7	175.6	0	0	0	0	0	112.9	Q770 R771 Y777 K778	Q770-A774 PolarHBondContact O-N 3.43Å; Q770-A774 VanDerWaalsContact O-N 3.16Å; R771-A774 PolarHBondContact O-N 3.33Å; A774-Y777 PolarHBondContact O-N 2.86Å; A774-K778 WeakPolarHBondContact O-CB 3.48Å; A774-K778 PolarHBondContact O-N 3.38Å
775	A	98	Very high	97	Very high	12 Å²	12	36.6 Å²	36.6	10%	0.099	18%	0.177	C	C	.	.	H	α-helix	trans	-67.4	-37.4	175.6	0	0	0	0	0	112.8	F711 R771 V772 S773 K778 S779 Y887	F711-A775 HydrophobicContact CB-CB 4.4Å; F711-A775 HydrophobicContact CD1-CB 3.75Å; F711-A775 HydrophobicContact CD2-CB 3.71Å; F711-A775 HydrophobicContact CE1-CB 3.82Å; F711-A775 HydrophobicContact CE2-CB 3.78Å; F711-A775 HydrophobicContact CG-CB 3.68Å; F711-A775 HydrophobicContact CZ-CB 3.83Å; F711-A775 WeakPolarHBondContact CZ-O 3.34Å; R771-A775 WeakPolarHBondContact O-CB 3.39Å; R771-A775 PolarHBondContact O-N 3.41Å; V772-A775 PolarHBondContact O-N 3.21Å; S773-A775 VanDerWaalsContact C-N 3.26Å; S773-A775 PolarHBondContact O-N 3.36Å; A775-K778 PolarHBondContact O-N 2.92Å; A775-S779 WeakPolarHBondContact O-CB 3.24Å; A775-S779 PolarHBondContact O-N 3.13Å; A775-Y887 HydrophobicContact CB-CE1 4.09Å
776	M	98.2	Very high	97.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.3	-48.4	172.5	-80.6	-62.3	-49.4	0	0	111.6	F711 V772 S773 K778 S779 L780 N805 T808 H809 L812 F821 M824	F711-M776 HydrophobicContact CE2-CG 3.95Å; F711-M776 HydrophobicContact CE2-SD 3.74Å; F711-M776 HydrophobicContact CZ-SD 4.49Å; V772-M776 PolarHBondContact O-N 3.04Å; S773-M776 WeakPolarHBondContact O-CB 3.26Å; S773-M776 PolarHBondContact O-N 2.91Å; M776-K778 PolarHBondContact O-N 3.48Å; M776-S779 WeakPolarHBondContact O-CB 3.39Å; M776-S779 PolarHBondContact O-N 2.8Å; M776-S779 VanDerWaalsContact O-N 3.16Å; M776-L780 WeakPolarHBondContact O-CG 3.38Å; M776-L780 PolarHBondContact O-N 3.33Å; M776-N805 HydrophobicContact CE-CB 4.42Å; M776-T808 HydrophobicContact SD-CG2 4.01Å; M776-H809 HydrophobicContact CE-CB 3.82Å; M776-H809 HydrophobicContact SD-CB 4.48Å; M776-L812 HydrophobicContact CG-CD1 4.33Å; M776-L812 HydrophobicContact SD-CD1 4.18Å; M776-F821 HydrophobicContact CE-CD2 4.48Å; M776-F821 HydrophobicContact CE-CE2 4.46Å; M776-M824 HydrophobicContact CB-SD 4.03Å
777	Y	97.6	Very high	97.2	Very high	51 Å²	51	31.4 Å²	31.4	20%	0.2	16%	0.156	C	C	.	.	H	α-helix	trans	-56.8	-48.6	174.6	-84.3	-75.7	0	0	0	111.8	S773 A774 S779 L780 E781 M824 E827	S773-Y777 VanDerWaalsContact O-CD2 3.28Å; S773-Y777 WeakPolarHBondContact O-CD2 3.36Å; S773-Y777 PolarHBondContact O-N 3.45Å; A774-Y777 PolarHBondContact O-N 2.86Å; Y777-S779 VanDerWaalsContact C-N 3.27Å; Y777-S779 PolarHBondContact O-N 3.08Å; Y777-L780 PolarHBondContact O-N 3.38Å; Y777-E781 WeakPolarHBondContact O-CB 3.48Å; Y777-E781 PolarHBondContact O-N 2.98Å; Y777-M824 HydrophobicContact CD2-CE 4.46Å; Y777-M824 HydrophobicContact CE1-CB 4.07Å; Y777-M824 HydrophobicContact CE1-CG 4.2Å; Y777-M824 HydrophobicContact CE2-CE 3.93Å; Y777-M824 HydrophobicContact CE2-CG 3.98Å; Y777-M824 HydrophobicContact CE2-SD 4.38Å; Y777-E827 HydrophobicContact CE1-CB 4.01Å; Y777-E827 VanDerWaalsContact CE1-CD 3.43Å; Y777-E827 HydrophobicContact CE1-CG 3.97Å; Y777-E827 WeakPolarHBondContact CE1-OE2 3.47Å; Y777-E827 PolarHBondContact OH-OE2 3.22Å
778	K	97.6	Very high	97.3	Very high	106 Å²	106	32.8 Å²	32.8	46%	0.461	16%	0.162	S	C	.	.	H	α-helix	trans	-60	-36.3	177	-175.8	173	175.9	-176.3	0	112.7	A774 A775 M776 L782 Y887	A774-K778 WeakPolarHBondContact O-CB 3.48Å; A774-K778 PolarHBondContact O-N 3.38Å; A775-K778 PolarHBondContact O-N 2.92Å; M776-K778 PolarHBondContact O-N 3.48Å; K778-L782 VanDerWaalsContact O-CB 3.25Å; K778-L782 WeakPolarHBondContact O-CB 3.49Å; K778-L782 PolarHBondContact O-N 2.86Å; K778-Y887 HydrophobicContact CB-CD1 4.3Å; K778-Y887 HydrophobicContact CB-CE1 4.36Å; K778-Y887 HydrophobicContact CD-CD1 4.01Å; K778-Y887 HydrophobicContact CD-CD2 4.49Å; K778-Y887 HydrophobicContact CD-CE1 3.7Å; K778-Y887 HydrophobicContact CD-CE2 4.2Å; K778-Y887 HydrophobicContact CD-CG 4.39Å; K778-Y887 HydrophobicContact CG-CD1 4.05Å; K778-Y887 HydrophobicContact CG-CE1 4.19Å; K778-Y887 HydrophobicContact CG-CG 4.43Å
779	S	97.8	Very high	97.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.7	-40.8	175.5	-98	0	0	0	0	113.5	K715 A775 M776 Y777 A783 N805 Y887	K715-S779 PolarHBondContact NZ-OG 3.46Å; A775-S779 WeakPolarHBondContact O-CB 3.24Å; A775-S779 PolarHBondContact O-N 3.13Å; M776-S779 WeakPolarHBondContact O-CB 3.39Å; M776-S779 PolarHBondContact O-N 2.8Å; M776-S779 VanDerWaalsContact O-N 3.16Å; Y777-S779 VanDerWaalsContact C-N 3.27Å; Y777-S779 PolarHBondContact O-N 3.08Å; S779-A783 PolarHBondContact O-N 3.41Å; S779-A783 VanDerWaalsContact O-N 3.09Å; S779-N805 WeakPolarHBondContact CB-OD1 3.34Å; S779-Y887 VanDerWaalsContact OG-C 3.31Å; S779-Y887 VanDerWaalsContact OG-CA 3.23Å; S779-Y887 WeakPolarHBondContact OG-CA 3.43Å; S779-Y887 PolarHBondContact OG-O 3.46Å
780	L	97.9	Very high	97.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-70	-44.6	177.2	-68	170.2	0	0	0	111	M776 Y777 L782 A783 I784 L802 N805 F821 M824 A828	M776-L780 WeakPolarHBondContact O-CG 3.38Å; M776-L780 PolarHBondContact O-N 3.33Å; Y777-L780 PolarHBondContact O-N 3.38Å; L780-L782 VanDerWaalsContact C-N 3.31Å; L780-L782 PolarHBondContact O-N 3.1Å; L780-A783 PolarHBondContact O-N 3.15Å; L780-I784 WeakPolarHBondContact O-CG1 3.42Å; L780-I784 PolarHBondContact O-N 3.29Å; L780-L802 HydrophobicContact CD2-CD2 3.81Å; L780-N805 HydrophobicContact CD2-CB 3.87Å; L780-F821 HydrophobicContact CD2-CE2 3.97Å; L780-F821 HydrophobicContact CD2-CZ 4.06Å; L780-M824 HydrophobicContact CD1-CB 3.72Å; L780-A828 HydrophobicContact CB-CB 3.77Å
781	E	97.1	Very high	97.1	Very high	73 Å²	73	31.3 Å²	31.3	34%	0.341	16%	0.156	S	C	.	.	H	α-helix	trans	-55.4	-47.5	174.3	179.9	54.8	-136.3	0	0	111.4	Y777 A783 I784 G785 R838	Y777-E781 WeakPolarHBondContact O-CB 3.48Å; Y777-E781 PolarHBondContact O-N 2.98Å; E781-A783 PolarHBondContact O-N 3.28Å; E781-I784 PolarHBondContact O-N 2.98Å; E781-G785 PolarHBondContact O-N 3.09Å; E781-R838 IonicContact OE1-CZ 3.59Å; E781-R838 VanDerWaalsContact OE1-CZ 3.28Å; E781-R838 IonicContact OE1-NH1 2.7Å; E781-R838 PolarHBondContact OE1-NH1 3.01Å; E781-R838 IonicContact OE1-NH2 2.72Å; E781-R838 PolarHBondContact OE1-NH2 3.32Å; E781-R838 IonicContact OE2-CZ 2.95Å; E781-R838 IonicContact OE2-NH1 3.18Å; E781-R838 PolarHBondContact OE2-NH1 3.27Å
782	L	96.3	Very high	97.1	Very high	21 Å²	21	26.9 Å²	26.9	11%	0.11	14%	0.14	C	C	.	.	H	α-helix	trans	-64.8	-39.1	179	-173.2	69.9	0	0	0	112	K778 L780 R786 Q880 A883 L888	K778-L782 VanDerWaalsContact O-CB 3.25Å; K778-L782 WeakPolarHBondContact O-CB 3.49Å; K778-L782 PolarHBondContact O-N 2.86Å; L780-L782 VanDerWaalsContact C-N 3.31Å; L780-L782 PolarHBondContact O-N 3.1Å; L782-R786 VanDerWaalsContact O-CB 3.24Å; L782-R786 WeakPolarHBondContact O-CB 3.37Å; L782-R786 PolarHBondContact O-N 2.94Å; L782-Q880 PolarHBondContact O-OE1 3.47Å; L782-A883 HydrophobicContact CD1-CB 4.1Å; L782-A883 HydrophobicContact CD2-CB 3.48Å; L782-A883 VanDerWaalsContact CD2-CB 3.48Å; L782-A883 HydrophobicContact CG-CB 4.46Å; L782-L888 HydrophobicContact CD2-CD2 3.46Å; L782-L888 VanDerWaalsContact CD2-CD2 3.46Å; L782-L888 HydrophobicContact CD2-CG 3.74Å; L782-L888 HydrophobicContact CG-CD2 3.94Å
783	A	97.3	Very high	97	Very high	2 Å²	2	26.9 Å²	26.9	2%	0.017	14%	0.14	C	C	.	.	H	α-helix	trans	-62.3	-46.1	177.5	0	0	0	0	0	111.4	S779 L780 E781 R786 F787 L798 L801 L802	S779-A783 PolarHBondContact O-N 3.41Å; S779-A783 VanDerWaalsContact O-N 3.09Å; L780-A783 PolarHBondContact O-N 3.15Å; E781-A783 PolarHBondContact O-N 3.28Å; A783-R786 PolarHBondContact O-N 2.83Å; A783-F787 PolarHBondContact O-N 3.36Å; A783-L798 HydrophobicContact CB-CD1 4.06Å; A783-L798 WeakPolarHBondContact O-CD1 3.32Å; A783-L801 HydrophobicContact CB-CD2 3.59Å; A783-L801 HydrophobicContact CB-CG 3.95Å; A783-L802 HydrophobicContact CB-CD2 4.37Å
784	I	97.4	Very high	97	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-69.8	-47.5	-179.9	-62.1	173.5	0	0	0	110.8	L780 E781 R786 F787 E788 F825 A828 N829 R838 I839	L780-I784 WeakPolarHBondContact O-CG1 3.42Å; L780-I784 PolarHBondContact O-N 3.29Å; E781-I784 PolarHBondContact O-N 2.98Å; I784-R786 PolarHBondContact O-N 2.87Å; I784-F787 WeakPolarHBondContact O-CA 3.48Å; I784-F787 WeakPolarHBondContact O-CB 3.48Å; I784-F787 PolarHBondContact O-N 2.84Å; I784-E788 PolarHBondContact O-N 2.99Å; I784-F825 HydrophobicContact CD1-CE2 4.31Å; I784-A828 HydrophobicContact CD1-CB 4.14Å; I784-N829 HydrophobicContact CD1-CB 3.78Å; I784-R838 HydrophobicContact CG2-CB 3.87Å; I784-I839 HydrophobicContact CD1-CD1 4.4Å; I784-I839 HydrophobicContact CG1-CD1 4.23Å; I784-I839 HydrophobicContact CG1-CG1 4.35Å; I784-I839 HydrophobicContact CG2-CG1 4.22Å
785	G	96.6	Very high	97	Very high	8 Å²	8	23.5 Å²	23.5	8%	0.082	11%	0.113	C	C	.	.	H	α-helix	trans	-63.4	-25.8	178.2	0	0	0	0	0	113.3	E781 E788 S789 Q880	E781-G785 PolarHBondContact O-N 3.09Å; G785-E788 WeakPolarHBondContact CA-OE2 3.44Å; G785-S789 PolarHBondContact O-N 3.44Å; G785-Q880 VanDerWaalsContact C-CD 3.48Å; G785-Q880 VanDerWaalsContact C-NE2 3.27Å
786	R	95.4	Very high	97	Very high	57 Å²	57	23.6 Å²	23.6	22%	0.215	11%	0.112	C	C	.	.	H	α-helix	trans	-69.1	-43.7	172.2	-171.1	174.1	176.8	143	-11.1	111	L782 A783 I784 E788 S789 E790 E797 Q880	L782-R786 VanDerWaalsContact O-CB 3.24Å; L782-R786 WeakPolarHBondContact O-CB 3.37Å; L782-R786 PolarHBondContact O-N 2.94Å; A783-R786 PolarHBondContact O-N 2.83Å; I784-R786 PolarHBondContact O-N 2.87Å; R786-E788 VanDerWaalsContact C-N 3.32Å; R786-E788 PolarHBondContact O-N 3.03Å; R786-S789 PolarHBondContact O-N 3.37Å; R786-S789 VanDerWaalsContact O-N 3.14Å; R786-S789 PolarHBondContact O-OG 3.14Å; R786-E790 IonicContact NE-OE1 3.86Å; R786-E790 PolarHBondContact O-N 2.74Å; R786-E797 IonicContact CZ-OE1 3.81Å; R786-E797 IonicContact NE-OE1 3.64Å; R786-E797 IonicContact NH2-OE1 3.91Å; R786-E797 PolarHBondContact NH2-OE1 3.11Å; R786-Q880 VanDerWaalsContact CB-OE1 3.31Å
787	F	97.6	Very high	97	Very high	5 Å²	5	24.1 Å²	24.1	2%	0.022	12%	0.115	C	C	.	.	H	α-helix	trans	-60	-42.4	174.6	177.4	-121.1	0	0	0	111.8	A783 I784 S789 E790 S794 I795 L798 I839 H842 V843	A783-F787 PolarHBondContact O-N 3.36Å; I784-F787 WeakPolarHBondContact O-CA 3.48Å; I784-F787 WeakPolarHBondContact O-CB 3.48Å; I784-F787 PolarHBondContact O-N 2.84Å; F787-S789 PolarHBondContact O-N 2.86Å; F787-S789 VanDerWaalsContact O-N 3.17Å; F787-E790 PolarHBondContact O-N 2.98Å; F787-E790 VanDerWaalsContact O-O 3.11Å; F787-S794 WeakPolarHBondContact CD2-OG 3.1Å; F787-I795 HydrophobicContact CD2-CB 4.36Å; F787-I795 HydrophobicContact CE1-CG1 4.46Å; F787-I795 HydrophobicContact CE2-CB 3.61Å; F787-I795 HydrophobicContact CE2-CG1 3.87Å; F787-I795 HydrophobicContact CZ-CB 3.99Å; F787-I795 HydrophobicContact CZ-CD1 4.02Å; F787-I795 HydrophobicContact CZ-CG1 3.82Å; F787-L798 HydrophobicContact CB-CB 4.36Å; F787-L798 HydrophobicContact CB-CD1 4.3Å; F787-L798 HydrophobicContact CB-CD2 3.87Å; F787-L798 HydrophobicContact CB-CG 4.4Å; F787-L798 HydrophobicContact CD1-CD2 3.74Å; F787-L798 HydrophobicContact CD2-CD2 4.3Å; F787-L798 HydrophobicContact CE1-CD2 4.36Å; F787-L798 HydrophobicContact CG-CD2 3.7Å; F787-I839 HydrophobicContact CD1-CG2 4.42Å; F787-I839 HydrophobicContact CE1-CG2 4.01Å; F787-H842 HydrophobicContact CD1-CB 4.31Å; F787-H842 AromaticContact CD1-CD2 3.66Å; F787-H842 HydrophobicContact CE1-CB 3.98Å; F787-H842 AromaticContact CE1-CD2 3.5Å; F787-H842 VanDerWaalsContact CE1-CD2 3.5Å; F787-H842 WeakPolarHBondContact CE1-CD2 3.48Å; F787-H842 AromaticContact CZ-CD2 3.74Å; F787-H842 PolarHBondContact O-CD2 3.07Å; F787-H842 VanDerWaalsContact O-CD2 3.28Å; F787-H842 PolarHBondContact O-NE2 3.13Å; F787-V843 HydrophobicContact CE1-CG2 4.14Å; F787-V843 HydrophobicContact CZ-CG2 4Å
788	E	96.7	Very high	97	Very high	69 Å²	69	22 Å²	22	32%	0.322	11%	0.107	S	C	.	.	H	α-helix	trans	-60.4	-24.4	176.3	-69.4	174	153	0	0	113.5	I784 G785 R786 R838 H842	I784-E788 PolarHBondContact O-N 2.99Å; G785-E788 WeakPolarHBondContact CA-OE2 3.44Å; R786-E788 VanDerWaalsContact C-N 3.32Å; R786-E788 PolarHBondContact O-N 3.03Å; E788-R838 WeakPolarHBondContact OE1-CB 3.48Å; E788-R838 IonicContact OE1-CZ 3.94Å; E788-R838 IonicContact OE1-NE 2.75Å; E788-R838 PolarHBondContact OE1-NE 3.34Å; E788-R838 IonicContact OE1-NH2 3.65Å; E788-R838 IonicContact OE2-CZ 3.05Å; E788-R838 IonicContact OE2-NE 2.62Å; E788-R838 PolarHBondContact OE2-NE 3.09Å; E788-R838 IonicContact OE2-NH2 2.99Å; E788-R838 PolarHBondContact OE2-NH2 3.02Å; E788-H842 WeakPolarHBondContact CA-NE2 3.45Å; E788-H842 HydrophobicContact CG-CB 4.36Å; E788-H842 PolarHBondContact O-CE1 3.33Å
789	S	95.6	Very high	97	Very high	23 Å²	23	18.2 Å²	18.2	16%	0.161	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-3.4	176.2	71.1	0	0	0	0	114.5	G785 R786 F787 D878	G785-S789 PolarHBondContact O-N 3.44Å; R786-S789 PolarHBondContact O-N 3.37Å; R786-S789 VanDerWaalsContact O-N 3.14Å; R786-S789 PolarHBondContact O-OG 3.14Å; F787-S789 PolarHBondContact O-N 2.86Å; F787-S789 VanDerWaalsContact O-N 3.17Å; S789-D878 WeakPolarHBondContact CB-O 3.46Å
790	E	95.2	Very high	97	Very high	40 Å²	40	18.7 Å²	18.7	19%	0.187	10%	0.096	C	C	.	.	S	Bend	trans	-125.4	169.3	-173.7	-65.1	-149.3	-133.3	0	0	112.5	R786 F787 S794 H842 R906	R786-E790 IonicContact NE-OE1 3.86Å; R786-E790 PolarHBondContact O-N 2.74Å; F787-E790 PolarHBondContact O-N 2.98Å; F787-E790 VanDerWaalsContact O-O 3.11Å; E790-S794 VanDerWaalsContact CB-OG 3.29Å; E790-S794 WeakPolarHBondContact CB-OG 3.13Å; E790-H842 PolarHBondContact O-NE2 3.28Å; E790-R906 IonicContact OE2-CZ 2.85Å; E790-R906 IonicContact OE2-NH1 3.58Å; E790-R906 PolarHBondContact OE2-NH1 2.91Å; E790-R906 IonicContact OE2-NH2 2.73Å; E790-R906 PolarHBondContact OE2-NH2 3.34Å
791	D	95.9	Very high	97	Very high	18 Å²	18	18.8 Å²	18.8	10%	0.096	10%	0.097	C	C	.	.			trans	-77.7	170	179.1	66.5	13.4	0	0	0	113	T793 S794 E846 R866 R906	D791-T793 PolarHBondContact O-N 3.08Å; D791-T793 PolarHBondContact OD1-N 2.86Å; D791-T793 PolarHBondContact OD1-OG1 3.42Å; D791-S794 WeakPolarHBondContact O-CB 3.3Å; D791-S794 PolarHBondContact O-N 3.2Å; D791-S794 PolarHBondContact O-OG 3.45Å; D791-E846 WeakPolarHBondContact CA-OE2 3.3Å; D791-R866 IonicContact OD2-CZ 3.39Å; D791-R866 IonicContact OD2-NH2 2.69Å; D791-R866 PolarHBondContact OD2-NH2 3.18Å; D791-R906 IonicContact OD1-CZ 3.59Å; D791-R906 IonicContact OD1-NE 3.27Å; D791-R906 IonicContact OD1-NH2 2.76Å; D791-R906 PolarHBondContact OD1-NH2 3.04Å; D791-R906 VanDerWaalsContact OD1-NH2 3.14Å
792	L	96.9	Very high	97	Very high	3 Å²	3	15.7 Å²	15.7	2%	0.016	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-53.9	-28.5	-178.3	-173.9	61.8	0	0	0	113.7	S794 I795 V843 E846 L847 F851 I917	L792-S794 PolarHBondContact O-N 3.18Å; L792-I795 WeakPolarHBondContact O-CB 3.26Å; L792-I795 VanDerWaalsContact O-CG2 3.27Å; L792-I795 WeakPolarHBondContact O-CG2 3.5Å; L792-I795 PolarHBondContact O-N 3.08Å; L792-V843 HydrophobicContact CD1-CB 4.41Å; L792-V843 HydrophobicContact CD1-CG1 4.05Å; L792-V843 HydrophobicContact CD1-CG2 4.15Å; L792-E846 HydrophobicContact CB-CB 4.11Å; L792-L847 HydrophobicContact CD2-CD2 3.82Å; L792-L847 HydrophobicContact CD2-CG 4.46Å; L792-F851 HydrophobicContact CD2-CB 4.4Å; L792-F851 HydrophobicContact CD2-CD2 4.23Å; L792-F851 HydrophobicContact CD2-CG 4.4Å; L792-I917 HydrophobicContact CD1-CD1 3.93Å; L792-I917 HydrophobicContact CD1-CG1 4.4Å; L792-I917 HydrophobicContact CD2-CD1 4.23Å; L792-I917 HydrophobicContact CG-CD1 4.27Å
793	T	97.3	Very high	97.1	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.006	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-67.1	-25.5	-178	72.3	0	0	0	0	113	D791 I795 Y855 Y905 R906 V909	D791-T793 PolarHBondContact O-N 3.08Å; D791-T793 PolarHBondContact OD1-N 2.86Å; D791-T793 PolarHBondContact OD1-OG1 3.42Å; T793-I795 PolarHBondContact O-N 3.23Å; T793-Y855 WeakPolarHBondContact CG2-OH 3.19Å; T793-Y905 WeakPolarHBondContact CB-O 3.37Å; T793-R906 WeakPolarHBondContact OG1-CA 3.44Å; T793-R906 PolarHBondContact OG1-NE 2.75Å; T793-V909 HydrophobicContact CG2-CG2 3.78Å
794	S	97.6	Very high	97.2	Very high	5 Å²	5	18 Å²	18	4%	0.035	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-71.9	-8.2	179.1	69.7	0	0	0	0	113.7	F787 E790 D791 L792 V796 E797 L798	F787-S794 WeakPolarHBondContact CD2-OG 3.1Å; E790-S794 VanDerWaalsContact CB-OG 3.29Å; E790-S794 WeakPolarHBondContact CB-OG 3.13Å; D791-S794 WeakPolarHBondContact O-CB 3.3Å; D791-S794 PolarHBondContact O-N 3.2Å; D791-S794 PolarHBondContact O-OG 3.45Å; L792-S794 PolarHBondContact O-N 3.18Å; S794-V796 PolarHBondContact O-N 2.6Å; S794-V796 VanDerWaalsContact O-N 3.11Å; S794-E797 WeakPolarHBondContact O-CA 3.42Å; S794-E797 WeakPolarHBondContact O-CB 3.43Å; S794-E797 PolarHBondContact O-N 3.33Å; S794-L798 PolarHBondContact O-N 2.97Å; S794-L798 VanDerWaalsContact O-N 3.09Å
795	I	98	Very high	97.2	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.1	-26.3	-180	-155.2	177.5	0	0	0	113	F787 L792 T793 L798 D799 V843 V916 I917 L920	F787-I795 HydrophobicContact CD2-CB 4.36Å; F787-I795 HydrophobicContact CE1-CG1 4.46Å; F787-I795 HydrophobicContact CE2-CB 3.61Å; F787-I795 HydrophobicContact CE2-CG1 3.87Å; F787-I795 HydrophobicContact CZ-CB 3.99Å; F787-I795 HydrophobicContact CZ-CD1 4.02Å; F787-I795 HydrophobicContact CZ-CG1 3.82Å; L792-I795 WeakPolarHBondContact O-CB 3.26Å; L792-I795 VanDerWaalsContact O-CG2 3.27Å; L792-I795 WeakPolarHBondContact O-CG2 3.5Å; L792-I795 PolarHBondContact O-N 3.08Å; T793-I795 PolarHBondContact O-N 3.23Å; I795-L798 HydrophobicContact CG1-CD2 4.37Å; I795-L798 WeakPolarHBondContact O-CB 3.43Å; I795-L798 PolarHBondContact O-N 2.97Å; I795-D799 PolarHBondContact O-N 3.03Å; I795-V843 HydrophobicContact CD1-CG2 3.85Å; I795-V916 HydrophobicContact CB-CG1 4.48Å; I795-V916 HydrophobicContact CD1-CG1 4.21Å; I795-V916 HydrophobicContact CG1-CG1 3.9Å; I795-V916 HydrophobicContact CG2-CB 4.44Å; I795-V916 HydrophobicContact CG2-CG1 4.13Å; I795-I917 HydrophobicContact CD1-CB 4.48Å; I795-I917 HydrophobicContact CD1-CG1 3.62Å; I795-I917 HydrophobicContact CG2-CG1 4.34Å; I795-L920 HydrophobicContact CD1-CD1 4.07Å; I795-L920 HydrophobicContact CG1-CD1 3.95Å
796	V	97.9	Very high	97.3	Very high	14 Å²	14	22.6 Å²	22.6	9%	0.085	11%	0.107	C	C	.	.	H	α-helix	trans	-70.6	-36.3	175.5	-175.4	0	0	0	0	111.3	S794 L798 G800 Y902 Y905	S794-V796 PolarHBondContact O-N 2.6Å; S794-V796 VanDerWaalsContact O-N 3.11Å; V796-L798 VanDerWaalsContact C-N 3.35Å; V796-G800 PolarHBondContact O-N 3.28Å; V796-Y902 HydrophobicContact CG1-CD1 3.99Å; V796-Y902 HydrophobicContact CG1-CE1 4.2Å; V796-Y905 HydrophobicContact CB-CG 4.3Å; V796-Y905 HydrophobicContact CG1-CD1 4.1Å; V796-Y905 HydrophobicContact CG1-CD2 4.14Å; V796-Y905 HydrophobicContact CG1-CE1 4.31Å; V796-Y905 HydrophobicContact CG1-CE2 4.35Å; V796-Y905 HydrophobicContact CG1-CG 4Å; V796-Y905 HydrophobicContact CG2-CD1 4.22Å; V796-Y905 HydrophobicContact CG2-CG 4.38Å
797	E	97.5	Very high	97.4	Very high	11 Å²	11	21.8 Å²	21.8	5%	0.051	11%	0.106	C	C	.	.	H	α-helix	trans	-66.6	-39.9	171.9	-176.9	171.7	167.4	0	0	110.4	R786 S794 G800 L801 Y902	R786-E797 IonicContact CZ-OE1 3.81Å; R786-E797 IonicContact NE-OE1 3.64Å; R786-E797 IonicContact NH2-OE1 3.91Å; R786-E797 PolarHBondContact NH2-OE1 3.11Å; S794-E797 WeakPolarHBondContact O-CA 3.42Å; S794-E797 WeakPolarHBondContact O-CB 3.43Å; S794-E797 PolarHBondContact O-N 3.33Å; E797-G800 PolarHBondContact O-N 3.47Å; E797-L801 WeakPolarHBondContact O-CB 3.15Å; E797-L801 PolarHBondContact O-N 2.99Å; E797-Y902 HydrophobicContact CB-CD2 3.94Å; E797-Y902 HydrophobicContact CB-CG 3.89Å; E797-Y902 HydrophobicContact CG-CD2 3.75Å; E797-Y902 HydrophobicContact CG-CG 4.19Å
798	L	98	Very high	97.5	Very high	6 Å²	6	21.5 Å²	21.5	3%	0.031	11%	0.105	C	C	.	.	H	α-helix	trans	-58.4	-51.9	175	173.9	66.7	0	0	0	112	A783 F787 S794 I795 V796 G800 L801 L802 I839 L920	A783-L798 HydrophobicContact CB-CD1 4.06Å; A783-L798 WeakPolarHBondContact O-CD1 3.32Å; F787-L798 HydrophobicContact CB-CB 4.36Å; F787-L798 HydrophobicContact CB-CD1 4.3Å; F787-L798 HydrophobicContact CB-CD2 3.87Å; F787-L798 HydrophobicContact CB-CG 4.4Å; F787-L798 HydrophobicContact CD1-CD2 3.74Å; F787-L798 HydrophobicContact CD2-CD2 4.3Å; F787-L798 HydrophobicContact CE1-CD2 4.36Å; F787-L798 HydrophobicContact CG-CD2 3.7Å; S794-L798 PolarHBondContact O-N 2.97Å; S794-L798 VanDerWaalsContact O-N 3.09Å; I795-L798 HydrophobicContact CG1-CD2 4.37Å; I795-L798 WeakPolarHBondContact O-CB 3.43Å; I795-L798 PolarHBondContact O-N 2.97Å; V796-L798 VanDerWaalsContact C-N 3.35Å; L798-G800 VanDerWaalsContact C-N 3.31Å; L798-G800 PolarHBondContact O-N 3Å; L798-L801 PolarHBondContact O-N 3.03Å; L798-L801 VanDerWaalsContact O-N 3.16Å; L798-L802 HydrophobicContact CD1-CD1 4.01Å; L798-L802 HydrophobicContact CD1-CD2 4.42Å; L798-L802 HydrophobicContact CD1-CG 3.95Å; L798-L802 HydrophobicContact CG-CD1 3.93Å; L798-L802 HydrophobicContact CG-CG 4.27Å; L798-L802 WeakPolarHBondContact O-CB 3.28Å; L798-L802 VanDerWaalsContact O-CG 3.32Å; L798-L802 WeakPolarHBondContact O-CG 3.45Å; L798-L802 PolarHBondContact O-N 3.47Å; L798-I839 HydrophobicContact CD2-CD1 3.94Å; L798-I839 HydrophobicContact CD2-CG1 3.98Å; L798-I839 HydrophobicContact CD2-CG2 4.25Å; L798-L920 HydrophobicContact CD2-CD1 4.22Å
799	D	97.7	Very high	97.5	Very high	26 Å²	26	19.4 Å²	19.4	14%	0.139	10%	0.095	C	C	.	.	H	α-helix	trans	-59.2	-43.6	179.7	-175.2	59.2	0	0	0	111.4	I795 L801 L802 E803 V916 R919	I795-D799 PolarHBondContact O-N 3.03Å; D799-L801 VanDerWaalsContact C-N 3.35Å; D799-L801 PolarHBondContact O-N 3.26Å; D799-L802 PolarHBondContact O-N 2.73Å; D799-E803 WeakPolarHBondContact O-CB 3.46Å; D799-E803 PolarHBondContact O-N 3.36Å; D799-V916 HydrophobicContact CB-CG1 3.68Å; D799-V916 HydrophobicContact CB-CG2 4.15Å; D799-R919 IonicContact OD1-CZ 2.69Å; D799-R919 IonicContact OD1-NH1 2.97Å; D799-R919 IonicContact OD1-NH2 2.66Å; D799-R919 PolarHBondContact OD1-NH2 3.11Å; D799-R919 IonicContact OD2-CZ 3.28Å; D799-R919 IonicContact OD2-NH1 3.58Å; D799-R919 PolarHBondContact OD2-NH1 3.38Å; D799-R919 IonicContact OD2-NH2 2.75Å; D799-R919 PolarHBondContact OD2-NH2 3.08Å
800	G	97	Very high	97.7	Very high	10 Å²	10	24.4 Å²	24.4	10%	0.103	11%	0.114	C	C	.	.	H	α-helix	trans	-57.7	-45	174.3	0	0	0	0	0	113.4	V796 E797 L798 E803 I804 Y902	V796-G800 PolarHBondContact O-N 3.28Å; E797-G800 PolarHBondContact O-N 3.47Å; L798-G800 VanDerWaalsContact C-N 3.31Å; L798-G800 PolarHBondContact O-N 3Å; G800-E803 PolarHBondContact O-N 2.96Å; G800-I804 WeakPolarHBondContact O-CG1 3.49Å; G800-I804 PolarHBondContact O-N 2.92Å; G800-Y902 VanDerWaalsContact CA-OH 3.3Å; G800-Y902 WeakPolarHBondContact CA-OH 3.28Å
801	L	97.8	Very high	97.8	Very high	3 Å²	3	23.1 Å²	23.1	2%	0.016	11%	0.109	C	C	.	.	H	α-helix	trans	-70.3	-38	178.9	-176.1	57.7	0	0	0	112.3	A783 E797 L798 D799 E803 I804 N805 L888	A783-L801 HydrophobicContact CB-CD2 3.59Å; A783-L801 HydrophobicContact CB-CG 3.95Å; E797-L801 WeakPolarHBondContact O-CB 3.15Å; E797-L801 PolarHBondContact O-N 2.99Å; L798-L801 PolarHBondContact O-N 3.03Å; L798-L801 VanDerWaalsContact O-N 3.16Å; D799-L801 VanDerWaalsContact C-N 3.35Å; D799-L801 PolarHBondContact O-N 3.26Å; L801-E803 VanDerWaalsContact C-N 3.29Å; L801-E803 PolarHBondContact O-N 3.18Å; L801-I804 PolarHBondContact O-N 3.34Å; L801-N805 PolarHBondContact O-N 3.43Å; L801-N805 PolarHBondContact O-ND2 2.7Å; L801-N805 VanDerWaalsContact O-ND2 3.08Å; L801-L888 HydrophobicContact CD2-CD2 4.05Å
802	L	97.9	Very high	97.9	Very high	7 Å²	7	22.3 Å²	22.3	4%	0.037	10%	0.104	C	C	.	.	H	α-helix	trans	-62.3	-37.9	172.8	-71.4	176.5	0	0	0	111.3	L780 A783 L798 D799 N805 R806 F825 I839 L920	L780-L802 HydrophobicContact CD2-CD2 3.81Å; A783-L802 HydrophobicContact CB-CD2 4.37Å; L798-L802 HydrophobicContact CD1-CD1 4.01Å; L798-L802 HydrophobicContact CD1-CD2 4.42Å; L798-L802 HydrophobicContact CD1-CG 3.95Å; L798-L802 HydrophobicContact CG-CD1 3.93Å; L798-L802 HydrophobicContact CG-CG 4.27Å; L798-L802 WeakPolarHBondContact O-CB 3.28Å; L798-L802 VanDerWaalsContact O-CG 3.32Å; L798-L802 WeakPolarHBondContact O-CG 3.45Å; L798-L802 PolarHBondContact O-N 3.47Å; D799-L802 PolarHBondContact O-N 2.73Å; L802-N805 CarbonylContact O-C 3.57Å; L802-N805 WeakPolarHBondContact O-CB 3.31Å; L802-N805 PolarHBondContact O-N 2.94Å; L802-R806 PolarHBondContact O-N 2.67Å; L802-F825 HydrophobicContact CD1-CD2 4.45Å; L802-F825 HydrophobicContact CD1-CE2 3.66Å; L802-F825 HydrophobicContact CD1-CZ 4.25Å; L802-F825 HydrophobicContact CD2-CD2 3.95Å; L802-F825 HydrophobicContact CD2-CE2 3.87Å; L802-F825 HydrophobicContact CG-CE2 4.43Å; L802-I839 HydrophobicContact CD1-CD1 4.42Å; L802-L920 HydrophobicContact CD1-CD2 4.16Å
803	E	98.1	Very high	97.9	Very high	72 Å²	72	24.5 Å²	24.5	34%	0.336	12%	0.12	S	C	.	.	H	α-helix	trans	-71.2	-34.9	177.5	-164.2	55.5	-150.4	0	0	112.3	L722 D799 G800 L801 N805 R806 M807	L722-E803 HydrophobicContact CD1-CG 4.49Å; D799-E803 WeakPolarHBondContact O-CB 3.46Å; D799-E803 PolarHBondContact O-N 3.36Å; G800-E803 PolarHBondContact O-N 2.96Å; L801-E803 VanDerWaalsContact C-N 3.29Å; L801-E803 PolarHBondContact O-N 3.18Å; E803-N805 VanDerWaalsContact C-N 3.32Å; E803-N805 PolarHBondContact O-N 3.27Å; E803-R806 PolarHBondContact O-N 2.7Å; E803-R806 IonicContact OE1-NE 3.54Å; E803-R806 WeakPolarHBondContact OE2-CD 3.29Å; E803-R806 IonicContact OE2-NE 2.76Å; E803-R806 PolarHBondContact OE2-NE 3.23Å; E803-M807 WeakPolarHBondContact O-CB 3.46Å; E803-M807 PolarHBondContact O-N 3.38Å
804	I	98.4	Very high	97.8	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-62.1	-41.8	168.6	-67.8	166.5	0	0	0	110.7	K715 A718 L722 G800 L801 M807 T808 H889 Y898	K715-I804 HydrophobicContact CD-CG2 3.72Å; A718-I804 HydrophobicContact CB-CG2 4.22Å; L722-I804 HydrophobicContact CD1-CG1 3.94Å; G800-I804 WeakPolarHBondContact O-CG1 3.49Å; G800-I804 PolarHBondContact O-N 2.92Å; L801-I804 PolarHBondContact O-N 3.34Å; I804-M807 PolarHBondContact O-N 2.87Å; I804-T808 WeakPolarHBondContact O-CB 3.5Å; I804-T808 PolarHBondContact O-N 3.06Å; I804-T808 PolarHBondContact O-OG1 2.89Å; I804-H889 HydrophobicContact CD1-CB 4.44Å; I804-Y898 HydrophobicContact CD1-CD1 4.44Å; I804-Y898 HydrophobicContact CD1-CD2 4.16Å; I804-Y898 HydrophobicContact CD1-CE1 4.04Å; I804-Y898 HydrophobicContact CD1-CE2 3.75Å; I804-Y898 HydrophobicContact CD1-CG 4.48Å
805	N	98.3	Very high	97.5	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.7	-41.2	175.5	-75	-46.9	0	0	0	111.6	K715 M776 S779 L780 L801 L802 E803 M807 T808 H809 F821	K715-N805 WeakPolarHBondContact CE-OD1 3.2Å; K715-N805 PolarHBondContact NZ-OD1 2.95Å; K715-N805 VanDerWaalsContact NZ-OD1 3.08Å; M776-N805 HydrophobicContact CE-CB 4.42Å; S779-N805 WeakPolarHBondContact CB-OD1 3.34Å; L780-N805 HydrophobicContact CD2-CB 3.87Å; L801-N805 PolarHBondContact O-N 3.43Å; L801-N805 PolarHBondContact O-ND2 2.7Å; L801-N805 VanDerWaalsContact O-ND2 3.08Å; L802-N805 CarbonylContact O-C 3.57Å; L802-N805 WeakPolarHBondContact O-CB 3.31Å; L802-N805 PolarHBondContact O-N 2.94Å; E803-N805 VanDerWaalsContact C-N 3.32Å; E803-N805 PolarHBondContact O-N 3.27Å; N805-M807 VanDerWaalsContact C-N 3.34Å; N805-M807 PolarHBondContact O-N 3.01Å; N805-T808 WeakPolarHBondContact O-CB 3.38Å; N805-T808 PolarHBondContact O-N 2.93Å; N805-H809 PolarHBondContact O-N 3.06Å; N805-F821 HydrophobicContact CB-CE2 4.13Å
806	R	98.1	Very high	97.4	Very high	103 Å²	103	33.2 Å²	33.2	39%	0.389	15%	0.153	S	C	.	.	H	α-helix	trans	-60.2	-43.7	174	-171.2	-170.2	-60	-79.7	-2.2	111.6	L802 E803 T808 H809 K810 F821	L802-R806 PolarHBondContact O-N 2.67Å; E803-R806 PolarHBondContact O-N 2.7Å; E803-R806 IonicContact OE1-NE 3.54Å; E803-R806 WeakPolarHBondContact OE2-CD 3.29Å; E803-R806 IonicContact OE2-NE 2.76Å; E803-R806 PolarHBondContact OE2-NE 3.23Å; R806-T808 VanDerWaalsContact C-N 3.35Å; R806-H809 PolarHBondContact O-N 3.26Å; R806-K810 WeakPolarHBondContact O-CB 3.5Å; R806-K810 PolarHBondContact O-N 3.08Å; R806-F821 VanDerWaalsContact CA-CE2 3.42Å; R806-F821 HydrophobicContact CB-CD1 4.32Å; R806-F821 HydrophobicContact CB-CD2 4.29Å; R806-F821 HydrophobicContact CB-CE1 3.95Å; R806-F821 HydrophobicContact CB-CE2 3.91Å; R806-F821 HydrophobicContact CB-CG 4.47Å; R806-F821 HydrophobicContact CB-CZ 3.72Å; R806-F821 HydrophobicContact CG-CD1 4.08Å; R806-F821 HydrophobicContact CG-CD2 4.5Å; R806-F821 HydrophobicContact CG-CE1 4.14Å; R806-F821 HydrophobicContact CG-CG 4.25Å; R806-F821 HydrophobicContact CG-CZ 4.37Å; R806-F821 VanDerWaalsContact N-CE2 3.35Å; R806-F821 VanDerWaalsContact NH1-CD1 3.31Å
807	M	98.3	Very high	97.3	Very high	40 Å²	40	38.6 Å²	38.6	20%	0.197	19%	0.186	C	C	.	.	H	α-helix	trans	-66.6	-38.1	176.6	-174.1	58.1	-178.2	0	0	111.7	A718 L721 L722 E803 I804 N805 K810 L811	A718-M807 HydrophobicContact CB-CB 4.01Å; A718-M807 HydrophobicContact CB-CG 3.89Å; L721-M807 HydrophobicContact CD1-CE 3.52Å; L722-M807 HydrophobicContact CD1-CB 3.94Å; L722-M807 HydrophobicContact CD1-CG 4.35Å; E803-M807 WeakPolarHBondContact O-CB 3.46Å; E803-M807 PolarHBondContact O-N 3.38Å; I804-M807 PolarHBondContact O-N 2.87Å; N805-M807 VanDerWaalsContact C-N 3.34Å; N805-M807 PolarHBondContact O-N 3.01Å; M807-K810 PolarHBondContact O-N 3.46Å; M807-K810 HydrophobicContact SD-CD 4.26Å; M807-L811 HydrophobicContact CE-CD1 4.3Å; M807-L811 HydrophobicContact CE-CD2 3.95Å; M807-L811 HydrophobicContact CE-CG 4.05Å; M807-L811 HydrophobicContact CG-CD1 4.45Å; M807-L811 VanDerWaalsContact O-CG 3.31Å; M807-L811 WeakPolarHBondContact O-CG 3.39Å; M807-L811 PolarHBondContact O-N 3.46Å
808	T	98.5	Very high	97.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-48	174.5	-54	0	0	0	0	111.1	F711 K715 A718 M776 I804 N805 R806 K810 L811 L812	F711-T808 HydrophobicContact CE2-CG2 4.33Å; K715-T808 HydrophobicContact CB-CG2 4.3Å; K715-T808 HydrophobicContact CD-CG2 4.41Å; K715-T808 VanDerWaalsContact CD-OG1 3.28Å; K715-T808 WeakPolarHBondContact CD-OG1 3.5Å; K715-T808 WeakPolarHBondContact CE-OG1 3.38Å; A718-T808 VanDerWaalsContact CB-OG1 3.28Å; A718-T808 WeakPolarHBondContact CB-OG1 3.36Å; M776-T808 HydrophobicContact SD-CG2 4.01Å; I804-T808 WeakPolarHBondContact O-CB 3.5Å; I804-T808 PolarHBondContact O-N 3.06Å; I804-T808 PolarHBondContact O-OG1 2.89Å; N805-T808 WeakPolarHBondContact O-CB 3.38Å; N805-T808 PolarHBondContact O-N 2.93Å; R806-T808 VanDerWaalsContact C-N 3.35Å; T808-K810 VanDerWaalsContact C-N 3.33Å; T808-K810 PolarHBondContact O-N 2.97Å; T808-L811 PolarHBondContact O-N 2.75Å; T808-L812 HydrophobicContact CG2-CD1 3.76Å; T808-L812 HydrophobicContact CG2-CG 4.46Å; T808-L812 WeakPolarHBondContact O-CB 3.37Å; T808-L812 WeakPolarHBondContact O-CD1 3.45Å; T808-L812 VanDerWaalsContact O-CG 3.31Å; T808-L812 WeakPolarHBondContact O-CG 3.41Å; T808-L812 PolarHBondContact O-N 2.91Å
809	H	98.6	Very high	97.2	Very high	24 Å²	24	42.9 Å²	42.9	11%	0.111	21%	0.209	C	C	.	.	H	α-helix	trans	-55.3	-47.1	174	176	-80.7	0	0	0	111.5	M776 N805 R806 L811 L812 S813 D819 F821	M776-H809 HydrophobicContact CE-CB 3.82Å; M776-H809 HydrophobicContact SD-CB 4.48Å; N805-H809 PolarHBondContact O-N 3.06Å; R806-H809 PolarHBondContact O-N 3.26Å; H809-L811 PolarHBondContact O-N 3.26Å; H809-L812 PolarHBondContact O-N 3.22Å; H809-S813 PolarHBondContact CE1-OG 3.36Å; H809-S813 PolarHBondContact ND1-OG 2.85Å; H809-S813 VanDerWaalsContact O-CB 3.26Å; H809-S813 WeakPolarHBondContact O-CB 3.09Å; H809-S813 PolarHBondContact O-N 3.37Å; H809-S813 PolarHBondContact O-OG 2.65Å; H809-D819 PolarHBondContact NE2-O 3.3Å; H809-F821 HydrophobicContact CB-CD2 3.83Å
810	K	98	Very high	97.1	Very high	129 Å²	129	43.8 Å²	43.8	56%	0.561	23%	0.225	S	C	*	.	H	α-helix	trans	-60.3	-44	178.1	-175.7	-179.2	-66.6	-179.9	0	112.2	R806 M807 T808	R806-K810 WeakPolarHBondContact O-CB 3.5Å; R806-K810 PolarHBondContact O-N 3.08Å; M807-K810 PolarHBondContact O-N 3.46Å; M807-K810 HydrophobicContact SD-CD 4.26Å; T808-K810 VanDerWaalsContact C-N 3.33Å; T808-K810 PolarHBondContact O-N 2.97Å
811	L	97.5	Very high	97.2	Very high	13 Å²	13	44 Å²	44	7%	0.068	22%	0.223	C	C	.	.	H	α-helix	trans	-65.3	-40.4	179.8	-71.1	172.8	0	0	0	112.2	Y714 M717 A718 L721 M807 T808 H809 R814	Y714-L811 HydrophobicContact CD1-CB 3.89Å; Y714-L811 HydrophobicContact CD1-CD1 4.45Å; M717-L811 HydrophobicContact CB-CD1 4.21Å; M717-L811 HydrophobicContact CG-CD1 3.94Å; M717-L811 HydrophobicContact SD-CD1 3.93Å; M717-L811 HydrophobicContact SD-CD2 4.27Å; A718-L811 HydrophobicContact CB-CD1 4.12Å; L721-L811 HydrophobicContact CD1-CD1 4.25Å; M807-L811 HydrophobicContact CE-CD1 4.3Å; M807-L811 HydrophobicContact CE-CD2 3.95Å; M807-L811 HydrophobicContact CE-CG 4.05Å; M807-L811 HydrophobicContact CG-CD1 4.45Å; M807-L811 VanDerWaalsContact O-CG 3.31Å; M807-L811 WeakPolarHBondContact O-CG 3.39Å; M807-L811 PolarHBondContact O-N 3.46Å; T808-L811 PolarHBondContact O-N 2.75Å; H809-L811 PolarHBondContact O-N 3.26Å; L811-R814 PolarHBondContact O-NE 2.88Å
812	L	97.7	Very high	97.1	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-71.9	-39.4	178.5	-70.2	164.8	0	0	0	112.3	I710 F711 Y714 V772 M776 T808 H809 R814 Y815 L816 L818	I710-L812 HydrophobicContact CG2-CD2 4.28Å; F711-L812 HydrophobicContact CD2-CD1 4.18Å; Y714-L812 HydrophobicContact CD2-CD2 3.46Å; Y714-L812 VanDerWaalsContact CD2-CD2 3.46Å; Y714-L812 HydrophobicContact CD2-CG 4.4Å; Y714-L812 HydrophobicContact CE2-CD2 4.23Å; Y714-L812 HydrophobicContact CG-CD2 3.9Å; Y714-L812 HydrophobicContact CG-CG 4.38Å; V772-L812 HydrophobicContact CG1-CD1 3.58Å; V772-L812 HydrophobicContact CG1-CD2 3.98Å; V772-L812 HydrophobicContact CG1-CG 4.27Å; M776-L812 HydrophobicContact CG-CD1 4.33Å; M776-L812 HydrophobicContact SD-CD1 4.18Å; T808-L812 HydrophobicContact CG2-CD1 3.76Å; T808-L812 HydrophobicContact CG2-CG 4.46Å; T808-L812 WeakPolarHBondContact O-CB 3.37Å; T808-L812 WeakPolarHBondContact O-CD1 3.45Å; T808-L812 VanDerWaalsContact O-CG 3.31Å; T808-L812 WeakPolarHBondContact O-CG 3.41Å; T808-L812 PolarHBondContact O-N 2.91Å; H809-L812 PolarHBondContact O-N 3.22Å; L812-R814 PolarHBondContact O-N 3.27Å; L812-Y815 PolarHBondContact O-N 3.26Å; L812-L816 HydrophobicContact CD2-CD1 4.45Å; L812-L816 PolarHBondContact O-N 2.98Å; L812-L818 HydrophobicContact CB-CD1 3.91Å; L812-L818 HydrophobicContact CD1-CD1 4.44Å
813	S	97.3	Very high	97	Very high	49 Å²	49	49.8 Å²	49.8	34%	0.343	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-11.2	-178.6	-61.7	0	0	0	0	113.9	H809 Y815 L816	H809-S813 PolarHBondContact CE1-OG 3.36Å; H809-S813 PolarHBondContact ND1-OG 2.85Å; H809-S813 VanDerWaalsContact O-CB 3.26Å; H809-S813 WeakPolarHBondContact O-CB 3.09Å; H809-S813 PolarHBondContact O-N 3.37Å; H809-S813 PolarHBondContact O-OG 2.65Å; S813-Y815 PolarHBondContact O-N 3.33Å; S813-L816 WeakPolarHBondContact CA-O 3.42Å
814	R	95.6	Very high	97	Very high	139 Å²	139	46.3 Å²	46.3	53%	0.525	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-24.5	171	-64.8	-177.5	-63.4	165.1	2.8	113.1	L811 L812	L811-R814 PolarHBondContact O-NE 2.88Å; L812-R814 PolarHBondContact O-N 3.27Å
815	Y	91.9	Very high	97	Very high	44 Å²	44	47.6 Å²	47.6	17%	0.173	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-24.7	-175.9	-43.1	-82.9	0	0	0	112.7	Y714 E747 L750 N765 L812 S813	Y714-Y815 HydrophobicContact CE1-CE2 4.13Å; Y714-Y815 AromaticContact CZ-CE2 3.77Å; Y714-Y815 WeakPolarHBondContact OH-CE2 3.41Å; E747-Y815 HydrophobicContact CB-CE1 4.11Å; E747-Y815 HydrophobicContact CG-CE1 3.72Å; E747-Y815 PolarHBondContact OE1-OH 2.77Å; L750-Y815 HydrophobicContact CD1-CD2 4.06Å; L750-Y815 HydrophobicContact CD1-CG 4.05Å; N765-Y815 PolarHBondContact ND2-O 3.35Å; L812-Y815 PolarHBondContact O-N 3.26Å; S813-Y815 PolarHBondContact O-N 3.33Å
816	L	94.8	Very high	96.8	Very high	6 Å²	6	52.4 Å²	52.4	3%	0.031	27%	0.268	C	S	.	.	S	Bend	trans	-117.6	148.1	-175.6	-55.3	-177.7	0	0	0	111.2	L750 N765 I768 T769 V772 L812 S813 L818	L750-L816 HydrophobicContact CD2-CD1 4.19Å; L750-L816 HydrophobicContact CD2-CD2 3.54Å; L750-L816 HydrophobicContact CD2-CG 4.07Å; N765-L816 VanDerWaalsContact ND2-CD2 3.3Å; N765-L816 WeakPolarHBondContact ND2-CD2 3.4Å; I768-L816 HydrophobicContact CG2-CD1 4.23Å; T769-L816 WeakPolarHBondContact OG1-CD2 3.44Å; V772-L816 HydrophobicContact CB-CD1 4.01Å; V772-L816 HydrophobicContact CG1-CD1 3.88Å; V772-L816 HydrophobicContact CG2-CD1 4.05Å; L812-L816 HydrophobicContact CD2-CD1 4.45Å; L812-L816 PolarHBondContact O-N 2.98Å; S813-L816 WeakPolarHBondContact CA-O 3.42Å; L816-L818 HydrophobicContact CB-CG 4.39Å; L816-L818 PolarHBondContact O-N 3.49Å
817	T	96.1	Very high	96.8	Very high	127 Å²	127	52.4 Å²	52.4	78%	0.779	27%	0.272	S	S	*	.			trans	-93.1	97.5	171.3	-53.5	0	0	0	0	109.1	T769	T769-T817 WeakPolarHBondContact CG2-O 3.29Å
818	L	96.3	Very high	96.7	Very high	21 Å²	21	50.8 Å²	50.8	11%	0.11	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-98.7	158.6	174.9	-61.2	174.6	0	0	0	110.2	T769 V772 L812 L816 M824	T769-L818 HydrophobicContact CG2-CD2 4.04Å; V772-L818 HydrophobicContact CG1-CD2 4.31Å; L812-L818 HydrophobicContact CB-CD1 3.91Å; L812-L818 HydrophobicContact CD1-CD1 4.44Å; L816-L818 HydrophobicContact CB-CG 4.39Å; L816-L818 PolarHBondContact O-N 3.49Å; L818-M824 HydrophobicContact CB-CE 3.97Å; L818-M824 HydrophobicContact CD2-CE 4.48Å
819	D	96.9	Very high	96.6	Very high	85 Å²	85	51 Å²	51	46%	0.455	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-57.4	151.7	165.5	-52	-53.1	0	0	0	110.2	H809 F821 M824	H809-D819 PolarHBondContact NE2-O 3.3Å; D819-F821 PolarHBondContact O-N 3.44Å; D819-M824 HydrophobicContact CB-CE 3.75Å; D819-M824 HydrophobicContact CB-CG 3.97Å
820	G	96.8	Very high	96.5	Very high	46 Å²	46	55.3 Å²	55.3	47%	0.474	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-56.8	137.3	178.8	0	0	0	0	0	110.7	D822 A823 M824	G820-D822 PolarHBondContact O-N 2.95Å; G820-D822 VanDerWaalsContact O-N 3.13Å; G820-A823 WeakPolarHBondContact O-CA 3.41Å; G820-A823 WeakPolarHBondContact O-CB 3.38Å; G820-A823 PolarHBondContact O-N 3.41Å; G820-M824 PolarHBondContact O-N 3.48Å; G820-M824 VanDerWaalsContact O-N 3.08Å
821	F	98	Very high	96.3	Very high	15 Å²	15	51 Å²	51	7%	0.066	27%	0.269	C	S	.	.	H	α-helix	trans	-53.4	-39.6	-177.2	178.5	-94.8	0	0	0	112.6	M776 L780 N805 R806 H809 D819 A823 M824 F825	M776-F821 HydrophobicContact CE-CD2 4.48Å; M776-F821 HydrophobicContact CE-CE2 4.46Å; L780-F821 HydrophobicContact CD2-CE2 3.97Å; L780-F821 HydrophobicContact CD2-CZ 4.06Å; N805-F821 HydrophobicContact CB-CE2 4.13Å; R806-F821 VanDerWaalsContact CA-CE2 3.42Å; R806-F821 HydrophobicContact CB-CD1 4.32Å; R806-F821 HydrophobicContact CB-CD2 4.29Å; R806-F821 HydrophobicContact CB-CE1 3.95Å; R806-F821 HydrophobicContact CB-CE2 3.91Å; R806-F821 HydrophobicContact CB-CG 4.47Å; R806-F821 HydrophobicContact CB-CZ 3.72Å; R806-F821 HydrophobicContact CG-CD1 4.08Å; R806-F821 HydrophobicContact CG-CD2 4.5Å; R806-F821 HydrophobicContact CG-CE1 4.14Å; R806-F821 HydrophobicContact CG-CG 4.25Å; R806-F821 HydrophobicContact CG-CZ 4.37Å; R806-F821 VanDerWaalsContact N-CE2 3.35Å; R806-F821 VanDerWaalsContact NH1-CD1 3.31Å; H809-F821 HydrophobicContact CB-CD2 3.83Å; D819-F821 PolarHBondContact O-N 3.44Å; F821-A823 VanDerWaalsContact C-N 3.34Å; F821-A823 PolarHBondContact O-N 2.94Å; F821-M824 PolarHBondContact O-N 3.24Å; F821-F825 HydrophobicContact CE1-CB 4.31Å; F821-F825 VanDerWaalsContact O-CB 3.3Å; F821-F825 WeakPolarHBondContact O-CB 3.19Å; F821-F825 PolarHBondContact O-N 3.44Å
822	D	95.6	Very high	96	Very high	81 Å²	81	55.6 Å²	55.6	43%	0.433	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-38	177.7	-170.9	62.9	0	0	0	112.4	G820 F825 R826	G820-D822 PolarHBondContact O-N 2.95Å; G820-D822 VanDerWaalsContact O-N 3.13Å; D822-F825 PolarHBondContact O-N 3.32Å; D822-R826 WeakPolarHBondContact O-CB 3.28Å; D822-R826 VanDerWaalsContact O-CG 3.24Å; D822-R826 WeakPolarHBondContact O-CG 3.21Å; D822-R826 PolarHBondContact O-N 3.12Å; D822-R826 IonicContact OD1-NE 3.52Å; D822-R826 IonicContact OD1-NH2 3.75Å; D822-R826 IonicContact OD2-CZ 3.39Å; D822-R826 IonicContact OD2-NE 3.51Å; D822-R826 PolarHBondContact OD2-NE 2.9Å; D822-R826 IonicContact OD2-NH2 2.72Å
823	A	96.2	Very high	95.7	Very high	49 Å²	49	61.5 Å²	61.5	41%	0.405	34%	0.339	S	S	.	.	H	α-helix	trans	-65.3	-48.4	175.4	0	0	0	0	0	111	G820 F821 F825 R826 E827	G820-A823 WeakPolarHBondContact O-CA 3.41Å; G820-A823 WeakPolarHBondContact O-CB 3.38Å; G820-A823 PolarHBondContact O-N 3.41Å; F821-A823 VanDerWaalsContact C-N 3.34Å; F821-A823 PolarHBondContact O-N 2.94Å; A823-F825 VanDerWaalsContact C-N 3.31Å; A823-F825 PolarHBondContact O-N 3.24Å; A823-R826 PolarHBondContact O-N 3.44Å; A823-E827 WeakPolarHBondContact O-CB 3.15Å; A823-E827 PolarHBondContact O-N 2.86Å
824	M	97.9	Very high	95.2	Very high	0 Å²	0	61 Å²	61	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.2	-42.3	176.4	-64.9	-172.9	163.5	0	0	111.9	S773 M776 Y777 L780 L818 D819 G820 F821 A828	S773-M824 WeakPolarHBondContact OG-CE 3.47Å; M776-M824 HydrophobicContact CB-SD 4.03Å; Y777-M824 HydrophobicContact CD2-CE 4.46Å; Y777-M824 HydrophobicContact CE1-CB 4.07Å; Y777-M824 HydrophobicContact CE1-CG 4.2Å; Y777-M824 HydrophobicContact CE2-CE 3.93Å; Y777-M824 HydrophobicContact CE2-CG 3.98Å; Y777-M824 HydrophobicContact CE2-SD 4.38Å; L780-M824 HydrophobicContact CD1-CB 3.72Å; L818-M824 HydrophobicContact CB-CE 3.97Å; L818-M824 HydrophobicContact CD2-CE 4.48Å; D819-M824 HydrophobicContact CB-CE 3.75Å; D819-M824 HydrophobicContact CB-CG 3.97Å; G820-M824 PolarHBondContact O-N 3.48Å; G820-M824 VanDerWaalsContact O-N 3.08Å; F821-M824 PolarHBondContact O-N 3.24Å; M824-A828 WeakPolarHBondContact O-CB 3.42Å; M824-A828 PolarHBondContact O-N 2.97Å
825	F	97.8	Very high	94.8	Very high	28 Å²	28	58.3 Å²	58.3	12%	0.123	34%	0.339	C	S	.	.	H	α-helix	trans	-65.8	-47.8	178.1	171.4	-109.6	0	0	0	111.9	I784 L802 F821 D822 A823 E827 A828 N829 I839	I784-F825 HydrophobicContact CD1-CE2 4.31Å; L802-F825 HydrophobicContact CD1-CD2 4.45Å; L802-F825 HydrophobicContact CD1-CE2 3.66Å; L802-F825 HydrophobicContact CD1-CZ 4.25Å; L802-F825 HydrophobicContact CD2-CD2 3.95Å; L802-F825 HydrophobicContact CD2-CE2 3.87Å; L802-F825 HydrophobicContact CG-CE2 4.43Å; F821-F825 HydrophobicContact CE1-CB 4.31Å; F821-F825 VanDerWaalsContact O-CB 3.3Å; F821-F825 WeakPolarHBondContact O-CB 3.19Å; F821-F825 PolarHBondContact O-N 3.44Å; D822-F825 PolarHBondContact O-N 3.32Å; A823-F825 VanDerWaalsContact C-N 3.31Å; A823-F825 PolarHBondContact O-N 3.24Å; F825-E827 VanDerWaalsContact C-N 3.29Å; F825-E827 PolarHBondContact O-N 3.31Å; F825-A828 PolarHBondContact O-N 2.88Å; F825-N829 WeakPolarHBondContact O-CB 3.45Å; F825-N829 PolarHBondContact O-N 2.93Å; F825-I839 HydrophobicContact CE2-CD1 3.75Å; F825-I839 HydrophobicContact CZ-CD1 3.64Å
826	R	95.5	Very high	94.9	Very high	100 Å²	100	60.1 Å²	60.1	38%	0.377	35%	0.346	S	S	.	.	H	α-helix	trans	-61.3	-40.8	177.2	-74.6	176.9	-172.8	-84.6	-6.2	111.4	D822 A823 N829 H830 N831 V832	D822-R826 WeakPolarHBondContact O-CB 3.28Å; D822-R826 VanDerWaalsContact O-CG 3.24Å; D822-R826 WeakPolarHBondContact O-CG 3.21Å; D822-R826 PolarHBondContact O-N 3.12Å; D822-R826 IonicContact OD1-NE 3.52Å; D822-R826 IonicContact OD1-NH2 3.75Å; D822-R826 IonicContact OD2-CZ 3.39Å; D822-R826 IonicContact OD2-NE 3.51Å; D822-R826 PolarHBondContact OD2-NE 2.9Å; D822-R826 IonicContact OD2-NH2 2.72Å; A823-R826 PolarHBondContact O-N 3.44Å; R826-N829 CarbonylContact O-C 3.57Å; R826-N829 PolarHBondContact O-N 2.87Å; R826-H830 PolarHBondContact O-N 3.42Å; R826-N831 HydrophobicContact CB-CB 4.48Å; R826-N831 PolarHBondContact O-N 2.95Å; R826-V832 HydrophobicContact CB-CG2 3.72Å
827	E	96.7	Very high	94.9	Very high	104 Å²	104	59.9 Å²	59.9	49%	0.486	34%	0.344	S	S	.	.	H	α-helix	trans	-63.3	-50.6	177.2	-177.9	175.7	175.2	0	0	111.3	Y777 A823 F825 N829 H830 V832	Y777-E827 HydrophobicContact CE1-CB 4.01Å; Y777-E827 VanDerWaalsContact CE1-CD 3.43Å; Y777-E827 HydrophobicContact CE1-CG 3.97Å; Y777-E827 WeakPolarHBondContact CE1-OE2 3.47Å; Y777-E827 PolarHBondContact OH-OE2 3.22Å; A823-E827 WeakPolarHBondContact O-CB 3.15Å; A823-E827 PolarHBondContact O-N 2.86Å; F825-E827 VanDerWaalsContact C-N 3.29Å; F825-E827 PolarHBondContact O-N 3.31Å; E827-N829 VanDerWaalsContact C-N 3.27Å; E827-N829 PolarHBondContact O-N 2.82Å; E827-H830 WeakPolarHBondContact O-CA 3.19Å; E827-H830 PolarHBondContact O-CD2 3.36Å; E827-H830 PolarHBondContact O-N 3.5Å; E827-V832 HydrophobicContact CB-CG2 4.31Å
828	A	96.6	Very high	94.9	Very high	6 Å²	6	55 Å²	55	5%	0.05	31%	0.312	C	S	.	.	H	α-helix	trans	-61.5	-35	175.5	0	0	0	0	0	112.6	L780 I784 M824 F825 H830 R838	L780-A828 HydrophobicContact CB-CB 3.77Å; I784-A828 HydrophobicContact CD1-CB 4.14Å; M824-A828 WeakPolarHBondContact O-CB 3.42Å; M824-A828 PolarHBondContact O-N 2.97Å; F825-A828 PolarHBondContact O-N 2.88Å; A828-H830 PolarHBondContact O-N 3.47Å; A828-R838 WeakPolarHBondContact O-CD 3.43Å; A828-R838 PolarHBondContact O-NH1 3.37Å
829	N	96.9	Very high	95	Very high	3 Å²	3	54 Å²	54	2%	0.016	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	2.4	175.6	-164.3	25.7	0	0	0	113	I784 F825 R826 E827 N831 G837 R838 I839	I784-N829 HydrophobicContact CD1-CB 3.78Å; F825-N829 WeakPolarHBondContact O-CB 3.45Å; F825-N829 PolarHBondContact O-N 2.93Å; R826-N829 CarbonylContact O-C 3.57Å; R826-N829 PolarHBondContact O-N 2.87Å; E827-N829 VanDerWaalsContact C-N 3.27Å; E827-N829 PolarHBondContact O-N 2.82Å; N829-N831 HydrophobicContact CB-CB 4.4Å; N829-N831 PolarHBondContact O-N 2.93Å; N829-G837 CarbonylContact O-C 3.53Å; N829-G837 WeakPolarHBondContact O-CA 3.41Å; N829-R838 PolarHBondContact O-N 3.3Å; N829-R838 WeakPolarHBondContact OD1-CB 3.21Å; N829-R838 PolarHBondContact OD1-N 3.27Å; N829-I839 WeakPolarHBondContact OD1-CG1 3.39Å; N829-I839 PolarHBondContact OD1-N 2.86Å
830	H	96.1	Very high	94.9	Very high	115 Å²	115	50.4 Å²	50.4	53%	0.532	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	32.6	-174.7	-62	-178.4	0	0	0	113.9	R826 E827 A828 A834 R838	R826-H830 PolarHBondContact O-N 3.42Å; E827-H830 WeakPolarHBondContact O-CA 3.19Å; E827-H830 PolarHBondContact O-CD2 3.36Å; E827-H830 PolarHBondContact O-N 3.5Å; A828-H830 PolarHBondContact O-N 3.47Å; H830-A834 WeakPolarHBondContact O-CB 3.47Å; H830-R838 HydrophobicContact CB-CG 4.22Å
831	N	94.5	Very high	94.9	Very high	38 Å²	38	53 Å²	53	20%	0.203	29%	0.29	C	S	.	.			trans	-109.5	34.1	-174.7	-162	35.8	0	0	0	113	R826 N829 A834 G837	R826-N831 HydrophobicContact CB-CB 4.48Å; R826-N831 PolarHBondContact O-N 2.95Å; N829-N831 HydrophobicContact CB-CB 4.4Å; N829-N831 PolarHBondContact O-N 2.93Å; N831-A834 PolarHBondContact OD1-O 2.98Å; N831-G837 PolarHBondContact OD1-N 3.22Å
832	V	91.8	Very high	94.9	Very high	110 Å²	110	53.1 Å²	53.1	67%	0.667	29%	0.291	S	S	*	.	S	Bend	trans	-106.7	-54.2	174.7	178.6	0	0	0	0	110.2	R826 E827	R826-V832 HydrophobicContact CB-CG2 3.72Å; E827-V832 HydrophobicContact CB-CG2 4.31Å
833	S	89.8	Confident	95	Very high	126 Å²	126	49.3 Å²	49.3	88%	0.881	27%	0.27	S	S	*	.	S	Bend	trans	-95.8	-1.9	177.7	59	0	0	0	0	113.7
834	A	87.9	Confident	95	Very high	39 Å²	39	49.5 Å²	49.5	32%	0.322	26%	0.262	S	S	.	.	S	Bend	trans	-122.7	149.9	177.5	0	0	0	0	0	110.3	H830 N831 Y836	H830-A834 WeakPolarHBondContact O-CB 3.47Å; N831-A834 PolarHBondContact OD1-O 2.98Å; A834-Y836 VanDerWaalsContact C-N 3.33Å
835	P	87.7	Confident	94.9	Very high	81 Å²	81	54.6 Å²	54.6	53%	0.526	28%	0.282	S	S	.	.	S	Bend	trans	-75.5	-19.5	-178.4	29.3	-35	0	0	0	113.7	Q924	P835-Q924 PolarHBondContact O-NE2 3.47Å
836	Y	92.7	Very high	94.9	Very high	83 Å²	83	53.4 Å²	53.4	33%	0.325	28%	0.276	S	S	.	.	S	Bend	trans	-132.9	128.9	-179	-49.4	-67.6	0	0	0	109.4	A834 Q924 V928	A834-Y836 VanDerWaalsContact C-N 3.33Å; Y836-Q924 HydrophobicContact CD1-CG 4.25Å; Y836-Q924 HydrophobicContact CE1-CG 3.69Å; Y836-V928 HydrophobicContact CD1-CB 4.33Å; Y836-V928 HydrophobicContact CD1-CG1 3.68Å; Y836-V928 HydrophobicContact CE1-CB 3.6Å; Y836-V928 HydrophobicContact CE1-CG1 3.42Å; Y836-V928 VanDerWaalsContact CE1-CG1 3.42Å; Y836-V928 HydrophobicContact CE1-CG2 4.07Å; Y836-V928 HydrophobicContact CE2-CB 4.48Å; Y836-V928 HydrophobicContact CE2-CG2 4.06Å; Y836-V928 HydrophobicContact CG-CG1 4.39Å
837	G	94.4	Very high	94.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.258	C	S	.	.			trans	-78.8	166.9	178	0	0	0	0	0	113.2	N829 N831 I839 T840 L841	N829-G837 CarbonylContact O-C 3.53Å; N829-G837 WeakPolarHBondContact O-CA 3.41Å; N831-G837 PolarHBondContact OD1-N 3.22Å; G837-I839 VanDerWaalsContact C-N 3.29Å; G837-I839 PolarHBondContact O-N 3.41Å; G837-T840 WeakPolarHBondContact O-CB 3.45Å; G837-T840 PolarHBondContact O-N 2.87Å; G837-T840 VanDerWaalsContact O-N 3.1Å; G837-L841 WeakPolarHBondContact O-CG 3.39Å; G837-L841 PolarHBondContact O-N 2.99Å; G837-L841 VanDerWaalsContact O-N 3.09Å
838	R	96.7	Very high	94.8	Very high	25 Å²	25	46.1 Å²	46.1	9%	0.094	25%	0.248	C	C	.	.	H	α-helix	trans	-50.9	-43.6	176.3	-72.7	166.9	64	-175.7	9.9	113.5	E781 I784 E788 A828 N829 H830 T840 L841 H842	E781-R838 IonicContact OE1-CZ 3.59Å; E781-R838 VanDerWaalsContact OE1-CZ 3.28Å; E781-R838 IonicContact OE1-NH1 2.7Å; E781-R838 PolarHBondContact OE1-NH1 3.01Å; E781-R838 IonicContact OE1-NH2 2.72Å; E781-R838 PolarHBondContact OE1-NH2 3.32Å; E781-R838 IonicContact OE2-CZ 2.95Å; E781-R838 IonicContact OE2-NH1 3.18Å; E781-R838 PolarHBondContact OE2-NH1 3.27Å; I784-R838 HydrophobicContact CG2-CB 3.87Å; E788-R838 WeakPolarHBondContact OE1-CB 3.48Å; E788-R838 IonicContact OE1-CZ 3.94Å; E788-R838 IonicContact OE1-NE 2.75Å; E788-R838 PolarHBondContact OE1-NE 3.34Å; E788-R838 IonicContact OE1-NH2 3.65Å; E788-R838 IonicContact OE2-CZ 3.05Å; E788-R838 IonicContact OE2-NE 2.62Å; E788-R838 PolarHBondContact OE2-NE 3.09Å; E788-R838 IonicContact OE2-NH2 2.99Å; E788-R838 PolarHBondContact OE2-NH2 3.02Å; A828-R838 WeakPolarHBondContact O-CD 3.43Å; A828-R838 PolarHBondContact O-NH1 3.37Å; N829-R838 PolarHBondContact O-N 3.3Å; N829-R838 WeakPolarHBondContact OD1-CB 3.21Å; N829-R838 PolarHBondContact OD1-N 3.27Å; H830-R838 HydrophobicContact CB-CG 4.22Å; R838-T840 PolarHBondContact O-N 2.83Å; R838-L841 PolarHBondContact O-N 3.42Å; R838-H842 WeakPolarHBondContact O-CB 3.45Å; R838-H842 PolarHBondContact O-N 3.41Å
839	I	97.8	Very high	94.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.9	-46.8	178.4	-63.4	165.6	0	0	0	110.9	I784 F787 L798 L802 F825 N829 G837 L841 H842 V843 L920	I784-I839 HydrophobicContact CD1-CD1 4.4Å; I784-I839 HydrophobicContact CG1-CD1 4.23Å; I784-I839 HydrophobicContact CG1-CG1 4.35Å; I784-I839 HydrophobicContact CG2-CG1 4.22Å; F787-I839 HydrophobicContact CD1-CG2 4.42Å; F787-I839 HydrophobicContact CE1-CG2 4.01Å; L798-I839 HydrophobicContact CD2-CD1 3.94Å; L798-I839 HydrophobicContact CD2-CG1 3.98Å; L798-I839 HydrophobicContact CD2-CG2 4.25Å; L802-I839 HydrophobicContact CD1-CD1 4.42Å; F825-I839 HydrophobicContact CE2-CD1 3.75Å; F825-I839 HydrophobicContact CZ-CD1 3.64Å; N829-I839 WeakPolarHBondContact OD1-CG1 3.39Å; N829-I839 PolarHBondContact OD1-N 2.86Å; G837-I839 VanDerWaalsContact C-N 3.29Å; G837-I839 PolarHBondContact O-N 3.41Å; I839-L841 PolarHBondContact O-N 3.16Å; I839-H842 PolarHBondContact O-N 3.21Å; I839-V843 HydrophobicContact CG2-CG2 4.42Å; I839-V843 WeakPolarHBondContact O-CG2 3.47Å; I839-V843 PolarHBondContact O-N 3.3Å; I839-L920 HydrophobicContact CG2-CB 4.26Å; I839-L920 HydrophobicContact CG2-CD1 4.23Å
840	T	96.6	Very high	94.7	Very high	9 Å²	9	51 Å²	51	6%	0.055	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-43.5	179.3	-57.4	0	0	0	0	111.4	G837 R838 V843 F844 L921 V928	G837-T840 WeakPolarHBondContact O-CB 3.45Å; G837-T840 PolarHBondContact O-N 2.87Å; G837-T840 VanDerWaalsContact O-N 3.1Å; R838-T840 PolarHBondContact O-N 2.83Å; T840-V843 PolarHBondContact O-N 2.89Å; T840-F844 PolarHBondContact O-N 2.92Å; T840-F844 VanDerWaalsContact O-N 3.12Å; T840-L921 HydrophobicContact CG2-CG 4.12Å; T840-V928 HydrophobicContact CG2-CG1 4.15Å
841	L	95.4	Very high	94.7	Very high	101 Å²	101	45.6 Å²	45.6	53%	0.529	24%	0.241	S	C	.	.	H	α-helix	trans	-64.4	-42.9	178.2	-63.7	173.2	0	0	0	111.5	G837 R838 I839 F844 W845	G837-L841 WeakPolarHBondContact O-CG 3.39Å; G837-L841 PolarHBondContact O-N 2.99Å; G837-L841 VanDerWaalsContact O-N 3.09Å; R838-L841 PolarHBondContact O-N 3.42Å; I839-L841 PolarHBondContact O-N 3.16Å; L841-F844 PolarHBondContact O-N 2.94Å; L841-W845 WeakPolarHBondContact O-CB 3.27Å; L841-W845 PolarHBondContact O-N 3.4Å
842	H	97.6	Very high	94.8	Very high	18 Å²	18	43.8 Å²	43.8	8%	0.083	23%	0.232	C	C	.	.	H	α-helix	trans	-68	-37.5	177.4	-166.6	58.9	0	0	0	112.4	F787 E788 E790 R838 I839 F844 W845 E846	F787-H842 HydrophobicContact CD1-CB 4.31Å; F787-H842 AromaticContact CD1-CD2 3.66Å; F787-H842 HydrophobicContact CE1-CB 3.98Å; F787-H842 AromaticContact CE1-CD2 3.5Å; F787-H842 VanDerWaalsContact CE1-CD2 3.5Å; F787-H842 WeakPolarHBondContact CE1-CD2 3.48Å; F787-H842 AromaticContact CZ-CD2 3.74Å; F787-H842 PolarHBondContact O-CD2 3.07Å; F787-H842 VanDerWaalsContact O-CD2 3.28Å; F787-H842 PolarHBondContact O-NE2 3.13Å; E788-H842 WeakPolarHBondContact CA-NE2 3.45Å; E788-H842 HydrophobicContact CG-CB 4.36Å; E788-H842 PolarHBondContact O-CE1 3.33Å; E790-H842 PolarHBondContact O-NE2 3.28Å; R838-H842 WeakPolarHBondContact O-CB 3.45Å; R838-H842 PolarHBondContact O-N 3.41Å; I839-H842 PolarHBondContact O-N 3.21Å; H842-F844 VanDerWaalsContact C-N 3.34Å; H842-F844 PolarHBondContact O-N 2.98Å; H842-W845 WeakPolarHBondContact O-CB 3.42Å; H842-W845 PolarHBondContact O-N 2.74Å; H842-E846 IonicContact CE1-OE1 3.6Å; H842-E846 PolarHBondContact CE1-OE1 2.67Å; H842-E846 WeakPolarHBondContact NE2-CG 3.31Å; H842-E846 IonicContact NE2-OE1 2.7Å; H842-E846 WeakPolarHBondContact O-CB 3.21Å; H842-E846 WeakPolarHBondContact O-CG 3.32Å; H842-E846 PolarHBondContact O-N 3.34Å
843	V	97.8	Very high	95.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.8	-48.5	172.4	169.8	0	0	0	0	110.5	F787 L792 I795 I839 T840 W845 E846 L847 I917 L921	F787-V843 HydrophobicContact CE1-CG2 4.14Å; F787-V843 HydrophobicContact CZ-CG2 4Å; L792-V843 HydrophobicContact CD1-CB 4.41Å; L792-V843 HydrophobicContact CD1-CG1 4.05Å; L792-V843 HydrophobicContact CD1-CG2 4.15Å; I795-V843 HydrophobicContact CD1-CG2 3.85Å; I839-V843 HydrophobicContact CG2-CG2 4.42Å; I839-V843 WeakPolarHBondContact O-CG2 3.47Å; I839-V843 PolarHBondContact O-N 3.3Å; T840-V843 PolarHBondContact O-N 2.89Å; V843-W845 VanDerWaalsContact C-N 3.35Å; V843-W845 PolarHBondContact O-N 2.9Å; V843-E846 PolarHBondContact O-N 3.12Å; V843-L847 HydrophobicContact CG1-CD1 4.01Å; V843-L847 HydrophobicContact CG1-CG 4.35Å; V843-L847 WeakPolarHBondContact O-CB 3.2Å; V843-L847 WeakPolarHBondContact O-CG 3.45Å; V843-L847 PolarHBondContact O-N 3.35Å; V843-I917 HydrophobicContact CG1-CG2 4.21Å; V843-L921 HydrophobicContact CB-CD1 4.35Å; V843-L921 HydrophobicContact CG1-CD2 4.24Å; V843-L921 HydrophobicContact CG2-CD1 3.92Å
844	F	96.5	Very high	95.4	Very high	54 Å²	54	32.8 Å²	32.8	24%	0.237	16%	0.159	C	C	.	.	H	α-helix	trans	-63.5	-40.9	177.3	175.8	-108.5	0	0	0	112.4	T840 L841 H842 L847 N848 V929 E932	T840-F844 PolarHBondContact O-N 2.92Å; T840-F844 VanDerWaalsContact O-N 3.12Å; L841-F844 PolarHBondContact O-N 2.94Å; H842-F844 VanDerWaalsContact C-N 3.34Å; H842-F844 PolarHBondContact O-N 2.98Å; F844-L847 WeakPolarHBondContact O-CB 3.47Å; F844-L847 PolarHBondContact O-N 2.82Å; F844-N848 WeakPolarHBondContact O-CB 3.28Å; F844-N848 PolarHBondContact O-N 3.06Å; F844-V929 HydrophobicContact CB-CG2 4.37Å; F844-E932 HydrophobicContact CD2-CB 3.9Å; F844-E932 HydrophobicContact CE1-CB 4.37Å; F844-E932 HydrophobicContact CE1-CG 4.48Å; F844-E932 HydrophobicContact CE2-CB 3.27Å; F844-E932 HydrophobicContact CE2-CG 4.16Å; F844-E932 HydrophobicContact CZ-CB 3.55Å; F844-E932 HydrophobicContact CZ-CG 4.11Å
845	W	96.3	Very high	95.9	Very high	107 Å²	107	31 Å²	31	41%	0.405	14%	0.144	S	C	.	.	H	α-helix	trans	-56.2	-52.9	175.4	-176.9	-86.1	0	0	0	111.6	L841 H842 V843 L847 N848 Y849 F875	L841-W845 WeakPolarHBondContact O-CB 3.27Å; L841-W845 PolarHBondContact O-N 3.4Å; H842-W845 WeakPolarHBondContact O-CB 3.42Å; H842-W845 PolarHBondContact O-N 2.74Å; V843-W845 VanDerWaalsContact C-N 3.35Å; V843-W845 PolarHBondContact O-N 2.9Å; W845-L847 VanDerWaalsContact C-N 3.29Å; W845-L847 PolarHBondContact O-N 2.59Å; W845-N848 PolarHBondContact O-N 3.34Å; W845-Y849 AromaticContact CD1-CD2 3.99Å; W845-Y849 AromaticContact CD2-CD2 3.66Å; W845-Y849 HydrophobicContact CD2-CD2 3.66Å; W845-Y849 AromaticContact CD2-CE2 3.66Å; W845-Y849 HydrophobicContact CD2-CE2 3.66Å; W845-Y849 AromaticContact CE2-CD2 3.54Å; W845-Y849 AromaticContact CE2-CE2 3.64Å; W845-Y849 HydrophobicContact CE3-CD2 4.2Å; W845-Y849 AromaticContact CE3-CE2 3.71Å; W845-Y849 HydrophobicContact CE3-CE2 3.71Å; W845-Y849 AromaticContact CG-CD2 3.95Å; W845-Y849 HydrophobicContact CG-CD2 3.95Å; W845-Y849 HydrophobicContact CG-CE2 4.37Å; W845-Y849 HydrophobicContact CH2-CD2 4.46Å; W845-Y849 AromaticContact CH2-CE2 3.74Å; W845-Y849 HydrophobicContact CH2-CE2 3.74Å; W845-Y849 AromaticContact CZ2-CD2 3.97Å; W845-Y849 HydrophobicContact CZ2-CD2 3.97Å; W845-Y849 AromaticContact CZ2-CE2 3.69Å; W845-Y849 HydrophobicContact CZ2-CE2 3.69Å; W845-Y849 AromaticContact CZ3-CE2 3.75Å; W845-Y849 HydrophobicContact CZ3-CE2 3.75Å; W845-Y849 AromaticContact NE1-CD2 3.72Å; W845-Y849 VanDerWaalsContact O-CD2 3.29Å; W845-Y849 WeakPolarHBondContact O-CD2 3.5Å; W845-Y849 PolarHBondContact O-N 3.01Å; W845-F875 HydrophobicContact CZ2-CE1 4.48Å; W845-F875 HydrophobicContact CZ2-CZ 4.16Å
846	E	97	Very high	96.4	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.009	12%	0.121	C	C	.	.	H	α-helix	trans	-66.8	-31.1	178.6	-69.3	-63.6	137.6	0	0	112.3	D791 L792 H842 V843 D850 F851 R877	D791-E846 WeakPolarHBondContact CA-OE2 3.3Å; L792-E846 HydrophobicContact CB-CB 4.11Å; H842-E846 IonicContact CE1-OE1 3.6Å; H842-E846 PolarHBondContact CE1-OE1 2.67Å; H842-E846 WeakPolarHBondContact NE2-CG 3.31Å; H842-E846 IonicContact NE2-OE1 2.7Å; H842-E846 WeakPolarHBondContact O-CB 3.21Å; H842-E846 WeakPolarHBondContact O-CG 3.32Å; H842-E846 PolarHBondContact O-N 3.34Å; V843-E846 PolarHBondContact O-N 3.12Å; E846-D850 WeakPolarHBondContact O-CA 3.33Å; E846-D850 WeakPolarHBondContact O-CB 3.41Å; E846-D850 PolarHBondContact O-N 2.76Å; E846-F851 PolarHBondContact O-N 3.3Å; E846-R877 IonicContact OE1-CZ 3.7Å; E846-R877 IonicContact OE1-NE 2.69Å; E846-R877 PolarHBondContact OE1-NE 3.03Å; E846-R877 VanDerWaalsContact OE1-NE 3.11Å; E846-R877 IonicContact OE1-NH2 3.79Å; E846-R877 IonicContact OE2-CZ 2.74Å; E846-R877 IonicContact OE2-NE 2.82Å; E846-R877 IonicContact OE2-NH2 3.42Å; E846-R877 PolarHBondContact OE2-NH2 2.99Å
847	L	96.5	Very high	96.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.109	C	C	.	.	I	π-helix	trans	-61.2	-51.8	171.6	-74.8	172.9	0	0	0	110.8	L792 V843 F844 W845 F851 L852 V929 F1006	L792-L847 HydrophobicContact CD2-CD2 3.82Å; L792-L847 HydrophobicContact CD2-CG 4.46Å; V843-L847 HydrophobicContact CG1-CD1 4.01Å; V843-L847 HydrophobicContact CG1-CG 4.35Å; V843-L847 WeakPolarHBondContact O-CB 3.2Å; V843-L847 WeakPolarHBondContact O-CG 3.45Å; V843-L847 PolarHBondContact O-N 3.35Å; F844-L847 WeakPolarHBondContact O-CB 3.47Å; F844-L847 PolarHBondContact O-N 2.82Å; W845-L847 VanDerWaalsContact C-N 3.29Å; W845-L847 PolarHBondContact O-N 2.59Å; L847-F851 HydrophobicContact CD2-CB 3.78Å; L847-F851 HydrophobicContact CD2-CD1 3.47Å; L847-F851 VanDerWaalsContact CD2-CD1 3.47Å; L847-F851 HydrophobicContact CD2-CE1 4.2Å; L847-F851 HydrophobicContact CD2-CG 3.71Å; L847-L852 WeakPolarHBondContact O-CB 3.48Å; L847-L852 WeakPolarHBondContact O-CG 3.42Å; L847-L852 PolarHBondContact O-N 2.95Å; L847-V929 HydrophobicContact CD1-CG1 3.6Å; L847-F1006 HydrophobicContact CD1-CD1 4.41Å; L847-F1006 HydrophobicContact CD1-CD2 4.3Å; L847-F1006 HydrophobicContact CD1-CE1 3.93Å; L847-F1006 HydrophobicContact CD1-CE2 3.83Å; L847-F1006 HydrophobicContact CD1-CZ 3.62Å; L847-F1006 HydrophobicContact CD2-CD2 3.57Å; L847-F1006 HydrophobicContact CD2-CE2 3.52Å; L847-F1006 HydrophobicContact CD2-CG 4.33Å; L847-F1006 HydrophobicContact CD2-CZ 4.22Å; L847-F1006 HydrophobicContact CG-CE2 4.28Å
848	N	94.5	Very high	96.7	Very high	51 Å²	51	27.7 Å²	27.7	27%	0.273	13%	0.127	S	C	.	.	I	π-helix	trans	-67	-42.6	-175.9	-173.9	70	0	0	0	113.1	F844 W845	F844-N848 WeakPolarHBondContact O-CB 3.28Å; F844-N848 PolarHBondContact O-N 3.06Å; W845-N848 PolarHBondContact O-N 3.34Å
849	Y	93.7	Very high	96.6	Very high	106 Å²	106	28 Å²	28	42%	0.416	14%	0.138	S	C	.	.	I	π-helix	trans	-96.4	-20.9	-171.6	-70.6	-71.4	0	0	0	115.1	W845 P853	W845-Y849 AromaticContact CD1-CD2 3.99Å; W845-Y849 AromaticContact CD2-CD2 3.66Å; W845-Y849 HydrophobicContact CD2-CD2 3.66Å; W845-Y849 AromaticContact CD2-CE2 3.66Å; W845-Y849 HydrophobicContact CD2-CE2 3.66Å; W845-Y849 AromaticContact CE2-CD2 3.54Å; W845-Y849 AromaticContact CE2-CE2 3.64Å; W845-Y849 HydrophobicContact CE3-CD2 4.2Å; W845-Y849 AromaticContact CE3-CE2 3.71Å; W845-Y849 HydrophobicContact CE3-CE2 3.71Å; W845-Y849 AromaticContact CG-CD2 3.95Å; W845-Y849 HydrophobicContact CG-CD2 3.95Å; W845-Y849 HydrophobicContact CG-CE2 4.37Å; W845-Y849 HydrophobicContact CH2-CD2 4.46Å; W845-Y849 AromaticContact CH2-CE2 3.74Å; W845-Y849 HydrophobicContact CH2-CE2 3.74Å; W845-Y849 AromaticContact CZ2-CD2 3.97Å; W845-Y849 HydrophobicContact CZ2-CD2 3.97Å; W845-Y849 AromaticContact CZ2-CE2 3.69Å; W845-Y849 HydrophobicContact CZ2-CE2 3.69Å; W845-Y849 AromaticContact CZ3-CE2 3.75Å; W845-Y849 HydrophobicContact CZ3-CE2 3.75Å; W845-Y849 AromaticContact NE1-CD2 3.72Å; W845-Y849 VanDerWaalsContact O-CD2 3.29Å; W845-Y849 WeakPolarHBondContact O-CD2 3.5Å; W845-Y849 PolarHBondContact O-N 3.01Å; Y849-P853 WeakPolarHBondContact O-CG 3.38Å
850	D	96.8	Very high	96.3	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.032	18%	0.178	C	C	.	.	I	π-helix	trans	-126.5	-55.9	-177.1	-166.3	13.5	0	0	0	112.7	E846 P853 N854 R866 R877	E846-D850 WeakPolarHBondContact O-CA 3.33Å; E846-D850 WeakPolarHBondContact O-CB 3.41Å; E846-D850 PolarHBondContact O-N 2.76Å; D850-P853 WeakPolarHBondContact O-CD 3.45Å; D850-N854 WeakPolarHBondContact O-CA 3.44Å; D850-N854 WeakPolarHBondContact O-CB 3.47Å; D850-N854 PolarHBondContact O-N 3.14Å; D850-N854 PolarHBondContact OD1-ND2 3.25Å; D850-R866 IonicContact OD1-CZ 2.87Å; D850-R866 IonicContact OD1-NH1 2.89Å; D850-R866 PolarHBondContact OD1-NH1 2.95Å; D850-R866 IonicContact OD1-NH2 3.93Å; D850-R866 IonicContact OD2-CZ 3.49Å; D850-R866 IonicContact OD2-NH1 3.64Å; D850-R866 PolarHBondContact OD2-NH1 2.98Å; D850-R866 IonicContact OD2-NH2 3.74Å; D850-R866 PolarHBondContact OD2-NH2 3.03Å; D850-R877 IonicContact OD2-NH2 2.69Å; D850-R877 PolarHBondContact OD2-NH2 3.39Å
851	F	97.7	Very high	96.2	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	20%	0.199	C	C	.	.	I	π-helix	trans	-61.6	-55.6	-172.5	-177.9	-102.5	0	0	0	113	L792 E846 L847 Y855 F864 V909 F914 N1002 F1006	L792-F851 HydrophobicContact CD2-CB 4.4Å; L792-F851 HydrophobicContact CD2-CD2 4.23Å; L792-F851 HydrophobicContact CD2-CG 4.4Å; E846-F851 PolarHBondContact O-N 3.3Å; L847-F851 HydrophobicContact CD2-CB 3.78Å; L847-F851 HydrophobicContact CD2-CD1 3.47Å; L847-F851 VanDerWaalsContact CD2-CD1 3.47Å; L847-F851 HydrophobicContact CD2-CE1 4.2Å; L847-F851 HydrophobicContact CD2-CG 3.71Å; F851-Y855 HydrophobicContact CB-CD2 4.44Å; F851-Y855 HydrophobicContact CD2-CD1 4.36Å; F851-Y855 HydrophobicContact CD2-CD2 4.09Å; F851-Y855 AromaticContact CD2-CG 3.98Å; F851-Y855 HydrophobicContact CD2-CG 3.98Å; F851-Y855 HydrophobicContact CE2-CG 4.39Å; F851-Y855 VanDerWaalsContact O-CB 3.31Å; F851-Y855 WeakPolarHBondContact O-CB 3.5Å; F851-Y855 PolarHBondContact O-N 3.17Å; F851-F864 HydrophobicContact CE1-CE1 4.27Å; F851-F864 HydrophobicContact CE1-CZ 4.4Å; F851-F864 HydrophobicContact CE2-CB 4.14Å; F851-F864 AromaticContact CE2-CD1 3.97Å; F851-F864 HydrophobicContact CE2-CD1 3.97Å; F851-F864 AromaticContact CE2-CD2 3.99Å; F851-F864 HydrophobicContact CE2-CD2 3.99Å; F851-F864 HydrophobicContact CE2-CE1 4.33Å; F851-F864 HydrophobicContact CE2-CE2 4.38Å; F851-F864 AromaticContact CE2-CG 3.78Å; F851-F864 HydrophobicContact CE2-CG 3.78Å; F851-F864 AromaticContact CZ-CD1 3.72Å; F851-F864 HydrophobicContact CZ-CD1 3.72Å; F851-F864 AromaticContact CZ-CD2 3.85Å; F851-F864 HydrophobicContact CZ-CD2 3.85Å; F851-F864 AromaticContact CZ-CE1 3.62Å; F851-F864 HydrophobicContact CZ-CE1 3.62Å; F851-F864 AromaticContact CZ-CE2 3.77Å; F851-F864 HydrophobicContact CZ-CE2 3.77Å; F851-F864 AromaticContact CZ-CG 3.84Å; F851-F864 HydrophobicContact CZ-CG 3.84Å; F851-F864 AromaticContact CZ-CZ 3.66Å; F851-F864 HydrophobicContact CZ-CZ 3.66Å; F851-V909 HydrophobicContact CD2-CG2 4.3Å; F851-V909 HydrophobicContact CE2-CB 4.03Å; F851-V909 HydrophobicContact CE2-CG1 3.89Å; F851-V909 HydrophobicContact CE2-CG2 4.26Å; F851-F914 HydrophobicContact CZ-CZ 4.45Å; F851-N1002 HydrophobicContact CE1-CB 4.42Å; F851-F1006 HydrophobicContact CE1-CB 4.23Å; F851-F1006 HydrophobicContact CE1-CD2 4.05Å; F851-F1006 HydrophobicContact CZ-CD2 4.47Å
852	L	96.4	Very high	96.2	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-58.6	-51	-178.2	-63.9	179.5	0	0	0	112	L847 L933 V936 E999 N1002 A1003	L847-L852 WeakPolarHBondContact O-CB 3.48Å; L847-L852 WeakPolarHBondContact O-CG 3.42Å; L847-L852 PolarHBondContact O-N 2.95Å; L852-L933 HydrophobicContact CD1-CD2 3.83Å; L852-L933 HydrophobicContact CD2-CD2 4.44Å; L852-V936 HydrophobicContact CD1-CG1 4.19Å; L852-E999 HydrophobicContact CB-CB 4.33Å; L852-E999 HydrophobicContact CB-CG 4.18Å; L852-E999 WeakPolarHBondContact O-CG 3.18Å; L852-N1002 HydrophobicContact CD2-CB 3.79Å; L852-N1002 PolarHBondContact O-ND2 3.14Å; L852-A1003 HydrophobicContact CD1-CB 4.48Å; L852-A1003 HydrophobicContact CD2-CB 3.77Å; L852-A1003 VanDerWaalsContact CD2-N 3.29Å
853	P	96.7	Very high	96.1	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-76.4	-36.4	-176.4	27.5	-35.4	0	0	0	114	Y849 D850 Q995 R998 E999	Y849-P853 WeakPolarHBondContact O-CG 3.38Å; D850-P853 WeakPolarHBondContact O-CD 3.45Å; P853-Q995 VanDerWaalsContact CA-NE2 3.29Å; P853-Q995 PolarHBondContact O-NE2 3.3Å; P853-R998 PolarHBondContact O-NE 3.17Å; P853-E999 HydrophobicContact CB-CG 4.31Å
854	N	97	Very high	96.2	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-102.4	-6.5	-165.3	-60.6	-36.7	0	0	0	114.6	D850 R866 T867 F871 Q873	D850-N854 WeakPolarHBondContact O-CA 3.44Å; D850-N854 WeakPolarHBondContact O-CB 3.47Å; D850-N854 PolarHBondContact O-N 3.14Å; D850-N854 PolarHBondContact OD1-ND2 3.25Å; N854-R866 CarbonylContact O-C 3.54Å; N854-R866 WeakPolarHBondContact O-CA 3.31Å; N854-T867 HydrophobicContact CB-CG2 4.41Å; N854-T867 WeakPolarHBondContact O-CB 3.39Å; N854-T867 WeakPolarHBondContact O-CG2 3.38Å; N854-T867 PolarHBondContact O-N 3.1Å; N854-F871 PolarHBondContact OD1-O 3.26Å; N854-Q873 PolarHBondContact ND2-O 2.86Å; N854-Q873 PolarHBondContact OD1-N 3.44Å
855	Y	97.8	Very high	96.2	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	149.9	-175.7	-75.1	-107.2	0	0	0	114.3	T793 F851 F864 V865 R866 V909 R998 N1002	T793-Y855 WeakPolarHBondContact CG2-OH 3.19Å; F851-Y855 HydrophobicContact CB-CD2 4.44Å; F851-Y855 HydrophobicContact CD2-CD1 4.36Å; F851-Y855 HydrophobicContact CD2-CD2 4.09Å; F851-Y855 AromaticContact CD2-CG 3.98Å; F851-Y855 HydrophobicContact CD2-CG 3.98Å; F851-Y855 HydrophobicContact CE2-CG 4.39Å; F851-Y855 VanDerWaalsContact O-CB 3.31Å; F851-Y855 WeakPolarHBondContact O-CB 3.5Å; F851-Y855 PolarHBondContact O-N 3.17Å; Y855-F864 HydrophobicContact CD1-CB 3.76Å; Y855-F864 HydrophobicContact CG-CB 4.36Å; Y855-V865 CarbonylContact C-O 3.33Å; Y855-V865 WeakPolarHBondContact CA-O 3.07Å; Y855-R866 HydrophobicContact CE1-CG 4.16Å; Y855-R866 HydrophobicContact CE2-CG 4.29Å; Y855-R866 PolarHBondContact OH-NH2 3.41Å; Y855-V909 HydrophobicContact CD1-CG2 4.28Å; Y855-V909 HydrophobicContact CE1-CB 4.47Å; Y855-V909 HydrophobicContact CE1-CG2 3.67Å; Y855-R998 PolarHBondContact O-NH1 3.16Å; Y855-N1002 PolarHBondContact O-ND2 2.95Å
856	C	97.7	Very high	96.2	Very high	5 Å²	5	39 Å²	39	3%	0.034	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	114.9	-178.1	-54.3	0	0	0	0	108.5	F864 V865 R998 C1152	C856-F864 CarbonylContact O-C 3.47Å; C856-F864 VanDerWaalsContact O-CA 3.25Å; C856-F864 WeakPolarHBondContact O-CA 3.5Å; C856-V865 HydrophobicContact CB-CG2 4.17Å; C856-V865 PolarHBondContact N-O 3.42Å; C856-V865 PolarHBondContact O-N 2.79Å; C856-R998 PolarHBondContact SG-NH1 3.14Å; C856-C1152 PolarHBondContact SG-O 2.97Å
857	Y	98.2	Very high	96.1	Very high	22 Å²	22	39.6 Å²	39.6	9%	0.086	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	139.5	174.3	-171.5	-126.1	0	0	0	111.6	G859 N862 F864 L1005 L1009 D1155	Y857-G859 VanDerWaalsContact CE1-CA 3.5Å; Y857-N862 PolarHBondContact OH-OD1 3.5Å; Y857-N862 VanDerWaalsContact OH-OD1 3.06Å; Y857-F864 VanDerWaalsContact CB-CE1 3.48Å; Y857-F864 HydrophobicContact CD2-CD1 4.05Å; Y857-F864 AromaticContact CD2-CD2 3.73Å; Y857-F864 HydrophobicContact CD2-CD2 3.73Å; Y857-F864 AromaticContact CD2-CE1 3.78Å; Y857-F864 HydrophobicContact CD2-CE1 3.78Å; Y857-F864 AromaticContact CD2-CE2 3.41Å; Y857-F864 HydrophobicContact CD2-CE2 3.41Å; Y857-F864 VanDerWaalsContact CD2-CE2 3.41Å; Y857-F864 HydrophobicContact CD2-CG 4.03Å; Y857-F864 AromaticContact CD2-CZ 3.43Å; Y857-F864 HydrophobicContact CD2-CZ 3.43Å; Y857-F864 VanDerWaalsContact CD2-CZ 3.43Å; Y857-F864 HydrophobicContact CE2-CD2 4.34Å; Y857-F864 AromaticContact CE2-CE2 3.86Å; Y857-F864 HydrophobicContact CE2-CE2 3.86Å; Y857-F864 HydrophobicContact CE2-CZ 4.16Å; Y857-F864 HydrophobicContact CG-CD1 4.35Å; Y857-F864 AromaticContact CG-CE1 3.93Å; Y857-F864 HydrophobicContact CG-CE1 3.93Å; Y857-F864 HydrophobicContact CG-CE2 4.33Å; Y857-F864 AromaticContact CG-CZ 3.9Å; Y857-F864 HydrophobicContact CG-CZ 3.9Å; Y857-L1005 HydrophobicContact CD1-CD1 3.49Å; Y857-L1005 VanDerWaalsContact CD1-CD1 3.49Å; Y857-L1005 HydrophobicContact CD1-CD2 3.76Å; Y857-L1005 HydrophobicContact CD1-CG 4.26Å; Y857-L1005 HydrophobicContact CE1-CD1 4.28Å; Y857-L1005 HydrophobicContact CE1-CD2 3.66Å; Y857-L1005 HydrophobicContact CG-CD1 3.67Å; Y857-L1005 HydrophobicContact CG-CD2 4.46Å; Y857-L1009 HydrophobicContact CE2-CD1 4Å; Y857-D1155 HydrophobicContact CD1-CB 3.95Å; Y857-D1155 PolarHBondContact O-N 2.95Å
858	N	97	Very high	96	Very high	67 Å²	67	40.6 Å²	40.6	36%	0.358	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	100.2	169.5	-179.6	-32.4	0	0	0	108.9	S860 T861 N862 R863	N858-S860 PolarHBondContact O-N 3.45Å; N858-S860 WeakPolarHBondContact OD1-CB 3.43Å; N858-S860 PolarHBondContact OD1-N 3.13Å; N858-S860 VanDerWaalsContact OD1-N 3.16Å; N858-T861 PolarHBondContact O-N 3.43Å; N858-T861 VanDerWaalsContact O-N 3.09Å; N858-T861 PolarHBondContact O-OG1 3.39Å; N858-T861 PolarHBondContact OD1-N 3.01Å; N858-N862 PolarHBondContact O-N 2.92Å; N858-R863 PolarHBondContact N-O 2.85Å; N858-R863 PolarHBondContact O-N 3.31Å
859	G	93.1	Very high	95.8	Very high	32 Å²	32	45.3 Å²	45.3	33%	0.33	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.1	-175.4	0	0	0	0	0	114.2	Y857 T861 D1155	Y857-G859 VanDerWaalsContact CE1-CA 3.5Å; G859-T861 VanDerWaalsContact C-N 3.33Å; G859-T861 PolarHBondContact O-N 3.34Å; G859-D1155 PolarHBondContact N-OD2 2.93Å
860	S	92.2	Very high	95.8	Very high	122 Å²	122	44.9 Å²	44.9	85%	0.853	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-31.8	175.4	-61.1	0	0	0	0	112.5	N858	N858-S860 PolarHBondContact O-N 3.45Å; N858-S860 WeakPolarHBondContact OD1-CB 3.43Å; N858-S860 PolarHBondContact OD1-N 3.13Å; N858-S860 VanDerWaalsContact OD1-N 3.16Å
861	T	94	Very high	95.5	Very high	78 Å²	78	45.9 Å²	45.9	48%	0.479	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-10.5	-179.4	64.1	0	0	0	0	113.6	N858 G859 R863	N858-T861 PolarHBondContact O-N 3.43Å; N858-T861 VanDerWaalsContact O-N 3.09Å; N858-T861 PolarHBondContact O-OG1 3.39Å; N858-T861 PolarHBondContact OD1-N 3.01Å; G859-T861 VanDerWaalsContact C-N 3.33Å; G859-T861 PolarHBondContact O-N 3.34Å; T861-R863 VanDerWaalsContact C-N 3.28Å; T861-R863 PolarHBondContact O-N 2.91Å
862	N	95.3	Very high	95.3	Very high	52 Å²	52	47.1 Å²	47.1	28%	0.278	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	45.7	-169.8	-167.4	16.1	0	0	0	112.3	Y857 N858 P911 L1009	Y857-N862 PolarHBondContact OH-OD1 3.5Å; Y857-N862 VanDerWaalsContact OH-OD1 3.06Å; N858-N862 PolarHBondContact O-N 2.92Å; N862-P911 WeakPolarHBondContact O-CD 3.36Å; N862-L1009 WeakPolarHBondContact OD1-CD2 3.42Å
863	R	97.1	Very high	95.1	Very high	115 Å²	115	52.1 Å²	52.1	43%	0.434	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	148.8	-179.7	-68.5	179.8	179	-169.4	-2	111	N858 T861 F908 V909	N858-R863 PolarHBondContact N-O 2.85Å; N858-R863 PolarHBondContact O-N 3.31Å; T861-R863 VanDerWaalsContact C-N 3.28Å; T861-R863 PolarHBondContact O-N 2.91Å; R863-F908 HydrophobicContact CB-CD2 4.2Å; R863-F908 HydrophobicContact CG-CD2 3.73Å; R863-F908 HydrophobicContact CG-CE2 4.15Å; R863-V909 CarbonylContact C-O 3.03Å; R863-V909 WeakPolarHBondContact CA-O 3.37Å
864	F	98.1	Very high	94.6	Very high	1 Å²	1	59.1 Å²	59.1	0%	0.004	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	139.8	167.5	-63.9	-101.6	0	0	0	110.4	F851 Y855 C856 Y857 F908 V909 F914 L1005 L1009	F851-F864 HydrophobicContact CE1-CE1 4.27Å; F851-F864 HydrophobicContact CE1-CZ 4.4Å; F851-F864 HydrophobicContact CE2-CB 4.14Å; F851-F864 AromaticContact CE2-CD1 3.97Å; F851-F864 HydrophobicContact CE2-CD1 3.97Å; F851-F864 AromaticContact CE2-CD2 3.99Å; F851-F864 HydrophobicContact CE2-CD2 3.99Å; F851-F864 HydrophobicContact CE2-CE1 4.33Å; F851-F864 HydrophobicContact CE2-CE2 4.38Å; F851-F864 AromaticContact CE2-CG 3.78Å; F851-F864 HydrophobicContact CE2-CG 3.78Å; F851-F864 AromaticContact CZ-CD1 3.72Å; F851-F864 HydrophobicContact CZ-CD1 3.72Å; F851-F864 AromaticContact CZ-CD2 3.85Å; F851-F864 HydrophobicContact CZ-CD2 3.85Å; F851-F864 AromaticContact CZ-CE1 3.62Å; F851-F864 HydrophobicContact CZ-CE1 3.62Å; F851-F864 AromaticContact CZ-CE2 3.77Å; F851-F864 HydrophobicContact CZ-CE2 3.77Å; F851-F864 AromaticContact CZ-CG 3.84Å; F851-F864 HydrophobicContact CZ-CG 3.84Å; F851-F864 AromaticContact CZ-CZ 3.66Å; F851-F864 HydrophobicContact CZ-CZ 3.66Å; Y855-F864 HydrophobicContact CD1-CB 3.76Å; Y855-F864 HydrophobicContact CG-CB 4.36Å; C856-F864 CarbonylContact O-C 3.47Å; C856-F864 VanDerWaalsContact O-CA 3.25Å; C856-F864 WeakPolarHBondContact O-CA 3.5Å; Y857-F864 VanDerWaalsContact CB-CE1 3.48Å; Y857-F864 HydrophobicContact CD2-CD1 4.05Å; Y857-F864 AromaticContact CD2-CD2 3.73Å; Y857-F864 HydrophobicContact CD2-CD2 3.73Å; Y857-F864 AromaticContact CD2-CE1 3.78Å; Y857-F864 HydrophobicContact CD2-CE1 3.78Å; Y857-F864 AromaticContact CD2-CE2 3.41Å; Y857-F864 HydrophobicContact CD2-CE2 3.41Å; Y857-F864 VanDerWaalsContact CD2-CE2 3.41Å; Y857-F864 HydrophobicContact CD2-CG 4.03Å; Y857-F864 AromaticContact CD2-CZ 3.43Å; Y857-F864 HydrophobicContact CD2-CZ 3.43Å; Y857-F864 VanDerWaalsContact CD2-CZ 3.43Å; Y857-F864 HydrophobicContact CE2-CD2 4.34Å; Y857-F864 AromaticContact CE2-CE2 3.86Å; Y857-F864 HydrophobicContact CE2-CE2 3.86Å; Y857-F864 HydrophobicContact CE2-CZ 4.16Å; Y857-F864 HydrophobicContact CG-CD1 4.35Å; Y857-F864 AromaticContact CG-CE1 3.93Å; Y857-F864 HydrophobicContact CG-CE1 3.93Å; Y857-F864 HydrophobicContact CG-CE2 4.33Å; Y857-F864 AromaticContact CG-CZ 3.9Å; Y857-F864 HydrophobicContact CG-CZ 3.9Å; F864-F908 CarbonylContact O-C 3.56Å; F864-F908 WeakPolarHBondContact O-CA 3.31Å; F864-F908 WeakPolarHBondContact O-CB 3.49Å; F864-V909 HydrophobicContact CB-CB 4.2Å; F864-V909 PolarHBondContact N-O 3.42Å; F864-V909 PolarHBondContact O-N 3.41Å; F864-F914 HydrophobicContact CD2-CE2 4.4Å; F864-F914 HydrophobicContact CE2-CE2 4.12Å; F864-F914 AromaticContact CE2-CZ 3.99Å; F864-F914 HydrophobicContact CE2-CZ 3.99Å; F864-L1005 HydrophobicContact CE1-CD1 4.34Å; F864-L1005 HydrophobicContact CZ-CB 3.88Å; F864-L1005 HydrophobicContact CZ-CD1 4.31Å; F864-L1009 HydrophobicContact CE2-CD1 3.55Å; F864-L1009 HydrophobicContact CZ-CD1 4.05Å
865	V	97.1	Very high	94.2	Very high	68 Å²	68	63.6 Å²	63.6	41%	0.412	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	157.4	173.5	-64.8	0	0	0	0	110.1	Y855 C856 F908	Y855-V865 CarbonylContact C-O 3.33Å; Y855-V865 WeakPolarHBondContact CA-O 3.07Å; C856-V865 HydrophobicContact CB-CG2 4.17Å; C856-V865 PolarHBondContact N-O 3.42Å; C856-V865 PolarHBondContact O-N 2.79Å; V865-F908 HydrophobicContact CG1-CB 4.45Å
866	R	96	Very high	93.9	Very high	83 Å²	83	71.7 Å²	71.7	31%	0.313	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	150.7	178.5	-71.3	-174	175.9	-78	-2.2	111.7	D791 D850 N854 Y855	D791-R866 IonicContact OD2-CZ 3.39Å; D791-R866 IonicContact OD2-NH2 2.69Å; D791-R866 PolarHBondContact OD2-NH2 3.18Å; D850-R866 IonicContact OD1-CZ 2.87Å; D850-R866 IonicContact OD1-NH1 2.89Å; D850-R866 PolarHBondContact OD1-NH1 2.95Å; D850-R866 IonicContact OD1-NH2 3.93Å; D850-R866 IonicContact OD2-CZ 3.49Å; D850-R866 IonicContact OD2-NH1 3.64Å; D850-R866 PolarHBondContact OD2-NH1 2.98Å; D850-R866 IonicContact OD2-NH2 3.74Å; D850-R866 PolarHBondContact OD2-NH2 3.03Å; N854-R866 CarbonylContact O-C 3.54Å; N854-R866 WeakPolarHBondContact O-CA 3.31Å; Y855-R866 HydrophobicContact CE1-CG 4.16Å; Y855-R866 HydrophobicContact CE2-CG 4.29Å; Y855-R866 PolarHBondContact OH-NH2 3.41Å
867	T	96	Very high	93.5	Very high	16 Å²	16	74.2 Å²	74.2	10%	0.098	39%	0.387	C	S	.	.			trans	-71.3	179.4	176.6	-166.9	0	0	0	0	112.1	N854 F871 R998 C1152	N854-T867 HydrophobicContact CB-CG2 4.41Å; N854-T867 WeakPolarHBondContact O-CB 3.39Å; N854-T867 WeakPolarHBondContact O-CG2 3.38Å; N854-T867 PolarHBondContact O-N 3.1Å; T867-F871 HydrophobicContact CG2-CB 3.9Å; T867-F871 WeakPolarHBondContact CG2-O 3.44Å; T867-R998 PolarHBondContact OG1-NH2 3.18Å; T867-R998 VanDerWaalsContact OG1-NH2 3.09Å; T867-C1152 WeakPolarHBondContact CB-O 3.35Å; T867-C1152 PolarHBondContact OG1-O 3.19Å
868	V	94.3	Very high	93.2	Very high	20 Å²	20	79.7 Å²	79.7	12%	0.121	42%	0.418	C	S	.	.			trans	-74.2	152.7	177.4	-64.3	0	0	0	0	111.3	P870 F871 S872 F1147 Q1151 C1152	V868-P870 VanDerWaalsContact C-CD 3.46Å; V868-P870 HydrophobicContact CG2-CG 3.99Å; V868-P870 VanDerWaalsContact O-N 3.16Å; V868-F871 HydrophobicContact CG2-CB 4.33Å; V868-F871 HydrophobicContact CG2-CD2 3.99Å; V868-F871 PolarHBondContact O-N 3.18Å; V868-S872 PolarHBondContact O-N 3.2Å; V868-S872 VanDerWaalsContact O-N 3.16Å; V868-F1147 HydrophobicContact CG1-CB 3.97Å; V868-F1147 HydrophobicContact CG1-CD2 4.46Å; V868-F1147 HydrophobicContact CG1-CG 4.08Å; V868-F1147 HydrophobicContact CG2-CD1 4.3Å; V868-F1147 HydrophobicContact CG2-CD2 4.08Å; V868-F1147 HydrophobicContact CG2-CE1 4.3Å; V868-F1147 HydrophobicContact CG2-CE2 4.07Å; V868-F1147 HydrophobicContact CG2-CG 4.2Å; V868-F1147 HydrophobicContact CG2-CZ 4.18Å; V868-Q1151 HydrophobicContact CG1-CG 4.04Å; V868-C1152 HydrophobicContact CG2-CB 4.24Å
869	L	90.3	Very high	92.7	Very high	151 Å²	151	85.9 Å²	85.9	79%	0.791	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-45	-47.4	-176.9	-174.4	64.8	0	0	0	115.7	F871 S872	L869-F871 PolarHBondContact O-N 2.94Å; L869-S872 PolarHBondContact O-N 2.8Å
870	P	92.2	Very high	92.5	Very high	96 Å²	96	87.1 Å²	87.1	62%	0.623	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-67.8	-15.2	-178.3	23.8	-32.2	0	0	0	114.7	V868 F1147	V868-P870 VanDerWaalsContact C-CD 3.46Å; V868-P870 HydrophobicContact CG2-CG 3.99Å; V868-P870 VanDerWaalsContact O-N 3.16Å; P870-F1147 HydrophobicContact CG-CE1 3.93Å; P870-F1147 HydrophobicContact CG-CZ 4.14Å
871	F	91.4	Very high	92.3	Very high	27 Å²	27	86.5 Å²	86.5	12%	0.118	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-108.1	-0.5	177.6	-77.5	-99.6	0	0	0	112.5	N854 T867 V868 L869 Q873 K990 T991 F1147 C1152 F1153	N854-F871 PolarHBondContact OD1-O 3.26Å; T867-F871 HydrophobicContact CG2-CB 3.9Å; T867-F871 WeakPolarHBondContact CG2-O 3.44Å; V868-F871 HydrophobicContact CG2-CB 4.33Å; V868-F871 HydrophobicContact CG2-CD2 3.99Å; V868-F871 PolarHBondContact O-N 3.18Å; L869-F871 PolarHBondContact O-N 2.94Å; F871-Q873 PolarHBondContact O-N 3.09Å; F871-K990 HydrophobicContact CZ-CB 4.29Å; F871-T991 HydrophobicContact CE1-CG2 4.28Å; F871-T991 HydrophobicContact CZ-CG2 3.91Å; F871-F1147 HydrophobicContact CD2-CZ 4.48Å; F871-F1147 HydrophobicContact CE2-CE2 4.3Å; F871-F1147 HydrophobicContact CE2-CZ 4.15Å; F871-C1152 VanDerWaalsContact CD2-SG 3.51Å; F871-F1153 AromaticContact CD1-CE1 3.94Å; F871-F1153 HydrophobicContact CD1-CE1 3.94Å; F871-F1153 AromaticContact CD1-CZ 3.96Å; F871-F1153 HydrophobicContact CD1-CZ 3.96Å; F871-F1153 AromaticContact CE1-CE1 3.8Å; F871-F1153 HydrophobicContact CE1-CE1 3.8Å; F871-F1153 AromaticContact CE1-CZ 3.44Å; F871-F1153 HydrophobicContact CE1-CZ 3.44Å; F871-F1153 VanDerWaalsContact CE1-CZ 3.44Å; F871-F1153 AromaticContact CZ-CZ 3.87Å; F871-F1153 HydrophobicContact CZ-CZ 3.87Å
872	S	93.4	Very high	91.7	Very high	27 Å²	27	90 Å²	90	19%	0.189	45%	0.448	C	S	.	.			trans	-76.4	106.3	175.2	-165.5	0	0	0	0	109.4	V868 L869 E874	V868-S872 PolarHBondContact O-N 3.2Å; V868-S872 VanDerWaalsContact O-N 3.16Å; L869-S872 PolarHBondContact O-N 2.8Å; S872-E874 PolarHBondContact O-N 3.33Å; S872-E874 PolarHBondContact OG-OE1 2.78Å
873	Q	91.3	Very high	91.5	Very high	106 Å²	106	89.1 Å²	89.1	50%	0.495	45%	0.447	S	S	.	.			trans	-84.6	95.4	176	-59.6	-176.5	35.2	0	0	108.7	N854 F871	N854-Q873 PolarHBondContact ND2-O 2.86Å; N854-Q873 PolarHBondContact OD1-N 3.44Å; F871-Q873 PolarHBondContact O-N 3.09Å
874	E	87.6	Confident	91.3	Very high	151 Å²	151	88.4 Å²	88.4	71%	0.706	45%	0.449	S	S	*	.			trans	-74	130.1	178	-64.9	-65.3	162.3	0	0	111	S872	S872-E874 PolarHBondContact O-N 3.33Å; S872-E874 PolarHBondContact OG-OE1 2.78Å
875	F	88.5	Confident	91.3	Very high	96 Å²	96	90.1 Å²	90.1	42%	0.421	46%	0.46	S	S	.	.			trans	-115.5	126.4	169.8	179.7	-96.6	0	0	0	109.2	W845 R877	W845-F875 HydrophobicContact CZ2-CE1 4.48Å; W845-F875 HydrophobicContact CZ2-CZ 4.16Å; F875-R877 HydrophobicContact CD1-CG 4.2Å; F875-R877 PolarHBondContact O-N 3.05Å
876	Q	90.1	Very high	91.2	Very high	170 Å²	170	87.9 Å²	87.9	79%	0.794	45%	0.445	S	S	*	.			trans	-69.7	119.3	179.5	-177.4	175.3	-7	0	0	110
877	R	91.3	Very high	91.3	Very high	58 Å²	58	85.1 Å²	85.1	22%	0.219	44%	0.435	C	S	.	.			trans	-100.1	138.5	175.1	-61.9	-179.7	-178	83.7	-13.7	110.4	E846 D850 F875 K879	E846-R877 IonicContact OE1-CZ 3.7Å; E846-R877 IonicContact OE1-NE 2.69Å; E846-R877 PolarHBondContact OE1-NE 3.03Å; E846-R877 VanDerWaalsContact OE1-NE 3.11Å; E846-R877 IonicContact OE1-NH2 3.79Å; E846-R877 IonicContact OE2-CZ 2.74Å; E846-R877 IonicContact OE2-NE 2.82Å; E846-R877 IonicContact OE2-NH2 3.42Å; E846-R877 PolarHBondContact OE2-NH2 2.99Å; D850-R877 IonicContact OD2-NH2 2.69Å; D850-R877 PolarHBondContact OD2-NH2 3.39Å; F875-R877 HydrophobicContact CD1-CG 4.2Å; F875-R877 PolarHBondContact O-N 3.05Å; R877-K879 PolarHBondContact O-N 3.21Å
878	D	90.2	Very high	91.3	Very high	138 Å²	138	84.7 Å²	84.7	74%	0.738	43%	0.432	S	S	*	.			trans	-75.9	113.3	177.6	-73	-26.5	0	0	0	110.4	S789 Q880	S789-D878 WeakPolarHBondContact CB-O 3.46Å; D878-Q880 PolarHBondContact O-N 3.48Å
879	K	88.3	Confident	91.4	Very high	197 Å²	197	83.8 Å²	83.8	86%	0.857	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-68.7	128.9	179.9	-77.5	-162.8	175	-169.7	0	111.6	R877	R877-K879 PolarHBondContact O-N 3.21Å
880	Q	88.5	Confident	91.6	Very high	57 Å²	57	76.9 Å²	76.9	27%	0.266	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-70.3	139.7	175.2	-156.7	-178.4	38	0	0	111.9	L782 G785 R786 D878	L782-Q880 PolarHBondContact O-OE1 3.47Å; G785-Q880 VanDerWaalsContact C-CD 3.48Å; G785-Q880 VanDerWaalsContact C-NE2 3.27Å; R786-Q880 VanDerWaalsContact CB-OE1 3.31Å; D878-Q880 PolarHBondContact O-N 3.48Å
881	P	87	Confident	91.9	Very high	109 Å²	109	74 Å²	74	71%	0.708	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-68.1	139	175.2	26.7	-34.8	0	0	0	112.1	A883	P881-A883 PolarHBondContact O-N 3.33Å
882	N	81.8	Confident	92.1	Very high	152 Å²	152	81 Å²	81	81%	0.813	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-68	120.8	179.9	-77.6	-27.6	0	0	0	111.9
883	A	90.4	Very high	92.2	Very high	33 Å²	33	82.3 Å²	82.3	27%	0.273	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-87.1	173.1	172	0	0	0	0	0	112.6	L782 P881 Y887	L782-A883 HydrophobicContact CD1-CB 4.1Å; L782-A883 HydrophobicContact CD2-CB 3.48Å; L782-A883 VanDerWaalsContact CD2-CB 3.48Å; L782-A883 HydrophobicContact CG-CB 4.46Å; P881-A883 PolarHBondContact O-N 3.33Å; A883-Y887 HydrophobicContact CB-CD2 4.31Å
884	Q	94.4	Very high	92.4	Very high	101 Å²	101	77.4 Å²	77.4	47%	0.472	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-59.8	145.8	173.1	-68.9	176.4	-17.5	0	0	111.6	Q886 Y887	Q884-Q886 HydrophobicContact CB-CG 4.26Å; Q884-Q886 PolarHBondContact O-N 3.1Å; Q884-Q886 VanDerWaalsContact O-N 3.09Å; Q884-Y887 HydrophobicContact CB-CD2 3.96Å; Q884-Y887 HydrophobicContact CB-CE2 4.1Å; Q884-Y887 PolarHBondContact O-N 3.4Å
885	P	96.6	Very high	92.9	Very high	36 Å²	36	71.7 Å²	71.7	23%	0.234	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-57	-30.5	-173.4	-27.8	35.7	0	0	0	115.7	Y887 L888 G890 K892	P885-Y887 PolarHBondContact O-N 2.88Å; P885-L888 CarbonylContact O-C 3.58Å; P885-L888 PolarHBondContact O-N 3.5Å; P885-G890 CarbonylContact C-O 3.34Å; P885-G890 WeakPolarHBondContact CB-O 3.49Å; P885-G890 CarbonylContact O-C 3.58Å; P885-G890 WeakPolarHBondContact O-CA 3.46Å; P885-G890 PolarHBondContact O-N 3.49Å; P885-K892 HydrophobicContact CG-CG 3.86Å
886	Q	95.9	Very high	93.2	Very high	21 Å²	21	72.7 Å²	72.7	10%	0.098	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-63.5	-21.3	177.9	65.1	-161.7	39.6	0	0	113.9	D708 F711 A712 K715 Q884 L888 G890	D708-Q886 PolarHBondContact OD1-NE2 2.88Å; F711-Q886 HydrophobicContact CD1-CB 4.45Å; F711-Q886 HydrophobicContact CD1-CG 4.49Å; F711-Q886 VanDerWaalsContact CE1-O 3.28Å; F711-Q886 WeakPolarHBondContact CE1-O 3.48Å; A712-Q886 HydrophobicContact CB-CB 3.84Å; K715-Q886 WeakPolarHBondContact CG-O 3.31Å; K715-Q886 PolarHBondContact NZ-O 3.33Å; Q884-Q886 HydrophobicContact CB-CG 4.26Å; Q884-Q886 PolarHBondContact O-N 3.1Å; Q884-Q886 VanDerWaalsContact O-N 3.09Å; Q886-L888 VanDerWaalsContact C-N 3.33Å; Q886-G890 PolarHBondContact N-O 3.1Å
887	Y	97.6	Very high	93.5	Very high	25 Å²	25	64.9 Å²	64.9	10%	0.098	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-83	-14.4	174.1	-59.9	-63.5	0	0	0	113.1	F711 A775 K778 S779 A883 Q884 P885	F711-Y887 AromaticContact CE1-CD1 3.91Å; F711-Y887 HydrophobicContact CE1-CD1 3.91Å; F711-Y887 HydrophobicContact CE1-CE1 4.09Å; A775-Y887 HydrophobicContact CB-CE1 4.09Å; K778-Y887 HydrophobicContact CB-CD1 4.3Å; K778-Y887 HydrophobicContact CB-CE1 4.36Å; K778-Y887 HydrophobicContact CD-CD1 4.01Å; K778-Y887 HydrophobicContact CD-CD2 4.49Å; K778-Y887 HydrophobicContact CD-CE1 3.7Å; K778-Y887 HydrophobicContact CD-CE2 4.2Å; K778-Y887 HydrophobicContact CD-CG 4.39Å; K778-Y887 HydrophobicContact CG-CD1 4.05Å; K778-Y887 HydrophobicContact CG-CE1 4.19Å; K778-Y887 HydrophobicContact CG-CG 4.43Å; S779-Y887 VanDerWaalsContact OG-C 3.31Å; S779-Y887 VanDerWaalsContact OG-CA 3.23Å; S779-Y887 WeakPolarHBondContact OG-CA 3.43Å; S779-Y887 PolarHBondContact OG-O 3.46Å; A883-Y887 HydrophobicContact CB-CD2 4.31Å; Q884-Y887 HydrophobicContact CB-CD2 3.96Å; Q884-Y887 HydrophobicContact CB-CE2 4.1Å; Q884-Y887 PolarHBondContact O-N 3.4Å; P885-Y887 PolarHBondContact O-N 2.88Å
888	L	96.3	Very high	93.8	Very high	8 Å²	8	62.5 Å²	62.5	4%	0.042	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-119	176.4	-63.8	171.9	0	0	0	109.9	K715 L782 L801 P885 Q886 N895	K715-L888 WeakPolarHBondContact CD-O 3.36Å; K715-L888 PolarHBondContact NZ-O 3.06Å; L782-L888 HydrophobicContact CD2-CD2 3.46Å; L782-L888 VanDerWaalsContact CD2-CD2 3.46Å; L782-L888 HydrophobicContact CD2-CG 3.74Å; L782-L888 HydrophobicContact CG-CD2 3.94Å; L801-L888 HydrophobicContact CD2-CD2 4.05Å; P885-L888 CarbonylContact O-C 3.58Å; P885-L888 PolarHBondContact O-N 3.5Å; Q886-L888 VanDerWaalsContact C-N 3.33Å; L888-N895 WeakPolarHBondContact CB-OD1 3.36Å
889	H	96.3	Very high	94.1	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-1.9	-175.4	-48	85.7	0	0	0	113.6	I804 L894 N895 Y898	I804-H889 HydrophobicContact CD1-CB 4.44Å; H889-L894 HydrophobicContact CB-CB 4.13Å; H889-L894 WeakPolarHBondContact O-CD1 3.31Å; H889-N895 WeakPolarHBondContact CB-OD1 3.49Å; H889-N895 PolarHBondContact N-OD1 3.47Å; H889-N895 PolarHBondContact ND1-OD1 3.32Å; H889-Y898 HydrophobicContact CB-CD2 3.87Å; H889-Y898 HydrophobicContact CB-CE2 4.47Å; H889-Y898 VanDerWaalsContact CD2-CB 3.41Å; H889-Y898 WeakPolarHBondContact CD2-CB 3.49Å; H889-Y898 AromaticContact CD2-CD2 3.58Å; H889-Y898 AromaticContact CD2-CG 3.52Å; H889-Y898 AromaticContact CG-CD2 3.93Å
890	G	95.3	Very high	94.4	Very high	6 Å²	6	52.7 Å²	52.7	6%	0.062	30%	0.3	C	S	.	.	S	Bend	trans	116.8	-55.1	174.8	0	0	0	0	0	114.1	V716 P885 Q886	V716-G890 VanDerWaalsContact CG2-C 3.44Å; V716-G890 WeakPolarHBondContact CG2-O 3.39Å; P885-G890 CarbonylContact C-O 3.34Å; P885-G890 WeakPolarHBondContact CB-O 3.49Å; P885-G890 CarbonylContact O-C 3.58Å; P885-G890 WeakPolarHBondContact O-CA 3.46Å; P885-G890 PolarHBondContact O-N 3.49Å; Q886-G890 PolarHBondContact N-O 3.1Å
891	S	96.9	Very high	94.8	Very high	34 Å²	34	52.2 Å²	52.2	24%	0.238	30%	0.299	C	S	.	.	S	Bend	trans	-134.9	165.3	-176.6	77.3	0	0	0	0	111.8	A893 L894 N895	S891-A893 VanDerWaalsContact C-N 3.29Å; S891-A893 PolarHBondContact O-N 3.43Å; S891-L894 PolarHBondContact O-N 3.35Å; S891-L894 WeakPolarHBondContact OG-CG 3.32Å; S891-L894 PolarHBondContact OG-N 2.94Å; S891-N895 WeakPolarHBondContact O-CB 3.35Å; S891-N895 PolarHBondContact O-N 2.9Å
892	K	96.3	Very high	95.3	Very high	174 Å²	174	48.6 Å²	48.6	76%	0.757	27%	0.271	S	S	*	.	H	α-helix	trans	-58.8	-40.7	177.2	-65.4	-176.2	-179.4	179.6	0	112.1	P885 N895 L896	P885-K892 HydrophobicContact CG-CG 3.86Å; K892-N895 PolarHBondContact O-N 3.37Å; K892-L896 PolarHBondContact O-N 2.9Å; K892-L896 VanDerWaalsContact O-N 3.08Å
893	A	95.3	Very high	95.9	Very high	55 Å²	55	42.9 Å²	42.9	46%	0.455	25%	0.248	S	C	.	.	H	α-helix	trans	-65.4	-41.9	178.2	0	0	0	0	0	112.1	S891 L896 A897	S891-A893 VanDerWaalsContact C-N 3.29Å; S891-A893 PolarHBondContact O-N 3.43Å; A893-L896 PolarHBondContact O-N 3.08Å; A893-A897 WeakPolarHBondContact O-CB 3.44Å; A893-A897 PolarHBondContact O-N 3.41Å
894	L	96.6	Very high	96.2	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-68.7	-41.6	176.6	-68.5	174.6	0	0	0	111.6	V716 L723 I738 H889 S891 L896 A897 Y898	V716-L894 HydrophobicContact CG1-CD1 4Å; L723-L894 HydrophobicContact CD2-CD2 3.97Å; I738-L894 HydrophobicContact CG2-CD2 4.45Å; H889-L894 HydrophobicContact CB-CB 4.13Å; H889-L894 WeakPolarHBondContact O-CD1 3.31Å; S891-L894 PolarHBondContact O-N 3.35Å; S891-L894 WeakPolarHBondContact OG-CG 3.32Å; S891-L894 PolarHBondContact OG-N 2.94Å; L894-L896 VanDerWaalsContact C-N 3.28Å; L894-L896 PolarHBondContact O-N 3.32Å; L894-A897 PolarHBondContact O-N 3.42Å; L894-Y898 HydrophobicContact CB-CD2 4.45Å; L894-Y898 VanDerWaalsContact O-CD2 3.31Å; L894-Y898 WeakPolarHBondContact O-CD2 3.43Å; L894-Y898 PolarHBondContact O-N 2.87Å
895	N	96.7	Very high	96.3	Very high	30 Å²	30	44 Å²	44	16%	0.16	25%	0.254	C	S	.	.	H	α-helix	trans	-56.3	-44.5	175	-76.8	-11	0	0	0	111.5	L888 H889 S891 K892 S899	L888-N895 WeakPolarHBondContact CB-OD1 3.36Å; H889-N895 WeakPolarHBondContact CB-OD1 3.49Å; H889-N895 PolarHBondContact N-OD1 3.47Å; H889-N895 PolarHBondContact ND1-OD1 3.32Å; S891-N895 WeakPolarHBondContact O-CB 3.35Å; S891-N895 PolarHBondContact O-N 2.9Å; K892-N895 PolarHBondContact O-N 3.37Å; N895-S899 WeakPolarHBondContact O-CB 3.24Å; N895-S899 PolarHBondContact O-N 2.92Å
896	L	96.2	Very high	96.2	Very high	118 Å²	118	45.4 Å²	45.4	62%	0.618	26%	0.255	S	S	*	.	H	α-helix	trans	-65.2	-48.3	176.7	-169.1	161.3	0	0	0	111	K892 A893 L894 Y898 S899 S900	K892-L896 PolarHBondContact O-N 2.9Å; K892-L896 VanDerWaalsContact O-N 3.08Å; A893-L896 PolarHBondContact O-N 3.08Å; L894-L896 VanDerWaalsContact C-N 3.28Å; L894-L896 PolarHBondContact O-N 3.32Å; L896-Y898 PolarHBondContact O-N 3.49Å; L896-S899 PolarHBondContact O-N 3.09Å; L896-S900 PolarHBondContact O-N 2.86Å; L896-S900 PolarHBondContact O-OG 2.98Å
897	A	96.3	Very high	96.2	Very high	6 Å²	6	50.5 Å²	50.5	5%	0.05	28%	0.283	C	S	.	.	H	α-helix	trans	-58.3	-48	-178.9	0	0	0	0	0	112.3	L723 I738 A893 L894 S900 I901	L723-A897 HydrophobicContact CD1-CB 4.17Å; L723-A897 HydrophobicContact CD2-CB 4.33Å; I738-A897 HydrophobicContact CD1-CB 3.85Å; A893-A897 WeakPolarHBondContact O-CB 3.44Å; A893-A897 PolarHBondContact O-N 3.41Å; L894-A897 PolarHBondContact O-N 3.42Å; A897-S900 PolarHBondContact O-N 3.48Å; A897-I901 VanDerWaalsContact O-CG1 3.31Å; A897-I901 WeakPolarHBondContact O-CG1 3.46Å; A897-I901 PolarHBondContact O-N 3.47Å
898	Y	97.1	Very high	96.2	Very high	7 Å²	7	50.4 Å²	50.4	3%	0.027	28%	0.283	C	S	.	.	H	α-helix	trans	-68.5	-40.8	177.9	-80.9	-71.5	0	0	0	112.6	G719 L722 L723 I804 H889 L894 L896 S900 I901 Y902	G719-Y898 PolarHBondContact O-OH 2.97Å; L722-Y898 WeakPolarHBondContact CB-OH 3.36Å; L723-Y898 WeakPolarHBondContact CA-OH 3.45Å; L723-Y898 HydrophobicContact CB-CE2 4.46Å; L723-Y898 HydrophobicContact CD1-CD1 4.49Å; L723-Y898 HydrophobicContact CD1-CD2 4.34Å; L723-Y898 HydrophobicContact CD1-CE1 4.16Å; L723-Y898 HydrophobicContact CD1-CE2 3.98Å; L723-Y898 PolarHBondContact N-OH 2.99Å; I804-Y898 HydrophobicContact CD1-CD1 4.44Å; I804-Y898 HydrophobicContact CD1-CD2 4.16Å; I804-Y898 HydrophobicContact CD1-CE1 4.04Å; I804-Y898 HydrophobicContact CD1-CE2 3.75Å; I804-Y898 HydrophobicContact CD1-CG 4.48Å; H889-Y898 HydrophobicContact CB-CD2 3.87Å; H889-Y898 HydrophobicContact CB-CE2 4.47Å; H889-Y898 VanDerWaalsContact CD2-CB 3.41Å; H889-Y898 WeakPolarHBondContact CD2-CB 3.49Å; H889-Y898 AromaticContact CD2-CD2 3.58Å; H889-Y898 AromaticContact CD2-CG 3.52Å; H889-Y898 AromaticContact CG-CD2 3.93Å; L894-Y898 HydrophobicContact CB-CD2 4.45Å; L894-Y898 VanDerWaalsContact O-CD2 3.31Å; L894-Y898 WeakPolarHBondContact O-CD2 3.43Å; L894-Y898 PolarHBondContact O-N 2.87Å; L896-Y898 PolarHBondContact O-N 3.49Å; Y898-S900 VanDerWaalsContact C-N 3.27Å; Y898-S900 PolarHBondContact O-N 2.94Å; Y898-I901 HydrophobicContact CD1-CD1 4.07Å; Y898-I901 HydrophobicContact CE1-CD1 4.41Å; Y898-I901 WeakPolarHBondContact O-CB 3.38Å; Y898-I901 PolarHBondContact O-N 2.88Å; Y898-I901 VanDerWaalsContact O-N 3.13Å; Y898-Y902 AromaticContact CD1-CE2 3.64Å; Y898-Y902 HydrophobicContact CD1-CE2 3.64Å; Y898-Y902 HydrophobicContact CG-CE2 4.32Å; Y898-Y902 WeakPolarHBondContact O-CD2 3.39Å; Y898-Y902 PolarHBondContact O-N 2.93Å
899	S	95.6	Very high	96.3	Very high	53 Å²	53	50.1 Å²	50.1	37%	0.371	28%	0.281	S	S	.	.	H	α-helix	trans	-59.4	-39.1	174.6	-176.9	0	0	0	0	111.7	N895 L896 Y902 G903	N895-S899 WeakPolarHBondContact O-CB 3.24Å; N895-S899 PolarHBondContact O-N 2.92Å; L896-S899 PolarHBondContact O-N 3.09Å; S899-Y902 PolarHBondContact O-N 3.49Å; S899-G903 PolarHBondContact O-N 2.94Å
900	S	95.3	Very high	96.3	Very high	76 Å²	76	50 Å²	50	53%	0.531	28%	0.281	S	S	.	.	H	α-helix	trans	-67.9	-39.3	173.8	-63.8	0	0	0	0	113.1	L896 A897 Y898 G903	L896-S900 PolarHBondContact O-N 2.86Å; L896-S900 PolarHBondContact O-OG 2.98Å; A897-S900 PolarHBondContact O-N 3.48Å; Y898-S900 VanDerWaalsContact C-N 3.27Å; Y898-S900 PolarHBondContact O-N 2.94Å; S900-G903 PolarHBondContact O-N 3.49Å
901	I	96.5	Very high	96.4	Very high	47 Å²	47	52.7 Å²	52.7	24%	0.241	30%	0.297	C	S	.	.	H	α-helix	trans	-58.1	-52.1	174.4	-71.2	164.4	0	0	0	109.5	L723 L727 A897 Y898 G903 S904	L723-I901 HydrophobicContact CD1-CD1 3.63Å; L727-I901 HydrophobicContact CD2-CD1 3.64Å; L727-I901 HydrophobicContact CD2-CG1 3.7Å; A897-I901 VanDerWaalsContact O-CG1 3.31Å; A897-I901 WeakPolarHBondContact O-CG1 3.46Å; A897-I901 PolarHBondContact O-N 3.47Å; Y898-I901 HydrophobicContact CD1-CD1 4.07Å; Y898-I901 HydrophobicContact CE1-CD1 4.41Å; Y898-I901 WeakPolarHBondContact O-CB 3.38Å; Y898-I901 PolarHBondContact O-N 2.88Å; Y898-I901 VanDerWaalsContact O-N 3.13Å; I901-G903 VanDerWaalsContact C-N 3.31Å; I901-G903 PolarHBondContact O-N 3.5Å; I901-S904 PolarHBondContact O-N 3.41Å; I901-S904 PolarHBondContact O-OG 3.5Å
902	Y	97.4	Very high	96.3	Very high	33 Å²	33	52.9 Å²	52.9	13%	0.129	30%	0.298	C	S	.	.	H	α-helix	trans	-77.8	-16.2	-175.4	-60.2	-57.3	0	0	0	113.7	V796 E797 G800 Y898 S899 S904 Y905	V796-Y902 HydrophobicContact CG1-CD1 3.99Å; V796-Y902 HydrophobicContact CG1-CE1 4.2Å; E797-Y902 HydrophobicContact CB-CD2 3.94Å; E797-Y902 HydrophobicContact CB-CG 3.89Å; E797-Y902 HydrophobicContact CG-CD2 3.75Å; E797-Y902 HydrophobicContact CG-CG 4.19Å; G800-Y902 VanDerWaalsContact CA-OH 3.3Å; G800-Y902 WeakPolarHBondContact CA-OH 3.28Å; Y898-Y902 AromaticContact CD1-CE2 3.64Å; Y898-Y902 HydrophobicContact CD1-CE2 3.64Å; Y898-Y902 HydrophobicContact CG-CE2 4.32Å; Y898-Y902 WeakPolarHBondContact O-CD2 3.39Å; Y898-Y902 PolarHBondContact O-N 2.93Å; S899-Y902 PolarHBondContact O-N 3.49Å; Y902-S904 PolarHBondContact O-N 2.94Å; Y902-S904 VanDerWaalsContact O-N 3.11Å; Y902-Y905 HydrophobicContact CD1-CD2 4.35Å; Y902-Y905 HydrophobicContact CD1-CE2 4.48Å; Y902-Y905 PolarHBondContact O-N 3.16Å
903	G	95.8	Very high	96.4	Very high	32 Å²	32	44.6 Å²	44.6	33%	0.33	26%	0.262	S	S	.	.	H	α-helix	trans	-52.6	-31.3	169.3	0	0	0	0	0	113.3	S899 S900 I901 Y905 R906	S899-G903 PolarHBondContact O-N 2.94Å; S900-G903 PolarHBondContact O-N 3.49Å; I901-G903 VanDerWaalsContact C-N 3.31Å; I901-G903 PolarHBondContact O-N 3.5Å; G903-Y905 PolarHBondContact O-N 3.39Å; G903-R906 PolarHBondContact O-N 2.88Å
904	S	95.4	Very high	96.5	Very high	82 Å²	82	42.1 Å²	42.1	57%	0.573	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.7	177.7	-55.6	0	0	0	0	114.2	I901 Y902	I901-S904 PolarHBondContact O-N 3.41Å; I901-S904 PolarHBondContact O-OG 3.5Å; Y902-S904 PolarHBondContact O-N 2.94Å; Y902-S904 VanDerWaalsContact O-N 3.11Å
905	Y	96.6	Very high	96.4	Very high	77 Å²	77	47.2 Å²	47.2	30%	0.302	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-1.7	-176.9	-64	-90.7	0	0	0	113.2	T793 V796 Y902 G903 F908 P912 H913	T793-Y905 WeakPolarHBondContact CB-O 3.37Å; V796-Y905 HydrophobicContact CB-CG 4.3Å; V796-Y905 HydrophobicContact CG1-CD1 4.1Å; V796-Y905 HydrophobicContact CG1-CD2 4.14Å; V796-Y905 HydrophobicContact CG1-CE1 4.31Å; V796-Y905 HydrophobicContact CG1-CE2 4.35Å; V796-Y905 HydrophobicContact CG1-CG 4Å; V796-Y905 HydrophobicContact CG2-CD1 4.22Å; V796-Y905 HydrophobicContact CG2-CG 4.38Å; Y902-Y905 HydrophobicContact CD1-CD2 4.35Å; Y902-Y905 HydrophobicContact CD1-CE2 4.48Å; Y902-Y905 PolarHBondContact O-N 3.16Å; G903-Y905 PolarHBondContact O-N 3.39Å; Y905-F908 HydrophobicContact CD1-CZ 4.49Å; Y905-P912 HydrophobicContact CD1-CB 4.27Å; Y905-P912 HydrophobicContact CD1-CG 4.06Å; Y905-P912 HydrophobicContact CE1-CB 3.89Å; Y905-P912 HydrophobicContact CE1-CG 3.91Å; Y905-H913 PolarHBondContact O-NE2 3.43Å
906	R	95	Very high	96.5	Very high	64 Å²	64	46.2 Å²	46.2	24%	0.242	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-21.5	-172.8	-57.5	-54.8	-59.2	-92.2	0.5	114.5	E790 D791 T793 G903	E790-R906 IonicContact OE2-CZ 2.85Å; E790-R906 IonicContact OE2-NH1 3.58Å; E790-R906 PolarHBondContact OE2-NH1 2.91Å; E790-R906 IonicContact OE2-NH2 2.73Å; E790-R906 PolarHBondContact OE2-NH2 3.34Å; D791-R906 IonicContact OD1-CZ 3.59Å; D791-R906 IonicContact OD1-NE 3.27Å; D791-R906 IonicContact OD1-NH2 2.76Å; D791-R906 PolarHBondContact OD1-NH2 3.04Å; D791-R906 VanDerWaalsContact OD1-NH2 3.14Å; T793-R906 WeakPolarHBondContact OG1-CA 3.44Å; T793-R906 PolarHBondContact OG1-NE 2.75Å; G903-R906 PolarHBondContact O-N 2.88Å
907	N	95.8	Very high	96.5	Very high	129 Å²	129	40.6 Å²	40.6	69%	0.69	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-0.7	-170.6	-55.2	106.1	0	0	0	114.5
908	F	97.8	Very high	96.5	Very high	23 Å²	23	40.3 Å²	40.3	10%	0.101	23%	0.227	C	C	.	.			trans	-154.2	166.6	179.1	75.6	-81.9	0	0	0	111.2	R863 F864 V865 Y905 P912 H913	R863-F908 HydrophobicContact CB-CD2 4.2Å; R863-F908 HydrophobicContact CG-CD2 3.73Å; R863-F908 HydrophobicContact CG-CE2 4.15Å; F864-F908 CarbonylContact O-C 3.56Å; F864-F908 WeakPolarHBondContact O-CA 3.31Å; F864-F908 WeakPolarHBondContact O-CB 3.49Å; V865-F908 HydrophobicContact CG1-CB 4.45Å; Y905-F908 HydrophobicContact CD1-CZ 4.49Å; F908-P912 HydrophobicContact CE2-CG 4.3Å; F908-P912 HydrophobicContact CZ-CG 4.26Å; F908-H913 AromaticContact CD2-CE1 3.93Å; F908-H913 AromaticContact CE2-CE1 3.63Å; F908-H913 AromaticContact CE2-ND1 3.92Å; F908-H913 AromaticContact CZ-CE1 3.82Å; F908-H913 PolarHBondContact O-CE1 3.24Å; F908-H913 PolarHBondContact O-NE2 3Å; F908-H913 VanDerWaalsContact O-NE2 3.16Å
909	V	98.4	Very high	96.3	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-120.4	130.5	164.8	177.1	0	0	0	0	108.6	T793 F851 Y855 R863 F864 H913 F914	T793-V909 HydrophobicContact CG2-CG2 3.78Å; F851-V909 HydrophobicContact CD2-CG2 4.3Å; F851-V909 HydrophobicContact CE2-CB 4.03Å; F851-V909 HydrophobicContact CE2-CG1 3.89Å; F851-V909 HydrophobicContact CE2-CG2 4.26Å; Y855-V909 HydrophobicContact CD1-CG2 4.28Å; Y855-V909 HydrophobicContact CE1-CB 4.47Å; Y855-V909 HydrophobicContact CE1-CG2 3.67Å; R863-V909 CarbonylContact C-O 3.03Å; R863-V909 WeakPolarHBondContact CA-O 3.37Å; F864-V909 HydrophobicContact CB-CB 4.2Å; F864-V909 PolarHBondContact N-O 3.42Å; F864-V909 PolarHBondContact O-N 3.41Å; V909-H913 HydrophobicContact CG1-CB 4.04Å; V909-F914 HydrophobicContact CG1-CE2 3.97Å; V909-F914 HydrophobicContact CG1-CZ 4.32Å
910	G	96.4	Very high	96.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.236	C	C	.	.			trans	-161	-161.9	-178.6	0	0	0	0	0	112.3	H913 F914	G910-H913 PolarHBondContact N-ND1 2.96Å; G910-H913 WeakPolarHBondContact O-CB 3.5Å; G910-H913 PolarHBondContact O-N 2.89Å; G910-F914 VanDerWaalsContact O-CD2 3.22Å; G910-F914 WeakPolarHBondContact O-CD2 3.24Å; G910-F914 PolarHBondContact O-N 3.44Å; G910-F914 VanDerWaalsContact O-N 3.12Å
911	P	96.3	Very high	96.2	Very high	61 Å²	61	41.1 Å²	41.1	40%	0.396	21%	0.214	S	C	.	.	H	α-helix	trans	-47	-44.3	-175.6	-29.6	35.1	0	0	0	116.4	N862 H913 F914 Q915	N862-P911 WeakPolarHBondContact O-CD 3.36Å; P911-H913 VanDerWaalsContact C-N 3.29Å; P911-H913 PolarHBondContact O-N 3Å; P911-F914 PolarHBondContact O-N 3.35Å; P911-Q915 WeakPolarHBondContact O-CB 3.28Å; P911-Q915 PolarHBondContact O-N 2.76Å
912	P	96.1	Very high	96.1	Very high	39 Å²	39	40.2 Å²	40.2	25%	0.253	22%	0.216	S	C	.	.	H	α-helix	trans	-63	-35.2	179.5	24.1	-34.1	0	0	0	112.8	Y905 F908 V916	Y905-P912 HydrophobicContact CD1-CB 4.27Å; Y905-P912 HydrophobicContact CD1-CG 4.06Å; Y905-P912 HydrophobicContact CE1-CB 3.89Å; Y905-P912 HydrophobicContact CE1-CG 3.91Å; F908-P912 HydrophobicContact CE2-CG 4.3Å; F908-P912 HydrophobicContact CZ-CG 4.26Å; P912-V916 WeakPolarHBondContact O-CG2 3.44Å; P912-V916 PolarHBondContact O-N 3.5Å
913	H	97.9	Very high	95.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-70.1	-47.5	176.6	-51.6	85.3	0	0	0	110.9	Y905 F908 V909 G910 P911 Q915 V916 I917	Y905-H913 PolarHBondContact O-NE2 3.43Å; F908-H913 AromaticContact CD2-CE1 3.93Å; F908-H913 AromaticContact CE2-CE1 3.63Å; F908-H913 AromaticContact CE2-ND1 3.92Å; F908-H913 AromaticContact CZ-CE1 3.82Å; F908-H913 PolarHBondContact O-CE1 3.24Å; F908-H913 PolarHBondContact O-NE2 3Å; F908-H913 VanDerWaalsContact O-NE2 3.16Å; V909-H913 HydrophobicContact CG1-CB 4.04Å; G910-H913 PolarHBondContact N-ND1 2.96Å; G910-H913 WeakPolarHBondContact O-CB 3.5Å; G910-H913 PolarHBondContact O-N 2.89Å; P911-H913 VanDerWaalsContact C-N 3.29Å; P911-H913 PolarHBondContact O-N 3Å; H913-Q915 VanDerWaalsContact C-N 3.3Å; H913-Q915 PolarHBondContact O-N 3.34Å; H913-V916 PolarHBondContact O-N 3.39Å; H913-V916 VanDerWaalsContact O-N 3.16Å; H913-I917 VanDerWaalsContact O-CG1 3.27Å; H913-I917 WeakPolarHBondContact O-CG1 3.27Å; H913-I917 PolarHBondContact O-N 3.27Å
914	F	96.8	Very high	95.7	Very high	2 Å²	2	47 Å²	47	1%	0.009	24%	0.237	C	C	.	.	H	α-helix	trans	-61.8	-37	178.4	-73.9	-78.3	0	0	0	112.7	F851 F864 V909 G910 P911 V916 I917 C918 F1006 L1009 I1010 S1013	F851-F914 HydrophobicContact CZ-CZ 4.45Å; F864-F914 HydrophobicContact CD2-CE2 4.4Å; F864-F914 HydrophobicContact CE2-CE2 4.12Å; F864-F914 AromaticContact CE2-CZ 3.99Å; F864-F914 HydrophobicContact CE2-CZ 3.99Å; V909-F914 HydrophobicContact CG1-CE2 3.97Å; V909-F914 HydrophobicContact CG1-CZ 4.32Å; G910-F914 VanDerWaalsContact O-CD2 3.22Å; G910-F914 WeakPolarHBondContact O-CD2 3.24Å; G910-F914 PolarHBondContact O-N 3.44Å; G910-F914 VanDerWaalsContact O-N 3.12Å; P911-F914 PolarHBondContact O-N 3.35Å; F914-V916 PolarHBondContact O-N 3.47Å; F914-I917 PolarHBondContact O-N 3.39Å; F914-C918 VanDerWaalsContact O-CB 3.27Å; F914-C918 WeakPolarHBondContact O-CB 3.5Å; F914-C918 PolarHBondContact O-N 2.92Å; F914-F1006 HydrophobicContact CD1-CD2 4.4Å; F914-F1006 HydrophobicContact CD1-CE2 4.15Å; F914-F1006 AromaticContact CE1-CD2 3.44Å; F914-F1006 HydrophobicContact CE1-CD2 3.44Å; F914-F1006 VanDerWaalsContact CE1-CD2 3.44Å; F914-F1006 AromaticContact CE1-CE2 3.58Å; F914-F1006 HydrophobicContact CE1-CE2 3.58Å; F914-F1006 HydrophobicContact CE1-CG 4.18Å; F914-F1006 HydrophobicContact CE1-CZ 4.44Å; F914-F1006 HydrophobicContact CZ-CD2 4.11Å; F914-L1009 HydrophobicContact CD1-CB 4.22Å; F914-L1009 HydrophobicContact CD2-CB 4.37Å; F914-L1009 HydrophobicContact CE1-CB 3.95Å; F914-L1009 HydrophobicContact CE2-CB 4.16Å; F914-L1009 HydrophobicContact CE2-CD1 3.93Å; F914-L1009 HydrophobicContact CG-CB 4.44Å; F914-L1009 HydrophobicContact CZ-CB 3.95Å; F914-L1009 HydrophobicContact CZ-CD1 3.9Å; F914-I1010 HydrophobicContact CD1-CB 4.34Å; F914-I1010 HydrophobicContact CD1-CD1 4.13Å; F914-S1013 VanDerWaalsContact CB-OG 3.26Å; F914-S1013 WeakPolarHBondContact CB-OG 3.48Å
915	Q	95.5	Very high	95.6	Very high	111 Å²	111	43.1 Å²	43.1	52%	0.519	21%	0.21	S	C	.	.	H	α-helix	trans	-62.6	-41.6	174.7	-171	179.4	13.2	0	0	112	P911 H913 R919	P911-Q915 WeakPolarHBondContact O-CB 3.28Å; P911-Q915 PolarHBondContact O-N 2.76Å; H913-Q915 VanDerWaalsContact C-N 3.3Å; H913-Q915 PolarHBondContact O-N 3.34Å; Q915-R919 WeakPolarHBondContact O-CG 3.38Å; Q915-R919 PolarHBondContact O-N 3.12Å; Q915-R919 VanDerWaalsContact O-N 3.17Å
916	V	97.3	Very high	95.5	Very high	9 Å²	9	39.7 Å²	39.7	6%	0.055	20%	0.197	C	C	.	.	H	α-helix	trans	-69.8	-43.2	177	172	0	0	0	0	111.4	I795 D799 P912 H913 F914 C918 R919 L920	I795-V916 HydrophobicContact CB-CG1 4.48Å; I795-V916 HydrophobicContact CD1-CG1 4.21Å; I795-V916 HydrophobicContact CG1-CG1 3.9Å; I795-V916 HydrophobicContact CG2-CB 4.44Å; I795-V916 HydrophobicContact CG2-CG1 4.13Å; D799-V916 HydrophobicContact CB-CG1 3.68Å; D799-V916 HydrophobicContact CB-CG2 4.15Å; P912-V916 WeakPolarHBondContact O-CG2 3.44Å; P912-V916 PolarHBondContact O-N 3.5Å; H913-V916 PolarHBondContact O-N 3.39Å; H913-V916 VanDerWaalsContact O-N 3.16Å; F914-V916 PolarHBondContact O-N 3.47Å; V916-C918 VanDerWaalsContact C-N 3.27Å; V916-C918 PolarHBondContact O-N 3.05Å; V916-R919 PolarHBondContact O-N 3.28Å; V916-L920 HydrophobicContact CG1-CD1 3.67Å; V916-L920 HydrophobicContact CG1-CG 4.19Å; V916-L920 WeakPolarHBondContact O-CG 3.26Å; V916-L920 PolarHBondContact O-N 3.43Å
917	I	97.3	Very high	95.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.8	-45.9	175.1	-67.5	165.3	0	0	0	109.7	L792 I795 V843 H913 F914 L920 L921 F1006 I1010	L792-I917 HydrophobicContact CD1-CD1 3.93Å; L792-I917 HydrophobicContact CD1-CG1 4.4Å; L792-I917 HydrophobicContact CD2-CD1 4.23Å; L792-I917 HydrophobicContact CG-CD1 4.27Å; I795-I917 HydrophobicContact CD1-CB 4.48Å; I795-I917 HydrophobicContact CD1-CG1 3.62Å; I795-I917 HydrophobicContact CG2-CG1 4.34Å; V843-I917 HydrophobicContact CG1-CG2 4.21Å; H913-I917 VanDerWaalsContact O-CG1 3.27Å; H913-I917 WeakPolarHBondContact O-CG1 3.27Å; H913-I917 PolarHBondContact O-N 3.27Å; F914-I917 PolarHBondContact O-N 3.39Å; I917-L920 PolarHBondContact O-N 3.35Å; I917-L921 HydrophobicContact CG2-CD1 4.1Å; I917-L921 HydrophobicContact CG2-CD2 3.77Å; I917-L921 HydrophobicContact CG2-CG 4.45Å; I917-L921 VanDerWaalsContact O-CB 3.28Å; I917-L921 WeakPolarHBondContact O-CB 3.33Å; I917-L921 WeakPolarHBondContact O-CD1 3.32Å; I917-L921 PolarHBondContact O-N 3.26Å; I917-F1006 HydrophobicContact CD1-CE2 4.39Å; I917-F1006 HydrophobicContact CG2-CZ 4.32Å; I917-I1010 HydrophobicContact CB-CD1 4.16Å; I917-I1010 HydrophobicContact CG2-CD1 3.82Å
918	C	95.3	Very high	95.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.1	-52.8	179	-173.5	0	0	0	0	112	F914 V916 L920 G922 I926 I1010 L1014 E1017	F914-C918 VanDerWaalsContact O-CB 3.27Å; F914-C918 WeakPolarHBondContact O-CB 3.5Å; F914-C918 PolarHBondContact O-N 2.92Å; V916-C918 VanDerWaalsContact C-N 3.27Å; V916-C918 PolarHBondContact O-N 3.05Å; C918-L920 PolarHBondContact O-N 3.44Å; C918-G922 PolarHBondContact O-N 2.98Å; C918-I926 HydrophobicContact CB-CD1 4.48Å; C918-I1010 HydrophobicContact CB-CD1 4.04Å; C918-L1014 WeakPolarHBondContact SG-CA 3.3Å; C918-L1014 VanDerWaalsContact SG-CD1 3.57Å; C918-E1017 PolarHBondContact SG-OE2 3.26Å
919	R	93.4	Very high	95.3	Very high	109 Å²	109	33.3 Å²	33.3	41%	0.411	18%	0.177	S	C	.	.	H	α-helix	trans	-60	-43.2	179.3	-72.4	169.1	56.1	-139.8	-14.7	113.3	D799 Q915 V916 E1017	D799-R919 IonicContact OD1-CZ 2.69Å; D799-R919 IonicContact OD1-NH1 2.97Å; D799-R919 IonicContact OD1-NH2 2.66Å; D799-R919 PolarHBondContact OD1-NH2 3.11Å; D799-R919 IonicContact OD2-CZ 3.28Å; D799-R919 IonicContact OD2-NH1 3.58Å; D799-R919 PolarHBondContact OD2-NH1 3.38Å; D799-R919 IonicContact OD2-NH2 2.75Å; D799-R919 PolarHBondContact OD2-NH2 3.08Å; Q915-R919 WeakPolarHBondContact O-CG 3.38Å; Q915-R919 PolarHBondContact O-N 3.12Å; Q915-R919 VanDerWaalsContact O-N 3.17Å; V916-R919 PolarHBondContact O-N 3.28Å; R919-E1017 WeakPolarHBondContact CG-OE1 3.32Å; R919-E1017 VanDerWaalsContact CG-OE2 3.22Å; R919-E1017 WeakPolarHBondContact CG-OE2 3.43Å; R919-E1017 PolarHBondContact N-OE2 3.24Å
920	L	95.6	Very high	95.1	Very high	31 Å²	31	33.7 Å²	33.7	16%	0.162	18%	0.179	C	C	.	.	H	α-helix	trans	-79.8	-30.4	-174.5	-65.9	179	0	0	0	113.3	I795 L798 L802 I839 V916 I917 C918	I795-L920 HydrophobicContact CD1-CD1 4.07Å; I795-L920 HydrophobicContact CG1-CD1 3.95Å; L798-L920 HydrophobicContact CD2-CD1 4.22Å; L802-L920 HydrophobicContact CD1-CD2 4.16Å; I839-L920 HydrophobicContact CG2-CB 4.26Å; I839-L920 HydrophobicContact CG2-CD1 4.23Å; V916-L920 HydrophobicContact CG1-CD1 3.67Å; V916-L920 HydrophobicContact CG1-CG 4.19Å; V916-L920 WeakPolarHBondContact O-CG 3.26Å; V916-L920 PolarHBondContact O-N 3.43Å; I917-L920 PolarHBondContact O-N 3.35Å; C918-L920 PolarHBondContact O-N 3.44Å
921	L	94.4	Very high	95	Very high	14 Å²	14	37.4 Å²	37.4	7%	0.073	20%	0.196	C	C	.	.	H	α-helix	trans	-83.7	-35.7	177.8	-87.3	58.2	0	0	0	112	T840 V843 I917 G925 I926 V929	T840-L921 HydrophobicContact CG2-CG 4.12Å; V843-L921 HydrophobicContact CB-CD1 4.35Å; V843-L921 HydrophobicContact CG1-CD2 4.24Å; V843-L921 HydrophobicContact CG2-CD1 3.92Å; I917-L921 HydrophobicContact CG2-CD1 4.1Å; I917-L921 HydrophobicContact CG2-CD2 3.77Å; I917-L921 HydrophobicContact CG2-CG 4.45Å; I917-L921 VanDerWaalsContact O-CB 3.28Å; I917-L921 WeakPolarHBondContact O-CB 3.33Å; I917-L921 WeakPolarHBondContact O-CD1 3.32Å; I917-L921 PolarHBondContact O-N 3.26Å; L921-G925 WeakPolarHBondContact O-CA 3.39Å; L921-G925 PolarHBondContact O-N 3.41Å; L921-G925 VanDerWaalsContact O-N 3.1Å; L921-I926 HydrophobicContact CB-CG1 4.18Å; L921-V929 HydrophobicContact CD2-CG2 3.87Å
922	G	93.6	Very high	94.9	Very high	28 Å²	28	37.1 Å²	37.1	29%	0.289	19%	0.19	S	C	.	.	H	α-helix	trans	57.8	-172.7	-168.9	0	0	0	0	0	112.7	C918 Q924 G925 I926	C918-G922 PolarHBondContact O-N 2.98Å; G922-Q924 VanDerWaalsContact C-N 3.35Å; G922-Q924 PolarHBondContact O-N 3.03Å; G922-G925 PolarHBondContact O-N 3.49Å; G922-I926 WeakPolarHBondContact O-CD1 3.35Å; G922-I926 VanDerWaalsContact O-CG1 3.24Å; G922-I926 WeakPolarHBondContact O-CG1 3.47Å; G922-I926 PolarHBondContact O-N 2.93Å
923	Y	93.3	Very high	94.9	Very high	97 Å²	97	35.4 Å²	35.4	38%	0.38	18%	0.178	S	C	.	.	H	α-helix	trans	-56.1	-46.3	-178.1	-66.4	-70.9	0	0	0	113.4	G925 I926 A927 L1014 E1018 R1085 L1086	Y923-G925 PolarHBondContact O-N 2.84Å; Y923-I926 PolarHBondContact O-N 3.16Å; Y923-A927 VanDerWaalsContact O-CB 3.32Å; Y923-A927 WeakPolarHBondContact O-CB 3.45Å; Y923-A927 PolarHBondContact O-N 3.39Å; Y923-L1014 HydrophobicContact CD1-CD1 4.3Å; Y923-L1014 HydrophobicContact CD1-CD2 4.08Å; Y923-L1014 HydrophobicContact CE1-CD1 3.8Å; Y923-L1014 HydrophobicContact CE1-CD2 3.91Å; Y923-L1014 HydrophobicContact CE1-CG 4.23Å; Y923-E1018 VanDerWaalsContact CE1-OE1 3.26Å; Y923-E1018 WeakPolarHBondContact CE1-OE1 3.28Å; Y923-E1018 VanDerWaalsContact CZ-OE1 3.28Å; Y923-E1018 VanDerWaalsContact OH-CD 3.31Å; Y923-E1018 WeakPolarHBondContact OH-CG 3.38Å; Y923-E1018 PolarHBondContact OH-OE1 2.98Å; Y923-R1085 VanDerWaalsContact OH-CZ 3.25Å; Y923-R1085 PolarHBondContact OH-NE 2.82Å; Y923-R1085 PolarHBondContact OH-NH2 3.29Å; Y923-L1086 HydrophobicContact CD1-CD1 4.27Å; Y923-L1086 HydrophobicContact CE1-CD1 3.97Å; Y923-L1086 HydrophobicContact CE1-CG 4.2Å
924	Q	91.5	Very high	94.7	Very high	109 Å²	109	35.6 Å²	35.6	51%	0.509	18%	0.179	S	C	.	.	H	α-helix	trans	-66.2	-39.8	-176.3	178.6	168.6	-18.4	0	0	112.2	P835 Y836 G922 V928	P835-Q924 PolarHBondContact O-NE2 3.47Å; Y836-Q924 HydrophobicContact CD1-CG 4.25Å; Y836-Q924 HydrophobicContact CE1-CG 3.69Å; G922-Q924 VanDerWaalsContact C-N 3.35Å; G922-Q924 PolarHBondContact O-N 3.03Å; Q924-V928 PolarHBondContact O-N 3.16Å
925	G	93.5	Very high	94.7	Very high	2 Å²	2	41 Å²	41	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-68.5	-42.4	175.5	0	0	0	0	0	112.5	L921 G922 Y923 A927 V928 V929	L921-G925 WeakPolarHBondContact O-CA 3.39Å; L921-G925 PolarHBondContact O-N 3.41Å; L921-G925 VanDerWaalsContact O-N 3.1Å; G922-G925 PolarHBondContact O-N 3.49Å; Y923-G925 PolarHBondContact O-N 2.84Å; G925-A927 VanDerWaalsContact C-N 3.35Å; G925-A927 PolarHBondContact O-N 3.27Å; G925-V928 WeakPolarHBondContact O-CG1 3.42Å; G925-V928 PolarHBondContact O-N 2.87Å; G925-V929 VanDerWaalsContact O-CG2 3.31Å; G925-V929 WeakPolarHBondContact O-CG2 3.27Å; G925-V929 PolarHBondContact O-N 3.42Å; G925-V929 VanDerWaalsContact O-N 3.08Å
926	I	95	Very high	94.7	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-63	-43.9	177.3	-65.9	165.7	0	0	0	110.5	C918 L921 G922 Y923 V928 V929 M930 I1010 L1014	C918-I926 HydrophobicContact CB-CD1 4.48Å; L921-I926 HydrophobicContact CB-CG1 4.18Å; G922-I926 WeakPolarHBondContact O-CD1 3.35Å; G922-I926 VanDerWaalsContact O-CG1 3.24Å; G922-I926 WeakPolarHBondContact O-CG1 3.47Å; G922-I926 PolarHBondContact O-N 2.93Å; Y923-I926 PolarHBondContact O-N 3.16Å; I926-V928 PolarHBondContact O-N 3.03Å; I926-V929 PolarHBondContact O-N 3.4Å; I926-M930 HydrophobicContact CG2-CE 4.24Å; I926-M930 HydrophobicContact CG2-CG 4.37Å; I926-M930 HydrophobicContact CG2-SD 4.2Å; I926-M930 WeakPolarHBondContact O-CB 3.38Å; I926-M930 WeakPolarHBondContact O-CG 3.48Å; I926-M930 PolarHBondContact O-N 2.88Å; I926-I1010 HydrophobicContact CD1-CG1 4.36Å; I926-I1010 HydrophobicContact CG1-CG1 4.2Å; I926-I1010 HydrophobicContact CG2-CG1 4.35Å; I926-I1010 HydrophobicContact CG2-CG2 4.3Å; I926-L1014 HydrophobicContact CD1-CD1 4.16Å; I926-L1014 HydrophobicContact CD1-CD2 4.12Å
927	A	93.4	Very high	94.7	Very high	52 Å²	52	36.5 Å²	36.5	43%	0.43	18%	0.183	S	C	.	.	H	α-helix	trans	-60	-47.1	179.3	0	0	0	0	0	112.2	Y923 G925 M930 E931	Y923-A927 VanDerWaalsContact O-CB 3.32Å; Y923-A927 WeakPolarHBondContact O-CB 3.45Å; Y923-A927 PolarHBondContact O-N 3.39Å; G925-A927 VanDerWaalsContact C-N 3.35Å; G925-A927 PolarHBondContact O-N 3.27Å; A927-M930 PolarHBondContact O-N 3.22Å; A927-E931 WeakPolarHBondContact O-CG 3.43Å; A927-E931 PolarHBondContact O-N 3.29Å
928	V	94.6	Very high	94.6	Very high	28 Å²	28	40.9 Å²	40.9	17%	0.17	20%	0.202	C	C	.	.	H	α-helix	trans	-66	-39.6	178.6	67.7	0	0	0	0	111.8	Y836 T840 Q924 G925 I926 E931 E932	Y836-V928 HydrophobicContact CD1-CB 4.33Å; Y836-V928 HydrophobicContact CD1-CG1 3.68Å; Y836-V928 HydrophobicContact CE1-CB 3.6Å; Y836-V928 HydrophobicContact CE1-CG1 3.42Å; Y836-V928 VanDerWaalsContact CE1-CG1 3.42Å; Y836-V928 HydrophobicContact CE1-CG2 4.07Å; Y836-V928 HydrophobicContact CE2-CB 4.48Å; Y836-V928 HydrophobicContact CE2-CG2 4.06Å; Y836-V928 HydrophobicContact CG-CG1 4.39Å; T840-V928 HydrophobicContact CG2-CG1 4.15Å; Q924-V928 PolarHBondContact O-N 3.16Å; G925-V928 WeakPolarHBondContact O-CG1 3.42Å; G925-V928 PolarHBondContact O-N 2.87Å; I926-V928 PolarHBondContact O-N 3.03Å; V928-E931 PolarHBondContact O-N 2.83Å; V928-E932 HydrophobicContact CG2-CG 4.35Å; V928-E932 WeakPolarHBondContact O-CG 3.49Å; V928-E932 PolarHBondContact O-N 3.37Å
929	V	95.9	Very high	94.7	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.012	23%	0.23	C	C	.	.	H	α-helix	trans	-63.3	-44.6	177	171.1	0	0	0	0	110.7	F844 L847 L921 G925 I926 E931 E932 L933 F1006	F844-V929 HydrophobicContact CB-CG2 4.37Å; L847-V929 HydrophobicContact CD1-CG1 3.6Å; L921-V929 HydrophobicContact CD2-CG2 3.87Å; G925-V929 VanDerWaalsContact O-CG2 3.31Å; G925-V929 WeakPolarHBondContact O-CG2 3.27Å; G925-V929 PolarHBondContact O-N 3.42Å; G925-V929 VanDerWaalsContact O-N 3.08Å; I926-V929 PolarHBondContact O-N 3.4Å; V929-E931 PolarHBondContact O-N 3.5Å; V929-E932 PolarHBondContact O-N 3.23Å; V929-L933 HydrophobicContact CG1-CD1 4.01Å; V929-L933 HydrophobicContact CG1-CG 4.27Å; V929-L933 WeakPolarHBondContact O-CB 3.27Å; V929-L933 VanDerWaalsContact O-CG 3.24Å; V929-L933 WeakPolarHBondContact O-CG 3.48Å; V929-L933 PolarHBondContact O-N 2.69Å; V929-F1006 HydrophobicContact CG1-CD1 4.44Å; V929-F1006 HydrophobicContact CG1-CE1 3.71Å; V929-F1006 HydrophobicContact CG1-CZ 4.34Å
930	M	94.4	Very high	94.8	Very high	9 Å²	9	40.7 Å²	40.7	4%	0.044	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-42.7	176.1	-76.3	-174.1	162.6	0	0	112.4	I926 A927 L933 L934 C1007 I1010 E1011 M1092 I1096	I926-M930 HydrophobicContact CG2-CE 4.24Å; I926-M930 HydrophobicContact CG2-CG 4.37Å; I926-M930 HydrophobicContact CG2-SD 4.2Å; I926-M930 WeakPolarHBondContact O-CB 3.38Å; I926-M930 WeakPolarHBondContact O-CG 3.48Å; I926-M930 PolarHBondContact O-N 2.88Å; A927-M930 PolarHBondContact O-N 3.22Å; M930-L933 PolarHBondContact O-N 2.99Å; M930-L934 WeakPolarHBondContact O-CG 3.37Å; M930-L934 PolarHBondContact O-N 2.6Å; M930-C1007 HydrophobicContact CE-CB 4.16Å; M930-C1007 WeakPolarHBondContact CE-O 3.38Å; M930-I1010 HydrophobicContact CE-CG2 3.6Å; M930-E1011 HydrophobicContact CE-CB 4.42Å; M930-M1092 HydrophobicContact CE-CE 3.91Å; M930-M1092 HydrophobicContact CE-SD 4.27Å; M930-M1092 HydrophobicContact SD-CE 4.32Å; M930-M1092 HydrophobicContact SD-SD 3.92Å; M930-I1096 HydrophobicContact CB-CD1 4.45Å; M930-I1096 HydrophobicContact SD-CD1 4.47Å
931	E	94.2	Very high	94.8	Very high	77 Å²	77	39.2 Å²	39.2	36%	0.36	21%	0.208	S	C	.	.	H	α-helix	trans	-64.3	-42.5	176.9	-74.5	-67	169.6	0	0	112.5	A927 V928 V929 L934 K935 R1099	A927-E931 WeakPolarHBondContact O-CG 3.43Å; A927-E931 PolarHBondContact O-N 3.29Å; V928-E931 PolarHBondContact O-N 2.83Å; V929-E931 PolarHBondContact O-N 3.5Å; E931-L934 WeakPolarHBondContact O-CB 3.36Å; E931-L934 PolarHBondContact O-N 2.96Å; E931-K935 WeakPolarHBondContact O-CG 3.45Å; E931-K935 PolarHBondContact O-N 2.74Å; E931-K935 VanDerWaalsContact O-N 3.1Å; E931-R1099 IonicContact OE1-CZ 3.31Å; E931-R1099 IonicContact OE1-NH1 3.45Å; E931-R1099 PolarHBondContact OE1-NH1 3.13Å; E931-R1099 IonicContact OE1-NH2 2.74Å; E931-R1099 IonicContact OE2-CZ 2.84Å; E931-R1099 IonicContact OE2-NH1 3.25Å; E931-R1099 PolarHBondContact OE2-NH1 3.16Å; E931-R1099 IonicContact OE2-NH2 2.78Å; E931-R1099 PolarHBondContact OE2-NH2 2.98Å
932	E	94.8	Very high	94.8	Very high	56 Å²	56	42.5 Å²	42.5	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-68.4	-39	176.4	-67.5	-55.1	136.6	0	0	111.7	F844 V928 V929 L934 K935 V936	F844-E932 HydrophobicContact CD2-CB 3.9Å; F844-E932 HydrophobicContact CE1-CB 4.37Å; F844-E932 HydrophobicContact CE1-CG 4.48Å; F844-E932 HydrophobicContact CE2-CB 3.27Å; F844-E932 HydrophobicContact CE2-CG 4.16Å; F844-E932 HydrophobicContact CZ-CB 3.55Å; F844-E932 HydrophobicContact CZ-CG 4.11Å; V928-E932 HydrophobicContact CG2-CG 4.35Å; V928-E932 WeakPolarHBondContact O-CG 3.49Å; V928-E932 PolarHBondContact O-N 3.37Å; V929-E932 PolarHBondContact O-N 3.23Å; E932-L934 VanDerWaalsContact C-N 3.31Å; E932-L934 PolarHBondContact O-N 3.09Å; E932-K935 WeakPolarHBondContact O-CA 3.49Å; E932-K935 WeakPolarHBondContact O-CB 3.49Å; E932-K935 PolarHBondContact O-N 3.31Å; E932-K935 IonicContact OE1-NZ 3.49Å; E932-K935 PolarHBondContact OE1-NZ 3.42Å; E932-K935 WeakPolarHBondContact OE2-CD 3.41Å; E932-K935 IonicContact OE2-NZ 3.76Å; E932-V936 WeakPolarHBondContact O-CG2 3.3Å; E932-V936 PolarHBondContact O-N 3.43Å
933	L	95.4	Very high	94.9	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-61.6	-38.7	172.9	-72.3	179.1	0	0	0	111.9	L852 V929 M930 K935 V936 V937 A1003 F1006	L852-L933 HydrophobicContact CD1-CD2 3.83Å; L852-L933 HydrophobicContact CD2-CD2 4.44Å; V929-L933 HydrophobicContact CG1-CD1 4.01Å; V929-L933 HydrophobicContact CG1-CG 4.27Å; V929-L933 WeakPolarHBondContact O-CB 3.27Å; V929-L933 VanDerWaalsContact O-CG 3.24Å; V929-L933 WeakPolarHBondContact O-CG 3.48Å; V929-L933 PolarHBondContact O-N 2.69Å; M930-L933 PolarHBondContact O-N 2.99Å; L933-K935 VanDerWaalsContact C-N 3.3Å; L933-K935 PolarHBondContact O-N 3.18Å; L933-V936 PolarHBondContact O-N 3.43Å; L933-V937 WeakPolarHBondContact O-CG2 3.31Å; L933-V937 PolarHBondContact O-N 3.28Å; L933-A1003 HydrophobicContact CD2-CB 4.2Å; L933-F1006 HydrophobicContact CD1-CB 4.27Å; L933-F1006 HydrophobicContact CD1-CD1 3.48Å; L933-F1006 VanDerWaalsContact CD1-CD1 3.48Å; L933-F1006 HydrophobicContact CD1-CE1 4.18Å; L933-F1006 HydrophobicContact CD1-CG 4.11Å
934	L	94.6	Very high	94.9	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-61	-38.4	172.1	-80.6	175.6	0	0	0	112.2	M930 E931 E932 V937 K938 I1096 I1100 F1103	M930-L934 WeakPolarHBondContact O-CG 3.37Å; M930-L934 PolarHBondContact O-N 2.6Å; E931-L934 WeakPolarHBondContact O-CB 3.36Å; E931-L934 PolarHBondContact O-N 2.96Å; E932-L934 VanDerWaalsContact C-N 3.31Å; E932-L934 PolarHBondContact O-N 3.09Å; L934-V937 PolarHBondContact O-N 3.15Å; L934-K938 VanDerWaalsContact O-CB 3.31Å; L934-K938 WeakPolarHBondContact O-CB 3.4Å; L934-K938 PolarHBondContact O-N 2.75Å; L934-I1096 HydrophobicContact CD1-CD1 3.78Å; L934-I1096 HydrophobicContact CD2-CD1 4.41Å; L934-I1096 HydrophobicContact CD2-CG2 3.96Å; L934-I1096 HydrophobicContact CG-CD1 4.14Å; L934-I1100 HydrophobicContact CD2-CD1 3.89Å; L934-I1100 HydrophobicContact CD2-CG1 3.61Å; L934-F1103 HydrophobicContact CD2-CE2 4.32Å
935	K	95.5	Very high	95.2	Very high	115 Å²	115	36 Å²	36	50%	0.5	20%	0.202	S	C	.	.	H	α-helix	trans	-67.1	-39.7	174.7	-67.9	170.9	-172.6	169.9	0	111.8	E931 E932 L933 K938 S939	E931-K935 WeakPolarHBondContact O-CG 3.45Å; E931-K935 PolarHBondContact O-N 2.74Å; E931-K935 VanDerWaalsContact O-N 3.1Å; E932-K935 WeakPolarHBondContact O-CA 3.49Å; E932-K935 WeakPolarHBondContact O-CB 3.49Å; E932-K935 PolarHBondContact O-N 3.31Å; E932-K935 IonicContact OE1-NZ 3.49Å; E932-K935 PolarHBondContact OE1-NZ 3.42Å; E932-K935 WeakPolarHBondContact OE2-CD 3.41Å; E932-K935 IonicContact OE2-NZ 3.76Å; L933-K935 VanDerWaalsContact C-N 3.3Å; L933-K935 PolarHBondContact O-N 3.18Å; K935-K938 PolarHBondContact O-N 2.96Å; K935-S939 WeakPolarHBondContact O-CB 3.24Å; K935-S939 PolarHBondContact O-N 3.11Å
936	V	95.5	Very high	95.2	Very high	25 Å²	25	36.9 Å²	36.9	15%	0.152	21%	0.206	C	C	.	.	H	α-helix	trans	-60.9	-50.2	173.8	173.5	0	0	0	0	110.2	L852 E932 L933 K938 S939 L940	L852-V936 HydrophobicContact CD1-CG1 4.19Å; E932-V936 WeakPolarHBondContact O-CG2 3.3Å; E932-V936 PolarHBondContact O-N 3.43Å; L933-V936 PolarHBondContact O-N 3.43Å; V936-K938 VanDerWaalsContact C-N 3.33Å; V936-K938 PolarHBondContact O-N 3.36Å; V936-S939 WeakPolarHBondContact O-CB 3.36Å; V936-S939 PolarHBondContact O-N 3.32Å; V936-S939 VanDerWaalsContact O-N 3.16Å; V936-L940 HydrophobicContact CG1-CD1 4.08Å; V936-L940 WeakPolarHBondContact O-CG 3.46Å; V936-L940 PolarHBondContact O-N 3.32Å
937	V	97	Very high	95.2	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.012	23%	0.232	C	C	.	.	H	α-helix	trans	-60.1	-43.2	177.6	171.3	0	0	0	0	111.3	L933 L934 S939 L940 L941 V1000 A1003 I1100	L933-V937 WeakPolarHBondContact O-CG2 3.31Å; L933-V937 PolarHBondContact O-N 3.28Å; L934-V937 PolarHBondContact O-N 3.15Å; V937-S939 PolarHBondContact O-N 2.9Å; V937-L940 PolarHBondContact O-N 3.23Å; V937-L941 HydrophobicContact CG1-CD1 3.61Å; V937-L941 HydrophobicContact CG1-CG 4.13Å; V937-L941 VanDerWaalsContact O-CB 3.32Å; V937-L941 WeakPolarHBondContact O-CB 3.4Å; V937-L941 WeakPolarHBondContact O-CG 3.36Å; V937-L941 PolarHBondContact O-N 3.05Å; V937-V1000 HydrophobicContact CG1-CG1 4.06Å; V937-V1000 HydrophobicContact CG2-CG1 4.37Å; V937-A1003 HydrophobicContact CG2-CB 3.79Å; V937-I1100 HydrophobicContact CG1-CD1 4.1Å; V937-I1100 HydrophobicContact CG1-CG1 4.1Å; V937-I1100 HydrophobicContact CG1-CG2 4.2Å
938	K	96.9	Very high	95.3	Very high	91 Å²	91	41.8 Å²	41.8	40%	0.396	22%	0.218	S	C	.	.	H	α-helix	trans	-58.9	-47.6	174.9	-175.8	179.4	178.3	179.2	0	111.6	L934 K935 V936 L940 L941 Q942 F1103	L934-K938 VanDerWaalsContact O-CB 3.31Å; L934-K938 WeakPolarHBondContact O-CB 3.4Å; L934-K938 PolarHBondContact O-N 2.75Å; K935-K938 PolarHBondContact O-N 2.96Å; V936-K938 VanDerWaalsContact C-N 3.33Å; V936-K938 PolarHBondContact O-N 3.36Å; K938-L940 PolarHBondContact O-N 3.11Å; K938-L941 PolarHBondContact O-N 2.97Å; K938-Q942 HydrophobicContact CG-CG 4.42Å; K938-Q942 WeakPolarHBondContact O-CB 3.43Å; K938-Q942 WeakPolarHBondContact O-CG 3.42Å; K938-Q942 PolarHBondContact O-N 3.32Å; K938-F1103 HydrophobicContact CB-CD1 4.33Å; K938-F1103 HydrophobicContact CB-CD2 3.7Å; K938-F1103 HydrophobicContact CB-CE1 4.3Å; K938-F1103 HydrophobicContact CB-CE2 3.66Å; K938-F1103 HydrophobicContact CB-CG 4.06Å; K938-F1103 HydrophobicContact CB-CZ 3.98Å; K938-F1103 HydrophobicContact CD-CD1 4.05Å; K938-F1103 HydrophobicContact CD-CE1 3.89Å; K938-F1103 HydrophobicContact CD-CZ 4.24Å; K938-F1103 HydrophobicContact CG-CD1 3.92Å; K938-F1103 HydrophobicContact CG-CD2 4.12Å; K938-F1103 HydrophobicContact CG-CE1 4.13Å; K938-F1103 HydrophobicContact CG-CE2 4.31Å; K938-F1103 HydrophobicContact CG-CG 3.94Å; K938-F1103 HydrophobicContact CG-CZ 4.32Å
939	S	96.3	Very high	95.3	Very high	83 Å²	83	40.6 Å²	40.6	58%	0.58	21%	0.212	S	C	*	.	H	α-helix	trans	-59	-46.8	179.2	-175.4	0	0	0	0	111.5	K935 V936 V937 G943	K935-S939 WeakPolarHBondContact O-CB 3.24Å; K935-S939 PolarHBondContact O-N 3.11Å; V936-S939 WeakPolarHBondContact O-CB 3.36Å; V936-S939 PolarHBondContact O-N 3.32Å; V936-S939 VanDerWaalsContact O-N 3.16Å; V937-S939 PolarHBondContact O-N 2.9Å; S939-G943 VanDerWaalsContact O-CA 3.3Å; S939-G943 WeakPolarHBondContact O-CA 3.33Å; S939-G943 PolarHBondContact O-N 3.38Å
940	L	95.9	Very high	95.2	Very high	22 Å²	22	44.6 Å²	44.6	12%	0.115	23%	0.229	C	C	.	.	H	α-helix	trans	-67	-47.8	178.7	-69	174.5	0	0	0	112.1	V936 V937 K938 Q942 T944 I945 E999 V1000	V936-L940 HydrophobicContact CG1-CD1 4.08Å; V936-L940 WeakPolarHBondContact O-CG 3.46Å; V936-L940 PolarHBondContact O-N 3.32Å; V937-L940 PolarHBondContact O-N 3.23Å; K938-L940 PolarHBondContact O-N 3.11Å; L940-Q942 PolarHBondContact O-N 3.34Å; L940-T944 PolarHBondContact O-N 3.33Å; L940-I945 HydrophobicContact CB-CD1 3.95Å; L940-I945 HydrophobicContact CB-CG1 4.45Å; L940-I945 VanDerWaalsContact O-CB 3.26Å; L940-I945 WeakPolarHBondContact O-CB 3.18Å; L940-I945 WeakPolarHBondContact O-CG1 3.47Å; L940-I945 PolarHBondContact O-N 3.01Å; L940-E999 HydrophobicContact CD1-CB 3.95Å; L940-V1000 HydrophobicContact CB-CG2 3.93Å; L940-V1000 HydrophobicContact CD1-CG2 3.83Å
941	L	95	Very high	95.2	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.1	-35.1	-177.8	-72.7	178	0	0	0	113.2	V937 K938 I945 L946 I1100 L1104 M1163 I1164	V937-L941 HydrophobicContact CG1-CD1 3.61Å; V937-L941 HydrophobicContact CG1-CG 4.13Å; V937-L941 VanDerWaalsContact O-CB 3.32Å; V937-L941 WeakPolarHBondContact O-CB 3.4Å; V937-L941 WeakPolarHBondContact O-CG 3.36Å; V937-L941 PolarHBondContact O-N 3.05Å; K938-L941 PolarHBondContact O-N 2.97Å; L941-I945 HydrophobicContact CD2-CD1 4.02Å; L941-I945 HydrophobicContact CD2-CG2 4.46Å; L941-L946 VanDerWaalsContact O-CB 3.27Å; L941-L946 WeakPolarHBondContact O-CB 3.36Å; L941-L946 PolarHBondContact O-N 3.11Å; L941-I1100 HydrophobicContact CD1-CG2 3.76Å; L941-L1104 HydrophobicContact CD1-CD2 4.2Å; L941-L1104 HydrophobicContact CD2-CD2 4.37Å; L941-M1163 HydrophobicContact CD1-CE 4.47Å; L941-I1164 HydrophobicContact CD2-CD1 3.81Å; L941-I1164 HydrophobicContact CD2-CG1 4.26Å
942	Q	94.9	Very high	95.2	Very high	84 Å²	84	43.3 Å²	43.3	39%	0.393	23%	0.226	S	C	.	.	H	α-helix	trans	-93.9	-16.1	-179.8	-62.3	-173.9	-28.1	0	0	113.4	K938 L940 F1103	K938-Q942 HydrophobicContact CG-CG 4.42Å; K938-Q942 WeakPolarHBondContact O-CB 3.43Å; K938-Q942 WeakPolarHBondContact O-CG 3.42Å; K938-Q942 PolarHBondContact O-N 3.32Å; L940-Q942 PolarHBondContact O-N 3.34Å; Q942-F1103 HydrophobicContact CG-CB 4.44Å; Q942-F1103 WeakPolarHBondContact CG-O 3.47Å; Q942-F1103 PolarHBondContact NE2-O 3.26Å; Q942-F1103 VanDerWaalsContact NE2-O 3.12Å
943	G	95.1	Very high	95	Very high	36 Å²	36	41.1 Å²	41.1	37%	0.371	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-102.5	179.2	0	0	0	0	0	112.1	S939 L946 Q947	S939-G943 VanDerWaalsContact O-CA 3.3Å; S939-G943 WeakPolarHBondContact O-CA 3.33Å; S939-G943 PolarHBondContact O-N 3.38Å; G943-L946 PolarHBondContact O-N 2.97Å; G943-Q947 WeakPolarHBondContact O-CB 3.28Å; G943-Q947 PolarHBondContact O-N 3.3Å; G943-Q947 VanDerWaalsContact O-N 3.09Å
944	T	94.1	Very high	94.8	Very high	53 Å²	53	47.1 Å²	47.1	33%	0.325	24%	0.244	S	C	.	.	H	α-helix	trans	-65.3	-45.5	-171	53.2	0	0	0	0	112.2	L940 L946 Q947 Y948 N996	L940-T944 PolarHBondContact O-N 3.33Å; T944-L946 PolarHBondContact O-N 3.36Å; T944-Q947 PolarHBondContact O-N 3.45Å; T944-Y948 VanDerWaalsContact O-CD2 3.27Å; T944-Y948 WeakPolarHBondContact O-CD2 3.35Å; T944-Y948 PolarHBondContact O-N 2.95Å; T944-N996 PolarHBondContact OG1-ND2 3.37Å
945	I	96.3	Very high	94.8	Very high	8 Å²	8	49.2 Å²	49.2	4%	0.041	26%	0.257	C	S	.	.	H	α-helix	trans	-64.1	-44.8	-178.5	-59	173.8	0	0	0	110.1	L940 L941 Q947 Y948 V949 N996 L997 V1000 W1109	L940-I945 HydrophobicContact CB-CD1 3.95Å; L940-I945 HydrophobicContact CB-CG1 4.45Å; L940-I945 VanDerWaalsContact O-CB 3.26Å; L940-I945 WeakPolarHBondContact O-CB 3.18Å; L940-I945 WeakPolarHBondContact O-CG1 3.47Å; L940-I945 PolarHBondContact O-N 3.01Å; L941-I945 HydrophobicContact CD2-CD1 4.02Å; L941-I945 HydrophobicContact CD2-CG2 4.46Å; I945-Q947 VanDerWaalsContact C-N 3.32Å; I945-Q947 PolarHBondContact O-N 2.95Å; I945-Y948 PolarHBondContact O-N 3.49Å; I945-V949 HydrophobicContact CG2-CG2 4.08Å; I945-V949 WeakPolarHBondContact O-CB 3.32Å; I945-V949 VanDerWaalsContact O-CG2 3.25Å; I945-V949 WeakPolarHBondContact O-CG2 3.27Å; I945-V949 PolarHBondContact O-N 2.84Å; I945-N996 HydrophobicContact CD1-CB 4.02Å; I945-N996 HydrophobicContact CG1-CB 3.71Å; I945-L997 HydrophobicContact CD1-CD2 4.19Å; I945-L997 HydrophobicContact CG2-CD2 4.29Å; I945-V1000 HydrophobicContact CD1-CG2 3.7Å; I945-W1109 HydrophobicContact CG2-CH2 4.07Å
946	L	95.5	Very high	94.6	Very high	21 Å²	21	44 Å²	44	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-58.4	-44	176.8	-177.8	58.9	0	0	0	112.2	L941 G943 T944 Y948 V949 K950 D1106 I1108 W1109	L941-L946 VanDerWaalsContact O-CB 3.27Å; L941-L946 WeakPolarHBondContact O-CB 3.36Å; L941-L946 PolarHBondContact O-N 3.11Å; G943-L946 PolarHBondContact O-N 2.97Å; T944-L946 PolarHBondContact O-N 3.36Å; L946-Y948 PolarHBondContact O-N 3.01Å; L946-V949 PolarHBondContact O-N 3.19Å; L946-K950 HydrophobicContact CD1-CD 4.39Å; L946-K950 HydrophobicContact CD1-CG 4.4Å; L946-K950 HydrophobicContact CG-CD 4.3Å; L946-K950 WeakPolarHBondContact O-CG 3.27Å; L946-K950 PolarHBondContact O-N 3.04Å; L946-D1106 HydrophobicContact CD1-CB 3.96Å; L946-D1106 HydrophobicContact CD2-CB 4.28Å; L946-I1108 HydrophobicContact CD1-CG2 3.59Å; L946-W1109 HydrophobicContact CB-CZ2 4.39Å; L946-W1109 HydrophobicContact CD1-CZ2 3.85Å
947	Q	94.9	Very high	94.5	Very high	121 Å²	121	43.9 Å²	43.9	57%	0.565	24%	0.235	S	C	*	.	H	α-helix	trans	-59.8	-46.8	178.6	-178.8	-178.3	-9.5	0	0	111.5	G943 T944 I945 K950 T951	G943-Q947 WeakPolarHBondContact O-CB 3.28Å; G943-Q947 PolarHBondContact O-N 3.3Å; G943-Q947 VanDerWaalsContact O-N 3.09Å; T944-Q947 PolarHBondContact O-N 3.45Å; I945-Q947 VanDerWaalsContact C-N 3.32Å; I945-Q947 PolarHBondContact O-N 2.95Å; Q947-K950 PolarHBondContact O-N 3.36Å; Q947-T951 WeakPolarHBondContact O-CB 3.18Å; Q947-T951 PolarHBondContact O-N 3.44Å; Q947-T951 PolarHBondContact O-OG1 3.06Å
948	Y	94.2	Very high	94.1	Very high	38 Å²	38	49.7 Å²	49.7	15%	0.149	26%	0.26	C	S	.	.	H	α-helix	trans	-72.6	-32.7	178.9	-81	-101.9	0	0	0	112.3	T944 I945 L946 T951 L952 Y986 E988 V992 C993	T944-Y948 VanDerWaalsContact O-CD2 3.27Å; T944-Y948 WeakPolarHBondContact O-CD2 3.35Å; T944-Y948 PolarHBondContact O-N 2.95Å; I945-Y948 PolarHBondContact O-N 3.49Å; L946-Y948 PolarHBondContact O-N 3.01Å; Y948-T951 PolarHBondContact O-N 2.6Å; Y948-L952 VanDerWaalsContact O-CB 3.28Å; Y948-L952 WeakPolarHBondContact O-CB 3.33Å; Y948-L952 VanDerWaalsContact O-CG 3.25Å; Y948-L952 WeakPolarHBondContact O-CG 3.42Å; Y948-L952 PolarHBondContact O-N 2.91Å; Y948-Y986 HydrophobicContact CD1-CE1 4.02Å; Y948-Y986 AromaticContact CE1-CE1 3.98Å; Y948-Y986 HydrophobicContact CE1-CE1 3.98Å; Y948-E988 HydrophobicContact CE1-CB 4.09Å; Y948-E988 PolarHBondContact OH-OE2 3.49Å; Y948-V992 HydrophobicContact CD2-CG1 4.23Å; Y948-V992 HydrophobicContact CE1-CB 4.19Å; Y948-V992 HydrophobicContact CE1-CG1 4.11Å; Y948-V992 HydrophobicContact CE2-CG1 3.64Å; Y948-C993 WeakPolarHBondContact CD1-SG 3.27Å
949	V	95.3	Very high	93.7	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.024	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-46.4	172.7	167.6	0	0	0	0	110.6	I945 L946 T951 L952 M953 I1108 W1109 F1127 L1130	I945-V949 HydrophobicContact CG2-CG2 4.08Å; I945-V949 WeakPolarHBondContact O-CB 3.32Å; I945-V949 VanDerWaalsContact O-CG2 3.25Å; I945-V949 WeakPolarHBondContact O-CG2 3.27Å; I945-V949 PolarHBondContact O-N 2.84Å; L946-V949 PolarHBondContact O-N 3.19Å; V949-T951 VanDerWaalsContact C-N 3.32Å; V949-T951 PolarHBondContact O-N 2.69Å; V949-L952 PolarHBondContact O-N 3.36Å; V949-M953 WeakPolarHBondContact O-CB 3.5Å; V949-M953 PolarHBondContact O-N 3.45Å; V949-I1108 HydrophobicContact CG1-CG1 4.48Å; V949-I1108 HydrophobicContact CG1-CG2 4.35Å; V949-W1109 HydrophobicContact CB-CH2 4.36Å; V949-W1109 HydrophobicContact CB-CZ3 4.43Å; V949-W1109 HydrophobicContact CG1-CE3 4.35Å; V949-W1109 HydrophobicContact CG1-CH2 4.46Å; V949-W1109 HydrophobicContact CG1-CZ3 4.13Å; V949-W1109 HydrophobicContact CG2-CH2 3.86Å; V949-W1109 HydrophobicContact CG2-CZ3 3.88Å; V949-F1127 HydrophobicContact CG1-CD2 4.19Å; V949-F1127 HydrophobicContact CG2-CD2 4.14Å; V949-F1127 HydrophobicContact CG2-CE2 3.89Å; V949-L1130 HydrophobicContact CB-CD2 4.33Å; V949-L1130 HydrophobicContact CG1-CD2 4.12Å; V949-L1130 HydrophobicContact CG2-CD2 4.15Å
950	K	93.7	Very high	93.5	Very high	86 Å²	86	46.4 Å²	46.4	37%	0.374	24%	0.239	S	C	.	.	H	α-helix	trans	-59.5	-44	174.5	-75	176.5	176	175.8	0	111.8	L946 Q947 E954 D1106 I1108	L946-K950 HydrophobicContact CD1-CD 4.39Å; L946-K950 HydrophobicContact CD1-CG 4.4Å; L946-K950 HydrophobicContact CG-CD 4.3Å; L946-K950 WeakPolarHBondContact O-CG 3.27Å; L946-K950 PolarHBondContact O-N 3.04Å; Q947-K950 PolarHBondContact O-N 3.36Å; K950-E954 PolarHBondContact O-N 2.88Å; K950-D1106 WeakPolarHBondContact CE-OD1 3.36Å; K950-D1106 VanDerWaalsContact CE-OD2 3.27Å; K950-D1106 WeakPolarHBondContact CE-OD2 3.33Å; K950-D1106 IonicContact NZ-OD1 2.7Å; K950-D1106 IonicContact NZ-OD2 2.79Å; K950-D1106 PolarHBondContact NZ-OD2 3.08Å; K950-I1108 HydrophobicContact CG-CB 4.17Å; K950-I1108 HydrophobicContact CG-CG1 3.96Å; K950-I1108 HydrophobicContact CG-CG2 3.96Å
951	T	94.8	Very high	93.3	Very high	58 Å²	58	52.4 Å²	52.4	36%	0.356	26%	0.26	S	S	.	.	H	α-helix	trans	-63.8	-52.1	179.6	-55.4	0	0	0	0	111.1	Q947 Y948 V949 M953 E954 V955	Q947-T951 WeakPolarHBondContact O-CB 3.18Å; Q947-T951 PolarHBondContact O-N 3.44Å; Q947-T951 PolarHBondContact O-OG1 3.06Å; Y948-T951 PolarHBondContact O-N 2.6Å; V949-T951 VanDerWaalsContact C-N 3.32Å; V949-T951 PolarHBondContact O-N 2.69Å; T951-M953 VanDerWaalsContact C-N 3.32Å; T951-M953 PolarHBondContact O-N 2.7Å; T951-E954 PolarHBondContact O-N 3.23Å; T951-V955 WeakPolarHBondContact O-CG2 3.32Å; T951-V955 PolarHBondContact O-N 3.26Å
952	L	93.4	Very high	93.2	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-70.3	-27.1	-177.8	-67.4	172.7	0	0	0	112.8	Y948 V949 E954 V955 M956 I983 Y986 L989 L1130 M1134	Y948-L952 VanDerWaalsContact O-CB 3.28Å; Y948-L952 WeakPolarHBondContact O-CB 3.33Å; Y948-L952 VanDerWaalsContact O-CG 3.25Å; Y948-L952 WeakPolarHBondContact O-CG 3.42Å; Y948-L952 PolarHBondContact O-N 2.91Å; V949-L952 PolarHBondContact O-N 3.36Å; L952-E954 VanDerWaalsContact C-N 3.31Å; L952-V955 CarbonylContact O-C 3.56Å; L952-V955 PolarHBondContact O-N 2.88Å; L952-M956 WeakPolarHBondContact O-CB 3.45Å; L952-M956 PolarHBondContact O-N 3.38Å; L952-I983 HydrophobicContact CB-CD1 4.33Å; L952-I983 HydrophobicContact CD2-CD1 3.99Å; L952-Y986 HydrophobicContact CD2-CD1 3.92Å; L952-Y986 HydrophobicContact CD2-CD2 3.83Å; L952-Y986 HydrophobicContact CD2-CE1 4.12Å; L952-Y986 HydrophobicContact CD2-CE2 4.02Å; L952-Y986 HydrophobicContact CD2-CG 3.78Å; L952-L989 HydrophobicContact CD1-CD1 3.99Å; L952-L1130 HydrophobicContact CB-CD1 3.69Å; L952-L1130 HydrophobicContact CB-CD2 4.08Å; L952-L1130 HydrophobicContact CD1-CD1 4.43Å; L952-M1134 HydrophobicContact CD1-CE 3.58Å
953	M	91.9	Very high	93.2	Very high	10 Å²	10	50.8 Å²	50.8	5%	0.049	26%	0.255	C	S	.	.	H	α-helix	trans	-69	-29.3	174.3	-162	64.9	69.9	0	0	112.3	V949 T951 M956 I1108 L1130	V949-M953 WeakPolarHBondContact O-CB 3.5Å; V949-M953 PolarHBondContact O-N 3.45Å; T951-M953 VanDerWaalsContact C-N 3.32Å; T951-M953 PolarHBondContact O-N 2.7Å; M953-M956 WeakPolarHBondContact O-CB 3.39Å; M953-I1108 HydrophobicContact CB-CD1 4.16Å; M953-I1108 HydrophobicContact CB-CG1 4.46Å; M953-I1108 HydrophobicContact CG-CD1 3.96Å; M953-L1130 HydrophobicContact CE-CB 3.75Å; M953-L1130 HydrophobicContact CE-CD2 4.22Å; M953-L1130 HydrophobicContact SD-CB 4.5Å
954	E	90.9	Very high	93	Very high	128 Å²	128	56.9 Å²	56.9	60%	0.598	27%	0.267	S	S	*	.	H	α-helix	trans	-76.2	-32.3	170.6	-72.6	-57	148.1	0	0	112.8	K950 T951 L952 M956 K958	K950-E954 PolarHBondContact O-N 2.88Å; T951-E954 PolarHBondContact O-N 3.23Å; L952-E954 VanDerWaalsContact C-N 3.31Å; E954-M956 VanDerWaalsContact C-N 3.28Å; E954-K958 IonicContact OE1-NZ 3.92Å; E954-K958 IonicContact OE2-NZ 3.39Å; E954-K958 PolarHBondContact OE2-NZ 3.12Å
955	V	92.9	Very high	92.8	Very high	49 Å²	49	57.9 Å²	57.9	30%	0.297	27%	0.268	S	S	.	.	H	α-helix	trans	-71.6	-24.7	172.6	177.8	0	0	0	0	111.7	T951 L952 D982 I983	T951-V955 WeakPolarHBondContact O-CG2 3.32Å; T951-V955 PolarHBondContact O-N 3.26Å; L952-V955 CarbonylContact O-C 3.56Å; L952-V955 PolarHBondContact O-N 2.88Å; V955-D982 HydrophobicContact CG1-CB 3.46Å; V955-D982 VanDerWaalsContact CG1-CB 3.46Å; V955-I983 HydrophobicContact CB-CD1 4.21Å; V955-I983 HydrophobicContact CG1-CD1 3.87Å
956	M	92.8	Very high	92.5	Very high	4 Å²	4	64.7 Å²	64.7	2%	0.02	30%	0.299	C	S	.	.	S	Bend	trans	-63.8	139.8	-179.4	-160.5	66.1	-163	0	0	111.4	L952 M953 E954 K958 L980 I983 C1124 L1130 A1133 F1179	L952-M956 WeakPolarHBondContact O-CB 3.45Å; L952-M956 PolarHBondContact O-N 3.38Å; M953-M956 WeakPolarHBondContact O-CB 3.39Å; E954-M956 VanDerWaalsContact C-N 3.28Å; M956-K958 PolarHBondContact O-N 3.13Å; M956-L980 HydrophobicContact CE-CD2 3.5Å; M956-L980 VanDerWaalsContact CE-CD2 3.5Å; M956-L980 HydrophobicContact SD-CD2 4.33Å; M956-I983 HydrophobicContact SD-CD1 4.31Å; M956-I983 HydrophobicContact SD-CG1 4.04Å; M956-C1124 HydrophobicContact CE-CB 4.26Å; M956-C1124 HydrophobicContact CG-CB 3.66Å; M956-L1130 HydrophobicContact SD-CD1 4.46Å; M956-A1133 HydrophobicContact CE-CB 3.64Å; M956-A1133 HydrophobicContact SD-CB 3.67Å; M956-F1179 HydrophobicContact CE-CE2 3.7Å; M956-F1179 HydrophobicContact CE-CZ 3.94Å
957	P	92.1	Very high	92.2	Very high	23 Å²	23	71.7 Å²	71.7	15%	0.149	33%	0.325	C	S	.	.			trans	-57.5	127.4	174.5	24.1	-36.7	0	0	0	110.5	I959 C960 Q979 L980 C1124	P957-I959 PolarHBondContact O-N 3.42Å; P957-I959 VanDerWaalsContact O-N 3.09Å; P957-C960 HydrophobicContact CG-CB 4.11Å; P957-Q979 WeakPolarHBondContact CG-O 3.48Å; P957-L980 HydrophobicContact CG-CD2 4.16Å; P957-C1124 WeakPolarHBondContact O-CB 3.5Å
958	K	88.4	Confident	92	Very high	125 Å²	125	66.2 Å²	66.2	54%	0.543	30%	0.301	S	S	.	.	S	Bend	trans	-54.6	-36.4	-176.1	-63.8	-62.8	178.7	-168.9	0	112.8	E954 M956 C1124	E954-K958 IonicContact OE1-NZ 3.92Å; E954-K958 IonicContact OE2-NZ 3.39Å; E954-K958 PolarHBondContact OE2-NZ 3.12Å; M956-K958 PolarHBondContact O-N 3.13Å; K958-C1124 PolarHBondContact O-N 3.25Å
959	I	89.8	Confident	91.9	Very high	104 Å²	104	64.4 Å²	64.4	53%	0.533	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-136.9	129.7	176.1	-55.3	176.2	0	0	0	108.4	P957 D1122	P957-I959 PolarHBondContact O-N 3.42Å; P957-I959 VanDerWaalsContact O-N 3.09Å; I959-D1122 CarbonylContact C-O 3.39Å; I959-D1122 WeakPolarHBondContact CA-O 3.47Å; I959-D1122 HydrophobicContact CG2-CB 3.52Å
960	C	92.4	Very high	91.8	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	30%	0.296	C	S	.	.			trans	-136.6	93.8	175.2	-169.7	0	0	0	0	110.7	P957 D1122 F1179	P957-C960 HydrophobicContact CG-CB 4.11Å; C960-D1122 PolarHBondContact N-O 2.87Å; C960-F1179 HydrophobicContact CB-CE1 4Å; C960-F1179 HydrophobicContact CB-CZ 4.12Å
961	R	91.2	Very high	91.6	Very high	148 Å²	148	62 Å²	62	56%	0.558	29%	0.293	S	S	*	.			trans	-71.5	145.2	179.1	-173.1	171.3	-173.4	177.3	8.6	111.5	P963 F975 D1122	R961-P963 VanDerWaalsContact O-CD 3.28Å; R961-P963 WeakPolarHBondContact O-CD 3.18Å; R961-F975 VanDerWaalsContact O-CE1 3.28Å; R961-F975 WeakPolarHBondContact O-CE1 3.44Å; R961-D1122 WeakPolarHBondContact CA-OD1 3.45Å
962	L	93.3	Very high	91.6	Very high	34 Å²	34	59.3 Å²	59.3	18%	0.178	28%	0.276	C	S	.	.			trans	-77	113.3	168.8	-62	-179.1	0	0	0	109.9	F976 L1177 F1179 H1182	L962-F976 HydrophobicContact CD2-CE1 4.29Å; L962-F976 HydrophobicContact CD2-CZ 3.89Å; L962-L1177 HydrophobicContact CD1-CD2 4.43Å; L962-F1179 HydrophobicContact CD2-CD1 3.98Å; L962-H1182 HydrophobicContact CD1-CB 4.26Å; L962-H1182 HydrophobicContact CD2-CB 3.92Å
963	P	93.6	Very high	91.6	Very high	17 Å²	17	59.3 Å²	59.3	11%	0.11	28%	0.276	C	S	.	.			trans	-65.1	151.6	-178.6	-16.8	30	0	0	0	111.3	R961 Y967 I972 F975 H1182	R961-P963 VanDerWaalsContact O-CD 3.28Å; R961-P963 WeakPolarHBondContact O-CD 3.18Å; P963-Y967 HydrophobicContact CB-CD2 4.07Å; P963-Y967 HydrophobicContact CB-CG 4.21Å; P963-I972 HydrophobicContact CB-CG1 4.04Å; P963-I972 HydrophobicContact CG-CG1 4.26Å; P963-F975 HydrophobicContact CG-CB 4.45Å; P963-F975 HydrophobicContact CG-CD1 3.5Å; P963-F975 VanDerWaalsContact CG-CD1 3.5Å; P963-F975 HydrophobicContact CG-CE1 3.79Å; P963-F975 HydrophobicContact CG-CG 3.92Å; P963-F975 HydrophobicContact CG-CZ 4.42Å; P963-H1182 PolarHBondContact O-CE1 3.21Å; P963-H1182 PolarHBondContact O-NE2 3.28Å
964	R	91.4	Very high	91.7	Very high	163 Å²	163	64.1 Å²	64.1	62%	0.615	30%	0.299	S	S	*	.			trans	-71.1	165.3	-178.6	-56.4	-176.5	169	-176.4	-2.8	111.9	E966 Y967	R964-E966 WeakPolarHBondContact CB-OE2 3.33Å; R964-E966 PolarHBondContact O-N 3.03Å; R964-E966 VanDerWaalsContact O-N 3.16Å; R964-Y967 HydrophobicContact CB-CD2 4.3Å; R964-Y967 HydrophobicContact CB-CE2 4.47Å; R964-Y967 PolarHBondContact O-N 3.4Å
965	H	90.8	Very high	91.8	Very high	75 Å²	75	61.3 Å²	61.3	35%	0.347	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-62.9	-25	-175.3	-70.2	60	0	0	0	112.4	Y967 G968 V1186	H965-Y967 PolarHBondContact O-N 3.23Å; H965-G968 PolarHBondContact O-N 3.13Å; H965-G968 VanDerWaalsContact O-N 3.15Å; H965-V1186 HydrophobicContact CB-CG1 4.49Å
966	E	88.3	Confident	91.9	Very high	151 Å²	151	59 Å²	59	71%	0.706	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-67.3	-21.7	-178.7	-59.9	83.3	174.7	0	0	113.6	R964 G968	R964-E966 WeakPolarHBondContact CB-OE2 3.33Å; R964-E966 PolarHBondContact O-N 3.03Å; R964-E966 VanDerWaalsContact O-N 3.16Å; E966-G968 PolarHBondContact O-N 3.23Å
967	Y	89.5	Confident	91.8	Very high	168 Å²	168	59.6 Å²	59.6	66%	0.659	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-69.9	-16.5	175.2	-73	-94.5	0	0	0	112.6	P963 R964 H965	P963-Y967 HydrophobicContact CB-CD2 4.07Å; P963-Y967 HydrophobicContact CB-CG 4.21Å; R964-Y967 HydrophobicContact CB-CD2 4.3Å; R964-Y967 HydrophobicContact CB-CE2 4.47Å; R964-Y967 PolarHBondContact O-N 3.4Å; H965-Y967 PolarHBondContact O-N 3.23Å
968	G	92	Very high	91.8	Very high	6 Å²	6	64.9 Å²	64.9	6%	0.062	30%	0.296	C	S	.	.	H	α-helix	trans	72.2	151	-177.1	0	0	0	0	0	113.4	H965 E966 P970 G971 I972 D1190	H965-G968 PolarHBondContact O-N 3.13Å; H965-G968 VanDerWaalsContact O-N 3.15Å; E966-G968 PolarHBondContact O-N 3.23Å; G968-P970 VanDerWaalsContact C-CD 3.44Å; G968-G971 PolarHBondContact O-N 3.43Å; G968-I972 VanDerWaalsContact O-CG1 3.3Å; G968-I972 WeakPolarHBondContact O-CG1 3.19Å; G968-I972 PolarHBondContact O-N 2.89Å; G968-D1190 WeakPolarHBondContact CA-OD2 3.25Å
969	S	91.4	Very high	91.9	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.8	-34.1	-178.1	55	0	0	0	0	115.1	I972 L973 L1183 D1190 L1201	S969-I972 PolarHBondContact O-N 3.5Å; S969-L973 WeakPolarHBondContact O-CB 3.25Å; S969-L973 PolarHBondContact O-N 3.17Å; S969-L1183 WeakPolarHBondContact O-CD1 3.4Å; S969-D1190 WeakPolarHBondContact CB-OD2 3.47Å; S969-D1190 PolarHBondContact N-OD2 2.9Å; S969-D1190 VanDerWaalsContact OG-CG 3.25Å; S969-D1190 PolarHBondContact OG-OD1 3.3Å; S969-D1190 PolarHBondContact OG-OD2 3.4Å; S969-L1201 WeakPolarHBondContact OG-CD2 3.27Å
970	P	92.5	Very high	92.1	Very high	9 Å²	9	56.8 Å²	56.8	6%	0.058	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-43.6	173.8	-20.2	33.1	0	0	0	113	G968 I972 L973 E974 K1192 E1194 I1196 L1201	G968-P970 VanDerWaalsContact C-CD 3.44Å; P970-I972 VanDerWaalsContact C-N 3.33Å; P970-I972 PolarHBondContact O-N 3.47Å; P970-L973 PolarHBondContact O-N 2.85Å; P970-E974 PolarHBondContact O-N 2.73Å; P970-K1192 HydrophobicContact CG-CB 4.05Å; P970-K1192 HydrophobicContact CG-CD 3.85Å; P970-E1194 HydrophobicContact CB-CB 4.28Å; P970-E1194 HydrophobicContact CB-CG 4.46Å; P970-E1194 WeakPolarHBondContact CB-OE2 3.22Å; P970-E1194 HydrophobicContact CG-CB 4.25Å; P970-E1194 VanDerWaalsContact CG-CD 3.44Å; P970-E1194 HydrophobicContact CG-CG 4.06Å; P970-E1194 WeakPolarHBondContact CG-OE1 3.4Å; P970-I1196 HydrophobicContact CB-CD1 3.96Å; P970-I1196 HydrophobicContact CB-CG1 4.09Å; P970-L1201 HydrophobicContact CG-CD2 3.98Å
971	G	90.9	Very high	92.1	Very high	31 Å²	31	61.5 Å²	61.5	32%	0.32	28%	0.278	S	S	.	.	H	α-helix	trans	-68.1	-32.6	178	0	0	0	0	0	112.8	G968 F975	G968-G971 PolarHBondContact O-N 3.43Å; G971-F975 WeakPolarHBondContact O-CB 3.4Å; G971-F975 PolarHBondContact O-N 2.88Å
972	I	93.2	Very high	92.1	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-69.1	-40.7	173.4	-66.8	174.2	0	0	0	111.3	P963 G968 S969 P970 F975 F976 L1183 V1186	P963-I972 HydrophobicContact CB-CG1 4.04Å; P963-I972 HydrophobicContact CG-CG1 4.26Å; G968-I972 VanDerWaalsContact O-CG1 3.3Å; G968-I972 WeakPolarHBondContact O-CG1 3.19Å; G968-I972 PolarHBondContact O-N 2.89Å; S969-I972 PolarHBondContact O-N 3.5Å; P970-I972 VanDerWaalsContact C-N 3.33Å; P970-I972 PolarHBondContact O-N 3.47Å; I972-F975 PolarHBondContact O-N 3.48Å; I972-F976 HydrophobicContact CG2-CD2 3.72Å; I972-F976 HydrophobicContact CG2-CE2 3.27Å; I972-F976 HydrophobicContact CG2-CZ 3.97Å; I972-F976 VanDerWaalsContact O-CD2 3.3Å; I972-F976 WeakPolarHBondContact O-CD2 3.42Å; I972-F976 PolarHBondContact O-N 3.48Å; I972-L1183 HydrophobicContact CB-CD1 4.2Å; I972-L1183 HydrophobicContact CG2-CD1 3.96Å; I972-V1186 HydrophobicContact CD1-CB 3.86Å; I972-V1186 HydrophobicContact CD1-CG1 3.71Å; I972-V1186 HydrophobicContact CD1-CG2 3.66Å
973	L	93.6	Very high	92.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.2	-43	174.8	176.1	57.7	0	0	0	111.2	S969 P970 F976 H977 F1136 L1183 I1196 V1199 L1201	S969-L973 WeakPolarHBondContact O-CB 3.25Å; S969-L973 PolarHBondContact O-N 3.17Å; P970-L973 PolarHBondContact O-N 2.85Å; L973-F976 PolarHBondContact O-N 3.27Å; L973-H977 PolarHBondContact O-CD2 3.35Å; L973-H977 PolarHBondContact O-N 3.46Å; L973-F1136 HydrophobicContact CD1-CE2 3.88Å; L973-F1136 HydrophobicContact CD1-CZ 3.93Å; L973-L1183 HydrophobicContact CB-CD1 4.04Å; L973-L1183 HydrophobicContact CB-CD2 4.24Å; L973-L1183 HydrophobicContact CD1-CD2 3.86Å; L973-I1196 HydrophobicContact CD2-CB 3.84Å; L973-I1196 HydrophobicContact CD2-CG1 4.16Å; L973-I1196 HydrophobicContact CG-CB 4.12Å; L973-I1196 HydrophobicContact CG-CG2 4.29Å; L973-V1199 HydrophobicContact CD2-CB 4.38Å; L973-V1199 HydrophobicContact CD2-CG1 4.09Å; L973-L1201 HydrophobicContact CB-CD1 4.23Å; L973-L1201 HydrophobicContact CD2-CB 4.17Å; L973-L1201 HydrophobicContact CD2-CD1 3.72Å
974	E	93.6	Very high	92	Very high	111 Å²	111	59.2 Å²	59.2	52%	0.519	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-43.7	175.2	-170.7	172.6	-161.1	0	0	112	P970 H977 H978 I1196	P970-E974 PolarHBondContact O-N 2.73Å; E974-H977 PolarHBondContact O-N 3.36Å; E974-H978 PolarHBondContact O-N 2.99Å; E974-I1196 HydrophobicContact CB-CG2 3.75Å; E974-I1196 HydrophobicContact CG-CG2 4.29Å
975	F	94.3	Very high	92	Very high	69 Å²	69	57.5 Å²	57.5	30%	0.303	28%	0.277	S	S	.	.	H	α-helix	trans	-58.2	-49.3	176.1	174.4	-97.2	0	0	0	112	R961 P963 G971 I972 H977 H978 Q979	R961-F975 VanDerWaalsContact O-CE1 3.28Å; R961-F975 WeakPolarHBondContact O-CE1 3.44Å; P963-F975 HydrophobicContact CG-CB 4.45Å; P963-F975 HydrophobicContact CG-CD1 3.5Å; P963-F975 VanDerWaalsContact CG-CD1 3.5Å; P963-F975 HydrophobicContact CG-CE1 3.79Å; P963-F975 HydrophobicContact CG-CG 3.92Å; P963-F975 HydrophobicContact CG-CZ 4.42Å; G971-F975 WeakPolarHBondContact O-CB 3.4Å; G971-F975 PolarHBondContact O-N 2.88Å; I972-F975 PolarHBondContact O-N 3.48Å; F975-H977 PolarHBondContact O-N 2.81Å; F975-H978 PolarHBondContact O-N 3.35Å; F975-Q979 HydrophobicContact CD1-CG 4.26Å; F975-Q979 HydrophobicContact CD2-CG 4.18Å; F975-Q979 HydrophobicContact CE1-CG 3.87Å; F975-Q979 HydrophobicContact CE2-CG 3.79Å; F975-Q979 HydrophobicContact CG-CG 4.41Å; F975-Q979 HydrophobicContact CZ-CG 3.63Å; F975-Q979 VanDerWaalsContact O-CG 3.32Å; F975-Q979 WeakPolarHBondContact O-CG 3.42Å; F975-Q979 PolarHBondContact O-N 2.82Å
976	F	94.5	Very high	92.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67	-36.4	178.8	-67.5	-42.4	0	0	0	112.6	L962 I972 L973 H978 Q979 L980 F1136 F1179 L1183	L962-F976 HydrophobicContact CD2-CE1 4.29Å; L962-F976 HydrophobicContact CD2-CZ 3.89Å; I972-F976 HydrophobicContact CG2-CD2 3.72Å; I972-F976 HydrophobicContact CG2-CE2 3.27Å; I972-F976 HydrophobicContact CG2-CZ 3.97Å; I972-F976 VanDerWaalsContact O-CD2 3.3Å; I972-F976 WeakPolarHBondContact O-CD2 3.42Å; I972-F976 PolarHBondContact O-N 3.48Å; L973-F976 PolarHBondContact O-N 3.27Å; F976-H978 VanDerWaalsContact C-N 3.27Å; F976-H978 PolarHBondContact O-N 3.15Å; F976-Q979 PolarHBondContact O-N 2.9Å; F976-L980 HydrophobicContact CB-CD1 4.43Å; F976-L980 VanDerWaalsContact O-CB 3.27Å; F976-L980 WeakPolarHBondContact O-CB 3.3Å; F976-L980 WeakPolarHBondContact O-CG 3.36Å; F976-L980 PolarHBondContact O-N 3.43Å; F976-F1136 HydrophobicContact CB-CD2 4.27Å; F976-F1136 HydrophobicContact CB-CE2 3.72Å; F976-F1136 HydrophobicContact CB-CZ 3.92Å; F976-F1179 HydrophobicContact CD1-CB 4.14Å; F976-F1179 HydrophobicContact CD1-CD1 4.09Å; F976-F1179 HydrophobicContact CD1-CG 4.25Å; F976-F1179 HydrophobicContact CD2-CB 4.26Å; F976-F1179 HydrophobicContact CE1-CB 4Å; F976-F1179 AromaticContact CE1-CD1 3.59Å; F976-F1179 HydrophobicContact CE1-CD1 3.59Å; F976-F1179 HydrophobicContact CE1-CE1 4.42Å; F976-F1179 HydrophobicContact CE1-CG 4.09Å; F976-F1179 HydrophobicContact CE2-CB 4.09Å; F976-F1179 VanDerWaalsContact CE2-O 3.28Å; F976-F1179 WeakPolarHBondContact CE2-O 3.3Å; F976-F1179 HydrophobicContact CG-CB 4.29Å; F976-F1179 HydrophobicContact CZ-CB 3.97Å; F976-F1179 HydrophobicContact CZ-CD1 4.1Å; F976-F1179 HydrophobicContact CZ-CG 4.47Å; F976-L1183 HydrophobicContact CE2-CB 4.35Å
977	H	91.3	Very high	92.1	Very high	18 Å²	18	53.9 Å²	53.9	8%	0.083	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-36.5	172.5	-93.3	-64.2	0	0	0	113.1	L973 E974 F975 K981 F1136 K1197 V1199	L973-H977 PolarHBondContact O-CD2 3.35Å; L973-H977 PolarHBondContact O-N 3.46Å; E974-H977 PolarHBondContact O-N 3.36Å; F975-H977 PolarHBondContact O-N 2.81Å; H977-K981 PolarHBondContact O-N 2.93Å; H977-F1136 AromaticContact CD2-CZ 3.79Å; H977-F1136 AromaticContact CE1-CE1 3.88Å; H977-F1136 AromaticContact CE1-CZ 3.89Å; H977-F1136 AromaticContact CG-CZ 3.86Å; H977-F1136 AromaticContact ND1-CE1 3.76Å; H977-F1136 AromaticContact ND1-CZ 3.93Å; H977-F1136 AromaticContact NE2-CZ 3.81Å; H977-K1197 HydrophobicContact CB-CD 3.82Å; H977-V1199 VanDerWaalsContact NE2-CG2 3.32Å; H977-V1199 WeakPolarHBondContact NE2-CG2 3.41Å
978	H	92.1	Very high	92.3	Very high	134 Å²	134	49.9 Å²	49.9	62%	0.62	26%	0.261	S	S	*	.	H	α-helix	trans	-71.6	-49.1	176.4	-174.3	74.9	0	0	0	111.4	E974 F975 F976 L980 K981	E974-H978 PolarHBondContact O-N 2.99Å; F975-H978 PolarHBondContact O-N 3.35Å; F976-H978 VanDerWaalsContact C-N 3.27Å; F976-H978 PolarHBondContact O-N 3.15Å; H978-L980 VanDerWaalsContact C-N 3.32Å; H978-L980 PolarHBondContact O-N 3.17Å; H978-K981 PolarHBondContact O-N 3.38Å
979	Q	91	Very high	92.4	Very high	58 Å²	58	49.8 Å²	49.8	27%	0.271	26%	0.259	S	S	.	.	H	α-helix	trans	-68.3	-28.6	-175.9	-67.5	-70.2	78.2	0	0	113.6	P957 F975 F976	P957-Q979 WeakPolarHBondContact CG-O 3.48Å; F975-Q979 HydrophobicContact CD1-CG 4.26Å; F975-Q979 HydrophobicContact CD2-CG 4.18Å; F975-Q979 HydrophobicContact CE1-CG 3.87Å; F975-Q979 HydrophobicContact CE2-CG 3.79Å; F975-Q979 HydrophobicContact CG-CG 4.41Å; F975-Q979 HydrophobicContact CZ-CG 3.63Å; F975-Q979 VanDerWaalsContact O-CG 3.32Å; F975-Q979 WeakPolarHBondContact O-CG 3.42Å; F975-Q979 PolarHBondContact O-N 2.82Å; F976-Q979 PolarHBondContact O-N 2.9Å
980	L	93.8	Very high	92.4	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	11.7	-176.2	-54.6	177.6	0	0	0	113	M956 P957 F976 H978 D982 I983 V984 A1133 F1136 F1179	M956-L980 HydrophobicContact CE-CD2 3.5Å; M956-L980 VanDerWaalsContact CE-CD2 3.5Å; M956-L980 HydrophobicContact SD-CD2 4.33Å; P957-L980 HydrophobicContact CG-CD2 4.16Å; F976-L980 HydrophobicContact CB-CD1 4.43Å; F976-L980 VanDerWaalsContact O-CB 3.27Å; F976-L980 WeakPolarHBondContact O-CB 3.3Å; F976-L980 WeakPolarHBondContact O-CG 3.36Å; F976-L980 PolarHBondContact O-N 3.43Å; H978-L980 VanDerWaalsContact C-N 3.32Å; H978-L980 PolarHBondContact O-N 3.17Å; L980-D982 VanDerWaalsContact C-N 3.3Å; L980-D982 PolarHBondContact O-N 2.86Å; L980-I983 PolarHBondContact O-N 3.12Å; L980-I983 VanDerWaalsContact O-N 3.08Å; L980-V984 WeakPolarHBondContact O-CG2 3.43Å; L980-V984 PolarHBondContact O-N 3.16Å; L980-A1133 HydrophobicContact CD2-CB 4.08Å; L980-F1136 HydrophobicContact CB-CD1 4.37Å; L980-F1136 HydrophobicContact CD1-CB 3.82Å; L980-F1136 HydrophobicContact CD1-CD1 3.8Å; L980-F1136 HydrophobicContact CD1-CD2 4.43Å; L980-F1136 HydrophobicContact CD1-CE1 4.49Å; L980-F1136 HydrophobicContact CD1-CG 3.76Å; L980-F1179 HydrophobicContact CD1-CD2 3.73Å; L980-F1179 HydrophobicContact CD1-CE2 4.13Å; L980-F1179 HydrophobicContact CD1-CG 4.39Å; L980-F1179 HydrophobicContact CD2-CD2 4.43Å; L980-F1179 HydrophobicContact CD2-CE2 3.98Å
981	K	92.1	Very high	92.3	Very high	99 Å²	99	58 Å²	58	43%	0.43	30%	0.301	S	S	.	.	H	α-helix	trans	-52.4	-47.2	-174.5	-174.1	-170.8	170.7	-162	0	112.5	H977 H978 I983 V984 E985	H977-K981 PolarHBondContact O-N 2.93Å; H978-K981 PolarHBondContact O-N 3.38Å; K981-I983 PolarHBondContact O-N 3.32Å; K981-V984 PolarHBondContact O-N 3.38Å; K981-V984 VanDerWaalsContact O-N 3.1Å; K981-E985 WeakPolarHBondContact CE-OE1 3.22Å; K981-E985 WeakPolarHBondContact CE-OE2 3.39Å; K981-E985 HydrophobicContact CG-CG 4.44Å; K981-E985 IonicContact NZ-OE1 2.77Å; K981-E985 IonicContact NZ-OE2 3.21Å; K981-E985 PolarHBondContact O-N 3.28Å
982	D	91.7	Very high	92.3	Very high	101 Å²	101	58.1 Å²	58.1	54%	0.54	30%	0.295	S	S	.	.	H	α-helix	trans	-69.5	-23.8	-175.3	-58.3	-28.8	0	0	0	112.6	V955 L980 Y986	V955-D982 HydrophobicContact CG1-CB 3.46Å; V955-D982 VanDerWaalsContact CG1-CB 3.46Å; L980-D982 VanDerWaalsContact C-N 3.3Å; L980-D982 PolarHBondContact O-N 2.86Å; D982-Y986 PolarHBondContact O-N 3.48Å
983	I	92.5	Very high	92.3	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-78.5	-41	170.9	-56.2	-62.9	0	0	0	110.5	L952 V955 M956 L980 K981 E985 Y986 L989 L1130 A1133 V1137	L952-I983 HydrophobicContact CB-CD1 4.33Å; L952-I983 HydrophobicContact CD2-CD1 3.99Å; V955-I983 HydrophobicContact CB-CD1 4.21Å; V955-I983 HydrophobicContact CG1-CD1 3.87Å; M956-I983 HydrophobicContact SD-CD1 4.31Å; M956-I983 HydrophobicContact SD-CG1 4.04Å; L980-I983 PolarHBondContact O-N 3.12Å; L980-I983 VanDerWaalsContact O-N 3.08Å; K981-I983 PolarHBondContact O-N 3.32Å; I983-E985 VanDerWaalsContact C-N 3.33Å; I983-E985 PolarHBondContact O-N 2.92Å; I983-Y986 WeakPolarHBondContact O-CB 3.25Å; I983-Y986 PolarHBondContact O-N 2.98Å; I983-L989 HydrophobicContact CG2-CD2 4.28Å; I983-L989 WeakPolarHBondContact O-CD2 3.3Å; I983-L1130 HydrophobicContact CD1-CD1 4.39Å; I983-A1133 HydrophobicContact CB-CB 4.48Å; I983-A1133 HydrophobicContact CG1-CB 4.3Å; I983-A1133 HydrophobicContact CG2-CB 4Å; I983-V1137 HydrophobicContact CG2-CG2 4.13Å
984	V	91.4	Very high	92.5	Very high	48 Å²	48	58.6 Å²	58.6	29%	0.291	30%	0.298	S	S	.	.	H	α-helix	trans	-63.4	-38.9	178.3	175.5	0	0	0	0	111.6	L980 K981 F1136 V1137 I1140	L980-V984 WeakPolarHBondContact O-CG2 3.43Å; L980-V984 PolarHBondContact O-N 3.16Å; K981-V984 PolarHBondContact O-N 3.38Å; K981-V984 VanDerWaalsContact O-N 3.1Å; V984-F1136 HydrophobicContact CG2-CD1 4.13Å; V984-F1136 HydrophobicContact CG2-CE1 4.21Å; V984-V1137 HydrophobicContact CB-CG2 4.35Å; V984-V1137 HydrophobicContact CG2-CG2 3.86Å; V984-I1140 HydrophobicContact CG1-CD1 4.23Å; V984-I1140 HydrophobicContact CG2-CD1 4.37Å
985	E	92.2	Very high	92.6	Very high	127 Å²	127	53.6 Å²	53.6	59%	0.593	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	0.2	-178	-67.7	178.2	-177	0	0	113.5	K981 I983 A987	K981-E985 WeakPolarHBondContact CE-OE1 3.22Å; K981-E985 WeakPolarHBondContact CE-OE2 3.39Å; K981-E985 HydrophobicContact CG-CG 4.44Å; K981-E985 IonicContact NZ-OE1 2.77Å; K981-E985 IonicContact NZ-OE2 3.21Å; K981-E985 PolarHBondContact O-N 3.28Å; I983-E985 VanDerWaalsContact C-N 3.33Å; I983-E985 PolarHBondContact O-N 2.92Å; E985-A987 PolarHBondContact O-N 3.34Å; E985-A987 VanDerWaalsContact O-N 3.11Å
986	Y	93.8	Very high	92.7	Very high	58 Å²	58	51.3 Å²	51.3	23%	0.227	27%	0.266	C	S	.	.			trans	-69	109.5	-178.2	-165.3	-96	0	0	0	111.7	Y948 L952 D982 I983 E988 L989	Y948-Y986 HydrophobicContact CD1-CE1 4.02Å; Y948-Y986 AromaticContact CE1-CE1 3.98Å; Y948-Y986 HydrophobicContact CE1-CE1 3.98Å; L952-Y986 HydrophobicContact CD2-CD1 3.92Å; L952-Y986 HydrophobicContact CD2-CD2 3.83Å; L952-Y986 HydrophobicContact CD2-CE1 4.12Å; L952-Y986 HydrophobicContact CD2-CE2 4.02Å; L952-Y986 HydrophobicContact CD2-CG 3.78Å; D982-Y986 PolarHBondContact O-N 3.48Å; I983-Y986 WeakPolarHBondContact O-CB 3.25Å; I983-Y986 PolarHBondContact O-N 2.98Å; Y986-E988 VanDerWaalsContact C-N 3.32Å; Y986-E988 HydrophobicContact CD1-CB 4.37Å; Y986-E988 HydrophobicContact CE1-CB 3.83Å; Y986-E988 PolarHBondContact O-N 3.28Å; Y986-L989 HydrophobicContact CD1-CB 4.04Å; Y986-L989 VanDerWaalsContact O-CB 3.27Å; Y986-L989 WeakPolarHBondContact O-CB 3.41Å; Y986-L989 PolarHBondContact O-N 3.41Å; Y986-L989 VanDerWaalsContact O-N 3.16Å
987	A	87.8	Confident	92.8	Very high	92 Å²	92	51.5 Å²	51.5	76%	0.76	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-38.5	-169.3	0	0	0	0	0	114	E985 L989	E985-A987 PolarHBondContact O-N 3.34Å; E985-A987 VanDerWaalsContact O-N 3.11Å; A987-L989 VanDerWaalsContact C-N 3.33Å; A987-L989 PolarHBondContact O-N 2.86Å
988	E	93.4	Very high	93.1	Very high	85 Å²	85	50.7 Å²	50.7	40%	0.397	26%	0.263	S	S	.	.	H	α-helix	trans	-91.9	7.8	-174.7	-67.2	174.6	164.7	0	0	113.5	Y948 Y986 K990 T991 V992 C993	Y948-E988 HydrophobicContact CE1-CB 4.09Å; Y948-E988 PolarHBondContact OH-OE2 3.49Å; Y986-E988 VanDerWaalsContact C-N 3.32Å; Y986-E988 HydrophobicContact CD1-CB 4.37Å; Y986-E988 HydrophobicContact CE1-CB 3.83Å; Y986-E988 PolarHBondContact O-N 3.28Å; E988-K990 VanDerWaalsContact C-N 3.32Å; E988-K990 PolarHBondContact O-N 3.21Å; E988-T991 WeakPolarHBondContact CA-OG1 3.27Å; E988-V992 HydrophobicContact CB-CB 4.31Å; E988-V992 HydrophobicContact CB-CG2 3.95Å; E988-V992 HydrophobicContact CG-CG2 4.3Å; E988-V992 WeakPolarHBondContact O-CB 3.3Å; E988-V992 PolarHBondContact O-N 3.22Å; E988-C993 PolarHBondContact O-N 3.05Å
989	L	92.3	Very high	93.3	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	24%	0.239	C	C	.	.	I	π-helix	trans	-63.2	-40.6	-176.4	-174.2	63.8	0	0	0	111.4	L952 I983 Y986 A987 C993 F994 M1134 V1137	L952-L989 HydrophobicContact CD1-CD1 3.99Å; I983-L989 HydrophobicContact CG2-CD2 4.28Å; I983-L989 WeakPolarHBondContact O-CD2 3.3Å; Y986-L989 HydrophobicContact CD1-CB 4.04Å; Y986-L989 VanDerWaalsContact O-CB 3.27Å; Y986-L989 WeakPolarHBondContact O-CB 3.41Å; Y986-L989 PolarHBondContact O-N 3.41Å; Y986-L989 VanDerWaalsContact O-N 3.16Å; A987-L989 VanDerWaalsContact C-N 3.33Å; A987-L989 PolarHBondContact O-N 2.86Å; L989-C993 HydrophobicContact CD1-CB 4.08Å; L989-C993 VanDerWaalsContact O-CB 3.27Å; L989-C993 WeakPolarHBondContact O-CB 3.4Å; L989-C993 PolarHBondContact O-N 2.87Å; L989-F994 HydrophobicContact CD1-CE1 4.09Å; L989-F994 HydrophobicContact CD2-CE1 4.45Å; L989-F994 HydrophobicContact CD2-CZ 4.13Å; L989-F994 HydrophobicContact CG-CE1 3.94Å; L989-F994 HydrophobicContact CG-CZ 3.99Å; L989-F994 WeakPolarHBondContact O-CD1 3.44Å; L989-F994 WeakPolarHBondContact O-CG 3.28Å; L989-F994 PolarHBondContact O-N 2.84Å; L989-M1134 HydrophobicContact CD1-CE 3.97Å; L989-M1134 HydrophobicContact CD1-CG 4.23Å; L989-V1137 HydrophobicContact CD2-CB 4.17Å; L989-V1137 HydrophobicContact CD2-CG1 3.97Å; L989-V1137 HydrophobicContact CD2-CG2 3.9Å
990	K	91.4	Very high	93.6	Very high	104 Å²	104	42.9 Å²	42.9	45%	0.452	23%	0.227	S	C	.	.	I	π-helix	trans	-84.1	-49	178.7	-65.8	174.7	-176.2	161.3	0	111.6	F871 E988 V992 F994 Q995 F1153	F871-K990 HydrophobicContact CZ-CB 4.29Å; E988-K990 VanDerWaalsContact C-N 3.32Å; E988-K990 PolarHBondContact O-N 3.21Å; K990-V992 VanDerWaalsContact C-N 3.34Å; K990-V992 PolarHBondContact O-N 2.8Å; K990-F994 HydrophobicContact CB-CD2 4.34Å; K990-F994 HydrophobicContact CG-CD2 3.85Å; K990-F994 HydrophobicContact CG-CE2 4.03Å; K990-Q995 PolarHBondContact O-N 2.82Å; K990-F1153 HydrophobicContact CB-CZ 4.39Å; K990-F1153 VanDerWaalsContact O-CZ 3.24Å; K990-F1153 WeakPolarHBondContact O-CZ 3.42Å
991	T	90.9	Very high	93.8	Very high	78 Å²	78	42.8 Å²	42.8	48%	0.479	23%	0.226	S	C	.	.	I	π-helix	trans	-68.5	-29.6	-173.5	50.3	0	0	0	0	113.7	F871 E988 Q995	F871-T991 HydrophobicContact CE1-CG2 4.28Å; F871-T991 HydrophobicContact CZ-CG2 3.91Å; E988-T991 WeakPolarHBondContact CA-OG1 3.27Å; T991-Q995 VanDerWaalsContact O-CB 3.3Å; T991-Q995 WeakPolarHBondContact O-CB 3.25Å
992	V	91.9	Very high	94.1	Very high	33 Å²	33	38.1 Å²	38.1	20%	0.2	21%	0.206	C	C	.	.	I	π-helix	trans	-116.7	-57	-177.9	-172.6	0	0	0	0	111.5	Y948 E988 K990 N996	Y948-V992 HydrophobicContact CD2-CG1 4.23Å; Y948-V992 HydrophobicContact CE1-CB 4.19Å; Y948-V992 HydrophobicContact CE1-CG1 4.11Å; Y948-V992 HydrophobicContact CE2-CG1 3.64Å; E988-V992 HydrophobicContact CB-CB 4.31Å; E988-V992 HydrophobicContact CB-CG2 3.95Å; E988-V992 HydrophobicContact CG-CG2 4.3Å; E988-V992 WeakPolarHBondContact O-CB 3.3Å; E988-V992 PolarHBondContact O-N 3.22Å; K990-V992 VanDerWaalsContact C-N 3.34Å; K990-V992 PolarHBondContact O-N 2.8Å; V992-N996 WeakPolarHBondContact CG1-ND2 3.44Å; V992-N996 WeakPolarHBondContact O-CB 3.34Å; V992-N996 PolarHBondContact O-N 2.92Å; V992-N996 PolarHBondContact O-ND2 2.77Å; V992-N996 VanDerWaalsContact O-ND2 3.08Å
993	C	93.3	Very high	94.3	Very high	8 Å²	8	33.4 Å²	33.4	5%	0.054	18%	0.181	C	C	.	.	I	π-helix	trans	-66.7	-53.2	-173.5	-52.1	0	0	0	0	112.2	Y948 E988 L989 Q995 L997	Y948-C993 WeakPolarHBondContact CD1-SG 3.27Å; E988-C993 PolarHBondContact O-N 3.05Å; L989-C993 HydrophobicContact CD1-CB 4.08Å; L989-C993 VanDerWaalsContact O-CB 3.27Å; L989-C993 WeakPolarHBondContact O-CB 3.4Å; L989-C993 PolarHBondContact O-N 2.87Å; C993-Q995 VanDerWaalsContact C-N 3.32Å; C993-Q995 PolarHBondContact O-N 2.79Å; C993-L997 WeakPolarHBondContact O-CB 3.44Å; C993-L997 VanDerWaalsContact O-CG 3.3Å; C993-L997 WeakPolarHBondContact O-CG 3.45Å; C993-L997 PolarHBondContact O-N 3.5Å
994	F	96.6	Very high	94.5	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	18%	0.181	C	C	.	.	I	π-helix	trans	-67.4	-34.6	-179.7	-67	-4.7	0	0	0	112.1	L989 K990 L997 R998 M1134 Y1138 V1149 F1153 L1157	L989-F994 HydrophobicContact CD1-CE1 4.09Å; L989-F994 HydrophobicContact CD2-CE1 4.45Å; L989-F994 HydrophobicContact CD2-CZ 4.13Å; L989-F994 HydrophobicContact CG-CE1 3.94Å; L989-F994 HydrophobicContact CG-CZ 3.99Å; L989-F994 WeakPolarHBondContact O-CD1 3.44Å; L989-F994 WeakPolarHBondContact O-CG 3.28Å; L989-F994 PolarHBondContact O-N 2.84Å; K990-F994 HydrophobicContact CB-CD2 4.34Å; K990-F994 HydrophobicContact CG-CD2 3.85Å; K990-F994 HydrophobicContact CG-CE2 4.03Å; F994-L997 PolarHBondContact O-N 2.99Å; F994-R998 VanDerWaalsContact O-CB 3.3Å; F994-R998 WeakPolarHBondContact O-CB 3.2Å; F994-R998 PolarHBondContact O-N 2.78Å; F994-M1134 HydrophobicContact CE1-CB 4.01Å; F994-M1134 HydrophobicContact CE1-CG 4.12Å; F994-M1134 HydrophobicContact CE1-SD 4.16Å; F994-M1134 HydrophobicContact CZ-CB 4.35Å; F994-Y1138 HydrophobicContact CZ-CD1 4.23Å; F994-V1149 HydrophobicContact CD2-CG2 4.11Å; F994-V1149 HydrophobicContact CE2-CG2 4.24Å; F994-F1153 HydrophobicContact CB-CD1 4.21Å; F994-F1153 HydrophobicContact CB-CD2 4.17Å; F994-F1153 HydrophobicContact CB-CE1 3.94Å; F994-F1153 HydrophobicContact CB-CE2 3.88Å; F994-F1153 HydrophobicContact CB-CG 4.34Å; F994-F1153 HydrophobicContact CB-CZ 3.76Å; F994-F1153 HydrophobicContact CD2-CD2 4.41Å; F994-F1153 HydrophobicContact CD2-CE2 4.06Å; F994-L1157 HydrophobicContact CB-CD1 3.96Å; F994-L1157 HydrophobicContact CB-CD2 4.21Å; F994-L1157 HydrophobicContact CD1-CD1 3.96Å; F994-L1157 HydrophobicContact CD1-CD2 4.36Å; F994-L1157 HydrophobicContact CD2-CD2 4.08Å; F994-L1157 HydrophobicContact CG-CD1 4.07Å; F994-L1157 HydrophobicContact CG-CD2 3.98Å
995	Q	96.1	Very high	94.8	Very high	6 Å²	6	31.2 Å²	31.2	3%	0.028	17%	0.168	C	C	.	.	H	α-helix	trans	-63.1	-51.2	176.3	-176.5	54.1	34.8	0	0	112	P853 K990 T991 C993 L997 R998 E999 F1153	P853-Q995 VanDerWaalsContact CA-NE2 3.29Å; P853-Q995 PolarHBondContact O-NE2 3.3Å; K990-Q995 PolarHBondContact O-N 2.82Å; T991-Q995 VanDerWaalsContact O-CB 3.3Å; T991-Q995 WeakPolarHBondContact O-CB 3.25Å; C993-Q995 VanDerWaalsContact C-N 3.32Å; C993-Q995 PolarHBondContact O-N 2.79Å; Q995-L997 VanDerWaalsContact C-N 3.33Å; Q995-L997 PolarHBondContact O-N 3.06Å; Q995-R998 WeakPolarHBondContact O-CB 3.34Å; Q995-R998 PolarHBondContact O-N 2.95Å; Q995-R998 VanDerWaalsContact O-N 3.16Å; Q995-E999 PolarHBondContact NE2-OE1 3.26Å; Q995-E999 PolarHBondContact O-N 3.08Å; Q995-F1153 HydrophobicContact CB-CE1 4.07Å
996	N	96.4	Very high	95.1	Very high	22 Å²	22	25.3 Å²	25.3	12%	0.118	14%	0.14	C	C	.	.	H	α-helix	trans	-63.6	-38.1	178.1	-67.3	-28.8	0	0	0	112.1	T944 I945 V992 E999 V1000	T944-N996 PolarHBondContact OG1-ND2 3.37Å; I945-N996 HydrophobicContact CD1-CB 4.02Å; I945-N996 HydrophobicContact CG1-CB 3.71Å; V992-N996 WeakPolarHBondContact CG1-ND2 3.44Å; V992-N996 WeakPolarHBondContact O-CB 3.34Å; V992-N996 PolarHBondContact O-N 2.92Å; V992-N996 PolarHBondContact O-ND2 2.77Å; V992-N996 VanDerWaalsContact O-ND2 3.08Å; N996-E999 PolarHBondContact O-N 3.47Å; N996-V1000 WeakPolarHBondContact O-CG2 3.47Å; N996-V1000 PolarHBondContact O-N 3.02Å; N996-V1000 VanDerWaalsContact O-N 3.12Å
997	L	96.6	Very high	95.2	Very high	4 Å²	4	22.7 Å²	22.7	2%	0.021	13%	0.13	C	C	.	.	H	α-helix	trans	-66.7	-38.4	175.4	-74.4	167.8	0	0	0	111.7	I945 C993 F994 Q995 E999 V1000 G1001 W1131 M1134 L1157 A1160 I1164	I945-L997 HydrophobicContact CD1-CD2 4.19Å; I945-L997 HydrophobicContact CG2-CD2 4.29Å; C993-L997 WeakPolarHBondContact O-CB 3.44Å; C993-L997 VanDerWaalsContact O-CG 3.3Å; C993-L997 WeakPolarHBondContact O-CG 3.45Å; C993-L997 PolarHBondContact O-N 3.5Å; F994-L997 PolarHBondContact O-N 2.99Å; Q995-L997 VanDerWaalsContact C-N 3.33Å; Q995-L997 PolarHBondContact O-N 3.06Å; L997-E999 VanDerWaalsContact C-N 3.34Å; L997-E999 PolarHBondContact O-N 3.46Å; L997-V1000 PolarHBondContact O-N 2.91Å; L997-G1001 PolarHBondContact O-N 3.1Å; L997-W1131 HydrophobicContact CD1-CZ3 3.9Å; L997-M1134 HydrophobicContact CD1-SD 4.44Å; L997-L1157 HydrophobicContact CB-CD1 3.67Å; L997-L1157 HydrophobicContact CD1-CD1 4.11Å; L997-A1160 HydrophobicContact CB-CB 4.19Å; L997-A1160 HydrophobicContact CD2-CB 4.07Å; L997-A1160 WeakPolarHBondContact O-CB 3.18Å; L997-I1164 HydrophobicContact CD2-CD1 3.97Å
998	R	97.1	Very high	95.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.9	-43.4	173.7	175.5	-116.5	-75.2	-89.4	-2.7	111.4	P853 Y855 C856 T867 F994 Q995 V1000 G1001 N1002 C1152 F1153	P853-R998 PolarHBondContact O-NE 3.17Å; Y855-R998 PolarHBondContact O-NH1 3.16Å; C856-R998 PolarHBondContact SG-NH1 3.14Å; T867-R998 PolarHBondContact OG1-NH2 3.18Å; T867-R998 VanDerWaalsContact OG1-NH2 3.09Å; F994-R998 VanDerWaalsContact O-CB 3.3Å; F994-R998 WeakPolarHBondContact O-CB 3.2Å; F994-R998 PolarHBondContact O-N 2.78Å; Q995-R998 WeakPolarHBondContact O-CB 3.34Å; Q995-R998 PolarHBondContact O-N 2.95Å; Q995-R998 VanDerWaalsContact O-N 3.16Å; R998-V1000 PolarHBondContact O-N 3.48Å; R998-G1001 PolarHBondContact O-N 3Å; R998-G1001 VanDerWaalsContact O-N 3.17Å; R998-N1002 WeakPolarHBondContact O-CB 3.13Å; R998-N1002 PolarHBondContact O-N 3.35Å; R998-C1152 PolarHBondContact NH1-O 3.21Å; R998-C1152 PolarHBondContact NH2-O 2.71Å; R998-F1153 HydrophobicContact CB-CB 4.24Å; R998-F1153 HydrophobicContact CB-CD1 3.98Å; R998-F1153 HydrophobicContact CG-CB 4.23Å; R998-F1153 HydrophobicContact CG-CD1 4.37Å; R998-F1153 WeakPolarHBondContact CG-O 3.48Å
999	E	97.4	Very high	95.7	Very high	28 Å²	28	15.2 Å²	15.2	13%	0.131	8%	0.08	C	C	.	.	H	α-helix	trans	-59.6	-45.5	176.3	-73.4	170.8	-144.9	0	0	112	L852 P853 L940 Q995 N996 L997 G1001 N1002 A1003	L852-E999 HydrophobicContact CB-CB 4.33Å; L852-E999 HydrophobicContact CB-CG 4.18Å; L852-E999 WeakPolarHBondContact O-CG 3.18Å; P853-E999 HydrophobicContact CB-CG 4.31Å; L940-E999 HydrophobicContact CD1-CB 3.95Å; Q995-E999 PolarHBondContact NE2-OE1 3.26Å; Q995-E999 PolarHBondContact O-N 3.08Å; N996-E999 PolarHBondContact O-N 3.47Å; L997-E999 VanDerWaalsContact C-N 3.34Å; L997-E999 PolarHBondContact O-N 3.46Å; E999-G1001 VanDerWaalsContact C-N 3.33Å; E999-G1001 PolarHBondContact O-N 3.21Å; E999-N1002 PolarHBondContact O-N 3.37Å; E999-A1003 PolarHBondContact O-N 2.64Å
1000	V	97.7	Very high	95.9	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-59.2	-44.8	173.5	171.5	0	0	0	0	111.2	V937 L940 I945 N996 L997 R998 A1003 I1004 A1160 M1163	V937-V1000 HydrophobicContact CG1-CG1 4.06Å; V937-V1000 HydrophobicContact CG2-CG1 4.37Å; L940-V1000 HydrophobicContact CB-CG2 3.93Å; L940-V1000 HydrophobicContact CD1-CG2 3.83Å; I945-V1000 HydrophobicContact CD1-CG2 3.7Å; N996-V1000 WeakPolarHBondContact O-CG2 3.47Å; N996-V1000 PolarHBondContact O-N 3.02Å; N996-V1000 VanDerWaalsContact O-N 3.12Å; L997-V1000 PolarHBondContact O-N 2.91Å; R998-V1000 PolarHBondContact O-N 3.48Å; V1000-A1003 PolarHBondContact O-N 2.82Å; V1000-I1004 WeakPolarHBondContact O-CG1 3.47Å; V1000-I1004 PolarHBondContact O-N 3.05Å; V1000-I1004 VanDerWaalsContact O-N 3.15Å; V1000-A1160 HydrophobicContact CB-CB 4.05Å; V1000-A1160 HydrophobicContact CG1-CB 3.95Å; V1000-M1163 HydrophobicContact CG1-CE 3.91Å
1001	G	96.9	Very high	96.1	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-64.7	-43.1	179.7	0	0	0	0	0	113.1	L997 R998 E999 A1003 I1004 L1005 G1156	L997-G1001 PolarHBondContact O-N 3.1Å; R998-G1001 PolarHBondContact O-N 3Å; R998-G1001 VanDerWaalsContact O-N 3.17Å; E999-G1001 VanDerWaalsContact C-N 3.33Å; E999-G1001 PolarHBondContact O-N 3.21Å; G1001-A1003 VanDerWaalsContact C-N 3.32Å; G1001-A1003 PolarHBondContact O-N 2.99Å; G1001-I1004 PolarHBondContact O-N 3.41Å; G1001-L1005 WeakPolarHBondContact O-CB 3.49Å; G1001-L1005 VanDerWaalsContact O-CG 3.3Å; G1001-L1005 WeakPolarHBondContact O-CG 3.37Å; G1001-L1005 PolarHBondContact O-N 3.03Å; G1001-G1156 VanDerWaalsContact CA-O 3.3Å; G1001-G1156 WeakPolarHBondContact CA-O 2.88Å
1002	N	97.9	Very high	96.3	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-63.5	-37.5	176.5	-74.6	-11.9	0	0	0	111.6	F851 L852 Y855 R998 E999 I1004 L1005 F1006	F851-N1002 HydrophobicContact CE1-CB 4.42Å; L852-N1002 HydrophobicContact CD2-CB 3.79Å; L852-N1002 PolarHBondContact O-ND2 3.14Å; Y855-N1002 PolarHBondContact O-ND2 2.95Å; R998-N1002 WeakPolarHBondContact O-CB 3.13Å; R998-N1002 PolarHBondContact O-N 3.35Å; E999-N1002 PolarHBondContact O-N 3.37Å; N1002-I1004 VanDerWaalsContact C-N 3.35Å; N1002-L1005 PolarHBondContact O-N 3.44Å; N1002-F1006 WeakPolarHBondContact O-CB 3.26Å; N1002-F1006 PolarHBondContact O-N 2.95Å
1003	A	97.6	Very high	96.4	Very high	2 Å²	2	10.2 Å²	10.2	2%	0.017	5%	0.052	C	C	.	.	H	α-helix	trans	-64	-40.5	175.9	0	0	0	0	0	111.9	L852 L933 V937 E999 V1000 G1001 F1006 C1007	L852-A1003 HydrophobicContact CD1-CB 4.48Å; L852-A1003 HydrophobicContact CD2-CB 3.77Å; L852-A1003 VanDerWaalsContact CD2-N 3.29Å; L933-A1003 HydrophobicContact CD2-CB 4.2Å; V937-A1003 HydrophobicContact CG2-CB 3.79Å; E999-A1003 PolarHBondContact O-N 2.64Å; V1000-A1003 PolarHBondContact O-N 2.82Å; G1001-A1003 VanDerWaalsContact C-N 3.32Å; G1001-A1003 PolarHBondContact O-N 2.99Å; A1003-F1006 PolarHBondContact O-N 3.01Å; A1003-C1007 PolarHBondContact O-N 2.71Å; A1003-C1007 VanDerWaalsContact O-N 3.13Å; A1003-C1007 PolarHBondContact O-SG 3.01Å
1004	I	96.4	Very high	96.5	Very high	3 Å²	3	10.2 Å²	10.2	2%	0.015	5%	0.052	C	C	.	.	H	α-helix	trans	-69.6	-44.2	177.6	-67	-65.5	0	0	0	111.7	V1000 G1001 N1002 F1006 C1007 L1008 F1093 I1096 I1100 M1163	V1000-I1004 WeakPolarHBondContact O-CG1 3.47Å; V1000-I1004 PolarHBondContact O-N 3.05Å; V1000-I1004 VanDerWaalsContact O-N 3.15Å; G1001-I1004 PolarHBondContact O-N 3.41Å; N1002-I1004 VanDerWaalsContact C-N 3.35Å; I1004-F1006 VanDerWaalsContact C-N 3.28Å; I1004-F1006 PolarHBondContact O-N 3.3Å; I1004-C1007 PolarHBondContact O-N 3.24Å; I1004-L1008 PolarHBondContact O-N 3.5Å; I1004-F1093 HydrophobicContact CG2-CE2 3.69Å; I1004-F1093 HydrophobicContact CG2-CZ 3.79Å; I1004-I1096 HydrophobicContact CD1-CG2 3.97Å; I1004-I1100 HydrophobicContact CD1-CD1 3.08Å; I1004-I1100 HydrophobicContact CG1-CD1 4.28Å; I1004-M1163 HydrophobicContact CD1-SD 3.85Å; I1004-M1163 HydrophobicContact CG1-SD 3.74Å
1005	L	96.9	Very high	96.3	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61.3	-39.2	174.7	-74.8	164.9	0	0	0	111.4	Y857 F864 G1001 N1002 L1008 L1009 W1159	Y857-L1005 HydrophobicContact CD1-CD1 3.49Å; Y857-L1005 VanDerWaalsContact CD1-CD1 3.49Å; Y857-L1005 HydrophobicContact CD1-CD2 3.76Å; Y857-L1005 HydrophobicContact CD1-CG 4.26Å; Y857-L1005 HydrophobicContact CE1-CD1 4.28Å; Y857-L1005 HydrophobicContact CE1-CD2 3.66Å; Y857-L1005 HydrophobicContact CG-CD1 3.67Å; Y857-L1005 HydrophobicContact CG-CD2 4.46Å; F864-L1005 HydrophobicContact CE1-CD1 4.34Å; F864-L1005 HydrophobicContact CZ-CB 3.88Å; F864-L1005 HydrophobicContact CZ-CD1 4.31Å; G1001-L1005 WeakPolarHBondContact O-CB 3.49Å; G1001-L1005 VanDerWaalsContact O-CG 3.3Å; G1001-L1005 WeakPolarHBondContact O-CG 3.37Å; G1001-L1005 PolarHBondContact O-N 3.03Å; N1002-L1005 PolarHBondContact O-N 3.44Å; L1005-L1008 PolarHBondContact O-N 3.47Å; L1005-L1009 WeakPolarHBondContact O-CB 3.41Å; L1005-L1009 WeakPolarHBondContact O-CG 3.43Å; L1005-L1009 PolarHBondContact O-N 3.48Å; L1005-W1159 HydrophobicContact CD1-CB 4.42Å; L1005-W1159 HydrophobicContact CD1-CG 4.09Å; L1005-W1159 HydrophobicContact CD2-CD2 3.67Å; L1005-W1159 HydrophobicContact CD2-CE3 4.16Å; L1005-W1159 HydrophobicContact CD2-CG 4Å; L1005-W1159 HydrophobicContact CD2-CH2 4.38Å; L1005-W1159 HydrophobicContact CD2-CZ2 3.94Å; L1005-W1159 HydrophobicContact CD2-CZ3 4.49Å; L1005-W1159 HydrophobicContact CG-CB 4.5Å; L1005-W1159 HydrophobicContact CG-CD2 4.13Å; L1005-W1159 HydrophobicContact CG-CG 4.06Å
1006	F	97.8	Very high	96.2	Very high	3 Å²	3	17.5 Å²	17.5	1%	0.013	9%	0.094	C	C	.	.	H	α-helix	trans	-59.1	-48.3	174.3	-175.2	-85.3	0	0	0	111.3	L847 F851 F914 I917 V929 L933 N1002 A1003 I1004 L1008 L1009 I1010	L847-F1006 HydrophobicContact CD1-CD1 4.41Å; L847-F1006 HydrophobicContact CD1-CD2 4.3Å; L847-F1006 HydrophobicContact CD1-CE1 3.93Å; L847-F1006 HydrophobicContact CD1-CE2 3.83Å; L847-F1006 HydrophobicContact CD1-CZ 3.62Å; L847-F1006 HydrophobicContact CD2-CD2 3.57Å; L847-F1006 HydrophobicContact CD2-CE2 3.52Å; L847-F1006 HydrophobicContact CD2-CG 4.33Å; L847-F1006 HydrophobicContact CD2-CZ 4.22Å; L847-F1006 HydrophobicContact CG-CE2 4.28Å; F851-F1006 HydrophobicContact CE1-CB 4.23Å; F851-F1006 HydrophobicContact CE1-CD2 4.05Å; F851-F1006 HydrophobicContact CZ-CD2 4.47Å; F914-F1006 HydrophobicContact CD1-CD2 4.4Å; F914-F1006 HydrophobicContact CD1-CE2 4.15Å; F914-F1006 AromaticContact CE1-CD2 3.44Å; F914-F1006 HydrophobicContact CE1-CD2 3.44Å; F914-F1006 VanDerWaalsContact CE1-CD2 3.44Å; F914-F1006 AromaticContact CE1-CE2 3.58Å; F914-F1006 HydrophobicContact CE1-CE2 3.58Å; F914-F1006 HydrophobicContact CE1-CG 4.18Å; F914-F1006 HydrophobicContact CE1-CZ 4.44Å; F914-F1006 HydrophobicContact CZ-CD2 4.11Å; I917-F1006 HydrophobicContact CD1-CE2 4.39Å; I917-F1006 HydrophobicContact CG2-CZ 4.32Å; V929-F1006 HydrophobicContact CG1-CD1 4.44Å; V929-F1006 HydrophobicContact CG1-CE1 3.71Å; V929-F1006 HydrophobicContact CG1-CZ 4.34Å; L933-F1006 HydrophobicContact CD1-CB 4.27Å; L933-F1006 HydrophobicContact CD1-CD1 3.48Å; L933-F1006 VanDerWaalsContact CD1-CD1 3.48Å; L933-F1006 HydrophobicContact CD1-CE1 4.18Å; L933-F1006 HydrophobicContact CD1-CG 4.11Å; N1002-F1006 WeakPolarHBondContact O-CB 3.26Å; N1002-F1006 PolarHBondContact O-N 2.95Å; A1003-F1006 PolarHBondContact O-N 3.01Å; I1004-F1006 VanDerWaalsContact C-N 3.28Å; I1004-F1006 PolarHBondContact O-N 3.3Å; F1006-L1008 VanDerWaalsContact C-N 3.32Å; F1006-L1008 PolarHBondContact O-N 3.32Å; F1006-L1009 PolarHBondContact O-N 3.33Å; F1006-I1010 HydrophobicContact CD1-CG2 4.3Å; F1006-I1010 HydrophobicContact CE1-CB 4.17Å; F1006-I1010 HydrophobicContact CE1-CG1 4.44Å; F1006-I1010 HydrophobicContact CE1-CG2 4.12Å; F1006-I1010 HydrophobicContact CZ-CB 4.48Å; F1006-I1010 WeakPolarHBondContact O-CB 3.41Å; F1006-I1010 VanDerWaalsContact O-CG2 3.25Å; F1006-I1010 WeakPolarHBondContact O-CG2 3.41Å; F1006-I1010 PolarHBondContact O-N 3.44Å
1007	C	96	Very high	96	Very high	3 Å²	3	18.7 Å²	18.7	2%	0.02	10%	0.098	C	C	.	.	H	α-helix	trans	-59.3	-42.3	178	-64.4	0	0	0	0	112.1	M930 A1003 I1004 I1010 E1011	M930-C1007 HydrophobicContact CE-CB 4.16Å; M930-C1007 WeakPolarHBondContact CE-O 3.38Å; A1003-C1007 PolarHBondContact O-N 2.71Å; A1003-C1007 VanDerWaalsContact O-N 3.13Å; A1003-C1007 PolarHBondContact O-SG 3.01Å; I1004-C1007 PolarHBondContact O-N 3.24Å; C1007-I1010 WeakPolarHBondContact O-CG2 3.42Å; C1007-E1011 WeakPolarHBondContact O-CB 3.35Å; C1007-E1011 PolarHBondContact O-N 3.49Å
1008	L	96	Very high	95.9	Very high	12 Å²	12	18.5 Å²	18.5	6%	0.063	10%	0.097	C	C	.	.	H	α-helix	trans	-63.9	-47.9	176.9	178.7	60.2	0	0	0	112.2	I1004 L1005 F1006 Q1012 F1093 W1159 Y1225	I1004-L1008 PolarHBondContact O-N 3.5Å; L1005-L1008 PolarHBondContact O-N 3.47Å; F1006-L1008 VanDerWaalsContact C-N 3.32Å; F1006-L1008 PolarHBondContact O-N 3.32Å; L1008-Q1012 WeakPolarHBondContact O-CG 3.43Å; L1008-Q1012 PolarHBondContact O-N 3.22Å; L1008-Q1012 VanDerWaalsContact O-N 3.14Å; L1008-F1093 HydrophobicContact CB-CD2 3.87Å; L1008-F1093 HydrophobicContact CB-CE2 3.66Å; L1008-F1093 HydrophobicContact CB-CZ 4.19Å; L1008-F1093 HydrophobicContact CD1-CD1 4.04Å; L1008-F1093 HydrophobicContact CD1-CD2 4.13Å; L1008-F1093 HydrophobicContact CD1-CE1 4.23Å; L1008-F1093 HydrophobicContact CD1-CE2 4.34Å; L1008-F1093 HydrophobicContact CD1-CG 3.99Å; L1008-F1093 HydrophobicContact CD1-CZ 4.39Å; L1008-F1093 HydrophobicContact CD2-CZ 4.36Å; L1008-F1093 HydrophobicContact CG-CE2 4.42Å; L1008-W1159 HydrophobicContact CD2-CH2 3.86Å; L1008-W1159 HydrophobicContact CD2-CZ3 4.2Å; L1008-Y1225 HydrophobicContact CD1-CE2 4.29Å
1009	L	96.1	Very high	95.8	Very high	8 Å²	8	21.5 Å²	21.5	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-76.1	-32.4	-172.9	-67	171.3	0	0	0	112.8	Y857 N862 F864 F914 L1005 F1006 S1013	Y857-L1009 HydrophobicContact CE2-CD1 4Å; N862-L1009 WeakPolarHBondContact OD1-CD2 3.42Å; F864-L1009 HydrophobicContact CE2-CD1 3.55Å; F864-L1009 HydrophobicContact CZ-CD1 4.05Å; F914-L1009 HydrophobicContact CD1-CB 4.22Å; F914-L1009 HydrophobicContact CD2-CB 4.37Å; F914-L1009 HydrophobicContact CE1-CB 3.95Å; F914-L1009 HydrophobicContact CE2-CB 4.16Å; F914-L1009 HydrophobicContact CE2-CD1 3.93Å; F914-L1009 HydrophobicContact CG-CB 4.44Å; F914-L1009 HydrophobicContact CZ-CB 3.95Å; F914-L1009 HydrophobicContact CZ-CD1 3.9Å; L1005-L1009 WeakPolarHBondContact O-CB 3.41Å; L1005-L1009 WeakPolarHBondContact O-CG 3.43Å; L1005-L1009 PolarHBondContact O-N 3.48Å; F1006-L1009 PolarHBondContact O-N 3.33Å; L1009-S1013 PolarHBondContact O-N 2.88Å; L1009-S1013 PolarHBondContact O-OG 3.03Å
1010	I	96.7	Very high	95.5	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-70.9	-36.7	174.6	-162.6	65.7	0	0	0	111.3	F914 I917 C918 I926 M930 F1006 C1007 S1013 L1014	F914-I1010 HydrophobicContact CD1-CB 4.34Å; F914-I1010 HydrophobicContact CD1-CD1 4.13Å; I917-I1010 HydrophobicContact CB-CD1 4.16Å; I917-I1010 HydrophobicContact CG2-CD1 3.82Å; C918-I1010 HydrophobicContact CB-CD1 4.04Å; I926-I1010 HydrophobicContact CD1-CG1 4.36Å; I926-I1010 HydrophobicContact CG1-CG1 4.2Å; I926-I1010 HydrophobicContact CG2-CG1 4.35Å; I926-I1010 HydrophobicContact CG2-CG2 4.3Å; M930-I1010 HydrophobicContact CE-CG2 3.6Å; F1006-I1010 HydrophobicContact CD1-CG2 4.3Å; F1006-I1010 HydrophobicContact CE1-CB 4.17Å; F1006-I1010 HydrophobicContact CE1-CG1 4.44Å; F1006-I1010 HydrophobicContact CE1-CG2 4.12Å; F1006-I1010 HydrophobicContact CZ-CB 4.48Å; F1006-I1010 WeakPolarHBondContact O-CB 3.41Å; F1006-I1010 VanDerWaalsContact O-CG2 3.25Å; F1006-I1010 WeakPolarHBondContact O-CG2 3.41Å; F1006-I1010 PolarHBondContact O-N 3.44Å; C1007-I1010 WeakPolarHBondContact O-CG2 3.42Å; I1010-S1013 PolarHBondContact O-N 3.06Å; I1010-L1014 WeakPolarHBondContact O-CB 3.34Å; I1010-L1014 PolarHBondContact O-N 2.49Å
1011	E	95.6	Very high	95.3	Very high	20 Å²	20	26.5 Å²	26.5	9%	0.093	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-41.4	173.4	178.7	177.4	176.8	0	0	111.9	M930 C1007 S1013 L1014 S1015 S1091 M1092 F1093	M930-E1011 HydrophobicContact CE-CB 4.42Å; C1007-E1011 WeakPolarHBondContact O-CB 3.35Å; C1007-E1011 PolarHBondContact O-N 3.49Å; E1011-S1013 VanDerWaalsContact C-N 3.31Å; E1011-S1013 PolarHBondContact O-N 3.24Å; E1011-L1014 PolarHBondContact O-N 3.2Å; E1011-S1015 PolarHBondContact O-N 3.26Å; E1011-S1015 PolarHBondContact O-OG 2.84Å; E1011-S1091 VanDerWaalsContact OE1-CA 3.26Å; E1011-S1091 WeakPolarHBondContact OE1-CA 3.4Å; E1011-S1091 WeakPolarHBondContact OE1-CB 3.38Å; E1011-M1092 HydrophobicContact CB-CE 3.93Å; E1011-M1092 HydrophobicContact CG-CE 3.76Å; E1011-M1092 PolarHBondContact OE1-N 3.3Å; E1011-M1092 PolarHBondContact OE2-N 3.03Å; E1011-F1093 WeakPolarHBondContact OE2-CB 3.46Å; E1011-F1093 PolarHBondContact OE2-N 3.34Å
1012	Q	94.4	Very high	95.1	Very high	79 Å²	79	28.1 Å²	28.1	37%	0.369	16%	0.156	S	C	.	.	H	α-helix	trans	-60.8	-42.7	173.6	-72.7	174.8	22.3	0	0	111.6	L1008 S1015 L1016	L1008-Q1012 WeakPolarHBondContact O-CG 3.43Å; L1008-Q1012 PolarHBondContact O-N 3.22Å; L1008-Q1012 VanDerWaalsContact O-N 3.14Å; Q1012-S1015 PolarHBondContact O-N 3.12Å; Q1012-L1016 WeakPolarHBondContact O-CG 3.26Å; Q1012-L1016 PolarHBondContact O-N 2.7Å; Q1012-L1016 VanDerWaalsContact O-N 3.08Å
1013	S	95.1	Very high	94.9	Very high	15 Å²	15	33.9 Å²	33.9	11%	0.105	19%	0.186	C	C	.	.	H	α-helix	trans	-65.8	-40.2	178.5	-57.9	0	0	0	0	111.6	F914 L1009 I1010 E1011 L1016 E1017	F914-S1013 VanDerWaalsContact CB-OG 3.26Å; F914-S1013 WeakPolarHBondContact CB-OG 3.48Å; L1009-S1013 PolarHBondContact O-N 2.88Å; L1009-S1013 PolarHBondContact O-OG 3.03Å; I1010-S1013 PolarHBondContact O-N 3.06Å; E1011-S1013 VanDerWaalsContact C-N 3.31Å; E1011-S1013 PolarHBondContact O-N 3.24Å; S1013-L1016 PolarHBondContact O-N 2.9Å; S1013-E1017 PolarHBondContact O-N 3.09Å
1014	L	94.3	Very high	94.6	Very high	8 Å²	8	40.6 Å²	40.6	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-42.8	174.3	-177.5	60.2	0	0	0	111.8	C918 Y923 I926 I1010 E1011 L1016 E1017 E1018 L1086 M1092	C918-L1014 WeakPolarHBondContact SG-CA 3.3Å; C918-L1014 VanDerWaalsContact SG-CD1 3.57Å; Y923-L1014 HydrophobicContact CD1-CD1 4.3Å; Y923-L1014 HydrophobicContact CD1-CD2 4.08Å; Y923-L1014 HydrophobicContact CE1-CD1 3.8Å; Y923-L1014 HydrophobicContact CE1-CD2 3.91Å; Y923-L1014 HydrophobicContact CE1-CG 4.23Å; I926-L1014 HydrophobicContact CD1-CD1 4.16Å; I926-L1014 HydrophobicContact CD1-CD2 4.12Å; I1010-L1014 WeakPolarHBondContact O-CB 3.34Å; I1010-L1014 PolarHBondContact O-N 2.49Å; E1011-L1014 PolarHBondContact O-N 3.2Å; L1014-L1016 VanDerWaalsContact C-N 3.3Å; L1014-L1016 PolarHBondContact O-N 2.87Å; L1014-E1017 PolarHBondContact O-N 2.88Å; L1014-E1018 HydrophobicContact CD1-CG 4.28Å; L1014-E1018 HydrophobicContact CG-CG 4.45Å; L1014-E1018 WeakPolarHBondContact O-CB 3.42Å; L1014-E1018 VanDerWaalsContact O-CG 3.28Å; L1014-E1018 WeakPolarHBondContact O-CG 3.44Å; L1014-E1018 PolarHBondContact O-N 3.04Å; L1014-L1086 HydrophobicContact CD2-CD1 3.68Å; L1014-M1092 HydrophobicContact CD2-CE 3.91Å
1015	S	94.1	Very high	94.5	Very high	42 Å²	42	41 Å²	41	29%	0.294	22%	0.221	S	C	.	.	H	α-helix	trans	-61.5	-39	176.5	-58.6	0	0	0	0	112.2	E1011 Q1012 V1019	E1011-S1015 PolarHBondContact O-N 3.26Å; E1011-S1015 PolarHBondContact O-OG 2.84Å; Q1012-S1015 PolarHBondContact O-N 3.12Å; S1015-V1019 WeakPolarHBondContact O-CG1 3.42Å; S1015-V1019 PolarHBondContact O-N 3.44Å; S1015-V1019 VanDerWaalsContact O-N 3.09Å
1016	L	93.1	Very high	94.3	Very high	118 Å²	118	41.8 Å²	41.8	62%	0.618	23%	0.227	S	C	*	.	H	α-helix	trans	-68.1	-37.3	175.9	-70	174.8	0	0	0	112.4	Q1012 S1013 L1014 V1019 C1020	Q1012-L1016 WeakPolarHBondContact O-CG 3.26Å; Q1012-L1016 PolarHBondContact O-N 2.7Å; Q1012-L1016 VanDerWaalsContact O-N 3.08Å; S1013-L1016 PolarHBondContact O-N 2.9Å; L1014-L1016 VanDerWaalsContact C-N 3.3Å; L1014-L1016 PolarHBondContact O-N 2.87Å; L1016-V1019 VanDerWaalsContact O-CG1 3.3Å; L1016-V1019 WeakPolarHBondContact O-CG1 3.35Å; L1016-C1020 PolarHBondContact O-N 3.39Å; L1016-C1020 PolarHBondContact O-SG 3.22Å; L1016-C1020 VanDerWaalsContact O-SG 3.39Å
1017	E	93.1	Very high	94.1	Very high	47 Å²	47	44.2 Å²	44.2	22%	0.22	24%	0.243	C	C	.	.	H	α-helix	trans	-66.8	-49.1	175.6	-172.2	170.4	153.9	0	0	111.2	C918 R919 S1013 L1014 V1019 C1020 D1021	C918-E1017 PolarHBondContact SG-OE2 3.26Å; R919-E1017 WeakPolarHBondContact CG-OE1 3.32Å; R919-E1017 VanDerWaalsContact CG-OE2 3.22Å; R919-E1017 WeakPolarHBondContact CG-OE2 3.43Å; R919-E1017 PolarHBondContact N-OE2 3.24Å; S1013-E1017 PolarHBondContact O-N 3.09Å; L1014-E1017 PolarHBondContact O-N 2.88Å; E1017-V1019 PolarHBondContact O-N 3.33Å; E1017-C1020 WeakPolarHBondContact O-CB 3.48Å; E1017-C1020 PolarHBondContact O-N 3.45Å; E1017-C1020 VanDerWaalsContact O-N 3.16Å; E1017-D1021 PolarHBondContact O-N 3.05Å
1018	E	93.7	Very high	94.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-41.4	-179.8	-70.8	178.1	143.9	0	0	113.2	Y923 L1014 C1020 D1021 L1022 R1085 L1086 C1087	Y923-E1018 VanDerWaalsContact CE1-OE1 3.26Å; Y923-E1018 WeakPolarHBondContact CE1-OE1 3.28Å; Y923-E1018 VanDerWaalsContact CZ-OE1 3.28Å; Y923-E1018 VanDerWaalsContact OH-CD 3.31Å; Y923-E1018 WeakPolarHBondContact OH-CG 3.38Å; Y923-E1018 PolarHBondContact OH-OE1 2.98Å; L1014-E1018 HydrophobicContact CD1-CG 4.28Å; L1014-E1018 HydrophobicContact CG-CG 4.45Å; L1014-E1018 WeakPolarHBondContact O-CB 3.42Å; L1014-E1018 VanDerWaalsContact O-CG 3.28Å; L1014-E1018 WeakPolarHBondContact O-CG 3.44Å; L1014-E1018 PolarHBondContact O-N 3.04Å; E1018-C1020 VanDerWaalsContact C-N 3.29Å; E1018-C1020 PolarHBondContact O-N 3.44Å; E1018-D1021 WeakPolarHBondContact O-CB 3.34Å; E1018-D1021 PolarHBondContact O-N 3.32Å; E1018-L1022 WeakPolarHBondContact O-CG 3.4Å; E1018-L1022 PolarHBondContact O-N 2.92Å; E1018-R1085 HydrophobicContact CB-CB 3.99Å; E1018-R1085 HydrophobicContact CB-CG 4.42Å; E1018-R1085 HydrophobicContact CG-CB 4.01Å; E1018-L1086 WeakPolarHBondContact OE1-CB 3.49Å; E1018-L1086 PolarHBondContact OE1-N 2.92Å; E1018-L1086 PolarHBondContact OE2-N 3.03Å; E1018-C1087 HydrophobicContact CB-CB 4.37Å; E1018-C1087 WeakPolarHBondContact OE2-CB 3.35Å; E1018-C1087 PolarHBondContact OE2-N 3.36Å
1019	V	94.2	Very high	94	Very high	63 Å²	63	49.7 Å²	49.7	38%	0.382	27%	0.267	S	S	.	.	H	α-helix	trans	-66.5	-34.8	178	70	0	0	0	0	111.3	S1015 L1016 E1017 L1022 L1023	S1015-V1019 WeakPolarHBondContact O-CG1 3.42Å; S1015-V1019 PolarHBondContact O-N 3.44Å; S1015-V1019 VanDerWaalsContact O-N 3.09Å; L1016-V1019 VanDerWaalsContact O-CG1 3.3Å; L1016-V1019 WeakPolarHBondContact O-CG1 3.35Å; E1017-V1019 PolarHBondContact O-N 3.33Å; V1019-L1022 PolarHBondContact O-N 2.78Å; V1019-L1023 VanDerWaalsContact O-CG 3.25Å; V1019-L1023 WeakPolarHBondContact O-CG 3.46Å; V1019-L1023 PolarHBondContact O-N 2.91Å
1020	C	92.1	Very high	93.9	Very high	65 Å²	65	51.3 Å²	51.3	44%	0.439	28%	0.275	S	S	.	.	H	α-helix	trans	-65.5	-40.7	173.3	-76.1	0	0	0	0	111.7	L1016 E1017 E1018 L1023 H1024	L1016-C1020 PolarHBondContact O-N 3.39Å; L1016-C1020 PolarHBondContact O-SG 3.22Å; L1016-C1020 VanDerWaalsContact O-SG 3.39Å; E1017-C1020 WeakPolarHBondContact O-CB 3.48Å; E1017-C1020 PolarHBondContact O-N 3.45Å; E1017-C1020 VanDerWaalsContact O-N 3.16Å; E1018-C1020 VanDerWaalsContact C-N 3.29Å; E1018-C1020 PolarHBondContact O-N 3.44Å; C1020-L1023 PolarHBondContact O-N 3.38Å; C1020-H1024 PolarHBondContact O-N 3.4Å; C1020-H1024 PolarHBondContact O-ND1 3.04Å
1021	D	92.4	Very high	93.7	Very high	67 Å²	67	55.9 Å²	55.9	36%	0.358	30%	0.299	S	S	.	.	H	α-helix	trans	-59.9	-48.1	174	-74.5	-8.5	0	0	0	111.1	E1017 E1018 L1023 H1024 A1025 R1085	E1017-D1021 PolarHBondContact O-N 3.05Å; E1018-D1021 WeakPolarHBondContact O-CB 3.34Å; E1018-D1021 PolarHBondContact O-N 3.32Å; D1021-L1023 VanDerWaalsContact C-N 3.32Å; D1021-L1023 PolarHBondContact O-N 3.34Å; D1021-H1024 PolarHBondContact O-N 3.06Å; D1021-H1024 VanDerWaalsContact O-N 3.13Å; D1021-A1025 PolarHBondContact O-N 3.18Å; D1021-R1085 IonicContact OD2-CZ 3.58Å; D1021-R1085 IonicContact OD2-NH1 3.36Å; D1021-R1085 IonicContact OD2-NH2 2.74Å; D1021-R1085 PolarHBondContact OD2-NH2 3.23Å
1022	L	93.5	Very high	93.5	Very high	34 Å²	34	56.6 Å²	56.6	18%	0.178	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-37.9	179.3	-72	170.1	0	0	0	112.6	E1018 V1019 H1024 A1025 A1026 T1082 R1085	E1018-L1022 WeakPolarHBondContact O-CG 3.4Å; E1018-L1022 PolarHBondContact O-N 2.92Å; V1019-L1022 PolarHBondContact O-N 2.78Å; L1022-H1024 VanDerWaalsContact C-N 3.31Å; L1022-H1024 PolarHBondContact O-N 3.44Å; L1022-A1025 PolarHBondContact O-N 3.33Å; L1022-A1026 WeakPolarHBondContact O-CB 3.26Å; L1022-A1026 PolarHBondContact O-N 2.92Å; L1022-T1082 VanDerWaalsContact CD2-O 3.32Å; L1022-T1082 WeakPolarHBondContact CD2-O 3.32Å; L1022-R1085 HydrophobicContact CD1-CB 4.34Å; L1022-R1085 HydrophobicContact CD1-CG 4.15Å; L1022-R1085 HydrophobicContact CD2-CG 3.98Å; L1022-R1085 HydrophobicContact CG-CG 4.02Å
1023	L	93.8	Very high	93.4	Very high	121 Å²	121	57.8 Å²	57.8	63%	0.634	32%	0.317	S	S	*	.	H	α-helix	trans	-63.9	-35.8	176	-74.4	171.2	0	0	0	112.4	V1019 C1020 D1021	V1019-L1023 VanDerWaalsContact O-CG 3.25Å; V1019-L1023 WeakPolarHBondContact O-CG 3.46Å; V1019-L1023 PolarHBondContact O-N 2.91Å; C1020-L1023 PolarHBondContact O-N 3.38Å; D1021-L1023 VanDerWaalsContact C-N 3.32Å; D1021-L1023 PolarHBondContact O-N 3.34Å
1024	H	91.8	Very high	93.1	Very high	144 Å²	144	67.1 Å²	67.1	67%	0.667	35%	0.351	S	S	*	.	H	α-helix	trans	-77.1	-30.2	174.9	-70.4	92.3	0	0	0	112.5	C1020 D1021 L1022 P1027	C1020-H1024 PolarHBondContact O-N 3.4Å; C1020-H1024 PolarHBondContact O-ND1 3.04Å; D1021-H1024 PolarHBondContact O-N 3.06Å; D1021-H1024 VanDerWaalsContact O-N 3.13Å; L1022-H1024 VanDerWaalsContact C-N 3.31Å; L1022-H1024 PolarHBondContact O-N 3.44Å; H1024-P1027 WeakPolarHBondContact O-CD 3.49Å
1025	A	93.1	Very high	92.9	Very high	11 Å²	11	68.5 Å²	68.5	9%	0.091	36%	0.359	C	S	.	.	H	α-helix	trans	-74.1	-30.8	176.6	0	0	0	0	0	113.1	D1021 L1022 P1027 F1028 Q1029 T1082	D1021-A1025 PolarHBondContact O-N 3.18Å; L1022-A1025 PolarHBondContact O-N 3.33Å; A1025-P1027 VanDerWaalsContact C-CD 3.45Å; A1025-P1027 VanDerWaalsContact O-N 3.15Å; A1025-F1028 PolarHBondContact O-N 3.19Å; A1025-Q1029 HydrophobicContact CB-CG 4.45Å; A1025-Q1029 PolarHBondContact O-N 3.16Å; A1025-T1082 HydrophobicContact CB-CG2 3.43Å; A1025-T1082 VanDerWaalsContact CB-CG2 3.43Å
1026	A	93.8	Very high	92.7	Very high	17 Å²	17	73.4 Å²	73.4	14%	0.14	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-46	-172.8	0	0	0	0	0	115.3	L1022 F1028 Q1029 N1030 I1031	L1022-A1026 WeakPolarHBondContact O-CB 3.26Å; L1022-A1026 PolarHBondContact O-N 2.92Å; A1026-F1028 VanDerWaalsContact C-N 3.28Å; A1026-F1028 PolarHBondContact O-N 3.01Å; A1026-Q1029 PolarHBondContact O-N 3.41Å; A1026-N1030 PolarHBondContact O-N 3.5Å; A1026-I1031 HydrophobicContact CB-CB 3.89Å; A1026-I1031 HydrophobicContact CB-CG2 4.21Å; A1026-I1031 PolarHBondContact O-N 3.15Å
1027	P	94.1	Very high	92.7	Very high	53 Å²	53	70 Å²	70	34%	0.344	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-31.1	178.6	-22.4	35	0	0	0	114.1	H1024 A1025	H1024-P1027 WeakPolarHBondContact O-CD 3.49Å; A1025-P1027 VanDerWaalsContact C-CD 3.45Å; A1025-P1027 VanDerWaalsContact O-N 3.15Å
1028	F	94.9	Very high	92.4	Very high	106 Å²	106	74.5 Å²	74.5	47%	0.465	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-17.9	-177.3	-54.5	-73.1	0	0	0	112.8	A1025 A1026 L1057 H1058 L1059	A1025-F1028 PolarHBondContact O-N 3.19Å; A1026-F1028 VanDerWaalsContact C-N 3.28Å; A1026-F1028 PolarHBondContact O-N 3.01Å; F1028-L1057 WeakPolarHBondContact CA-O 3.08Å; F1028-H1058 WeakPolarHBondContact O-CA 3.43Å; F1028-H1058 PolarHBondContact O-CD2 3.32Å; F1028-L1059 HydrophobicContact CB-CB 4.38Å; F1028-L1059 PolarHBondContact O-N 2.96Å
1029	Q	94.1	Very high	91.4	Very high	25 Å²	25	84.2 Å²	84.2	12%	0.117	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	12.7	178.5	-59.8	-171.2	-45.7	0	0	113	A1025 A1026 I1031 D1079	A1025-Q1029 HydrophobicContact CB-CG 4.45Å; A1025-Q1029 PolarHBondContact O-N 3.16Å; A1026-Q1029 PolarHBondContact O-N 3.41Å; Q1029-I1031 VanDerWaalsContact C-N 3.29Å; Q1029-I1031 HydrophobicContact CB-CD1 4.33Å; Q1029-I1031 HydrophobicContact CB-CG1 4.37Å; Q1029-I1031 PolarHBondContact O-N 2.9Å; Q1029-D1079 WeakPolarHBondContact CG-OD1 3.31Å; Q1029-D1079 PolarHBondContact NE2-O 2.76Å; Q1029-D1079 PolarHBondContact NE2-OD1 2.84Å
1030	N	93.3	Very high	90.9	Very high	42 Å²	42	85.3 Å²	85.3	23%	0.225	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	30.1	179.6	-163.4	41.5	0	0	0	114.6	A1026 E1051	A1026-N1030 PolarHBondContact O-N 3.5Å; N1030-E1051 PolarHBondContact ND2-OE1 3.19Å
1031	I	93.4	Very high	90.7	Very high	97 Å²	97	85.5 Å²	85.5	50%	0.497	44%	0.444	S	S	.	.			trans	-96.3	115.3	176.1	-58.6	173.3	0	0	0	108.6	A1026 Q1029	A1026-I1031 HydrophobicContact CB-CB 3.89Å; A1026-I1031 HydrophobicContact CB-CG2 4.21Å; A1026-I1031 PolarHBondContact O-N 3.15Å; Q1029-I1031 VanDerWaalsContact C-N 3.29Å; Q1029-I1031 HydrophobicContact CB-CD1 4.33Å; Q1029-I1031 HydrophobicContact CB-CG1 4.37Å; Q1029-I1031 PolarHBondContact O-N 2.9Å
1032	L	91.5	Very high	90.4	Very high	35 Å²	35	91.9 Å²	91.9	18%	0.183	46%	0.463	C	S	.	.			trans	-114.7	139.2	-177.8	-64.8	176	0	0	0	111.7	M1047 L1050 E1051 Y1054	L1032-M1047 HydrophobicContact CB-CE 3.94Å; L1032-L1050 HydrophobicContact CD1-CB 4.19Å; L1032-L1050 HydrophobicContact CD1-CD2 4.26Å; L1032-L1050 HydrophobicContact CD1-CG 4.01Å; L1032-E1051 HydrophobicContact CD1-CB 4.23Å; L1032-Y1054 HydrophobicContact CD1-CD2 4.3Å; L1032-Y1054 HydrophobicContact CD2-CD2 3.49Å; L1032-Y1054 VanDerWaalsContact CD2-CD2 3.49Å; L1032-Y1054 HydrophobicContact CD2-CE2 3.98Å; L1032-Y1054 HydrophobicContact CD2-CG 4.19Å
1033	P	92.2	Very high	90.1	Very high	103 Å²	103	92.9 Å²	92.9	67%	0.669	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-69	156.9	174.7	30.7	-35.3	0	0	0	110.7	V1035	P1033-V1035 PolarHBondContact O-N 2.88Å; P1033-V1035 VanDerWaalsContact O-N 3.15Å
1034	R	89.6	Confident	89.7	Confident	212 Å²	212	92.7 Å²	92.7	80%	0.8	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-61.9	117.7	177.1	-169.8	173.7	-175.5	178.8	1.3	110.5	L1043	R1034-L1043 HydrophobicContact CG-CD1 4.26Å
1035	V	90.1	Very high	89.5	Confident	37 Å²	37	88.1 Å²	88.1	22%	0.224	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-81	143.2	-178.7	69.7	0	0	0	0	111.9	P1033 V1037 L1043 K1046 M1047 L1050	P1033-V1035 PolarHBondContact O-N 2.88Å; P1033-V1035 VanDerWaalsContact O-N 3.15Å; V1035-V1037 PolarHBondContact O-N 3Å; V1035-L1043 HydrophobicContact CG1-CD1 4.1Å; V1035-K1046 HydrophobicContact CG1-CB 4.08Å; V1035-K1046 HydrophobicContact CG1-CD 3.91Å; V1035-K1046 HydrophobicContact CG1-CG 3.85Å; V1035-K1046 HydrophobicContact CG2-CD 4.17Å; V1035-K1046 HydrophobicContact CG2-CG 4.46Å; V1035-M1047 HydrophobicContact CB-SD 4.2Å; V1035-M1047 HydrophobicContact CG1-CG 4.23Å; V1035-M1047 HydrophobicContact CG1-SD 3.71Å; V1035-L1050 HydrophobicContact CB-CD2 4.37Å
1036	H	89.8	Confident	89.3	Confident	144 Å²	144	89.6 Å²	89.6	67%	0.667	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-65.1	131.2	173.1	-180	66.2	0	0	0	111.3	K1046	H1036-K1046 WeakPolarHBondContact O-CE 3.35Å; H1036-K1046 PolarHBondContact O-NZ 3.25Å
1037	V	91.7	Very high	89	Confident	47 Å²	47	91.1 Å²	91.1	29%	0.285	46%	0.464	S	S	.	.			trans	-111.3	121.1	-176.2	-174.7	0	0	0	0	108.9	V1035 E1041 L1043	V1035-V1037 PolarHBondContact O-N 3Å; V1037-E1041 HydrophobicContact CG1-CB 3.66Å; V1037-E1041 WeakPolarHBondContact CG1-O 3.09Å; V1037-L1043 HydrophobicContact CG2-CB 3.96Å; V1037-L1043 HydrophobicContact CG2-CD1 3.55Å; V1037-L1043 HydrophobicContact CG2-CG 4.36Å
1038	K	87.2	Confident	88.8	Confident	141 Å²	141	95.3 Å²	95.3	61%	0.613	48%	0.477	S	S	*	.			trans	-82.1	161.4	175.8	-70.9	-176.6	175.5	-178.6	0	110.7	G1040 E1041	K1038-G1040 PolarHBondContact O-N 3.33Å; K1038-E1041 PolarHBondContact N-OE2 3.14Å; K1038-E1041 WeakPolarHBondContact O-CB 3.37Å; K1038-E1041 PolarHBondContact O-N 3.44Å
1039	E	74.1	Confident	88.6	Confident	205 Å²	205	97.4 Å²	97.4	96%	0.958	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	125.8	175.5	-164.8	178.7	179.9	0	0	110.5
1040	G	82.8	Confident	88.3	Confident	86 Å²	86	98 Å²	98	89%	0.887	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.3	-7.4	-173.9	0	0	0	0	0	116	K1038	K1038-G1040 PolarHBondContact O-N 3.33Å
1041	E	88.4	Confident	88.3	Confident	69 Å²	69	100 Å²	100	32%	0.322	49%	0.494	S	S	.	.			trans	-99.7	148	173.5	-62.9	-175.3	137.6	0	0	112	V1037 K1038 K1046 R1049	V1037-E1041 HydrophobicContact CG1-CB 3.66Å; V1037-E1041 WeakPolarHBondContact CG1-O 3.09Å; K1038-E1041 PolarHBondContact N-OE2 3.14Å; K1038-E1041 WeakPolarHBondContact O-CB 3.37Å; K1038-E1041 PolarHBondContact O-N 3.44Å; E1041-K1046 IonicContact OE1-NZ 3.81Å; E1041-K1046 WeakPolarHBondContact OE2-CD 3.21Å; E1041-K1046 WeakPolarHBondContact OE2-CE 3.38Å; E1041-K1046 IonicContact OE2-NZ 2.71Å; E1041-K1046 PolarHBondContact OE2-NZ 3.28Å; E1041-R1049 IonicContact OE1-NH2 3.43Å
1042	R	85.9	Confident	88.3	Confident	201 Å²	201	99.6 Å²	99.6	76%	0.758	50%	0.499	S	S	*	.			trans	-100.8	137.2	169.5	-66.3	-174.5	-178.2	-177.5	0.8	110.1	D1044 A1045 K1046	R1042-D1044 VanDerWaalsContact C-N 3.32Å; R1042-D1044 PolarHBondContact O-N 2.87Å; R1042-A1045 HydrophobicContact CB-CB 4.25Å; R1042-A1045 PolarHBondContact O-N 3.04Å; R1042-K1046 PolarHBondContact O-N 3.33Å; R1042-K1046 VanDerWaalsContact O-N 3.1Å
1043	L	86.1	Confident	88.3	Confident	54 Å²	54	104.6 Å²	104.6	28%	0.283	52%	0.519	S	S	.	.	H	α-helix	trans	-54.3	-48.2	179	-177.8	63.5	0	0	0	111.3	R1034 V1035 V1037 A1045 K1046 M1047	R1034-L1043 HydrophobicContact CG-CD1 4.26Å; V1035-L1043 HydrophobicContact CG1-CD1 4.1Å; V1037-L1043 HydrophobicContact CG2-CB 3.96Å; V1037-L1043 HydrophobicContact CG2-CD1 3.55Å; V1037-L1043 HydrophobicContact CG2-CG 4.36Å; L1043-A1045 VanDerWaalsContact C-N 3.34Å; L1043-A1045 PolarHBondContact O-N 2.91Å; L1043-K1046 PolarHBondContact O-N 2.89Å; L1043-K1046 VanDerWaalsContact O-N 3.11Å; L1043-M1047 HydrophobicContact CD1-CG 3.98Å; L1043-M1047 HydrophobicContact CG-CG 4.18Å; L1043-M1047 WeakPolarHBondContact O-CB 3.42Å; L1043-M1047 WeakPolarHBondContact O-CG 2.97Å; L1043-M1047 PolarHBondContact O-N 3.27Å
1044	D	86.7	Confident	88.4	Confident	117 Å²	117	103.4 Å²	103.4	63%	0.626	50%	0.502	S	S	*	.	H	α-helix	trans	-61.4	-41.2	-178.1	-53.7	-35.3	0	0	0	112.6	R1042 K1046 K1048	R1042-D1044 VanDerWaalsContact C-N 3.32Å; R1042-D1044 PolarHBondContact O-N 2.87Å; D1044-K1046 VanDerWaalsContact C-N 3.3Å; D1044-K1046 PolarHBondContact O-N 3.46Å; D1044-K1048 WeakPolarHBondContact O-CB 3.46Å; D1044-K1048 WeakPolarHBondContact O-CG 3.49Å; D1044-K1048 PolarHBondContact O-N 2.99Å
1045	A	86.9	Confident	88.6	Confident	48 Å²	48	95.9 Å²	95.9	40%	0.397	49%	0.485	S	S	.	.	H	α-helix	trans	-69.4	-30.2	178.8	0	0	0	0	0	112	R1042 L1043 R1049	R1042-A1045 HydrophobicContact CB-CB 4.25Å; R1042-A1045 PolarHBondContact O-N 3.04Å; L1043-A1045 VanDerWaalsContact C-N 3.34Å; L1043-A1045 PolarHBondContact O-N 2.91Å; A1045-R1049 WeakPolarHBondContact O-CG 3.27Å; A1045-R1049 PolarHBondContact O-N 3.43Å; A1045-R1049 PolarHBondContact O-NE 3.03Å; A1045-R1049 VanDerWaalsContact O-NE 3.12Å
1046	K	88.3	Confident	88.7	Confident	43 Å²	43	98 Å²	98	19%	0.187	50%	0.5	C	S	.	.	H	α-helix	trans	-81.6	-40.2	177.7	-160.7	170	-173.2	170.6	0	112.1	V1035 H1036 E1041 R1042 L1043 D1044 R1049 L1050	V1035-K1046 HydrophobicContact CG1-CB 4.08Å; V1035-K1046 HydrophobicContact CG1-CD 3.91Å; V1035-K1046 HydrophobicContact CG1-CG 3.85Å; V1035-K1046 HydrophobicContact CG2-CD 4.17Å; V1035-K1046 HydrophobicContact CG2-CG 4.46Å; H1036-K1046 WeakPolarHBondContact O-CE 3.35Å; H1036-K1046 PolarHBondContact O-NZ 3.25Å; E1041-K1046 IonicContact OE1-NZ 3.81Å; E1041-K1046 WeakPolarHBondContact OE2-CD 3.21Å; E1041-K1046 WeakPolarHBondContact OE2-CE 3.38Å; E1041-K1046 IonicContact OE2-NZ 2.71Å; E1041-K1046 PolarHBondContact OE2-NZ 3.28Å; R1042-K1046 PolarHBondContact O-N 3.33Å; R1042-K1046 VanDerWaalsContact O-N 3.1Å; L1043-K1046 PolarHBondContact O-N 2.89Å; L1043-K1046 VanDerWaalsContact O-N 3.11Å; D1044-K1046 VanDerWaalsContact C-N 3.3Å; D1044-K1046 PolarHBondContact O-N 3.46Å; K1046-R1049 PolarHBondContact O-N 3.26Å; K1046-L1050 PolarHBondContact O-N 3Å
1047	M	88.9	Confident	88.9	Confident	49 Å²	49	94.8 Å²	94.8	24%	0.241	49%	0.487	C	S	.	.	H	α-helix	trans	-61.6	-45.6	174.7	-73.2	-61.5	-65.9	0	0	111.3	L1032 V1035 L1043 R1049 L1050 E1051	L1032-M1047 HydrophobicContact CB-CE 3.94Å; V1035-M1047 HydrophobicContact CB-SD 4.2Å; V1035-M1047 HydrophobicContact CG1-CG 4.23Å; V1035-M1047 HydrophobicContact CG1-SD 3.71Å; L1043-M1047 HydrophobicContact CD1-CG 3.98Å; L1043-M1047 HydrophobicContact CG-CG 4.18Å; L1043-M1047 WeakPolarHBondContact O-CB 3.42Å; L1043-M1047 WeakPolarHBondContact O-CG 2.97Å; L1043-M1047 PolarHBondContact O-N 3.27Å; M1047-R1049 VanDerWaalsContact C-N 3.33Å; M1047-R1049 PolarHBondContact O-N 3.11Å; M1047-L1050 CarbonylContact O-C 3.49Å; M1047-L1050 PolarHBondContact O-N 2.91Å; M1047-L1050 VanDerWaalsContact O-N 3.09Å; M1047-E1051 WeakPolarHBondContact O-CB 3.47Å; M1047-E1051 PolarHBondContact O-N 3.38Å
1048	K	90.1	Very high	89.1	Confident	141 Å²	141	94.9 Å²	94.9	61%	0.613	49%	0.485	S	S	*	.	H	α-helix	trans	-60.5	-39.3	175.3	-75.4	-178	176.3	-176.3	0	113.2	D1044 L1050 E1051 S1052	D1044-K1048 WeakPolarHBondContact O-CB 3.46Å; D1044-K1048 WeakPolarHBondContact O-CG 3.49Å; D1044-K1048 PolarHBondContact O-N 2.99Å; K1048-L1050 VanDerWaalsContact C-N 3.33Å; K1048-E1051 PolarHBondContact O-N 3.16Å; K1048-S1052 PolarHBondContact O-N 3.29Å; K1048-S1052 PolarHBondContact O-OG 3.5Å
1049	R	88.8	Confident	89.4	Confident	149 Å²	149	92.1 Å²	92.1	56%	0.562	48%	0.476	S	S	*	.	H	α-helix	trans	-65.5	-37	174.8	-76.1	-176.9	-69.1	-178.5	6.3	112.1	E1041 A1045 K1046 M1047 K1053	E1041-R1049 IonicContact OE1-NH2 3.43Å; A1045-R1049 WeakPolarHBondContact O-CG 3.27Å; A1045-R1049 PolarHBondContact O-N 3.43Å; A1045-R1049 PolarHBondContact O-NE 3.03Å; A1045-R1049 VanDerWaalsContact O-NE 3.12Å; K1046-R1049 PolarHBondContact O-N 3.26Å; M1047-R1049 VanDerWaalsContact C-N 3.33Å; M1047-R1049 PolarHBondContact O-N 3.11Å; R1049-K1053 PolarHBondContact O-N 3.43Å
1050	L	89.8	Confident	90.4	Very high	39 Å²	39	83.2 Å²	83.2	20%	0.204	44%	0.436	C	S	.	.	H	α-helix	trans	-73.1	-37.4	177.5	-164.6	64.6	0	0	0	111.9	L1032 V1035 K1046 M1047 K1048 K1053 Y1054	L1032-L1050 HydrophobicContact CD1-CB 4.19Å; L1032-L1050 HydrophobicContact CD1-CD2 4.26Å; L1032-L1050 HydrophobicContact CD1-CG 4.01Å; V1035-L1050 HydrophobicContact CB-CD2 4.37Å; K1046-L1050 PolarHBondContact O-N 3Å; M1047-L1050 CarbonylContact O-C 3.49Å; M1047-L1050 PolarHBondContact O-N 2.91Å; M1047-L1050 VanDerWaalsContact O-N 3.09Å; K1048-L1050 VanDerWaalsContact C-N 3.33Å; L1050-K1053 HydrophobicContact CD1-CD 4.2Å; L1050-K1053 WeakPolarHBondContact O-CB 3.42Å; L1050-K1053 PolarHBondContact O-N 3.08Å; L1050-K1053 VanDerWaalsContact O-N 3.15Å; L1050-Y1054 HydrophobicContact CD1-CD2 4.25Å; L1050-Y1054 HydrophobicContact CD1-CE2 3.76Å; L1050-Y1054 HydrophobicContact CG-CD2 4.11Å; L1050-Y1054 HydrophobicContact CG-CE2 3.97Å; L1050-Y1054 WeakPolarHBondContact O-CD2 3.49Å; L1050-Y1054 PolarHBondContact O-N 3.24Å; L1050-Y1054 VanDerWaalsContact O-N 3.15Å
1051	E	93.1	Very high	91	Very high	84 Å²	84	81.7 Å²	81.7	39%	0.393	41%	0.41	S	S	.	.	H	α-helix	trans	-59.9	-46.4	170.8	-174.6	175.4	-162.8	0	0	110.8	N1030 L1032 M1047 K1048 K1053 Y1054 A1055	N1030-E1051 PolarHBondContact ND2-OE1 3.19Å; L1032-E1051 HydrophobicContact CD1-CB 4.23Å; M1047-E1051 WeakPolarHBondContact O-CB 3.47Å; M1047-E1051 PolarHBondContact O-N 3.38Å; K1048-E1051 PolarHBondContact O-N 3.16Å; E1051-K1053 PolarHBondContact O-N 2.93Å; E1051-Y1054 CarbonylContact O-C 3.6Å; E1051-Y1054 PolarHBondContact O-N 3.4Å; E1051-Y1054 VanDerWaalsContact O-N 3.12Å; E1051-A1055 PolarHBondContact O-N 3.46Å
1052	S	92	Very high	91.3	Very high	88 Å²	88	81.1 Å²	81.1	62%	0.615	41%	0.409	S	S	*	.	H	α-helix	trans	-59.6	-33.1	173.5	-58.9	0	0	0	0	113.3	K1048	K1048-S1052 PolarHBondContact O-N 3.29Å; K1048-S1052 PolarHBondContact O-OG 3.5Å
1053	K	92.9	Very high	91.7	Very high	139 Å²	139	73.5 Å²	73.5	60%	0.604	38%	0.383	S	S	*	.	H	α-helix	trans	-66.5	-39.3	176.2	-176.4	-172	176.5	-171.5	0	111.9	R1049 L1050 E1051 P1056	R1049-K1053 PolarHBondContact O-N 3.43Å; L1050-K1053 HydrophobicContact CD1-CD 4.2Å; L1050-K1053 WeakPolarHBondContact O-CB 3.42Å; L1050-K1053 PolarHBondContact O-N 3.08Å; L1050-K1053 VanDerWaalsContact O-N 3.15Å; E1051-K1053 PolarHBondContact O-N 2.93Å; K1053-P1056 WeakPolarHBondContact O-CD 3.34Å
1054	Y	94	Very high	92.1	Very high	79 Å²	79	74.8 Å²	74.8	31%	0.31	39%	0.387	S	S	.	.	H	α-helix	trans	-98.2	-3.2	-176.6	-67.8	-65.3	0	0	0	114.4	L1032 L1050 E1051 P1056 L1057	L1032-Y1054 HydrophobicContact CD1-CD2 4.3Å; L1032-Y1054 HydrophobicContact CD2-CD2 3.49Å; L1032-Y1054 VanDerWaalsContact CD2-CD2 3.49Å; L1032-Y1054 HydrophobicContact CD2-CE2 3.98Å; L1032-Y1054 HydrophobicContact CD2-CG 4.19Å; L1050-Y1054 HydrophobicContact CD1-CD2 4.25Å; L1050-Y1054 HydrophobicContact CD1-CE2 3.76Å; L1050-Y1054 HydrophobicContact CG-CD2 4.11Å; L1050-Y1054 HydrophobicContact CG-CE2 3.97Å; L1050-Y1054 WeakPolarHBondContact O-CD2 3.49Å; L1050-Y1054 PolarHBondContact O-N 3.24Å; L1050-Y1054 VanDerWaalsContact O-N 3.15Å; E1051-Y1054 CarbonylContact O-C 3.6Å; E1051-Y1054 PolarHBondContact O-N 3.4Å; E1051-Y1054 VanDerWaalsContact O-N 3.12Å; Y1054-P1056 VanDerWaalsContact O-N 3.11Å; Y1054-L1057 HydrophobicContact CD1-CD1 3.64Å; Y1054-L1057 HydrophobicContact CD1-CG 4.41Å; Y1054-L1057 HydrophobicContact CE1-CD1 4.27Å; Y1054-L1057 WeakPolarHBondContact O-CB 3.47Å; Y1054-L1057 PolarHBondContact O-N 3.37Å
1055	A	92.8	Very high	92.5	Very high	53 Å²	53	78 Å²	78	44%	0.438	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-47.8	-35.9	172.9	0	0	0	0	0	114.6	E1051 L1057 H1058	E1051-A1055 PolarHBondContact O-N 3.46Å; A1055-L1057 PolarHBondContact O-N 3.08Å; A1055-H1058 WeakPolarHBondContact O-CB 3.3Å; A1055-H1058 PolarHBondContact O-N 2.95Å
1056	P	93.4	Very high	92.8	Very high	83 Å²	83	82 Å²	82	54%	0.539	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-65.9	-20.5	175.1	-22.6	35.1	0	0	0	115	K1053 Y1054	K1053-P1056 WeakPolarHBondContact O-CD 3.34Å; Y1054-P1056 VanDerWaalsContact O-N 3.11Å
1057	L	92.8	Very high	93.1	Very high	76 Å²	76	81 Å²	81	40%	0.398	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-87.9	-13.7	178.2	-55	-172.9	0	0	0	112.6	F1028 Y1054 A1055 L1059	F1028-L1057 WeakPolarHBondContact CA-O 3.08Å; Y1054-L1057 HydrophobicContact CD1-CD1 3.64Å; Y1054-L1057 HydrophobicContact CD1-CG 4.41Å; Y1054-L1057 HydrophobicContact CE1-CD1 4.27Å; Y1054-L1057 WeakPolarHBondContact O-CB 3.47Å; Y1054-L1057 PolarHBondContact O-N 3.37Å; A1055-L1057 PolarHBondContact O-N 3.08Å; L1057-L1059 PolarHBondContact O-N 3.25Å
1058	H	95.8	Very high	93.4	Very high	49 Å²	49	81.7 Å²	81.7	23%	0.227	41%	0.414	C	S	.	.			trans	-68.3	106.1	-178.1	-167.3	176.4	0	0	0	109.9	F1028 A1055 P1061 L1062	F1028-H1058 WeakPolarHBondContact O-CA 3.43Å; F1028-H1058 PolarHBondContact O-CD2 3.32Å; A1055-H1058 WeakPolarHBondContact O-CB 3.3Å; A1055-H1058 PolarHBondContact O-N 2.95Å; H1058-P1061 HydrophobicContact CB-CG 4.47Å; H1058-P1061 WeakPolarHBondContact CD2-CD 3.4Å; H1058-P1061 VanDerWaalsContact CE1-CG 3.47Å; H1058-P1061 WeakPolarHBondContact CE1-CG 3.45Å; H1058-P1061 VanDerWaalsContact CG-CD 3.49Å; H1058-P1061 WeakPolarHBondContact ND1-CG 3.27Å; H1058-P1061 WeakPolarHBondContact NE2-CD 3.44Å; H1058-L1062 VanDerWaalsContact O-CB 3.31Å; H1058-L1062 WeakPolarHBondContact O-CB 3.45Å; H1058-L1062 PolarHBondContact O-N 3.22Å
1059	L	93.4	Very high	93.7	Very high	83 Å²	83	79.7 Å²	79.7	44%	0.435	42%	0.415	S	S	.	.	H	α-helix	trans	-68.3	-48.6	-162.2	-176.8	63.5	0	0	0	112.8	F1028 L1057 L1062 I1063	F1028-L1059 HydrophobicContact CB-CB 4.38Å; F1028-L1059 PolarHBondContact O-N 2.96Å; L1057-L1059 PolarHBondContact O-N 3.25Å; L1059-L1062 WeakPolarHBondContact O-CB 3.43Å; L1059-L1062 PolarHBondContact O-N 3.38Å; L1059-I1063 HydrophobicContact CD1-CD1 3.81Å; L1059-I1063 HydrophobicContact CD1-CG1 4.31Å; L1059-I1063 HydrophobicContact CG-CD1 3.95Å; L1059-I1063 WeakPolarHBondContact O-CG1 3.24Å; L1059-I1063 PolarHBondContact O-N 3.42Å
1060	V	95.2	Very high	93.9	Very high	18 Å²	18	78.8 Å²	78.8	11%	0.109	42%	0.418	C	S	.	.	H	α-helix	trans	-63.8	-51.3	-175.7	175.4	0	0	0	0	111.6	L1062 I1063 E1064 R1076 D1079	V1060-L1062 VanDerWaalsContact C-N 3.25Å; V1060-L1062 PolarHBondContact O-N 2.99Å; V1060-I1063 PolarHBondContact O-N 3.45Å; V1060-I1063 VanDerWaalsContact O-N 3.16Å; V1060-E1064 HydrophobicContact CG1-CG 4.23Å; V1060-E1064 WeakPolarHBondContact O-CG 3.36Å; V1060-E1064 PolarHBondContact O-N 3.17Å; V1060-R1076 HydrophobicContact CG1-CG 4.12Å; V1060-D1079 HydrophobicContact CG2-CB 3.7Å
1061	P	95.3	Very high	94.1	Very high	53 Å²	53	81.8 Å²	81.8	34%	0.344	43%	0.431	S	S	.	.	H	α-helix	trans	-62.8	-30	176.6	-26.7	38.6	0	0	0	113.8	H1058 R1065	H1058-P1061 HydrophobicContact CB-CG 4.47Å; H1058-P1061 WeakPolarHBondContact CD2-CD 3.4Å; H1058-P1061 VanDerWaalsContact CE1-CG 3.47Å; H1058-P1061 WeakPolarHBondContact CE1-CG 3.45Å; H1058-P1061 VanDerWaalsContact CG-CD 3.49Å; H1058-P1061 WeakPolarHBondContact ND1-CG 3.27Å; H1058-P1061 WeakPolarHBondContact NE2-CD 3.44Å; P1061-R1065 WeakPolarHBondContact O-CB 3.35Å; P1061-R1065 PolarHBondContact O-N 3.09Å; P1061-R1065 VanDerWaalsContact O-N 3.1Å
1062	L	95	Very high	94.2	Very high	57 Å²	57	79.1 Å²	79.1	30%	0.298	42%	0.419	S	S	.	.	H	α-helix	trans	-66	-45	175	-176.8	65	0	0	0	111.3	H1058 L1059 V1060 R1065 L1066	H1058-L1062 VanDerWaalsContact O-CB 3.31Å; H1058-L1062 WeakPolarHBondContact O-CB 3.45Å; H1058-L1062 PolarHBondContact O-N 3.22Å; L1059-L1062 WeakPolarHBondContact O-CB 3.43Å; L1059-L1062 PolarHBondContact O-N 3.38Å; V1060-L1062 VanDerWaalsContact C-N 3.25Å; V1060-L1062 PolarHBondContact O-N 2.99Å; L1062-R1065 PolarHBondContact O-N 3.4Å; L1062-L1066 HydrophobicContact CD1-CD1 3.73Å; L1062-L1066 HydrophobicContact CG-CD1 4.42Å; L1062-L1066 PolarHBondContact O-N 2.76Å; L1062-L1066 VanDerWaalsContact O-N 3.1Å
1063	I	95.1	Very high	94.3	Very high	42 Å²	42	77.5 Å²	77.5	22%	0.215	41%	0.411	C	S	.	.	H	α-helix	trans	-70.9	-35.4	176.6	-65.9	175	0	0	0	111.1	L1059 V1060 R1065 L1066 G1067 Q1071 I1072 A1075	L1059-I1063 HydrophobicContact CD1-CD1 3.81Å; L1059-I1063 HydrophobicContact CD1-CG1 4.31Å; L1059-I1063 HydrophobicContact CG-CD1 3.95Å; L1059-I1063 WeakPolarHBondContact O-CG1 3.24Å; L1059-I1063 PolarHBondContact O-N 3.42Å; V1060-I1063 PolarHBondContact O-N 3.45Å; V1060-I1063 VanDerWaalsContact O-N 3.16Å; I1063-R1065 PolarHBondContact O-N 3.06Å; I1063-L1066 PolarHBondContact O-N 2.93Å; I1063-G1067 WeakPolarHBondContact O-CA 3.38Å; I1063-G1067 PolarHBondContact O-N 3.2Å; I1063-Q1071 HydrophobicContact CG2-CB 3.97Å; I1063-I1072 HydrophobicContact CG2-CG1 4Å; I1063-A1075 HydrophobicContact CB-CB 4.38Å; I1063-A1075 HydrophobicContact CD1-CB 3.61Å; I1063-A1075 HydrophobicContact CG2-CB 4.12Å
1064	E	94.5	Very high	94.4	Very high	80 Å²	80	76.6 Å²	76.6	37%	0.374	41%	0.411	S	S	.	.	H	α-helix	trans	-63.1	-31.1	173.8	-74.2	178.5	158.9	0	0	112.7	V1060 I1072 R1076	V1060-E1064 HydrophobicContact CG1-CG 4.23Å; V1060-E1064 WeakPolarHBondContact O-CG 3.36Å; V1060-E1064 PolarHBondContact O-N 3.17Å; E1064-I1072 HydrophobicContact CG-CG1 4.29Å; E1064-I1072 HydrophobicContact CG-CG2 3.89Å; E1064-R1076 IonicContact OE1-CZ 3.48Å; E1064-R1076 VanDerWaalsContact OE1-CZ 3.25Å; E1064-R1076 IonicContact OE1-NE 3.43Å; E1064-R1076 PolarHBondContact OE1-NE 3.42Å; E1064-R1076 IonicContact OE1-NH2 2.74Å; E1064-R1076 PolarHBondContact OE1-NH2 3.32Å
1065	R	94.5	Very high	94.3	Very high	186 Å²	186	73.5 Å²	73.5	70%	0.702	40%	0.402	S	S	*	.	H	α-helix	trans	-82.1	-35.3	179	-169.9	177.6	66.8	-172.7	-1.1	113.5	P1061 L1062 I1063	P1061-R1065 WeakPolarHBondContact O-CB 3.35Å; P1061-R1065 PolarHBondContact O-N 3.09Å; P1061-R1065 VanDerWaalsContact O-N 3.1Å; L1062-R1065 PolarHBondContact O-N 3.4Å; I1063-R1065 PolarHBondContact O-N 3.06Å
1066	L	93.9	Very high	94.3	Very high	130 Å²	130	77.6 Å²	77.6	68%	0.681	41%	0.406	S	S	*	.	H	α-helix	trans	-118.8	-16.9	-168.6	-58.1	178.8	0	0	0	114.3	L1062 I1063	L1062-L1066 HydrophobicContact CD1-CD1 3.73Å; L1062-L1066 HydrophobicContact CG-CD1 4.42Å; L1062-L1066 PolarHBondContact O-N 2.76Å; L1062-L1066 VanDerWaalsContact O-N 3.1Å; I1063-L1066 PolarHBondContact O-N 2.93Å
1067	G	94.7	Very high	94.4	Very high	24 Å²	24	79.4 Å²	79.4	25%	0.247	41%	0.407	C	S	.	.	S	Bend	trans	-94.7	166.8	-172	0	0	0	0	0	113.9	I1063	I1063-G1067 WeakPolarHBondContact O-CA 3.38Å; I1063-G1067 PolarHBondContact O-N 3.2Å
1068	T	95.4	Very high	94.4	Very high	63 Å²	63	77.4 Å²	77.4	39%	0.387	41%	0.405	S	S	.	.			trans	-77.2	160.7	174.3	59.2	0	0	0	0	111.6	Q1070 Q1071 I1072	T1068-Q1070 PolarHBondContact O-N 3.3Å; T1068-Q1071 PolarHBondContact O-N 3Å; T1068-Q1071 VanDerWaalsContact OG1-CD 3.32Å; T1068-Q1071 VanDerWaalsContact OG1-CG 3.28Å; T1068-Q1071 WeakPolarHBondContact OG1-CG 3.37Å; T1068-Q1071 PolarHBondContact OG1-N 2.84Å; T1068-Q1071 PolarHBondContact OG1-OE1 2.76Å; T1068-I1072 WeakPolarHBondContact O-CG1 3.32Å; T1068-I1072 PolarHBondContact O-N 3.14Å
1069	P	95.8	Very high	94.3	Very high	98 Å²	98	76.7 Å²	76.7	64%	0.636	40%	0.403	S	S	*	.	H	α-helix	trans	-54.4	-36.2	175.7	-27.4	35.9	0	0	0	113.9	I1072 A1073	P1069-I1072 PolarHBondContact O-N 2.85Å; P1069-A1073 PolarHBondContact O-N 3.2Å
1070	Q	93.7	Very high	94.3	Very high	131 Å²	131	75.7 Å²	75.7	61%	0.612	40%	0.397	S	S	*	.	H	α-helix	trans	-66	-45.4	176.3	-64.7	79	7.5	0	0	111.4	T1068 I1072 A1073 I1074	T1068-Q1070 PolarHBondContact O-N 3.3Å; Q1070-I1072 VanDerWaalsContact C-N 3.31Å; Q1070-I1072 PolarHBondContact O-N 3.16Å; Q1070-A1073 PolarHBondContact O-N 3.09Å; Q1070-I1074 WeakPolarHBondContact O-CD1 3.24Å; Q1070-I1074 VanDerWaalsContact O-CG1 3.27Å; Q1070-I1074 WeakPolarHBondContact O-CG1 3.38Å; Q1070-I1074 PolarHBondContact O-N 3.44Å
1071	Q	93.1	Very high	94.1	Very high	102 Å²	102	80.9 Å²	80.9	48%	0.477	42%	0.424	S	S	.	.	H	α-helix	trans	-63.7	-37.5	177.1	-72.9	166.9	-38	0	0	111.8	I1063 T1068 I1074 A1075	I1063-Q1071 HydrophobicContact CG2-CB 3.97Å; T1068-Q1071 PolarHBondContact O-N 3Å; T1068-Q1071 VanDerWaalsContact OG1-CD 3.32Å; T1068-Q1071 VanDerWaalsContact OG1-CG 3.28Å; T1068-Q1071 WeakPolarHBondContact OG1-CG 3.37Å; T1068-Q1071 PolarHBondContact OG1-N 2.84Å; T1068-Q1071 PolarHBondContact OG1-OE1 2.76Å; Q1071-I1074 PolarHBondContact O-N 3.39Å; Q1071-A1075 WeakPolarHBondContact O-CB 3.35Å; Q1071-A1075 PolarHBondContact O-N 3.25Å
1072	I	94.3	Very high	94	Very high	28 Å²	28	80.8 Å²	80.8	14%	0.144	42%	0.422	C	S	.	.	H	α-helix	trans	-63.8	-47.6	176.5	-66	167	0	0	0	110.7	I1063 E1064 T1068 P1069 Q1070 I1074 A1075 R1076	I1063-I1072 HydrophobicContact CG2-CG1 4Å; E1064-I1072 HydrophobicContact CG-CG1 4.29Å; E1064-I1072 HydrophobicContact CG-CG2 3.89Å; T1068-I1072 WeakPolarHBondContact O-CG1 3.32Å; T1068-I1072 PolarHBondContact O-N 3.14Å; P1069-I1072 PolarHBondContact O-N 2.85Å; Q1070-I1072 VanDerWaalsContact C-N 3.31Å; Q1070-I1072 PolarHBondContact O-N 3.16Å; I1072-I1074 PolarHBondContact O-N 3.44Å; I1072-A1075 PolarHBondContact O-N 3.38Å; I1072-R1076 WeakPolarHBondContact O-CG 3.24Å; I1072-R1076 PolarHBondContact O-N 3Å
1073	A	94.6	Very high	93.8	Very high	54 Å²	54	82.3 Å²	82.3	45%	0.446	43%	0.426	S	S	.	.	H	α-helix	trans	-58.8	-49.1	177.3	0	0	0	0	0	111.1	P1069 Q1070 A1075 R1076 E1077	P1069-A1073 PolarHBondContact O-N 3.2Å; Q1070-A1073 PolarHBondContact O-N 3.09Å; A1073-A1075 VanDerWaalsContact C-N 3.34Å; A1073-A1075 PolarHBondContact O-N 2.93Å; A1073-R1076 PolarHBondContact O-N 3.47Å; A1073-E1077 WeakPolarHBondContact O-CG 3.49Å; A1073-E1077 PolarHBondContact O-N 3.37Å
1074	I	94.5	Very high	93.7	Very high	120 Å²	120	86.5 Å²	86.5	62%	0.615	45%	0.445	S	S	*	.	H	α-helix	trans	-61.2	-42.4	178.2	-66.5	165.4	0	0	0	111.4	Q1070 Q1071 I1072 E1077 G1078	Q1070-I1074 WeakPolarHBondContact O-CD1 3.24Å; Q1070-I1074 VanDerWaalsContact O-CG1 3.27Å; Q1070-I1074 WeakPolarHBondContact O-CG1 3.38Å; Q1070-I1074 PolarHBondContact O-N 3.44Å; Q1071-I1074 PolarHBondContact O-N 3.39Å; I1072-I1074 PolarHBondContact O-N 3.44Å; I1074-E1077 PolarHBondContact O-N 3.43Å; I1074-G1078 PolarHBondContact O-N 3.01Å
1075	A	92.8	Very high	93.5	Very high	14 Å²	14	85 Å²	85	12%	0.116	44%	0.436	C	S	.	.	H	α-helix	trans	-66.2	-38.2	179.9	0	0	0	0	0	112.4	I1063 Q1071 I1072 A1073 D1079	I1063-A1075 HydrophobicContact CB-CB 4.38Å; I1063-A1075 HydrophobicContact CD1-CB 3.61Å; I1063-A1075 HydrophobicContact CG2-CB 4.12Å; Q1071-A1075 WeakPolarHBondContact O-CB 3.35Å; Q1071-A1075 PolarHBondContact O-N 3.25Å; I1072-A1075 PolarHBondContact O-N 3.38Å; A1073-A1075 VanDerWaalsContact C-N 3.34Å; A1073-A1075 PolarHBondContact O-N 2.93Å; A1075-D1079 VanDerWaalsContact O-CB 3.26Å; A1075-D1079 WeakPolarHBondContact O-CB 3.38Å; A1075-D1079 PolarHBondContact O-N 3.49Å
1076	R	93.6	Very high	93.4	Very high	139 Å²	139	78.3 Å²	78.3	53%	0.525	41%	0.414	S	S	.	.	H	α-helix	trans	-66.7	-43.6	175.8	-73.4	180	-176.1	162.7	0.1	111.9	V1060 E1064 I1072 A1073 D1079 L1080	V1060-R1076 HydrophobicContact CG1-CG 4.12Å; E1064-R1076 IonicContact OE1-CZ 3.48Å; E1064-R1076 VanDerWaalsContact OE1-CZ 3.25Å; E1064-R1076 IonicContact OE1-NE 3.43Å; E1064-R1076 PolarHBondContact OE1-NE 3.42Å; E1064-R1076 IonicContact OE1-NH2 2.74Å; E1064-R1076 PolarHBondContact OE1-NH2 3.32Å; I1072-R1076 WeakPolarHBondContact O-CG 3.24Å; I1072-R1076 PolarHBondContact O-N 3Å; A1073-R1076 PolarHBondContact O-N 3.47Å; R1076-D1079 PolarHBondContact O-N 3.43Å; R1076-L1080 WeakPolarHBondContact O-CB 3.44Å; R1076-L1080 PolarHBondContact O-N 2.78Å
1077	E	94.3	Very high	93.3	Very high	121 Å²	121	74.5 Å²	74.5	57%	0.565	40%	0.398	S	S	*	.	H	α-helix	trans	-62.4	-46.4	174.7	-68.2	-67.5	166.2	0	0	111.2	A1073 I1074 D1079 L1080 L1081	A1073-E1077 WeakPolarHBondContact O-CG 3.49Å; A1073-E1077 PolarHBondContact O-N 3.37Å; I1074-E1077 PolarHBondContact O-N 3.43Å; E1077-D1079 PolarHBondContact O-N 3.01Å; E1077-L1080 WeakPolarHBondContact O-CB 3.49Å; E1077-L1080 PolarHBondContact O-N 3.46Å; E1077-L1081 WeakPolarHBondContact O-CG 3.37Å; E1077-L1081 PolarHBondContact O-N 2.89Å
1078	G	93.1	Very high	93	Very high	33 Å²	33	77.3 Å²	77.3	34%	0.34	41%	0.413	S	S	.	.	H	α-helix	trans	-62.7	-41.7	177.5	0	0	0	0	0	113	I1074 L1080 L1081 T1082	I1074-G1078 PolarHBondContact O-N 3.01Å; G1078-L1080 VanDerWaalsContact C-N 3.33Å; G1078-L1080 PolarHBondContact O-N 3.27Å; G1078-L1081 PolarHBondContact O-N 3.1Å; G1078-T1082 WeakPolarHBondContact O-CB 3.32Å; G1078-T1082 PolarHBondContact O-N 3.36Å; G1078-T1082 PolarHBondContact O-OG1 3.16Å
1079	D	93.2	Very high	92.5	Very high	35 Å²	35	77.6 Å²	77.6	19%	0.187	43%	0.428	C	S	.	.	H	α-helix	trans	-62.3	-40.9	174.8	-179.9	71.5	0	0	0	111.9	Q1029 V1060 A1075 R1076 E1077 T1082 K1083	Q1029-D1079 WeakPolarHBondContact CG-OD1 3.31Å; Q1029-D1079 PolarHBondContact NE2-O 2.76Å; Q1029-D1079 PolarHBondContact NE2-OD1 2.84Å; V1060-D1079 HydrophobicContact CG2-CB 3.7Å; A1075-D1079 VanDerWaalsContact O-CB 3.26Å; A1075-D1079 WeakPolarHBondContact O-CB 3.38Å; A1075-D1079 PolarHBondContact O-N 3.49Å; R1076-D1079 PolarHBondContact O-N 3.43Å; E1077-D1079 PolarHBondContact O-N 3.01Å; D1079-T1082 PolarHBondContact O-N 2.82Å; D1079-K1083 WeakPolarHBondContact O-CG 3.35Å; D1079-K1083 PolarHBondContact O-N 3Å; D1079-K1083 IonicContact OD2-NZ 3.54Å; D1079-K1083 PolarHBondContact OD2-NZ 3.1Å
1080	L	93.6	Very high	92.2	Very high	62 Å²	62	78.8 Å²	78.8	33%	0.325	43%	0.429	S	S	.	.	H	α-helix	trans	-61.6	-50.7	177.6	-168.4	64.9	0	0	0	111.6	R1076 E1077 G1078 T1082 K1083 E1084	R1076-L1080 WeakPolarHBondContact O-CB 3.44Å; R1076-L1080 PolarHBondContact O-N 2.78Å; E1077-L1080 WeakPolarHBondContact O-CB 3.49Å; E1077-L1080 PolarHBondContact O-N 3.46Å; G1078-L1080 VanDerWaalsContact C-N 3.33Å; G1078-L1080 PolarHBondContact O-N 3.27Å; L1080-T1082 PolarHBondContact O-N 3.19Å; L1080-K1083 PolarHBondContact O-N 2.69Å; L1080-E1084 VanDerWaalsContact CD1-CD 3.46Å; L1080-E1084 HydrophobicContact CD1-CG 4.1Å; L1080-E1084 VanDerWaalsContact CD1-OE1 3.24Å; L1080-E1084 WeakPolarHBondContact CD1-OE1 3.47Å; L1080-E1084 WeakPolarHBondContact O-CB 3.35Å; L1080-E1084 PolarHBondContact O-N 2.97Å
1081	L	91.8	Very high	92	Very high	126 Å²	126	75 Å²	75	66%	0.66	42%	0.416	S	S	*	.	H	α-helix	trans	-63.1	-24.7	176.7	-66.7	173.6	0	0	0	113.6	E1077 G1078	E1077-L1081 WeakPolarHBondContact O-CG 3.37Å; E1077-L1081 PolarHBondContact O-N 2.89Å; G1078-L1081 PolarHBondContact O-N 3.1Å
1082	T	92.1	Very high	91.9	Very high	51 Å²	51	72.2 Å²	72.2	31%	0.313	40%	0.404	S	S	.	.	H	α-helix	trans	-80.9	-40	179.8	-56.2	0	0	0	0	111.7	L1022 A1025 G1078 D1079 L1080	L1022-T1082 VanDerWaalsContact CD2-O 3.32Å; L1022-T1082 WeakPolarHBondContact CD2-O 3.32Å; A1025-T1082 HydrophobicContact CB-CG2 3.43Å; A1025-T1082 VanDerWaalsContact CB-CG2 3.43Å; G1078-T1082 WeakPolarHBondContact O-CB 3.32Å; G1078-T1082 PolarHBondContact O-N 3.36Å; G1078-T1082 PolarHBondContact O-OG1 3.16Å; D1079-T1082 PolarHBondContact O-N 2.82Å; L1080-T1082 PolarHBondContact O-N 3.19Å
1083	K	90.4	Very high	91.8	Very high	89 Å²	89	70.9 Å²	70.9	39%	0.387	40%	0.397	S	S	.	.	H	α-helix	trans	-85.5	-27.6	-178.5	70.7	-165	176	-152	0	114.4	D1079 L1080 R1085 C1088	D1079-K1083 WeakPolarHBondContact O-CG 3.35Å; D1079-K1083 PolarHBondContact O-N 3Å; D1079-K1083 IonicContact OD2-NZ 3.54Å; D1079-K1083 PolarHBondContact OD2-NZ 3.1Å; L1080-K1083 PolarHBondContact O-N 2.69Å; K1083-R1085 PolarHBondContact O-N 2.79Å; K1083-C1088 PolarHBondContact O-SG 3.26Å
1084	E	93.6	Very high	91.6	Very high	130 Å²	130	70.4 Å²	70.4	61%	0.607	39%	0.385	S	S	*	.			trans	-90.6	92.5	-179.5	-64.7	-172.3	167.2	0	0	110.7	L1080	L1080-E1084 VanDerWaalsContact CD1-CD 3.46Å; L1080-E1084 HydrophobicContact CD1-CG 4.1Å; L1080-E1084 VanDerWaalsContact CD1-OE1 3.24Å; L1080-E1084 WeakPolarHBondContact CD1-OE1 3.47Å; L1080-E1084 WeakPolarHBondContact O-CB 3.35Å; L1080-E1084 PolarHBondContact O-N 2.97Å
1085	R	91.5	Very high	91.4	Very high	49 Å²	49	68.5 Å²	68.5	19%	0.185	38%	0.38	C	S	.	.			trans	-119.3	160.2	178.8	-49.4	-56.4	-73	-132.6	-14.9	110.4	Y923 E1018 D1021 L1022 K1083 C1087 C1088	Y923-R1085 VanDerWaalsContact OH-CZ 3.25Å; Y923-R1085 PolarHBondContact OH-NE 2.82Å; Y923-R1085 PolarHBondContact OH-NH2 3.29Å; E1018-R1085 HydrophobicContact CB-CB 3.99Å; E1018-R1085 HydrophobicContact CB-CG 4.42Å; E1018-R1085 HydrophobicContact CG-CB 4.01Å; D1021-R1085 IonicContact OD2-CZ 3.58Å; D1021-R1085 IonicContact OD2-NH1 3.36Å; D1021-R1085 IonicContact OD2-NH2 2.74Å; D1021-R1085 PolarHBondContact OD2-NH2 3.23Å; L1022-R1085 HydrophobicContact CD1-CB 4.34Å; L1022-R1085 HydrophobicContact CD1-CG 4.15Å; L1022-R1085 HydrophobicContact CD2-CG 3.98Å; L1022-R1085 HydrophobicContact CG-CG 4.02Å; K1083-R1085 PolarHBondContact O-N 2.79Å; R1085-C1087 VanDerWaalsContact C-N 3.32Å; R1085-C1087 PolarHBondContact O-N 3.49Å; R1085-C1088 VanDerWaalsContact O-CB 3.32Å; R1085-C1088 WeakPolarHBondContact O-CB 3.4Å; R1085-C1088 PolarHBondContact O-N 3.06Å
1086	L	90.9	Very high	91.5	Very high	45 Å²	45	68.3 Å²	68.3	24%	0.236	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-62.6	-40.8	-177.2	-65.2	176.1	0	0	0	111.5	Y923 L1014 E1018 C1088 G1089 L1090 M1092	Y923-L1086 HydrophobicContact CD1-CD1 4.27Å; Y923-L1086 HydrophobicContact CE1-CD1 3.97Å; Y923-L1086 HydrophobicContact CE1-CG 4.2Å; L1014-L1086 HydrophobicContact CD2-CD1 3.68Å; E1018-L1086 WeakPolarHBondContact OE1-CB 3.49Å; E1018-L1086 PolarHBondContact OE1-N 2.92Å; E1018-L1086 PolarHBondContact OE2-N 3.03Å; L1086-C1088 PolarHBondContact O-N 3.28Å; L1086-G1089 PolarHBondContact O-N 3.02Å; L1086-G1089 VanDerWaalsContact O-N 3.13Å; L1086-L1090 HydrophobicContact CD2-CB 4.08Å; L1086-L1090 HydrophobicContact CD2-CD1 3.85Å; L1086-L1090 PolarHBondContact O-N 3.17Å; L1086-L1090 VanDerWaalsContact O-O 3.12Å; L1086-M1092 HydrophobicContact CD1-CE 3.99Å; L1086-M1092 HydrophobicContact CD1-SD 4.13Å
1087	C	91.9	Very high	91.5	Very high	51 Å²	51	61.8 Å²	61.8	35%	0.345	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-60.4	-12.4	179.2	73.5	0	0	0	0	114.8	E1018 R1085 G1089	E1018-C1087 HydrophobicContact CB-CB 4.37Å; E1018-C1087 WeakPolarHBondContact OE2-CB 3.35Å; E1018-C1087 PolarHBondContact OE2-N 3.36Å; R1085-C1087 VanDerWaalsContact C-N 3.32Å; R1085-C1087 PolarHBondContact O-N 3.49Å; C1087-G1089 VanDerWaalsContact C-N 3.28Å; C1087-G1089 PolarHBondContact O-N 3.3Å
1088	C	88.4	Confident	91.4	Very high	83 Å²	83	58.7 Å²	58.7	56%	0.561	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-73.1	-15.3	176.4	-64.2	0	0	0	0	113.8	K1083 R1085 L1086	K1083-C1088 PolarHBondContact O-SG 3.26Å; R1085-C1088 VanDerWaalsContact O-CB 3.32Å; R1085-C1088 WeakPolarHBondContact O-CB 3.4Å; R1085-C1088 PolarHBondContact O-N 3.06Å; L1086-C1088 PolarHBondContact O-N 3.28Å
1089	G	86.1	Confident	91.4	Very high	69 Å²	69	61.5 Å²	61.5	71%	0.711	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	165	12	177.8	0	0	0	0	0	117.1	L1086 C1087	L1086-G1089 PolarHBondContact O-N 3.02Å; L1086-G1089 VanDerWaalsContact O-N 3.13Å; C1087-G1089 VanDerWaalsContact C-N 3.28Å; C1087-G1089 PolarHBondContact O-N 3.3Å
1090	L	88.8	Confident	91.5	Very high	123 Å²	123	59.8 Å²	59.8	64%	0.644	33%	0.333	S	S	*	.			trans	-117.9	148.3	-179.9	-62.2	172.7	0	0	0	110.4	L1086	L1086-L1090 HydrophobicContact CD2-CB 4.08Å; L1086-L1090 HydrophobicContact CD2-CD1 3.85Å; L1086-L1090 PolarHBondContact O-N 3.17Å; L1086-L1090 VanDerWaalsContact O-O 3.12Å
1091	S	88.5	Confident	91.5	Very high	51 Å²	51	61.7 Å²	61.7	36%	0.357	34%	0.336	S	S	.	.			trans	-136.6	147.7	173	70.3	0	0	0	0	110.7	E1011	E1011-S1091 VanDerWaalsContact OE1-CA 3.26Å; E1011-S1091 WeakPolarHBondContact OE1-CA 3.4Å; E1011-S1091 WeakPolarHBondContact OE1-CB 3.38Å
1092	M	90.9	Very high	91.6	Very high	43 Å²	43	58.6 Å²	58.6	21%	0.212	32%	0.324	C	S	.	.	S	Bend	trans	-102.7	-35.5	-176.5	-63.7	-177.9	-74.1	0	0	112	M930 E1011 L1014 L1086 E1094 V1095 I1096	M930-M1092 HydrophobicContact CE-CE 3.91Å; M930-M1092 HydrophobicContact CE-SD 4.27Å; M930-M1092 HydrophobicContact SD-CE 4.32Å; M930-M1092 HydrophobicContact SD-SD 3.92Å; E1011-M1092 HydrophobicContact CB-CE 3.93Å; E1011-M1092 HydrophobicContact CG-CE 3.76Å; E1011-M1092 PolarHBondContact OE1-N 3.3Å; E1011-M1092 PolarHBondContact OE2-N 3.03Å; L1014-M1092 HydrophobicContact CD2-CE 3.91Å; L1086-M1092 HydrophobicContact CD1-CE 3.99Å; L1086-M1092 HydrophobicContact CD1-SD 4.13Å; M1092-E1094 VanDerWaalsContact C-N 3.26Å; M1092-E1094 PolarHBondContact O-N 2.91Å; M1092-V1095 WeakPolarHBondContact O-CA 3.41Å; M1092-V1095 WeakPolarHBondContact O-CB 3.3Å; M1092-V1095 PolarHBondContact O-N 2.85Å; M1092-I1096 WeakPolarHBondContact O-CG1 3.25Å; M1092-I1096 PolarHBondContact O-N 3.2Å
1093	F	92.9	Very high	91.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-57.4	-36.4	-173.2	-166.8	-117.3	0	0	0	113.6	I1004 L1008 E1011 V1095 I1096 L1097 W1159 L1222 Y1225	I1004-F1093 HydrophobicContact CG2-CE2 3.69Å; I1004-F1093 HydrophobicContact CG2-CZ 3.79Å; L1008-F1093 HydrophobicContact CB-CD2 3.87Å; L1008-F1093 HydrophobicContact CB-CE2 3.66Å; L1008-F1093 HydrophobicContact CB-CZ 4.19Å; L1008-F1093 HydrophobicContact CD1-CD1 4.04Å; L1008-F1093 HydrophobicContact CD1-CD2 4.13Å; L1008-F1093 HydrophobicContact CD1-CE1 4.23Å; L1008-F1093 HydrophobicContact CD1-CE2 4.34Å; L1008-F1093 HydrophobicContact CD1-CG 3.99Å; L1008-F1093 HydrophobicContact CD1-CZ 4.39Å; L1008-F1093 HydrophobicContact CD2-CZ 4.36Å; L1008-F1093 HydrophobicContact CG-CE2 4.42Å; E1011-F1093 WeakPolarHBondContact OE2-CB 3.46Å; E1011-F1093 PolarHBondContact OE2-N 3.34Å; F1093-V1095 VanDerWaalsContact C-N 3.35Å; F1093-V1095 PolarHBondContact O-N 2.96Å; F1093-I1096 PolarHBondContact O-N 3.4Å; F1093-L1097 HydrophobicContact CD1-CD1 3.97Å; F1093-L1097 HydrophobicContact CD1-CG 4.41Å; F1093-L1097 HydrophobicContact CE1-CD1 3.69Å; F1093-L1097 HydrophobicContact CE1-CD2 4.49Å; F1093-L1097 HydrophobicContact CE1-CG 4.17Å; F1093-L1097 HydrophobicContact CZ-CD1 4.25Å; F1093-L1097 HydrophobicContact CZ-CD2 4.22Å; F1093-L1097 HydrophobicContact CZ-CG 4.31Å; F1093-L1097 WeakPolarHBondContact O-CG 3.46Å; F1093-L1097 PolarHBondContact O-N 2.85Å; F1093-W1159 HydrophobicContact CZ-CZ3 4.4Å; F1093-L1222 HydrophobicContact CE1-CD2 4.27Å; F1093-L1222 HydrophobicContact CZ-CD2 4.27Å; F1093-Y1225 HydrophobicContact CD1-CD1 4.14Å; F1093-Y1225 AromaticContact CD1-CD2 3.79Å; F1093-Y1225 HydrophobicContact CD1-CD2 3.79Å; F1093-Y1225 HydrophobicContact CD1-CE2 4.35Å; F1093-Y1225 AromaticContact CD1-CG 3.68Å; F1093-Y1225 HydrophobicContact CD1-CG 3.68Å; F1093-Y1225 HydrophobicContact CE1-CD2 4.06Å; F1093-Y1225 HydrophobicContact CE1-CG 4.31Å
1094	E	90.1	Very high	92	Very high	44 Å²	44	52.9 Å²	52.9	21%	0.206	30%	0.295	C	S	.	.	H	α-helix	trans	-60.4	-43.4	173.7	-179.6	-179.1	164.6	0	0	112.2	M1092 I1096 L1097 T1098 Y1225 S1228	M1092-E1094 VanDerWaalsContact C-N 3.26Å; M1092-E1094 PolarHBondContact O-N 2.91Å; E1094-I1096 VanDerWaalsContact C-N 3.35Å; E1094-L1097 PolarHBondContact O-N 3.13Å; E1094-T1098 WeakPolarHBondContact O-CB 3.28Å; E1094-T1098 PolarHBondContact O-N 3.27Å; E1094-T1098 PolarHBondContact O-OG1 3.26Å; E1094-Y1225 WeakPolarHBondContact CG-O 3.26Å; E1094-S1228 VanDerWaalsContact OE2-CB 3.24Å; E1094-S1228 WeakPolarHBondContact OE2-CB 3.4Å; E1094-S1228 PolarHBondContact OE2-OG 2.87Å
1095	V	91.9	Very high	91.9	Very high	81 Å²	81	52 Å²	52	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-41.5	178.9	-178.7	0	0	0	0	110.4	M1092 F1093 T1098 R1099	M1092-V1095 WeakPolarHBondContact O-CA 3.41Å; M1092-V1095 WeakPolarHBondContact O-CB 3.3Å; M1092-V1095 PolarHBondContact O-N 2.85Å; F1093-V1095 VanDerWaalsContact C-N 3.35Å; F1093-V1095 PolarHBondContact O-N 2.96Å; V1095-T1098 PolarHBondContact O-N 3.44Å; V1095-R1099 WeakPolarHBondContact O-CG 3.19Å; V1095-R1099 PolarHBondContact O-N 3.44Å
1096	I	93.5	Very high	92.1	Very high	10 Å²	10	51.8 Å²	51.8	5%	0.051	30%	0.297	C	S	.	.	H	α-helix	trans	-58.4	-52	175.8	-61	-56.8	0	0	0	110.4	M930 L934 I1004 M1092 F1093 E1094 T1098 R1099 I1100	M930-I1096 HydrophobicContact CB-CD1 4.45Å; M930-I1096 HydrophobicContact SD-CD1 4.47Å; L934-I1096 HydrophobicContact CD1-CD1 3.78Å; L934-I1096 HydrophobicContact CD2-CD1 4.41Å; L934-I1096 HydrophobicContact CD2-CG2 3.96Å; L934-I1096 HydrophobicContact CG-CD1 4.14Å; I1004-I1096 HydrophobicContact CD1-CG2 3.97Å; M1092-I1096 WeakPolarHBondContact O-CG1 3.25Å; M1092-I1096 PolarHBondContact O-N 3.2Å; F1093-I1096 PolarHBondContact O-N 3.4Å; E1094-I1096 VanDerWaalsContact C-N 3.35Å; I1096-T1098 PolarHBondContact O-N 2.9Å; I1096-R1099 PolarHBondContact O-N 2.95Å; I1096-I1100 HydrophobicContact CG2-CD1 3.88Å; I1096-I1100 WeakPolarHBondContact O-CG1 3.4Å; I1096-I1100 PolarHBondContact O-N 2.93Å
1097	L	93.1	Very high	92.2	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-61.1	-43.2	178.9	-69.2	180	0	0	0	112.3	F1093 E1094 R1099 I1100 R1101 M1163 L1167 L1222 L1226	F1093-L1097 HydrophobicContact CD1-CD1 3.97Å; F1093-L1097 HydrophobicContact CD1-CG 4.41Å; F1093-L1097 HydrophobicContact CE1-CD1 3.69Å; F1093-L1097 HydrophobicContact CE1-CD2 4.49Å; F1093-L1097 HydrophobicContact CE1-CG 4.17Å; F1093-L1097 HydrophobicContact CZ-CD1 4.25Å; F1093-L1097 HydrophobicContact CZ-CD2 4.22Å; F1093-L1097 HydrophobicContact CZ-CG 4.31Å; F1093-L1097 WeakPolarHBondContact O-CG 3.46Å; F1093-L1097 PolarHBondContact O-N 2.85Å; E1094-L1097 PolarHBondContact O-N 3.13Å; L1097-R1099 VanDerWaalsContact C-N 3.34Å; L1097-R1099 PolarHBondContact O-N 3.37Å; L1097-I1100 PolarHBondContact O-N 3.48Å; L1097-R1101 PolarHBondContact O-N 2.78Å; L1097-M1163 HydrophobicContact CD2-CG 4Å; L1097-M1163 HydrophobicContact CD2-SD 4.14Å; L1097-L1167 HydrophobicContact CB-CD2 4.21Å; L1097-L1222 HydrophobicContact CD1-CD2 3.98Å; L1097-L1222 HydrophobicContact CD2-CD2 3.91Å; L1097-L1226 HydrophobicContact CB-CD1 4.16Å
1098	T	92.4	Very high	92.2	Very high	56 Å²	56	53.5 Å²	53.5	34%	0.344	31%	0.308	S	S	.	.	H	α-helix	trans	-62.2	-41	179.3	-62.8	0	0	0	0	111.8	E1094 V1095 I1096 R1101	E1094-T1098 WeakPolarHBondContact O-CB 3.28Å; E1094-T1098 PolarHBondContact O-N 3.27Å; E1094-T1098 PolarHBondContact O-OG1 3.26Å; V1095-T1098 PolarHBondContact O-N 3.44Å; I1096-T1098 PolarHBondContact O-N 2.9Å; T1098-R1101 WeakPolarHBondContact O-CB 3.46Å; T1098-R1101 PolarHBondContact O-N 2.92Å
1099	R	93.8	Very high	92.4	Very high	91 Å²	91	49.6 Å²	49.6	34%	0.343	28%	0.282	S	S	.	.	H	α-helix	trans	-67.8	-40.4	175.6	-74.3	178.9	67.5	-176	-4.2	111.8	E931 V1095 I1096 L1097 R1101 S1102	E931-R1099 IonicContact OE1-CZ 3.31Å; E931-R1099 IonicContact OE1-NH1 3.45Å; E931-R1099 PolarHBondContact OE1-NH1 3.13Å; E931-R1099 IonicContact OE1-NH2 2.74Å; E931-R1099 IonicContact OE2-CZ 2.84Å; E931-R1099 IonicContact OE2-NH1 3.25Å; E931-R1099 PolarHBondContact OE2-NH1 3.16Å; E931-R1099 IonicContact OE2-NH2 2.78Å; E931-R1099 PolarHBondContact OE2-NH2 2.98Å; V1095-R1099 WeakPolarHBondContact O-CG 3.19Å; V1095-R1099 PolarHBondContact O-N 3.44Å; I1096-R1099 PolarHBondContact O-N 2.95Å; L1097-R1099 VanDerWaalsContact C-N 3.34Å; L1097-R1099 PolarHBondContact O-N 3.37Å; R1099-R1101 VanDerWaalsContact C-N 3.25Å; R1099-R1101 PolarHBondContact O-N 3.09Å; R1099-S1102 WeakPolarHBondContact O-CB 3.26Å; R1099-S1102 PolarHBondContact O-N 3.24Å; R1099-S1102 VanDerWaalsContact O-N 3.09Å; R1099-S1102 PolarHBondContact O-OG 3.4Å
1100	I	95.4	Very high	92.8	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-32.7	178.6	-67.8	164.9	0	0	0	112	L934 V937 L941 I1004 I1096 L1097 S1102 F1103 M1163 L1167	L934-I1100 HydrophobicContact CD2-CD1 3.89Å; L934-I1100 HydrophobicContact CD2-CG1 3.61Å; V937-I1100 HydrophobicContact CG1-CD1 4.1Å; V937-I1100 HydrophobicContact CG1-CG1 4.1Å; V937-I1100 HydrophobicContact CG1-CG2 4.2Å; L941-I1100 HydrophobicContact CD1-CG2 3.76Å; I1004-I1100 HydrophobicContact CD1-CD1 3.08Å; I1004-I1100 HydrophobicContact CG1-CD1 4.28Å; I1096-I1100 HydrophobicContact CG2-CD1 3.88Å; I1096-I1100 WeakPolarHBondContact O-CG1 3.4Å; I1096-I1100 PolarHBondContact O-N 2.93Å; L1097-I1100 PolarHBondContact O-N 3.48Å; I1100-S1102 PolarHBondContact O-N 3.44Å; I1100-F1103 HydrophobicContact CB-CD2 4.27Å; I1100-F1103 HydrophobicContact CB-CE2 4.46Å; I1100-F1103 HydrophobicContact CG1-CD2 4.13Å; I1100-F1103 HydrophobicContact CG1-CE2 3.92Å; I1100-F1103 HydrophobicContact CG2-CD2 4.35Å; I1100-F1103 VanDerWaalsContact O-CB 3.32Å; I1100-F1103 WeakPolarHBondContact O-CB 3.39Å; I1100-F1103 PolarHBondContact O-N 3Å; I1100-M1163 HydrophobicContact CD1-SD 4.17Å; I1100-M1163 HydrophobicContact CG2-CE 3.66Å; I1100-M1163 HydrophobicContact CG2-SD 4.03Å; I1100-L1167 HydrophobicContact CB-CD1 4.06Å; I1100-L1167 HydrophobicContact CG2-CD1 3.72Å
1101	R	92.9	Very high	92.9	Very high	102 Å²	102	46.2 Å²	46.2	39%	0.385	25%	0.246	S	C	.	.	H	α-helix	trans	-55.2	-37.1	173.7	-172.8	169.1	59.7	-169.8	-2.3	112.3	L1097 T1098 R1099 F1103 L1104 L1167	L1097-R1101 PolarHBondContact O-N 2.78Å; T1098-R1101 WeakPolarHBondContact O-CB 3.46Å; T1098-R1101 PolarHBondContact O-N 2.92Å; R1099-R1101 VanDerWaalsContact C-N 3.25Å; R1099-R1101 PolarHBondContact O-N 3.09Å; R1101-F1103 PolarHBondContact O-N 2.8Å; R1101-L1104 PolarHBondContact O-N 3.35Å; R1101-L1167 HydrophobicContact CB-CB 4.24Å; R1101-L1167 HydrophobicContact CB-CD1 4.38Å; R1101-L1167 HydrophobicContact CB-CD2 4.23Å; R1101-L1167 WeakPolarHBondContact CD-O 3.47Å; R1101-L1167 HydrophobicContact CG-CB 4.23Å
1102	S	93.6	Very high	93.1	Very high	61 Å²	61	47.9 Å²	47.9	43%	0.427	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-12	176.4	76.4	0	0	0	0	114	R1099 I1100 L1104	R1099-S1102 WeakPolarHBondContact O-CB 3.26Å; R1099-S1102 PolarHBondContact O-N 3.24Å; R1099-S1102 VanDerWaalsContact O-N 3.09Å; R1099-S1102 PolarHBondContact O-OG 3.4Å; I1100-S1102 PolarHBondContact O-N 3.44Å; S1102-L1104 VanDerWaalsContact C-N 3.3Å
1103	F	96.1	Very high	93	Very high	20 Å²	20	53.4 Å²	53.4	9%	0.088	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-12.9	176.5	-52.5	-21.7	0	0	0	112.1	L934 K938 Q942 I1100 R1101	L934-F1103 HydrophobicContact CD2-CE2 4.32Å; K938-F1103 HydrophobicContact CB-CD1 4.33Å; K938-F1103 HydrophobicContact CB-CD2 3.7Å; K938-F1103 HydrophobicContact CB-CE1 4.3Å; K938-F1103 HydrophobicContact CB-CE2 3.66Å; K938-F1103 HydrophobicContact CB-CG 4.06Å; K938-F1103 HydrophobicContact CB-CZ 3.98Å; K938-F1103 HydrophobicContact CD-CD1 4.05Å; K938-F1103 HydrophobicContact CD-CE1 3.89Å; K938-F1103 HydrophobicContact CD-CZ 4.24Å; K938-F1103 HydrophobicContact CG-CD1 3.92Å; K938-F1103 HydrophobicContact CG-CD2 4.12Å; K938-F1103 HydrophobicContact CG-CE1 4.13Å; K938-F1103 HydrophobicContact CG-CE2 4.31Å; K938-F1103 HydrophobicContact CG-CG 3.94Å; K938-F1103 HydrophobicContact CG-CZ 4.32Å; Q942-F1103 HydrophobicContact CG-CB 4.44Å; Q942-F1103 WeakPolarHBondContact CG-O 3.47Å; Q942-F1103 PolarHBondContact NE2-O 3.26Å; Q942-F1103 VanDerWaalsContact NE2-O 3.12Å; I1100-F1103 HydrophobicContact CB-CD2 4.27Å; I1100-F1103 HydrophobicContact CB-CE2 4.46Å; I1100-F1103 HydrophobicContact CG1-CD2 4.13Å; I1100-F1103 HydrophobicContact CG1-CE2 3.92Å; I1100-F1103 HydrophobicContact CG2-CD2 4.35Å; I1100-F1103 VanDerWaalsContact O-CB 3.32Å; I1100-F1103 WeakPolarHBondContact O-CB 3.39Å; I1100-F1103 PolarHBondContact O-N 3Å; R1101-F1103 PolarHBondContact O-N 2.8Å
1104	L	95	Very high	92.9	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.292	C	S	.	.			trans	-103.2	36.4	-174.2	-57.6	172.6	0	0	0	113	L941 R1101 S1102 W1109 R1110 I1164 L1167 L1168	L941-L1104 HydrophobicContact CD1-CD2 4.2Å; L941-L1104 HydrophobicContact CD2-CD2 4.37Å; R1101-L1104 PolarHBondContact O-N 3.35Å; S1102-L1104 VanDerWaalsContact C-N 3.3Å; L1104-W1109 HydrophobicContact CB-CG 4.33Å; L1104-W1109 HydrophobicContact CD2-CD2 3.9Å; L1104-W1109 HydrophobicContact CD2-CE3 4.26Å; L1104-W1109 HydrophobicContact CD2-CG 4.41Å; L1104-W1109 HydrophobicContact CD2-CH2 4.12Å; L1104-W1109 HydrophobicContact CD2-CZ2 3.74Å; L1104-W1109 HydrophobicContact CD2-CZ3 4.35Å; L1104-R1110 PolarHBondContact O-NH1 3.31Å; L1104-I1164 HydrophobicContact CD1-CG2 4.09Å; L1104-I1164 HydrophobicContact CD2-CG2 4.47Å; L1104-L1167 HydrophobicContact CD1-CB 4.25Å; L1104-L1168 HydrophobicContact CB-CD2 4.13Å; L1104-L1168 HydrophobicContact CD1-CD2 4.33Å; L1104-L1168 HydrophobicContact CD1-CG 4.29Å
1105	D	92.8	Very high	92.8	Very high	112 Å²	112	57.5 Å²	57.5	60%	0.599	32%	0.318	S	S	*	.			trans	-79.8	-14.6	-177.2	-72.5	-18.7	0	0	0	114.2
1106	D	95.1	Very high	92.7	Very high	43 Å²	43	57.9 Å²	57.9	23%	0.23	32%	0.317	C	S	.	.	S	Bend	trans	-59.6	135.2	177.4	-167.5	-71.1	0	0	0	111.1	L946 K950 I1108 W1109	L946-D1106 HydrophobicContact CD1-CB 3.96Å; L946-D1106 HydrophobicContact CD2-CB 4.28Å; K950-D1106 WeakPolarHBondContact CE-OD1 3.36Å; K950-D1106 VanDerWaalsContact CE-OD2 3.27Å; K950-D1106 WeakPolarHBondContact CE-OD2 3.33Å; K950-D1106 IonicContact NZ-OD1 2.7Å; K950-D1106 IonicContact NZ-OD2 2.79Å; K950-D1106 PolarHBondContact NZ-OD2 3.08Å; D1106-I1108 HydrophobicContact CB-CG2 4.39Å; D1106-I1108 PolarHBondContact O-N 2.7Å; D1106-I1108 VanDerWaalsContact O-N 3.12Å; D1106-I1108 WeakPolarHBondContact OD1-CB 3.34Å; D1106-I1108 WeakPolarHBondContact OD1-CG2 3.23Å; D1106-I1108 PolarHBondContact OD1-N 3.47Å; D1106-W1109 PolarHBondContact O-N 3.39Å
1107	P	92.5	Very high	92.3	Very high	98 Å²	98	59.3 Å²	59.3	64%	0.636	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-60.9	-24.9	-175.4	23.9	-35.6	0	0	0	113.5	W1109 R1110 G1111	P1107-W1109 PolarHBondContact O-N 3.47Å; P1107-W1109 VanDerWaalsContact O-N 3.15Å; P1107-R1110 PolarHBondContact O-N 2.92Å; P1107-G1111 PolarHBondContact O-N 3.27Å
1108	I	93.1	Very high	92.1	Very high	34 Å²	34	62.5 Å²	62.5	17%	0.174	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-60.9	-26.9	-178.3	-162.7	62.6	0	0	0	113.1	L946 V949 K950 M953 D1106 R1110	L946-I1108 HydrophobicContact CD1-CG2 3.59Å; V949-I1108 HydrophobicContact CG1-CG1 4.48Å; V949-I1108 HydrophobicContact CG1-CG2 4.35Å; K950-I1108 HydrophobicContact CG-CB 4.17Å; K950-I1108 HydrophobicContact CG-CG1 3.96Å; K950-I1108 HydrophobicContact CG-CG2 3.96Å; M953-I1108 HydrophobicContact CB-CD1 4.16Å; M953-I1108 HydrophobicContact CB-CG1 4.46Å; M953-I1108 HydrophobicContact CG-CD1 3.96Å; D1106-I1108 HydrophobicContact CB-CG2 4.39Å; D1106-I1108 PolarHBondContact O-N 2.7Å; D1106-I1108 VanDerWaalsContact O-N 3.12Å; D1106-I1108 WeakPolarHBondContact OD1-CB 3.34Å; D1106-I1108 WeakPolarHBondContact OD1-CG2 3.23Å; D1106-I1108 PolarHBondContact OD1-N 3.47Å; I1108-R1110 PolarHBondContact O-N 3.21Å
1109	W	93	Very high	92	Very high	1 Å²	1	62.8 Å²	62.8	0%	0.004	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-67	-37.5	-179.6	-63.5	114.5	0	0	0	112.4	I945 L946 V949 L1104 D1106 P1107 F1127 I1164 L1168 Q1170	I945-W1109 HydrophobicContact CG2-CH2 4.07Å; L946-W1109 HydrophobicContact CB-CZ2 4.39Å; L946-W1109 HydrophobicContact CD1-CZ2 3.85Å; V949-W1109 HydrophobicContact CB-CH2 4.36Å; V949-W1109 HydrophobicContact CB-CZ3 4.43Å; V949-W1109 HydrophobicContact CG1-CE3 4.35Å; V949-W1109 HydrophobicContact CG1-CH2 4.46Å; V949-W1109 HydrophobicContact CG1-CZ3 4.13Å; V949-W1109 HydrophobicContact CG2-CH2 3.86Å; V949-W1109 HydrophobicContact CG2-CZ3 3.88Å; L1104-W1109 HydrophobicContact CB-CG 4.33Å; L1104-W1109 HydrophobicContact CD2-CD2 3.9Å; L1104-W1109 HydrophobicContact CD2-CE3 4.26Å; L1104-W1109 HydrophobicContact CD2-CG 4.41Å; L1104-W1109 HydrophobicContact CD2-CH2 4.12Å; L1104-W1109 HydrophobicContact CD2-CZ2 3.74Å; L1104-W1109 HydrophobicContact CD2-CZ3 4.35Å; D1106-W1109 PolarHBondContact O-N 3.39Å; P1107-W1109 PolarHBondContact O-N 3.47Å; P1107-W1109 VanDerWaalsContact O-N 3.15Å; W1109-F1127 HydrophobicContact CE3-CB 4.06Å; W1109-F1127 AromaticContact CE3-CD2 3.7Å; W1109-F1127 HydrophobicContact CE3-CD2 3.7Å; W1109-F1127 HydrophobicContact CE3-CE2 4.37Å; W1109-F1127 AromaticContact CE3-CG 3.92Å; W1109-F1127 HydrophobicContact CE3-CG 3.92Å; W1109-F1127 AromaticContact CZ3-CD2 3.44Å; W1109-F1127 HydrophobicContact CZ3-CD2 3.44Å; W1109-F1127 VanDerWaalsContact CZ3-CD2 3.44Å; W1109-F1127 AromaticContact CZ3-CE2 3.67Å; W1109-F1127 HydrophobicContact CZ3-CE2 3.67Å; W1109-F1127 HydrophobicContact CZ3-CG 4.04Å; W1109-F1127 HydrophobicContact CZ3-CZ 4.43Å; W1109-F1127 PolarHBondContact O-N 2.9Å; W1109-I1164 HydrophobicContact CE3-CG2 3.95Å; W1109-I1164 HydrophobicContact CZ3-CD1 4.4Å; W1109-I1164 HydrophobicContact CZ3-CG2 3.89Å; W1109-L1168 HydrophobicContact CB-CD1 3.86Å; W1109-L1168 HydrophobicContact CB-CD2 3.8Å; W1109-L1168 HydrophobicContact CE3-CD1 4.4Å; W1109-Q1170 PolarHBondContact O-NE2 3.45Å
1110	R	92.8	Very high	91.9	Very high	100 Å²	100	58.8 Å²	58.8	38%	0.377	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-22	-176.7	-62.5	178.3	-173.6	75.9	-1.2	113.3	L1104 P1107 I1108 L1168	L1104-R1110 PolarHBondContact O-NH1 3.31Å; P1107-R1110 PolarHBondContact O-N 2.92Å; I1108-R1110 PolarHBondContact O-N 3.21Å; R1110-L1168 HydrophobicContact CG-CD2 4.12Å
1111	G	91.6	Very high	91.6	Very high	22 Å²	22	61.5 Å²	61.5	23%	0.227	35%	0.353	C	S	.	.			trans	72.5	-178.4	-175.5	0	0	0	0	0	113.6	P1107 V1125	P1107-G1111 PolarHBondContact O-N 3.27Å; G1111-V1125 VanDerWaalsContact CA-O 3.28Å; G1111-V1125 WeakPolarHBondContact CA-O 3.29Å
1112	P	92.4	Very high	91.5	Very high	85 Å²	85	59 Å²	59	55%	0.552	35%	0.347	S	S	*	.	S	Bend	trans	-69	174.8	175.8	30.8	-35.5	0	0	0	112.1	H1120 V1125	P1112-H1120 PolarHBondContact O-CE1 2.91Å; P1112-H1120 PolarHBondContact O-NE2 3.35Å; P1112-V1125 HydrophobicContact CG-CB 4.46Å; P1112-V1125 HydrophobicContact CG-CG2 4.22Å
1113	L	89.3	Confident	91.4	Very high	159 Å²	159	58.4 Å²	58.4	83%	0.832	34%	0.338	S	S	*	.			trans	-67.7	145.5	171.9	-69.2	172.5	0	0	0	111.3
1114	P	91.6	Very high	91.2	Very high	23 Å²	23	57.7 Å²	57.7	15%	0.149	34%	0.335	C	S	.	.			trans	-72.9	139.2	-177.2	30.4	-36.1	0	0	0	112.9	N1116 G1117 H1120	P1114-N1116 PolarHBondContact O-N 3.08Å; P1114-G1117 PolarHBondContact O-N 3.39Å; P1114-H1120 WeakPolarHBondContact CA-CE1 3.22Å
1115	S	88.1	Confident	91.1	Very high	108 Å²	108	59.5 Å²	59.5	76%	0.755	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-32.3	-178.3	-50.8	0	0	0	0	113.5	G1117	S1115-G1117 VanDerWaalsContact C-N 3.33Å
1116	N	88.5	Confident	91.2	Very high	89 Å²	89	54.6 Å²	54.6	48%	0.476	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	1.7	179.3	62.4	18.9	0	0	0	113.8	P1114 V1118 M1119	P1114-N1116 PolarHBondContact O-N 3.08Å; N1116-V1118 PolarHBondContact O-N 3.47Å; N1116-V1118 VanDerWaalsContact O-N 3.16Å; N1116-V1118 WeakPolarHBondContact OD1-CA 3.38Å; N1116-V1118 PolarHBondContact OD1-N 3.36Å; N1116-M1119 PolarHBondContact ND2-O 3.17Å; N1116-M1119 PolarHBondContact OD1-N 3.39Å; N1116-M1119 PolarHBondContact OD1-O 3.01Å; N1116-M1119 VanDerWaalsContact OD1-O 3.06Å
1117	G	86.3	Confident	91.3	Very high	40 Å²	40	52.6 Å²	52.6	41%	0.412	31%	0.309	S	S	.	.	S	Bend	trans	68.9	3.8	-175.7	0	0	0	0	0	114.9	P1114 S1115 R1240	P1114-G1117 PolarHBondContact O-N 3.39Å; S1115-G1117 VanDerWaalsContact C-N 3.33Å; G1117-R1240 PolarHBondContact O-NH1 2.78Å; G1117-R1240 PolarHBondContact O-NH2 3.2Å
1118	V	88.1	Confident	91.5	Very high	68 Å²	68	48 Å²	48	41%	0.412	28%	0.279	S	S	.	.	S	Bend	trans	-113.7	-71.9	-176.2	-174.1	0	0	0	0	111.3	N1116 R1240 F1242	N1116-V1118 PolarHBondContact O-N 3.47Å; N1116-V1118 VanDerWaalsContact O-N 3.16Å; N1116-V1118 WeakPolarHBondContact OD1-CA 3.38Å; N1116-V1118 PolarHBondContact OD1-N 3.36Å; V1118-R1240 VanDerWaalsContact CA-NH2 3.32Å; V1118-R1240 PolarHBondContact O-NH2 3.27Å; V1118-F1242 HydrophobicContact CB-CZ 4.42Å; V1118-F1242 HydrophobicContact CG1-CZ 4.13Å; V1118-F1242 HydrophobicContact CG2-CE1 3.84Å; V1118-F1242 HydrophobicContact CG2-CZ 3.84Å
1119	M	90.7	Very high	91.6	Very high	62 Å²	62	46.4 Å²	46.4	31%	0.305	27%	0.271	S	S	.	.			trans	-159.4	153.5	-178.6	59.5	180	-87.3	0	0	110.6	N1116 V1121 R1173 L1177	N1116-M1119 PolarHBondContact ND2-O 3.17Å; N1116-M1119 PolarHBondContact OD1-N 3.39Å; N1116-M1119 PolarHBondContact OD1-O 3.01Å; N1116-M1119 VanDerWaalsContact OD1-O 3.06Å; M1119-V1121 HydrophobicContact CG-CG2 4.36Å; M1119-R1173 HydrophobicContact CE-CB 4.4Å; M1119-R1173 HydrophobicContact CE-CG 3.75Å; M1119-R1173 HydrophobicContact SD-CG 4.44Å; M1119-L1177 HydrophobicContact CE-CD1 3.97Å
1120	H	90.6	Very high	91.7	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.037	27%	0.271	C	S	.	.			trans	-66.8	138.7	170.4	-63.9	-68.6	0	0	0	110	P1112 P1114 E1123 E1126	P1112-H1120 PolarHBondContact O-CE1 2.91Å; P1112-H1120 PolarHBondContact O-NE2 3.35Å; P1114-H1120 WeakPolarHBondContact CA-CE1 3.22Å; H1120-E1123 HydrophobicContact CB-CB 4.4Å; H1120-E1126 IonicContact CD2-OE1 3.67Å
1121	V	89.6	Confident	91.9	Very high	56 Å²	56	41.6 Å²	41.6	34%	0.339	25%	0.253	S	S	.	.	S	Bend	trans	-122.6	-57.4	-176.9	-177.4	0	0	0	0	110.4	M1119 E1123 R1129 L1177	M1119-V1121 HydrophobicContact CG-CG2 4.36Å; V1121-E1123 PolarHBondContact N-OE2 3.09Å; V1121-R1129 PolarHBondContact O-NH2 3.31Å; V1121-L1177 HydrophobicContact CG1-CD2 4.26Å
1122	D	90	Very high	92.1	Very high	49 Å²	49	40.5 Å²	40.5	26%	0.262	24%	0.242	S	C	.	.	S	Bend	trans	-102.4	-18.8	-178.8	-65.6	-35.9	0	0	0	111.8	I959 C960 R961	I959-D1122 CarbonylContact C-O 3.39Å; I959-D1122 WeakPolarHBondContact CA-O 3.47Å; I959-D1122 HydrophobicContact CG2-CB 3.52Å; C960-D1122 PolarHBondContact N-O 2.87Å; R961-D1122 WeakPolarHBondContact CA-OD1 3.45Å
1123	E	92.1	Very high	92.3	Very high	50 Å²	50	36.5 Å²	36.5	23%	0.234	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-68.8	133.4	179.7	-57.1	87.2	166.8	0	0	111.7	H1120 V1121 V1125	H1120-E1123 HydrophobicContact CB-CB 4.4Å; V1121-E1123 PolarHBondContact N-OE2 3.09Å; E1123-V1125 HydrophobicContact CB-CG1 4.41Å; E1123-V1125 HydrophobicContact CB-CG2 4.16Å; E1123-V1125 PolarHBondContact O-N 3.16Å
1124	C	93.2	Very high	92.6	Very high	4 Å²	4	29.1 Å²	29.1	3%	0.027	18%	0.177	C	C	.	.			trans	-101.5	64.1	177.4	-61.3	0	0	0	0	111.3	M956 P957 K958 R1129	M956-C1124 HydrophobicContact CE-CB 4.26Å; M956-C1124 HydrophobicContact CG-CB 3.66Å; P957-C1124 WeakPolarHBondContact O-CB 3.5Å; K958-C1124 PolarHBondContact O-N 3.25Å; C1124-R1129 HydrophobicContact CB-CB 4.17Å
1125	V	92.8	Very high	92.8	Very high	38 Å²	38	28 Å²	28	23%	0.23	17%	0.17	C	C	.	.			trans	-118.1	-1.8	-174.4	-61.6	0	0	0	0	114.2	G1111 P1112 E1123	G1111-V1125 VanDerWaalsContact CA-O 3.28Å; G1111-V1125 WeakPolarHBondContact CA-O 3.29Å; P1112-V1125 HydrophobicContact CG-CB 4.46Å; P1112-V1125 HydrophobicContact CG-CG2 4.22Å; E1123-V1125 HydrophobicContact CB-CG1 4.41Å; E1123-V1125 HydrophobicContact CB-CG2 4.16Å; E1123-V1125 PolarHBondContact O-N 3.16Å
1126	E	94.3	Very high	93.2	Very high	10 Å²	10	22.9 Å²	22.9	5%	0.047	13%	0.134	C	C	.	.	S	Bend	trans	-107.6	148.9	178.2	-58.5	-169.8	119.6	0	0	110.4	H1120 H1128 R1129 R1173	H1120-E1126 IonicContact CD2-OE1 3.67Å; E1126-H1128 VanDerWaalsContact C-N 3.3Å; E1126-H1128 PolarHBondContact O-N 3.35Å; E1126-H1128 IonicContact OE2-CD2 3.75Å; E1126-H1128 PolarHBondContact OE2-CD2 3.34Å; E1126-H1128 IonicContact OE2-CE1 3.93Å; E1126-H1128 IonicContact OE2-NE2 2.8Å; E1126-H1128 PolarHBondContact OE2-NE2 2.79Å; E1126-R1129 WeakPolarHBondContact O-CB 3.41Å; E1126-R1129 PolarHBondContact O-N 3.19Å; E1126-R1173 IonicContact OE1-CZ 2.69Å; E1126-R1173 IonicContact OE1-NE 2.92Å; E1126-R1173 PolarHBondContact OE1-NE 2.65Å; E1126-R1173 IonicContact OE1-NH2 3.85Å; E1126-R1173 PolarHBondContact OE1-NH2 2.88Å; E1126-R1173 IonicContact OE2-CZ 3.12Å; E1126-R1173 IonicContact OE2-NE 3.71Å; E1126-R1173 PolarHBondContact OE2-NE 3.48Å; E1126-R1173 IonicContact OE2-NH2 2.78Å
1127	F	96.7	Very high	93.6	Very high	1 Å²	1	19.3 Å²	19.3	0%	0.004	12%	0.115	C	C	.	.	H	α-helix	trans	-53.8	-41.4	-178.7	176.1	-99.6	0	0	0	113.9	V949 W1109 R1129 L1130 W1131 I1164 I1165 L1168	V949-F1127 HydrophobicContact CG1-CD2 4.19Å; V949-F1127 HydrophobicContact CG2-CD2 4.14Å; V949-F1127 HydrophobicContact CG2-CE2 3.89Å; W1109-F1127 HydrophobicContact CE3-CB 4.06Å; W1109-F1127 AromaticContact CE3-CD2 3.7Å; W1109-F1127 HydrophobicContact CE3-CD2 3.7Å; W1109-F1127 HydrophobicContact CE3-CE2 4.37Å; W1109-F1127 AromaticContact CE3-CG 3.92Å; W1109-F1127 HydrophobicContact CE3-CG 3.92Å; W1109-F1127 AromaticContact CZ3-CD2 3.44Å; W1109-F1127 HydrophobicContact CZ3-CD2 3.44Å; W1109-F1127 VanDerWaalsContact CZ3-CD2 3.44Å; W1109-F1127 AromaticContact CZ3-CE2 3.67Å; W1109-F1127 HydrophobicContact CZ3-CE2 3.67Å; W1109-F1127 HydrophobicContact CZ3-CG 4.04Å; W1109-F1127 HydrophobicContact CZ3-CZ 4.43Å; W1109-F1127 PolarHBondContact O-N 2.9Å; F1127-R1129 PolarHBondContact O-N 3.48Å; F1127-R1129 VanDerWaalsContact O-N 3.11Å; F1127-L1130 WeakPolarHBondContact O-CA 3.31Å; F1127-L1130 WeakPolarHBondContact O-CB 3.23Å; F1127-L1130 PolarHBondContact O-N 3.49Å; F1127-W1131 HydrophobicContact CE1-CB 4.28Å; F1127-W1131 PolarHBondContact O-N 2.99Å; F1127-I1164 HydrophobicContact CD1-CB 4.11Å; F1127-I1164 HydrophobicContact CD1-CG2 3.41Å; F1127-I1164 VanDerWaalsContact CD1-CG2 3.41Å; F1127-I1164 HydrophobicContact CD2-CG2 4.44Å; F1127-I1164 HydrophobicContact CE1-CB 3.68Å; F1127-I1164 HydrophobicContact CE1-CD1 4.25Å; F1127-I1164 HydrophobicContact CE1-CG2 3.45Å; F1127-I1164 VanDerWaalsContact CE1-CG2 3.45Å; F1127-I1164 HydrophobicContact CE2-CG2 4.46Å; F1127-I1164 HydrophobicContact CG-CG2 3.94Å; F1127-I1164 HydrophobicContact CZ-CB 4.23Å; F1127-I1164 HydrophobicContact CZ-CD1 3.91Å; F1127-I1164 HydrophobicContact CZ-CG2 3.99Å; F1127-I1165 HydrophobicContact CD1-CG1 3.98Å; F1127-I1165 HydrophobicContact CE1-CG1 4.05Å; F1127-L1168 HydrophobicContact CB-CD1 3.98Å
1128	H	96.3	Very high	94	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.5	-25.6	179.9	77.2	90	0	0	0	113.7	E1126 W1131 S1132 I1165 Q1170 F1174	E1126-H1128 VanDerWaalsContact C-N 3.3Å; E1126-H1128 PolarHBondContact O-N 3.35Å; E1126-H1128 IonicContact OE2-CD2 3.75Å; E1126-H1128 PolarHBondContact OE2-CD2 3.34Å; E1126-H1128 IonicContact OE2-CE1 3.93Å; E1126-H1128 IonicContact OE2-NE2 2.8Å; E1126-H1128 PolarHBondContact OE2-NE2 2.79Å; H1128-W1131 PolarHBondContact O-N 3.41Å; H1128-S1132 PolarHBondContact O-N 3.2Å; H1128-S1132 PolarHBondContact O-OG 3.49Å; H1128-I1165 HydrophobicContact CB-CD1 4.16Å; H1128-I1165 HydrophobicContact CB-CG1 4.01Å; H1128-I1165 HydrophobicContact CB-CG2 4.43Å; H1128-Q1170 HydrophobicContact CB-CB 4.06Å; H1128-Q1170 PolarHBondContact CD2-OE1 3.44Å; H1128-F1174 HydrophobicContact CB-CB 3.93Å; H1128-F1174 HydrophobicContact CB-CD2 4.06Å; H1128-F1174 HydrophobicContact CB-CG 4.38Å; H1128-F1174 WeakPolarHBondContact ND1-CA 3.25Å
1129	R	95.1	Very high	94.4	Very high	1 Å²	1	14.5 Å²	14.5	0%	0.004	8%	0.077	C	C	.	.	H	α-helix	trans	-71.1	-40.1	173.7	-73.2	-63.2	-151.9	169.6	-1.6	112.3	V1121 C1124 E1126 F1127 W1131 S1132 A1133 L1177	V1121-R1129 PolarHBondContact O-NH2 3.31Å; C1124-R1129 HydrophobicContact CB-CB 4.17Å; E1126-R1129 WeakPolarHBondContact O-CB 3.41Å; E1126-R1129 PolarHBondContact O-N 3.19Å; F1127-R1129 PolarHBondContact O-N 3.48Å; F1127-R1129 VanDerWaalsContact O-N 3.11Å; R1129-W1131 VanDerWaalsContact C-N 3.33Å; R1129-S1132 WeakPolarHBondContact O-CB 3.13Å; R1129-S1132 PolarHBondContact O-N 2.78Å; R1129-A1133 PolarHBondContact O-N 3.02Å; R1129-A1133 VanDerWaalsContact O-N 3.16Å; R1129-L1177 PolarHBondContact NH1-O 2.96Å
1130	L	95.6	Very high	94.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.6	-40.7	171.3	175.3	61.5	0	0	0	110.5	V949 L952 M953 M956 I983 F1127 S1132 A1133 M1134	V949-L1130 HydrophobicContact CB-CD2 4.33Å; V949-L1130 HydrophobicContact CG1-CD2 4.12Å; V949-L1130 HydrophobicContact CG2-CD2 4.15Å; L952-L1130 HydrophobicContact CB-CD1 3.69Å; L952-L1130 HydrophobicContact CB-CD2 4.08Å; L952-L1130 HydrophobicContact CD1-CD1 4.43Å; M953-L1130 HydrophobicContact CE-CB 3.75Å; M953-L1130 HydrophobicContact CE-CD2 4.22Å; M953-L1130 HydrophobicContact SD-CB 4.5Å; M956-L1130 HydrophobicContact SD-CD1 4.46Å; I983-L1130 HydrophobicContact CD1-CD1 4.39Å; F1127-L1130 WeakPolarHBondContact O-CA 3.31Å; F1127-L1130 WeakPolarHBondContact O-CB 3.23Å; F1127-L1130 PolarHBondContact O-N 3.49Å; L1130-S1132 VanDerWaalsContact C-N 3.35Å; L1130-S1132 PolarHBondContact O-N 3.29Å; L1130-A1133 WeakPolarHBondContact O-CA 3.3Å; L1130-A1133 VanDerWaalsContact O-CB 3.27Å; L1130-A1133 WeakPolarHBondContact O-CB 3.33Å; L1130-A1133 PolarHBondContact O-N 3.18Å; L1130-A1133 VanDerWaalsContact O-N 3.08Å; L1130-M1134 HydrophobicContact CD1-CE 4.12Å; L1130-M1134 HydrophobicContact CD2-CE 4.09Å; L1130-M1134 HydrophobicContact CG-CE 3.93Å; L1130-M1134 WeakPolarHBondContact O-CG 3.35Å; L1130-M1134 PolarHBondContact O-N 2.95Å
1131	W	97.3	Very high	94.7	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.6	-39	174.1	-171.9	-110.5	0	0	0	112.6	L997 F1127 H1128 R1129 A1133 M1134 Q1135 Y1138 L1157 I1165 F1174	L997-W1131 HydrophobicContact CD1-CZ3 3.9Å; F1127-W1131 HydrophobicContact CE1-CB 4.28Å; F1127-W1131 PolarHBondContact O-N 2.99Å; H1128-W1131 PolarHBondContact O-N 3.41Å; R1129-W1131 VanDerWaalsContact C-N 3.33Å; W1131-A1133 PolarHBondContact O-N 3.01Å; W1131-M1134 HydrophobicContact CE3-CB 4.16Å; W1131-M1134 HydrophobicContact CE3-SD 3.81Å; W1131-M1134 HydrophobicContact CZ3-CB 4.47Å; W1131-M1134 HydrophobicContact CZ3-SD 4.04Å; W1131-M1134 PolarHBondContact O-N 3.01Å; W1131-Q1135 WeakPolarHBondContact O-CB 3.3Å; W1131-Q1135 PolarHBondContact O-N 2.95Å; W1131-Y1138 HydrophobicContact CH2-CE1 4.23Å; W1131-Y1138 HydrophobicContact CZ2-CE1 4.04Å; W1131-L1157 HydrophobicContact CH2-CD1 4.01Å; W1131-L1157 HydrophobicContact CH2-CG 4.09Å; W1131-L1157 WeakPolarHBondContact CH2-O 3.32Å; W1131-L1157 HydrophobicContact CZ3-CD1 4.35Å; W1131-I1165 HydrophobicContact CB-CD1 3.9Å; W1131-I1165 HydrophobicContact CG-CD1 3.69Å; W1131-F1174 AromaticContact CD1-CE2 3.69Å; W1131-F1174 AromaticContact CD1-CZ 3.79Å
1132	S	96.3	Very high	94.8	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59.5	-34.7	171.4	-69.8	0	0	0	0	112.9	H1128 R1129 L1130 F1136 F1174 D1178	H1128-S1132 PolarHBondContact O-N 3.2Å; H1128-S1132 PolarHBondContact O-OG 3.49Å; R1129-S1132 WeakPolarHBondContact O-CB 3.13Å; R1129-S1132 PolarHBondContact O-N 2.78Å; L1130-S1132 VanDerWaalsContact C-N 3.35Å; L1130-S1132 PolarHBondContact O-N 3.29Å; S1132-F1136 PolarHBondContact O-N 2.98Å; S1132-F1174 WeakPolarHBondContact OG-CD2 3.26Å; S1132-F1174 VanDerWaalsContact OG-CE2 3.31Å; S1132-F1174 WeakPolarHBondContact OG-CE2 3.25Å; S1132-D1178 VanDerWaalsContact CA-OD1 3.3Å; S1132-D1178 WeakPolarHBondContact CA-OD1 3.35Å; S1132-D1178 WeakPolarHBondContact CB-OD1 3.46Å; S1132-D1178 WeakPolarHBondContact OG-CA 3.41Å; S1132-D1178 PolarHBondContact OG-OD1 3.38Å
1133	A	95.4	Very high	94.7	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-69	-45.9	174	0	0	0	0	0	111.6	M956 L980 I983 R1129 L1130 W1131 Q1135 F1136 V1137	M956-A1133 HydrophobicContact CE-CB 3.64Å; M956-A1133 HydrophobicContact SD-CB 3.67Å; L980-A1133 HydrophobicContact CD2-CB 4.08Å; I983-A1133 HydrophobicContact CB-CB 4.48Å; I983-A1133 HydrophobicContact CG1-CB 4.3Å; I983-A1133 HydrophobicContact CG2-CB 4Å; R1129-A1133 PolarHBondContact O-N 3.02Å; R1129-A1133 VanDerWaalsContact O-N 3.16Å; L1130-A1133 WeakPolarHBondContact O-CA 3.3Å; L1130-A1133 VanDerWaalsContact O-CB 3.27Å; L1130-A1133 WeakPolarHBondContact O-CB 3.33Å; L1130-A1133 PolarHBondContact O-N 3.18Å; L1130-A1133 VanDerWaalsContact O-N 3.08Å; W1131-A1133 PolarHBondContact O-N 3.01Å; A1133-Q1135 VanDerWaalsContact C-N 3.27Å; A1133-Q1135 PolarHBondContact O-N 3.42Å; A1133-F1136 WeakPolarHBondContact O-CB 3.47Å; A1133-F1136 PolarHBondContact O-N 3.11Å; A1133-V1137 WeakPolarHBondContact O-CG2 3.42Å; A1133-V1137 PolarHBondContact O-N 3.09Å; A1133-V1137 VanDerWaalsContact O-N 3.09Å
1134	M	96.1	Very high	94.3	Very high	4 Å²	4	17.5 Å²	17.5	2%	0.02	11%	0.111	C	C	.	.	H	α-helix	trans	-60.1	-39.5	174.2	-67	-178.5	176.6	0	0	111.5	L952 L989 F994 L997 L1130 W1131 F1136 V1137 Y1138	L952-M1134 HydrophobicContact CD1-CE 3.58Å; L989-M1134 HydrophobicContact CD1-CE 3.97Å; L989-M1134 HydrophobicContact CD1-CG 4.23Å; F994-M1134 HydrophobicContact CE1-CB 4.01Å; F994-M1134 HydrophobicContact CE1-CG 4.12Å; F994-M1134 HydrophobicContact CE1-SD 4.16Å; F994-M1134 HydrophobicContact CZ-CB 4.35Å; L997-M1134 HydrophobicContact CD1-SD 4.44Å; L1130-M1134 HydrophobicContact CD1-CE 4.12Å; L1130-M1134 HydrophobicContact CD2-CE 4.09Å; L1130-M1134 HydrophobicContact CG-CE 3.93Å; L1130-M1134 WeakPolarHBondContact O-CG 3.35Å; L1130-M1134 PolarHBondContact O-N 2.95Å; W1131-M1134 HydrophobicContact CE3-CB 4.16Å; W1131-M1134 HydrophobicContact CE3-SD 3.81Å; W1131-M1134 HydrophobicContact CZ3-CB 4.47Å; W1131-M1134 HydrophobicContact CZ3-SD 4.04Å; W1131-M1134 PolarHBondContact O-N 3.01Å; M1134-F1136 VanDerWaalsContact C-N 3.35Å; M1134-V1137 WeakPolarHBondContact O-CB 3.31Å; M1134-V1137 PolarHBondContact O-N 3.3Å; M1134-V1137 VanDerWaalsContact O-N 3.14Å; M1134-Y1138 WeakPolarHBondContact O-CD1 3.47Å; M1134-Y1138 PolarHBondContact O-N 3.01Å
1135	Q	96.6	Very high	94.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.7	-42	174.3	175.9	156.4	-96	0	0	112.8	W1131 A1133 V1137 Y1138 C1139 D1178 C1180 N1215	W1131-Q1135 WeakPolarHBondContact O-CB 3.3Å; W1131-Q1135 PolarHBondContact O-N 2.95Å; A1133-Q1135 VanDerWaalsContact C-N 3.27Å; A1133-Q1135 PolarHBondContact O-N 3.42Å; Q1135-V1137 VanDerWaalsContact C-N 3.3Å; Q1135-V1137 PolarHBondContact O-N 3.17Å; Q1135-Y1138 HydrophobicContact CB-CE1 3.92Å; Q1135-Y1138 HydrophobicContact CB-CE2 4.01Å; Q1135-Y1138 VanDerWaalsContact CB-OH 3.3Å; Q1135-Y1138 WeakPolarHBondContact CB-OH 3.47Å; Q1135-Y1138 HydrophobicContact CG-CE2 3.7Å; Q1135-Y1138 WeakPolarHBondContact CG-OH 3.48Å; Q1135-Y1138 PolarHBondContact O-N 3.47Å; Q1135-Y1138 PolarHBondContact OE1-OH 3.18Å; Q1135-C1139 VanDerWaalsContact O-CB 3.26Å; Q1135-C1139 WeakPolarHBondContact O-CB 3.46Å; Q1135-C1139 PolarHBondContact O-N 2.87Å; Q1135-C1139 PolarHBondContact O-SG 3.39Å; Q1135-D1178 PolarHBondContact NE2-OD1 3.37Å; Q1135-D1178 PolarHBondContact NE2-OD2 3.32Å; Q1135-C1180 HydrophobicContact CG-CB 4.21Å; Q1135-N1215 PolarHBondContact OE1-ND2 3.34Å
1136	F	96.3	Very high	94	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-56.8	-46.9	171.8	-174.4	-99.3	0	0	0	111.2	L973 F976 H977 L980 V984 S1132 A1133 M1134 C1139 I1140 C1180 M1204	L973-F1136 HydrophobicContact CD1-CE2 3.88Å; L973-F1136 HydrophobicContact CD1-CZ 3.93Å; F976-F1136 HydrophobicContact CB-CD2 4.27Å; F976-F1136 HydrophobicContact CB-CE2 3.72Å; F976-F1136 HydrophobicContact CB-CZ 3.92Å; H977-F1136 AromaticContact CD2-CZ 3.79Å; H977-F1136 AromaticContact CE1-CE1 3.88Å; H977-F1136 AromaticContact CE1-CZ 3.89Å; H977-F1136 AromaticContact CG-CZ 3.86Å; H977-F1136 AromaticContact ND1-CE1 3.76Å; H977-F1136 AromaticContact ND1-CZ 3.93Å; H977-F1136 AromaticContact NE2-CZ 3.81Å; L980-F1136 HydrophobicContact CB-CD1 4.37Å; L980-F1136 HydrophobicContact CD1-CB 3.82Å; L980-F1136 HydrophobicContact CD1-CD1 3.8Å; L980-F1136 HydrophobicContact CD1-CD2 4.43Å; L980-F1136 HydrophobicContact CD1-CE1 4.49Å; L980-F1136 HydrophobicContact CD1-CG 3.76Å; V984-F1136 HydrophobicContact CG2-CD1 4.13Å; V984-F1136 HydrophobicContact CG2-CE1 4.21Å; S1132-F1136 PolarHBondContact O-N 2.98Å; A1133-F1136 WeakPolarHBondContact O-CB 3.47Å; A1133-F1136 PolarHBondContact O-N 3.11Å; M1134-F1136 VanDerWaalsContact C-N 3.35Å; F1136-C1139 PolarHBondContact O-N 3.31Å; F1136-I1140 HydrophobicContact CD1-CD1 4.42Å; F1136-I1140 HydrophobicContact CE1-CD1 4.22Å; F1136-I1140 WeakPolarHBondContact O-CG1 3.48Å; F1136-I1140 PolarHBondContact O-N 2.97Å; F1136-C1180 WeakPolarHBondContact CA-SG 3.49Å; F1136-M1204 HydrophobicContact CD2-CE 3.67Å; F1136-M1204 HydrophobicContact CE2-CE 3.67Å; F1136-M1204 HydrophobicContact CG-CE 4.38Å; F1136-M1204 HydrophobicContact CZ-CE 4.38Å
1137	V	95.5	Very high	93.8	Very high	14 Å²	14	33.9 Å²	33.9	9%	0.085	18%	0.183	C	C	.	.	H	α-helix	trans	-59.9	-49.7	178.8	-179.4	0	0	0	0	112.4	I983 V984 L989 A1133 M1134 Q1135 C1139 I1140	I983-V1137 HydrophobicContact CG2-CG2 4.13Å; V984-V1137 HydrophobicContact CB-CG2 4.35Å; V984-V1137 HydrophobicContact CG2-CG2 3.86Å; L989-V1137 HydrophobicContact CD2-CB 4.17Å; L989-V1137 HydrophobicContact CD2-CG1 3.97Å; L989-V1137 HydrophobicContact CD2-CG2 3.9Å; A1133-V1137 WeakPolarHBondContact O-CG2 3.42Å; A1133-V1137 PolarHBondContact O-N 3.09Å; A1133-V1137 VanDerWaalsContact O-N 3.09Å; M1134-V1137 WeakPolarHBondContact O-CB 3.31Å; M1134-V1137 PolarHBondContact O-N 3.3Å; M1134-V1137 VanDerWaalsContact O-N 3.14Å; Q1135-V1137 VanDerWaalsContact C-N 3.3Å; Q1135-V1137 PolarHBondContact O-N 3.17Å; V1137-C1139 VanDerWaalsContact C-N 3.31Å; V1137-C1139 PolarHBondContact O-N 3.16Å; V1137-I1140 WeakPolarHBondContact O-CB 3.29Å; V1137-I1140 PolarHBondContact O-N 3.03Å
1138	Y	95.3	Very high	93.7	Very high	7 Å²	7	35.4 Å²	35.4	3%	0.027	19%	0.193	C	C	.	.	H	α-helix	trans	-79.3	-14.5	-173.8	69.7	-127.3	0	0	0	114.2	F994 W1131 M1134 Q1135 V1149 H1158 R1207 F1211	F994-Y1138 HydrophobicContact CZ-CD1 4.23Å; W1131-Y1138 HydrophobicContact CH2-CE1 4.23Å; W1131-Y1138 HydrophobicContact CZ2-CE1 4.04Å; M1134-Y1138 WeakPolarHBondContact O-CD1 3.47Å; M1134-Y1138 PolarHBondContact O-N 3.01Å; Q1135-Y1138 HydrophobicContact CB-CE1 3.92Å; Q1135-Y1138 HydrophobicContact CB-CE2 4.01Å; Q1135-Y1138 VanDerWaalsContact CB-OH 3.3Å; Q1135-Y1138 WeakPolarHBondContact CB-OH 3.47Å; Q1135-Y1138 HydrophobicContact CG-CE2 3.7Å; Q1135-Y1138 WeakPolarHBondContact CG-OH 3.48Å; Q1135-Y1138 PolarHBondContact O-N 3.47Å; Q1135-Y1138 PolarHBondContact OE1-OH 3.18Å; Y1138-V1149 HydrophobicContact CD2-CG1 4.44Å; Y1138-V1149 HydrophobicContact CG-CG1 4.28Å; Y1138-H1158 AromaticContact CE1-CE1 3.92Å; Y1138-H1158 AromaticContact CE2-CE1 3.75Å; Y1138-H1158 AromaticContact CZ-CE1 3.62Å; Y1138-H1158 AromaticContact CZ-ND1 3.8Å; Y1138-R1207 PolarHBondContact O-NH2 3.01Å; Y1138-F1211 HydrophobicContact CD2-CD1 4.33Å; Y1138-F1211 AromaticContact CD2-CD2 3.94Å; Y1138-F1211 HydrophobicContact CD2-CD2 3.94Å; Y1138-F1211 HydrophobicContact CD2-CE1 4.29Å; Y1138-F1211 AromaticContact CD2-CE2 3.87Å; Y1138-F1211 HydrophobicContact CD2-CE2 3.87Å; Y1138-F1211 HydrophobicContact CD2-CG 4.17Å; Y1138-F1211 HydrophobicContact CD2-CZ 4.05Å; Y1138-F1211 HydrophobicContact CE2-CB 4.06Å; Y1138-F1211 AromaticContact CE2-CD1 3.9Å; Y1138-F1211 HydrophobicContact CE2-CD1 3.9Å; Y1138-F1211 AromaticContact CE2-CD2 3.82Å; Y1138-F1211 HydrophobicContact CE2-CD2 3.82Å; Y1138-F1211 HydrophobicContact CE2-CE1 4.29Å; Y1138-F1211 HydrophobicContact CE2-CE2 4.21Å; Y1138-F1211 AromaticContact CE2-CG 3.65Å; Y1138-F1211 HydrophobicContact CE2-CG 3.65Å; Y1138-F1211 HydrophobicContact CE2-CZ 4.43Å
1139	C	95.9	Very high	93.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-78.6	-23.4	171.2	-72.2	0	0	0	0	112.7	Q1135 F1136 V1137 P1141 M1204 R1207 I1208 F1211	Q1135-C1139 VanDerWaalsContact O-CB 3.26Å; Q1135-C1139 WeakPolarHBondContact O-CB 3.46Å; Q1135-C1139 PolarHBondContact O-N 2.87Å; Q1135-C1139 PolarHBondContact O-SG 3.39Å; F1136-C1139 PolarHBondContact O-N 3.31Å; V1137-C1139 VanDerWaalsContact C-N 3.31Å; V1137-C1139 PolarHBondContact O-N 3.16Å; C1139-P1141 WeakPolarHBondContact O-CD 3.4Å; C1139-M1204 HydrophobicContact CB-CE 3.78Å; C1139-M1204 HydrophobicContact CB-SD 3.6Å; C1139-M1204 VanDerWaalsContact CB-SD 3.6Å; C1139-R1207 VanDerWaalsContact O-CD 3.31Å; C1139-R1207 WeakPolarHBondContact O-CD 3.47Å; C1139-R1207 PolarHBondContact O-NE 3.26Å; C1139-I1208 HydrophobicContact CB-CG1 3.75Å; C1139-F1211 VanDerWaalsContact SG-CD2 3.54Å
1140	I	94.5	Very high	93.4	Very high	33 Å²	33	39.2 Å²	39.2	17%	0.169	21%	0.212	C	C	.	.	S	Bend	trans	-55.6	123.7	177.5	-68.2	165.2	0	0	0	109.4	V984 F1136 V1137 V1142 V1199 M1204	V984-I1140 HydrophobicContact CG1-CD1 4.23Å; V984-I1140 HydrophobicContact CG2-CD1 4.37Å; F1136-I1140 HydrophobicContact CD1-CD1 4.42Å; F1136-I1140 HydrophobicContact CE1-CD1 4.22Å; F1136-I1140 WeakPolarHBondContact O-CG1 3.48Å; F1136-I1140 PolarHBondContact O-N 2.97Å; V1137-I1140 WeakPolarHBondContact O-CB 3.29Å; V1137-I1140 PolarHBondContact O-N 3.03Å; I1140-V1142 PolarHBondContact O-N 3.3Å; I1140-V1199 HydrophobicContact CG1-CG2 4.49Å; I1140-V1199 HydrophobicContact CG2-CG2 3.84Å; I1140-M1204 HydrophobicContact CG1-CE 4.26Å
1141	P	92.9	Very high	93.2	Very high	24 Å²	24	44.6 Å²	44.6	16%	0.156	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-64.4	131.6	174.5	-19	32.3	0	0	0	111.1	C1139 P1200 K1203 M1204	C1139-P1141 WeakPolarHBondContact O-CD 3.4Å; P1141-P1200 HydrophobicContact CG-CG 4.3Å; P1141-K1203 HydrophobicContact CB-CB 4.44Å; P1141-K1203 HydrophobicContact CG-CB 3.85Å; P1141-M1204 HydrophobicContact CG-CB 4.4Å
1142	V	92.2	Very high	93.1	Very high	59 Å²	59	44.6 Å²	44.6	36%	0.358	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-94	170.4	173	-62.4	0	0	0	0	111	I1140 E1146 T1148	I1140-V1142 PolarHBondContact O-N 3.3Å; V1142-E1146 HydrophobicContact CB-CB 3.96Å; V1142-E1146 HydrophobicContact CG2-CB 3.97Å; V1142-T1148 HydrophobicContact CG2-CG2 3.93Å
1143	G	88	Confident	93.1	Very high	36 Å²	36	44.7 Å²	44.7	37%	0.371	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-60.7	155.6	176.5	0	0	0	0	0	112.8	H1145 E1146	G1143-H1145 PolarHBondContact O-N 3.25Å; G1143-E1146 WeakPolarHBondContact CA-OE2 3.45Å; G1143-E1146 PolarHBondContact N-OE2 2.91Å; G1143-E1146 PolarHBondContact O-N 3.35Å
1144	T	84.6	Confident	93.1	Very high	136 Å²	136	44.9 Å²	44.9	83%	0.834	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.4	-175.4	-45.5	0	0	0	0	114.3
1145	H	89.6	Confident	93.2	Very high	189 Å²	189	45.8 Å²	45.8	88%	0.875	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.2	7.3	-179.6	-57.4	97.6	0	0	0	113.3	G1143	G1143-H1145 PolarHBondContact O-N 3.25Å
1146	E	89.5	Confident	93.1	Very high	124 Å²	124	45.8 Å²	45.8	58%	0.579	24%	0.244	S	C	*	.	S	Bend	trans	-96.1	144.4	174.5	-65.5	-177.4	111.1	0	0	109.7	V1142 G1143	V1142-E1146 HydrophobicContact CB-CB 3.96Å; V1142-E1146 HydrophobicContact CG2-CB 3.97Å; G1143-E1146 WeakPolarHBondContact CA-OE2 3.45Å; G1143-E1146 PolarHBondContact N-OE2 2.91Å; G1143-E1146 PolarHBondContact O-N 3.35Å
1147	F	91.1	Very high	93.2	Very high	84 Å²	84	45.8 Å²	45.8	37%	0.368	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-75.5	143.3	176.1	59.7	-97.5	0	0	0	110.7	V868 P870 F871 Q1151 C1152	V868-F1147 HydrophobicContact CG1-CB 3.97Å; V868-F1147 HydrophobicContact CG1-CD2 4.46Å; V868-F1147 HydrophobicContact CG1-CG 4.08Å; V868-F1147 HydrophobicContact CG2-CD1 4.3Å; V868-F1147 HydrophobicContact CG2-CD2 4.08Å; V868-F1147 HydrophobicContact CG2-CE1 4.3Å; V868-F1147 HydrophobicContact CG2-CE2 4.07Å; V868-F1147 HydrophobicContact CG2-CG 4.2Å; V868-F1147 HydrophobicContact CG2-CZ 4.18Å; P870-F1147 HydrophobicContact CG-CE1 3.93Å; P870-F1147 HydrophobicContact CG-CZ 4.14Å; F871-F1147 HydrophobicContact CD2-CZ 4.48Å; F871-F1147 HydrophobicContact CE2-CE2 4.3Å; F871-F1147 HydrophobicContact CE2-CZ 4.15Å; F1147-Q1151 HydrophobicContact CB-CG 4.44Å; F1147-C1152 HydrophobicContact CD2-CB 3.85Å; F1147-C1152 HydrophobicContact CE2-CB 4.03Å
1148	T	93.6	Very high	93.2	Very high	32 Å²	32	45.1 Å²	45.1	20%	0.196	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-86.7	170.7	179.3	60.7	0	0	0	0	112.1	V1142 E1150 Q1151 C1152	V1142-T1148 HydrophobicContact CG2-CG2 3.93Å; T1148-E1150 VanDerWaalsContact C-N 3.29Å; T1148-E1150 VanDerWaalsContact CB-OE1 3.24Å; T1148-E1150 WeakPolarHBondContact CB-OE1 3.35Å; T1148-E1150 WeakPolarHBondContact CB-OE2 3.37Å; T1148-E1150 PolarHBondContact O-N 3.29Å; T1148-E1150 WeakPolarHBondContact OG1-CG 3.24Å; T1148-E1150 PolarHBondContact OG1-OE1 2.85Å; T1148-E1150 PolarHBondContact OG1-OE2 3.26Å; T1148-Q1151 PolarHBondContact O-N 3.44Å; T1148-Q1151 PolarHBondContact OG1-N 3.44Å; T1148-C1152 WeakPolarHBondContact O-CB 3.43Å; T1148-C1152 PolarHBondContact O-N 2.99Å
1149	V	94.1	Very high	93.4	Very high	17 Å²	17	45.5 Å²	45.5	10%	0.103	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-40	176.5	71.3	0	0	0	0	111.1	F994 Y1138 Q1151 C1152 F1153 L1157 F1211	F994-V1149 HydrophobicContact CD2-CG2 4.11Å; F994-V1149 HydrophobicContact CE2-CG2 4.24Å; Y1138-V1149 HydrophobicContact CD2-CG1 4.44Å; Y1138-V1149 HydrophobicContact CG-CG1 4.28Å; V1149-Q1151 VanDerWaalsContact C-N 3.34Å; V1149-C1152 PolarHBondContact O-N 2.88Å; V1149-F1153 HydrophobicContact CG2-CD2 3.73Å; V1149-F1153 HydrophobicContact CG2-CE2 4.4Å; V1149-F1153 PolarHBondContact O-N 3.35Å; V1149-L1157 HydrophobicContact CG2-CD2 3.48Å; V1149-L1157 VanDerWaalsContact CG2-CD2 3.48Å; V1149-F1211 HydrophobicContact CG1-CE1 4.2Å; V1149-F1211 HydrophobicContact CG1-CZ 3.68Å
1150	E	91.3	Very high	93.4	Very high	65 Å²	65	45.5 Å²	45.5	30%	0.304	24%	0.242	S	C	.	.	H	α-helix	trans	-72.2	-30.5	-178	59.5	-83.9	-169.2	0	0	111.6	T1148 G1154 R1207	T1148-E1150 VanDerWaalsContact C-N 3.29Å; T1148-E1150 VanDerWaalsContact CB-OE1 3.24Å; T1148-E1150 WeakPolarHBondContact CB-OE1 3.35Å; T1148-E1150 WeakPolarHBondContact CB-OE2 3.37Å; T1148-E1150 PolarHBondContact O-N 3.29Å; T1148-E1150 WeakPolarHBondContact OG1-CG 3.24Å; T1148-E1150 PolarHBondContact OG1-OE1 2.85Å; T1148-E1150 PolarHBondContact OG1-OE2 3.26Å; E1150-G1154 WeakPolarHBondContact O-CA 3.4Å; E1150-G1154 PolarHBondContact O-N 3.28Å; E1150-R1207 IonicContact OE1-CZ 3.76Å; E1150-R1207 IonicContact OE1-NH1 3.72Å; E1150-R1207 PolarHBondContact OE1-NH1 3.19Å; E1150-R1207 IonicContact OE1-NH2 3.71Å; E1150-R1207 PolarHBondContact OE1-NH2 3.16Å; E1150-R1207 IonicContact OE2-CZ 3.35Å; E1150-R1207 IonicContact OE2-NH1 2.71Å; E1150-R1207 IonicContact OE2-NH2 3.08Å; E1150-R1207 PolarHBondContact OE2-NH2 2.73Å
1151	Q	91.7	Very high	93.5	Very high	112 Å²	112	44 Å²	44	52%	0.523	23%	0.233	S	C	.	.	H	α-helix	trans	-72.2	-33.5	171.4	-172.2	179.5	2.3	0	0	112	V868 F1147 T1148 V1149	V868-Q1151 HydrophobicContact CG1-CG 4.04Å; F1147-Q1151 HydrophobicContact CB-CG 4.44Å; T1148-Q1151 PolarHBondContact O-N 3.44Å; T1148-Q1151 PolarHBondContact OG1-N 3.44Å; V1149-Q1151 VanDerWaalsContact C-N 3.34Å
1152	C	94.8	Very high	93.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-81.2	-51.5	-179.3	-171.1	0	0	0	0	111.9	C856 T867 V868 F871 R998 F1147 T1148 V1149	C856-C1152 PolarHBondContact SG-O 2.97Å; T867-C1152 WeakPolarHBondContact CB-O 3.35Å; T867-C1152 PolarHBondContact OG1-O 3.19Å; V868-C1152 HydrophobicContact CG2-CB 4.24Å; F871-C1152 VanDerWaalsContact CD2-SG 3.51Å; R998-C1152 PolarHBondContact NH1-O 3.21Å; R998-C1152 PolarHBondContact NH2-O 2.71Å; F1147-C1152 HydrophobicContact CD2-CB 3.85Å; F1147-C1152 HydrophobicContact CE2-CB 4.03Å; T1148-C1152 WeakPolarHBondContact O-CB 3.43Å; T1148-C1152 PolarHBondContact O-N 2.99Å; V1149-C1152 PolarHBondContact O-N 2.88Å
1153	F	95.7	Very high	93.9	Very high	3 Å²	3	40 Å²	40	1%	0.013	21%	0.209	C	C	.	.	H	α-helix	trans	-110.1	-15.1	-169.8	-56.3	-80.8	0	0	0	114.4	F871 K990 F994 Q995 R998 V1149 L1157	F871-F1153 AromaticContact CD1-CE1 3.94Å; F871-F1153 HydrophobicContact CD1-CE1 3.94Å; F871-F1153 AromaticContact CD1-CZ 3.96Å; F871-F1153 HydrophobicContact CD1-CZ 3.96Å; F871-F1153 AromaticContact CE1-CE1 3.8Å; F871-F1153 HydrophobicContact CE1-CE1 3.8Å; F871-F1153 AromaticContact CE1-CZ 3.44Å; F871-F1153 HydrophobicContact CE1-CZ 3.44Å; F871-F1153 VanDerWaalsContact CE1-CZ 3.44Å; F871-F1153 AromaticContact CZ-CZ 3.87Å; F871-F1153 HydrophobicContact CZ-CZ 3.87Å; K990-F1153 HydrophobicContact CB-CZ 4.39Å; K990-F1153 VanDerWaalsContact O-CZ 3.24Å; K990-F1153 WeakPolarHBondContact O-CZ 3.42Å; F994-F1153 HydrophobicContact CB-CD1 4.21Å; F994-F1153 HydrophobicContact CB-CD2 4.17Å; F994-F1153 HydrophobicContact CB-CE1 3.94Å; F994-F1153 HydrophobicContact CB-CE2 3.88Å; F994-F1153 HydrophobicContact CB-CG 4.34Å; F994-F1153 HydrophobicContact CB-CZ 3.76Å; F994-F1153 HydrophobicContact CD2-CD2 4.41Å; F994-F1153 HydrophobicContact CD2-CE2 4.06Å; Q995-F1153 HydrophobicContact CB-CE1 4.07Å; R998-F1153 HydrophobicContact CB-CB 4.24Å; R998-F1153 HydrophobicContact CB-CD1 3.98Å; R998-F1153 HydrophobicContact CG-CB 4.23Å; R998-F1153 HydrophobicContact CG-CD1 4.37Å; R998-F1153 WeakPolarHBondContact CG-O 3.48Å; V1149-F1153 HydrophobicContact CG2-CD2 3.73Å; V1149-F1153 HydrophobicContact CG2-CE2 4.4Å; V1149-F1153 PolarHBondContact O-N 3.35Å; F1153-L1157 HydrophobicContact CB-CB 3.98Å; F1153-L1157 HydrophobicContact CB-CD2 4.28Å; F1153-L1157 HydrophobicContact CD2-CD2 4.48Å
1154	G	96.6	Very high	94.3	Very high	4 Å²	4	38.3 Å²	38.3	4%	0.041	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	58.4	-160.4	-173.8	0	0	0	0	0	113.1	E1150 G1156	E1150-G1154 WeakPolarHBondContact O-CA 3.4Å; E1150-G1154 PolarHBondContact O-N 3.28Å; G1154-G1156 VanDerWaalsContact C-N 3.27Å; G1154-G1156 PolarHBondContact O-N 3.31Å
1155	D	96.8	Very high	94.9	Very high	23 Å²	23	31.9 Å²	31.9	12%	0.123	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-20	-175.3	-63	-15.2	0	0	0	112.6	Y857 G859 L1157 H1158 W1159	Y857-D1155 HydrophobicContact CD1-CB 3.95Å; Y857-D1155 PolarHBondContact O-N 2.95Å; G859-D1155 PolarHBondContact N-OD2 2.93Å; D1155-L1157 VanDerWaalsContact C-N 3.26Å; D1155-L1157 PolarHBondContact O-N 3.12Å; D1155-H1158 PolarHBondContact O-N 3.34Å; D1155-W1159 VanDerWaalsContact O-CD1 3.3Å; D1155-W1159 PolarHBondContact O-N 2.88Å
1156	G	95.9	Very high	95.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-54.3	-39.7	-178.9	0	0	0	0	0	113.1	G1001 G1154 H1158 W1159 A1160	G1001-G1156 VanDerWaalsContact CA-O 3.3Å; G1001-G1156 WeakPolarHBondContact CA-O 2.88Å; G1154-G1156 VanDerWaalsContact C-N 3.27Å; G1154-G1156 PolarHBondContact O-N 3.31Å; G1156-H1158 VanDerWaalsContact C-N 3.29Å; G1156-H1158 PolarHBondContact O-N 3.19Å; G1156-W1159 PolarHBondContact O-N 3.04Å; G1156-A1160 PolarHBondContact O-N 2.69Å; G1156-A1160 VanDerWaalsContact O-N 3.08Å
1157	L	97.6	Very high	95.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-54.7	-46	174.6	172.9	60.3	0	0	0	112.1	F994 L997 W1131 V1149 F1153 D1155 G1161	F994-L1157 HydrophobicContact CB-CD1 3.96Å; F994-L1157 HydrophobicContact CB-CD2 4.21Å; F994-L1157 HydrophobicContact CD1-CD1 3.96Å; F994-L1157 HydrophobicContact CD1-CD2 4.36Å; F994-L1157 HydrophobicContact CD2-CD2 4.08Å; F994-L1157 HydrophobicContact CG-CD1 4.07Å; F994-L1157 HydrophobicContact CG-CD2 3.98Å; L997-L1157 HydrophobicContact CB-CD1 3.67Å; L997-L1157 HydrophobicContact CD1-CD1 4.11Å; W1131-L1157 HydrophobicContact CH2-CD1 4.01Å; W1131-L1157 HydrophobicContact CH2-CG 4.09Å; W1131-L1157 WeakPolarHBondContact CH2-O 3.32Å; W1131-L1157 HydrophobicContact CZ3-CD1 4.35Å; V1149-L1157 HydrophobicContact CG2-CD2 3.48Å; V1149-L1157 VanDerWaalsContact CG2-CD2 3.48Å; F1153-L1157 HydrophobicContact CB-CB 3.98Å; F1153-L1157 HydrophobicContact CB-CD2 4.28Å; F1153-L1157 HydrophobicContact CD2-CD2 4.48Å; D1155-L1157 VanDerWaalsContact C-N 3.26Å; D1155-L1157 PolarHBondContact O-N 3.12Å; L1157-G1161 PolarHBondContact O-N 3.05Å; L1157-G1161 VanDerWaalsContact O-N 3.16Å
1158	H	96.4	Very high	95.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-73.7	-36.4	-177.9	-55.2	-71	0	0	0	111.4	Y1138 D1155 G1156 A1160 G1161 C1162 F1211 L1214 I1218	Y1138-H1158 AromaticContact CE1-CE1 3.92Å; Y1138-H1158 AromaticContact CE2-CE1 3.75Å; Y1138-H1158 AromaticContact CZ-CE1 3.62Å; Y1138-H1158 AromaticContact CZ-ND1 3.8Å; D1155-H1158 PolarHBondContact O-N 3.34Å; G1156-H1158 VanDerWaalsContact C-N 3.29Å; G1156-H1158 PolarHBondContact O-N 3.19Å; H1158-A1160 VanDerWaalsContact C-N 3.34Å; H1158-A1160 PolarHBondContact O-N 2.92Å; H1158-G1161 PolarHBondContact O-N 3.41Å; H1158-C1162 VanDerWaalsContact O-CB 3.23Å; H1158-C1162 WeakPolarHBondContact O-CB 3.27Å; H1158-C1162 PolarHBondContact O-N 2.92Å; H1158-C1162 PolarHBondContact O-SG 2.95Å; H1158-C1162 VanDerWaalsContact O-SG 3.37Å; H1158-F1211 AromaticContact CE1-CD1 3.45Å; H1158-F1211 VanDerWaalsContact CE1-CD1 3.45Å; H1158-F1211 WeakPolarHBondContact CE1-CD1 3.29Å; H1158-F1211 AromaticContact CE1-CE1 3.45Å; H1158-F1211 VanDerWaalsContact CE1-CE1 3.45Å; H1158-F1211 WeakPolarHBondContact CE1-CE1 3.34Å; H1158-F1211 AromaticContact NE2-CD1 3.64Å; H1158-F1211 AromaticContact NE2-CE1 3.3Å; H1158-F1211 VanDerWaalsContact NE2-CE1 3.3Å; H1158-F1211 WeakPolarHBondContact NE2-CE1 3.5Å; H1158-L1214 HydrophobicContact CB-CD2 4.11Å; H1158-I1218 HydrophobicContact CB-CD1 3.85Å
1159	W	97.7	Very high	95.5	Very high	15 Å²	15	14.4 Å²	14.4	6%	0.057	8%	0.078	C	C	.	.	H	α-helix	trans	-57.6	-44.7	173.2	-85.7	84.3	0	0	0	112.2	L1005 L1008 F1093 D1155 G1156 M1163 I1218 I1221 L1222	L1005-W1159 HydrophobicContact CD1-CB 4.42Å; L1005-W1159 HydrophobicContact CD1-CG 4.09Å; L1005-W1159 HydrophobicContact CD2-CD2 3.67Å; L1005-W1159 HydrophobicContact CD2-CE3 4.16Å; L1005-W1159 HydrophobicContact CD2-CG 4Å; L1005-W1159 HydrophobicContact CD2-CH2 4.38Å; L1005-W1159 HydrophobicContact CD2-CZ2 3.94Å; L1005-W1159 HydrophobicContact CD2-CZ3 4.49Å; L1005-W1159 HydrophobicContact CG-CB 4.5Å; L1005-W1159 HydrophobicContact CG-CD2 4.13Å; L1005-W1159 HydrophobicContact CG-CG 4.06Å; L1008-W1159 HydrophobicContact CD2-CH2 3.86Å; L1008-W1159 HydrophobicContact CD2-CZ3 4.2Å; F1093-W1159 HydrophobicContact CZ-CZ3 4.4Å; D1155-W1159 VanDerWaalsContact O-CD1 3.3Å; D1155-W1159 PolarHBondContact O-N 2.88Å; G1156-W1159 PolarHBondContact O-N 3.04Å; W1159-M1163 WeakPolarHBondContact O-CB 3.25Å; W1159-M1163 PolarHBondContact O-N 2.92Å; W1159-I1218 HydrophobicContact CD2-CD1 4.41Å; W1159-I1218 HydrophobicContact CD2-CG1 4.22Å; W1159-I1218 HydrophobicContact CD2-CG2 3.89Å; W1159-I1218 HydrophobicContact CE3-CG2 4.01Å; W1159-I1218 HydrophobicContact CG-CD1 4.03Å; W1159-I1218 HydrophobicContact CG-CG1 4.36Å; W1159-I1218 HydrophobicContact CG-CG2 4.23Å; W1159-I1218 HydrophobicContact CZ2-CG1 4.21Å; W1159-I1218 HydrophobicContact CZ3-CG2 4.45Å; W1159-I1221 HydrophobicContact CH2-CB 4.41Å; W1159-I1221 HydrophobicContact CH2-CD1 4.28Å; W1159-I1221 HydrophobicContact CH2-CG2 3.93Å; W1159-I1221 HydrophobicContact CZ2-CD1 4.35Å; W1159-I1221 HydrophobicContact CZ3-CG2 4.5Å; W1159-L1222 HydrophobicContact CE3-CD2 4.38Å; W1159-L1222 HydrophobicContact CZ3-CD2 4.11Å; W1159-L1222 HydrophobicContact CZ3-CG 4.44Å
1160	A	97.2	Very high	95.5	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-67	-48.4	176.4	0	0	0	0	0	112.9	L997 V1000 G1156 H1158 C1162 M1163 I1164	L997-A1160 HydrophobicContact CB-CB 4.19Å; L997-A1160 HydrophobicContact CD2-CB 4.07Å; L997-A1160 WeakPolarHBondContact O-CB 3.18Å; V1000-A1160 HydrophobicContact CB-CB 4.05Å; V1000-A1160 HydrophobicContact CG1-CB 3.95Å; G1156-A1160 PolarHBondContact O-N 2.69Å; G1156-A1160 VanDerWaalsContact O-N 3.08Å; H1158-A1160 VanDerWaalsContact C-N 3.34Å; H1158-A1160 PolarHBondContact O-N 2.92Å; A1160-C1162 PolarHBondContact O-N 3Å; A1160-M1163 PolarHBondContact O-N 3.18Å; A1160-I1164 WeakPolarHBondContact O-CG1 3.22Å; A1160-I1164 PolarHBondContact O-N 2.97Å
1161	G	95.6	Very high	95.6	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-59.7	-48.5	179.6	0	0	0	0	0	112.5	L1157 H1158 I1164 I1165	L1157-G1161 PolarHBondContact O-N 3.05Å; L1157-G1161 VanDerWaalsContact O-N 3.16Å; H1158-G1161 PolarHBondContact O-N 3.41Å; G1161-I1164 PolarHBondContact O-N 3.35Å; G1161-I1165 WeakPolarHBondContact O-CG1 3.42Å; G1161-I1165 PolarHBondContact O-N 3.28Å
1162	C	97.1	Very high	95.7	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-65.7	-37.6	176.7	-69.6	0	0	0	0	112.4	H1158 A1160 I1165 V1166 I1218 I1219 L1222	H1158-C1162 VanDerWaalsContact O-CB 3.23Å; H1158-C1162 WeakPolarHBondContact O-CB 3.27Å; H1158-C1162 PolarHBondContact O-N 2.92Å; H1158-C1162 PolarHBondContact O-SG 2.95Å; H1158-C1162 VanDerWaalsContact O-SG 3.37Å; A1160-C1162 PolarHBondContact O-N 3Å; C1162-I1165 PolarHBondContact O-N 3.02Å; C1162-V1166 WeakPolarHBondContact O-CG2 3.32Å; C1162-V1166 PolarHBondContact O-N 2.61Å; C1162-I1218 HydrophobicContact CB-CB 4.33Å; C1162-I1218 HydrophobicContact CB-CG2 3.63Å; C1162-I1219 HydrophobicContact CB-CG1 3.94Å; C1162-L1222 HydrophobicContact CB-CD1 4.34Å
1163	M	97.5	Very high	95.6	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-58.6	-50.5	174.7	-179.2	-161.5	70.4	0	0	111.5	L941 V1000 I1004 L1097 I1100 W1159 A1160 I1165 V1166 L1167 L1222	L941-M1163 HydrophobicContact CD1-CE 4.47Å; V1000-M1163 HydrophobicContact CG1-CE 3.91Å; I1004-M1163 HydrophobicContact CD1-SD 3.85Å; I1004-M1163 HydrophobicContact CG1-SD 3.74Å; L1097-M1163 HydrophobicContact CD2-CG 4Å; L1097-M1163 HydrophobicContact CD2-SD 4.14Å; I1100-M1163 HydrophobicContact CD1-SD 4.17Å; I1100-M1163 HydrophobicContact CG2-CE 3.66Å; I1100-M1163 HydrophobicContact CG2-SD 4.03Å; W1159-M1163 WeakPolarHBondContact O-CB 3.25Å; W1159-M1163 PolarHBondContact O-N 2.92Å; A1160-M1163 PolarHBondContact O-N 3.18Å; M1163-I1165 VanDerWaalsContact C-N 3.28Å; M1163-I1165 PolarHBondContact O-N 3.17Å; M1163-V1166 PolarHBondContact O-N 2.77Å; M1163-L1167 HydrophobicContact CE-CD1 4.44Å; M1163-L1167 HydrophobicContact CG-CD1 3.71Å; M1163-L1167 HydrophobicContact CG-CG 4.11Å; M1163-L1167 WeakPolarHBondContact O-CB 3.33Å; M1163-L1167 VanDerWaalsContact O-CG 3.26Å; M1163-L1167 WeakPolarHBondContact O-CG 3.28Å; M1163-L1167 PolarHBondContact O-N 3.14Å; M1163-L1167 HydrophobicContact SD-CD1 4.18Å; M1163-L1222 HydrophobicContact CB-CD1 4.1Å
1164	I	96.9	Very high	95.7	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-58.9	-44	179	-63.4	166	0	0	0	110.2	L941 L997 L1104 W1109 F1127 A1160 G1161 V1166 L1167 L1168	L941-I1164 HydrophobicContact CD2-CD1 3.81Å; L941-I1164 HydrophobicContact CD2-CG1 4.26Å; L997-I1164 HydrophobicContact CD2-CD1 3.97Å; L1104-I1164 HydrophobicContact CD1-CG2 4.09Å; L1104-I1164 HydrophobicContact CD2-CG2 4.47Å; W1109-I1164 HydrophobicContact CE3-CG2 3.95Å; W1109-I1164 HydrophobicContact CZ3-CD1 4.4Å; W1109-I1164 HydrophobicContact CZ3-CG2 3.89Å; F1127-I1164 HydrophobicContact CD1-CB 4.11Å; F1127-I1164 HydrophobicContact CD1-CG2 3.41Å; F1127-I1164 VanDerWaalsContact CD1-CG2 3.41Å; F1127-I1164 HydrophobicContact CD2-CG2 4.44Å; F1127-I1164 HydrophobicContact CE1-CB 3.68Å; F1127-I1164 HydrophobicContact CE1-CD1 4.25Å; F1127-I1164 HydrophobicContact CE1-CG2 3.45Å; F1127-I1164 VanDerWaalsContact CE1-CG2 3.45Å; F1127-I1164 HydrophobicContact CE2-CG2 4.46Å; F1127-I1164 HydrophobicContact CG-CG2 3.94Å; F1127-I1164 HydrophobicContact CZ-CB 4.23Å; F1127-I1164 HydrophobicContact CZ-CD1 3.91Å; F1127-I1164 HydrophobicContact CZ-CG2 3.99Å; A1160-I1164 WeakPolarHBondContact O-CG1 3.22Å; A1160-I1164 PolarHBondContact O-N 2.97Å; G1161-I1164 PolarHBondContact O-N 3.35Å; I1164-V1166 PolarHBondContact O-N 2.89Å; I1164-L1167 PolarHBondContact O-N 3.1Å; I1164-L1168 HydrophobicContact CG2-CD1 3.72Å; I1164-L1168 HydrophobicContact CG2-CG 4.41Å; I1164-L1168 WeakPolarHBondContact O-CB 3.28Å; I1164-L1168 WeakPolarHBondContact O-CG 3.39Å; I1164-L1168 PolarHBondContact O-N 2.86Å; I1164-L1168 VanDerWaalsContact O-N 3.08Å
1165	I	96.4	Very high	95.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.3	-44.6	178.1	-69.4	171.4	0	0	0	112	F1127 H1128 W1131 G1161 C1162 M1163 G1169 Q1170 Q1171 F1174	F1127-I1165 HydrophobicContact CD1-CG1 3.98Å; F1127-I1165 HydrophobicContact CE1-CG1 4.05Å; H1128-I1165 HydrophobicContact CB-CD1 4.16Å; H1128-I1165 HydrophobicContact CB-CG1 4.01Å; H1128-I1165 HydrophobicContact CB-CG2 4.43Å; W1131-I1165 HydrophobicContact CB-CD1 3.9Å; W1131-I1165 HydrophobicContact CG-CD1 3.69Å; G1161-I1165 WeakPolarHBondContact O-CG1 3.42Å; G1161-I1165 PolarHBondContact O-N 3.28Å; C1162-I1165 PolarHBondContact O-N 3.02Å; M1163-I1165 VanDerWaalsContact C-N 3.28Å; M1163-I1165 PolarHBondContact O-N 3.17Å; I1165-G1169 PolarHBondContact O-N 2.83Å; I1165-Q1170 HydrophobicContact CG2-CB 4.06Å; I1165-Q1170 PolarHBondContact O-N 2.83Å; I1165-Q1171 VanDerWaalsContact CG2-CA 3.43Å; I1165-Q1171 HydrophobicContact CG2-CB 3.86Å; I1165-F1174 HydrophobicContact CD1-CD2 4.18Å; I1165-F1174 HydrophobicContact CD1-CE2 4.39Å; I1165-F1174 HydrophobicContact CD1-CG 4.24Å; I1165-F1174 HydrophobicContact CG2-CB 4.25Å
1166	V	96.1	Very high	95.4	Very high	6 Å²	6	22.4 Å²	22.4	4%	0.036	12%	0.117	C	C	.	.	H	α-helix	trans	-68.2	-46.1	-179.9	169.2	0	0	0	0	111.3	C1162 M1163 I1164 L1168 G1169 Q1171 I1219 L1222 D1223 L1226	C1162-V1166 WeakPolarHBondContact O-CG2 3.32Å; C1162-V1166 PolarHBondContact O-N 2.61Å; M1163-V1166 PolarHBondContact O-N 2.77Å; I1164-V1166 PolarHBondContact O-N 2.89Å; V1166-L1168 PolarHBondContact O-N 3.2Å; V1166-G1169 PolarHBondContact O-N 2.95Å; V1166-Q1171 HydrophobicContact CG2-CB 4.21Å; V1166-Q1171 HydrophobicContact CG2-CG 4.42Å; V1166-I1219 HydrophobicContact CG2-CB 4.25Å; V1166-I1219 HydrophobicContact CG2-CG1 4.07Å; V1166-I1219 HydrophobicContact CG2-CG2 3.9Å; V1166-L1222 HydrophobicContact CB-CB 4.44Å; V1166-L1222 HydrophobicContact CB-CD1 4.47Å; V1166-L1222 HydrophobicContact CG1-CB 4.1Å; V1166-L1222 HydrophobicContact CG2-CB 4.29Å; V1166-L1222 HydrophobicContact CG2-CD1 4.22Å; V1166-D1223 WeakPolarHBondContact CG1-OD1 3.34Å; V1166-L1226 HydrophobicContact CG1-CD2 4.15Å
1167	L	93.6	Very high	95.4	Very high	10 Å²	10	22.9 Å²	22.9	5%	0.052	12%	0.119	C	C	.	.	H	α-helix	trans	-65.1	-27.2	-179.4	-64.9	-179.2	0	0	0	112.8	L1097 I1100 R1101 L1104 M1163 I1164 L1226	L1097-L1167 HydrophobicContact CB-CD2 4.21Å; I1100-L1167 HydrophobicContact CB-CD1 4.06Å; I1100-L1167 HydrophobicContact CG2-CD1 3.72Å; R1101-L1167 HydrophobicContact CB-CB 4.24Å; R1101-L1167 HydrophobicContact CB-CD1 4.38Å; R1101-L1167 HydrophobicContact CB-CD2 4.23Å; R1101-L1167 WeakPolarHBondContact CD-O 3.47Å; R1101-L1167 HydrophobicContact CG-CB 4.23Å; L1104-L1167 HydrophobicContact CD1-CB 4.25Å; M1163-L1167 HydrophobicContact CE-CD1 4.44Å; M1163-L1167 HydrophobicContact CG-CD1 3.71Å; M1163-L1167 HydrophobicContact CG-CG 4.11Å; M1163-L1167 WeakPolarHBondContact O-CB 3.33Å; M1163-L1167 VanDerWaalsContact O-CG 3.26Å; M1163-L1167 WeakPolarHBondContact O-CG 3.28Å; M1163-L1167 PolarHBondContact O-N 3.14Å; M1163-L1167 HydrophobicContact SD-CD1 4.18Å; I1164-L1167 PolarHBondContact O-N 3.1Å; L1167-L1226 HydrophobicContact CD2-CD1 4.2Å; L1167-L1226 HydrophobicContact CD2-CD2 4.27Å
1168	L	94.1	Very high	95.4	Very high	19 Å²	19	22.9 Å²	22.9	10%	0.099	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.4	172.6	-65.4	172.6	0	0	0	113.8	L1104 W1109 R1110 F1127 I1164 V1166 Q1170	L1104-L1168 HydrophobicContact CB-CD2 4.13Å; L1104-L1168 HydrophobicContact CD1-CD2 4.33Å; L1104-L1168 HydrophobicContact CD1-CG 4.29Å; W1109-L1168 HydrophobicContact CB-CD1 3.86Å; W1109-L1168 HydrophobicContact CB-CD2 3.8Å; W1109-L1168 HydrophobicContact CE3-CD1 4.4Å; R1110-L1168 HydrophobicContact CG-CD2 4.12Å; F1127-L1168 HydrophobicContact CB-CD1 3.98Å; I1164-L1168 HydrophobicContact CG2-CD1 3.72Å; I1164-L1168 HydrophobicContact CG2-CG 4.41Å; I1164-L1168 WeakPolarHBondContact O-CB 3.28Å; I1164-L1168 WeakPolarHBondContact O-CG 3.39Å; I1164-L1168 PolarHBondContact O-N 2.86Å; I1164-L1168 VanDerWaalsContact O-N 3.08Å; V1166-L1168 PolarHBondContact O-N 3.2Å; L1168-Q1170 VanDerWaalsContact C-N 3.31Å; L1168-Q1170 HydrophobicContact CB-CB 4.5Å; L1168-Q1170 HydrophobicContact CB-CG 3.88Å; L1168-Q1170 PolarHBondContact O-N 3.48Å
1169	G	93.1	Very high	95.4	Very high	27 Å²	27	22.9 Å²	22.9	28%	0.278	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	30	-176.2	0	0	0	0	0	113.6	I1165 V1166 Q1171 R1173	I1165-G1169 PolarHBondContact O-N 2.83Å; V1166-G1169 PolarHBondContact O-N 2.95Å; G1169-Q1171 VanDerWaalsContact CA-OE1 3.26Å; G1169-R1173 PolarHBondContact O-NH1 2.96Å
1170	Q	94.6	Very high	95.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.			trans	-99.2	-9.8	-175	-71.4	177.5	7.7	0	0	113.8	W1109 H1128 I1165 L1168 R1172 R1173 F1174	W1109-Q1170 PolarHBondContact O-NE2 3.45Å; H1128-Q1170 HydrophobicContact CB-CB 4.06Å; H1128-Q1170 PolarHBondContact CD2-OE1 3.44Å; I1165-Q1170 HydrophobicContact CG2-CB 4.06Å; I1165-Q1170 PolarHBondContact O-N 2.83Å; L1168-Q1170 VanDerWaalsContact C-N 3.31Å; L1168-Q1170 HydrophobicContact CB-CB 4.5Å; L1168-Q1170 HydrophobicContact CB-CG 3.88Å; L1168-Q1170 PolarHBondContact O-N 3.48Å; Q1170-R1172 VanDerWaalsContact C-N 3.31Å; Q1170-R1172 PolarHBondContact O-N 3.42Å; Q1170-R1173 PolarHBondContact O-N 3.32Å; Q1170-F1174 PolarHBondContact O-N 3.07Å
1171	Q	92.9	Very high	95.3	Very high	16 Å²	16	22.8 Å²	22.8	8%	0.075	12%	0.119	C	C	.	.	H	α-helix	trans	-56.9	-37	-171.6	67.8	-81.5	35.1	0	0	114.4	I1165 V1166 G1169 A1175 I1219 D1223	I1165-Q1171 VanDerWaalsContact CG2-CA 3.43Å; I1165-Q1171 HydrophobicContact CG2-CB 3.86Å; V1166-Q1171 HydrophobicContact CG2-CB 4.21Å; V1166-Q1171 HydrophobicContact CG2-CG 4.42Å; G1169-Q1171 VanDerWaalsContact CA-OE1 3.26Å; Q1171-A1175 PolarHBondContact O-N 3.46Å; Q1171-I1219 HydrophobicContact CB-CD1 4.4Å; Q1171-I1219 HydrophobicContact CB-CG2 3.91Å; Q1171-I1219 HydrophobicContact CG-CG2 4.01Å; Q1171-D1223 PolarHBondContact NE2-OD1 2.82Å; Q1171-D1223 PolarHBondContact NE2-OD2 3Å
1172	R	93	Very high	95.2	Very high	177 Å²	177	23.6 Å²	23.6	67%	0.668	12%	0.123	S	C	*	.	H	α-helix	trans	-68.9	-39.8	176.6	-69	-178.1	-70.6	-82.9	2.9	112.1	Q1170 V1176	Q1170-R1172 VanDerWaalsContact C-N 3.31Å; Q1170-R1172 PolarHBondContact O-N 3.42Å; R1172-V1176 WeakPolarHBondContact O-CG2 3.27Å; R1172-V1176 PolarHBondContact O-N 3.36Å
1173	R	93.8	Very high	95.2	Very high	58 Å²	58	23.6 Å²	23.6	22%	0.219	12%	0.123	C	C	.	.	H	α-helix	trans	-69.6	-42.6	177.5	-66.7	-165.4	-68.4	-72.8	11.5	110.4	M1119 E1126 G1169 Q1170 A1175 V1176 L1177	M1119-R1173 HydrophobicContact CE-CB 4.4Å; M1119-R1173 HydrophobicContact CE-CG 3.75Å; M1119-R1173 HydrophobicContact SD-CG 4.44Å; E1126-R1173 IonicContact OE1-CZ 2.69Å; E1126-R1173 IonicContact OE1-NE 2.92Å; E1126-R1173 PolarHBondContact OE1-NE 2.65Å; E1126-R1173 IonicContact OE1-NH2 3.85Å; E1126-R1173 PolarHBondContact OE1-NH2 2.88Å; E1126-R1173 IonicContact OE2-CZ 3.12Å; E1126-R1173 IonicContact OE2-NE 3.71Å; E1126-R1173 PolarHBondContact OE2-NE 3.48Å; E1126-R1173 IonicContact OE2-NH2 2.78Å; G1169-R1173 PolarHBondContact O-NH1 2.96Å; Q1170-R1173 PolarHBondContact O-N 3.32Å; R1173-A1175 PolarHBondContact O-N 3.02Å; R1173-V1176 PolarHBondContact O-N 3.5Å; R1173-L1177 HydrophobicContact CB-CD1 4.48Å; R1173-L1177 VanDerWaalsContact O-CB 3.25Å; R1173-L1177 WeakPolarHBondContact O-CB 3.31Å; R1173-L1177 WeakPolarHBondContact O-CG 3.24Å; R1173-L1177 PolarHBondContact O-N 2.79Å
1174	F	96.3	Very high	95.1	Very high	1 Å²	1	24.1 Å²	24.1	0%	0.004	13%	0.126	C	C	.	.	H	α-helix	trans	-53.7	-53.3	173.5	176	-108.4	0	0	0	112.1	H1128 W1131 S1132 I1165 Q1170 V1176 L1177 D1178 Y1181	H1128-F1174 HydrophobicContact CB-CB 3.93Å; H1128-F1174 HydrophobicContact CB-CD2 4.06Å; H1128-F1174 HydrophobicContact CB-CG 4.38Å; H1128-F1174 WeakPolarHBondContact ND1-CA 3.25Å; W1131-F1174 AromaticContact CD1-CE2 3.69Å; W1131-F1174 AromaticContact CD1-CZ 3.79Å; S1132-F1174 WeakPolarHBondContact OG-CD2 3.26Å; S1132-F1174 VanDerWaalsContact OG-CE2 3.31Å; S1132-F1174 WeakPolarHBondContact OG-CE2 3.25Å; I1165-F1174 HydrophobicContact CD1-CD2 4.18Å; I1165-F1174 HydrophobicContact CD1-CE2 4.39Å; I1165-F1174 HydrophobicContact CD1-CG 4.24Å; I1165-F1174 HydrophobicContact CG2-CB 4.25Å; Q1170-F1174 PolarHBondContact O-N 3.07Å; F1174-V1176 PolarHBondContact O-N 3.49Å; F1174-V1176 VanDerWaalsContact O-N 3.1Å; F1174-L1177 PolarHBondContact O-N 3.19Å; F1174-L1177 VanDerWaalsContact O-N 3.14Å; F1174-D1178 HydrophobicContact CD2-CB 4.22Å; F1174-D1178 HydrophobicContact CE2-CB 3.99Å; F1174-D1178 VanDerWaalsContact CE2-OD1 3.23Å; F1174-D1178 WeakPolarHBondContact CE2-OD1 3.49Å; F1174-D1178 HydrophobicContact CZ-CB 4.31Å; F1174-D1178 VanDerWaalsContact O-CB 3.22Å; F1174-D1178 WeakPolarHBondContact O-CB 3.48Å; F1174-D1178 PolarHBondContact O-N 3.5Å; F1174-Y1181 HydrophobicContact CE1-CE2 4.14Å
1175	A	93.9	Very high	95	Very high	49 Å²	49	29.5 Å²	29.5	41%	0.405	15%	0.149	S	C	.	.	H	α-helix	trans	-58.7	-29.4	-178.9	0	0	0	0	0	113.7	Q1171 R1173	Q1171-A1175 PolarHBondContact O-N 3.46Å; R1173-A1175 PolarHBondContact O-N 3.02Å
1176	V	94	Very high	94.9	Very high	92 Å²	92	29.5 Å²	29.5	56%	0.558	15%	0.149	S	C	*	.	H	α-helix	trans	-83.6	-40.6	177.5	175.6	0	0	0	0	112	R1172 R1173 F1174	R1172-V1176 WeakPolarHBondContact O-CG2 3.27Å; R1172-V1176 PolarHBondContact O-N 3.36Å; R1173-V1176 PolarHBondContact O-N 3.5Å; F1174-V1176 PolarHBondContact O-N 3.49Å; F1174-V1176 VanDerWaalsContact O-N 3.1Å
1177	L	95.8	Very high	94.8	Very high	10 Å²	10	29.7 Å²	29.7	5%	0.052	15%	0.149	C	C	.	.	H	α-helix	trans	-104.1	-5.2	-164.6	-64.7	178.5	0	0	0	114.7	L962 M1119 V1121 R1129 R1173 F1174 F1179	L962-L1177 HydrophobicContact CD1-CD2 4.43Å; M1119-L1177 HydrophobicContact CE-CD1 3.97Å; V1121-L1177 HydrophobicContact CG1-CD2 4.26Å; R1129-L1177 PolarHBondContact NH1-O 2.96Å; R1173-L1177 HydrophobicContact CB-CD1 4.48Å; R1173-L1177 VanDerWaalsContact O-CB 3.25Å; R1173-L1177 WeakPolarHBondContact O-CB 3.31Å; R1173-L1177 WeakPolarHBondContact O-CG 3.24Å; R1173-L1177 PolarHBondContact O-N 2.79Å; F1174-L1177 PolarHBondContact O-N 3.19Å; F1174-L1177 VanDerWaalsContact O-N 3.14Å; L1177-F1179 PolarHBondContact O-N 3.23Å
1178	D	97.4	Very high	94.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.178	C	C	.	.			trans	-61.6	133.5	-178.8	179.5	79.7	0	0	0	113.2	S1132 Q1135 F1174 C1180 Y1181 H1182	S1132-D1178 VanDerWaalsContact CA-OD1 3.3Å; S1132-D1178 WeakPolarHBondContact CA-OD1 3.35Å; S1132-D1178 WeakPolarHBondContact CB-OD1 3.46Å; S1132-D1178 WeakPolarHBondContact OG-CA 3.41Å; S1132-D1178 PolarHBondContact OG-OD1 3.38Å; Q1135-D1178 PolarHBondContact NE2-OD1 3.37Å; Q1135-D1178 PolarHBondContact NE2-OD2 3.32Å; F1174-D1178 HydrophobicContact CD2-CB 4.22Å; F1174-D1178 HydrophobicContact CE2-CB 3.99Å; F1174-D1178 VanDerWaalsContact CE2-OD1 3.23Å; F1174-D1178 WeakPolarHBondContact CE2-OD1 3.49Å; F1174-D1178 HydrophobicContact CZ-CB 4.31Å; F1174-D1178 VanDerWaalsContact O-CB 3.22Å; F1174-D1178 WeakPolarHBondContact O-CB 3.48Å; F1174-D1178 PolarHBondContact O-N 3.5Å; D1178-C1180 WeakPolarHBondContact OD2-CA 3.28Å; D1178-C1180 VanDerWaalsContact OD2-CB 3.27Å; D1178-C1180 WeakPolarHBondContact OD2-CB 3.3Å; D1178-C1180 PolarHBondContact OD2-N 3.33Å; D1178-Y1181 HydrophobicContact CB-CD1 4.41Å; D1178-Y1181 HydrophobicContact CB-CD2 4.05Å; D1178-Y1181 HydrophobicContact CB-CG 3.92Å; D1178-Y1181 PolarHBondContact O-N 3.22Å; D1178-Y1181 VanDerWaalsContact OD2-CD1 3.24Å; D1178-Y1181 WeakPolarHBondContact OD2-CD1 3.44Å; D1178-Y1181 PolarHBondContact OD2-N 2.97Å; D1178-H1182 WeakPolarHBondContact O-CB 3.35Å; D1178-H1182 PolarHBondContact O-N 2.83Å; D1178-H1182 VanDerWaalsContact O-N 3.07Å
1179	F	95.9	Very high	94.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.2	-43.3	-175.8	-52.5	-52.3	0	0	0	112.1	M956 C960 L962 F976 L980 L1177 H1182 L1183	M956-F1179 HydrophobicContact CE-CE2 3.7Å; M956-F1179 HydrophobicContact CE-CZ 3.94Å; C960-F1179 HydrophobicContact CB-CE1 4Å; C960-F1179 HydrophobicContact CB-CZ 4.12Å; L962-F1179 HydrophobicContact CD2-CD1 3.98Å; F976-F1179 HydrophobicContact CD1-CB 4.14Å; F976-F1179 HydrophobicContact CD1-CD1 4.09Å; F976-F1179 HydrophobicContact CD1-CG 4.25Å; F976-F1179 HydrophobicContact CD2-CB 4.26Å; F976-F1179 HydrophobicContact CE1-CB 4Å; F976-F1179 AromaticContact CE1-CD1 3.59Å; F976-F1179 HydrophobicContact CE1-CD1 3.59Å; F976-F1179 HydrophobicContact CE1-CE1 4.42Å; F976-F1179 HydrophobicContact CE1-CG 4.09Å; F976-F1179 HydrophobicContact CE2-CB 4.09Å; F976-F1179 VanDerWaalsContact CE2-O 3.28Å; F976-F1179 WeakPolarHBondContact CE2-O 3.3Å; F976-F1179 HydrophobicContact CG-CB 4.29Å; F976-F1179 HydrophobicContact CZ-CB 3.97Å; F976-F1179 HydrophobicContact CZ-CD1 4.1Å; F976-F1179 HydrophobicContact CZ-CG 4.47Å; L980-F1179 HydrophobicContact CD1-CD2 3.73Å; L980-F1179 HydrophobicContact CD1-CE2 4.13Å; L980-F1179 HydrophobicContact CD1-CG 4.39Å; L980-F1179 HydrophobicContact CD2-CD2 4.43Å; L980-F1179 HydrophobicContact CD2-CE2 3.98Å; L1177-F1179 PolarHBondContact O-N 3.23Å; F1179-H1182 PolarHBondContact O-N 3.35Å; F1179-L1183 PolarHBondContact O-N 3.43Å
1180	C	95.7	Very high	94.7	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-69.7	-41.9	-179.6	-75.1	0	0	0	0	111.6	Q1135 F1136 D1178 H1182 L1183 L1184 I1208	Q1135-C1180 HydrophobicContact CG-CB 4.21Å; F1136-C1180 WeakPolarHBondContact CA-SG 3.49Å; D1178-C1180 WeakPolarHBondContact OD2-CA 3.28Å; D1178-C1180 VanDerWaalsContact OD2-CB 3.27Å; D1178-C1180 WeakPolarHBondContact OD2-CB 3.3Å; D1178-C1180 PolarHBondContact OD2-N 3.33Å; C1180-H1182 VanDerWaalsContact C-N 3.26Å; C1180-H1182 PolarHBondContact O-N 3.34Å; C1180-L1183 PolarHBondContact O-N 3.1Å; C1180-L1184 WeakPolarHBondContact O-CB 3.26Å; C1180-L1184 PolarHBondContact O-N 2.88Å; C1180-I1208 HydrophobicContact CB-CB 4.37Å; C1180-I1208 HydrophobicContact CB-CD1 3.69Å; C1180-I1208 HydrophobicContact CB-CG1 3.73Å; C1180-I1208 HydrophobicContact CB-CG2 3.72Å
1181	Y	96.7	Very high	94.5	Very high	12 Å²	12	45.7 Å²	45.7	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-36.4	178	-69.5	9.6	0	0	0	110.8	F1174 D1178 K1185 I1208 Q1212 N1215	F1174-Y1181 HydrophobicContact CE1-CE2 4.14Å; D1178-Y1181 HydrophobicContact CB-CD1 4.41Å; D1178-Y1181 HydrophobicContact CB-CD2 4.05Å; D1178-Y1181 HydrophobicContact CB-CG 3.92Å; D1178-Y1181 PolarHBondContact O-N 3.22Å; D1178-Y1181 VanDerWaalsContact OD2-CD1 3.24Å; D1178-Y1181 WeakPolarHBondContact OD2-CD1 3.44Å; D1178-Y1181 PolarHBondContact OD2-N 2.97Å; Y1181-K1185 WeakPolarHBondContact O-CB 3.5Å; Y1181-K1185 PolarHBondContact O-N 3.01Å; Y1181-I1208 HydrophobicContact CD1-CG2 4.33Å; Y1181-Q1212 HydrophobicContact CD1-CB 4.25Å; Y1181-Q1212 HydrophobicContact CD1-CG 4.26Å; Y1181-Q1212 HydrophobicContact CE1-CB 3.58Å; Y1181-Q1212 HydrophobicContact CE1-CG 3.74Å; Y1181-Q1212 HydrophobicContact CE2-CG 4.15Å; Y1181-Q1212 WeakPolarHBondContact OH-CA 3.36Å; Y1181-N1215 PolarHBondContact OH-ND2 3.04Å
1182	H	95.2	Very high	94.4	Very high	17 Å²	17	49.5 Å²	49.5	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-66.2	-47.3	172.2	-173.1	64.5	0	0	0	112.3	L962 P963 D1178 F1179 C1180 L1184 K1185 V1186	L962-H1182 HydrophobicContact CD1-CB 4.26Å; L962-H1182 HydrophobicContact CD2-CB 3.92Å; P963-H1182 PolarHBondContact O-CE1 3.21Å; P963-H1182 PolarHBondContact O-NE2 3.28Å; D1178-H1182 WeakPolarHBondContact O-CB 3.35Å; D1178-H1182 PolarHBondContact O-N 2.83Å; D1178-H1182 VanDerWaalsContact O-N 3.07Å; F1179-H1182 PolarHBondContact O-N 3.35Å; C1180-H1182 VanDerWaalsContact C-N 3.26Å; C1180-H1182 PolarHBondContact O-N 3.34Å; H1182-L1184 VanDerWaalsContact C-N 3.35Å; H1182-L1184 PolarHBondContact O-N 3.48Å; H1182-K1185 WeakPolarHBondContact O-CB 3.22Å; H1182-K1185 PolarHBondContact O-N 3.28Å; H1182-K1185 VanDerWaalsContact O-N 3.13Å; H1182-V1186 WeakPolarHBondContact O-CG2 3.16Å; H1182-V1186 PolarHBondContact O-N 3.47Å
1183	L	95.6	Very high	94.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57.4	-46.4	176.2	177.9	62.7	0	0	0	111.9	S969 I972 L973 F976 F1179 C1180 K1185 V1186 Q1187 L1201 M1204 V1205 I1208	S969-L1183 WeakPolarHBondContact O-CD1 3.4Å; I972-L1183 HydrophobicContact CB-CD1 4.2Å; I972-L1183 HydrophobicContact CG2-CD1 3.96Å; L973-L1183 HydrophobicContact CB-CD1 4.04Å; L973-L1183 HydrophobicContact CB-CD2 4.24Å; L973-L1183 HydrophobicContact CD1-CD2 3.86Å; F976-L1183 HydrophobicContact CE2-CB 4.35Å; F1179-L1183 PolarHBondContact O-N 3.43Å; C1180-L1183 PolarHBondContact O-N 3.1Å; L1183-K1185 VanDerWaalsContact C-N 3.32Å; L1183-K1185 PolarHBondContact O-N 3.48Å; L1183-V1186 PolarHBondContact O-N 3.48Å; L1183-Q1187 WeakPolarHBondContact O-CB 3.43Å; L1183-Q1187 PolarHBondContact O-N 2.96Å; L1183-L1201 HydrophobicContact CD1-CD1 3.99Å; L1183-L1201 HydrophobicContact CD2-CD1 4.32Å; L1183-L1201 HydrophobicContact CG-CD1 4.37Å; L1183-M1204 HydrophobicContact CD2-CG 4.22Å; L1183-V1205 HydrophobicContact CD2-CG1 4.47Å; L1183-V1205 HydrophobicContact CG-CG1 4.17Å; L1183-I1208 HydrophobicContact CD2-CD1 4.05Å
1184	L	95.9	Very high	94.3	Very high	12 Å²	12	47.2 Å²	47.2	6%	0.063	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-42.1	175.8	172.6	64	0	0	0	111.7	C1180 H1182 Q1187 K1188 V1205 I1208 R1209	C1180-L1184 WeakPolarHBondContact O-CB 3.26Å; C1180-L1184 PolarHBondContact O-N 2.88Å; H1182-L1184 VanDerWaalsContact C-N 3.35Å; H1182-L1184 PolarHBondContact O-N 3.48Å; L1184-Q1187 PolarHBondContact O-N 2.92Å; L1184-K1188 HydrophobicContact CD1-CD 3.98Å; L1184-K1188 HydrophobicContact CD1-CG 4Å; L1184-K1188 HydrophobicContact CG-CD 4.27Å; L1184-K1188 WeakPolarHBondContact O-CB 3.29Å; L1184-K1188 VanDerWaalsContact O-CG 3.31Å; L1184-K1188 WeakPolarHBondContact O-CG 3.34Å; L1184-K1188 PolarHBondContact O-N 2.98Å; L1184-V1205 HydrophobicContact CD1-CB 3.89Å; L1184-I1208 HydrophobicContact CB-CG2 3.96Å; L1184-I1208 HydrophobicContact CD2-CG2 4.08Å; L1184-R1209 HydrophobicContact CD1-CB 4.46Å; L1184-R1209 HydrophobicContact CD2-CB 4.05Å
1185	K	94.4	Very high	94.2	Very high	114 Å²	114	53.1 Å²	53.1	50%	0.496	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-45.4	179.2	-173.1	-174.7	-61.6	168.2	0	111.5	Y1181 H1182 L1183 H1189	Y1181-K1185 WeakPolarHBondContact O-CB 3.5Å; Y1181-K1185 PolarHBondContact O-N 3.01Å; H1182-K1185 WeakPolarHBondContact O-CB 3.22Å; H1182-K1185 PolarHBondContact O-N 3.28Å; H1182-K1185 VanDerWaalsContact O-N 3.13Å; L1183-K1185 VanDerWaalsContact C-N 3.32Å; L1183-K1185 PolarHBondContact O-N 3.48Å; K1185-H1189 PolarHBondContact O-N 3.02Å
1186	V	94.6	Very high	94	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-72.2	-40.2	179.2	-176.3	0	0	0	0	111.6	H965 I972 H1182 L1183 K1188 H1189 D1190	H965-V1186 HydrophobicContact CB-CG1 4.49Å; I972-V1186 HydrophobicContact CD1-CB 3.86Å; I972-V1186 HydrophobicContact CD1-CG1 3.71Å; I972-V1186 HydrophobicContact CD1-CG2 3.66Å; H1182-V1186 WeakPolarHBondContact O-CG2 3.16Å; H1182-V1186 PolarHBondContact O-N 3.47Å; L1183-V1186 PolarHBondContact O-N 3.48Å; V1186-K1188 VanDerWaalsContact C-N 3.33Å; V1186-K1188 PolarHBondContact O-N 3.02Å; V1186-H1189 WeakPolarHBondContact O-CA 3.31Å; V1186-H1189 WeakPolarHBondContact O-CB 3.32Å; V1186-H1189 PolarHBondContact O-N 3.41Å; V1186-D1190 PolarHBondContact O-N 2.92Å
1187	Q	94.8	Very high	93.6	Very high	9 Å²	9	54.1 Å²	54.1	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-38.3	176.9	-165.1	-74.8	-28.4	0	0	112	L1183 L1184 H1189 D1190 G1191 K1192 L1201 V1205	L1183-Q1187 WeakPolarHBondContact O-CB 3.43Å; L1183-Q1187 PolarHBondContact O-N 2.96Å; L1184-Q1187 PolarHBondContact O-N 2.92Å; Q1187-H1189 PolarHBondContact O-N 3.07Å; Q1187-D1190 WeakPolarHBondContact CA-OD1 3.1Å; Q1187-G1191 WeakPolarHBondContact O-CA 3.39Å; Q1187-G1191 PolarHBondContact O-N 3.25Å; Q1187-K1192 PolarHBondContact NE2-O 3.44Å; Q1187-L1201 HydrophobicContact CG-CD1 4.38Å; Q1187-L1201 HydrophobicContact CG-CD2 4.24Å; Q1187-L1201 HydrophobicContact CG-CG 4.1Å; Q1187-V1205 HydrophobicContact CB-CG1 3.82Å; Q1187-V1205 HydrophobicContact CG-CB 4.49Å; Q1187-V1205 HydrophobicContact CG-CG1 3.9Å; Q1187-V1205 HydrophobicContact CG-CG2 4.01Å
1188	K	93.1	Very high	93.2	Very high	151 Å²	151	60.9 Å²	60.9	66%	0.657	30%	0.304	S	S	*	.	H	α-helix	trans	-65.6	-26.3	173.4	-76.5	-174.8	72.7	176.6	0	113	L1184 V1186	L1184-K1188 HydrophobicContact CD1-CD 3.98Å; L1184-K1188 HydrophobicContact CD1-CG 4Å; L1184-K1188 HydrophobicContact CG-CD 4.27Å; L1184-K1188 WeakPolarHBondContact O-CB 3.29Å; L1184-K1188 VanDerWaalsContact O-CG 3.31Å; L1184-K1188 WeakPolarHBondContact O-CG 3.34Å; L1184-K1188 PolarHBondContact O-N 2.98Å; V1186-K1188 VanDerWaalsContact C-N 3.33Å; V1186-K1188 PolarHBondContact O-N 3.02Å
1189	H	92.5	Very high	93	Very high	139 Å²	139	61.1 Å²	61.1	64%	0.644	31%	0.306	S	S	*	.	H	α-helix	trans	-80.1	-45.9	177.7	171.1	-89.9	0	0	0	112.1	K1185 V1186 Q1187	K1185-H1189 PolarHBondContact O-N 3.02Å; V1186-H1189 WeakPolarHBondContact O-CA 3.31Å; V1186-H1189 WeakPolarHBondContact O-CB 3.32Å; V1186-H1189 PolarHBondContact O-N 3.41Å; Q1187-H1189 PolarHBondContact O-N 3.07Å
1190	D	92.2	Very high	92.8	Very high	46 Å²	46	62.8 Å²	62.8	25%	0.246	32%	0.316	C	S	.	.	H	α-helix	trans	-94.8	-17.4	-175.2	71.9	8.9	0	0	0	115.1	G968 S969 V1186 Q1187 K1192	G968-D1190 WeakPolarHBondContact CA-OD2 3.25Å; S969-D1190 WeakPolarHBondContact CB-OD2 3.47Å; S969-D1190 PolarHBondContact N-OD2 2.9Å; S969-D1190 VanDerWaalsContact OG-CG 3.25Å; S969-D1190 PolarHBondContact OG-OD1 3.3Å; S969-D1190 PolarHBondContact OG-OD2 3.4Å; V1186-D1190 PolarHBondContact O-N 2.92Å; Q1187-D1190 WeakPolarHBondContact CA-OD1 3.1Å; D1190-K1192 HydrophobicContact CB-CG 4.38Å; D1190-K1192 PolarHBondContact O-N 3.04Å; D1190-K1192 PolarHBondContact OD1-N 2.86Å; D1190-K1192 VanDerWaalsContact OD1-N 3.12Å
1191	G	91.1	Very high	92.7	Very high	56 Å²	56	62.8 Å²	62.8	58%	0.577	32%	0.316	S	S	*	.			trans	68.2	12.6	176.2	0	0	0	0	0	115.6	Q1187	Q1187-G1191 WeakPolarHBondContact O-CA 3.39Å; Q1187-G1191 PolarHBondContact O-N 3.25Å
1192	K	91.3	Very high	92.5	Very high	96 Å²	96	66.4 Å²	66.4	42%	0.417	33%	0.332	S	S	.	.			trans	-73.6	151.7	-175.4	-66.1	-176.3	175	-173.2	0	112.8	P970 Q1187 D1190	P970-K1192 HydrophobicContact CG-CB 4.05Å; P970-K1192 HydrophobicContact CG-CD 3.85Å; Q1187-K1192 PolarHBondContact NE2-O 3.44Å; D1190-K1192 HydrophobicContact CB-CG 4.38Å; D1190-K1192 PolarHBondContact O-N 3.04Å; D1190-K1192 PolarHBondContact OD1-N 2.86Å; D1190-K1192 VanDerWaalsContact OD1-N 3.12Å
1193	D	92.9	Very high	92.3	Very high	99 Å²	99	71.6 Å²	71.6	53%	0.529	36%	0.355	S	S	.	.			trans	-142.4	104.7	175.5	-174	21.6	0	0	0	110.3	K1202	D1193-K1202 HydrophobicContact CB-CB 4.21Å; D1193-K1202 WeakPolarHBondContact OD1-CB 3.24Å; D1193-K1202 PolarHBondContact OD1-N 3.04Å; D1193-K1202 WeakPolarHBondContact OD2-CB 3.48Å
1194	E	91.9	Very high	92.3	Very high	89 Å²	89	71.6 Å²	71.6	42%	0.416	36%	0.355	S	S	.	.			trans	-133.1	159.9	-179.1	-67.4	176.6	-152.1	0	0	109.4	P970 I1196 L1201	P970-E1194 HydrophobicContact CB-CB 4.28Å; P970-E1194 HydrophobicContact CB-CG 4.46Å; P970-E1194 WeakPolarHBondContact CB-OE2 3.22Å; P970-E1194 HydrophobicContact CG-CB 4.25Å; P970-E1194 VanDerWaalsContact CG-CD 3.44Å; P970-E1194 HydrophobicContact CG-CG 4.06Å; P970-E1194 WeakPolarHBondContact CG-OE1 3.4Å; E1194-I1196 HydrophobicContact CB-CD1 4.08Å; E1194-I1196 HydrophobicContact CB-CG1 4.4Å; E1194-L1201 WeakPolarHBondContact O-CB 3.39Å; E1194-L1201 PolarHBondContact O-N 2.81Å
1195	I	93.4	Very high	92.2	Very high	125 Å²	125	71.2 Å²	71.2	64%	0.641	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	107.7	174.3	-57.2	176.7	0	0	0	108.2	P1200	I1195-P1200 HydrophobicContact CG1-CB 4.47Å
1196	I	89.8	Confident	92.2	Very high	24 Å²	24	70.7 Å²	70.7	12%	0.123	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	120	-177.4	-54.4	-57.9	0	0	0	108.7	P970 L973 E974 E1194 N1198 V1199	P970-I1196 HydrophobicContact CB-CD1 3.96Å; P970-I1196 HydrophobicContact CB-CG1 4.09Å; L973-I1196 HydrophobicContact CD2-CB 3.84Å; L973-I1196 HydrophobicContact CD2-CG1 4.16Å; L973-I1196 HydrophobicContact CG-CB 4.12Å; L973-I1196 HydrophobicContact CG-CG2 4.29Å; E974-I1196 HydrophobicContact CB-CG2 3.75Å; E974-I1196 HydrophobicContact CG-CG2 4.29Å; E1194-I1196 HydrophobicContact CB-CD1 4.08Å; E1194-I1196 HydrophobicContact CB-CG1 4.4Å; I1196-N1198 VanDerWaalsContact C-N 3.3Å; I1196-N1198 PolarHBondContact O-N 3.15Å; I1196-V1199 PolarHBondContact N-O 3.15Å; I1196-V1199 WeakPolarHBondContact O-CA 3.35Å; I1196-V1199 VanDerWaalsContact O-CB 3.29Å; I1196-V1199 WeakPolarHBondContact O-CB 3.2Å; I1196-V1199 PolarHBondContact O-N 3.25Å
1197	K	85.8	Confident	92.2	Very high	138 Å²	138	72.8 Å²	72.8	60%	0.6	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	49.2	-175.4	-76.5	-177.4	173.1	-76.6	0	113.3	H977 V1199	H977-K1197 HydrophobicContact CB-CD 3.82Å; K1197-V1199 PolarHBondContact O-N 3.12Å
1198	N	87.8	Confident	92.3	Very high	152 Å²	152	72.4 Å²	72.4	81%	0.813	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	11	-176	-63.9	-1	0	0	0	115.4	I1196 P1200	I1196-N1198 VanDerWaalsContact C-N 3.3Å; I1196-N1198 PolarHBondContact O-N 3.15Å; N1198-P1200 WeakPolarHBondContact O-CD 3.34Å
1199	V	92.2	Very high	92.4	Very high	5 Å²	5	70.6 Å²	70.6	3%	0.03	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	110.4	175.7	178.7	0	0	0	0	109.8	L973 H977 I1140 I1196 K1197 L1201 M1204	L973-V1199 HydrophobicContact CD2-CB 4.38Å; L973-V1199 HydrophobicContact CD2-CG1 4.09Å; H977-V1199 VanDerWaalsContact NE2-CG2 3.32Å; H977-V1199 WeakPolarHBondContact NE2-CG2 3.41Å; I1140-V1199 HydrophobicContact CG1-CG2 4.49Å; I1140-V1199 HydrophobicContact CG2-CG2 3.84Å; I1196-V1199 PolarHBondContact N-O 3.15Å; I1196-V1199 WeakPolarHBondContact O-CA 3.35Å; I1196-V1199 VanDerWaalsContact O-CB 3.29Å; I1196-V1199 WeakPolarHBondContact O-CB 3.2Å; I1196-V1199 PolarHBondContact O-N 3.25Å; K1197-V1199 PolarHBondContact O-N 3.12Å; V1199-L1201 PolarHBondContact O-N 3.17Å; V1199-M1204 HydrophobicContact CG1-CB 3.76Å; V1199-M1204 HydrophobicContact CG1-CG 4.04Å
1200	P	92.8	Very high	92.5	Very high	34 Å²	34	71.1 Å²	71.1	22%	0.221	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	112.1	172.5	23.3	-28.3	0	0	0	109.9	P1141 I1195 N1198 K1202 K1203 M1204	P1141-P1200 HydrophobicContact CG-CG 4.3Å; I1195-P1200 HydrophobicContact CG1-CB 4.47Å; N1198-P1200 WeakPolarHBondContact O-CD 3.34Å; P1200-K1202 VanDerWaalsContact C-N 3.3Å; P1200-K1202 PolarHBondContact O-N 2.95Å; P1200-K1203 HydrophobicContact CB-CB 4.39Å; P1200-K1203 HydrophobicContact CG-CB 4.02Å; P1200-K1203 HydrophobicContact CG-CD 4.08Å; P1200-K1203 HydrophobicContact CG-CG 4.37Å; P1200-K1203 PolarHBondContact O-N 2.97Å; P1200-K1203 VanDerWaalsContact O-N 3.16Å; P1200-M1204 PolarHBondContact O-N 2.98Å
1201	L	92.6	Very high	92.7	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-55.9	-42.5	-172.7	176.8	60.8	0	0	0	111.9	S969 P970 L973 L1183 Q1187 E1194 V1199 M1204 V1205	S969-L1201 WeakPolarHBondContact OG-CD2 3.27Å; P970-L1201 HydrophobicContact CG-CD2 3.98Å; L973-L1201 HydrophobicContact CB-CD1 4.23Å; L973-L1201 HydrophobicContact CD2-CB 4.17Å; L973-L1201 HydrophobicContact CD2-CD1 3.72Å; L1183-L1201 HydrophobicContact CD1-CD1 3.99Å; L1183-L1201 HydrophobicContact CD2-CD1 4.32Å; L1183-L1201 HydrophobicContact CG-CD1 4.37Å; Q1187-L1201 HydrophobicContact CG-CD1 4.38Å; Q1187-L1201 HydrophobicContact CG-CD2 4.24Å; Q1187-L1201 HydrophobicContact CG-CG 4.1Å; E1194-L1201 WeakPolarHBondContact O-CB 3.39Å; E1194-L1201 PolarHBondContact O-N 2.81Å; V1199-L1201 PolarHBondContact O-N 3.17Å; L1201-M1204 WeakPolarHBondContact O-CB 3.32Å; L1201-M1204 PolarHBondContact O-N 2.82Å; L1201-V1205 HydrophobicContact CD1-CG1 4.11Å; L1201-V1205 WeakPolarHBondContact O-CG2 3.49Å; L1201-V1205 PolarHBondContact O-N 3.42Å
1202	K	91.8	Very high	92.9	Very high	89 Å²	89	68.1 Å²	68.1	39%	0.387	32%	0.317	S	S	.	.	H	α-helix	trans	-60.9	-46.6	178	-175.4	63.6	173.3	-177.8	0	113.6	D1193 P1200 M1204 V1205 E1206	D1193-K1202 HydrophobicContact CB-CB 4.21Å; D1193-K1202 WeakPolarHBondContact OD1-CB 3.24Å; D1193-K1202 PolarHBondContact OD1-N 3.04Å; D1193-K1202 WeakPolarHBondContact OD2-CB 3.48Å; P1200-K1202 VanDerWaalsContact C-N 3.3Å; P1200-K1202 PolarHBondContact O-N 2.95Å; K1202-M1204 VanDerWaalsContact C-N 3.34Å; K1202-V1205 VanDerWaalsContact O-CG2 3.22Å; K1202-V1205 WeakPolarHBondContact O-CG2 3.34Å; K1202-V1205 PolarHBondContact O-N 2.65Å; K1202-E1206 VanDerWaalsContact CE-OE1 3.31Å; K1202-E1206 WeakPolarHBondContact CE-OE1 3.41Å; K1202-E1206 VanDerWaalsContact O-CG 3.29Å; K1202-E1206 WeakPolarHBondContact O-CG 3.35Å; K1202-E1206 PolarHBondContact O-N 3.19Å
1203	K	92.3	Very high	93.1	Very high	125 Å²	125	67.3 Å²	67.3	54%	0.543	32%	0.316	S	S	.	.	H	α-helix	trans	-67.8	-35.4	177.4	-74.4	-172.2	173.5	-177.5	0	112	P1141 P1200 E1206 R1207	P1141-K1203 HydrophobicContact CB-CB 4.44Å; P1141-K1203 HydrophobicContact CG-CB 3.85Å; P1200-K1203 HydrophobicContact CB-CB 4.39Å; P1200-K1203 HydrophobicContact CG-CB 4.02Å; P1200-K1203 HydrophobicContact CG-CD 4.08Å; P1200-K1203 HydrophobicContact CG-CG 4.37Å; P1200-K1203 PolarHBondContact O-N 2.97Å; P1200-K1203 VanDerWaalsContact O-N 3.16Å; K1203-E1206 PolarHBondContact O-N 2.8Å; K1203-R1207 WeakPolarHBondContact O-CG 3.31Å; K1203-R1207 PolarHBondContact O-N 3.16Å
1204	M	94.4	Very high	93.1	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.7	-51.9	175.4	175.3	54.3	165.3	0	0	110.8	F1136 C1139 I1140 P1141 L1183 V1199 P1200 L1201 K1202 E1206 R1207 I1208	F1136-M1204 HydrophobicContact CD2-CE 3.67Å; F1136-M1204 HydrophobicContact CE2-CE 3.67Å; F1136-M1204 HydrophobicContact CG-CE 4.38Å; F1136-M1204 HydrophobicContact CZ-CE 4.38Å; C1139-M1204 HydrophobicContact CB-CE 3.78Å; C1139-M1204 HydrophobicContact CB-SD 3.6Å; C1139-M1204 VanDerWaalsContact CB-SD 3.6Å; I1140-M1204 HydrophobicContact CG1-CE 4.26Å; P1141-M1204 HydrophobicContact CG-CB 4.4Å; L1183-M1204 HydrophobicContact CD2-CG 4.22Å; V1199-M1204 HydrophobicContact CG1-CB 3.76Å; V1199-M1204 HydrophobicContact CG1-CG 4.04Å; P1200-M1204 PolarHBondContact O-N 2.98Å; L1201-M1204 WeakPolarHBondContact O-CB 3.32Å; L1201-M1204 PolarHBondContact O-N 2.82Å; K1202-M1204 VanDerWaalsContact C-N 3.34Å; M1204-E1206 VanDerWaalsContact C-N 3.34Å; M1204-E1206 PolarHBondContact O-N 3.06Å; M1204-R1207 PolarHBondContact O-N 2.86Å; M1204-I1208 HydrophobicContact CE-CD1 4Å; M1204-I1208 HydrophobicContact CE-CG1 4.44Å; M1204-I1208 HydrophobicContact CG-CD1 3.99Å; M1204-I1208 VanDerWaalsContact O-CG1 3.26Å; M1204-I1208 WeakPolarHBondContact O-CG1 3.39Å; M1204-I1208 PolarHBondContact O-N 3.37Å; M1204-I1208 HydrophobicContact SD-CD1 4.07Å; M1204-I1208 HydrophobicContact SD-CG1 4.25Å
1205	V	94.1	Very high	93.3	Very high	4 Å²	4	59.6 Å²	59.6	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-69.6	-29	-179.7	-60.5	0	0	0	0	113.6	L1183 L1184 Q1187 L1201 K1202 I1208 R1209	L1183-V1205 HydrophobicContact CD2-CG1 4.47Å; L1183-V1205 HydrophobicContact CG-CG1 4.17Å; L1184-V1205 HydrophobicContact CD1-CB 3.89Å; Q1187-V1205 HydrophobicContact CB-CG1 3.82Å; Q1187-V1205 HydrophobicContact CG-CB 4.49Å; Q1187-V1205 HydrophobicContact CG-CG1 3.9Å; Q1187-V1205 HydrophobicContact CG-CG2 4.01Å; L1201-V1205 HydrophobicContact CD1-CG1 4.11Å; L1201-V1205 WeakPolarHBondContact O-CG2 3.49Å; L1201-V1205 PolarHBondContact O-N 3.42Å; K1202-V1205 VanDerWaalsContact O-CG2 3.22Å; K1202-V1205 WeakPolarHBondContact O-CG2 3.34Å; K1202-V1205 PolarHBondContact O-N 2.65Å; V1205-I1208 HydrophobicContact CG1-CD1 4.45Å; V1205-I1208 PolarHBondContact O-N 3.37Å; V1205-R1209 PolarHBondContact O-N 3.02Å
1206	E	93.9	Very high	93.4	Very high	103 Å²	103	57 Å²	57	48%	0.481	27%	0.265	S	S	.	.	H	α-helix	trans	-63.6	-46.2	170.8	-76.9	172.2	-178.2	0	0	111.7	K1202 K1203 M1204 R1209 K1210	K1202-E1206 VanDerWaalsContact CE-OE1 3.31Å; K1202-E1206 WeakPolarHBondContact CE-OE1 3.41Å; K1202-E1206 VanDerWaalsContact O-CG 3.29Å; K1202-E1206 WeakPolarHBondContact O-CG 3.35Å; K1202-E1206 PolarHBondContact O-N 3.19Å; K1203-E1206 PolarHBondContact O-N 2.8Å; M1204-E1206 VanDerWaalsContact C-N 3.34Å; M1204-E1206 PolarHBondContact O-N 3.06Å; E1206-R1209 PolarHBondContact O-N 3.44Å; E1206-K1210 WeakPolarHBondContact O-CG 3.3Å; E1206-K1210 PolarHBondContact O-N 3.13Å
1207	R	95.3	Very high	93.6	Very high	45 Å²	45	61 Å²	61	17%	0.17	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-44.5	173.9	-74.1	-178.3	63.5	73.8	2.8	111.6	Y1138 C1139 E1150 K1203 M1204 R1209 K1210 F1211	Y1138-R1207 PolarHBondContact O-NH2 3.01Å; C1139-R1207 VanDerWaalsContact O-CD 3.31Å; C1139-R1207 WeakPolarHBondContact O-CD 3.47Å; C1139-R1207 PolarHBondContact O-NE 3.26Å; E1150-R1207 IonicContact OE1-CZ 3.76Å; E1150-R1207 IonicContact OE1-NH1 3.72Å; E1150-R1207 PolarHBondContact OE1-NH1 3.19Å; E1150-R1207 IonicContact OE1-NH2 3.71Å; E1150-R1207 PolarHBondContact OE1-NH2 3.16Å; E1150-R1207 IonicContact OE2-CZ 3.35Å; E1150-R1207 IonicContact OE2-NH1 2.71Å; E1150-R1207 IonicContact OE2-NH2 3.08Å; E1150-R1207 PolarHBondContact OE2-NH2 2.73Å; K1203-R1207 WeakPolarHBondContact O-CG 3.31Å; K1203-R1207 PolarHBondContact O-N 3.16Å; M1204-R1207 PolarHBondContact O-N 2.86Å; R1207-R1209 VanDerWaalsContact C-N 3.26Å; R1207-R1209 PolarHBondContact O-N 3.39Å; R1207-K1210 WeakPolarHBondContact O-CB 3.32Å; R1207-K1210 PolarHBondContact O-N 3.45Å; R1207-F1211 VanDerWaalsContact O-CD2 3.25Å; R1207-F1211 WeakPolarHBondContact O-CD2 3.46Å; R1207-F1211 PolarHBondContact O-N 3.24Å; R1207-F1211 VanDerWaalsContact O-N 3.09Å
1208	I	96.6	Very high	94.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-54.5	-45.2	174.9	-68.8	167.3	0	0	0	110.6	C1139 C1180 Y1181 L1183 L1184 M1204 V1205 K1210 F1211 Q1212	C1139-I1208 HydrophobicContact CB-CG1 3.75Å; C1180-I1208 HydrophobicContact CB-CB 4.37Å; C1180-I1208 HydrophobicContact CB-CD1 3.69Å; C1180-I1208 HydrophobicContact CB-CG1 3.73Å; C1180-I1208 HydrophobicContact CB-CG2 3.72Å; Y1181-I1208 HydrophobicContact CD1-CG2 4.33Å; L1183-I1208 HydrophobicContact CD2-CD1 4.05Å; L1184-I1208 HydrophobicContact CB-CG2 3.96Å; L1184-I1208 HydrophobicContact CD2-CG2 4.08Å; M1204-I1208 HydrophobicContact CE-CD1 4Å; M1204-I1208 HydrophobicContact CE-CG1 4.44Å; M1204-I1208 HydrophobicContact CG-CD1 3.99Å; M1204-I1208 VanDerWaalsContact O-CG1 3.26Å; M1204-I1208 WeakPolarHBondContact O-CG1 3.39Å; M1204-I1208 PolarHBondContact O-N 3.37Å; M1204-I1208 HydrophobicContact SD-CD1 4.07Å; M1204-I1208 HydrophobicContact SD-CG1 4.25Å; V1205-I1208 HydrophobicContact CG1-CD1 4.45Å; V1205-I1208 PolarHBondContact O-N 3.37Å; I1208-K1210 VanDerWaalsContact C-N 3.27Å; I1208-K1210 PolarHBondContact O-N 3.02Å; I1208-F1211 PolarHBondContact O-N 3.41Å; I1208-Q1212 VanDerWaalsContact O-CB 3.31Å; I1208-Q1212 WeakPolarHBondContact O-CB 3.41Å; I1208-Q1212 PolarHBondContact O-N 2.94Å
1209	R	96	Very high	94.4	Very high	114 Å²	114	48.1 Å²	48.1	43%	0.43	22%	0.221	S	C	.	.	H	α-helix	trans	-62.7	-34.2	179.1	-179.2	56.8	-178	171.8	6.9	112.3	L1184 V1205 E1206 R1207 I1213	L1184-R1209 HydrophobicContact CD1-CB 4.46Å; L1184-R1209 HydrophobicContact CD2-CB 4.05Å; V1205-R1209 PolarHBondContact O-N 3.02Å; E1206-R1209 PolarHBondContact O-N 3.44Å; R1207-R1209 VanDerWaalsContact C-N 3.26Å; R1207-R1209 PolarHBondContact O-N 3.39Å; R1209-I1213 HydrophobicContact CG-CD1 4.35Å; R1209-I1213 WeakPolarHBondContact O-CG1 3.49Å; R1209-I1213 PolarHBondContact O-N 3.25Å
1210	K	94.4	Very high	94.5	Very high	149 Å²	149	52.3 Å²	52.3	65%	0.648	25%	0.246	S	C	*	.	H	α-helix	trans	-66.4	-49.8	176.1	-63.9	-62.6	-176.8	176	0	111.6	E1206 R1207 I1208 Q1212 I1213 L1214	E1206-K1210 WeakPolarHBondContact O-CG 3.3Å; E1206-K1210 PolarHBondContact O-N 3.13Å; R1207-K1210 WeakPolarHBondContact O-CB 3.32Å; R1207-K1210 PolarHBondContact O-N 3.45Å; I1208-K1210 VanDerWaalsContact C-N 3.27Å; I1208-K1210 PolarHBondContact O-N 3.02Å; K1210-Q1212 VanDerWaalsContact C-N 3.3Å; K1210-Q1212 PolarHBondContact O-N 3.49Å; K1210-I1213 PolarHBondContact O-N 3.15Å; K1210-L1214 PolarHBondContact O-N 2.74Å; K1210-L1214 VanDerWaalsContact O-N 3.1Å
1211	F	95.5	Very high	94.6	Very high	12 Å²	12	52.9 Å²	52.9	5%	0.053	25%	0.247	C	C	.	.	H	α-helix	trans	-67.1	-31.4	177.2	-67.7	-66.7	0	0	0	112.7	Y1138 C1139 V1149 H1158 R1207 I1208 I1213 L1214 N1215	Y1138-F1211 HydrophobicContact CD2-CD1 4.33Å; Y1138-F1211 AromaticContact CD2-CD2 3.94Å; Y1138-F1211 HydrophobicContact CD2-CD2 3.94Å; Y1138-F1211 HydrophobicContact CD2-CE1 4.29Å; Y1138-F1211 AromaticContact CD2-CE2 3.87Å; Y1138-F1211 HydrophobicContact CD2-CE2 3.87Å; Y1138-F1211 HydrophobicContact CD2-CG 4.17Å; Y1138-F1211 HydrophobicContact CD2-CZ 4.05Å; Y1138-F1211 HydrophobicContact CE2-CB 4.06Å; Y1138-F1211 AromaticContact CE2-CD1 3.9Å; Y1138-F1211 HydrophobicContact CE2-CD1 3.9Å; Y1138-F1211 AromaticContact CE2-CD2 3.82Å; Y1138-F1211 HydrophobicContact CE2-CD2 3.82Å; Y1138-F1211 HydrophobicContact CE2-CE1 4.29Å; Y1138-F1211 HydrophobicContact CE2-CE2 4.21Å; Y1138-F1211 AromaticContact CE2-CG 3.65Å; Y1138-F1211 HydrophobicContact CE2-CG 3.65Å; Y1138-F1211 HydrophobicContact CE2-CZ 4.43Å; C1139-F1211 VanDerWaalsContact SG-CD2 3.54Å; V1149-F1211 HydrophobicContact CG1-CE1 4.2Å; V1149-F1211 HydrophobicContact CG1-CZ 3.68Å; H1158-F1211 AromaticContact CE1-CD1 3.45Å; H1158-F1211 VanDerWaalsContact CE1-CD1 3.45Å; H1158-F1211 WeakPolarHBondContact CE1-CD1 3.29Å; H1158-F1211 AromaticContact CE1-CE1 3.45Å; H1158-F1211 VanDerWaalsContact CE1-CE1 3.45Å; H1158-F1211 WeakPolarHBondContact CE1-CE1 3.34Å; H1158-F1211 AromaticContact NE2-CD1 3.64Å; H1158-F1211 AromaticContact NE2-CE1 3.3Å; H1158-F1211 VanDerWaalsContact NE2-CE1 3.3Å; H1158-F1211 WeakPolarHBondContact NE2-CE1 3.5Å; R1207-F1211 VanDerWaalsContact O-CD2 3.25Å; R1207-F1211 WeakPolarHBondContact O-CD2 3.46Å; R1207-F1211 PolarHBondContact O-N 3.24Å; R1207-F1211 VanDerWaalsContact O-N 3.09Å; I1208-F1211 PolarHBondContact O-N 3.41Å; F1211-I1213 PolarHBondContact O-N 3.33Å; F1211-L1214 HydrophobicContact CD1-CD2 4.39Å; F1211-L1214 PolarHBondContact O-N 2.9Å; F1211-N1215 WeakPolarHBondContact O-CB 3.48Å; F1211-N1215 PolarHBondContact O-N 2.97Å; F1211-N1215 PolarHBondContact O-ND2 3.4Å; F1211-N1215 PolarHBondContact O-OD1 3.41Å
1212	Q	95.5	Very high	94.6	Very high	28 Å²	28	53 Å²	53	13%	0.131	25%	0.248	C	C	.	.	H	α-helix	trans	-59.1	-47.2	172	179.7	174.2	59	0	0	111.6	Y1181 I1208 K1210 L1214 N1215 D1216	Y1181-Q1212 HydrophobicContact CD1-CB 4.25Å; Y1181-Q1212 HydrophobicContact CD1-CG 4.26Å; Y1181-Q1212 HydrophobicContact CE1-CB 3.58Å; Y1181-Q1212 HydrophobicContact CE1-CG 3.74Å; Y1181-Q1212 HydrophobicContact CE2-CG 4.15Å; Y1181-Q1212 WeakPolarHBondContact OH-CA 3.36Å; I1208-Q1212 VanDerWaalsContact O-CB 3.31Å; I1208-Q1212 WeakPolarHBondContact O-CB 3.41Å; I1208-Q1212 PolarHBondContact O-N 2.94Å; K1210-Q1212 VanDerWaalsContact C-N 3.3Å; K1210-Q1212 PolarHBondContact O-N 3.49Å; Q1212-L1214 PolarHBondContact O-N 2.77Å; Q1212-N1215 PolarHBondContact O-N 2.84Å; Q1212-D1216 WeakPolarHBondContact O-CB 3.44Å; Q1212-D1216 PolarHBondContact O-N 3.02Å
1213	I	95.1	Very high	94.6	Very high	78 Å²	78	50.2 Å²	50.2	40%	0.4	24%	0.237	S	C	.	.	H	α-helix	trans	-61.8	-45.4	177.5	-66.8	164.2	0	0	0	110.6	R1209 K1210 F1211 D1216 E1217	R1209-I1213 HydrophobicContact CG-CD1 4.35Å; R1209-I1213 WeakPolarHBondContact O-CG1 3.49Å; R1209-I1213 PolarHBondContact O-N 3.25Å; K1210-I1213 PolarHBondContact O-N 3.15Å; F1211-I1213 PolarHBondContact O-N 3.33Å; I1213-D1216 PolarHBondContact O-N 3.49Å; I1213-E1217 WeakPolarHBondContact O-CB 3.4Å; I1213-E1217 PolarHBondContact O-N 2.69Å
1214	L	94.8	Very high	94.5	Very high	27 Å²	27	51.6 Å²	51.6	14%	0.141	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-47.3	179	-179.1	62.8	0	0	0	112	H1158 K1210 F1211 Q1212 E1217 I1218	H1158-L1214 HydrophobicContact CB-CD2 4.11Å; K1210-L1214 PolarHBondContact O-N 2.74Å; K1210-L1214 VanDerWaalsContact O-N 3.1Å; F1211-L1214 HydrophobicContact CD1-CD2 4.39Å; F1211-L1214 PolarHBondContact O-N 2.9Å; Q1212-L1214 PolarHBondContact O-N 2.77Å; L1214-E1217 PolarHBondContact O-N 2.8Å; L1214-I1218 HydrophobicContact CD1-CD1 3.92Å; L1214-I1218 HydrophobicContact CD1-CG1 4.36Å; L1214-I1218 HydrophobicContact CG-CD1 3.85Å; L1214-I1218 VanDerWaalsContact O-CG1 3.25Å; L1214-I1218 WeakPolarHBondContact O-CG1 2.9Å; L1214-I1218 PolarHBondContact O-N 3.45Å
1215	N	95.2	Very high	94.2	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-44.7	178	-68	-18.9	0	0	0	111.4	Q1135 Y1181 F1211 Q1212 E1217 I1218 I1219	Q1135-N1215 PolarHBondContact OE1-ND2 3.34Å; Y1181-N1215 PolarHBondContact OH-ND2 3.04Å; F1211-N1215 WeakPolarHBondContact O-CB 3.48Å; F1211-N1215 PolarHBondContact O-N 2.97Å; F1211-N1215 PolarHBondContact O-ND2 3.4Å; F1211-N1215 PolarHBondContact O-OD1 3.41Å; Q1212-N1215 PolarHBondContact O-N 2.84Å; N1215-E1217 VanDerWaalsContact C-N 3.3Å; N1215-E1217 PolarHBondContact O-N 3.12Å; N1215-I1218 PolarHBondContact O-N 3.26Å; N1215-I1219 HydrophobicContact CB-CD1 4.48Å; N1215-I1219 VanDerWaalsContact O-CB 3.27Å; N1215-I1219 WeakPolarHBondContact O-CB 3.37Å; N1215-I1219 WeakPolarHBondContact O-CG1 3.49Å; N1215-I1219 PolarHBondContact O-N 3.04Å
1216	D	94.7	Very high	93.7	Very high	69 Å²	69	56.4 Å²	56.4	37%	0.369	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-39.6	-179.9	-69.9	-16.1	0	0	0	110.8	Q1212 I1213 T1220	Q1212-D1216 WeakPolarHBondContact O-CB 3.44Å; Q1212-D1216 PolarHBondContact O-N 3.02Å; I1213-D1216 PolarHBondContact O-N 3.49Å; D1216-T1220 VanDerWaalsContact O-CB 3.24Å; D1216-T1220 WeakPolarHBondContact O-CB 3.34Å; D1216-T1220 PolarHBondContact O-N 3.37Å; D1216-T1220 PolarHBondContact O-OG1 3.45Å
1217	E	95.2	Very high	92.5	Very high	109 Å²	109	58 Å²	58	51%	0.509	27%	0.27	S	S	.	.	H	α-helix	trans	-61	-53.1	173.5	-179.5	178.8	176	0	0	111.5	I1213 L1214 N1215 T1220 I1221	I1213-E1217 WeakPolarHBondContact O-CB 3.4Å; I1213-E1217 PolarHBondContact O-N 2.69Å; L1214-E1217 PolarHBondContact O-N 2.8Å; N1215-E1217 VanDerWaalsContact C-N 3.3Å; N1215-E1217 PolarHBondContact O-N 3.12Å; E1217-T1220 PolarHBondContact O-N 2.99Å; E1217-I1221 HydrophobicContact CG-CD1 3.96Å; E1217-I1221 WeakPolarHBondContact O-CG1 3.47Å; E1217-I1221 PolarHBondContact O-N 3.08Å
1218	I	96.2	Very high	90.5	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-61.7	-49.1	-178.6	-65.7	169.2	0	0	0	111	H1158 W1159 C1162 L1214 N1215 T1220 I1221 L1222	H1158-I1218 HydrophobicContact CB-CD1 3.85Å; W1159-I1218 HydrophobicContact CD2-CD1 4.41Å; W1159-I1218 HydrophobicContact CD2-CG1 4.22Å; W1159-I1218 HydrophobicContact CD2-CG2 3.89Å; W1159-I1218 HydrophobicContact CE3-CG2 4.01Å; W1159-I1218 HydrophobicContact CG-CD1 4.03Å; W1159-I1218 HydrophobicContact CG-CG1 4.36Å; W1159-I1218 HydrophobicContact CG-CG2 4.23Å; W1159-I1218 HydrophobicContact CZ2-CG1 4.21Å; W1159-I1218 HydrophobicContact CZ3-CG2 4.45Å; C1162-I1218 HydrophobicContact CB-CB 4.33Å; C1162-I1218 HydrophobicContact CB-CG2 3.63Å; L1214-I1218 HydrophobicContact CD1-CD1 3.92Å; L1214-I1218 HydrophobicContact CD1-CG1 4.36Å; L1214-I1218 HydrophobicContact CG-CD1 3.85Å; L1214-I1218 VanDerWaalsContact O-CG1 3.25Å; L1214-I1218 WeakPolarHBondContact O-CG1 2.9Å; L1214-I1218 PolarHBondContact O-N 3.45Å; N1215-I1218 PolarHBondContact O-N 3.26Å; I1218-T1220 VanDerWaalsContact C-N 3.27Å; I1218-T1220 PolarHBondContact O-N 3.31Å; I1218-I1221 PolarHBondContact O-N 3.04Å; I1218-I1221 VanDerWaalsContact O-N 3.17Å; I1218-L1222 HydrophobicContact CG2-CD1 3.73Å; I1218-L1222 HydrophobicContact CG2-CG 4.28Å; I1218-L1222 VanDerWaalsContact O-CG 3.29Å; I1218-L1222 WeakPolarHBondContact O-CG 3.46Å; I1218-L1222 PolarHBondContact O-N 3.15Å
1219	I	94.8	Very high	88.1	Confident	17 Å²	17	61.8 Å²	61.8	9%	0.087	31%	0.311	C	S	.	.	H	α-helix	trans	-58.4	-43	179	-70.9	169.1	0	0	0	110.1	C1162 V1166 Q1171 N1215 L1222 D1223	C1162-I1219 HydrophobicContact CB-CG1 3.94Å; V1166-I1219 HydrophobicContact CG2-CB 4.25Å; V1166-I1219 HydrophobicContact CG2-CG1 4.07Å; V1166-I1219 HydrophobicContact CG2-CG2 3.9Å; Q1171-I1219 HydrophobicContact CB-CD1 4.4Å; Q1171-I1219 HydrophobicContact CB-CG2 3.91Å; Q1171-I1219 HydrophobicContact CG-CG2 4.01Å; N1215-I1219 HydrophobicContact CB-CD1 4.48Å; N1215-I1219 VanDerWaalsContact O-CB 3.27Å; N1215-I1219 WeakPolarHBondContact O-CB 3.37Å; N1215-I1219 WeakPolarHBondContact O-CG1 3.49Å; N1215-I1219 PolarHBondContact O-N 3.04Å; I1219-L1222 PolarHBondContact O-N 3.09Å; I1219-D1223 WeakPolarHBondContact O-CB 3.38Å; I1219-D1223 PolarHBondContact O-N 3.29Å
1220	T	94.3	Very high	85.5	Confident	93 Å²	93	62 Å²	62	57%	0.571	32%	0.321	S	S	*	.	H	α-helix	trans	-64	-41.8	178.2	-59.3	0	0	0	0	111.8	D1216 E1217 I1218 K1224	D1216-T1220 VanDerWaalsContact O-CB 3.24Å; D1216-T1220 WeakPolarHBondContact O-CB 3.34Å; D1216-T1220 PolarHBondContact O-N 3.37Å; D1216-T1220 PolarHBondContact O-OG1 3.45Å; E1217-T1220 PolarHBondContact O-N 2.99Å; I1218-T1220 VanDerWaalsContact C-N 3.27Å; I1218-T1220 PolarHBondContact O-N 3.31Å; T1220-K1224 VanDerWaalsContact O-CB 3.29Å; T1220-K1224 WeakPolarHBondContact O-CB 3.46Å; T1220-K1224 PolarHBondContact O-N 3.31Å
1221	I	93.8	Very high	83	Confident	47 Å²	47	57.2 Å²	57.2	24%	0.241	31%	0.314	C	S	.	.	H	α-helix	trans	-63.7	-47.7	177.1	-67.8	165.5	0	0	0	110.5	W1159 E1217 I1218 K1224 Y1225	W1159-I1221 HydrophobicContact CH2-CB 4.41Å; W1159-I1221 HydrophobicContact CH2-CD1 4.28Å; W1159-I1221 HydrophobicContact CH2-CG2 3.93Å; W1159-I1221 HydrophobicContact CZ2-CD1 4.35Å; W1159-I1221 HydrophobicContact CZ3-CG2 4.5Å; E1217-I1221 HydrophobicContact CG-CD1 3.96Å; E1217-I1221 WeakPolarHBondContact O-CG1 3.47Å; E1217-I1221 PolarHBondContact O-N 3.08Å; I1218-I1221 PolarHBondContact O-N 3.04Å; I1218-I1221 VanDerWaalsContact O-N 3.17Å; I1221-K1224 WeakPolarHBondContact O-CB 3.48Å; I1221-K1224 PolarHBondContact O-N 2.95Å; I1221-Y1225 HydrophobicContact CG2-CD2 3.89Å; I1221-Y1225 HydrophobicContact CG2-CE2 3.9Å; I1221-Y1225 WeakPolarHBondContact O-CD2 3.38Å; I1221-Y1225 PolarHBondContact O-N 3.35Å; I1221-Y1225 VanDerWaalsContact O-N 3.12Å
1222	L	93.8	Very high	80.2	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-62.2	-46.8	179.3	-67.2	168	0	0	0	111.7	F1093 L1097 W1159 C1162 M1163 V1166 I1218 I1219 K1224 Y1225 L1226	F1093-L1222 HydrophobicContact CE1-CD2 4.27Å; F1093-L1222 HydrophobicContact CZ-CD2 4.27Å; L1097-L1222 HydrophobicContact CD1-CD2 3.98Å; L1097-L1222 HydrophobicContact CD2-CD2 3.91Å; W1159-L1222 HydrophobicContact CE3-CD2 4.38Å; W1159-L1222 HydrophobicContact CZ3-CD2 4.11Å; W1159-L1222 HydrophobicContact CZ3-CG 4.44Å; C1162-L1222 HydrophobicContact CB-CD1 4.34Å; M1163-L1222 HydrophobicContact CB-CD1 4.1Å; V1166-L1222 HydrophobicContact CB-CB 4.44Å; V1166-L1222 HydrophobicContact CB-CD1 4.47Å; V1166-L1222 HydrophobicContact CG1-CB 4.1Å; V1166-L1222 HydrophobicContact CG2-CB 4.29Å; V1166-L1222 HydrophobicContact CG2-CD1 4.22Å; I1218-L1222 HydrophobicContact CG2-CD1 3.73Å; I1218-L1222 HydrophobicContact CG2-CG 4.28Å; I1218-L1222 VanDerWaalsContact O-CG 3.29Å; I1218-L1222 WeakPolarHBondContact O-CG 3.46Å; I1218-L1222 PolarHBondContact O-N 3.15Å; I1219-L1222 PolarHBondContact O-N 3.09Å; L1222-K1224 PolarHBondContact O-N 3.04Å; L1222-Y1225 PolarHBondContact O-N 3.43Å; L1222-L1226 WeakPolarHBondContact O-CB 3.42Å; L1222-L1226 PolarHBondContact O-N 3.45Å
1223	D	90.9	Very high	77.7	Confident	31 Å²	31	69.2 Å²	69.2	17%	0.166	39%	0.39	C	S	.	.	H	α-helix	trans	-62.5	-31.8	175.7	-88.6	-24.4	0	0	0	111.9	V1166 Q1171 I1219 K1227	V1166-D1223 WeakPolarHBondContact CG1-OD1 3.34Å; Q1171-D1223 PolarHBondContact NE2-OD1 2.82Å; Q1171-D1223 PolarHBondContact NE2-OD2 3Å; I1219-D1223 WeakPolarHBondContact O-CB 3.38Å; I1219-D1223 PolarHBondContact O-N 3.29Å; D1223-K1227 WeakPolarHBondContact O-CD 3.5Å; D1223-K1227 WeakPolarHBondContact O-CG 3.05Å
1224	K	89.7	Confident	75	Confident	153 Å²	153	69.8 Å²	69.8	67%	0.665	40%	0.397	S	S	*	.	H	α-helix	trans	-66.4	-46.9	176.7	-177	-172.2	175.1	-170.8	0	111.4	T1220 I1221 L1222	T1220-K1224 VanDerWaalsContact O-CB 3.29Å; T1220-K1224 WeakPolarHBondContact O-CB 3.46Å; T1220-K1224 PolarHBondContact O-N 3.31Å; I1221-K1224 WeakPolarHBondContact O-CB 3.48Å; I1221-K1224 PolarHBondContact O-N 2.95Å; L1222-K1224 PolarHBondContact O-N 3.04Å
1225	Y	88.4	Confident	72.6	Confident	66 Å²	66	74 Å²	74	26%	0.259	43%	0.426	S	S	.	.	H	α-helix	trans	-74.4	-25.3	179.8	-79.1	-75.9	0	0	0	113.4	L1008 F1093 E1094 I1221 L1222 K1227 S1228	L1008-Y1225 HydrophobicContact CD1-CE2 4.29Å; F1093-Y1225 HydrophobicContact CD1-CD1 4.14Å; F1093-Y1225 AromaticContact CD1-CD2 3.79Å; F1093-Y1225 HydrophobicContact CD1-CD2 3.79Å; F1093-Y1225 HydrophobicContact CD1-CE2 4.35Å; F1093-Y1225 AromaticContact CD1-CG 3.68Å; F1093-Y1225 HydrophobicContact CD1-CG 3.68Å; F1093-Y1225 HydrophobicContact CE1-CD2 4.06Å; F1093-Y1225 HydrophobicContact CE1-CG 4.31Å; E1094-Y1225 WeakPolarHBondContact CG-O 3.26Å; I1221-Y1225 HydrophobicContact CG2-CD2 3.89Å; I1221-Y1225 HydrophobicContact CG2-CE2 3.9Å; I1221-Y1225 WeakPolarHBondContact O-CD2 3.38Å; I1221-Y1225 PolarHBondContact O-N 3.35Å; I1221-Y1225 VanDerWaalsContact O-N 3.12Å; L1222-Y1225 PolarHBondContact O-N 3.43Å; Y1225-K1227 VanDerWaalsContact C-N 3.27Å; Y1225-K1227 PolarHBondContact O-N 3.37Å; Y1225-S1228 PolarHBondContact O-OG 2.83Å
1226	L	84.4	Confident	70.2	Confident	39 Å²	39	81 Å²	81	20%	0.204	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-10.3	179	-158.6	67.1	0	0	0	113.5	L1097 V1166 L1167 L1222	L1097-L1226 HydrophobicContact CB-CD1 4.16Å; V1166-L1226 HydrophobicContact CG1-CD2 4.15Å; L1167-L1226 HydrophobicContact CD2-CD1 4.2Å; L1167-L1226 HydrophobicContact CD2-CD2 4.27Å; L1222-L1226 WeakPolarHBondContact O-CB 3.42Å; L1222-L1226 PolarHBondContact O-N 3.45Å
1227	K	67.6	Low	68.5	Low	137 Å²	137	85.9 Å²	85.9	60%	0.596	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-1.1	-176.6	-71.5	175.6	-171.7	179.2	0	114.6	D1223 Y1225 G1229	D1223-K1227 WeakPolarHBondContact O-CD 3.5Å; D1223-K1227 WeakPolarHBondContact O-CG 3.05Å; Y1225-K1227 VanDerWaalsContact C-N 3.27Å; Y1225-K1227 PolarHBondContact O-N 3.37Å; K1227-G1229 PolarHBondContact O-N 2.83Å
1228	S	54.5	Low	67.3	Low	72 Å²	72	89.3 Å²	89.3	50%	0.503	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-10.7	-172.5	-13.1	0	0	0	0	114.6	E1094 Y1225	E1094-S1228 VanDerWaalsContact OE2-CB 3.24Å; E1094-S1228 WeakPolarHBondContact OE2-CB 3.4Å; E1094-S1228 PolarHBondContact OE2-OG 2.87Å; Y1225-S1228 PolarHBondContact O-OG 2.83Å
1229	G	45.2	Very low	66.5	Low	52 Å²	52	94.6 Å²	94.6	54%	0.536	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-6.1	-179.5	0	0	0	0	0	117.1	K1227 G1231	K1227-G1229 PolarHBondContact O-N 2.83Å; G1229-G1231 VanDerWaalsContact C-N 3.29Å; G1229-G1231 PolarHBondContact O-N 3.45Å
1230	D	42.6	Very low	65.8	Low	119 Å²	119	100.1 Å²	100.1	64%	0.636	56%	0.557	S	S	*	*			trans	-80.7	76.3	175.3	-79.3	-30.8	0	0	0	110.4
1231	G	41.3	Very low	65.4	Low	49 Å²	49	100.8 Å²	100.8	51%	0.505	56%	0.563	S	S	.	*			trans	-63	156.3	166.3	0	0	0	0	0	111.5	G1229 G1233 T1234	G1229-G1231 VanDerWaalsContact C-N 3.29Å; G1229-G1231 PolarHBondContact O-N 3.45Å; G1231-G1233 PolarHBondContact O-N 3.11Å; G1231-T1234 PolarHBondContact O-N 3.1Å; G1231-T1234 PolarHBondContact O-OG1 3.36Å
1232	E	37.3	Very low	65	Low	219 Å²	219	104.5 Å²	104.5	100%	1.023	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	20	-175.1	-64	-177	146.9	0	0	116.7
1233	G	41.7	Very low	64.4	Low	73 Å²	73	112.5 Å²	112.5	75%	0.753	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.2	2.3	-176.4	0	0	0	0	0	116.7	G1231	G1231-G1233 PolarHBondContact O-N 3.11Å
1234	T	39.4	Very low	64.1	Low	89 Å²	89	115.5 Å²	115.5	55%	0.546	64%	0.637	S	S	.	*	S	Bend	trans	-77.5	130	172.2	28	0	0	0	0	110.8	G1231 V1236	G1231-T1234 PolarHBondContact O-N 3.1Å; G1231-T1234 PolarHBondContact O-OG1 3.36Å; T1234-V1236 PolarHBondContact O-N 3.12Å
1235	P	43.8	Very low	63.5	Low	117 Å²	117	114.7 Å²	114.7	76%	0.76	65%	0.647	S	S	*	*			trans	-60.6	137	172.7	26.3	-31.4	0	0	0	108.4	E1237	P1235-E1237 PolarHBondContact O-N 3.24Å
1236	V	45.5	Very low	63	Low	145 Å²	145	117 Å²	117	88%	0.879	66%	0.663	S	S	*	*			trans	-36.7	113.8	178.5	-176.7	0	0	0	0	110.2	T1234 H1238	T1234-V1236 PolarHBondContact O-N 3.12Å; V1236-H1238 PolarHBondContact O-N 2.93Å
1237	E	58.4	Low	62.5	Low	172 Å²	172	121.5 Å²	121.5	80%	0.804	68%	0.682	S	S	*	*			trans	-50.5	136.7	-179.3	-95.3	-148.8	146.9	0	0	110.7	P1235 V1239	P1235-E1237 PolarHBondContact O-N 3.24Å; E1237-V1239 PolarHBondContact O-N 3.49Å
1238	H	70.8	Confident	62.6	Low	181 Å²	181	122.7 Å²	122.7	84%	0.838	69%	0.69	S	S	*	*			trans	-66.7	105.6	-176.2	-175.2	72.7	0	0	0	111.4	V1236	V1236-H1238 PolarHBondContact O-N 2.93Å
1239	V	78.4	Confident	63.4	Low	114 Å²	114	123.5 Å²	123.5	69%	0.691	70%	0.696	S	S	*	*			trans	-82.3	132.7	172.3	-176.5	0	0	0	0	109.6	E1237 C1241	E1237-V1239 PolarHBondContact O-N 3.49Å; V1239-C1241 PolarHBondContact O-N 3.25Å; V1239-C1241 VanDerWaalsContact O-N 3.08Å
1240	R	81.1	Confident	64.3	Low	133 Å²	133	126.5 Å²	126.5	50%	0.502	70%	0.699	S	S	.	*			trans	-60.8	112.4	176.1	-173.9	179.3	66.2	-169.8	-8.8	110.8	G1117 V1118	G1117-R1240 PolarHBondContact O-NH1 2.78Å; G1117-R1240 PolarHBondContact O-NH2 3.2Å; V1118-R1240 VanDerWaalsContact CA-NH2 3.32Å; V1118-R1240 PolarHBondContact O-NH2 3.27Å
1241	C	85.4	Confident	64.9	Low	106 Å²	106	124.1 Å²	124.1	72%	0.716	70%	0.696	S	S	*	*			trans	-81.4	149.6	174.9	-58.6	0	0	0	0	111.9	V1239	V1239-C1241 PolarHBondContact O-N 3.25Å; V1239-C1241 VanDerWaalsContact O-N 3.08Å
1242	F	85.2	Confident	65.5	Low	126 Å²	126	127.2 Å²	127.2	55%	0.553	71%	0.71	S	S	*	*			trans	-105.2	141.2	170	-58.1	-72.8	0	0	0	109.4	V1118	V1118-F1242 HydrophobicContact CB-CZ 4.42Å; V1118-F1242 HydrophobicContact CG1-CZ 4.13Å; V1118-F1242 HydrophobicContact CG2-CE1 3.84Å; V1118-F1242 HydrophobicContact CG2-CZ 3.84Å
1243	Q	81.3	Confident	65.8	Low	170 Å²	170	124.3 Å²	124.3	79%	0.794	71%	0.713	S	S	*	*			trans	-70.3	134.3	175.6	-66.3	-64.1	-19.4	0	0	109.6
1244	P	83.8	Confident	67	Low	94 Å²	94	126.9 Å²	126.9	61%	0.61	71%	0.712	S	S	*	*			trans	-61.8	157.7	167.2	29.1	-33.8	0	0	0	109.4	I1246	P1244-I1246 PolarHBondContact O-N 3.02Å
1245	P	78.3	Confident	68.5	Low	136 Å²	136	128.8 Å²	128.8	88%	0.883	72%	0.72	S	S	*	*			trans	-55.5	112.2	175.7	22.6	-32	0	0	0	109.6
1246	I	77.8	Confident	69.9	Low	115 Å²	115	129.5 Å²	129.5	59%	0.59	72%	0.718	S	S	*	*			trans	-80.7	126.9	-178	-163	153	0	0	0	109.4	P1244 Q1248 L1250 A1251	P1244-I1246 PolarHBondContact O-N 3.02Å; I1246-Q1248 PolarHBondContact O-N 2.9Å; I1246-L1250 HydrophobicContact CG1-CB 4.46Å; I1246-A1251 HydrophobicContact CG2-CB 4.31Å
1247	H	73.9	Confident	71.3	Confident	132 Å²	132	128.6 Å²	128.6	61%	0.611	71%	0.709	S	S	*	*			trans	-65.3	132.5	177	-168.6	-94.5	0	0	0	109.2	S1249 L1250	H1247-S1249 VanDerWaalsContact ND1-CB 3.3Å; H1247-S1249 WeakPolarHBondContact ND1-CB 3.3Å; H1247-S1249 PolarHBondContact O-N 3.47Å; H1247-L1250 PolarHBondContact O-N 2.71Å
1248	Q	69.3	Low	72.1	Confident	162 Å²	162	125.9 Å²	125.9	76%	0.757	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-55.2	-23.7	-172.9	-72.9	107.1	-15.7	0	0	113.9	I1246 L1250 A1251	I1246-Q1248 PolarHBondContact O-N 2.9Å; Q1248-L1250 PolarHBondContact O-N 3.28Å; Q1248-A1251 PolarHBondContact O-N 3Å
1249	S	70.1	Confident	72.2	Confident	90 Å²	90	122.2 Å²	122.2	63%	0.629	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-63.2	-18.5	177	-173.5	0	0	0	0	115.5	H1247	H1247-S1249 VanDerWaalsContact ND1-CB 3.3Å; H1247-S1249 WeakPolarHBondContact ND1-CB 3.3Å; H1247-S1249 PolarHBondContact O-N 3.47Å
1250	L	64.6	Low	71.8	Confident	115 Å²	115	122.8 Å²	122.8	60%	0.602	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-111.7	-8.1	-176.9	-67.8	150.8	0	0	0	112.6	I1246 H1247 Q1248 S1253	I1246-L1250 HydrophobicContact CG1-CB 4.46Å; H1247-L1250 PolarHBondContact O-N 2.71Å; Q1248-L1250 PolarHBondContact O-N 3.28Å; L1250-S1253 PolarHBondContact O-OG 3.28Å
1251	A	56.3	Low	71.1	Confident	69 Å²	69	122 Å²	122	57%	0.57	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-2.3	-175.3	0	0	0	0	0	113.9	I1246 Q1248	I1246-A1251 HydrophobicContact CG2-CB 4.31Å; Q1248-A1251 PolarHBondContact O-N 3Å
1252	S	53.4	Low	69.9	Low	113 Å²	113	123.3 Å²	123.3	79%	0.79	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	12.3	-178.8	37.2	0	0	0	0	113.7
1253	S	44.3	Very low	68.5	Low	158 Å²	158	123.1 Å²	123.1	100%	1.105	72%	0.722	S	S	*	*			trans	-108.6	0	172	54.3	0	0	0	0	111.8	L1250	L1250-S1253 PolarHBondContact O-OG 3.28Å

Retrieved 1,253 of 1,253 residues in 440.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).