A0A096NT16_PAPAN Loading...

Cytoplasmic FMR1-interacting protein

AlphaFold DB (A0A2K6ARD5), UniProt , Accession A0A096NT16, Species PAPAN (Papio anubis, Olive baboon), Gene CYFIP1, Length 1,253 aa.

						>A0A096NT16_PAPAN|A0A096NT16|CYFIP1
MAAQVTLEDALSNVDLLEELPLPDQQPCIEPPPSSLLYQPNFNTNFEDRNAFVTGIARYIEQATVHSSMNEMLEEGQEYAVMLYTWRSCSRAIPQVKCNEQPNRVEIYEKTVEVLEPEVTKLMNFMYFQRNAIERFCGEVRRLCHAERRKDFVSEAYLITLGKFINMFAVLDELKNMKCSVKNDHSAYKRAAQFLRKMADPQSIQESQNLSMFLANHNKITQSLQQQLEVISGYEELLADIVNLCVDYYENRMYLTPSEKHMLLKVMGFGLYLMDGSVSNIYKLDAKKRINLSKIDKYFKQLQVVPLFGDMQIELARYIKTSAHYEENKSRWTCTSSGSSPQYNICEQMIQIREDHMRFISELARYSNSEVVTGSGRQEAQKTDAEYRKLFDLALQGLQLLSQWSAHVMEVYSWKLVHPTDKYSNKDCPDSAEEYERATRYNYTSEEKFALVEVIAMIKGLQVLMGRMESVFNHAIRHTVYAALQDFSQVTLREPLRQAIKKKKNVIQSVLQAIRKTVCDWETGHEPFNDPALRGEKDPKSGFDIKVPRRAVGPSSTQLYMVRTMLESLIADKSGSKKTLRSSLEGPTILDIEKFHRESFFYTHLINFSETLQQCCDLSQLWFREFFLELTMGRRIQFPIEMSMPWILTDHILETKEASMMEYVLYSLDLYNDSAHYALTRFNKQFLYDEIEAEVNLCFDQFVYKLADQIFAYYKVMAGSLLLDKRLRSECKNQGATIHLPPSNRYETLLKQRHVQLLGRSIDLNRLITQRVSAAVYKSLELAIGRFESEDLTSIVELDGLLEINRMTHKLLSRYLTLDSFDAMFREANHNVSAPYGRITLHVFWELNYDFLPNYCYNGSTNRFVRTVLPFSQEFQRDKQPNAQPQYLHGSKALNLAYSSIYGSYRNFVGPPHFQVICRLLGYQGIAVVMEELLKVVKSLLQGTILQYVKTLMEVMPKICRLPRHEYGSPGILEFFHHQLKDIVEYAELKTVCFQNLREVGNAVLFCLLIEQSLSLEEVCDLLHAAPFQNILPRVHVKEGERLDAKMKRLESKYAPLHLVPLIERLGTPQQIAIAREGDLLTKERLCCGLSMFEVILTRIRSFLDDPIWRGPLPSNGVMHVDECVEFHRLWSAMQFVYCIPVGTHEFTVEQCFGDGLHWAGCMIIVLLGQQRRFAVLDFCYHLLKVQKHDGKDEIIKNVPLKKMVERIRKFQILNDEIITILDKYLKSGDGEGTPVEHVRCFQPPIHQSLASS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.7	Very low	43.6	Very low	247 Å²	247	122.2 Å²	122.2	100%	1.217	70%	0.701	S	S	*	*				0	120.4	0	-82.5	-178.4	-105.1	0	0	107.1
2	A	33.3	Very low	43.7	Very low	108 Å²	108	117.8 Å²	117.8	89%	0.893	68%	0.683	S	S	*	*			trans	-74.9	126.5	-179.4	0	0	0	0	0	109.8
3	A	30.7	Very low	44	Very low	95 Å²	95	117.8 Å²	117.8	79%	0.785	68%	0.679	S	S	*	*			trans	-110.7	118.1	161.8	0	0	0	0	0	107	V5	A3-V5 PolarHBondContact O-N 3.21Å
4	Q	41.2	Very low	44.2	Very low	189 Å²	189	116.2 Å²	116.2	88%	0.883	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-66.5	125.6	176.6	-75.7	169.8	-38.9	0	0	109.3
5	V	41.5	Very low	44.1	Very low	122 Å²	122	116.9 Å²	116.9	74%	0.739	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-72.8	129.7	163.1	178.3	0	0	0	0	107.2	A3 D9	A3-V5 PolarHBondContact O-N 3.21Å; V5-D9 HydrophobicContact CG1-CB 4.23Å
6	T	59	Low	43.9	Very low	68 Å²	68	118.6 Å²	118.6	42%	0.417	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-80.3	155.4	-177.6	65.5	0	0	0	0	111.6	E8 D9 A10	T6-E8 VanDerWaalsContact C-N 3.27Å; T6-E8 PolarHBondContact O-N 2.98Å; T6-D9 PolarHBondContact O-N 3.23Å; T6-D9 PolarHBondContact OG1-OD2 3.29Å; T6-A10 PolarHBondContact O-N 3.31Å
7	L	51.8	Low	43.7	Very low	129 Å²	129	120.5 Å²	120.5	68%	0.675	68%	0.684	S	S	*	*	H	α-helix	trans	-65.5	-31.4	-179.3	-176.3	60.5	0	0	0	111.2	D9 A10 L11	L7-D9 VanDerWaalsContact C-N 3.35Å; L7-D9 PolarHBondContact O-N 3.26Å; L7-A10 PolarHBondContact O-N 3.27Å; L7-L11 HydrophobicContact CD1-CD1 4.02Å; L7-L11 HydrophobicContact CG-CD1 3.87Å; L7-L11 VanDerWaalsContact O-CD1 3.25Å; L7-L11 WeakPolarHBondContact O-CD1 3Å; L7-L11 PolarHBondContact O-N 3.03Å
8	E	46.4	Very low	43.5	Very low	142 Å²	142	123.6 Å²	123.6	66%	0.664	69%	0.692	S	S	*	*	H	α-helix	trans	-64.3	-32.7	174.3	-71	86.4	-175.8	0	0	113.9	T6 S12	T6-E8 VanDerWaalsContact C-N 3.27Å; T6-E8 PolarHBondContact O-N 2.98Å; E8-S12 PolarHBondContact O-N 3.09Å; E8-S12 PolarHBondContact O-OG 3.33Å
9	D	44.2	Very low	43.4	Very low	94 Å²	94	127.1 Å²	127.1	50%	0.503	70%	0.702	S	S	.	*	H	α-helix	trans	-75.4	-25.2	174.5	-74.9	-40.3	0	0	0	112.8	V5 T6 L7 N13	V5-D9 HydrophobicContact CG1-CB 4.23Å; T6-D9 PolarHBondContact O-N 3.23Å; T6-D9 PolarHBondContact OG1-OD2 3.29Å; L7-D9 VanDerWaalsContact C-N 3.35Å; L7-D9 PolarHBondContact O-N 3.26Å; D9-N13 PolarHBondContact O-ND2 3.11Å
10	A	55.4	Low	42.8	Very low	49 Å²	49	128.3 Å²	128.3	41%	0.405	71%	0.706	S	S	.	*	H	α-helix	trans	-75.9	-33.9	175.5	0	0	0	0	0	112.1	T6 L7	T6-A10 PolarHBondContact O-N 3.31Å; L7-A10 PolarHBondContact O-N 3.27Å
11	L	47	Very low	42.7	Very low	101 Å²	101	127.8 Å²	127.8	53%	0.529	71%	0.709	S	S	.	*	H	α-helix	trans	-74.9	-35.5	176.8	-86.4	116.2	0	0	0	112.9	L7 N13 V14	L7-L11 HydrophobicContact CD1-CD1 4.02Å; L7-L11 HydrophobicContact CG-CD1 3.87Å; L7-L11 VanDerWaalsContact O-CD1 3.25Å; L7-L11 WeakPolarHBondContact O-CD1 3Å; L7-L11 PolarHBondContact O-N 3.03Å; L11-N13 PolarHBondContact O-N 3.05Å; L11-V14 PolarHBondContact O-N 3.16Å
12	S	44.3	Very low	42.9	Very low	70 Å²	70	121.6 Å²	121.6	49%	0.49	68%	0.68	S	S	.	*	H	α-helix	trans	-64.9	-21.6	176.8	-61.1	0	0	0	0	113.6	E8	E8-S12 PolarHBondContact O-N 3.09Å; E8-S12 PolarHBondContact O-OG 3.33Å
13	N	47.3	Very low	43	Very low	117 Å²	117	122 Å²	122	63%	0.626	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-14.6	175	-73.9	-34.7	0	0	0	113.6	D9 L11	D9-N13 PolarHBondContact O-ND2 3.11Å; L11-N13 PolarHBondContact O-N 3.05Å
14	V	47.7	Very low	43.2	Very low	96 Å²	96	125.5 Å²	125.5	58%	0.582	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-31.5	177.7	178.5	0	0	0	0	110.9	L11 L16 L17	L11-V14 PolarHBondContact O-N 3.16Å; V14-L16 VanDerWaalsContact C-N 3.28Å; V14-L16 PolarHBondContact O-N 3.13Å; V14-L17 PolarHBondContact O-N 3.22Å
15	D	42.6	Very low	43.1	Very low	127 Å²	127	123.2 Å²	123.2	68%	0.679	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-76.2	-10.9	178.9	-66.5	-20.5	0	0	0	113.7	L17	D15-L17 VanDerWaalsContact C-N 3.34Å
16	L	40.2	Very low	43	Very low	143 Å²	143	120.5 Å²	120.5	75%	0.749	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-87	3.5	174.3	-100.3	89.8	0	0	0	114.3	V14	V14-L16 VanDerWaalsContact C-N 3.28Å; V14-L16 PolarHBondContact O-N 3.13Å
17	L	41.1	Very low	42.2	Very low	152 Å²	152	119.2 Å²	119.2	80%	0.796	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-101.1	-2	-177.8	-71	172	0	0	0	114.7	V14 D15	V14-L17 PolarHBondContact O-N 3.22Å; D15-L17 VanDerWaalsContact C-N 3.34Å
18	E	39.2	Very low	41.9	Very low	175 Å²	175	115.9 Å²	115.9	82%	0.818	63%	0.628	S	S	*	*	S	Bend	trans	-97.7	-8.9	-170.6	-150.6	167.3	-169.6	0	0	115.8
19	E	42.5	Very low	42.2	Very low	190 Å²	190	109.7 Å²	109.7	89%	0.888	60%	0.599	S	S	*	*			trans	-141.4	89.2	176.3	-72.2	-172.4	166.9	0	0	113.2
20	L	31.8	Very low	42.2	Very low	151 Å²	151	106.2 Å²	106.2	79%	0.791	58%	0.58	S	S	*	*			trans	-140.2	124.6	157.7	-101.3	162	0	0	0	109	L22	L20-L22 PolarHBondContact O-N 3.46Å
21	P	40.1	Very low	42	Very low	119 Å²	119	104.6 Å²	104.6	77%	0.773	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-66.2	127.4	175.7	28.2	-31.8	0	0	0	109
22	L	33.3	Very low	42	Very low	116 Å²	116	102.5 Å²	102.5	61%	0.607	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-72.6	124.9	174.7	-66.1	164.4	0	0	0	108.9	L20 Q25	L20-L22 PolarHBondContact O-N 3.46Å; L22-Q25 HydrophobicContact CB-CG 4.3Å; L22-Q25 HydrophobicContact CD1-CG 4.18Å; L22-Q25 HydrophobicContact CD2-CG 4.26Å; L22-Q25 HydrophobicContact CG-CG 4.48Å
23	P	36.1	Very low	41.9	Very low	116 Å²	116	102.5 Å²	102.5	75%	0.753	56%	0.556	S	S	*	*	S	Bend	trans	-62.5	136.8	155.9	27.5	-29.1	0	0	0	107.5	Q25	P23-Q25 PolarHBondContact O-N 2.99Å; P23-Q25 VanDerWaalsContact O-N 3.07Å
24	D	34.6	Very low	41.7	Very low	169 Å²	169	101 Å²	101	90%	0.904	56%	0.555	S	S	*	*			trans	-24.1	106.2	-174.7	-91.4	-38.1	0	0	0	114	Q26	D24-Q26 VanDerWaalsContact C-N 3.31Å; D24-Q26 PolarHBondContact O-N 3.33Å
25	Q	38.6	Very low	41	Very low	142 Å²	142	100.2 Å²	100.2	66%	0.664	55%	0.553	S	S	*	*			trans	-77.5	81.7	174.6	-76.5	-170.8	-9	0	0	110.1	L22 P23	L22-Q25 HydrophobicContact CB-CG 4.3Å; L22-Q25 HydrophobicContact CD1-CG 4.18Å; L22-Q25 HydrophobicContact CD2-CG 4.26Å; L22-Q25 HydrophobicContact CG-CG 4.48Å; P23-Q25 PolarHBondContact O-N 2.99Å; P23-Q25 VanDerWaalsContact O-N 3.07Å
26	Q	39.4	Very low	40.5	Very low	64 Å²	64	103 Å²	103	30%	0.299	57%	0.567	S	S	.	*			trans	-73.5	124.9	150.6	-167.2	172.2	-1.2	0	0	107.8	D24 C28 H754	D24-Q26 VanDerWaalsContact C-N 3.31Å; D24-Q26 PolarHBondContact O-N 3.33Å; Q26-C28 PolarHBondContact O-N 3.14Å; Q26-H754 PolarHBondContact NE2-CE1 3.28Å; Q26-H754 PolarHBondContact OE1-CE1 3.06Å; Q26-H754 PolarHBondContact OE1-NE2 2.78Å
27	P	42.1	Very low	40.2	Very low	42 Å²	42	101 Å²	101	27%	0.273	56%	0.557	S	S	.	*			trans	-60.4	124.7	169.2	15.9	-16.5	0	0	0	107.8	I29 T748 K751	P27-I29 HydrophobicContact CB-CG2 4.39Å; P27-I29 PolarHBondContact O-N 3.49Å; P27-T748 HydrophobicContact CB-CG2 4.36Å; P27-T748 HydrophobicContact CG-CG2 4.07Å; P27-K751 HydrophobicContact CG-CD 4.49Å
28	C	47.1	Very low	39.7	Very low	59 Å²	59	104.2 Å²	104.2	40%	0.399	56%	0.56	S	S	.	*			trans	-73.5	72.5	179.5	-161.6	0	0	0	0	109.3	Q26 E30 R467 Y666	Q26-C28 PolarHBondContact O-N 3.14Å; C28-E30 VanDerWaalsContact C-N 3.26Å; C28-E30 PolarHBondContact SG-O 3.48Å; C28-R467 PolarHBondContact SG-NH2 3.21Å; C28-Y666 PolarHBondContact O-OH 3.09Å; C28-Y666 VanDerWaalsContact O-OH 3.07Å
29	I	52.3	Low	39.9	Very low	12 Å²	12	99.6 Å²	99.6	6%	0.062	54%	0.538	C	S	.	.			trans	-93.9	10.9	169.6	63.3	163.4	0	0	0	111.4	P27 L665 Y666 L749 Q752	P27-I29 HydrophobicContact CB-CG2 4.39Å; P27-I29 PolarHBondContact O-N 3.49Å; I29-L665 HydrophobicContact CD1-CD1 3.7Å; I29-L665 HydrophobicContact CG1-CD1 4.24Å; I29-Y666 VanDerWaalsContact C-CZ 3.43Å; I29-Y666 VanDerWaalsContact CA-OH 3.32Å; I29-Y666 WeakPolarHBondContact CA-OH 3.36Å; I29-Y666 HydrophobicContact CB-CE2 4.41Å; I29-Y666 WeakPolarHBondContact O-CE2 3.38Å; I29-Y666 VanDerWaalsContact O-CZ 3.31Å; I29-L749 HydrophobicContact CD1-CD2 4.13Å; I29-Q752 HydrophobicContact CD1-CG 3.97Å; I29-Q752 VanDerWaalsContact CD1-NE2 3.29Å; I29-Q752 HydrophobicContact CG1-CG 4.47Å; I29-Q752 VanDerWaalsContact CG1-NE2 3.29Å
30	E	43.6	Very low	39.7	Very low	21 Å²	21	94.2 Å²	94.2	10%	0.098	52%	0.52	C	S	.	.	S	Bend	trans	-120.2	140.7	-178.8	-64.8	-174.1	171.4	0	0	110.2	C28 V463 L665 Q752 V755	C28-E30 VanDerWaalsContact C-N 3.26Å; C28-E30 PolarHBondContact SG-O 3.48Å; E30-V463 WeakPolarHBondContact O-CG2 3.38Å; E30-L665 HydrophobicContact CG-CD1 4.38Å; E30-Q752 PolarHBondContact OE1-OE1 2.64Å; E30-V755 VanDerWaalsContact OE1-CA 3.24Å; E30-V755 WeakPolarHBondContact OE1-CA 3.22Å; E30-V755 VanDerWaalsContact OE1-CG2 3.32Å; E30-V755 WeakPolarHBondContact OE1-CG2 3.37Å
31	P	51.4	Low	40.5	Very low	15 Å²	15	92.9 Å²	92.9	10%	0.097	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-67.4	165.7	167.4	21.9	-22.1	0	0	0	111.6	K459 D669	P31-K459 HydrophobicContact CB-CB 4.18Å; P31-K459 HydrophobicContact CB-CD 4.41Å; P31-K459 HydrophobicContact CB-CG 4.47Å; P31-K459 HydrophobicContact CG-CD 4.26Å; P31-D669 HydrophobicContact CG-CB 3.67Å; P31-D669 VanDerWaalsContact CG-OD1 3.32Å; P31-D669 WeakPolarHBondContact CG-OD1 3.46Å; P31-D669 WeakPolarHBondContact CG-OD2 3.41Å
32	P	46.6	Very low	41.1	Very low	57 Å²	57	93.1 Å²	93.1	37%	0.37	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-70.4	142.3	-175.9	29.3	-26.4	0	0	0	110.1	S34 V463	P32-S34 PolarHBondContact O-N 3.41Å; P32-V463 VanDerWaalsContact CD-CG2 3.44Å; P32-V463 HydrophobicContact CG-CG2 4.26Å
33	P	42.4	Very low	42.5	Very low	70 Å²	70	91.1 Å²	91.1	46%	0.455	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-59.1	125.4	175	19.6	-28.3	0	0	0	110.1	S35 Q756	P33-S35 PolarHBondContact O-N 3.42Å; P33-S35 PolarHBondContact O-OG 2.69Å; P33-Q756 HydrophobicContact CB-CB 4.44Å; P33-Q756 HydrophobicContact CB-CG 3.98Å
34	S	42.5	Very low	43.8	Very low	85 Å²	85	87.9 Å²	87.9	59%	0.594	47%	0.471	S	S	*	.			trans	-66.6	69.4	167.8	-53.7	0	0	0	0	109.9	P32	P32-S34 PolarHBondContact O-N 3.41Å
35	S	32.7	Very low	45.6	Very low	79 Å²	79	81.9 Å²	81.9	55%	0.552	44%	0.439	S	S	*	.			trans	-67.9	152.4	168.8	-45.9	0	0	0	0	108.1	P33 L37	P33-S35 PolarHBondContact O-N 3.42Å; P33-S35 PolarHBondContact O-OG 2.69Å; S35-L37 VanDerWaalsContact C-N 3.29Å; S35-L37 PolarHBondContact O-N 3.27Å
36	L	31.8	Very low	47.3	Very low	185 Å²	185	76 Å²	76	97%	0.969	41%	0.411	S	S	*	.			trans	-54.7	93.2	167.6	-82.4	154.3	0	0	0	109.5	Y38	L36-Y38 PolarHBondContact O-N 2.6Å
37	L	34.1	Very low	48.6	Very low	102 Å²	102	80.4 Å²	80.4	53%	0.534	43%	0.431	S	S	.	.			trans	-78.7	106.2	176.3	-80.9	159.1	0	0	0	107.5	S35 Q39	S35-L37 VanDerWaalsContact C-N 3.29Å; S35-L37 PolarHBondContact O-N 3.27Å; L37-Q39 HydrophobicContact CB-CG 4.42Å; L37-Q39 PolarHBondContact O-N 2.88Å; L37-Q39 VanDerWaalsContact O-N 3.13Å
38	Y	30.9	Very low	50	Low	220 Å²	220	80.7 Å²	80.7	86%	0.863	43%	0.431	S	S	*	.			trans	-74.6	98.8	166.7	-172.4	-94.9	0	0	0	108.2	L36	L36-Y38 PolarHBondContact O-N 2.6Å
39	Q	43.1	Very low	51	Low	77 Å²	77	80.1 Å²	80.1	36%	0.36	42%	0.42	S	S	.	.			trans	-98.1	121.5	178.4	-79.5	178.2	-7.3	0	0	110.6	L37 N41 S609	L37-Q39 HydrophobicContact CB-CG 4.42Å; L37-Q39 PolarHBondContact O-N 2.88Å; L37-Q39 VanDerWaalsContact O-N 3.13Å; Q39-N41 PolarHBondContact O-N 3.38Å; Q39-S609 VanDerWaalsContact NE2-CB 3.27Å; Q39-S609 PolarHBondContact NE2-OG 3.28Å
40	P	38	Very low	51.7	Low	78 Å²	78	85 Å²	85	51%	0.506	45%	0.447	S	S	.	.			trans	-69.8	112.9	168.3	26.6	-29.9	0	0	0	109.6	F42	P40-F42 HydrophobicContact CB-CE1 4.41Å; P40-F42 HydrophobicContact CB-CE2 3.86Å; P40-F42 HydrophobicContact CB-CZ 3.78Å; P40-F42 HydrophobicContact CG-CE2 3.68Å; P40-F42 HydrophobicContact CG-CZ 3.85Å; P40-F42 WeakPolarHBondContact O-CD2 3.49Å; P40-F42 PolarHBondContact O-N 2.88Å
41	N	48.8	Very low	52.5	Low	123 Å²	123	88 Å²	88	66%	0.658	47%	0.474	S	S	*	.			trans	-78.5	110.1	171.8	-177.2	3.5	0	0	0	109.6	Q39 N43	Q39-N41 PolarHBondContact O-N 3.38Å; N41-N43 VanDerWaalsContact OD1-CB 3.3Å; N41-N43 WeakPolarHBondContact OD1-CB 3.35Å; N41-N43 PolarHBondContact OD1-N 3.45Å
42	F	53.7	Low	53	Low	124 Å²	124	89 Å²	89	54%	0.544	48%	0.477	S	S	.	.			trans	-90.4	-0.5	176.9	-62.7	-74.9	0	0	0	113.4	P40 T44	P40-F42 HydrophobicContact CB-CE1 4.41Å; P40-F42 HydrophobicContact CB-CE2 3.86Å; P40-F42 HydrophobicContact CB-CZ 3.78Å; P40-F42 HydrophobicContact CG-CE2 3.68Å; P40-F42 HydrophobicContact CG-CZ 3.85Å; P40-F42 WeakPolarHBondContact O-CD2 3.49Å; P40-F42 PolarHBondContact O-N 2.88Å; F42-T44 PolarHBondContact O-N 3.08Å
43	N	61.9	Low	53.3	Low	74 Å²	74	91.6 Å²	91.6	40%	0.396	49%	0.492	S	S	.	.			trans	-83	99.2	176.3	-172.4	6.4	0	0	0	110.5	N41 N45	N41-N43 VanDerWaalsContact OD1-CB 3.3Å; N41-N43 WeakPolarHBondContact OD1-CB 3.35Å; N41-N43 PolarHBondContact OD1-N 3.45Å; N43-N45 PolarHBondContact O-N 3.03Å; N43-N45 PolarHBondContact OD1-N 3.27Å
44	T	63.3	Low	53.8	Low	48 Å²	48	92.8 Å²	92.8	29%	0.294	50%	0.498	S	S	.	.			trans	-77.2	6.3	-179.5	57.8	0	0	0	0	114.6	F42 F46 E47 D48 S556	F42-T44 PolarHBondContact O-N 3.08Å; T44-F46 PolarHBondContact O-N 2.87Å; T44-E47 WeakPolarHBondContact O-CB 3.11Å; T44-E47 WeakPolarHBondContact O-CG 3.49Å; T44-E47 PolarHBondContact O-N 3.41Å; T44-D48 PolarHBondContact OG1-OD1 3.38Å; T44-S556 PolarHBondContact OG1-OG 3.47Å
45	N	73.1	Confident	54.2	Low	42 Å²	42	89.2 Å²	89.2	23%	0.225	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	44.8	35.7	-171.9	-168.2	30.8	0	0	0	113.7	N43 E47 S67	N43-N45 PolarHBondContact O-N 3.03Å; N43-N45 PolarHBondContact OD1-N 3.27Å; N45-E47 PolarHBondContact O-N 3.2Å; N45-S67 PolarHBondContact ND2-OG 2.66Å; N45-S67 PolarHBondContact O-OG 2.98Å; N45-S67 VanDerWaalsContact O-OG 3.05Å
46	F	74.1	Confident	55.6	Low	20 Å²	20	88.5 Å²	88.5	9%	0.088	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	23	-178.1	-37.2	-61.3	0	0	0	116.7	T44 D48 R49 T557 Y560	T44-F46 PolarHBondContact O-N 2.87Å; F46-D48 VanDerWaalsContact C-N 3.26Å; F46-D48 PolarHBondContact O-N 3.4Å; F46-R49 HydrophobicContact CB-CB 4.45Å; F46-R49 WeakPolarHBondContact O-CB 3.18Å; F46-R49 WeakPolarHBondContact O-CD 3.47Å; F46-R49 WeakPolarHBondContact O-CG 3.46Å; F46-R49 PolarHBondContact O-N 2.89Å; F46-R49 VanDerWaalsContact O-N 3.15Å; F46-T557 VanDerWaalsContact CA-CG2 3.47Å; F46-T557 HydrophobicContact CB-CG2 3.91Å; F46-T557 HydrophobicContact CD1-CG2 3.91Å; F46-T557 HydrophobicContact CG-CG2 4.43Å; F46-Y560 HydrophobicContact CD1-CD1 4.34Å; F46-Y560 HydrophobicContact CD1-CG 4.28Å; F46-Y560 AromaticContact CE1-CD1 3.93Å; F46-Y560 HydrophobicContact CE1-CD1 3.93Å; F46-Y560 AromaticContact CE1-CD2 3.95Å; F46-Y560 HydrophobicContact CE1-CD2 3.95Å; F46-Y560 AromaticContact CE1-CG 3.46Å; F46-Y560 HydrophobicContact CE1-CG 3.46Å; F46-Y560 VanDerWaalsContact CE1-CG 3.46Å; F46-Y560 HydrophobicContact CE2-CD2 4.49Å; F46-Y560 HydrophobicContact CZ-CD1 4.11Å; F46-Y560 AromaticContact CZ-CD2 3.61Å; F46-Y560 HydrophobicContact CZ-CD2 3.61Å; F46-Y560 HydrophobicContact CZ-CE2 4.14Å; F46-Y560 AromaticContact CZ-CG 3.6Å; F46-Y560 HydrophobicContact CZ-CG 3.6Å
47	E	67.5	Low	57.1	Low	155 Å²	155	83.3 Å²	83.3	72%	0.724	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-56.7	-37	176.5	-78.5	173.9	-174.4	0	0	113.2	T44 N45 R49	T44-E47 WeakPolarHBondContact O-CB 3.11Å; T44-E47 WeakPolarHBondContact O-CG 3.49Å; T44-E47 PolarHBondContact O-N 3.41Å; N45-E47 PolarHBondContact O-N 3.2Å; E47-R49 VanDerWaalsContact C-N 3.26Å; E47-R49 PolarHBondContact O-N 2.96Å
48	D	70.3	Confident	59	Low	49 Å²	49	82.6 Å²	82.6	26%	0.262	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-81.8	6.1	-179.3	59.8	-51.6	0	0	0	114.1	T44 F46 N50 A51 F52 T557	T44-D48 PolarHBondContact OG1-OD1 3.38Å; F46-D48 VanDerWaalsContact C-N 3.26Å; F46-D48 PolarHBondContact O-N 3.4Å; D48-N50 PolarHBondContact O-N 3.42Å; D48-A51 WeakPolarHBondContact O-CB 3.48Å; D48-A51 PolarHBondContact O-N 3.1Å; D48-F52 WeakPolarHBondContact OD2-CE2 3.49Å; D48-T557 VanDerWaalsContact CG-CG2 3.49Å; D48-T557 WeakPolarHBondContact OD1-CG2 3.19Å; D48-T557 PolarHBondContact OD1-OG1 3Å; D48-T557 PolarHBondContact OD2-OG1 3.34Å
49	R	68.4	Low	61.2	Low	47 Å²	47	73 Å²	73	18%	0.177	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-54	-31.7	-178.5	64.2	-168.9	161	-136.1	-1.3	114.3	F46 E47 A51 F52 I60 T64 S67	F46-R49 HydrophobicContact CB-CB 4.45Å; F46-R49 WeakPolarHBondContact O-CB 3.18Å; F46-R49 WeakPolarHBondContact O-CD 3.47Å; F46-R49 WeakPolarHBondContact O-CG 3.46Å; F46-R49 PolarHBondContact O-N 2.89Å; F46-R49 VanDerWaalsContact O-N 3.15Å; E47-R49 VanDerWaalsContact C-N 3.26Å; E47-R49 PolarHBondContact O-N 2.96Å; R49-A51 PolarHBondContact O-N 3.12Å; R49-F52 PolarHBondContact O-N 3.28Å; R49-I60 HydrophobicContact CB-CG2 4.34Å; R49-I60 HydrophobicContact CG-CG2 4.21Å; R49-T64 WeakPolarHBondContact CD-OG1 3.44Å; R49-T64 PolarHBondContact NE-OG1 3.26Å; R49-T64 VanDerWaalsContact NE-OG1 3.14Å; R49-S67 VanDerWaalsContact NH1-CB 3.31Å; R49-S67 PolarHBondContact NH1-OG 3.06Å
50	N	68.1	Low	62.7	Low	115 Å²	115	70.4 Å²	70.4	62%	0.615	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-71.3	-12.5	-179.8	-69.3	-24	0	0	0	113.2	D48 F52 V53	D48-N50 PolarHBondContact O-N 3.42Å; N50-F52 VanDerWaalsContact C-N 3.3Å; N50-V53 WeakPolarHBondContact O-CG2 3.45Å
51	A	59.3	Low	64.6	Low	82 Å²	82	72.4 Å²	72.4	68%	0.678	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-76.1	-18.9	173.9	0	0	0	0	0	112.7	D48 R49 V53	D48-A51 WeakPolarHBondContact O-CB 3.48Å; D48-A51 PolarHBondContact O-N 3.1Å; R49-A51 PolarHBondContact O-N 3.12Å; A51-V53 PolarHBondContact O-N 3.07Å
52	F	62.8	Low	66	Low	36 Å²	36	67.2 Å²	67.2	16%	0.158	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-100.6	38.7	-175	-55.2	-79.1	0	0	0	113.1	D48 R49 N50 T54 G55 T517 T557 Q558	D48-F52 WeakPolarHBondContact OD2-CE2 3.49Å; R49-F52 PolarHBondContact O-N 3.28Å; N50-F52 VanDerWaalsContact C-N 3.3Å; F52-T54 PolarHBondContact O-N 3.11Å; F52-G55 PolarHBondContact O-N 3.3Å; F52-T517 HydrophobicContact CD1-CG2 3.88Å; F52-T517 HydrophobicContact CE1-CG2 4.27Å; F52-T517 HydrophobicContact CG-CG2 4.43Å; F52-T557 WeakPolarHBondContact CE2-OG1 3.24Å; F52-Q558 HydrophobicContact CE1-CG 3.87Å; F52-Q558 HydrophobicContact CZ-CG 3.75Å
53	V	53	Low	67.2	Low	113 Å²	113	61.4 Å²	61.4	69%	0.685	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-13.3	-174	-168.2	0	0	0	0	114.7	N50 A51 G55	N50-V53 WeakPolarHBondContact O-CG2 3.45Å; A51-V53 PolarHBondContact O-N 3.07Å; V53-G55 VanDerWaalsContact C-N 3.33Å; V53-G55 PolarHBondContact O-N 3.39Å
54	T	51.9	Low	68.2	Low	95 Å²	95	59.9 Å²	59.9	58%	0.583	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-6.2	-178.5	58.8	0	0	0	0	114.5	F52	F52-T54 PolarHBondContact O-N 3.11Å
55	G	51.1	Low	69.3	Low	9 Å²	9	59 Å²	59	9%	0.093	33%	0.325	C	S	.	.	S	Bend	trans	-83.5	155.6	173.4	0	0	0	0	0	113.6	F52 V53 A57	F52-G55 PolarHBondContact O-N 3.3Å; V53-G55 VanDerWaalsContact C-N 3.33Å; V53-G55 PolarHBondContact O-N 3.39Å; G55-A57 PolarHBondContact O-N 3.09Å
56	I	61.7	Low	69.9	Low	64 Å²	64	57.3 Å²	57.3	33%	0.328	32%	0.316	S	S	.	.			trans	-54.1	115.1	174.9	-61	163.3	0	0	0	108.5	R58 Y59 V510	I56-R58 HydrophobicContact CG2-CB 3.97Å; I56-R58 PolarHBondContact O-N 3.18Å; I56-Y59 HydrophobicContact CB-CD2 3.97Å; I56-Y59 HydrophobicContact CB-CE2 4.04Å; I56-Y59 HydrophobicContact CD1-CE2 4.06Å; I56-Y59 HydrophobicContact CG2-CE2 4.49Å; I56-Y59 PolarHBondContact O-N 3.26Å; I56-V510 HydrophobicContact CD1-CG2 3.81Å
57	A	63.2	Low	70.4	Confident	76 Å²	76	56.6 Å²	56.6	63%	0.628	31%	0.314	S	S	*	.	H	α-helix	trans	-47.7	-26.8	-172.7	0	0	0	0	0	114.7	G55 Y59 I60 E61	G55-A57 PolarHBondContact O-N 3.09Å; A57-Y59 VanDerWaalsContact C-N 3.34Å; A57-Y59 PolarHBondContact O-N 3.27Å; A57-I60 PolarHBondContact O-N 2.97Å; A57-E61 PolarHBondContact O-N 3.35Å; A57-E61 VanDerWaalsContact O-N 3.1Å
58	R	74.1	Confident	71.4	Confident	88 Å²	88	50.7 Å²	50.7	33%	0.332	29%	0.289	S	S	.	.	H	α-helix	trans	-52.8	-41.5	174	179.9	-178.4	166.4	157.4	-0	114.2	I56 Q62 D151 F152	I56-R58 HydrophobicContact CG2-CB 3.97Å; I56-R58 PolarHBondContact O-N 3.18Å; R58-Q62 WeakPolarHBondContact O-CB 3.2Å; R58-Q62 PolarHBondContact O-N 3.08Å; R58-Q62 VanDerWaalsContact O-N 3.1Å; R58-D151 IonicContact CZ-OD2 3.1Å; R58-D151 IonicContact NH1-OD1 2.74Å; R58-D151 IonicContact NH1-OD2 3.78Å; R58-D151 IonicContact NH2-OD2 2.73Å; R58-F152 PolarHBondContact NH2-O 2.75Å
59	Y	77.9	Confident	72.3	Confident	17 Å²	17	48.4 Å²	48.4	7%	0.067	28%	0.277	C	S	.	.	H	α-helix	trans	-76.9	-31.8	-176.4	-62.2	-72.3	0	0	0	112.2	I56 A57 Q62 A63 F152 T564 M565 S568	I56-Y59 HydrophobicContact CB-CD2 3.97Å; I56-Y59 HydrophobicContact CB-CE2 4.04Å; I56-Y59 HydrophobicContact CD1-CE2 4.06Å; I56-Y59 HydrophobicContact CG2-CE2 4.49Å; I56-Y59 PolarHBondContact O-N 3.26Å; A57-Y59 VanDerWaalsContact C-N 3.34Å; A57-Y59 PolarHBondContact O-N 3.27Å; Y59-Q62 PolarHBondContact O-N 3.32Å; Y59-A63 WeakPolarHBondContact O-CB 3.25Å; Y59-A63 PolarHBondContact O-N 2.67Å; Y59-F152 HydrophobicContact CE1-CE1 4.48Å; Y59-T564 HydrophobicContact CD1-CG2 3.78Å; Y59-T564 HydrophobicContact CE1-CG2 4.15Å; Y59-M565 HydrophobicContact CD2-CG 4.02Å; Y59-M565 HydrophobicContact CE2-CG 3.96Å; Y59-M565 HydrophobicContact CG-CG 4.37Å; Y59-S568 WeakPolarHBondContact OH-CB 3.38Å; Y59-S568 PolarHBondContact OH-OG 2.95Å
60	I	75.3	Confident	73.2	Confident	23 Å²	23	48 Å²	48	12%	0.118	28%	0.279	C	S	.	.	H	α-helix	trans	-68.2	-42.9	175.5	-58.7	175.2	0	0	0	110.1	R49 A57 Q62 A63 T64 M561	R49-I60 HydrophobicContact CB-CG2 4.34Å; R49-I60 HydrophobicContact CG-CG2 4.21Å; A57-I60 PolarHBondContact O-N 2.97Å; I60-Q62 VanDerWaalsContact C-N 3.35Å; I60-A63 PolarHBondContact O-N 3.35Å; I60-T64 PolarHBondContact O-N 3.47Å; I60-T64 PolarHBondContact O-OG1 3.37Å; I60-M561 HydrophobicContact CG1-CE 4.03Å
61	E	77.2	Confident	74.3	Confident	121 Å²	121	47.7 Å²	47.7	57%	0.565	27%	0.273	S	S	*	.	H	α-helix	trans	-61.7	-43.8	173.8	-174.8	60.8	-158.1	0	0	111.2	A57 A63 T64 V65	A57-E61 PolarHBondContact O-N 3.35Å; A57-E61 VanDerWaalsContact O-N 3.1Å; E61-A63 PolarHBondContact O-N 2.91Å; E61-T64 WeakPolarHBondContact O-CB 3.18Å; E61-T64 PolarHBondContact O-N 3.28Å; E61-T64 VanDerWaalsContact O-N 3.13Å; E61-V65 WeakPolarHBondContact O-CG2 3.38Å; E61-V65 PolarHBondContact O-N 2.91Å
62	Q	78.1	Confident	76	Confident	14 Å²	14	44.2 Å²	44.2	7%	0.065	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-39.8	176.7	-169.4	179.4	-19.2	0	0	112.2	R58 Y59 I60 T64 V65 H66	R58-Q62 WeakPolarHBondContact O-CB 3.2Å; R58-Q62 PolarHBondContact O-N 3.08Å; R58-Q62 VanDerWaalsContact O-N 3.1Å; Y59-Q62 PolarHBondContact O-N 3.32Å; I60-Q62 VanDerWaalsContact C-N 3.35Å; Q62-T64 VanDerWaalsContact C-N 3.28Å; Q62-T64 PolarHBondContact O-N 2.96Å; Q62-V65 PolarHBondContact O-N 2.96Å; Q62-H66 VanDerWaalsContact O-CB 3.26Å; Q62-H66 WeakPolarHBondContact O-CB 3.32Å; Q62-H66 PolarHBondContact O-N 3.29Å
63	A	79.8	Confident	77.5	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-35.4	173.3	0	0	0	0	0	112	Y59 I60 E61 H66 S67 Y560	Y59-A63 WeakPolarHBondContact O-CB 3.25Å; Y59-A63 PolarHBondContact O-N 2.67Å; I60-A63 PolarHBondContact O-N 3.35Å; E61-A63 PolarHBondContact O-N 2.91Å; A63-H66 PolarHBondContact O-N 2.82Å; A63-S67 WeakPolarHBondContact O-CB 3.45Å; A63-S67 PolarHBondContact O-N 3.5Å; A63-Y560 HydrophobicContact CB-CD1 4.29Å; A63-Y560 HydrophobicContact CB-CE1 3.73Å
64	T	83.1	Confident	79.3	Confident	43 Å²	43	44.4 Å²	44.4	26%	0.264	24%	0.238	S	C	.	.	H	α-helix	trans	-65.9	-48.3	177.2	-56.9	0	0	0	0	111.8	R49 I60 E61 Q62 H66 S67 S68	R49-T64 WeakPolarHBondContact CD-OG1 3.44Å; R49-T64 PolarHBondContact NE-OG1 3.26Å; R49-T64 VanDerWaalsContact NE-OG1 3.14Å; I60-T64 PolarHBondContact O-N 3.47Å; I60-T64 PolarHBondContact O-OG1 3.37Å; E61-T64 WeakPolarHBondContact O-CB 3.18Å; E61-T64 PolarHBondContact O-N 3.28Å; E61-T64 VanDerWaalsContact O-N 3.13Å; Q62-T64 VanDerWaalsContact C-N 3.28Å; Q62-T64 PolarHBondContact O-N 2.96Å; T64-H66 VanDerWaalsContact C-N 3.31Å; T64-H66 PolarHBondContact O-N 3.44Å; T64-S67 PolarHBondContact O-N 3.32Å; T64-S68 PolarHBondContact O-N 2.84Å; T64-S68 VanDerWaalsContact O-N 3.14Å
65	V	85.4	Confident	81.4	Confident	28 Å²	28	43.4 Å²	43.4	17%	0.17	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-43	175	178.3	0	0	0	0	110.5	E61 Q62 S68 M69 Y157	E61-V65 WeakPolarHBondContact O-CG2 3.38Å; E61-V65 PolarHBondContact O-N 2.91Å; Q62-V65 PolarHBondContact O-N 2.96Å; V65-S68 PolarHBondContact O-N 2.97Å; V65-M69 HydrophobicContact CG1-CG 4.4Å; V65-M69 VanDerWaalsContact O-CG 3.23Å; V65-M69 WeakPolarHBondContact O-CG 3.48Å; V65-M69 PolarHBondContact O-N 2.89Å; V65-Y157 HydrophobicContact CG1-CE2 4.44Å; V65-Y157 WeakPolarHBondContact CG1-OH 3.19Å
66	H	85.8	Confident	83.5	Confident	8 Å²	8	43 Å²	43	4%	0.037	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-46.9	-179.8	-170.7	-174.7	0	0	0	112.6	Q62 A63 T64 S68 M69 N70 Y157 T160 Y560	Q62-H66 VanDerWaalsContact O-CB 3.26Å; Q62-H66 WeakPolarHBondContact O-CB 3.32Å; Q62-H66 PolarHBondContact O-N 3.29Å; A63-H66 PolarHBondContact O-N 2.82Å; T64-H66 VanDerWaalsContact C-N 3.31Å; T64-H66 PolarHBondContact O-N 3.44Å; H66-S68 VanDerWaalsContact C-N 3.35Å; H66-S68 PolarHBondContact O-N 3.43Å; H66-M69 PolarHBondContact O-N 3.32Å; H66-N70 PolarHBondContact O-N 2.88Å; H66-Y157 HydrophobicContact CB-CD2 3.86Å; H66-Y157 HydrophobicContact CB-CE2 4.19Å; H66-Y157 AromaticContact CD2-CD2 3.69Å; H66-Y157 AromaticContact CG-CD2 3.71Å; H66-T160 PolarHBondContact NE2-OG1 3.38Å; H66-Y560 AromaticContact ND1-CE2 3.66Å; H66-Y560 AromaticContact ND1-CZ 3.71Å; H66-Y560 PolarHBondContact ND1-OH 3.29Å
67	S	84.4	Confident	85	Confident	5 Å²	5	43.8 Å²	43.8	4%	0.035	23%	0.225	C	C	.	.	H	α-helix	trans	-53.7	-49.1	174.6	171.2	0	0	0	0	111.8	N45 R49 A63 T64 M69 N70 E71	N45-S67 PolarHBondContact ND2-OG 2.66Å; N45-S67 PolarHBondContact O-OG 2.98Å; N45-S67 VanDerWaalsContact O-OG 3.05Å; R49-S67 VanDerWaalsContact NH1-CB 3.31Å; R49-S67 PolarHBondContact NH1-OG 3.06Å; A63-S67 WeakPolarHBondContact O-CB 3.45Å; A63-S67 PolarHBondContact O-N 3.5Å; T64-S67 PolarHBondContact O-N 3.32Å; S67-M69 VanDerWaalsContact C-N 3.32Å; S67-M69 PolarHBondContact O-N 3.48Å; S67-N70 WeakPolarHBondContact O-CB 3.47Å; S67-N70 PolarHBondContact O-N 2.77Å; S67-E71 PolarHBondContact O-N 3.5Å
68	S	87.9	Confident	86.5	Confident	30 Å²	30	47 Å²	47	21%	0.21	23%	0.227	C	C	.	.	H	α-helix	trans	-69.2	-28.3	-179.5	-171	0	0	0	0	113.5	T64 V65 H66 R135	T64-S68 PolarHBondContact O-N 2.84Å; T64-S68 VanDerWaalsContact O-N 3.14Å; V65-S68 PolarHBondContact O-N 2.97Å; H66-S68 VanDerWaalsContact C-N 3.35Å; H66-S68 PolarHBondContact O-N 3.43Å; S68-R135 PolarHBondContact OG-NH2 3.47Å
69	M	89.3	Confident	87.6	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-71.5	-35.4	172.9	-70	-70.4	-76.2	0	0	111.6	V65 H66 S67 M72 L73 R135 E139 Y157 T160 L161 F164	V65-M69 HydrophobicContact CG1-CG 4.4Å; V65-M69 VanDerWaalsContact O-CG 3.23Å; V65-M69 WeakPolarHBondContact O-CG 3.48Å; V65-M69 PolarHBondContact O-N 2.89Å; H66-M69 PolarHBondContact O-N 3.32Å; S67-M69 VanDerWaalsContact C-N 3.32Å; S67-M69 PolarHBondContact O-N 3.48Å; M69-M72 PolarHBondContact O-N 2.88Å; M69-L73 PolarHBondContact O-N 2.73Å; M69-R135 HydrophobicContact SD-CG 4.13Å; M69-E139 HydrophobicContact CE-CG 4.41Å; M69-E139 HydrophobicContact SD-CG 4.43Å; M69-Y157 HydrophobicContact CG-CE2 4.29Å; M69-T160 HydrophobicContact CB-CG2 4.27Å; M69-L161 HydrophobicContact CE-CD2 3.97Å; M69-F164 HydrophobicContact CB-CE2 3.85Å; M69-F164 HydrophobicContact CB-CZ 4.1Å; M69-F164 HydrophobicContact CE-CD1 4.28Å; M69-F164 HydrophobicContact CE-CD2 4.02Å; M69-F164 HydrophobicContact CE-CE1 3.84Å; M69-F164 HydrophobicContact CE-CE2 3.57Å; M69-F164 HydrophobicContact CE-CG 4.35Å; M69-F164 HydrophobicContact CE-CZ 3.45Å; M69-F164 VanDerWaalsContact CE-CZ 3.45Å; M69-F164 WeakPolarHBondContact O-CE2 3.48Å; M69-F164 VanDerWaalsContact O-CZ 3.23Å; M69-F164 WeakPolarHBondContact O-CZ 3.23Å; M69-F164 HydrophobicContact SD-CE1 4.49Å; M69-F164 HydrophobicContact SD-CE2 4.34Å; M69-F164 HydrophobicContact SD-CZ 3.89Å
70	N	88.5	Confident	88.5	Confident	39 Å²	39	43.6 Å²	43.6	21%	0.209	21%	0.214	C	C	.	.	H	α-helix	trans	-65.6	-39.2	176.4	-71.4	-26.3	0	0	0	112.3	H66 S67 M72 L73 E74 T160	H66-N70 PolarHBondContact O-N 2.88Å; S67-N70 WeakPolarHBondContact O-CB 3.47Å; S67-N70 PolarHBondContact O-N 2.77Å; N70-M72 PolarHBondContact O-N 3.23Å; N70-L73 WeakPolarHBondContact O-CB 3.47Å; N70-L73 PolarHBondContact O-N 3.11Å; N70-E74 PolarHBondContact O-N 3.18Å; N70-T160 VanDerWaalsContact OD1-CG2 3.28Å; N70-T160 WeakPolarHBondContact OD1-CG2 3.29Å; N70-T160 PolarHBondContact OD1-OG1 3.04Å
71	E	90.9	Very high	89.5	Confident	108 Å²	108	43.1 Å²	43.1	51%	0.505	21%	0.213	S	C	.	.	H	α-helix	trans	-56.3	-38.2	175	-69.3	167.4	-172.8	0	0	112	S67 E74 E75	S67-E71 PolarHBondContact O-N 3.5Å; E71-E74 PolarHBondContact O-N 3.27Å; E71-E75 PolarHBondContact O-N 3.4Å
72	M	94.8	Very high	90.5	Very high	10 Å²	10	38.6 Å²	38.6	5%	0.049	19%	0.192	C	C	.	.	H	α-helix	trans	-72.9	-25.7	178.1	-174.1	171.3	-76.5	0	0	113.1	M69 N70 G76 F128 A132 R135 F164	M69-M72 PolarHBondContact O-N 2.88Å; N70-M72 PolarHBondContact O-N 3.23Å; M72-G76 PolarHBondContact O-N 2.97Å; M72-F128 HydrophobicContact CG-CE2 3.82Å; M72-F128 HydrophobicContact CG-CZ 4.14Å; M72-F128 WeakPolarHBondContact O-CZ 3.23Å; M72-A132 HydrophobicContact CG-CB 4.39Å; M72-A132 HydrophobicContact SD-CB 3.85Å; M72-R135 HydrophobicContact SD-CB 4.43Å; M72-F164 HydrophobicContact CB-CE1 4.45Å; M72-F164 HydrophobicContact CB-CZ 4Å; M72-F164 HydrophobicContact CG-CE1 4.08Å; M72-F164 HydrophobicContact CG-CZ 4.14Å; M72-F164 HydrophobicContact SD-CE1 3.92Å; M72-F164 HydrophobicContact SD-CZ 4.24Å
73	L	93.3	Very high	91.4	Very high	22 Å²	22	38 Å²	38	12%	0.115	19%	0.189	C	C	.	.	H	α-helix	trans	-69.1	-41	170.9	-73	172.2	0	0	0	111.4	M69 N70 G76 Q77 T160 K163 F164 M167	M69-L73 PolarHBondContact O-N 2.73Å; N70-L73 WeakPolarHBondContact O-CB 3.47Å; N70-L73 PolarHBondContact O-N 3.11Å; L73-G76 PolarHBondContact O-N 3.48Å; L73-Q77 PolarHBondContact O-N 3.38Å; L73-T160 HydrophobicContact CD1-CG2 3.93Å; L73-K163 HydrophobicContact CD1-CB 3.79Å; L73-K163 HydrophobicContact CD1-CD 4.19Å; L73-K163 HydrophobicContact CD2-CB 4.07Å; L73-F164 HydrophobicContact CD1-CD2 4.09Å; L73-F164 HydrophobicContact CD1-CE2 4.01Å; L73-F164 HydrophobicContact CD2-CD2 3.59Å; L73-F164 HydrophobicContact CD2-CE2 3.83Å; L73-F164 HydrophobicContact CD2-CG 4.02Å; L73-F164 HydrophobicContact CD2-CZ 4.44Å; L73-F164 HydrophobicContact CG-CD2 3.8Å; L73-F164 HydrophobicContact CG-CE2 3.55Å; L73-F164 HydrophobicContact CG-CZ 4.23Å; L73-M167 HydrophobicContact CD2-CB 4.13Å; L73-M167 HydrophobicContact CD2-SD 3.95Å
74	E	91.7	Very high	92.2	Very high	131 Å²	131	38 Å²	38	61%	0.612	19%	0.189	S	C	*	.	H	α-helix	trans	-64.2	-45.7	175.4	-61.8	-57.2	143	0	0	110.8	N70 E71 G76 Q77 E78	N70-E74 PolarHBondContact O-N 3.18Å; E71-E74 PolarHBondContact O-N 3.27Å; E74-G76 VanDerWaalsContact C-N 3.29Å; E74-G76 PolarHBondContact O-N 3.02Å; E74-Q77 WeakPolarHBondContact O-CB 3.35Å; E74-Q77 PolarHBondContact O-N 3.38Å; E74-Q77 VanDerWaalsContact O-N 3.08Å; E74-E78 PolarHBondContact O-N 3.05Å; E74-E78 VanDerWaalsContact O-N 3.1Å
75	E	95.1	Very high	92.9	Very high	74 Å²	74	36.3 Å²	36.3	35%	0.346	18%	0.178	S	C	.	.	H	α-helix	trans	-59	-40.9	173.9	-170.6	-173.7	175.1	0	0	111.6	E71 Q77 E78 Y79 F128	E71-E75 PolarHBondContact O-N 3.4Å; E75-Q77 VanDerWaalsContact C-N 3.31Å; E75-Q77 PolarHBondContact O-N 3.4Å; E75-E78 WeakPolarHBondContact O-CB 3.15Å; E75-E78 PolarHBondContact O-N 3.21Å; E75-Y79 HydrophobicContact CG-CD2 4.34Å; E75-Y79 HydrophobicContact CG-CE2 3.87Å; E75-Y79 VanDerWaalsContact O-CD2 3.23Å; E75-Y79 WeakPolarHBondContact O-CD2 3.45Å; E75-Y79 PolarHBondContact O-N 2.84Å; E75-F128 HydrophobicContact CB-CE2 3.87Å; E75-F128 HydrophobicContact CG-CD2 3.87Å; E75-F128 HydrophobicContact CG-CE2 3.73Å; E75-F128 WeakPolarHBondContact OE1-CD2 3.21Å
76	G	95.4	Very high	93.5	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-63.5	-35.6	175.2	0	0	0	0	0	113.6	M72 L73 E74 Y79 A80	M72-G76 PolarHBondContact O-N 2.97Å; L73-G76 PolarHBondContact O-N 3.48Å; E74-G76 VanDerWaalsContact C-N 3.29Å; E74-G76 PolarHBondContact O-N 3.02Å; G76-Y79 PolarHBondContact O-N 3.21Å; G76-A80 PolarHBondContact O-N 3.16Å
77	Q	93.6	Very high	94	Very high	80 Å²	80	37.9 Å²	37.9	37%	0.374	18%	0.181	S	C	.	.	H	α-helix	trans	-65.7	-38.1	175	-177.3	64.6	13.5	0	0	111.5	L73 E74 E75 Y79 A80 V81 F308	L73-Q77 PolarHBondContact O-N 3.38Å; E74-Q77 WeakPolarHBondContact O-CB 3.35Å; E74-Q77 PolarHBondContact O-N 3.38Å; E74-Q77 VanDerWaalsContact O-N 3.08Å; E75-Q77 VanDerWaalsContact C-N 3.31Å; E75-Q77 PolarHBondContact O-N 3.4Å; Q77-Y79 VanDerWaalsContact C-N 3.34Å; Q77-Y79 PolarHBondContact O-N 3.41Å; Q77-A80 WeakPolarHBondContact O-CB 3.49Å; Q77-A80 PolarHBondContact O-N 3.34Å; Q77-A80 VanDerWaalsContact O-N 3.16Å; Q77-V81 WeakPolarHBondContact O-CG2 3.3Å; Q77-V81 PolarHBondContact O-N 3.36Å; Q77-F308 VanDerWaalsContact NE2-CE2 3.35Å
78	E	95	Very high	94.6	Very high	142 Å²	142	38.6 Å²	38.6	66%	0.664	19%	0.186	S	C	*	.	H	α-helix	trans	-60.4	-42.3	174.1	-65.4	-178.8	-169.3	0	0	111.9	E74 E75 V81 M82	E74-E78 PolarHBondContact O-N 3.05Å; E74-E78 VanDerWaalsContact O-N 3.1Å; E75-E78 WeakPolarHBondContact O-CB 3.15Å; E75-E78 PolarHBondContact O-N 3.21Å; E78-V81 PolarHBondContact O-N 2.96Å; E78-M82 PolarHBondContact O-N 3.21Å
79	Y	97.4	Very high	94.9	Very high	33 Å²	33	39.1 Å²	39.1	13%	0.129	19%	0.189	C	C	.	.	H	α-helix	trans	-67.3	-34.5	174.2	-73.1	-66.6	0	0	0	112.9	E75 G76 Q77 M82 L83 N124 F125 F128	E75-Y79 HydrophobicContact CG-CD2 4.34Å; E75-Y79 HydrophobicContact CG-CE2 3.87Å; E75-Y79 VanDerWaalsContact O-CD2 3.23Å; E75-Y79 WeakPolarHBondContact O-CD2 3.45Å; E75-Y79 PolarHBondContact O-N 2.84Å; G76-Y79 PolarHBondContact O-N 3.21Å; Q77-Y79 VanDerWaalsContact C-N 3.34Å; Q77-Y79 PolarHBondContact O-N 3.41Å; Y79-M82 HydrophobicContact CD1-CE 4.08Å; Y79-M82 HydrophobicContact CD1-SD 4.12Å; Y79-M82 WeakPolarHBondContact O-CB 3.46Å; Y79-M82 PolarHBondContact O-N 3.46Å; Y79-L83 WeakPolarHBondContact O-CG 3.23Å; Y79-L83 PolarHBondContact O-N 3Å; Y79-N124 HydrophobicContact CE1-CB 4.33Å; Y79-N124 WeakPolarHBondContact OH-CB 3.23Å; Y79-F125 HydrophobicContact CD1-CB 3.65Å; Y79-F125 AromaticContact CD1-CD2 3.96Å; Y79-F125 HydrophobicContact CD1-CD2 3.96Å; Y79-F125 HydrophobicContact CD1-CG 4.21Å; Y79-F125 HydrophobicContact CE1-CB 3.79Å; 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 4.07Å; Y79-F128 AromaticContact CD2-CD1 3.58Å; Y79-F128 HydrophobicContact CD2-CD1 3.58Å; Y79-F128 HydrophobicContact CD2-CD2 4.13Å; Y79-F128 HydrophobicContact CD2-CE1 4.07Å; Y79-F128 AromaticContact CD2-CG 3.63Å; Y79-F128 HydrophobicContact CD2-CG 3.63Å; Y79-F128 HydrophobicContact CE2-CB 3.51Å; Y79-F128 AromaticContact CE2-CD1 3.9Å; Y79-F128 HydrophobicContact CE2-CD1 3.9Å; 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	96.7	Very high	95.1	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-63.1	-44.2	173.6	0	0	0	0	0	111.1	G76 Q77 M82 L83 Y84 V170 L171 L174 F308	G76-A80 PolarHBondContact O-N 3.16Å; Q77-A80 WeakPolarHBondContact O-CB 3.49Å; Q77-A80 PolarHBondContact O-N 3.34Å; Q77-A80 VanDerWaalsContact O-N 3.16Å; A80-M82 PolarHBondContact O-N 3.03Å; A80-L83 PolarHBondContact O-N 3.24Å; A80-Y84 WeakPolarHBondContact O-CB 3.4Å; A80-Y84 PolarHBondContact O-N 3.39Å; A80-V170 HydrophobicContact CB-CG1 3.94Å; A80-L171 HydrophobicContact CB-CD2 3.95Å; A80-L174 HydrophobicContact CB-CD1 3.72Å; A80-L174 WeakPolarHBondContact O-CD1 3.47Å; A80-F308 HydrophobicContact CB-CD2 4.01Å; A80-F308 HydrophobicContact CB-CE2 3.46Å; A80-F308 VanDerWaalsContact CB-CE2 3.46Å; A80-F308 HydrophobicContact CB-CZ 3.96Å
81	V	96.4	Very high	95.3	Very high	14 Å²	14	44.7 Å²	44.7	9%	0.085	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-46.1	172.7	170.7	0	0	0	0	111	Q77 E78 L83 Y84 T85 F308 F682	Q77-V81 WeakPolarHBondContact O-CG2 3.3Å; Q77-V81 PolarHBondContact O-N 3.36Å; E78-V81 PolarHBondContact O-N 2.96Å; V81-L83 PolarHBondContact O-N 3.27Å; V81-Y84 PolarHBondContact O-N 2.88Å; V81-T85 HydrophobicContact CG1-CG2 4.41Å; V81-T85 WeakPolarHBondContact O-CB 3.44Å; V81-T85 WeakPolarHBondContact O-CG2 3.21Å; V81-T85 PolarHBondContact O-N 3.34Å; V81-T85 PolarHBondContact O-OG1 3.13Å; V81-F308 HydrophobicContact CG2-CZ 3.94Å; V81-F682 HydrophobicContact CB-CD1 4.48Å; V81-F682 HydrophobicContact CG1-CB 4.33Å; V81-F682 HydrophobicContact CG1-CD1 3.96Å; V81-F682 WeakPolarHBondContact CG1-O 3.38Å; V81-F682 HydrophobicContact CG2-CD1 3.99Å; V81-F682 HydrophobicContact CG2-CE1 4.45Å
82	M	97.1	Very high	95.4	Very high	26 Å²	26	43.7 Å²	43.7	13%	0.128	22%	0.222	C	C	.	.	H	α-helix	trans	-56.1	-49	177	-179	-155.1	70.4	0	0	111.2	E78 Y79 A80 W86 K121 L122 F125	E78-M82 PolarHBondContact O-N 3.21Å; Y79-M82 HydrophobicContact CD1-CE 4.08Å; Y79-M82 HydrophobicContact CD1-SD 4.12Å; Y79-M82 WeakPolarHBondContact O-CB 3.46Å; Y79-M82 PolarHBondContact O-N 3.46Å; A80-M82 PolarHBondContact O-N 3.03Å; M82-W86 HydrophobicContact CE-CE3 4.42Å; M82-W86 HydrophobicContact CE-CZ3 4.3Å; M82-W86 HydrophobicContact CG-CE3 4.04Å; M82-W86 HydrophobicContact CG-CZ3 4.16Å; M82-W86 WeakPolarHBondContact O-CB 3.48Å; M82-W86 PolarHBondContact O-N 2.95Å; M82-W86 HydrophobicContact SD-CE3 4.38Å; M82-W86 HydrophobicContact SD-CZ3 4.01Å; M82-K121 HydrophobicContact SD-CB 3.65Å; M82-K121 HydrophobicContact SD-CD 4.45Å; M82-L122 HydrophobicContact CE-CD2 4.19Å; M82-F125 HydrophobicContact CE-CB 4.11Å; M82-F125 HydrophobicContact CE-CG 4.3Å
83	L	97.3	Very high	95.4	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-65.4	-49	-179.8	-70.4	171	0	0	0	111.7	Y79 A80 V81 T85 W86 F125 L171 L174 K178 V181	Y79-L83 WeakPolarHBondContact O-CG 3.23Å; Y79-L83 PolarHBondContact O-N 3Å; A80-L83 PolarHBondContact O-N 3.24Å; V81-L83 PolarHBondContact O-N 3.27Å; L83-T85 VanDerWaalsContact C-N 3.34Å; L83-T85 PolarHBondContact O-N 2.95Å; L83-W86 WeakPolarHBondContact O-CB 3.37Å; L83-W86 PolarHBondContact O-N 2.77Å; L83-F125 HydrophobicContact CD1-CE1 4.05Å; L83-F125 HydrophobicContact CD1-CE2 4.09Å; L83-F125 HydrophobicContact CD1-CZ 3.7Å; L83-F125 HydrophobicContact CD2-CD1 4.46Å; L83-F125 HydrophobicContact CD2-CE1 4.23Å; L83-L171 HydrophobicContact CD1-CD2 4.11Å; L83-L174 HydrophobicContact CB-CB 3.93Å; L83-L174 HydrophobicContact CB-CD1 4.35Å; L83-L174 HydrophobicContact CD1-CB 3.97Å; L83-K178 WeakPolarHBondContact O-CD 3.49Å; L83-K178 WeakPolarHBondContact O-CE 3.45Å; L83-K178 WeakPolarHBondContact O-CG 3.29Å; L83-V181 HydrophobicContact CD2-CG2 4.23Å
84	Y	97.9	Very high	95.3	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.8	-44.5	-177.3	-179.2	-106.6	0	0	0	112	A80 V81 W86 L174 M177 K178 F308 D310 E625 F682	A80-Y84 WeakPolarHBondContact O-CB 3.4Å; A80-Y84 PolarHBondContact O-N 3.39Å; V81-Y84 PolarHBondContact O-N 2.88Å; Y84-W86 VanDerWaalsContact C-N 3.29Å; Y84-W86 PolarHBondContact O-N 3.33Å; Y84-L174 HydrophobicContact CD2-CD2 3.95Å; Y84-L174 HydrophobicContact CG-CD2 4.49Å; Y84-M177 HydrophobicContact CD2-CE 4.12Å; Y84-K178 VanDerWaalsContact O-CE 3.23Å; Y84-K178 WeakPolarHBondContact O-CE 3.47Å; Y84-K178 PolarHBondContact O-NZ 3.49Å; Y84-F308 HydrophobicContact CD1-CD1 4.21Å; Y84-F308 AromaticContact CD1-CE1 3.79Å; Y84-F308 HydrophobicContact CD1-CE1 3.79Å; Y84-F308 AromaticContact CD2-CD1 3.76Å; Y84-F308 HydrophobicContact CD2-CD1 3.76Å; Y84-F308 HydrophobicContact CD2-CE1 4.13Å; Y84-F308 HydrophobicContact CE2-CD1 4.45Å; Y84-F308 AromaticContact CG-CD1 3.64Å; Y84-F308 HydrophobicContact CG-CD1 3.64Å; Y84-F308 AromaticContact CG-CE1 3.5Å; Y84-F308 HydrophobicContact CG-CE1 3.5Å; Y84-F308 VanDerWaalsContact CG-CE1 3.5Å; Y84-D310 WeakPolarHBondContact CE2-OD1 3.42Å; Y84-D310 VanDerWaalsContact CZ-OD1 3.26Å; Y84-D310 PolarHBondContact OH-N 2.91Å; Y84-D310 PolarHBondContact OH-OD1 3.47Å; Y84-E625 HydrophobicContact CD1-CB 4.37Å; Y84-E625 HydrophobicContact CD1-CG 4.29Å; Y84-E625 HydrophobicContact CD2-CB 4.29Å; Y84-E625 HydrophobicContact CE1-CB 3.92Å; Y84-E625 HydrophobicContact CE1-CG 3.78Å; Y84-E625 HydrophobicContact CE2-CB 3.83Å; Y84-E625 PolarHBondContact OH-N 3.15Å; Y84-F682 HydrophobicContact CD1-CE1 4.02Å; Y84-F682 AromaticContact CD1-CZ 3.9Å; Y84-F682 HydrophobicContact CD1-CZ 3.9Å; Y84-F682 HydrophobicContact CE1-CE1 4.33Å; Y84-F682 HydrophobicContact CE1-CE2 4.16Å; Y84-F682 AromaticContact CE1-CZ 3.74Å; Y84-F682 HydrophobicContact CE1-CZ 3.74Å
85	T	97.1	Very high	95.2	Very high	8 Å²	8	49 Å²	49	5%	0.049	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	3.7	-178.5	62.8	0	0	0	0	114	V81 L83 R87 F682 K684 F686 L687	V81-T85 HydrophobicContact CG1-CG2 4.41Å; V81-T85 WeakPolarHBondContact O-CB 3.44Å; V81-T85 WeakPolarHBondContact O-CG2 3.21Å; V81-T85 PolarHBondContact O-N 3.34Å; V81-T85 PolarHBondContact O-OG1 3.13Å; L83-T85 VanDerWaalsContact C-N 3.34Å; L83-T85 PolarHBondContact O-N 2.95Å; T85-R87 PolarHBondContact O-N 2.98Å; T85-F682 HydrophobicContact CG2-CB 4.36Å; T85-F682 HydrophobicContact CG2-CD1 4.33Å; T85-F682 HydrophobicContact CG2-CG 4.27Å; T85-K684 HydrophobicContact CG2-CG 4.04Å; T85-K684 WeakPolarHBondContact OG1-CE 3.39Å; T85-F686 WeakPolarHBondContact O-CZ 3.48Å; T85-L687 HydrophobicContact CG2-CD1 3.9Å
86	W	97.7	Very high	95	Very high	14 Å²	14	47 Å²	47	5%	0.053	25%	0.247	C	C	.	.			trans	-74.2	109.1	176.9	-161.3	-59.5	0	0	0	111	M82 L83 Y84 E118 L122 K178 V181 D184	M82-W86 HydrophobicContact CE-CE3 4.42Å; M82-W86 HydrophobicContact CE-CZ3 4.3Å; M82-W86 HydrophobicContact CG-CE3 4.04Å; M82-W86 HydrophobicContact CG-CZ3 4.16Å; M82-W86 WeakPolarHBondContact O-CB 3.48Å; M82-W86 PolarHBondContact O-N 2.95Å; M82-W86 HydrophobicContact SD-CE3 4.38Å; M82-W86 HydrophobicContact SD-CZ3 4.01Å; L83-W86 WeakPolarHBondContact O-CB 3.37Å; L83-W86 PolarHBondContact O-N 2.77Å; Y84-W86 VanDerWaalsContact C-N 3.29Å; Y84-W86 PolarHBondContact O-N 3.33Å; W86-E118 HydrophobicContact CH2-CB 3.72Å; W86-E118 WeakPolarHBondContact CH2-O 3.5Å; W86-E118 HydrophobicContact CZ2-CB 3.84Å; W86-L122 HydrophobicContact CE3-CD2 4.12Å; W86-L122 HydrophobicContact CH2-CD1 3.78Å; W86-L122 HydrophobicContact CH2-CD2 3.57Å; W86-L122 HydrophobicContact CH2-CG 3.48Å; W86-L122 VanDerWaalsContact CH2-CG 3.48Å; W86-L122 HydrophobicContact CZ2-CD1 4.07Å; W86-L122 HydrophobicContact CZ2-CD2 4.36Å; W86-L122 HydrophobicContact CZ2-CG 4.26Å; W86-L122 HydrophobicContact CZ3-CD2 3.43Å; W86-L122 VanDerWaalsContact CZ3-CD2 3.43Å; W86-L122 HydrophobicContact CZ3-CG 3.85Å; W86-K178 PolarHBondContact O-NZ 3.31Å; W86-V181 HydrophobicContact CB-CG2 4Å; W86-V181 HydrophobicContact CD2-CG2 3.65Å; W86-V181 HydrophobicContact CE3-CG2 4.09Å; W86-V181 HydrophobicContact CG-CG2 3.58Å; W86-D184 PolarHBondContact NE1-OD2 3.42Å
87	R	96.6	Very high	94.6	Very high	56 Å²	56	55.4 Å²	55.4	21%	0.211	28%	0.283	C	S	.	.			trans	-99.5	150.5	167.6	-67.8	-169.1	178.8	167.9	20	110.6	T85 C89 E625 I636 E690	T85-R87 PolarHBondContact O-N 2.98Å; R87-C89 PolarHBondContact O-N 3.38Å; R87-E625 IonicContact CZ-OE1 3.69Å; R87-E625 IonicContact CZ-OE2 3.97Å; R87-E625 IonicContact NE-OE1 3.69Å; R87-E625 PolarHBondContact NE-OE1 3.26Å; R87-E625 IonicContact NE-OE2 3.94Å; R87-E625 PolarHBondContact NE-OE2 3.38Å; R87-E625 IonicContact NH2-OE1 2.84Å; R87-E625 PolarHBondContact NH2-OE1 3.24Å; R87-E625 IonicContact NH2-OE2 3.22Å; R87-I636 PolarHBondContact NH1-O 3.15Å; R87-E690 IonicContact CZ-OE1 2.55Å; R87-E690 IonicContact CZ-OE2 3.73Å; R87-E690 IonicContact NH1-OE1 3.27Å; R87-E690 PolarHBondContact NH1-OE1 3.29Å; R87-E690 IonicContact NH1-OE2 2.68Å; R87-E690 IonicContact NH2-OE1 3.84Å; R87-E690 PolarHBondContact NH2-OE1 2.93Å; R87-E690 IonicContact NH2-OE2 3.63Å; R87-E690 PolarHBondContact NH2-OE2 3.3Å
88	S	96.4	Very high	94.3	Very high	20 Å²	20	54.4 Å²	54.4	14%	0.14	28%	0.284	C	S	.	.			trans	-68.7	116.1	-172.7	-176.2	0	0	0	0	112.8	S90 R91 S180 D184	S88-S90 PolarHBondContact OG-OG 3.24Å; S88-R91 WeakPolarHBondContact OG-CG 3.28Å; S88-R91 PolarHBondContact OG-N 3.04Å; S88-S180 WeakPolarHBondContact CB-OG 3.44Å; S88-D184 PolarHBondContact OG-OD1 3.11Å; S88-D184 VanDerWaalsContact OG-OD1 3.04Å
89	C	95.1	Very high	93.9	Very high	40 Å²	40	53.4 Å²	53.4	27%	0.27	28%	0.283	S	S	.	.	S	Bend	trans	-72.4	-38.1	170.4	-68.9	0	0	0	0	111.2	R87 R91 A92 I93 L115 D184	R87-C89 PolarHBondContact O-N 3.38Å; C89-R91 PolarHBondContact O-N 2.81Å; C89-A92 WeakPolarHBondContact O-CB 3.38Å; C89-A92 PolarHBondContact O-N 2.61Å; C89-I93 WeakPolarHBondContact O-CG1 3.37Å; C89-I93 PolarHBondContact O-N 3.21Å; C89-L115 HydrophobicContact CB-CD2 3.5Å; C89-L115 VanDerWaalsContact CB-CD2 3.5Å; C89-D184 PolarHBondContact N-OD1 3.3Å; C89-D184 PolarHBondContact N-OD2 3.36Å
90	S	92.9	Very high	93.4	Very high	31 Å²	31	59.4 Å²	59.4	22%	0.217	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.7	-178.4	55.5	0	0	0	0	113.8	S88 A92 I93 D184	S88-S90 PolarHBondContact OG-OG 3.24Å; S90-A92 VanDerWaalsContact C-N 3.3Å; S90-I93 PolarHBondContact O-N 3.32Å; S90-D184 WeakPolarHBondContact CB-OD1 3.45Å; S90-D184 PolarHBondContact N-OD1 3.21Å; S90-D184 PolarHBondContact OG-OD1 3.1Å
91	R	93.4	Very high	93.1	Very high	127 Å²	127	61.2 Å²	61.2	48%	0.479	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-27.3	171.4	-70.3	179.2	-168.6	-83.5	3.9	113.4	S88 C89 M632	S88-R91 WeakPolarHBondContact OG-CG 3.28Å; S88-R91 PolarHBondContact OG-N 3.04Å; C89-R91 PolarHBondContact O-N 2.81Å; R91-M632 VanDerWaalsContact CZ-C 3.46Å; R91-M632 PolarHBondContact NH1-O 3.13Å; R91-M632 PolarHBondContact NH2-O 3.43Å
92	A	93.4	Very high	92.7	Very high	87 Å²	87	66.4 Å²	66.4	72%	0.719	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-16	176.7	0	0	0	0	0	112.9	C89 S90	C89-A92 WeakPolarHBondContact O-CB 3.38Å; C89-A92 PolarHBondContact O-N 2.61Å; S90-A92 VanDerWaalsContact C-N 3.3Å
93	I	93.4	Very high	92.5	Very high	41 Å²	41	68.6 Å²	68.6	21%	0.21	37%	0.367	C	S	.	.	S	Bend	trans	-80.7	131.7	-179.2	-64.7	176.5	0	0	0	110.2	C89 S90 Q95 I107 T111 L115	C89-I93 WeakPolarHBondContact O-CG1 3.37Å; C89-I93 PolarHBondContact O-N 3.21Å; S90-I93 PolarHBondContact O-N 3.32Å; I93-Q95 PolarHBondContact O-N 3.2Å; I93-I107 HydrophobicContact CG2-CG2 4.31Å; I93-T111 HydrophobicContact CD1-CG2 3.88Å; I93-T111 WeakPolarHBondContact CG2-OG1 3.36Å; I93-L115 HydrophobicContact CD1-CD1 3.92Å; I93-L115 HydrophobicContact CD1-CG 4.3Å
94	P	91.3	Very high	92.2	Very high	81 Å²	81	71.3 Å²	71.3	53%	0.526	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-64.8	121.9	175.7	26.8	-34.5	0	0	0	110.9	I107	P94-I107 HydrophobicContact CB-CD1 4.38Å; P94-I107 HydrophobicContact CG-CD1 4.13Å; P94-I107 HydrophobicContact CG-CG1 4.03Å; P94-I107 HydrophobicContact CG-CG2 4.41Å; P94-I107 WeakPolarHBondContact O-CG2 3.41Å
95	Q	89.8	Confident	91.9	Very high	152 Å²	152	74.3 Å²	74.3	71%	0.71	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-70.3	139.6	179.2	64.1	179.2	-15.1	0	0	112.3	I93 K97	I93-Q95 PolarHBondContact O-N 3.2Å; Q95-K97 PolarHBondContact O-N 2.95Å
96	V	90.1	Very high	91.7	Very high	33 Å²	33	78.7 Å²	78.7	20%	0.2	42%	0.415	C	S	.	.			trans	-76.7	110.9	170.4	179	0	0	0	0	108.5	C98 Q101 R104 I107 Y108	V96-C98 WeakPolarHBondContact CG1-O 3.32Å; V96-Q101 VanDerWaalsContact CA-OE1 3.28Å; V96-Q101 HydrophobicContact CG1-CB 4.38Å; V96-R104 HydrophobicContact CG1-CB 4.3Å; V96-R104 HydrophobicContact CG1-CG 3.72Å; V96-R104 HydrophobicContact CG2-CG 4.08Å; V96-I107 HydrophobicContact CG2-CB 4.41Å; V96-I107 HydrophobicContact CG2-CD1 4.3Å; V96-I107 HydrophobicContact CG2-CG2 4.05Å; V96-Y108 HydrophobicContact CG2-CE1 4.15Å; V96-Y108 HydrophobicContact CG2-CE2 4.14Å
97	K	88.1	Confident	91.5	Very high	177 Å²	177	78.7 Å²	78.7	77%	0.77	42%	0.416	S	S	*	.			trans	-78.6	-36.6	-174.1	-67.2	-175	-179.4	-179.9	0	113.2	Q95	Q95-K97 PolarHBondContact O-N 2.95Å
98	C	87.6	Confident	91.4	Very high	59 Å²	59	77.6 Å²	77.6	40%	0.399	41%	0.412	S	S	.	.	S	Bend	trans	-147.5	168.2	179.8	64.6	0	0	0	0	111	V96 E100 Q101	V96-C98 WeakPolarHBondContact CG1-O 3.32Å; C98-E100 VanDerWaalsContact C-N 3.28Å; C98-E100 PolarHBondContact O-N 2.89Å; C98-Q101 WeakPolarHBondContact O-CB 3.34Å; C98-Q101 PolarHBondContact O-N 3.44Å
99	N	85.8	Confident	91.2	Very high	120 Å²	120	81.6 Å²	81.6	64%	0.642	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-22.5	-179.3	-72.4	-23	0	0	0	113	Q101 R104	N99-Q101 VanDerWaalsContact C-N 3.3Å; N99-Q101 PolarHBondContact O-N 3Å; N99-R104 VanDerWaalsContact CA-NH1 3.35Å; N99-R104 PolarHBondContact O-NE 3.28Å; N99-R104 PolarHBondContact O-NH1 2.97Å; N99-R104 PolarHBondContact O-NH2 3.2Å; N99-R104 PolarHBondContact OD1-NH1 3.44Å
100	E	87.3	Confident	91.2	Very high	159 Å²	159	85.4 Å²	85.4	74%	0.743	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	8.1	177.5	-54.1	93.4	175.7	0	0	114.3	C98	C98-E100 VanDerWaalsContact C-N 3.28Å; C98-E100 PolarHBondContact O-N 2.89Å
101	Q	89.8	Confident	91.3	Very high	39 Å²	39	84.2 Å²	84.2	18%	0.182	43%	0.432	C	S	.	.			trans	-65.1	126.5	-177.3	-177.2	169.3	-22.9	0	0	111.7	V96 C98 N99 N103 R104	V96-Q101 VanDerWaalsContact CA-OE1 3.28Å; V96-Q101 HydrophobicContact CG1-CB 4.38Å; C98-Q101 WeakPolarHBondContact O-CB 3.34Å; C98-Q101 PolarHBondContact O-N 3.44Å; N99-Q101 VanDerWaalsContact C-N 3.3Å; N99-Q101 PolarHBondContact O-N 3Å; Q101-N103 VanDerWaalsContact CG-OD1 3.25Å; Q101-N103 WeakPolarHBondContact CG-OD1 3.37Å; Q101-N103 PolarHBondContact NE2-OD1 3.02Å; Q101-N103 PolarHBondContact O-N 3.03Å; Q101-R104 HydrophobicContact CB-CB 4.31Å; Q101-R104 WeakPolarHBondContact O-CB 3.45Å; Q101-R104 PolarHBondContact O-N 2.92Å
102	P	88.8	Confident	91.4	Very high	123 Å²	123	78.8 Å²	78.8	80%	0.799	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-46.2	-172.6	-26.5	34.2	0	0	0	114	R104	P102-R104 PolarHBondContact O-N 3.44Å
103	N	92.6	Very high	91.5	Very high	72 Å²	72	80.1 Å²	80.1	39%	0.385	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	20.6	-176.9	64.7	-21.2	0	0	0	113.6	Q101 V105 E106 I107	Q101-N103 VanDerWaalsContact CG-OD1 3.25Å; Q101-N103 WeakPolarHBondContact CG-OD1 3.37Å; Q101-N103 PolarHBondContact NE2-OD1 3.02Å; Q101-N103 PolarHBondContact O-N 3.03Å; N103-V105 VanDerWaalsContact C-N 3.35Å; N103-V105 PolarHBondContact O-N 3.11Å; N103-E106 WeakPolarHBondContact CA-OE2 3.18Å; N103-I107 WeakPolarHBondContact O-CB 3.4Å; N103-I107 WeakPolarHBondContact O-CD1 3.46Å; N103-I107 WeakPolarHBondContact O-CG1 3.45Å; N103-I107 PolarHBondContact O-N 2.83Å
104	R	91	Very high	91.6	Very high	59 Å²	59	82 Å²	82	22%	0.223	42%	0.418	C	S	.	.	H	α-helix	trans	-63.1	-39.8	-173.8	176.5	174.6	66.2	164.4	-3.1	112.4	V96 N99 Q101 P102 Y108 F194	V96-R104 HydrophobicContact CG1-CB 4.3Å; V96-R104 HydrophobicContact CG1-CG 3.72Å; V96-R104 HydrophobicContact CG2-CG 4.08Å; N99-R104 VanDerWaalsContact CA-NH1 3.35Å; N99-R104 PolarHBondContact O-NE 3.28Å; N99-R104 PolarHBondContact O-NH1 2.97Å; N99-R104 PolarHBondContact O-NH2 3.2Å; N99-R104 PolarHBondContact OD1-NH1 3.44Å; Q101-R104 HydrophobicContact CB-CB 4.31Å; Q101-R104 WeakPolarHBondContact O-CB 3.45Å; Q101-R104 PolarHBondContact O-N 2.92Å; P102-R104 PolarHBondContact O-N 3.44Å; R104-Y108 HydrophobicContact CG-CD2 3.98Å; R104-Y108 HydrophobicContact CG-CE2 3.66Å; R104-Y108 WeakPolarHBondContact O-CD2 3.29Å; R104-Y108 PolarHBondContact O-N 3.4Å; R104-F194 HydrophobicContact CG-CE1 4.48Å; R104-F194 HydrophobicContact CG-CZ 4.35Å
105	V	91.6	Very high	91.9	Very high	62 Å²	62	78.2 Å²	78.2	38%	0.376	39%	0.393	S	S	.	.	H	α-helix	trans	-70.3	-46.9	-177.2	179.4	0	0	0	0	109.5	N103 I107 Y108 E109 F194 L195	N103-V105 VanDerWaalsContact C-N 3.35Å; N103-V105 PolarHBondContact O-N 3.11Å; V105-I107 VanDerWaalsContact C-N 3.32Å; V105-I107 PolarHBondContact O-N 3.47Å; V105-Y108 PolarHBondContact O-N 2.72Å; V105-Y108 VanDerWaalsContact O-N 3.08Å; V105-E109 HydrophobicContact CG1-CG 4.4Å; V105-E109 WeakPolarHBondContact O-CG 3.48Å; V105-E109 PolarHBondContact O-N 2.94Å; V105-F194 HydrophobicContact CG2-CE1 4.4Å; V105-L195 HydrophobicContact CG1-CD2 4.05Å
106	E	92.6	Very high	92.1	Very high	101 Å²	101	74.6 Å²	74.6	47%	0.472	38%	0.376	S	S	.	.	H	α-helix	trans	-60.7	-41.2	179.3	-59.9	89.6	152.8	0	0	111.4	N103 Y108 E109 K110	N103-E106 WeakPolarHBondContact CA-OE2 3.18Å; E106-Y108 VanDerWaalsContact C-N 3.34Å; E106-Y108 PolarHBondContact O-N 3.15Å; E106-E109 PolarHBondContact O-N 3.24Å; E106-K110 WeakPolarHBondContact O-CB 3.49Å; E106-K110 WeakPolarHBondContact O-CG 3.49Å; E106-K110 PolarHBondContact O-N 3.29Å
107	I	93.6	Very high	92.4	Very high	14 Å²	14	76.3 Å²	76.3	7%	0.072	39%	0.388	C	S	.	.	H	α-helix	trans	-59.3	-46.7	174.6	-71.7	168.9	0	0	0	110.5	I93 P94 V96 N103 V105 K110 T111	I93-I107 HydrophobicContact CG2-CG2 4.31Å; P94-I107 HydrophobicContact CB-CD1 4.38Å; P94-I107 HydrophobicContact CG-CD1 4.13Å; P94-I107 HydrophobicContact CG-CG1 4.03Å; P94-I107 HydrophobicContact CG-CG2 4.41Å; P94-I107 WeakPolarHBondContact O-CG2 3.41Å; V96-I107 HydrophobicContact CG2-CB 4.41Å; V96-I107 HydrophobicContact CG2-CD1 4.3Å; V96-I107 HydrophobicContact CG2-CG2 4.05Å; N103-I107 WeakPolarHBondContact O-CB 3.4Å; N103-I107 WeakPolarHBondContact O-CD1 3.46Å; N103-I107 WeakPolarHBondContact O-CG1 3.45Å; N103-I107 PolarHBondContact O-N 2.83Å; V105-I107 VanDerWaalsContact C-N 3.32Å; V105-I107 PolarHBondContact O-N 3.47Å; I107-K110 PolarHBondContact O-N 2.95Å; I107-T111 VanDerWaalsContact O-CB 3.3Å; I107-T111 WeakPolarHBondContact O-CB 3.49Å; I107-T111 PolarHBondContact O-N 3.19Å; I107-T111 PolarHBondContact O-OG1 2.68Å
108	Y	93.8	Very high	92.8	Very high	33 Å²	33	70.3 Å²	70.3	13%	0.129	36%	0.363	C	S	.	.	H	α-helix	trans	-69.6	-36.5	-179.7	-71.7	-45.5	0	0	0	112.6	V96 R104 V105 E106 T111 V112 A191 F194	V96-Y108 HydrophobicContact CG2-CE1 4.15Å; V96-Y108 HydrophobicContact CG2-CE2 4.14Å; R104-Y108 HydrophobicContact CG-CD2 3.98Å; R104-Y108 HydrophobicContact CG-CE2 3.66Å; R104-Y108 WeakPolarHBondContact O-CD2 3.29Å; R104-Y108 PolarHBondContact O-N 3.4Å; V105-Y108 PolarHBondContact O-N 2.72Å; V105-Y108 VanDerWaalsContact O-N 3.08Å; E106-Y108 VanDerWaalsContact C-N 3.34Å; E106-Y108 PolarHBondContact O-N 3.15Å; Y108-T111 WeakPolarHBondContact O-CB 3.34Å; Y108-T111 PolarHBondContact O-N 3.43Å; Y108-V112 WeakPolarHBondContact O-CG2 3.37Å; Y108-V112 PolarHBondContact O-N 2.93Å; Y108-A191 HydrophobicContact CD1-CB 3.51Å; Y108-A191 HydrophobicContact CE1-CB 4.36Å; Y108-A191 HydrophobicContact CG-CB 4.1Å; Y108-F194 HydrophobicContact CD2-CB 4.11Å; Y108-F194 AromaticContact CD2-CD1 3.25Å; Y108-F194 HydrophobicContact CD2-CD1 3.25Å; Y108-F194 HydrophobicContact CD2-CD2 4.46Å; Y108-F194 AromaticContact CD2-CE1 3.73Å; Y108-F194 HydrophobicContact CD2-CE1 3.73Å; Y108-F194 AromaticContact CD2-CG 3.68Å; Y108-F194 HydrophobicContact CD2-CG 3.68Å; Y108-F194 HydrophobicContact CE2-CB 4.16Å; Y108-F194 AromaticContact CE2-CD1 3.69Å; Y108-F194 HydrophobicContact CE2-CD1 3.69Å; Y108-F194 HydrophobicContact CE2-CD2 4.06Å; Y108-F194 HydrophobicContact CE2-CE1 4.07Å; Y108-F194 HydrophobicContact CE2-CE2 4.42Å; Y108-F194 AromaticContact CE2-CG 3.68Å; Y108-F194 HydrophobicContact CE2-CG 3.68Å; Y108-F194 HydrophobicContact CE2-CZ 4.43Å; Y108-F194 HydrophobicContact CG-CD1 4.19Å
109	E	93.5	Very high	93.1	Very high	103 Å²	103	68 Å²	68	48%	0.481	35%	0.347	S	S	.	.	H	α-helix	trans	-60.8	-48.5	175.1	-74.5	177.5	166.1	0	0	110.5	V105 E106 T111 V112 E113 L195	V105-E109 HydrophobicContact CG1-CG 4.4Å; V105-E109 WeakPolarHBondContact O-CG 3.48Å; V105-E109 PolarHBondContact O-N 2.94Å; E106-E109 PolarHBondContact O-N 3.24Å; E109-T111 VanDerWaalsContact C-N 3.34Å; E109-T111 PolarHBondContact O-N 3.13Å; E109-V112 PolarHBondContact O-N 3.26Å; E109-E113 WeakPolarHBondContact O-CB 3.2Å; E109-E113 PolarHBondContact O-N 3.26Å; E109-L195 HydrophobicContact CB-CD1 4.41Å; E109-L195 HydrophobicContact CG-CD1 3.87Å; E109-L195 HydrophobicContact CG-CD2 3.88Å
110	K	94.9	Very high	93.6	Very high	120 Å²	120	65.6 Å²	65.6	52%	0.522	34%	0.337	S	S	.	.	H	α-helix	trans	-67.5	-32.7	176.2	-64.7	-59.4	176.1	-171.5	0	113.2	E106 I107 E113 V114	E106-K110 WeakPolarHBondContact O-CB 3.49Å; E106-K110 WeakPolarHBondContact O-CG 3.49Å; E106-K110 PolarHBondContact O-N 3.29Å; I107-K110 PolarHBondContact O-N 2.95Å; K110-E113 WeakPolarHBondContact CD-OE2 3.41Å; K110-E113 WeakPolarHBondContact CE-OE2 3.35Å; K110-E113 IonicContact NZ-OE1 3.52Å; K110-E113 PolarHBondContact NZ-OE1 2.89Å; K110-E113 IonicContact NZ-OE2 2.67Å; K110-E113 PolarHBondContact NZ-OE2 3.47Å; K110-E113 PolarHBondContact O-N 3.46Å; K110-V114 VanDerWaalsContact O-CG2 3.32Å; K110-V114 WeakPolarHBondContact O-CG2 3.38Å; K110-V114 PolarHBondContact O-N 3.17Å
111	T	95.1	Very high	94	Very high	7 Å²	7	62.2 Å²	62.2	4%	0.043	32%	0.32	C	S	.	.	H	α-helix	trans	-61.9	-44.4	173.5	-61.9	0	0	0	0	111	I93 I107 Y108 E109 L115 A191	I93-T111 HydrophobicContact CD1-CG2 3.88Å; I93-T111 WeakPolarHBondContact CG2-OG1 3.36Å; I107-T111 VanDerWaalsContact O-CB 3.3Å; I107-T111 WeakPolarHBondContact O-CB 3.49Å; I107-T111 PolarHBondContact O-N 3.19Å; I107-T111 PolarHBondContact O-OG1 2.68Å; Y108-T111 WeakPolarHBondContact O-CB 3.34Å; Y108-T111 PolarHBondContact O-N 3.43Å; E109-T111 VanDerWaalsContact C-N 3.34Å; E109-T111 PolarHBondContact O-N 3.13Å; T111-L115 HydrophobicContact CG2-CD1 3.76Å; T111-L115 VanDerWaalsContact O-CB 3.29Å; T111-L115 WeakPolarHBondContact O-CB 3.47Å; T111-L115 WeakPolarHBondContact O-CG 3.06Å; T111-L115 PolarHBondContact O-N 3.45Å; T111-A191 HydrophobicContact CG2-CB 3.68Å
112	V	95.1	Very high	94.3	Very high	12 Å²	12	60.4 Å²	60.4	7%	0.073	31%	0.311	C	S	.	.	H	α-helix	trans	-66.3	-47.2	176.7	170	0	0	0	0	110.5	Y108 E109 V114 L115 E116 Y188 A191 A192 L195 K197	Y108-V112 WeakPolarHBondContact O-CG2 3.37Å; Y108-V112 PolarHBondContact O-N 2.93Å; E109-V112 PolarHBondContact O-N 3.26Å; V112-V114 VanDerWaalsContact C-N 3.31Å; V112-V114 PolarHBondContact O-N 3.03Å; V112-L115 PolarHBondContact O-N 3.36Å; V112-E116 WeakPolarHBondContact O-CB 3.44Å; V112-E116 PolarHBondContact O-N 3.31Å; V112-Y188 HydrophobicContact CB-CE2 4.42Å; V112-Y188 HydrophobicContact CG1-CE2 3.99Å; V112-Y188 HydrophobicContact CG2-CD2 4.44Å; V112-Y188 HydrophobicContact CG2-CE2 4.35Å; V112-A191 HydrophobicContact CG2-CB 3.77Å; V112-A192 HydrophobicContact CG2-CB 4.16Å; V112-L195 HydrophobicContact CG2-CD1 4.03Å; V112-K197 HydrophobicContact CG1-CD 4.42Å
113	E	95.3	Very high	94.6	Very high	116 Å²	116	55.7 Å²	55.7	54%	0.542	28%	0.279	S	S	.	.	H	α-helix	trans	-55.4	-43.2	179.5	-174.2	-178.9	157.3	0	0	112.7	E109 K110	E109-E113 WeakPolarHBondContact O-CB 3.2Å; E109-E113 PolarHBondContact O-N 3.26Å; K110-E113 WeakPolarHBondContact CD-OE2 3.41Å; K110-E113 WeakPolarHBondContact CE-OE2 3.35Å; K110-E113 IonicContact NZ-OE1 3.52Å; K110-E113 PolarHBondContact NZ-OE1 2.89Å; K110-E113 IonicContact NZ-OE2 2.67Å; K110-E113 PolarHBondContact NZ-OE2 3.47Å; K110-E113 PolarHBondContact O-N 3.46Å
114	V	95.8	Very high	94.7	Very high	81 Å²	81	55.9 Å²	55.9	49%	0.491	28%	0.28	S	S	.	.	H	α-helix	trans	-76.6	-43.1	-179.5	173.5	0	0	0	0	112.3	K110 V112	K110-V114 VanDerWaalsContact O-CG2 3.32Å; K110-V114 WeakPolarHBondContact O-CG2 3.38Å; K110-V114 PolarHBondContact O-N 3.17Å; V112-V114 VanDerWaalsContact C-N 3.31Å; V112-V114 PolarHBondContact O-N 3.03Å
115	L	96.8	Very high	95	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-90.2	-19.3	-170.2	-68.4	175	0	0	0	114.3	C89 I93 T111 V112 E118 V119 D184 A187 Y188	C89-L115 HydrophobicContact CB-CD2 3.5Å; C89-L115 VanDerWaalsContact CB-CD2 3.5Å; I93-L115 HydrophobicContact CD1-CD1 3.92Å; I93-L115 HydrophobicContact CD1-CG 4.3Å; T111-L115 HydrophobicContact CG2-CD1 3.76Å; T111-L115 VanDerWaalsContact O-CB 3.29Å; T111-L115 WeakPolarHBondContact O-CB 3.47Å; T111-L115 WeakPolarHBondContact O-CG 3.06Å; T111-L115 PolarHBondContact O-N 3.45Å; V112-L115 PolarHBondContact O-N 3.36Å; L115-E118 PolarHBondContact O-N 2.83Å; L115-V119 WeakPolarHBondContact O-CG2 3.17Å; L115-V119 PolarHBondContact O-N 2.75Å; L115-D184 HydrophobicContact CD2-CB 4.07Å; L115-A187 HydrophobicContact CD1-CB 4.09Å; L115-Y188 HydrophobicContact CB-CD2 4.03Å; L115-Y188 HydrophobicContact CB-CG 4.37Å
116	E	94.9	Very high	95.3	Very high	75 Å²	75	50.7 Å²	50.7	35%	0.35	25%	0.254	S	S	.	.	H	α-helix	trans	-58.7	-46.5	-179.1	178.7	168.1	-158.4	0	0	113.8	V112 E118 V119 T120 Y188 K197	V112-E116 WeakPolarHBondContact O-CB 3.44Å; V112-E116 PolarHBondContact O-N 3.31Å; E116-E118 VanDerWaalsContact C-N 3.26Å; E116-E118 PolarHBondContact O-N 3.44Å; E116-V119 PolarHBondContact O-N 2.87Å; E116-T120 PolarHBondContact O-N 3.25Å; E116-T120 PolarHBondContact O-OG1 3.09Å; E116-Y188 HydrophobicContact CB-CE2 3.76Å; E116-Y188 HydrophobicContact CG-CE2 4.34Å; E116-K197 IonicContact OE1-NZ 2.6Å; E116-K197 PolarHBondContact OE1-NZ 3.28Å; E116-K197 IonicContact OE2-NZ 2.69Å; E116-K197 PolarHBondContact OE2-NZ 3.15Å
117	P	96.1	Very high	95.4	Very high	69 Å²	69	48.8 Å²	48.8	45%	0.448	24%	0.243	S	C	.	.	H	α-helix	trans	-61.5	-36.9	176	-22.5	34.9	0	0	0	112.2	T120 K121	P117-T120 WeakPolarHBondContact O-CB 3.27Å; P117-T120 PolarHBondContact O-N 2.77Å; P117-K121 PolarHBondContact O-N 3.34Å
118	E	95.8	Very high	95.6	Very high	51 Å²	51	48.4 Å²	48.4	24%	0.238	24%	0.241	C	C	.	.	H	α-helix	trans	-70.3	-43.2	178.9	-58.6	-51.8	131.6	0	0	111.4	W86 L115 E116 T120 K121 L122	W86-E118 HydrophobicContact CH2-CB 3.72Å; W86-E118 WeakPolarHBondContact CH2-O 3.5Å; W86-E118 HydrophobicContact CZ2-CB 3.84Å; L115-E118 PolarHBondContact O-N 2.83Å; E116-E118 VanDerWaalsContact C-N 3.26Å; E116-E118 PolarHBondContact O-N 3.44Å; E118-T120 PolarHBondContact O-N 2.78Å; E118-K121 WeakPolarHBondContact O-CB 3.39Å; E118-K121 PolarHBondContact O-N 3.5Å; E118-K121 IonicContact OE1-NZ 3.48Å; E118-K121 PolarHBondContact OE1-NZ 2.84Å; E118-K121 WeakPolarHBondContact OE2-CE 3.38Å; E118-K121 IonicContact OE2-NZ 2.75Å; E118-K121 PolarHBondContact OE2-NZ 3.37Å; E118-L122 PolarHBondContact O-N 3.37Å
119	V	95.6	Very high	95.7	Very high	10 Å²	10	47.5 Å²	47.5	6%	0.061	24%	0.238	C	C	.	.	H	α-helix	trans	-61.2	-32.5	174.7	171	0	0	0	0	111.7	L115 E116 K121 L122 M123 Y188 L210	L115-V119 WeakPolarHBondContact O-CG2 3.17Å; L115-V119 PolarHBondContact O-N 2.75Å; E116-V119 PolarHBondContact O-N 2.87Å; V119-K121 VanDerWaalsContact C-N 3.33Å; V119-K121 PolarHBondContact O-N 3.19Å; V119-L122 WeakPolarHBondContact O-CB 3.46Å; V119-L122 PolarHBondContact O-N 2.99Å; V119-L122 VanDerWaalsContact O-N 3.16Å; V119-M123 PolarHBondContact O-N 2.73Å; V119-Y188 HydrophobicContact CB-CD1 4.29Å; V119-Y188 HydrophobicContact CB-CE1 4.47Å; V119-Y188 HydrophobicContact CG1-CD1 4.1Å; V119-Y188 HydrophobicContact CG1-CE1 4.09Å; 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 4.05Å
120	T	95.5	Very high	95.8	Very high	71 Å²	71	48.1 Å²	48.1	44%	0.436	24%	0.235	S	C	.	.	H	α-helix	trans	-61.4	-40.7	173.5	-55.7	0	0	0	0	111.6	E116 P117 E118 L122 M123 N124	E116-T120 PolarHBondContact O-N 3.25Å; E116-T120 PolarHBondContact O-OG1 3.09Å; P117-T120 WeakPolarHBondContact O-CB 3.27Å; P117-T120 PolarHBondContact O-N 2.77Å; E118-T120 PolarHBondContact O-N 2.78Å; T120-L122 VanDerWaalsContact C-N 3.3Å; T120-L122 PolarHBondContact O-N 3.03Å; T120-M123 WeakPolarHBondContact O-CB 3.47Å; T120-M123 PolarHBondContact O-N 2.78Å; T120-N124 PolarHBondContact O-N 3.48Å
121	K	96.5	Very high	95.8	Very high	88 Å²	88	46.1 Å²	46.1	38%	0.383	23%	0.231	S	C	.	.	H	α-helix	trans	-62.6	-38.3	174.3	-56.8	175.8	-168.2	161.2	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 3.34Å; E118-K121 WeakPolarHBondContact O-CB 3.39Å; E118-K121 PolarHBondContact O-N 3.5Å; E118-K121 IonicContact OE1-NZ 3.48Å; E118-K121 PolarHBondContact OE1-NZ 2.84Å; E118-K121 WeakPolarHBondContact OE2-CE 3.38Å; E118-K121 IonicContact OE2-NZ 2.75Å; E118-K121 PolarHBondContact OE2-NZ 3.37Å; V119-K121 VanDerWaalsContact C-N 3.33Å; V119-K121 PolarHBondContact O-N 3.19Å; K121-N124 PolarHBondContact O-N 2.92Å; K121-F125 WeakPolarHBondContact O-CB 3.36Å; K121-F125 PolarHBondContact O-N 3.19Å
122	L	95.7	Very high	95.9	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-67.5	-35.6	175.9	-60.6	178.6	0	0	0	113	M82 W86 E118 V119 T120 F125 M126 V181 H185 L210 L214	M82-L122 HydrophobicContact CE-CD2 4.19Å; W86-L122 HydrophobicContact CE3-CD2 4.12Å; W86-L122 HydrophobicContact CH2-CD1 3.78Å; W86-L122 HydrophobicContact CH2-CD2 3.57Å; W86-L122 HydrophobicContact CH2-CG 3.48Å; W86-L122 VanDerWaalsContact CH2-CG 3.48Å; W86-L122 HydrophobicContact CZ2-CD1 4.07Å; W86-L122 HydrophobicContact CZ2-CD2 4.36Å; W86-L122 HydrophobicContact CZ2-CG 4.26Å; W86-L122 HydrophobicContact CZ3-CD2 3.43Å; W86-L122 VanDerWaalsContact CZ3-CD2 3.43Å; W86-L122 HydrophobicContact CZ3-CG 3.85Å; E118-L122 PolarHBondContact O-N 3.37Å; V119-L122 WeakPolarHBondContact O-CB 3.46Å; V119-L122 PolarHBondContact O-N 2.99Å; V119-L122 VanDerWaalsContact O-N 3.16Å; T120-L122 VanDerWaalsContact C-N 3.3Å; T120-L122 PolarHBondContact O-N 3.03Å; L122-F125 PolarHBondContact O-N 2.95Å; L122-M126 WeakPolarHBondContact O-CB 3.22Å; L122-M126 PolarHBondContact O-N 2.96Å; L122-V181 HydrophobicContact CD1-CG1 3.74Å; L122-V181 HydrophobicContact CD2-CG1 3.43Å; L122-V181 VanDerWaalsContact CD2-CG1 3.43Å; L122-V181 HydrophobicContact CG-CG1 4.23Å; L122-H185 HydrophobicContact CD1-CB 4.23Å; L122-L210 HydrophobicContact CB-CD1 4.14Å; L122-L210 HydrophobicContact CB-CD2 4.02Å; L122-L214 HydrophobicContact CD1-CD1 4.28Å
123	M	93.9	Very high	96	Very high	24 Å²	24	45.3 Å²	45.3	12%	0.118	23%	0.225	C	C	.	.	H	α-helix	trans	-62.2	-49.1	171.4	-71.9	-63	-174.4	0	0	110.7	V119 T120 F125 M126 Y127 E206 L210	V119-M123 PolarHBondContact O-N 2.73Å; T120-M123 WeakPolarHBondContact O-CB 3.47Å; T120-M123 PolarHBondContact O-N 2.78Å; M123-F125 VanDerWaalsContact C-N 3.31Å; M123-F125 PolarHBondContact O-N 2.93Å; M123-M126 WeakPolarHBondContact O-CB 3.39Å; M123-M126 PolarHBondContact O-N 3.36Å; M123-M126 VanDerWaalsContact O-N 3.13Å; M123-M126 HydrophobicContact SD-CE 3.85Å; M123-Y127 HydrophobicContact CB-CE2 4.2Å; M123-Y127 VanDerWaalsContact O-CD2 3.23Å; M123-Y127 WeakPolarHBondContact O-CD2 3.43Å; M123-Y127 PolarHBondContact O-N 3.02Å; M123-E206 HydrophobicContact CE-CB 4.16Å; M123-E206 WeakPolarHBondContact CE-O 3.47Å; M123-E206 HydrophobicContact SD-CB 4.47Å; M123-L210 HydrophobicContact CE-CB 3.71Å; M123-L210 HydrophobicContact CE-CD2 3.59Å; M123-L210 HydrophobicContact CE-CG 4.26Å; M123-L210 HydrophobicContact CG-CD2 4.11Å; M123-L210 HydrophobicContact SD-CB 3.76Å; M123-L210 HydrophobicContact SD-CD1 4.48Å; M123-L210 HydrophobicContact SD-CD2 3.7Å; M123-L210 HydrophobicContact SD-CG 4.18Å
124	N	96.3	Very high	95.9	Very high	76 Å²	76	44.4 Å²	44.4	41%	0.406	22%	0.221	S	C	.	.	H	α-helix	trans	-60.7	-40.8	178.1	-66.3	-15	0	0	0	111.6	Y79 T120 K121 Y127 F128	Y79-N124 HydrophobicContact CE1-CB 4.33Å; Y79-N124 WeakPolarHBondContact OH-CB 3.23Å; T120-N124 PolarHBondContact O-N 3.48Å; K121-N124 PolarHBondContact O-N 2.92Å; N124-Y127 PolarHBondContact O-N 3.33Å; N124-F128 VanDerWaalsContact O-CB 3.29Å; N124-F128 WeakPolarHBondContact O-CB 3.31Å; N124-F128 PolarHBondContact O-N 2.9Å
125	F	97.7	Very high	95.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.3	-45.8	172.8	171.5	-123.9	0	0	0	112.6	Y79 M82 L83 K121 L122 M123 Y127 F128 Q129 L171 K175 F213 I220	Y79-F125 HydrophobicContact CD1-CB 3.65Å; Y79-F125 AromaticContact CD1-CD2 3.96Å; Y79-F125 HydrophobicContact CD1-CD2 3.96Å; Y79-F125 HydrophobicContact CD1-CG 4.21Å; Y79-F125 HydrophobicContact CE1-CB 3.79Å; 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 4.3Å; L83-F125 HydrophobicContact CD1-CE1 4.05Å; L83-F125 HydrophobicContact CD1-CE2 4.09Å; L83-F125 HydrophobicContact CD1-CZ 3.7Å; L83-F125 HydrophobicContact CD2-CD1 4.46Å; L83-F125 HydrophobicContact CD2-CE1 4.23Å; K121-F125 WeakPolarHBondContact O-CB 3.36Å; K121-F125 PolarHBondContact O-N 3.19Å; L122-F125 PolarHBondContact O-N 2.95Å; M123-F125 VanDerWaalsContact C-N 3.31Å; M123-F125 PolarHBondContact O-N 2.93Å; F125-Y127 VanDerWaalsContact C-N 3.28Å; F125-Y127 PolarHBondContact O-N 2.91Å; F125-F128 PolarHBondContact O-N 3.11Å; F125-Q129 HydrophobicContact CE2-CB 4.47Å; F125-Q129 WeakPolarHBondContact O-CG 3.32Å; F125-Q129 PolarHBondContact O-N 3.21Å; F125-L171 HydrophobicContact CE2-CB 4.28Å; F125-L171 HydrophobicContact CE2-CD1 4.27Å; F125-L171 HydrophobicContact CE2-CD2 3.98Å; F125-L171 HydrophobicContact CE2-CG 4.41Å; F125-L171 HydrophobicContact CZ-CB 4.42Å; F125-K175 HydrophobicContact CE1-CD 4.34Å; F125-F213 AromaticContact CD1-CE1 3.79Å; F125-F213 HydrophobicContact CD1-CE1 3.79Å; F125-F213 HydrophobicContact CD1-CZ 4.22Å; F125-F213 AromaticContact CE1-CE1 3.54Å; F125-F213 HydrophobicContact CE1-CE1 3.54Å; F125-F213 AromaticContact CE1-CZ 3.64Å; F125-F213 HydrophobicContact CE1-CZ 3.64Å; F125-F213 HydrophobicContact CZ-CE1 4.46Å; F125-F213 HydrophobicContact CZ-CZ 4.12Å; F125-I220 HydrophobicContact CE2-CD1 4.47Å; F125-I220 HydrophobicContact CZ-CD1 3.88Å
126	M	96.6	Very high	95.9	Very high	11 Å²	11	45.2 Å²	45.2	5%	0.054	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-39.7	176.8	180	-174.3	65.4	0	0	111.4	L122 M123 Q129 R130 N209 L210 F213	L122-M126 WeakPolarHBondContact O-CB 3.22Å; L122-M126 PolarHBondContact O-N 2.96Å; M123-M126 WeakPolarHBondContact O-CB 3.39Å; M123-M126 PolarHBondContact O-N 3.36Å; M123-M126 VanDerWaalsContact O-N 3.13Å; M123-M126 HydrophobicContact SD-CE 3.85Å; M126-Q129 WeakPolarHBondContact O-CG 3.27Å; M126-Q129 PolarHBondContact O-NE2 2.86Å; M126-R130 PolarHBondContact O-N 2.84Å; M126-N209 HydrophobicContact CE-CB 4.22Å; M126-N209 HydrophobicContact SD-CB 4.1Å; M126-L210 HydrophobicContact CB-CD1 4.15Å; M126-L210 HydrophobicContact CE-CB 4.44Å; M126-L210 HydrophobicContact SD-CB 4.16Å; M126-L210 HydrophobicContact SD-CD1 4.18Å; M126-F213 HydrophobicContact CB-CD1 4.11Å; M126-F213 HydrophobicContact CB-CE1 4.31Å; M126-F213 HydrophobicContact CG-CB 4.24Å; M126-F213 HydrophobicContact CG-CD1 4.1Å; M126-F213 HydrophobicContact CG-CG 4.04Å; M126-F213 HydrophobicContact SD-CB 4.05Å; M126-F213 HydrophobicContact SD-CG 4.48Å
127	Y	95.4	Very high	95.9	Very high	61 Å²	61	41.9 Å²	41.9	24%	0.239	20%	0.2	C	C	.	.	H	α-helix	trans	-71.3	-43.4	176.3	-63.1	-36.7	0	0	0	112.8	M123 N124 F125 R130 N131 E206	M123-Y127 HydrophobicContact CB-CE2 4.2Å; M123-Y127 VanDerWaalsContact O-CD2 3.23Å; M123-Y127 WeakPolarHBondContact O-CD2 3.43Å; M123-Y127 PolarHBondContact O-N 3.02Å; N124-Y127 PolarHBondContact O-N 3.33Å; F125-Y127 VanDerWaalsContact C-N 3.28Å; F125-Y127 PolarHBondContact O-N 2.91Å; Y127-R130 PolarHBondContact O-N 3.4Å; Y127-N131 WeakPolarHBondContact O-CB 3.47Å; Y127-N131 PolarHBondContact O-N 3.41Å; Y127-E206 WeakPolarHBondContact OH-CG 3.27Å; Y127-E206 PolarHBondContact OH-OE1 2.76Å; Y127-E206 PolarHBondContact OH-OE2 3.32Å
128	F	97.7	Very high	95.8	Very high	7 Å²	7	40.2 Å²	40.2	3%	0.031	20%	0.196	C	C	.	.	H	α-helix	trans	-55.9	-56.8	177.3	168.8	-97.7	0	0	0	110.8	M72 E75 Y79 N124 F125 R130 N131 A132 M167 L171	M72-F128 HydrophobicContact CG-CE2 3.82Å; M72-F128 HydrophobicContact CG-CZ 4.14Å; M72-F128 WeakPolarHBondContact O-CZ 3.23Å; E75-F128 HydrophobicContact CB-CE2 3.87Å; E75-F128 HydrophobicContact CG-CD2 3.87Å; E75-F128 HydrophobicContact CG-CE2 3.73Å; E75-F128 WeakPolarHBondContact OE1-CD2 3.21Å; Y79-F128 HydrophobicContact CD2-CB 4.07Å; Y79-F128 AromaticContact CD2-CD1 3.58Å; Y79-F128 HydrophobicContact CD2-CD1 3.58Å; Y79-F128 HydrophobicContact CD2-CD2 4.13Å; Y79-F128 HydrophobicContact CD2-CE1 4.07Å; Y79-F128 AromaticContact CD2-CG 3.63Å; Y79-F128 HydrophobicContact CD2-CG 3.63Å; Y79-F128 HydrophobicContact CE2-CB 3.51Å; Y79-F128 AromaticContact CE2-CD1 3.9Å; Y79-F128 HydrophobicContact CE2-CD1 3.9Å; 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 2.9Å; F125-F128 PolarHBondContact O-N 3.11Å; F128-R130 PolarHBondContact O-N 3.36Å; F128-N131 PolarHBondContact O-N 3.3Å; F128-N131 VanDerWaalsContact O-N 3.15Å; F128-A132 HydrophobicContact CE1-CB 4.33Å; F128-A132 HydrophobicContact CZ-CB 4.2Å; F128-A132 VanDerWaalsContact O-CB 3.31Å; F128-A132 WeakPolarHBondContact O-CB 3.5Å; F128-A132 PolarHBondContact O-N 3.4Å; F128-M167 HydrophobicContact CE1-CE 4.35Å; F128-M167 HydrophobicContact CE1-SD 4.42Å; F128-M167 HydrophobicContact CZ-CE 4.19Å; F128-M167 HydrophobicContact CZ-SD 4.12Å; F128-L171 HydrophobicContact CE1-CD1 3.89Å
129	Q	95.9	Very high	95.7	Very high	14 Å²	14	39.1 Å²	39.1	7%	0.065	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-34.5	-176.5	66.5	75.1	33.3	0	0	111.9	F125 M126 A132 I133 F213 I220	F125-Q129 HydrophobicContact CE2-CB 4.47Å; F125-Q129 WeakPolarHBondContact O-CG 3.32Å; F125-Q129 PolarHBondContact O-N 3.21Å; M126-Q129 WeakPolarHBondContact O-CG 3.27Å; M126-Q129 PolarHBondContact O-NE2 2.86Å; Q129-A132 PolarHBondContact O-N 3.2Å; Q129-I133 WeakPolarHBondContact O-CB 3.21Å; Q129-I133 VanDerWaalsContact O-CG1 3.23Å; Q129-I133 WeakPolarHBondContact O-CG1 3.25Å; Q129-I133 PolarHBondContact O-N 3.36Å; Q129-F213 HydrophobicContact CG-CE2 4Å; Q129-F213 HydrophobicContact CG-CZ 3.89Å; Q129-I220 HydrophobicContact CB-CD1 4.18Å; Q129-I220 HydrophobicContact CB-CG1 4.47Å; Q129-I220 HydrophobicContact CG-CD1 4.32Å; Q129-I220 HydrophobicContact CG-CG1 4.33Å
130	R	94.5	Very high	95.6	Very high	115 Å²	115	38.7 Å²	38.7	43%	0.434	19%	0.188	S	C	.	.	H	α-helix	trans	-65.2	-50.5	177.6	-179.1	175.4	64.7	-170.7	0.8	110.5	M126 Y127 F128 A132 I133 E134	M126-R130 PolarHBondContact O-N 2.84Å; Y127-R130 PolarHBondContact O-N 3.4Å; F128-R130 PolarHBondContact O-N 3.36Å; R130-A132 VanDerWaalsContact C-N 3.34Å; R130-A132 PolarHBondContact O-N 2.97Å; R130-I133 PolarHBondContact O-N 3.48Å; R130-E134 WeakPolarHBondContact CG-OE1 3.42Å; R130-E134 WeakPolarHBondContact O-CG 3.37Å; R130-E134 PolarHBondContact O-N 2.87Å
131	N	96.2	Very high	95.5	Very high	79 Å²	79	42.4 Å²	42.4	42%	0.422	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-40.7	177.6	-175.6	37.2	0	0	0	111.7	Y127 F128 E134 R135	Y127-N131 WeakPolarHBondContact O-CB 3.47Å; Y127-N131 PolarHBondContact O-N 3.41Å; F128-N131 PolarHBondContact O-N 3.3Å; F128-N131 VanDerWaalsContact O-N 3.15Å; N131-E134 PolarHBondContact O-N 2.95Å; N131-R135 WeakPolarHBondContact O-CB 3.47Å; N131-R135 PolarHBondContact O-N 3.34Å
132	A	96.1	Very high	95.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-43.2	179	0	0	0	0	0	112	M72 F128 Q129 R130 F136 M167 F168	M72-A132 HydrophobicContact CG-CB 4.39Å; M72-A132 HydrophobicContact SD-CB 3.85Å; F128-A132 HydrophobicContact CE1-CB 4.33Å; F128-A132 HydrophobicContact CZ-CB 4.2Å; F128-A132 VanDerWaalsContact O-CB 3.31Å; F128-A132 WeakPolarHBondContact O-CB 3.5Å; F128-A132 PolarHBondContact O-N 3.4Å; Q129-A132 PolarHBondContact O-N 3.2Å; R130-A132 VanDerWaalsContact C-N 3.34Å; R130-A132 PolarHBondContact O-N 2.97Å; A132-F136 VanDerWaalsContact O-CB 3.25Å; A132-F136 WeakPolarHBondContact O-CB 3.48Å; A132-F136 PolarHBondContact O-N 3.37Å; A132-M167 HydrophobicContact CB-CE 4.16Å; A132-F168 HydrophobicContact CB-CE1 3.86Å; A132-F168 HydrophobicContact CB-CZ 4.2Å
133	I	96.9	Very high	95	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-62.4	-49.7	173.8	-68.1	168.6	0	0	0	110.2	Q129 R130 R135 F136 C137 F168 I220 L224 Q227	Q129-I133 WeakPolarHBondContact O-CB 3.21Å; Q129-I133 VanDerWaalsContact O-CG1 3.23Å; Q129-I133 WeakPolarHBondContact O-CG1 3.25Å; Q129-I133 PolarHBondContact O-N 3.36Å; R130-I133 PolarHBondContact O-N 3.48Å; I133-R135 VanDerWaalsContact C-N 3.3Å; I133-R135 PolarHBondContact O-N 2.8Å; I133-F136 PolarHBondContact O-N 3.35Å; I133-C137 VanDerWaalsContact O-CB 3.32Å; I133-C137 WeakPolarHBondContact O-CB 3.38Å; I133-C137 PolarHBondContact O-N 3.38Å; I133-C137 PolarHBondContact O-SG 3.43Å; I133-C137 VanDerWaalsContact O-SG 3.4Å; I133-F168 HydrophobicContact CG1-CD1 4.1Å; I133-F168 HydrophobicContact CG1-CE1 3.67Å; I133-F168 HydrophobicContact CG1-CZ 4.01Å; I133-I220 HydrophobicContact CD1-CG2 4.01Å; I133-L224 HydrophobicContact CG2-CD1 4.18Å; I133-Q227 HydrophobicContact CG2-CB 4.49Å; I133-Q227 HydrophobicContact CG2-CG 4.45Å
134	E	94.8	Very high	94.8	Very high	98 Å²	98	42.4 Å²	42.4	46%	0.458	19%	0.192	S	C	.	.	H	α-helix	trans	-58.7	-43.3	-179.8	-75.3	171.7	-165.6	0	0	111.5	R130 N131 G138	R130-E134 WeakPolarHBondContact CG-OE1 3.42Å; R130-E134 WeakPolarHBondContact O-CG 3.37Å; R130-E134 PolarHBondContact O-N 2.87Å; N131-E134 PolarHBondContact O-N 2.95Å; E134-G138 PolarHBondContact O-N 3.37Å
135	R	95.1	Very high	94.5	Very high	98 Å²	98	44.2 Å²	44.2	37%	0.37	20%	0.198	S	C	.	.	H	α-helix	trans	-68.1	-44.4	179.1	-171.5	152.1	-175.1	-166.5	-4.9	112.3	S68 M69 M72 N131 I133 G138 E139	S68-R135 PolarHBondContact OG-NH2 3.47Å; M69-R135 HydrophobicContact SD-CG 4.13Å; M72-R135 HydrophobicContact SD-CB 4.43Å; N131-R135 WeakPolarHBondContact O-CB 3.47Å; N131-R135 PolarHBondContact O-N 3.34Å; I133-R135 VanDerWaalsContact C-N 3.3Å; I133-R135 PolarHBondContact O-N 2.8Å; R135-G138 PolarHBondContact O-N 2.93Å; R135-E139 PolarHBondContact O-N 3.04Å
136	F	96.3	Very high	93.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61	-51	174.5	175.3	-99.4	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 3.48Å; A132-F136 PolarHBondContact O-N 3.37Å; I133-F136 PolarHBondContact O-N 3.35Å; F136-G138 VanDerWaalsContact C-N 3.28Å; F136-G138 PolarHBondContact O-N 3.12Å; F136-E139 PolarHBondContact O-N 2.87Å; F136-E139 VanDerWaalsContact O-N 3.11Å; F136-V140 HydrophobicContact CD1-CG2 4.13Å; F136-V140 HydrophobicContact CE1-CG2 3.73Å; F136-V140 HydrophobicContact CE2-CG2 4.33Å; F136-V140 HydrophobicContact CZ-CG2 3.83Å; F136-V140 WeakPolarHBondContact O-CG2 3.42Å; F136-V140 PolarHBondContact O-N 3.3Å; F136-L161 HydrophobicContact CD2-CD2 3.99Å; F136-L161 HydrophobicContact CE2-CB 4.11Å; F136-L161 HydrophobicContact CE2-CD2 3.87Å; F136-F164 HydrophobicContact CB-CD1 4.22Å; F136-F164 HydrophobicContact CD2-CB 3.63Å; F136-F164 HydrophobicContact CD2-CD1 4.11Å; F136-F164 AromaticContact CD2-CG 3.98Å; F136-F164 HydrophobicContact CD2-CG 3.98Å; F136-F164 HydrophobicContact CE2-CB 3.83Å; F136-I165 HydrophobicContact CE1-CG2 3.99Å; F136-I165 HydrophobicContact CE2-CG2 4.12Å; F136-I165 HydrophobicContact CZ-CG2 3.46Å; F136-I165 VanDerWaalsContact CZ-CG2 3.46Å; F136-F168 HydrophobicContact CB-CE2 4.03Å; F136-F168 HydrophobicContact CB-CZ 4.06Å; F136-F168 HydrophobicContact CD1-CE2 4.02Å; F136-F168 HydrophobicContact CD2-CE2 4.49Å; F136-F168 AromaticContact CG-CE2 3.92Å; F136-F168 HydrophobicContact CG-CE2 3.92Å; F136-F168 HydrophobicContact CG-CZ 4.46Å; F136-L224 HydrophobicContact CD1-CD1 3.81Å; F136-L224 HydrophobicContact CE1-CD1 4.06Å; F136-L228 HydrophobicContact CE1-CD1 4.49Å; F136-L228 HydrophobicContact CE1-CD2 4.12Å
137	C	95.4	Very high	92.7	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.034	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-33	178	-70.9	0	0	0	0	112.3	I133 V140 R141 Q227 I231	I133-C137 VanDerWaalsContact O-CB 3.32Å; I133-C137 WeakPolarHBondContact O-CB 3.38Å; I133-C137 PolarHBondContact O-N 3.38Å; I133-C137 PolarHBondContact O-SG 3.43Å; I133-C137 VanDerWaalsContact O-SG 3.4Å; C137-V140 PolarHBondContact O-N 3.07Å; C137-R141 WeakPolarHBondContact O-CB 3.44Å; C137-R141 PolarHBondContact O-N 2.64Å; C137-Q227 HydrophobicContact CB-CB 4.23Å; C137-I231 HydrophobicContact CB-CD1 4.18Å; C137-I231 VanDerWaalsContact O-CD1 3.27Å; C137-I231 WeakPolarHBondContact O-CD1 3.45Å
138	G	94.1	Very high	92	Very high	34 Å²	34	54 Å²	54	35%	0.351	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-45	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 2.93Å; F136-G138 VanDerWaalsContact C-N 3.28Å; F136-G138 PolarHBondContact O-N 3.12Å; G138-R141 WeakPolarHBondContact O-CB 3.44Å; G138-R141 PolarHBondContact O-N 3.45Å; G138-R142 PolarHBondContact O-N 2.92Å
139	E	93.4	Very high	91	Very high	28 Å²	28	58.4 Å²	58.4	13%	0.131	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-41.5	174.7	-81.9	-61	120.5	0	0	112.7	M69 R135 F136 R141 R142 L143 Y157	M69-E139 HydrophobicContact CE-CG 4.41Å; M69-E139 HydrophobicContact SD-CG 4.43Å; R135-E139 PolarHBondContact O-N 3.04Å; F136-E139 PolarHBondContact O-N 2.87Å; F136-E139 VanDerWaalsContact O-N 3.11Å; E139-R141 VanDerWaalsContact C-N 3.32Å; E139-R141 PolarHBondContact O-N 3.24Å; E139-R142 WeakPolarHBondContact O-CB 3.5Å; E139-R142 PolarHBondContact O-N 3.03Å; E139-R142 IonicContact OE1-CZ 3.44Å; E139-R142 IonicContact OE1-NE 2.78Å; E139-R142 PolarHBondContact OE1-NE 3.39Å; E139-R142 IonicContact OE1-NH2 2.86Å; E139-R142 IonicContact OE2-CZ 3.02Å; E139-R142 VanDerWaalsContact OE2-CZ 3.3Å; E139-R142 IonicContact OE2-NE 2.73Å; E139-R142 PolarHBondContact OE2-NE 3.33Å; E139-R142 IonicContact OE2-NH2 3.7Å; E139-R142 PolarHBondContact OE2-NH2 2.79Å; E139-L143 WeakPolarHBondContact O-CG 3.36Å; E139-L143 PolarHBondContact O-N 3.06Å; E139-Y157 PolarHBondContact OE2-OH 3.4Å
140	V	94.4	Very high	90.2	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-58.1	-46.4	173	173.9	0	0	0	0	110.3	F136 C137 R142 L143 C144 L228 I231 L237	F136-V140 HydrophobicContact CD1-CG2 4.13Å; F136-V140 HydrophobicContact CE1-CG2 3.73Å; F136-V140 HydrophobicContact CE2-CG2 4.33Å; F136-V140 HydrophobicContact CZ-CG2 3.83Å; F136-V140 WeakPolarHBondContact O-CG2 3.42Å; F136-V140 PolarHBondContact O-N 3.3Å; C137-V140 PolarHBondContact O-N 3.07Å; V140-R142 VanDerWaalsContact C-N 3.33Å; V140-R142 PolarHBondContact O-N 3.03Å; V140-L143 PolarHBondContact O-N 2.92Å; V140-C144 WeakPolarHBondContact O-CB 3.17Å; V140-C144 PolarHBondContact O-N 2.91Å; V140-C144 PolarHBondContact O-SG 3.43Å; V140-C144 VanDerWaalsContact O-SG 3.34Å; V140-L228 HydrophobicContact CB-CD2 4.25Å; V140-L228 HydrophobicContact CG1-CD2 3.97Å; V140-L228 HydrophobicContact CG2-CD2 4.05Å; V140-I231 HydrophobicContact CB-CD1 4.35Å; V140-I231 HydrophobicContact CG1-CD1 4.21Å; V140-L237 HydrophobicContact CB-CD2 4.14Å; V140-L237 HydrophobicContact CG1-CD2 4.03Å; V140-L237 HydrophobicContact CG2-CD2 3.97Å
141	R	93.1	Very high	89.4	Confident	150 Å²	150	60.6 Å²	60.6	57%	0.566	29%	0.289	S	S	*	.	H	α-helix	trans	-59.3	-43.5	177	-173.9	-179.1	-63.4	-156.1	-0.7	111.8	C137 G138 E139 C144 H145 I231	C137-R141 WeakPolarHBondContact O-CB 3.44Å; C137-R141 PolarHBondContact O-N 2.64Å; G138-R141 WeakPolarHBondContact O-CB 3.44Å; G138-R141 PolarHBondContact O-N 3.45Å; E139-R141 VanDerWaalsContact C-N 3.32Å; E139-R141 PolarHBondContact O-N 3.24Å; R141-C144 PolarHBondContact O-N 3.2Å; R141-H145 PolarHBondContact O-N 3.33Å; R141-I231 HydrophobicContact CB-CD1 3.96Å; R141-I231 HydrophobicContact CB-CG1 4.26Å; R141-I231 HydrophobicContact CB-CG2 4.29Å; R141-I231 HydrophobicContact CG-CG2 4.49Å
142	R	90.8	Very high	88.8	Confident	95 Å²	95	58.2 Å²	58.2	36%	0.358	27%	0.274	S	S	.	.	H	α-helix	trans	-62	-45.3	178.4	-170.5	-177.1	70	86.2	1	111.7	G138 E139 V140 R148	G138-R142 PolarHBondContact O-N 2.92Å; E139-R142 WeakPolarHBondContact O-CB 3.5Å; E139-R142 PolarHBondContact O-N 3.03Å; E139-R142 IonicContact OE1-CZ 3.44Å; E139-R142 IonicContact OE1-NE 2.78Å; E139-R142 PolarHBondContact OE1-NE 3.39Å; E139-R142 IonicContact OE1-NH2 2.86Å; E139-R142 IonicContact OE2-CZ 3.02Å; E139-R142 VanDerWaalsContact OE2-CZ 3.3Å; E139-R142 IonicContact OE2-NE 2.73Å; E139-R142 PolarHBondContact OE2-NE 3.33Å; E139-R142 IonicContact OE2-NH2 3.7Å; E139-R142 PolarHBondContact OE2-NH2 2.79Å; V140-R142 VanDerWaalsContact C-N 3.33Å; V140-R142 PolarHBondContact O-N 3.03Å; R142-R148 WeakPolarHBondContact O-CG 3.29Å
143	L	89.9	Confident	88.4	Confident	9 Å²	9	59.7 Å²	59.7	5%	0.047	28%	0.283	C	S	.	.	H	α-helix	trans	-75.8	-28	-178.7	-65.6	177.9	0	0	0	113.2	E139 V140 R149 V153 Y157 L161 L237	E139-L143 WeakPolarHBondContact O-CG 3.36Å; E139-L143 PolarHBondContact O-N 3.06Å; V140-L143 PolarHBondContact O-N 2.92Å; L143-R149 PolarHBondContact O-N 3.43Å; L143-V153 HydrophobicContact CD2-CG2 4.08Å; L143-Y157 HydrophobicContact CD1-CD1 4.49Å; L143-Y157 HydrophobicContact CD1-CE1 4.02Å; L143-L161 HydrophobicContact CD1-CD1 3.86Å; L143-L237 HydrophobicContact CB-CD1 4.43Å; L143-L237 HydrophobicContact CB-CD2 4.04Å; L143-L237 HydrophobicContact CD1-CD1 4.13Å; L143-L237 HydrophobicContact CD1-CD2 3.95Å
144	C	90.3	Very high	88	Confident	8 Å²	8	59.7 Å²	59.7	5%	0.054	28%	0.283	C	S	.	.	H	α-helix	trans	-83	-6.6	179.7	-75	0	0	0	0	114.7	V140 R141 R149 I231 G233	V140-C144 WeakPolarHBondContact O-CB 3.17Å; V140-C144 PolarHBondContact O-N 2.91Å; V140-C144 PolarHBondContact O-SG 3.43Å; V140-C144 VanDerWaalsContact O-SG 3.34Å; R141-C144 PolarHBondContact O-N 3.2Å; C144-R149 PolarHBondContact O-NE 2.97Å; C144-R149 PolarHBondContact O-NH2 3.31Å; C144-I231 HydrophobicContact CB-CG2 4.22Å; C144-G233 PolarHBondContact SG-O 3.27Å; C144-G233 VanDerWaalsContact SG-O 3.33Å
145	H	90	Very high	87.9	Confident	114 Å²	114	57.5 Å²	57.5	53%	0.528	27%	0.273	S	S	.	.	S	Bend	trans	-52.4	141.8	176.5	-176.4	-98.7	0	0	0	111.5	R141 E147 R148 R149	R141-H145 PolarHBondContact O-N 3.33Å; H145-E147 PolarHBondContact ND1-N 3.24Å; H145-E147 PolarHBondContact O-N 3.47Å; H145-R148 HydrophobicContact CB-CB 4.01Å; H145-R148 CarbonylContact O-C 3.59Å; H145-R148 PolarHBondContact O-N 2.73Å; H145-R149 WeakPolarHBondContact O-CB 3.38Å; H145-R149 PolarHBondContact O-N 2.79Å
146	A	79.3	Confident	87.6	Confident	78 Å²	78	54.6 Å²	54.6	65%	0.645	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-34.7	-169.1	0	0	0	0	0	114.2
147	E	76.6	Confident	87.4	Confident	149 Å²	149	54.7 Å²	54.7	70%	0.696	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-34.8	176.7	-160.4	167.9	-161	0	0	112.4	H145 K150	H145-E147 PolarHBondContact ND1-N 3.24Å; H145-E147 PolarHBondContact O-N 3.47Å; E147-K150 PolarHBondContact O-N 2.63Å
148	R	80.2	Confident	87.3	Confident	52 Å²	52	55.1 Å²	55.1	20%	0.196	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-77.3	-26.5	-179.1	-168.9	60.8	-178.1	-172.2	-6.7	113.2	R142 H145 K150 D151	R142-R148 WeakPolarHBondContact O-CG 3.29Å; H145-R148 HydrophobicContact CB-CB 4.01Å; H145-R148 CarbonylContact O-C 3.59Å; H145-R148 PolarHBondContact O-N 2.73Å; R148-K150 PolarHBondContact O-N 2.9Å; R148-K150 VanDerWaalsContact O-N 3.15Å; R148-D151 VanDerWaalsContact CD-OD2 3.32Å; R148-D151 WeakPolarHBondContact CD-OD2 3.25Å; R148-D151 IonicContact CZ-OD2 2.75Å; R148-D151 IonicContact NE-OD2 3.3Å; R148-D151 IonicContact NH1-OD2 3.48Å; R148-D151 PolarHBondContact NH1-OD2 3.38Å; R148-D151 VanDerWaalsContact O-CB 3.29Å; R148-D151 WeakPolarHBondContact O-CB 3.44Å; R148-D151 PolarHBondContact O-N 2.92Å
149	R	78.1	Confident	87.3	Confident	99 Å²	99	54.9 Å²	54.9	37%	0.374	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-60	-24.9	173.4	-172.1	178.9	-58.9	-138.8	-5.7	112.6	L143 C144 H145 D151 S232 G233	L143-R149 PolarHBondContact O-N 3.43Å; C144-R149 PolarHBondContact O-NE 2.97Å; C144-R149 PolarHBondContact O-NH2 3.31Å; H145-R149 WeakPolarHBondContact O-CB 3.38Å; H145-R149 PolarHBondContact O-N 2.79Å; R149-D151 VanDerWaalsContact C-N 3.31Å; R149-S232 PolarHBondContact NH2-O 3.34Å; R149-G233 PolarHBondContact NH1-O 2.84Å; R149-G233 VanDerWaalsContact NH2-CA 3.32Å; R149-G233 PolarHBondContact NH2-O 3.22Å
150	K	78.4	Confident	87.3	Confident	116 Å²	116	53.9 Å²	53.9	50%	0.504	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-85.6	-4.7	178	-64.3	-177.3	175.3	-176.4	0	112.8	E147 R148 S574 G575	E147-K150 PolarHBondContact O-N 2.63Å; R148-K150 PolarHBondContact O-N 2.9Å; R148-K150 VanDerWaalsContact O-N 3.15Å; K150-S574 CarbonylContact O-C 3.6Å; K150-S574 VanDerWaalsContact O-CA 3.27Å; K150-S574 WeakPolarHBondContact O-CA 3.46Å; K150-G575 PolarHBondContact O-N 3.45Å
151	D	78.4	Confident	87.3	Confident	59 Å²	59	53.8 Å²	53.8	32%	0.316	26%	0.258	S	S	.	.	S	Bend	trans	-94.2	156.6	-178.2	-84.8	-15.4	0	0	0	112.4	R58 R148 R149	R58-D151 IonicContact CZ-OD2 3.1Å; R58-D151 IonicContact NH1-OD1 2.74Å; R58-D151 IonicContact NH1-OD2 3.78Å; R58-D151 IonicContact NH2-OD2 2.73Å; R148-D151 VanDerWaalsContact CD-OD2 3.32Å; R148-D151 WeakPolarHBondContact CD-OD2 3.25Å; R148-D151 IonicContact CZ-OD2 2.75Å; R148-D151 IonicContact NE-OD2 3.3Å; R148-D151 IonicContact NH1-OD2 3.48Å; R148-D151 PolarHBondContact NH1-OD2 3.38Å; R148-D151 VanDerWaalsContact O-CB 3.29Å; R148-D151 WeakPolarHBondContact O-CB 3.44Å; R148-D151 PolarHBondContact O-N 2.92Å; R149-D151 VanDerWaalsContact C-N 3.31Å
152	F	83.2	Confident	87.4	Confident	28 Å²	28	46.7 Å²	46.7	12%	0.123	23%	0.232	C	C	.	.			trans	-64.3	134.6	170.8	171.2	-101.8	0	0	0	112.4	R58 Y59 T564 E567 A571	R58-F152 PolarHBondContact NH2-O 2.75Å; Y59-F152 HydrophobicContact CE1-CE1 4.48Å; F152-T564 HydrophobicContact CE1-CG2 4.15Å; F152-E567 HydrophobicContact CE2-CB 4.18Å; F152-E567 HydrophobicContact CE2-CG 3.81Å; F152-E567 VanDerWaalsContact CE2-OE1 3.24Å; F152-E567 WeakPolarHBondContact CE2-OE1 3.44Å; F152-E567 HydrophobicContact CZ-CB 3.83Å; F152-E567 VanDerWaalsContact CZ-CD 3.46Å; F152-E567 HydrophobicContact CZ-CG 3.8Å; F152-E567 VanDerWaalsContact CZ-OE1 3.28Å; F152-E567 WeakPolarHBondContact CZ-OE1 3.47Å; F152-A571 HydrophobicContact CD2-CB 3.64Å; F152-A571 HydrophobicContact CE2-CB 4.07Å
153	V	86.9	Confident	87.6	Confident	31 Å²	31	46.3 Å²	46.3	19%	0.188	23%	0.233	C	C	.	.			trans	-123.9	135.3	168.8	-174.6	0	0	0	0	107	L143 Y157 L158	L143-V153 HydrophobicContact CD2-CG2 4.08Å; V153-Y157 HydrophobicContact CG1-CD1 3.95Å; V153-L158 HydrophobicContact CG1-CD2 3.91Å; V153-L158 HydrophobicContact CG1-CG 4.04Å
154	S	89.8	Confident	87.9	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.007	23%	0.23	C	C	.	.			trans	-72.5	140.5	-178.2	175.4	0	0	0	0	111.4	A156 Y157 L158 E567	S154-A156 VanDerWaalsContact C-N 3.26Å; S154-A156 PolarHBondContact O-N 3.04Å; S154-A156 PolarHBondContact OG-N 3.22Å; S154-Y157 WeakPolarHBondContact O-CB 3.47Å; S154-Y157 PolarHBondContact O-N 3.02Å; S154-L158 PolarHBondContact O-N 3.2Å; S154-E567 VanDerWaalsContact CA-OE1 3.29Å; S154-E567 WeakPolarHBondContact CA-OE1 3.42Å; S154-E567 PolarHBondContact OG-OE2 3.48Å
155	E	91.8	Very high	88.1	Confident	52 Å²	52	45.5 Å²	45.5	24%	0.243	23%	0.228	C	C	.	.	H	α-helix	trans	-49.5	-46.1	171.8	-74.7	175.2	-159.7	0	0	111.9	Y157 L158 I159 L244 Y248 E567 H596	E155-Y157 PolarHBondContact O-N 3.26Å; E155-L158 WeakPolarHBondContact O-CB 3.39Å; E155-L158 PolarHBondContact O-N 3.03Å; E155-L158 VanDerWaalsContact O-N 3.11Å; E155-I159 WeakPolarHBondContact O-CG1 3.46Å; E155-I159 PolarHBondContact O-N 3.43Å; E155-L244 HydrophobicContact CB-CD1 4.22Å; E155-L244 HydrophobicContact CB-CD2 3.84Å; E155-L244 HydrophobicContact CG-CD1 3.68Å; E155-L244 HydrophobicContact CG-CD2 4.06Å; E155-L244 WeakPolarHBondContact O-CD2 3.21Å; E155-Y248 WeakPolarHBondContact CB-OH 3.44Å; E155-Y248 WeakPolarHBondContact OE2-CE1 3.15Å; E155-Y248 PolarHBondContact OE2-OH 3.5Å; E155-E567 VanDerWaalsContact CG-OE1 3.3Å; E155-E567 WeakPolarHBondContact CG-OE1 3.49Å; E155-E567 PolarHBondContact N-OE1 3.36Å; E155-E567 PolarHBondContact N-OE2 2.78Å; E155-H596 IonicContact OE2-CE1 2.85Å
156	A	89.3	Confident	88.4	Confident	38 Å²	38	40.6 Å²	40.6	31%	0.314	21%	0.206	S	C	.	.	H	α-helix	trans	-60.1	-36.7	179.7	0	0	0	0	0	112.1	S154 T160 Y560	S154-A156 VanDerWaalsContact C-N 3.26Å; S154-A156 PolarHBondContact O-N 3.04Å; S154-A156 PolarHBondContact OG-N 3.22Å; A156-T160 PolarHBondContact O-N 3.44Å; A156-T160 VanDerWaalsContact O-N 3.11Å; A156-T160 PolarHBondContact O-OG1 3.14Å; A156-Y560 HydrophobicContact CB-CE2 4.23Å
157	Y	91.4	Very high	89.3	Confident	1 Å²	1	37.5 Å²	37.5	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-73.5	-36.8	177.3	-168.3	-126.5	0	0	0	111.9	V65 H66 M69 E139 L143 V153 S154 E155 I159 T160 L161	V65-Y157 HydrophobicContact CG1-CE2 4.44Å; V65-Y157 WeakPolarHBondContact CG1-OH 3.19Å; H66-Y157 HydrophobicContact CB-CD2 3.86Å; H66-Y157 HydrophobicContact CB-CE2 4.19Å; H66-Y157 AromaticContact CD2-CD2 3.69Å; H66-Y157 AromaticContact CG-CD2 3.71Å; M69-Y157 HydrophobicContact CG-CE2 4.29Å; E139-Y157 PolarHBondContact OE2-OH 3.4Å; L143-Y157 HydrophobicContact CD1-CD1 4.49Å; L143-Y157 HydrophobicContact CD1-CE1 4.02Å; V153-Y157 HydrophobicContact CG1-CD1 3.95Å; S154-Y157 WeakPolarHBondContact O-CB 3.47Å; S154-Y157 PolarHBondContact O-N 3.02Å; E155-Y157 PolarHBondContact O-N 3.26Å; Y157-I159 VanDerWaalsContact C-N 3.33Å; Y157-I159 PolarHBondContact O-N 3.3Å; Y157-T160 WeakPolarHBondContact O-CB 3.15Å; Y157-T160 PolarHBondContact O-N 3.34Å; Y157-L161 HydrophobicContact CD1-CD1 4.31Å; Y157-L161 HydrophobicContact CE1-CD1 4.19Å; Y157-L161 WeakPolarHBondContact O-CG 3.36Å; Y157-L161 PolarHBondContact O-N 3.47Å
158	L	93.1	Very high	90.3	Very high	15 Å²	15	30.4 Å²	30.4	8%	0.079	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-39.7	173.1	-67.9	176.8	0	0	0	111.7	V153 S154 E155 L161 G162 L237 D240 I241 L244	V153-L158 HydrophobicContact CG1-CD2 3.91Å; V153-L158 HydrophobicContact CG1-CG 4.04Å; S154-L158 PolarHBondContact O-N 3.2Å; E155-L158 WeakPolarHBondContact O-CB 3.39Å; E155-L158 PolarHBondContact O-N 3.03Å; E155-L158 VanDerWaalsContact O-N 3.11Å; L158-L161 PolarHBondContact O-N 3Å; L158-G162 PolarHBondContact O-N 3.45Å; L158-L237 HydrophobicContact CD2-CD1 3.81Å; L158-D240 HydrophobicContact CD1-CB 4.35Å; L158-I241 HydrophobicContact CB-CG1 4.27Å; L158-I241 HydrophobicContact CD2-CG1 3.96Å; L158-L244 HydrophobicContact CB-CD2 3.74Å; L158-L244 HydrophobicContact CD1-CD2 4.19Å
159	I	94.4	Very high	91	Very high	29 Å²	29	28 Å²	28	15%	0.149	14%	0.137	C	C	.	.	H	α-helix	trans	-63.1	-42.1	173.8	-67	-59.3	0	0	0	111.1	E155 Y157 L161 G162 K163 L244 Y248 L263	E155-I159 WeakPolarHBondContact O-CG1 3.46Å; E155-I159 PolarHBondContact O-N 3.43Å; Y157-I159 VanDerWaalsContact C-N 3.33Å; Y157-I159 PolarHBondContact O-N 3.3Å; I159-L161 PolarHBondContact O-N 3.49Å; I159-G162 CarbonylContact O-C 3.59Å; I159-G162 WeakPolarHBondContact O-CA 3.08Å; I159-G162 PolarHBondContact O-N 3.49Å; I159-G162 VanDerWaalsContact O-N 3.1Å; I159-K163 WeakPolarHBondContact O-CG 3.49Å; I159-K163 PolarHBondContact O-N 2.89Å; I159-L244 HydrophobicContact CD1-CD2 3.85Å; I159-L244 HydrophobicContact CD1-CG 4.12Å; I159-L244 HydrophobicContact CG1-CD2 3.83Å; I159-Y248 HydrophobicContact CD1-CD2 4.03Å; I159-Y248 HydrophobicContact CD1-CE2 4.1Å; I159-Y248 HydrophobicContact CG1-CD2 4.36Å; I159-Y248 HydrophobicContact CG1-CE2 3.93Å; I159-L263 HydrophobicContact CD1-CD2 4.17Å
160	T	93.9	Very high	91.8	Very high	6 Å²	6	23.7 Å²	23.7	4%	0.037	12%	0.121	C	C	.	.	H	α-helix	trans	-60.4	-45.5	174.2	-65	0	0	0	0	111.7	H66 M69 N70 L73 A156 Y157 G162 K163 F164	H66-T160 PolarHBondContact NE2-OG1 3.38Å; M69-T160 HydrophobicContact CB-CG2 4.27Å; N70-T160 VanDerWaalsContact OD1-CG2 3.28Å; N70-T160 WeakPolarHBondContact OD1-CG2 3.29Å; N70-T160 PolarHBondContact OD1-OG1 3.04Å; L73-T160 HydrophobicContact CD1-CG2 3.93Å; A156-T160 PolarHBondContact O-N 3.44Å; A156-T160 VanDerWaalsContact O-N 3.11Å; A156-T160 PolarHBondContact O-OG1 3.14Å; Y157-T160 WeakPolarHBondContact O-CB 3.15Å; Y157-T160 PolarHBondContact O-N 3.34Å; T160-G162 VanDerWaalsContact C-N 3.26Å; T160-G162 PolarHBondContact O-N 3.31Å; T160-K163 WeakPolarHBondContact O-CB 3.23Å; T160-K163 PolarHBondContact O-N 3.45Å; T160-F164 HydrophobicContact CG2-CD2 4.28Å; T160-F164 HydrophobicContact CG2-CE2 4.18Å; T160-F164 WeakPolarHBondContact O-CD2 3.46Å; T160-F164 PolarHBondContact O-N 3.34Å
161	L	94.5	Very high	92.7	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.7	-34.3	173.4	-65.3	176.6	0	0	0	112.3	M69 F136 L143 Y157 L158 I159 F164 I165 L237 I241	M69-L161 HydrophobicContact CE-CD2 3.97Å; F136-L161 HydrophobicContact CD2-CD2 3.99Å; F136-L161 HydrophobicContact CE2-CB 4.11Å; F136-L161 HydrophobicContact CE2-CD2 3.87Å; L143-L161 HydrophobicContact CD1-CD1 3.86Å; Y157-L161 HydrophobicContact CD1-CD1 4.31Å; Y157-L161 HydrophobicContact CE1-CD1 4.19Å; Y157-L161 WeakPolarHBondContact O-CG 3.36Å; Y157-L161 PolarHBondContact O-N 3.47Å; L158-L161 PolarHBondContact O-N 3Å; I159-L161 PolarHBondContact O-N 3.49Å; L161-F164 WeakPolarHBondContact O-CB 3.44Å; L161-F164 PolarHBondContact O-N 3.35Å; L161-I165 PolarHBondContact O-N 3.46Å; L161-L237 HydrophobicContact CD1-CD2 4.4Å; L161-I241 HydrophobicContact CB-CD1 3.64Å; L161-I241 HydrophobicContact CD1-CD1 4.5Å
162	G	94.8	Very high	93.6	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.01	8%	0.082	C	C	.	.	H	α-helix	trans	-60.7	-46.8	169.2	0	0	0	0	0	112.6	L158 I159 T160 F164 I165 N166 V266	L158-G162 PolarHBondContact O-N 3.45Å; I159-G162 CarbonylContact O-C 3.59Å; I159-G162 WeakPolarHBondContact O-CA 3.08Å; I159-G162 PolarHBondContact O-N 3.49Å; I159-G162 VanDerWaalsContact O-N 3.1Å; T160-G162 VanDerWaalsContact C-N 3.26Å; T160-G162 PolarHBondContact O-N 3.31Å; G162-F164 PolarHBondContact O-N 3.31Å; G162-I165 WeakPolarHBondContact O-CG1 3.36Å; G162-I165 PolarHBondContact O-N 3.24Å; G162-N166 PolarHBondContact O-N 3.3Å; G162-N166 VanDerWaalsContact O-N 3.1Å; G162-V266 VanDerWaalsContact O-CG2 3.3Å; G162-V266 WeakPolarHBondContact O-CG2 3.32Å
163	K	94.8	Very high	94.1	Very high	86 Å²	86	16.1 Å²	16.1	37%	0.374	9%	0.086	S	C	.	.	H	α-helix	trans	-60	-34.2	175.2	-67.8	179.6	-178.3	-176.3	0	112.1	L73 I159 T160 N166 M167 M262	L73-K163 HydrophobicContact CD1-CB 3.79Å; L73-K163 HydrophobicContact CD1-CD 4.19Å; L73-K163 HydrophobicContact CD2-CB 4.07Å; I159-K163 WeakPolarHBondContact O-CG 3.49Å; I159-K163 PolarHBondContact O-N 2.89Å; T160-K163 WeakPolarHBondContact O-CB 3.23Å; T160-K163 PolarHBondContact O-N 3.45Å; K163-N166 PolarHBondContact O-N 3.35Å; K163-M167 WeakPolarHBondContact O-CB 3.41Å; K163-M167 PolarHBondContact O-N 3.26Å; K163-M262 HydrophobicContact CG-CE 4.33Å; K163-M262 HydrophobicContact CG-CG 4.25Å; K163-M262 HydrophobicContact CG-SD 4.22Å
164	F	96.3	Very high	94.5	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.7	-47.5	173.9	-94.9	-99	0	0	0	112.5	M69 M72 L73 F136 T160 L161 G162 N166 M167 F168	M69-F164 HydrophobicContact CB-CE2 3.85Å; M69-F164 HydrophobicContact CB-CZ 4.1Å; M69-F164 HydrophobicContact CE-CD1 4.28Å; M69-F164 HydrophobicContact CE-CD2 4.02Å; M69-F164 HydrophobicContact CE-CE1 3.84Å; M69-F164 HydrophobicContact CE-CE2 3.57Å; M69-F164 HydrophobicContact CE-CG 4.35Å; M69-F164 HydrophobicContact CE-CZ 3.45Å; M69-F164 VanDerWaalsContact CE-CZ 3.45Å; M69-F164 WeakPolarHBondContact O-CE2 3.48Å; M69-F164 VanDerWaalsContact O-CZ 3.23Å; M69-F164 WeakPolarHBondContact O-CZ 3.23Å; M69-F164 HydrophobicContact SD-CE1 4.49Å; M69-F164 HydrophobicContact SD-CE2 4.34Å; M69-F164 HydrophobicContact SD-CZ 3.89Å; M72-F164 HydrophobicContact CB-CE1 4.45Å; M72-F164 HydrophobicContact CB-CZ 4Å; M72-F164 HydrophobicContact CG-CE1 4.08Å; M72-F164 HydrophobicContact CG-CZ 4.14Å; M72-F164 HydrophobicContact SD-CE1 3.92Å; M72-F164 HydrophobicContact SD-CZ 4.24Å; L73-F164 HydrophobicContact CD1-CD2 4.09Å; L73-F164 HydrophobicContact CD1-CE2 4.01Å; L73-F164 HydrophobicContact CD2-CD2 3.59Å; L73-F164 HydrophobicContact CD2-CE2 3.83Å; L73-F164 HydrophobicContact CD2-CG 4.02Å; L73-F164 HydrophobicContact CD2-CZ 4.44Å; L73-F164 HydrophobicContact CG-CD2 3.8Å; L73-F164 HydrophobicContact CG-CE2 3.55Å; L73-F164 HydrophobicContact CG-CZ 4.23Å; F136-F164 HydrophobicContact CB-CD1 4.22Å; F136-F164 HydrophobicContact CD2-CB 3.63Å; F136-F164 HydrophobicContact CD2-CD1 4.11Å; F136-F164 AromaticContact CD2-CG 3.98Å; F136-F164 HydrophobicContact CD2-CG 3.98Å; F136-F164 HydrophobicContact CE2-CB 3.83Å; T160-F164 HydrophobicContact CG2-CD2 4.28Å; T160-F164 HydrophobicContact CG2-CE2 4.18Å; T160-F164 WeakPolarHBondContact O-CD2 3.46Å; T160-F164 PolarHBondContact O-N 3.34Å; L161-F164 WeakPolarHBondContact O-CB 3.44Å; L161-F164 PolarHBondContact O-N 3.35Å; G162-F164 PolarHBondContact O-N 3.31Å; F164-N166 VanDerWaalsContact C-N 3.27Å; F164-N166 PolarHBondContact O-N 2.98Å; F164-M167 HydrophobicContact CD1-CE 3.95Å; F164-M167 HydrophobicContact CE1-CE 4.2Å; F164-M167 WeakPolarHBondContact O-CB 3.35Å; F164-M167 PolarHBondContact O-N 3.42Å; F164-M167 VanDerWaalsContact O-N 3.13Å; F164-F168 HydrophobicContact CB-CE2 4.35Å; F164-F168 HydrophobicContact CD1-CE2 4.3Å; F164-F168 HydrophobicContact CD1-CZ 4.12Å; F164-F168 WeakPolarHBondContact O-CD2 3.39Å; F164-F168 WeakPolarHBondContact O-CG 3.43Å; F164-F168 PolarHBondContact O-N 2.77Å
165	I	95.2	Very high	94.8	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-63.9	-36.8	177.7	66.6	166	0	0	0	111.2	F136 L161 G162 F168 A169 V266 F269 L273	F136-I165 HydrophobicContact CE1-CG2 3.99Å; F136-I165 HydrophobicContact CE2-CG2 4.12Å; F136-I165 HydrophobicContact CZ-CG2 3.46Å; F136-I165 VanDerWaalsContact CZ-CG2 3.46Å; L161-I165 PolarHBondContact O-N 3.46Å; G162-I165 WeakPolarHBondContact O-CG1 3.36Å; G162-I165 PolarHBondContact O-N 3.24Å; I165-F168 PolarHBondContact O-N 2.72Å; I165-A169 PolarHBondContact O-N 3.22Å; I165-A169 VanDerWaalsContact O-N 3.13Å; I165-V266 HydrophobicContact CD1-CG1 4.04Å; I165-V266 HydrophobicContact CG1-CG1 4.39Å; I165-F269 HydrophobicContact CB-CD1 4Å; I165-F269 HydrophobicContact CB-CE1 4.41Å; I165-F269 HydrophobicContact CG1-CD1 4.49Å; I165-F269 WeakPolarHBondContact O-CD1 3.22Å; I165-F269 WeakPolarHBondContact O-CE1 3.32Å; I165-L273 HydrophobicContact CB-CD1 4.21Å; I165-L273 HydrophobicContact CG2-CD1 4.06Å
166	N	95.9	Very high	94.8	Very high	10 Å²	10	13.8 Å²	13.8	5%	0.053	7%	0.073	C	C	.	.	H	α-helix	trans	-65.3	-40.6	172.4	177.6	87	0	0	0	112.3	G162 K163 F164 F168 A169 V170 M262 K265 V266	G162-N166 PolarHBondContact O-N 3.3Å; G162-N166 VanDerWaalsContact O-N 3.1Å; K163-N166 PolarHBondContact O-N 3.35Å; F164-N166 VanDerWaalsContact C-N 3.27Å; F164-N166 PolarHBondContact O-N 2.98Å; N166-F168 VanDerWaalsContact C-N 3.3Å; N166-F168 PolarHBondContact O-N 2.74Å; N166-A169 WeakPolarHBondContact O-CB 3.44Å; N166-A169 PolarHBondContact O-N 2.85Å; N166-A169 VanDerWaalsContact O-N 3.15Å; N166-V170 WeakPolarHBondContact O-CG2 3.39Å; N166-V170 PolarHBondContact O-N 3.21Å; N166-M262 HydrophobicContact CB-CE 4.46Å; N166-M262 HydrophobicContact CB-SD 3.56Å; N166-M262 VanDerWaalsContact CB-SD 3.56Å; N166-M262 WeakPolarHBondContact ND2-CE 3.5Å; N166-K265 WeakPolarHBondContact OD1-CB 3.49Å; N166-K265 WeakPolarHBondContact OD1-CD 3.47Å; N166-K265 WeakPolarHBondContact OD1-CE 3.08Å; N166-V266 HydrophobicContact CB-CG2 4.27Å
167	M	97.5	Very high	94.8	Very high	13 Å²	13	13 Å²	13	6%	0.064	6%	0.064	C	C	.	.	H	α-helix	trans	-57.8	-43.9	176	-180	-168.5	74.3	0	0	110.8	L73 F128 A132 K163 F164 A169 V170 L171	L73-M167 HydrophobicContact CD2-CB 4.13Å; L73-M167 HydrophobicContact CD2-SD 3.95Å; F128-M167 HydrophobicContact CE1-CE 4.35Å; F128-M167 HydrophobicContact CE1-SD 4.42Å; F128-M167 HydrophobicContact CZ-CE 4.19Å; F128-M167 HydrophobicContact CZ-SD 4.12Å; A132-M167 HydrophobicContact CB-CE 4.16Å; K163-M167 WeakPolarHBondContact O-CB 3.41Å; K163-M167 PolarHBondContact O-N 3.26Å; F164-M167 HydrophobicContact CD1-CE 3.95Å; F164-M167 HydrophobicContact CE1-CE 4.2Å; F164-M167 WeakPolarHBondContact O-CB 3.35Å; F164-M167 PolarHBondContact O-N 3.42Å; F164-M167 VanDerWaalsContact O-N 3.13Å; M167-A169 PolarHBondContact O-N 3.42Å; M167-V170 PolarHBondContact O-N 3.19Å; M167-L171 HydrophobicContact CG-CD1 3.91Å; M167-L171 HydrophobicContact CG-CG 4.41Å; M167-L171 WeakPolarHBondContact O-CB 3.39Å; M167-L171 VanDerWaalsContact O-CG 3.3Å; M167-L171 WeakPolarHBondContact O-CG 3.29Å; M167-L171 PolarHBondContact O-N 3.41Å
168	F	97.5	Very high	94.9	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62	-43	175.1	-62.1	-50.5	0	0	0	112.1	A132 I133 F136 F164 I165 N166 L171 D172 I220 L224	A132-F168 HydrophobicContact CB-CE1 3.86Å; A132-F168 HydrophobicContact CB-CZ 4.2Å; I133-F168 HydrophobicContact CG1-CD1 4.1Å; I133-F168 HydrophobicContact CG1-CE1 3.67Å; I133-F168 HydrophobicContact CG1-CZ 4.01Å; F136-F168 HydrophobicContact CB-CE2 4.03Å; F136-F168 HydrophobicContact CB-CZ 4.06Å; F136-F168 HydrophobicContact CD1-CE2 4.02Å; F136-F168 HydrophobicContact CD2-CE2 4.49Å; F136-F168 AromaticContact CG-CE2 3.92Å; F136-F168 HydrophobicContact CG-CE2 3.92Å; F136-F168 HydrophobicContact CG-CZ 4.46Å; F164-F168 HydrophobicContact CB-CE2 4.35Å; F164-F168 HydrophobicContact CD1-CE2 4.3Å; F164-F168 HydrophobicContact CD1-CZ 4.12Å; F164-F168 WeakPolarHBondContact O-CD2 3.39Å; F164-F168 WeakPolarHBondContact O-CG 3.43Å; F164-F168 PolarHBondContact O-N 2.77Å; I165-F168 PolarHBondContact O-N 2.72Å; N166-F168 VanDerWaalsContact C-N 3.3Å; N166-F168 PolarHBondContact O-N 2.74Å; F168-L171 PolarHBondContact O-N 3.44Å; F168-D172 WeakPolarHBondContact O-CB 3.3Å; F168-D172 PolarHBondContact O-N 3.32Å; F168-I220 HydrophobicContact CB-CG2 4.02Å; F168-I220 HydrophobicContact CD1-CG2 3.94Å; F168-I220 HydrophobicContact CG-CG2 4.33Å; F168-L224 HydrophobicContact CB-CD2 4.18Å; F168-L224 HydrophobicContact CD2-CD1 4.2Å; F168-L224 HydrophobicContact CD2-CD2 3.63Å; F168-L224 HydrophobicContact CE2-CD1 4.13Å; F168-L224 HydrophobicContact CE2-CD2 4.37Å; F168-L224 HydrophobicContact CG-CD2 4.15Å
169	A	94.9	Very high	94.9	Very high	3 Å²	3	16 Å²	16	3%	0.025	8%	0.084	C	C	.	.	H	α-helix	trans	-61.3	-45.4	175.7	0	0	0	0	0	112.1	I165 N166 M167 D172 E173 F269	I165-A169 PolarHBondContact O-N 3.22Å; I165-A169 VanDerWaalsContact O-N 3.13Å; N166-A169 WeakPolarHBondContact O-CB 3.44Å; N166-A169 PolarHBondContact O-N 2.85Å; N166-A169 VanDerWaalsContact O-N 3.15Å; M167-A169 PolarHBondContact O-N 3.42Å; A169-D172 PolarHBondContact O-N 2.91Å; A169-E173 WeakPolarHBondContact O-CB 3.44Å; A169-E173 WeakPolarHBondContact O-CG 3.22Å; A169-E173 PolarHBondContact O-N 3.42Å; A169-F269 HydrophobicContact CB-CD1 3.88Å; A169-F269 HydrophobicContact CB-CD2 4.45Å; A169-F269 HydrophobicContact CB-CE1 3.94Å; A169-F269 HydrophobicContact CB-CG 4.14Å; A169-F269 HydrophobicContact CB-CZ 4.25Å
170	V	96.1	Very high	94.9	Very high	8 Å²	8	14.7 Å²	14.7	5%	0.048	8%	0.078	C	C	.	.	H	α-helix	trans	-59.4	-51.1	177	169.1	0	0	0	0	110.9	A80 N166 M167 D172 E173 L174 L307 F308	A80-V170 HydrophobicContact CB-CG1 3.94Å; N166-V170 WeakPolarHBondContact O-CG2 3.39Å; N166-V170 PolarHBondContact O-N 3.21Å; M167-V170 PolarHBondContact O-N 3.19Å; V170-D172 PolarHBondContact O-N 3.43Å; V170-E173 PolarHBondContact O-N 2.91Å; V170-L174 HydrophobicContact CG1-CD1 3.72Å; V170-L174 HydrophobicContact CG1-CG 4.36Å; V170-L174 WeakPolarHBondContact O-CB 3.34Å; V170-L174 VanDerWaalsContact O-CG 3.22Å; V170-L174 WeakPolarHBondContact O-CG 3.34Å; V170-L174 PolarHBondContact O-N 2.95Å; V170-L307 HydrophobicContact CG2-CD1 3.65Å; V170-L307 HydrophobicContact CG2-CG 4.09Å; V170-F308 HydrophobicContact CG1-CB 4.11Å; V170-F308 HydrophobicContact CG1-CD2 3.76Å; V170-F308 HydrophobicContact CG1-CG 4.23Å
171	L	97.3	Very high	95	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.3	-38	-177.7	-68.9	173.3	0	0	0	112.3	A80 L83 F125 F128 M167 F168 K175 I220	A80-L171 HydrophobicContact CB-CD2 3.95Å; L83-L171 HydrophobicContact CD1-CD2 4.11Å; F125-L171 HydrophobicContact CE2-CB 4.28Å; F125-L171 HydrophobicContact CE2-CD1 4.27Å; F125-L171 HydrophobicContact CE2-CD2 3.98Å; F125-L171 HydrophobicContact CE2-CG 4.41Å; F125-L171 HydrophobicContact CZ-CB 4.42Å; F128-L171 HydrophobicContact CE1-CD1 3.89Å; M167-L171 HydrophobicContact CG-CD1 3.91Å; M167-L171 HydrophobicContact CG-CG 4.41Å; M167-L171 WeakPolarHBondContact O-CB 3.39Å; M167-L171 VanDerWaalsContact O-CG 3.3Å; M167-L171 WeakPolarHBondContact O-CG 3.29Å; M167-L171 PolarHBondContact O-N 3.41Å; F168-L171 PolarHBondContact O-N 3.44Å; L171-K175 WeakPolarHBondContact O-CB 3.09Å; L171-K175 PolarHBondContact O-N 3.4Å; L171-I220 HydrophobicContact CB-CD1 3.93Å
172	D	96.5	Very high	94.9	Very high	1 Å²	1	19 Å²	19	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-70.8	-43.3	179.7	-148.5	24.2	0	0	0	111.2	F168 A169 V170 K175 N176 N218 K219 I220 T221	F168-D172 WeakPolarHBondContact O-CB 3.3Å; F168-D172 PolarHBondContact O-N 3.32Å; A169-D172 PolarHBondContact O-N 2.91Å; V170-D172 PolarHBondContact O-N 3.43Å; D172-K175 PolarHBondContact O-N 3.21Å; D172-N176 VanDerWaalsContact O-CB 3.25Å; D172-N176 WeakPolarHBondContact O-CB 3.48Å; D172-N176 PolarHBondContact O-N 3.3Å; D172-N176 PolarHBondContact O-ND2 3.48Å; D172-N218 WeakPolarHBondContact OD2-CA 3.19Å; D172-K219 PolarHBondContact OD1-N 3.44Å; D172-I220 HydrophobicContact CB-CB 3.9Å; D172-I220 HydrophobicContact CB-CD1 4.37Å; D172-I220 HydrophobicContact CB-CG1 4.47Å; D172-I220 WeakPolarHBondContact OD1-CB 3.44Å; D172-I220 PolarHBondContact OD1-N 3.4Å; D172-I220 VanDerWaalsContact OD1-N 3.07Å; D172-T221 WeakPolarHBondContact OD2-CB 3.2Å; D172-T221 PolarHBondContact OD2-N 2.99Å; D172-T221 PolarHBondContact OD2-OG1 2.94Å
173	E	94	Very high	94.9	Very high	42 Å²	42	22.3 Å²	22.3	20%	0.196	11%	0.113	C	C	.	.	H	α-helix	trans	-69	-40	178.5	-67.2	-63.8	177.3	0	0	112.3	A169 V170 K175 N176 M177 L307 M311	A169-E173 WeakPolarHBondContact O-CB 3.44Å; A169-E173 WeakPolarHBondContact O-CG 3.22Å; A169-E173 PolarHBondContact O-N 3.42Å; V170-E173 PolarHBondContact O-N 2.91Å; E173-K175 VanDerWaalsContact C-N 3.34Å; E173-K175 PolarHBondContact O-N 2.98Å; E173-N176 WeakPolarHBondContact O-CB 3.2Å; E173-N176 PolarHBondContact O-N 2.96Å; E173-N176 PolarHBondContact OE2-ND2 3.46Å; E173-M177 WeakPolarHBondContact O-CG 3.34Å; E173-M177 PolarHBondContact O-N 2.93Å; E173-L307 HydrophobicContact CB-CD2 3.88Å; E173-L307 HydrophobicContact CG-CD2 3.93Å; E173-M311 HydrophobicContact CB-CE 3.94Å; E173-M311 HydrophobicContact CB-SD 4.1Å
174	L	95.1	Very high	94.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.9	-41.3	171.9	-72.1	174.9	0	0	0	111.7	A80 L83 Y84 V170 M177 K178 F308 M311	A80-L174 HydrophobicContact CB-CD1 3.72Å; A80-L174 WeakPolarHBondContact O-CD1 3.47Å; L83-L174 HydrophobicContact CB-CB 3.93Å; L83-L174 HydrophobicContact CB-CD1 4.35Å; L83-L174 HydrophobicContact CD1-CB 3.97Å; Y84-L174 HydrophobicContact CD2-CD2 3.95Å; Y84-L174 HydrophobicContact CG-CD2 4.49Å; V170-L174 HydrophobicContact CG1-CD1 3.72Å; V170-L174 HydrophobicContact CG1-CG 4.36Å; V170-L174 WeakPolarHBondContact O-CB 3.34Å; V170-L174 VanDerWaalsContact O-CG 3.22Å; V170-L174 WeakPolarHBondContact O-CG 3.34Å; V170-L174 PolarHBondContact O-N 2.95Å; L174-M177 HydrophobicContact CD2-CE 3.3Å; L174-M177 WeakPolarHBondContact O-CG 3.45Å; L174-K178 WeakPolarHBondContact O-CB 3.32Å; L174-K178 WeakPolarHBondContact O-CG 3.46Å; L174-K178 PolarHBondContact O-N 3.15Å; L174-F308 HydrophobicContact CD1-CB 4.43Å; L174-F308 HydrophobicContact CD1-CD1 4.2Å; L174-F308 HydrophobicContact CD1-CD2 4.35Å; L174-F308 HydrophobicContact CD1-CG 4.07Å; L174-F308 HydrophobicContact CD2-CB 4.38Å; L174-F308 HydrophobicContact CD2-CD1 4.22Å; L174-F308 HydrophobicContact CD2-CG 4.47Å; L174-M311 HydrophobicContact CD2-CE 3.54Å; L174-M311 HydrophobicContact CD2-SD 4.32Å; L174-M311 HydrophobicContact CG-CE 3.75Å
175	K	96.3	Very high	94.9	Very high	15 Å²	15	18.3 Å²	18.3	7%	0.065	10%	0.096	C	C	.	.	H	α-helix	trans	-65.2	-40.9	174.8	175.9	-169.9	165.3	-66.4	0	111.5	F125 L171 D172 E173 F213 N216 I220	F125-K175 HydrophobicContact CE1-CD 4.34Å; L171-K175 WeakPolarHBondContact O-CB 3.09Å; L171-K175 PolarHBondContact O-N 3.4Å; D172-K175 PolarHBondContact O-N 3.21Å; E173-K175 VanDerWaalsContact C-N 3.34Å; E173-K175 PolarHBondContact O-N 2.98Å; K175-F213 HydrophobicContact CD-CE1 3.89Å; K175-F213 HydrophobicContact CD-CE2 4.09Å; K175-F213 HydrophobicContact CD-CZ 3.56Å; K175-F213 WeakPolarHBondContact CE-O 2.95Å; K175-F213 PolarHBondContact NZ-O 3.17Å; K175-F213 VanDerWaalsContact NZ-O 3.11Å; K175-N216 PolarHBondContact NZ-O 3.46Å; K175-I220 HydrophobicContact CD-CD1 4.49Å
176	N	92.3	Very high	94.8	Very high	21 Å²	21	20.5 Å²	20.5	11%	0.112	11%	0.112	C	C	.	.	H	α-helix	trans	-63.4	-42.7	-178.2	-80.6	-20.1	0	0	0	112	D172 E173 H217 N218	D172-N176 VanDerWaalsContact O-CB 3.25Å; D172-N176 WeakPolarHBondContact O-CB 3.48Å; D172-N176 PolarHBondContact O-N 3.3Å; D172-N176 PolarHBondContact O-ND2 3.48Å; E173-N176 WeakPolarHBondContact O-CB 3.2Å; E173-N176 PolarHBondContact O-N 2.96Å; E173-N176 PolarHBondContact OE2-ND2 3.46Å; N176-H217 VanDerWaalsContact CB-CE1 3.42Å; N176-H217 WeakPolarHBondContact CB-CE1 3.15Å; N176-H217 PolarHBondContact OD1-ND1 3.47Å; N176-N218 PolarHBondContact ND2-OD1 2.95Å; N176-N218 PolarHBondContact OD1-N 3.45Å
177	M	89.6	Confident	94.7	Very high	22 Å²	22	20.8 Å²	20.8	11%	0.108	12%	0.115	C	C	.	.	H	α-helix	trans	-76.7	-31	-179	66.3	106.4	165.2	0	0	113	Y84 E173 L174 C179 M311 F626 E629	Y84-M177 HydrophobicContact CD2-CE 4.12Å; E173-M177 WeakPolarHBondContact O-CG 3.34Å; E173-M177 PolarHBondContact O-N 2.93Å; L174-M177 HydrophobicContact CD2-CE 3.3Å; L174-M177 WeakPolarHBondContact O-CG 3.45Å; M177-C179 PolarHBondContact O-N 3.34Å; M177-M311 HydrophobicContact CE-SD 4.31Å; M177-M311 HydrophobicContact CG-SD 4.11Å; M177-F626 HydrophobicContact CB-CD2 4.14Å; M177-F626 HydrophobicContact CB-CE2 4.16Å; M177-F626 HydrophobicContact CE-CB 4.27Å; M177-F626 HydrophobicContact CE-CD2 4.33Å; M177-F626 HydrophobicContact CG-CD2 4.06Å; M177-F626 HydrophobicContact SD-CB 4.32Å; M177-F626 HydrophobicContact SD-CD2 3.72Å; M177-E629 WeakPolarHBondContact O-CG 3.26Å; M177-E629 HydrophobicContact SD-CB 4.42Å; M177-E629 HydrophobicContact SD-CG 4.38Å
178	K	94.1	Very high	94.6	Very high	6 Å²	6	21.7 Å²	21.7	3%	0.026	12%	0.118	C	C	.	.			trans	-77.4	80.8	-175.5	-72.4	-73.6	174.2	171.8	0	113.8	L83 Y84 W86 L174 S180 V181 E629	L83-K178 WeakPolarHBondContact O-CD 3.49Å; L83-K178 WeakPolarHBondContact O-CE 3.45Å; L83-K178 WeakPolarHBondContact O-CG 3.29Å; Y84-K178 VanDerWaalsContact O-CE 3.23Å; Y84-K178 WeakPolarHBondContact O-CE 3.47Å; Y84-K178 PolarHBondContact O-NZ 3.49Å; W86-K178 PolarHBondContact O-NZ 3.31Å; L174-K178 WeakPolarHBondContact O-CB 3.32Å; L174-K178 WeakPolarHBondContact O-CG 3.46Å; L174-K178 PolarHBondContact O-N 3.15Å; K178-S180 PolarHBondContact O-N 3.49Å; K178-V181 HydrophobicContact CB-CB 4.27Å; K178-V181 HydrophobicContact CB-CG2 3.86Å; K178-V181 PolarHBondContact O-N 3.02Å; K178-E629 HydrophobicContact CD-CG 4.25Å
179	C	92.9	Very high	94.4	Very high	71 Å²	71	23.4 Å²	23.4	48%	0.48	13%	0.126	S	C	.	.	H	α-helix	trans	-61.6	-33.6	168.1	-67.6	0	0	0	0	111.8	M177 V181 K182 N183 E629	M177-C179 PolarHBondContact O-N 3.34Å; C179-V181 VanDerWaalsContact C-N 3.32Å; C179-V181 PolarHBondContact O-N 3.41Å; C179-K182 PolarHBondContact O-N 3.13Å; C179-N183 WeakPolarHBondContact O-CB 3.35Å; C179-N183 VanDerWaalsContact O-CG 3.24Å; C179-N183 PolarHBondContact O-N 3.19Å; C179-N183 PolarHBondContact O-ND2 2.87Å; C179-E629 WeakPolarHBondContact CA-OE1 3.47Å; C179-E629 WeakPolarHBondContact CB-OE1 3.28Å; C179-E629 PolarHBondContact N-OE1 3.27Å
180	S	94.6	Very high	94.3	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.021	15%	0.152	C	C	.	.	H	α-helix	trans	-50.1	-47.7	174.7	-67.4	0	0	0	0	112.9	S88 K178 K182 N183 D184 E629	S88-S180 WeakPolarHBondContact CB-OG 3.44Å; K178-S180 PolarHBondContact O-N 3.49Å; S180-K182 PolarHBondContact O-N 3.38Å; S180-N183 PolarHBondContact O-N 3.02Å; S180-D184 WeakPolarHBondContact O-CB 3.17Å; S180-D184 PolarHBondContact O-N 3.17Å; S180-E629 WeakPolarHBondContact CB-OE2 3.37Å; S180-E629 PolarHBondContact N-OE1 3.15Å; S180-E629 VanDerWaalsContact OG-CD 3.29Å; S180-E629 PolarHBondContact OG-OE1 3.13Å; S180-E629 VanDerWaalsContact OG-OE1 3.12Å; S180-E629 PolarHBondContact OG-OE2 3.41Å
181	V	94.7	Very high	94.2	Very high	4 Å²	4	30 Å²	30	2%	0.024	15%	0.149	C	C	.	.	H	α-helix	trans	-59.5	-47.2	179	168.8	0	0	0	0	111.7	L83 W86 L122 K178 C179 H185 L214	L83-V181 HydrophobicContact CD2-CG2 4.23Å; W86-V181 HydrophobicContact CB-CG2 4Å; W86-V181 HydrophobicContact CD2-CG2 3.65Å; W86-V181 HydrophobicContact CE3-CG2 4.09Å; W86-V181 HydrophobicContact CG-CG2 3.58Å; L122-V181 HydrophobicContact CD1-CG1 3.74Å; L122-V181 HydrophobicContact CD2-CG1 3.43Å; L122-V181 VanDerWaalsContact CD2-CG1 3.43Å; L122-V181 HydrophobicContact CG-CG1 4.23Å; K178-V181 HydrophobicContact CB-CB 4.27Å; K178-V181 HydrophobicContact CB-CG2 3.86Å; K178-V181 PolarHBondContact O-N 3.02Å; C179-V181 VanDerWaalsContact C-N 3.32Å; C179-V181 PolarHBondContact O-N 3.41Å; V181-H185 PolarHBondContact O-N 3.02Å; V181-L214 HydrophobicContact CG1-CD1 4.3Å; V181-L214 HydrophobicContact CG1-CD2 3.79Å
182	K	93	Very high	93.9	Very high	93 Å²	93	30.8 Å²	30.8	40%	0.404	16%	0.155	S	C	.	.	H	α-helix	trans	-64	-41.9	179.1	-179.6	-176.1	175	-176.6	0	111.7	C179 S180 S186 L214	C179-K182 PolarHBondContact O-N 3.13Å; S180-K182 PolarHBondContact O-N 3.38Å; K182-S186 WeakPolarHBondContact O-CB 3.46Å; K182-S186 PolarHBondContact O-N 3.34Å; K182-S186 VanDerWaalsContact O-N 3.11Å; K182-S186 PolarHBondContact O-OG 3Å; K182-L214 HydrophobicContact CG-CB 4.49Å
183	N	94.1	Very high	93.6	Very high	69 Å²	69	36.9 Å²	36.9	37%	0.369	18%	0.184	S	C	.	.	H	α-helix	trans	-70.3	-41.6	-177.3	-69.5	-21.6	0	0	0	111.8	C179 S180 S186 A187	C179-N183 WeakPolarHBondContact O-CB 3.35Å; C179-N183 VanDerWaalsContact O-CG 3.24Å; C179-N183 PolarHBondContact O-N 3.19Å; C179-N183 PolarHBondContact O-ND2 2.87Å; S180-N183 PolarHBondContact O-N 3.02Å; N183-S186 WeakPolarHBondContact O-CB 3.19Å; N183-S186 PolarHBondContact O-N 3.47Å; N183-A187 PolarHBondContact O-N 2.92Å
184	D	96.1	Very high	93.4	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-46.4	178.3	-69.7	-7.4	0	0	0	111.1	W86 S88 C89 S90 L115 S180 S186 A187 Y188	W86-D184 PolarHBondContact NE1-OD2 3.42Å; S88-D184 PolarHBondContact OG-OD1 3.11Å; S88-D184 VanDerWaalsContact OG-OD1 3.04Å; C89-D184 PolarHBondContact N-OD1 3.3Å; C89-D184 PolarHBondContact N-OD2 3.36Å; S90-D184 WeakPolarHBondContact CB-OD1 3.45Å; S90-D184 PolarHBondContact N-OD1 3.21Å; S90-D184 PolarHBondContact OG-OD1 3.1Å; L115-D184 HydrophobicContact CD2-CB 4.07Å; S180-D184 WeakPolarHBondContact O-CB 3.17Å; S180-D184 PolarHBondContact O-N 3.17Å; D184-S186 VanDerWaalsContact C-N 3.28Å; D184-S186 PolarHBondContact O-N 3.2Å; D184-A187 PolarHBondContact O-N 3Å; D184-Y188 PolarHBondContact O-N 3.28Å
185	H	95.3	Very high	93.2	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-38.3	173.3	175.5	-120.8	0	0	0	112.4	L122 V181 Y188 K189 S211 L214	L122-H185 HydrophobicContact CD1-CB 4.23Å; V181-H185 PolarHBondContact O-N 3.02Å; H185-Y188 PolarHBondContact O-N 3.17Å; H185-K189 WeakPolarHBondContact O-CB 3.21Å; H185-K189 PolarHBondContact O-N 3.1Å; H185-S211 PolarHBondContact CE1-OG 3.01Å; H185-L214 HydrophobicContact CB-CD1 3.79Å
186	S	93.9	Very high	92.8	Very high	47 Å²	47	50.9 Å²	50.9	33%	0.329	24%	0.24	S	C	.	.	H	α-helix	trans	-67.6	-36.9	178.2	-59.1	0	0	0	0	112.4	K182 N183 D184 R190	K182-S186 WeakPolarHBondContact O-CB 3.46Å; K182-S186 PolarHBondContact O-N 3.34Å; K182-S186 VanDerWaalsContact O-N 3.11Å; K182-S186 PolarHBondContact O-OG 3Å; N183-S186 WeakPolarHBondContact O-CB 3.19Å; N183-S186 PolarHBondContact O-N 3.47Å; D184-S186 VanDerWaalsContact C-N 3.28Å; D184-S186 PolarHBondContact O-N 3.2Å; S186-R190 WeakPolarHBondContact O-CB 3.41Å; S186-R190 PolarHBondContact O-N 3.22Å; S186-R190 VanDerWaalsContact O-N 3.11Å
187	A	94	Very high	92.3	Very high	16 Å²	16	53.9 Å²	53.9	13%	0.132	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-45.5	174.3	0	0	0	0	0	111.3	L115 N183 D184 R190 A191	L115-A187 HydrophobicContact CD1-CB 4.09Å; N183-A187 PolarHBondContact O-N 2.92Å; D184-A187 PolarHBondContact O-N 3Å; A187-R190 PolarHBondContact O-N 2.86Å; A187-A191 PolarHBondContact O-N 2.68Å
188	Y	95.3	Very high	91.5	Very high	31 Å²	31	62 Å²	62	12%	0.122	29%	0.293	C	S	.	.	H	α-helix	trans	-57.1	-52	173	171.1	-99.9	0	0	0	112	V112 L115 E116 V119 D184 H185 R190 A191 A192	V112-Y188 HydrophobicContact CB-CE2 4.42Å; V112-Y188 HydrophobicContact CG1-CE2 3.99Å; V112-Y188 HydrophobicContact CG2-CD2 4.44Å; V112-Y188 HydrophobicContact CG2-CE2 4.35Å; L115-Y188 HydrophobicContact CB-CD2 4.03Å; L115-Y188 HydrophobicContact CB-CG 4.37Å; E116-Y188 HydrophobicContact CB-CE2 3.76Å; E116-Y188 HydrophobicContact CG-CE2 4.34Å; V119-Y188 HydrophobicContact CB-CD1 4.29Å; V119-Y188 HydrophobicContact CB-CE1 4.47Å; V119-Y188 HydrophobicContact CG1-CD1 4.1Å; V119-Y188 HydrophobicContact CG1-CE1 4.09Å; 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 3.28Å; H185-Y188 PolarHBondContact O-N 3.17Å; Y188-R190 VanDerWaalsContact C-N 3.27Å; Y188-R190 PolarHBondContact O-N 2.84Å; Y188-A191 PolarHBondContact O-N 3.42Å; Y188-A191 VanDerWaalsContact O-N 3.12Å; Y188-A192 HydrophobicContact CE1-CB 4.48Å; Y188-A192 WeakPolarHBondContact O-CB 3.49Å; Y188-A192 PolarHBondContact O-N 3.27Å
189	K	93.4	Very high	90.8	Very high	36 Å²	36	64 Å²	64	16%	0.157	31%	0.31	C	S	.	.	H	α-helix	trans	-57.6	-41.5	-178.6	-172	174	-172.6	174.2	0	111.5	H185 Q193 Q208 S211	H185-K189 WeakPolarHBondContact O-CB 3.21Å; H185-K189 PolarHBondContact O-N 3.1Å; K189-Q193 WeakPolarHBondContact O-CB 3.49Å; K189-Q193 WeakPolarHBondContact O-CG 3.38Å; K189-Q193 PolarHBondContact O-N 2.72Å; K189-Q193 VanDerWaalsContact O-N 3.1Å; K189-Q208 VanDerWaalsContact NZ-OE1 3.1Å; K189-S211 PolarHBondContact NZ-OG 3.32Å
190	R	92.4	Very high	90.4	Very high	151 Å²	151	65.1 Å²	65.1	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-64.2	-44.6	177.2	-166.2	-173.3	-56.1	133.6	3.2	112	S186 A187 Y188 F194	S186-R190 WeakPolarHBondContact O-CB 3.41Å; S186-R190 PolarHBondContact O-N 3.22Å; S186-R190 VanDerWaalsContact O-N 3.11Å; A187-R190 PolarHBondContact O-N 2.86Å; Y188-R190 VanDerWaalsContact C-N 3.27Å; Y188-R190 PolarHBondContact O-N 2.84Å; R190-F194 WeakPolarHBondContact O-CB 3.45Å; R190-F194 PolarHBondContact O-N 3.15Å; R190-F194 VanDerWaalsContact O-N 3.14Å
191	A	92.8	Very high	90	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66.4	-47.6	179.4	0	0	0	0	0	112	Y108 T111 V112 A187 Y188 Q193 F194 L195	Y108-A191 HydrophobicContact CD1-CB 3.51Å; Y108-A191 HydrophobicContact CE1-CB 4.36Å; Y108-A191 HydrophobicContact CG-CB 4.1Å; T111-A191 HydrophobicContact CG2-CB 3.68Å; V112-A191 HydrophobicContact CG2-CB 3.77Å; A187-A191 PolarHBondContact O-N 2.68Å; Y188-A191 PolarHBondContact O-N 3.42Å; Y188-A191 VanDerWaalsContact O-N 3.12Å; A191-Q193 VanDerWaalsContact C-N 3.35Å; A191-Q193 PolarHBondContact O-N 3.06Å; A191-F194 PolarHBondContact O-N 3.12Å; A191-L195 WeakPolarHBondContact O-CG 3.45Å; A191-L195 PolarHBondContact O-N 2.7Å
192	A	90.9	Very high	89.6	Confident	15 Å²	15	75.5 Å²	75.5	12%	0.124	37%	0.369	C	S	.	.	H	α-helix	trans	-62.6	-39.5	179.9	0	0	0	0	0	112.6	V112 Y188 R196 K197	V112-A192 HydrophobicContact CG2-CB 4.16Å; Y188-A192 HydrophobicContact CE1-CB 4.48Å; Y188-A192 WeakPolarHBondContact O-CB 3.49Å; Y188-A192 PolarHBondContact O-N 3.27Å; A192-R196 PolarHBondContact O-N 3.14Å; A192-K197 PolarHBondContact O-N 2.72Å
193	Q	89.9	Confident	89.1	Confident	129 Å²	129	73.4 Å²	73.4	60%	0.603	37%	0.366	S	S	*	.	H	α-helix	trans	-65.6	-41.2	174.9	-75.2	176	-8.4	0	0	112.2	K189 A191 R196	K189-Q193 WeakPolarHBondContact O-CB 3.49Å; K189-Q193 WeakPolarHBondContact O-CG 3.38Å; K189-Q193 PolarHBondContact O-N 2.72Å; K189-Q193 VanDerWaalsContact O-N 3.1Å; A191-Q193 VanDerWaalsContact C-N 3.35Å; A191-Q193 PolarHBondContact O-N 3.06Å; Q193-R196 PolarHBondContact O-N 3.02Å
194	F	91.3	Very high	88.7	Confident	79 Å²	79	75 Å²	75	35%	0.346	37%	0.373	S	S	.	.	H	α-helix	trans	-64.5	-43.7	178.7	-178.7	-90.7	0	0	0	112.1	R104 V105 Y108 R190 A191 R196	R104-F194 HydrophobicContact CG-CE1 4.48Å; R104-F194 HydrophobicContact CG-CZ 4.35Å; V105-F194 HydrophobicContact CG2-CE1 4.4Å; Y108-F194 HydrophobicContact CD2-CB 4.11Å; Y108-F194 AromaticContact CD2-CD1 3.25Å; Y108-F194 HydrophobicContact CD2-CD1 3.25Å; Y108-F194 HydrophobicContact CD2-CD2 4.46Å; Y108-F194 AromaticContact CD2-CE1 3.73Å; Y108-F194 HydrophobicContact CD2-CE1 3.73Å; Y108-F194 AromaticContact CD2-CG 3.68Å; Y108-F194 HydrophobicContact CD2-CG 3.68Å; Y108-F194 HydrophobicContact CE2-CB 4.16Å; Y108-F194 AromaticContact CE2-CD1 3.69Å; Y108-F194 HydrophobicContact CE2-CD1 3.69Å; Y108-F194 HydrophobicContact CE2-CD2 4.06Å; Y108-F194 HydrophobicContact CE2-CE1 4.07Å; Y108-F194 HydrophobicContact CE2-CE2 4.42Å; Y108-F194 AromaticContact CE2-CG 3.68Å; Y108-F194 HydrophobicContact CE2-CG 3.68Å; Y108-F194 HydrophobicContact CE2-CZ 4.43Å; Y108-F194 HydrophobicContact CG-CD1 4.19Å; R190-F194 WeakPolarHBondContact O-CB 3.45Å; R190-F194 PolarHBondContact O-N 3.15Å; R190-F194 VanDerWaalsContact O-N 3.14Å; A191-F194 PolarHBondContact O-N 3.12Å; F194-R196 PolarHBondContact O-N 3.35Å
195	L	91	Very high	88.3	Confident	53 Å²	53	79.8 Å²	79.8	28%	0.277	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-4.4	178.5	-66.2	174.7	0	0	0	114	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 3.45Å; A191-L195 PolarHBondContact O-N 2.7Å; L195-K197 PolarHBondContact O-N 3.47Å
196	R	86.3	Confident	87.9	Confident	220 Å²	220	82.3 Å²	82.3	83%	0.83	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	42	-176.3	-56	179.2	179.6	179.7	-0.7	112.1	A192 Q193 F194 M198	A192-R196 PolarHBondContact O-N 3.14Å; Q193-R196 PolarHBondContact O-N 3.02Å; F194-R196 PolarHBondContact O-N 3.35Å; R196-M198 PolarHBondContact O-N 3.27Å
197	K	82.6	Confident	87.7	Confident	83 Å²	83	81.1 Å²	81.1	36%	0.361	40%	0.399	S	S	.	.			trans	-54.9	126.3	176	-170.2	177	-178.6	179.9	0	108.6	V112 E116 A192 L195 A199	V112-K197 HydrophobicContact CG1-CD 4.42Å; E116-K197 IonicContact OE1-NZ 2.6Å; E116-K197 PolarHBondContact OE1-NZ 3.28Å; E116-K197 IonicContact OE2-NZ 2.69Å; E116-K197 PolarHBondContact OE2-NZ 3.15Å; A192-K197 PolarHBondContact O-N 2.72Å; L195-K197 PolarHBondContact O-N 3.47Å; K197-A199 PolarHBondContact O-N 2.96Å
198	M	72.8	Confident	87.5	Confident	194 Å²	194	84.6 Å²	84.6	96%	0.956	41%	0.413	S	S	*	.			trans	-59.1	108.9	178.9	-72.5	-76.1	174.9	0	0	108.6	R196	R196-M198 PolarHBondContact O-N 3.27Å
199	A	80.3	Confident	87.4	Confident	48 Å²	48	86.2 Å²	86.2	40%	0.397	42%	0.424	S	S	.	.			trans	-119.7	128.5	177.4	0	0	0	0	0	108.3	K197 I204	K197-A199 PolarHBondContact O-N 2.96Å; A199-I204 HydrophobicContact CB-CG1 3.98Å
200	D	84.6	Confident	87.4	Confident	93 Å²	93	84.5 Å²	84.5	50%	0.497	42%	0.416	S	S	.	.			trans	-72.9	160.8	174.6	64.6	-53.9	0	0	0	111	Q202 S203 I204	D200-Q202 PolarHBondContact O-N 3.03Å; D200-Q202 VanDerWaalsContact O-N 3.11Å; D200-Q202 WeakPolarHBondContact OD2-CB 3.4Å; D200-S203 PolarHBondContact O-N 3.36Å; D200-S203 WeakPolarHBondContact OD1-CB 3.31Å; D200-I204 PolarHBondContact O-N 3.25Å; D200-I204 VanDerWaalsContact O-N 3.09Å
201	P	84.8	Confident	87.3	Confident	113 Å²	113	78.6 Å²	78.6	73%	0.734	40%	0.398	S	S	*	.	H	α-helix	trans	-55.7	-32.3	-176.7	-27.1	35.4	0	0	0	113.9	Q205	P201-Q205 PolarHBondContact O-N 3Å; P201-Q205 VanDerWaalsContact O-N 3.16Å
202	Q	85.9	Confident	87.3	Confident	112 Å²	112	83.4 Å²	83.4	52%	0.523	42%	0.422	S	S	.	.	H	α-helix	trans	-67.4	-48.6	176	179.9	66	19.4	0	0	110.9	D200 I204 Q205 E206	D200-Q202 PolarHBondContact O-N 3.03Å; D200-Q202 VanDerWaalsContact O-N 3.11Å; D200-Q202 WeakPolarHBondContact OD2-CB 3.4Å; Q202-I204 VanDerWaalsContact C-N 3.3Å; Q202-I204 PolarHBondContact O-N 3.03Å; Q202-Q205 PolarHBondContact O-N 2.9Å; Q202-Q205 VanDerWaalsContact O-N 3.13Å; Q202-E206 PolarHBondContact NE2-OE1 3.39Å; Q202-E206 WeakPolarHBondContact O-CG 3.48Å; Q202-E206 PolarHBondContact O-N 2.86Å
203	S	84.4	Confident	87.5	Confident	49 Å²	49	83.2 Å²	83.2	34%	0.343	42%	0.418	S	S	.	.	H	α-helix	trans	-59.6	-37.5	176.7	-178.1	0	0	0	0	113.1	D200 E206 S207	D200-S203 PolarHBondContact O-N 3.36Å; D200-S203 WeakPolarHBondContact OD1-CB 3.31Å; S203-E206 PolarHBondContact O-N 3.3Å; S203-S207 WeakPolarHBondContact O-CB 3.35Å; S203-S207 PolarHBondContact O-N 3.19Å
204	I	85.4	Confident	87.7	Confident	102 Å²	102	77.8 Å²	77.8	52%	0.523	39%	0.393	S	S	.	.	H	α-helix	trans	-63	-45.1	175.2	-63.8	172.4	0	0	0	110.8	A199 D200 Q202 S207 Q208	A199-I204 HydrophobicContact CB-CG1 3.98Å; D200-I204 PolarHBondContact O-N 3.25Å; D200-I204 VanDerWaalsContact O-N 3.09Å; Q202-I204 VanDerWaalsContact C-N 3.3Å; Q202-I204 PolarHBondContact O-N 3.03Å; I204-S207 PolarHBondContact O-N 3.28Å; I204-Q208 PolarHBondContact O-N 3.5Å; I204-Q208 VanDerWaalsContact O-N 3.09Å
205	Q	86.4	Confident	87.7	Confident	102 Å²	102	76.7 Å²	76.7	48%	0.477	40%	0.399	S	S	.	.	H	α-helix	trans	-66	-39.9	178.2	-175.2	63.2	16.2	0	0	111.9	P201 Q202 Q208 N209	P201-Q205 PolarHBondContact O-N 3Å; P201-Q205 VanDerWaalsContact O-N 3.16Å; Q202-Q205 PolarHBondContact O-N 2.9Å; Q202-Q205 VanDerWaalsContact O-N 3.13Å; Q205-Q208 PolarHBondContact O-N 3.06Å; Q205-N209 PolarHBondContact O-N 3.13Å; Q205-N209 PolarHBondContact O-ND2 3.28Å
206	E	87.4	Confident	87.7	Confident	55 Å²	55	77.2 Å²	77.2	26%	0.257	40%	0.402	S	S	.	.	H	α-helix	trans	-63.1	-46.5	176.4	-71.8	-176.2	-171.9	0	0	111.8	M123 Y127 Q202 S203 Q208 N209 L210	M123-E206 HydrophobicContact CE-CB 4.16Å; M123-E206 WeakPolarHBondContact CE-O 3.47Å; M123-E206 HydrophobicContact SD-CB 4.47Å; Y127-E206 WeakPolarHBondContact OH-CG 3.27Å; Y127-E206 PolarHBondContact OH-OE1 2.76Å; Y127-E206 PolarHBondContact OH-OE2 3.32Å; Q202-E206 PolarHBondContact NE2-OE1 3.39Å; Q202-E206 WeakPolarHBondContact O-CG 3.48Å; Q202-E206 PolarHBondContact O-N 2.86Å; S203-E206 PolarHBondContact O-N 3.3Å; E206-Q208 PolarHBondContact O-N 3.05Å; E206-N209 PolarHBondContact O-N 2.96Å; E206-L210 PolarHBondContact O-N 2.59Å
207	S	89.1	Confident	87.9	Confident	23 Å²	23	72 Å²	72	16%	0.161	39%	0.386	C	S	.	.	H	α-helix	trans	-58	-38	174.1	-176.6	0	0	0	0	112.2	S203 I204 S211	S203-S207 WeakPolarHBondContact O-CB 3.35Å; S203-S207 PolarHBondContact O-N 3.19Å; I204-S207 PolarHBondContact O-N 3.28Å; S207-S211 PolarHBondContact O-N 3.06Å; S207-S211 VanDerWaalsContact O-N 3.09Å; S207-S211 PolarHBondContact O-OG 3.48Å
208	Q	90.3	Very high	88.4	Confident	88 Å²	88	70.2 Å²	70.2	41%	0.411	38%	0.381	S	S	.	.	H	α-helix	trans	-68.6	-43	177	-172.5	59.6	17.5	0	0	112.4	K189 I204 Q205 E206 L210 S211 M212	K189-Q208 VanDerWaalsContact NZ-OE1 3.1Å; I204-Q208 PolarHBondContact O-N 3.5Å; I204-Q208 VanDerWaalsContact O-N 3.09Å; Q205-Q208 PolarHBondContact O-N 3.06Å; E206-Q208 PolarHBondContact O-N 3.05Å; Q208-L210 VanDerWaalsContact C-N 3.35Å; Q208-L210 PolarHBondContact O-N 3.14Å; Q208-S211 PolarHBondContact O-N 3.38Å; Q208-M212 WeakPolarHBondContact O-CG 3.13Å; Q208-M212 PolarHBondContact O-N 3.45Å; Q208-M212 VanDerWaalsContact O-N 3.08Å
209	N	92.4	Very high	89.4	Confident	65 Å²	65	63.9 Å²	63.9	35%	0.348	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-43.7	175.9	-72.2	-28.7	0	0	0	111.6	M126 Q205 E206 S211 M212 F213	M126-N209 HydrophobicContact CE-CB 4.22Å; M126-N209 HydrophobicContact SD-CB 4.1Å; Q205-N209 PolarHBondContact O-N 3.13Å; Q205-N209 PolarHBondContact O-ND2 3.28Å; E206-N209 PolarHBondContact O-N 2.96Å; N209-S211 PolarHBondContact O-N 3.1Å; N209-M212 PolarHBondContact O-N 2.83Å; N209-F213 WeakPolarHBondContact O-CB 3.13Å; N209-F213 PolarHBondContact O-N 3.48Å
210	L	93.4	Very high	90.2	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.8	-42	177.8	-176.4	62	0	0	0	111.9	V119 L122 M123 M126 E206 Q208 M212 F213 L214	V119-L210 HydrophobicContact CG1-CD2 4.05Å; L122-L210 HydrophobicContact CB-CD1 4.14Å; L122-L210 HydrophobicContact CB-CD2 4.02Å; M123-L210 HydrophobicContact CE-CB 3.71Å; M123-L210 HydrophobicContact CE-CD2 3.59Å; M123-L210 HydrophobicContact CE-CG 4.26Å; M123-L210 HydrophobicContact CG-CD2 4.11Å; M123-L210 HydrophobicContact SD-CB 3.76Å; M123-L210 HydrophobicContact SD-CD1 4.48Å; M123-L210 HydrophobicContact SD-CD2 3.7Å; M123-L210 HydrophobicContact SD-CG 4.18Å; M126-L210 HydrophobicContact CB-CD1 4.15Å; M126-L210 HydrophobicContact CE-CB 4.44Å; M126-L210 HydrophobicContact SD-CB 4.16Å; M126-L210 HydrophobicContact SD-CD1 4.18Å; E206-L210 PolarHBondContact O-N 2.59Å; Q208-L210 VanDerWaalsContact C-N 3.35Å; Q208-L210 PolarHBondContact O-N 3.14Å; L210-M212 VanDerWaalsContact C-N 3.31Å; L210-M212 PolarHBondContact O-N 3.35Å; L210-F213 HydrophobicContact CD1-CD1 4.24Å; L210-F213 PolarHBondContact O-N 3.25Å; L210-L214 HydrophobicContact CD1-CD1 4.02Å; L210-L214 HydrophobicContact CD1-CD2 4.5Å; L210-L214 HydrophobicContact CD1-CG 4.01Å; L210-L214 HydrophobicContact CG-CD1 3.98Å; L210-L214 HydrophobicContact CG-CG 4.34Å; L210-L214 WeakPolarHBondContact O-CG 3.27Å; L210-L214 PolarHBondContact O-N 2.86Å
211	S	92.3	Very high	90.6	Very high	28 Å²	28	57.7 Å²	57.7	20%	0.196	31%	0.309	C	S	.	.	H	α-helix	trans	-56.7	-45.3	173.2	-72	0	0	0	0	111.9	H185 K189 S207 Q208 N209 A215	H185-S211 PolarHBondContact CE1-OG 3.01Å; K189-S211 PolarHBondContact NZ-OG 3.32Å; S207-S211 PolarHBondContact O-N 3.06Å; S207-S211 VanDerWaalsContact O-N 3.09Å; S207-S211 PolarHBondContact O-OG 3.48Å; Q208-S211 PolarHBondContact O-N 3.38Å; N209-S211 PolarHBondContact O-N 3.1Å; S211-A215 WeakPolarHBondContact O-CB 3.42Å; S211-A215 PolarHBondContact O-N 3.31Å
212	M	92.6	Very high	91	Very high	100 Å²	100	56 Å²	56	49%	0.493	29%	0.291	S	S	.	.	H	α-helix	trans	-66.3	-41.6	178.4	-68.9	-58.3	-64.9	0	0	111.7	Q208 N209 L210 A215 N216	Q208-M212 WeakPolarHBondContact O-CG 3.13Å; Q208-M212 PolarHBondContact O-N 3.45Å; Q208-M212 VanDerWaalsContact O-N 3.08Å; N209-M212 PolarHBondContact O-N 2.83Å; L210-M212 VanDerWaalsContact C-N 3.31Å; L210-M212 PolarHBondContact O-N 3.35Å; M212-A215 PolarHBondContact O-N 2.98Å; M212-N216 PolarHBondContact O-N 3.03Å; M212-N216 PolarHBondContact O-ND2 3.15Å
213	F	94.9	Very high	91.5	Very high	11 Å²	11	51.5 Å²	51.5	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-48.2	178	173.3	-110	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 4.22Å; F125-F213 AromaticContact CE1-CE1 3.54Å; F125-F213 HydrophobicContact CE1-CE1 3.54Å; F125-F213 AromaticContact CE1-CZ 3.64Å; F125-F213 HydrophobicContact CE1-CZ 3.64Å; F125-F213 HydrophobicContact CZ-CE1 4.46Å; F125-F213 HydrophobicContact CZ-CZ 4.12Å; M126-F213 HydrophobicContact CB-CD1 4.11Å; M126-F213 HydrophobicContact CB-CE1 4.31Å; M126-F213 HydrophobicContact CG-CB 4.24Å; M126-F213 HydrophobicContact CG-CD1 4.1Å; M126-F213 HydrophobicContact CG-CG 4.04Å; M126-F213 HydrophobicContact SD-CB 4.05Å; M126-F213 HydrophobicContact SD-CG 4.48Å; Q129-F213 HydrophobicContact CG-CE2 4Å; Q129-F213 HydrophobicContact CG-CZ 3.89Å; K175-F213 HydrophobicContact CD-CE1 3.89Å; K175-F213 HydrophobicContact CD-CE2 4.09Å; K175-F213 HydrophobicContact CD-CZ 3.56Å; K175-F213 WeakPolarHBondContact CE-O 2.95Å; K175-F213 PolarHBondContact NZ-O 3.17Å; K175-F213 VanDerWaalsContact NZ-O 3.11Å; N209-F213 WeakPolarHBondContact O-CB 3.13Å; N209-F213 PolarHBondContact O-N 3.48Å; L210-F213 HydrophobicContact CD1-CD1 4.24Å; L210-F213 PolarHBondContact O-N 3.25Å; F213-A215 VanDerWaalsContact C-N 3.33Å; F213-A215 PolarHBondContact O-N 3.03Å; F213-K219 HydrophobicContact CD2-CB 4.4Å; F213-K219 HydrophobicContact CD2-CG 3.78Å; F213-K219 HydrophobicContact CE2-CB 4.49Å; F213-K219 HydrophobicContact CE2-CG 4.18Å; F213-I220 HydrophobicContact CE2-CG1 4.07Å; F213-I220 HydrophobicContact CZ-CD1 4.35Å; F213-I220 HydrophobicContact CZ-CG1 4.29Å
214	L	93.4	Very high	92.1	Very high	16 Å²	16	49.1 Å²	49.1	8%	0.084	26%	0.255	C	S	.	.	H	α-helix	trans	-71.3	-26.4	-179.9	-63.3	178.4	0	0	0	113	L122 V181 K182 H185 L210	L122-L214 HydrophobicContact CD1-CD1 4.28Å; V181-L214 HydrophobicContact CG1-CD1 4.3Å; V181-L214 HydrophobicContact CG1-CD2 3.79Å; K182-L214 HydrophobicContact CG-CB 4.49Å; H185-L214 HydrophobicContact CB-CD1 3.79Å; L210-L214 HydrophobicContact CD1-CD1 4.02Å; L210-L214 HydrophobicContact CD1-CD2 4.5Å; L210-L214 HydrophobicContact CD1-CG 4.01Å; L210-L214 HydrophobicContact CG-CD1 3.98Å; L210-L214 HydrophobicContact CG-CG 4.34Å; L210-L214 WeakPolarHBondContact O-CG 3.27Å; L210-L214 PolarHBondContact O-N 2.86Å
215	A	90.8	Very high	92.5	Very high	55 Å²	55	46.3 Å²	46.3	46%	0.455	24%	0.24	S	C	.	.	H	α-helix	trans	-77.2	-29.3	178.5	0	0	0	0	0	113.8	S211 M212 F213	S211-A215 WeakPolarHBondContact O-CB 3.42Å; S211-A215 PolarHBondContact O-N 3.31Å; M212-A215 PolarHBondContact O-N 2.98Å; F213-A215 VanDerWaalsContact C-N 3.33Å; F213-A215 PolarHBondContact O-N 3.03Å
216	N	91.4	Very high	92.8	Very high	64 Å²	64	47.2 Å²	47.2	34%	0.342	24%	0.244	S	C	.	.	S	Bend	trans	-86.1	123.7	-177.3	-73.7	-62.8	0	0	0	111.6	K175 M212 K219	K175-N216 PolarHBondContact NZ-O 3.46Å; M212-N216 PolarHBondContact O-N 3.03Å; M212-N216 PolarHBondContact O-ND2 3.15Å; N216-K219 HydrophobicContact CB-CB 4.01Å; N216-K219 HydrophobicContact CB-CD 4.18Å; N216-K219 HydrophobicContact CB-CG 4.29Å
217	H	90.3	Very high	93.2	Very high	110 Å²	110	47.7 Å²	47.7	51%	0.509	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	145.9	174	-160.7	80.6	0	0	0	110.8	N176 K219 Q222	N176-H217 VanDerWaalsContact CB-CE1 3.42Å; N176-H217 WeakPolarHBondContact CB-CE1 3.15Å; N176-H217 PolarHBondContact OD1-ND1 3.47Å; H217-K219 PolarHBondContact O-N 2.94Å; H217-Q222 PolarHBondContact O-NE2 3.17Å
218	N	92.8	Very high	93.5	Very high	47 Å²	47	46.7 Å²	46.7	25%	0.251	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	30.5	-176	-62.6	-28.7	0	0	0	114.6	D172 N176 I220 T221 Q222	D172-N218 WeakPolarHBondContact OD2-CA 3.19Å; N176-N218 PolarHBondContact ND2-OD1 2.95Å; N176-N218 PolarHBondContact OD1-N 3.45Å; N218-I220 PolarHBondContact O-N 3.1Å; N218-T221 PolarHBondContact O-N 3.04Å; N218-Q222 WeakPolarHBondContact O-CB 3.08Å; N218-Q222 WeakPolarHBondContact O-CG 3.22Å; N218-Q222 PolarHBondContact O-N 2.88Å
219	K	94.8	Very high	93.7	Very high	61 Å²	61	44.9 Å²	44.9	27%	0.265	23%	0.231	S	C	.	.	H	α-helix	trans	-67.6	-36.1	-170	-179.7	56	-173.9	164.2	0	112.2	D172 F213 N216 H217 S223	D172-K219 PolarHBondContact OD1-N 3.44Å; F213-K219 HydrophobicContact CD2-CB 4.4Å; F213-K219 HydrophobicContact CD2-CG 3.78Å; F213-K219 HydrophobicContact CE2-CB 4.49Å; F213-K219 HydrophobicContact CE2-CG 4.18Å; N216-K219 HydrophobicContact CB-CB 4.01Å; N216-K219 HydrophobicContact CB-CD 4.18Å; N216-K219 HydrophobicContact CB-CG 4.29Å; H217-K219 PolarHBondContact O-N 2.94Å; K219-S223 WeakPolarHBondContact CE-OG 3.45Å; K219-S223 PolarHBondContact NZ-OG 3.32Å; K219-S223 WeakPolarHBondContact O-CB 3.26Å; K219-S223 PolarHBondContact O-N 2.9Å; K219-S223 VanDerWaalsContact O-N 3.13Å; K219-S223 PolarHBondContact O-OG 3.18Å
220	I	96.1	Very high	93.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-69.8	-48.3	179.8	-60.3	177.6	0	0	0	108.8	F125 Q129 I133 F168 L171 D172 K175 F213 N218 Q222 S223 L224	F125-I220 HydrophobicContact CE2-CD1 4.47Å; F125-I220 HydrophobicContact CZ-CD1 3.88Å; Q129-I220 HydrophobicContact CB-CD1 4.18Å; Q129-I220 HydrophobicContact CB-CG1 4.47Å; Q129-I220 HydrophobicContact CG-CD1 4.32Å; Q129-I220 HydrophobicContact CG-CG1 4.33Å; I133-I220 HydrophobicContact CD1-CG2 4.01Å; F168-I220 HydrophobicContact CB-CG2 4.02Å; F168-I220 HydrophobicContact CD1-CG2 3.94Å; F168-I220 HydrophobicContact CG-CG2 4.33Å; L171-I220 HydrophobicContact CB-CD1 3.93Å; D172-I220 HydrophobicContact CB-CB 3.9Å; D172-I220 HydrophobicContact CB-CD1 4.37Å; D172-I220 HydrophobicContact CB-CG1 4.47Å; D172-I220 WeakPolarHBondContact OD1-CB 3.44Å; D172-I220 PolarHBondContact OD1-N 3.4Å; D172-I220 VanDerWaalsContact OD1-N 3.07Å; K175-I220 HydrophobicContact CD-CD1 4.49Å; F213-I220 HydrophobicContact CE2-CG1 4.07Å; F213-I220 HydrophobicContact CZ-CD1 4.35Å; F213-I220 HydrophobicContact CZ-CG1 4.29Å; N218-I220 PolarHBondContact O-N 3.1Å; I220-Q222 PolarHBondContact O-N 2.7Å; I220-S223 PolarHBondContact O-N 2.79Å; I220-L224 WeakPolarHBondContact O-CB 3.46Å; I220-L224 PolarHBondContact O-N 2.68Å
221	T	94.7	Very high	93.8	Very high	10 Å²	10	47.5 Å²	47.5	6%	0.061	25%	0.249	C	C	.	.	H	α-helix	trans	-59.7	-46.4	178.3	-59.7	0	0	0	0	112.3	D172 N218 S223 L224 Q225 F269 Y272	D172-T221 WeakPolarHBondContact OD2-CB 3.2Å; D172-T221 PolarHBondContact OD2-N 2.99Å; D172-T221 PolarHBondContact OD2-OG1 2.94Å; N218-T221 PolarHBondContact O-N 3.04Å; T221-S223 VanDerWaalsContact C-N 3.34Å; T221-S223 PolarHBondContact O-N 2.95Å; T221-L224 WeakPolarHBondContact O-CB 3.38Å; T221-L224 PolarHBondContact O-N 2.79Å; T221-Q225 WeakPolarHBondContact O-CG 3.36Å; T221-Q225 PolarHBondContact O-N 3.1Å; T221-F269 HydrophobicContact CG2-CE2 3.93Å; T221-F269 HydrophobicContact CG2-CZ 3.9Å; T221-Y272 HydrophobicContact CG2-CE1 3.77Å
222	Q	92.8	Very high	93.8	Very high	78 Å²	78	51.3 Å²	51.3	36%	0.364	28%	0.275	S	S	.	.	H	α-helix	trans	-62.1	-41.6	177.9	-73.3	167.1	16.3	0	0	112.2	H217 N218 I220 L224 Q225 Q226	H217-Q222 PolarHBondContact O-NE2 3.17Å; N218-Q222 WeakPolarHBondContact O-CB 3.08Å; N218-Q222 WeakPolarHBondContact O-CG 3.22Å; N218-Q222 PolarHBondContact O-N 2.88Å; I220-Q222 PolarHBondContact O-N 2.7Å; Q222-L224 VanDerWaalsContact C-N 3.33Å; Q222-Q225 PolarHBondContact O-N 3.16Å; Q222-Q226 WeakPolarHBondContact O-CB 3.4Å; Q222-Q226 VanDerWaalsContact O-CG 3.27Å; Q222-Q226 WeakPolarHBondContact O-CG 3.5Å; Q222-Q226 PolarHBondContact O-N 3.08Å
223	S	95.4	Very high	93.7	Very high	17 Å²	17	46.9 Å²	46.9	12%	0.119	26%	0.255	C	S	.	.	H	α-helix	trans	-67.9	-37.3	179.8	-54	0	0	0	0	111	K219 I220 T221 Q227	K219-S223 WeakPolarHBondContact CE-OG 3.45Å; K219-S223 PolarHBondContact NZ-OG 3.32Å; K219-S223 WeakPolarHBondContact O-CB 3.26Å; K219-S223 PolarHBondContact O-N 2.9Å; K219-S223 VanDerWaalsContact O-N 3.13Å; K219-S223 PolarHBondContact O-OG 3.18Å; I220-S223 PolarHBondContact O-N 2.79Å; T221-S223 VanDerWaalsContact C-N 3.34Å; T221-S223 PolarHBondContact O-N 2.95Å; S223-Q227 WeakPolarHBondContact O-CG 3.36Å; S223-Q227 PolarHBondContact O-N 3.42Å; S223-Q227 VanDerWaalsContact O-N 3.15Å
224	L	96.4	Very high	93.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.8	-48.4	173.8	-179.5	63.9	0	0	0	111.8	I133 F136 F168 I220 T221 Q222 Q226 Q227 L228 F269 L273	I133-L224 HydrophobicContact CG2-CD1 4.18Å; F136-L224 HydrophobicContact CD1-CD1 3.81Å; F136-L224 HydrophobicContact CE1-CD1 4.06Å; F168-L224 HydrophobicContact CB-CD2 4.18Å; F168-L224 HydrophobicContact CD2-CD1 4.2Å; F168-L224 HydrophobicContact CD2-CD2 3.63Å; F168-L224 HydrophobicContact CE2-CD1 4.13Å; F168-L224 HydrophobicContact CE2-CD2 4.37Å; F168-L224 HydrophobicContact CG-CD2 4.15Å; I220-L224 WeakPolarHBondContact O-CB 3.46Å; I220-L224 PolarHBondContact O-N 2.68Å; T221-L224 WeakPolarHBondContact O-CB 3.38Å; T221-L224 PolarHBondContact O-N 2.79Å; Q222-L224 VanDerWaalsContact C-N 3.33Å; L224-Q226 PolarHBondContact O-N 3.28Å; L224-Q227 PolarHBondContact O-N 2.85Å; L224-L228 HydrophobicContact CD1-CD1 3.87Å; L224-L228 HydrophobicContact CD1-CG 4.11Å; L224-L228 HydrophobicContact CG-CD1 3.8Å; L224-L228 HydrophobicContact CG-CG 4.41Å; L224-L228 WeakPolarHBondContact O-CB 3.34Å; L224-L228 VanDerWaalsContact O-CG 3.29Å; L224-L228 WeakPolarHBondContact O-CG 3.5Å; L224-L228 PolarHBondContact O-N 2.83Å; L224-F269 HydrophobicContact CD2-CE1 4.32Å; L224-L273 HydrophobicContact CD2-CD1 3.82Å; L224-L273 HydrophobicContact CD2-CD2 4.16Å
225	Q	94	Very high	93.7	Very high	42 Å²	42	47.3 Å²	47.3	20%	0.196	26%	0.257	C	S	.	.	H	α-helix	trans	-58.2	-48	177.1	-76.2	175.8	-38.8	0	0	111.7	T221 Q222 Q227 L228 E229 Y272 L273	T221-Q225 WeakPolarHBondContact O-CG 3.36Å; T221-Q225 PolarHBondContact O-N 3.1Å; Q222-Q225 PolarHBondContact O-N 3.16Å; Q225-Q227 VanDerWaalsContact C-N 3.33Å; Q225-Q227 PolarHBondContact O-N 3.47Å; Q225-L228 PolarHBondContact O-N 2.99Å; Q225-E229 WeakPolarHBondContact O-CB 3.42Å; Q225-E229 WeakPolarHBondContact O-CG 3.43Å; Q225-E229 PolarHBondContact O-N 2.71Å; Q225-Y272 VanDerWaalsContact NE2-CE1 3.33Å; Q225-L273 HydrophobicContact CG-CD2 3.63Å
226	Q	93.3	Very high	93.8	Very high	122 Å²	122	47.2 Å²	47.2	57%	0.57	25%	0.247	S	C	*	.	H	α-helix	trans	-58.3	-43.3	178.7	-73.8	172.8	3.9	0	0	112.4	Q222 L224 V230	Q222-Q226 WeakPolarHBondContact O-CB 3.4Å; Q222-Q226 VanDerWaalsContact O-CG 3.27Å; Q222-Q226 WeakPolarHBondContact O-CG 3.5Å; Q222-Q226 PolarHBondContact O-N 3.08Å; L224-Q226 PolarHBondContact O-N 3.28Å; Q226-V230 VanDerWaalsContact O-CG2 3.28Å; Q226-V230 WeakPolarHBondContact O-CG2 3.45Å
227	Q	95.6	Very high	93.9	Very high	65 Å²	65	44.8 Å²	44.8	30%	0.304	23%	0.234	S	C	.	.	H	α-helix	trans	-75.1	-29.8	180	-69.4	-166.8	38.5	0	0	113.2	I133 C137 S223 L224 Q225	I133-Q227 HydrophobicContact CG2-CB 4.49Å; I133-Q227 HydrophobicContact CG2-CG 4.45Å; C137-Q227 HydrophobicContact CB-CB 4.23Å; S223-Q227 WeakPolarHBondContact O-CG 3.36Å; S223-Q227 PolarHBondContact O-N 3.42Å; S223-Q227 VanDerWaalsContact O-N 3.15Å; L224-Q227 PolarHBondContact O-N 2.85Å; Q225-Q227 VanDerWaalsContact C-N 3.33Å; Q225-Q227 PolarHBondContact O-N 3.47Å
228	L	95.5	Very high	94.1	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-73.8	-46.2	175.8	-74.2	174.5	0	0	0	112.4	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 4.25Å; V140-L228 HydrophobicContact CG1-CD2 3.97Å; V140-L228 HydrophobicContact CG2-CD2 4.05Å; L224-L228 HydrophobicContact CD1-CD1 3.87Å; L224-L228 HydrophobicContact CD1-CG 4.11Å; L224-L228 HydrophobicContact CG-CD1 3.8Å; L224-L228 HydrophobicContact CG-CG 4.41Å; L224-L228 WeakPolarHBondContact O-CB 3.34Å; L224-L228 VanDerWaalsContact O-CG 3.29Å; L224-L228 WeakPolarHBondContact O-CG 3.5Å; L224-L228 PolarHBondContact O-N 2.83Å; Q225-L228 PolarHBondContact O-N 2.99Å; L228-V230 PolarHBondContact O-N 3Å; L228-V230 VanDerWaalsContact O-N 3.17Å; L228-I231 WeakPolarHBondContact O-CB 3.43Å; L228-I231 PolarHBondContact O-N 2.79Å; L228-Y234 HydrophobicContact CB-CD2 3.9Å; L228-Y234 HydrophobicContact CB-CE2 4.2Å; L228-Y234 HydrophobicContact CB-CG 4.19Å; L228-Y234 HydrophobicContact CD2-CD2 4.48Å; L228-Y234 WeakPolarHBondContact O-CD1 3.28Å; L228-L273 HydrophobicContact CD1-CD1 4.34Å
229	E	93.8	Very high	94.2	Very high	51 Å²	51	37.3 Å²	37.3	24%	0.238	20%	0.198	C	C	.	.	H	α-helix	trans	-63.4	-23.7	-177.4	-73.1	-171.6	157.7	0	0	113.3	Q225 I231 Y234 G276 S277 V278	Q225-E229 WeakPolarHBondContact O-CB 3.42Å; Q225-E229 WeakPolarHBondContact O-CG 3.43Å; Q225-E229 PolarHBondContact O-N 2.71Å; E229-I231 PolarHBondContact O-N 3.32Å; E229-Y234 HydrophobicContact CB-CE1 4.48Å; E229-Y234 HydrophobicContact CG-CE1 4.17Å; E229-G276 WeakPolarHBondContact OE1-CA 3.47Å; E229-S277 VanDerWaalsContact CD-OG 3.27Å; E229-S277 PolarHBondContact OE1-N 3.32Å; E229-S277 PolarHBondContact OE1-OG 2.71Å; E229-S277 PolarHBondContact OE2-OG 3.26Å; E229-V278 HydrophobicContact CB-CG2 4.06Å; E229-V278 HydrophobicContact CG-CG2 4.37Å
230	V	94.9	Very high	94.1	Very high	111 Å²	111	36 Å²	36	67%	0.673	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-22.2	172.6	171.4	0	0	0	0	112.2	Q226 L228	Q226-V230 VanDerWaalsContact O-CG2 3.28Å; Q226-V230 WeakPolarHBondContact O-CG2 3.45Å; L228-V230 PolarHBondContact O-N 3Å; L228-V230 VanDerWaalsContact O-N 3.17Å
231	I	94.5	Very high	94.1	Very high	9 Å²	9	36.1 Å²	36.1	5%	0.046	19%	0.194	C	C	.	.	S	Bend	trans	-89.2	113.6	-177.8	-59.2	166	0	0	0	109.3	C137 V140 R141 C144 L228 E229 G233 Y234	C137-I231 HydrophobicContact CB-CD1 4.18Å; C137-I231 VanDerWaalsContact O-CD1 3.27Å; C137-I231 WeakPolarHBondContact O-CD1 3.45Å; V140-I231 HydrophobicContact CB-CD1 4.35Å; V140-I231 HydrophobicContact CG1-CD1 4.21Å; R141-I231 HydrophobicContact CB-CD1 3.96Å; R141-I231 HydrophobicContact CB-CG1 4.26Å; R141-I231 HydrophobicContact CB-CG2 4.29Å; R141-I231 HydrophobicContact CG-CG2 4.49Å; C144-I231 HydrophobicContact CB-CG2 4.22Å; L228-I231 WeakPolarHBondContact O-CB 3.43Å; L228-I231 PolarHBondContact O-N 2.79Å; E229-I231 PolarHBondContact O-N 3.32Å; I231-G233 PolarHBondContact O-N 3.3Å; I231-G233 VanDerWaalsContact O-N 3.09Å; I231-Y234 WeakPolarHBondContact O-CD1 3.23Å; I231-Y234 PolarHBondContact O-N 3.06Å
232	S	92.5	Very high	94.2	Very high	108 Å²	108	35.7 Å²	35.7	76%	0.755	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	116.9	178.2	-179.5	0	0	0	0	112.2	R149	R149-S232 PolarHBondContact NH2-O 3.34Å
233	G	90.6	Very high	94.3	Very high	7 Å²	7	34.3 Å²	34.3	7%	0.072	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	28.4	175.4	0	0	0	0	0	114.5	C144 R149 I231 E235 E236	C144-G233 PolarHBondContact SG-O 3.27Å; C144-G233 VanDerWaalsContact SG-O 3.33Å; R149-G233 PolarHBondContact NH1-O 2.84Å; R149-G233 VanDerWaalsContact NH2-CA 3.32Å; R149-G233 PolarHBondContact NH2-O 3.22Å; I231-G233 PolarHBondContact O-N 3.3Å; I231-G233 VanDerWaalsContact O-N 3.09Å; G233-E235 WeakPolarHBondContact CA-OE1 3.34Å; G233-E235 WeakPolarHBondContact CA-OE2 3.41Å; G233-E235 PolarHBondContact O-N 3.34Å; G233-E236 PolarHBondContact O-N 3.1Å
234	Y	95.2	Very high	94.3	Very high	1 Å²	1	34.3 Å²	34.3	0%	0.004	19%	0.185	C	C	.	.	H	α-helix	trans	-58.7	-33.3	172.5	75.7	-85.2	0	0	0	112.1	L228 E229 I231 E236 L237 L238 L273	L228-Y234 HydrophobicContact CB-CD2 3.9Å; L228-Y234 HydrophobicContact CB-CE2 4.2Å; L228-Y234 HydrophobicContact CB-CG 4.19Å; L228-Y234 HydrophobicContact CD2-CD2 4.48Å; L228-Y234 WeakPolarHBondContact O-CD1 3.28Å; E229-Y234 HydrophobicContact CB-CE1 4.48Å; E229-Y234 HydrophobicContact CG-CE1 4.17Å; I231-Y234 WeakPolarHBondContact O-CD1 3.23Å; I231-Y234 PolarHBondContact O-N 3.06Å; Y234-E236 PolarHBondContact O-N 3.26Å; Y234-L237 PolarHBondContact O-N 3.11Å; Y234-L237 VanDerWaalsContact O-N 3.1Å; Y234-L238 HydrophobicContact CD2-CD1 3.78Å; Y234-L238 HydrophobicContact CD2-CG 4.42Å; Y234-L238 HydrophobicContact CE2-CD1 3.95Å; Y234-L238 PolarHBondContact O-N 3.24Å; Y234-L273 PolarHBondContact OH-O 2.85Å
235	E	93	Very high	94.3	Very high	35 Å²	35	34.3 Å²	34.3	16%	0.164	19%	0.185	C	C	.	.	H	α-helix	trans	-63	-25.9	-178.6	72.7	-73.3	173.4	0	0	112.6	G233 A239 M274 S279 L284	G233-E235 WeakPolarHBondContact CA-OE1 3.34Å; G233-E235 WeakPolarHBondContact CA-OE2 3.41Å; G233-E235 PolarHBondContact O-N 3.34Å; E235-A239 WeakPolarHBondContact O-CB 3.42Å; E235-A239 PolarHBondContact O-N 2.87Å; E235-M274 HydrophobicContact CB-CG 4.44Å; E235-S279 WeakPolarHBondContact CB-OG 2.99Å; E235-S279 WeakPolarHBondContact CG-OG 3.21Å; E235-L284 HydrophobicContact CB-CD1 4.45Å; E235-L284 HydrophobicContact CG-CD1 4.29Å
236	E	92.4	Very high	94.5	Very high	53 Å²	53	32.8 Å²	32.8	25%	0.248	18%	0.179	C	C	.	.	H	α-helix	trans	-70.9	-37.4	175.9	-71.5	-69.2	160.2	0	0	111.9	G233 Y234 D240 R289	G233-E236 PolarHBondContact O-N 3.1Å; Y234-E236 PolarHBondContact O-N 3.26Å; E236-D240 PolarHBondContact O-N 3.4Å; E236-R289 PolarHBondContact O-NH2 3.5Å; E236-R289 IonicContact OE2-CZ 2.72Å; E236-R289 IonicContact OE2-NE 2.82Å; E236-R289 PolarHBondContact OE2-NE 3.33Å; E236-R289 IonicContact OE2-NH2 3.72Å; E236-R289 PolarHBondContact OE2-NH2 2.94Å
237	L	93.4	Very high	94.5	Very high	12 Å²	12	30.4 Å²	30.4	6%	0.063	17%	0.17	C	C	.	.	H	α-helix	trans	-71	-43.3	174.7	179.4	65.3	0	0	0	110.7	V140 L143 L158 L161 Y234 A239 D240 I241	V140-L237 HydrophobicContact CB-CD2 4.14Å; V140-L237 HydrophobicContact CG1-CD2 4.03Å; V140-L237 HydrophobicContact CG2-CD2 3.97Å; L143-L237 HydrophobicContact CB-CD1 4.43Å; L143-L237 HydrophobicContact CB-CD2 4.04Å; L143-L237 HydrophobicContact CD1-CD1 4.13Å; L143-L237 HydrophobicContact CD1-CD2 3.95Å; L158-L237 HydrophobicContact CD2-CD1 3.81Å; L161-L237 HydrophobicContact CD1-CD2 4.4Å; Y234-L237 PolarHBondContact O-N 3.11Å; Y234-L237 VanDerWaalsContact O-N 3.1Å; L237-A239 VanDerWaalsContact C-N 3.29Å; L237-A239 PolarHBondContact O-N 3.05Å; L237-D240 WeakPolarHBondContact O-CB 3.27Å; L237-D240 PolarHBondContact O-N 3.5Å; L237-I241 PolarHBondContact O-N 3.02Å; L237-I241 VanDerWaalsContact O-N 3.11Å
238	L	94.4	Very high	94.5	Very high	1 Å²	1	28 Å²	28	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-38.8	175.7	-65.4	-175.7	0	0	0	111.7	Y234 D240 I241 V242 L273 M274	Y234-L238 HydrophobicContact CD2-CD1 3.78Å; Y234-L238 HydrophobicContact CD2-CG 4.42Å; Y234-L238 HydrophobicContact CE2-CD1 3.95Å; Y234-L238 PolarHBondContact O-N 3.24Å; L238-D240 PolarHBondContact O-N 3.03Å; L238-I241 HydrophobicContact CD2-CD1 4.19Å; L238-I241 PolarHBondContact O-N 3.04Å; L238-V242 WeakPolarHBondContact O-CG2 3.34Å; L238-V242 PolarHBondContact O-N 3.33Å; L238-L273 HydrophobicContact CD1-CB 3.94Å; L238-M274 HydrophobicContact CB-CG 3.54Å; L238-M274 HydrophobicContact CB-SD 3.68Å; L238-M274 HydrophobicContact CD1-CG 3.82Å; L238-M274 HydrophobicContact CG-CG 4.35Å
239	A	94.7	Very high	94.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.7	-32.2	173.7	0	0	0	0	0	112.4	E235 L237 N243 M274 R289 I290	E235-A239 WeakPolarHBondContact O-CB 3.42Å; E235-A239 PolarHBondContact O-N 2.87Å; L237-A239 VanDerWaalsContact C-N 3.29Å; L237-A239 PolarHBondContact O-N 3.05Å; A239-N243 VanDerWaalsContact O-CB 3.24Å; A239-N243 WeakPolarHBondContact O-CB 3.39Å; A239-N243 PolarHBondContact O-N 2.93Å; A239-N243 PolarHBondContact O-ND2 2.97Å; A239-N243 VanDerWaalsContact O-ND2 3.16Å; A239-M274 HydrophobicContact CB-CE 3.64Å; A239-M274 HydrophobicContact CB-SD 4.41Å; A239-R289 HydrophobicContact CB-CG 4.28Å; A239-R289 VanDerWaalsContact CB-NH1 3.33Å; A239-I290 HydrophobicContact CB-CG2 3.73Å
240	D	93.4	Very high	94.6	Very high	33 Å²	33	30.3 Å²	30.3	18%	0.176	17%	0.168	C	C	.	.	H	α-helix	trans	-71.2	-41.6	175.3	-72	-9.5	0	0	0	112.5	L158 E236 L237 L238 L244 R289 K573	L158-D240 HydrophobicContact CD1-CB 4.35Å; E236-D240 PolarHBondContact O-N 3.4Å; L237-D240 WeakPolarHBondContact O-CB 3.27Å; L237-D240 PolarHBondContact O-N 3.5Å; L238-D240 PolarHBondContact O-N 3.03Å; D240-L244 WeakPolarHBondContact O-CB 3.19Å; D240-L244 PolarHBondContact O-N 3.38Å; D240-R289 IonicContact OD1-CZ 3.49Å; D240-R289 IonicContact OD1-NH1 3.97Å; D240-R289 PolarHBondContact OD1-NH1 3.37Å; D240-R289 IonicContact OD1-NH2 2.82Å; D240-R289 PolarHBondContact OD1-NH2 3.13Å; D240-R289 IonicContact OD2-NH2 3.65Å; D240-K573 IonicContact OD1-NZ 2.76Å; D240-K573 PolarHBondContact OD1-NZ 3.16Å; D240-K573 IonicContact OD2-NZ 2.59Å; D240-K573 PolarHBondContact OD2-NZ 3.42Å
241	I	95.9	Very high	94.6	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-61	-48.3	173.6	-61.7	171.5	0	0	0	110.2	L158 L161 L237 L238 L244 C245 V266	L158-I241 HydrophobicContact CB-CG1 4.27Å; L158-I241 HydrophobicContact CD2-CG1 3.96Å; L161-I241 HydrophobicContact CB-CD1 3.64Å; L161-I241 HydrophobicContact CD1-CD1 4.5Å; L237-I241 PolarHBondContact O-N 3.02Å; L237-I241 VanDerWaalsContact O-N 3.11Å; L238-I241 HydrophobicContact CD2-CD1 4.19Å; L238-I241 PolarHBondContact O-N 3.04Å; I241-L244 PolarHBondContact O-N 3.21Å; I241-C245 PolarHBondContact O-N 2.78Å; I241-C245 PolarHBondContact O-SG 2.83Å; I241-V266 HydrophobicContact CG2-CG1 3.6Å
242	V	96.6	Very high	94.5	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-45.9	-179.9	171.1	0	0	0	0	111.2	L238 L244 C245 V246 L271 M274 I295	L238-V242 WeakPolarHBondContact O-CG2 3.34Å; L238-V242 PolarHBondContact O-N 3.33Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 3.1Å; V242-C245 PolarHBondContact O-N 2.59Å; V242-V246 WeakPolarHBondContact O-CG2 3.36Å; V242-V246 PolarHBondContact O-N 3.2Å; V242-L271 HydrophobicContact CG1-CD2 4.45Å; V242-M274 HydrophobicContact CG2-SD 4.22Å; V242-I295 HydrophobicContact CG1-CD1 3.67Å
243	N	95.4	Very high	94.7	Very high	50 Å²	50	31.6 Å²	31.6	27%	0.267	15%	0.152	S	C	.	.	H	α-helix	trans	-63	-38.9	178.8	-75.8	-22.7	0	0	0	112.3	A239 V246 D247 R289	A239-N243 VanDerWaalsContact O-CB 3.24Å; A239-N243 WeakPolarHBondContact O-CB 3.39Å; A239-N243 PolarHBondContact O-N 2.93Å; A239-N243 PolarHBondContact O-ND2 2.97Å; A239-N243 VanDerWaalsContact O-ND2 3.16Å; N243-V246 PolarHBondContact O-N 3.22Å; N243-D247 WeakPolarHBondContact O-CB 3.47Å; N243-D247 PolarHBondContact O-N 3.35Å; N243-R289 PolarHBondContact ND2-NH1 3.15Å; N243-R289 VanDerWaalsContact ND2-NH1 3.12Å; N243-R289 PolarHBondContact ND2-O 3.11Å
244	L	95	Very high	94.9	Very high	16 Å²	16	32.2 Å²	32.2	8%	0.084	15%	0.152	C	C	.	.	H	α-helix	trans	-63.7	-42.8	174.8	-177.1	62.4	0	0	0	111.4	E155 L158 I159 D240 I241 V242 V246 D247 Y248	E155-L244 HydrophobicContact CB-CD1 4.22Å; E155-L244 HydrophobicContact CB-CD2 3.84Å; E155-L244 HydrophobicContact CG-CD1 3.68Å; E155-L244 HydrophobicContact CG-CD2 4.06Å; E155-L244 WeakPolarHBondContact O-CD2 3.21Å; L158-L244 HydrophobicContact CB-CD2 3.74Å; L158-L244 HydrophobicContact CD1-CD2 4.19Å; I159-L244 HydrophobicContact CD1-CD2 3.85Å; I159-L244 HydrophobicContact CD1-CG 4.12Å; I159-L244 HydrophobicContact CG1-CD2 3.83Å; D240-L244 WeakPolarHBondContact O-CB 3.19Å; D240-L244 PolarHBondContact O-N 3.38Å; I241-L244 PolarHBondContact O-N 3.21Å; V242-L244 VanDerWaalsContact C-N 3.32Å; V242-L244 PolarHBondContact O-N 3.1Å; L244-V246 VanDerWaalsContact C-N 3.31Å; L244-V246 PolarHBondContact O-N 3.05Å; L244-D247 PolarHBondContact O-N 3.41Å; L244-Y248 HydrophobicContact CD1-CD1 3.65Å; L244-Y248 HydrophobicContact CD1-CE1 3.3Å; L244-Y248 HydrophobicContact CG-CD1 4.16Å; L244-Y248 HydrophobicContact CG-CE1 4.04Å; L244-Y248 WeakPolarHBondContact O-CB 3.35Å; L244-Y248 WeakPolarHBondContact O-CD1 3.47Å; L244-Y248 PolarHBondContact O-N 3.31Å
245	C	96.7	Very high	94.9	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.007	15%	0.153	C	C	.	.	H	α-helix	trans	-62.8	-40.6	176.6	-65	0	0	0	0	111.7	I241 V242 Y248 Y249 L263 V266 M267	I241-C245 PolarHBondContact O-N 2.78Å; I241-C245 PolarHBondContact O-SG 2.83Å; V242-C245 PolarHBondContact O-N 2.59Å; C245-Y248 PolarHBondContact O-N 2.84Å; C245-Y249 WeakPolarHBondContact O-CB 3.05Å; C245-Y249 PolarHBondContact O-N 3Å; C245-L263 HydrophobicContact CB-CB 4.3Å; C245-L263 HydrophobicContact CB-CD2 4.15Å; C245-V266 VanDerWaalsContact SG-CG1 3.53Å; C245-M267 HydrophobicContact CB-CE 3.92Å; C245-M267 HydrophobicContact CB-CG 3.97Å; C245-M267 WeakPolarHBondContact O-CE 3.28Å
246	V	96.6	Very high	95.1	Very high	10 Å²	10	30.6 Å²	30.6	6%	0.061	15%	0.145	C	C	.	.	H	α-helix	trans	-59.9	-47.5	175.3	165	0	0	0	0	110.3	V242 N243 L244 Y249 E250 M267 K294 I295 Y298	V242-V246 WeakPolarHBondContact O-CG2 3.36Å; V242-V246 PolarHBondContact O-N 3.2Å; N243-V246 PolarHBondContact O-N 3.22Å; L244-V246 VanDerWaalsContact C-N 3.31Å; L244-V246 PolarHBondContact O-N 3.05Å; V246-Y249 PolarHBondContact O-N 2.73Å; V246-E250 WeakPolarHBondContact O-CB 3.36Å; V246-E250 PolarHBondContact O-N 3.2Å; V246-M267 HydrophobicContact CG2-CE 4.22Å; V246-M267 HydrophobicContact CG2-CG 4.19Å; V246-M267 HydrophobicContact CG2-SD 3.74Å; V246-K294 HydrophobicContact CG1-CB 4.23Å; 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	94.6	Very high	95.3	Very high	71 Å²	71	28.7 Å²	28.7	38%	0.38	14%	0.137	S	C	.	.	H	α-helix	trans	-62	-46.3	177.8	-173.1	78.5	0	0	0	111.7	N243 L244 Y249 E250 N251	N243-D247 WeakPolarHBondContact O-CB 3.47Å; N243-D247 PolarHBondContact O-N 3.35Å; L244-D247 PolarHBondContact O-N 3.41Å; D247-Y249 VanDerWaalsContact C-N 3.34Å; D247-Y249 PolarHBondContact O-N 2.89Å; D247-E250 PolarHBondContact O-N 3.3Å; D247-N251 WeakPolarHBondContact O-CB 3.25Å; D247-N251 PolarHBondContact O-N 3.12Å; D247-N251 PolarHBondContact O-ND2 3Å; D247-N251 VanDerWaalsContact O-ND2 3.11Å; D247-N251 PolarHBondContact OD1-ND2 2.66Å; D247-N251 PolarHBondContact OD2-ND2 2.97Å; D247-N251 VanDerWaalsContact OD2-ND2 3.16Å
248	Y	96.4	Very high	95.4	Very high	15 Å²	15	31.7 Å²	31.7	6%	0.059	16%	0.159	C	C	.	.	H	α-helix	trans	-63.8	-40	179.5	-83.9	25.2	0	0	0	112.2	E155 I159 L244 C245 R252 M253 L263 F600	E155-Y248 WeakPolarHBondContact CB-OH 3.44Å; E155-Y248 WeakPolarHBondContact OE2-CE1 3.15Å; E155-Y248 PolarHBondContact OE2-OH 3.5Å; I159-Y248 HydrophobicContact CD1-CD2 4.03Å; I159-Y248 HydrophobicContact CD1-CE2 4.1Å; I159-Y248 HydrophobicContact CG1-CD2 4.36Å; I159-Y248 HydrophobicContact CG1-CE2 3.93Å; L244-Y248 HydrophobicContact CD1-CD1 3.65Å; L244-Y248 HydrophobicContact CD1-CE1 3.3Å; L244-Y248 HydrophobicContact CG-CD1 4.16Å; L244-Y248 HydrophobicContact CG-CE1 4.04Å; L244-Y248 WeakPolarHBondContact O-CB 3.35Å; L244-Y248 WeakPolarHBondContact O-CD1 3.47Å; L244-Y248 PolarHBondContact O-N 3.31Å; C245-Y248 PolarHBondContact O-N 2.84Å; Y248-R252 PolarHBondContact O-N 3.23Å; Y248-R252 VanDerWaalsContact O-N 3.11Å; Y248-M253 HydrophobicContact CD1-CB 3.81Å; Y248-M253 HydrophobicContact CD1-CG 4.08Å; Y248-M253 HydrophobicContact CD2-CB 3.93Å; Y248-M253 WeakPolarHBondContact CD2-O 3.47Å; Y248-M253 HydrophobicContact CE1-CB 4.27Å; Y248-M253 HydrophobicContact CE1-CG 4.47Å; Y248-M253 HydrophobicContact CE2-CB 4.4Å; Y248-M253 HydrophobicContact CG-CB 3.61Å; Y248-M253 HydrophobicContact CG-CG 4.36Å; Y248-M253 PolarHBondContact O-N 3.16Å; Y248-L263 HydrophobicContact CD2-CD2 4.45Å; Y248-F600 HydrophobicContact CD2-CE2 4.47Å; Y248-F600 AromaticContact CE2-CE2 3.75Å; Y248-F600 HydrophobicContact CE2-CE2 3.75Å; Y248-F600 HydrophobicContact CE2-CZ 4.22Å
249	Y	95.9	Very high	95.4	Very high	17 Å²	17	34.3 Å²	34.3	7%	0.067	17%	0.171	C	C	.	.	H	α-helix	trans	-68.1	-42.8	178.3	-171.1	-96.6	0	0	0	111.6	C245 V246 D247 Y254 K260 L263 L264 M267 Y298	C245-Y249 WeakPolarHBondContact O-CB 3.05Å; C245-Y249 PolarHBondContact O-N 3Å; V246-Y249 PolarHBondContact O-N 2.73Å; D247-Y249 VanDerWaalsContact C-N 3.34Å; D247-Y249 PolarHBondContact O-N 2.89Å; Y249-Y254 HydrophobicContact CD2-CE1 4.21Å; Y249-K260 HydrophobicContact CD2-CG 4.37Å; Y249-K260 HydrophobicContact CE2-CG 3.8Å; Y249-L263 HydrophobicContact CD2-CD1 4.44Å; Y249-L264 HydrophobicContact CD1-CD2 4.42Å; Y249-L264 HydrophobicContact CD2-CD2 4Å; Y249-L264 HydrophobicContact CD2-CG 4.14Å; Y249-L264 HydrophobicContact CE1-CD2 4.3Å; Y249-L264 HydrophobicContact CE2-CD1 3.85Å; Y249-L264 HydrophobicContact CE2-CD2 3.87Å; Y249-L264 HydrophobicContact CE2-CG 3.88Å; Y249-L264 HydrophobicContact CG-CD2 4.27Å; Y249-M267 HydrophobicContact CG-CE 4.28Å; Y249-Y298 AromaticContact CD1-CD1 3.85Å; Y249-Y298 HydrophobicContact CD1-CD1 3.85Å; Y249-Y298 AromaticContact CD1-CD2 3.73Å; Y249-Y298 HydrophobicContact CD1-CD2 3.73Å; Y249-Y298 HydrophobicContact CD1-CE1 4.03Å; Y249-Y298 AromaticContact CD1-CE2 3.91Å; Y249-Y298 HydrophobicContact CD1-CE2 3.91Å; Y249-Y298 AromaticContact CD1-CG 3.72Å; Y249-Y298 HydrophobicContact CD1-CG 3.72Å; Y249-Y298 AromaticContact CE1-CD1 3.73Å; Y249-Y298 HydrophobicContact CE1-CD1 3.73Å; Y249-Y298 HydrophobicContact CE1-CD2 4.23Å; Y249-Y298 HydrophobicContact CE1-CE1 4.26Å; Y249-Y298 AromaticContact CE1-CG 3.75Å; Y249-Y298 HydrophobicContact CE1-CG 3.75Å
250	E	95.2	Very high	95.5	Very high	84 Å²	84	35.4 Å²	35.4	39%	0.393	18%	0.176	S	C	.	.	H	α-helix	trans	-64.5	-44.4	179.1	-167.7	169.9	-143.4	0	0	112.2	V246 D247 K294 Y298	V246-E250 WeakPolarHBondContact O-CB 3.36Å; V246-E250 PolarHBondContact O-N 3.2Å; D247-E250 PolarHBondContact O-N 3.3Å; E250-K294 WeakPolarHBondContact OE1-CE 3.38Å; E250-K294 IonicContact OE1-NZ 2.9Å; E250-K294 PolarHBondContact OE1-NZ 2.82Å; E250-K294 IonicContact OE2-NZ 2.8Å; E250-K294 PolarHBondContact OE2-NZ 2.67Å; E250-Y298 WeakPolarHBondContact CB-OH 3.3Å
251	N	93.6	Very high	95.7	Very high	88 Å²	88	34.2 Å²	34.2	47%	0.471	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	6.7	-174.5	-62	-43.9	0	0	0	113.8	D247 M253	D247-N251 WeakPolarHBondContact O-CB 3.25Å; D247-N251 PolarHBondContact O-N 3.12Å; D247-N251 PolarHBondContact O-ND2 3Å; D247-N251 VanDerWaalsContact O-ND2 3.11Å; D247-N251 PolarHBondContact OD1-ND2 2.66Å; D247-N251 PolarHBondContact OD2-ND2 2.97Å; D247-N251 VanDerWaalsContact OD2-ND2 3.16Å; N251-M253 VanDerWaalsContact C-N 3.32Å; N251-M253 HydrophobicContact CB-CG 4.06Å; N251-M253 PolarHBondContact O-N 2.94Å
252	R	94.1	Very high	95.8	Very high	143 Å²	143	36 Å²	36	54%	0.54	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	38.2	-178.7	-52.8	-65.7	-170.5	144.6	7.6	113.5	Y248 Y254	Y248-R252 PolarHBondContact O-N 3.23Å; Y248-R252 VanDerWaalsContact O-N 3.11Å; R252-Y254 WeakPolarHBondContact CD-OH 3.33Å; R252-Y254 PolarHBondContact NH1-OH 2.8Å; R252-Y254 PolarHBondContact O-N 2.77Å
253	M	94.8	Very high	95.8	Very high	23 Å²	23	36.5 Å²	36.5	11%	0.113	18%	0.181	C	C	.	.			trans	-83	59.9	174.2	-53.9	-58.6	-62.8	0	0	110.6	Y248 N251 R597 F600	Y248-M253 HydrophobicContact CD1-CB 3.81Å; Y248-M253 HydrophobicContact CD1-CG 4.08Å; Y248-M253 HydrophobicContact CD2-CB 3.93Å; Y248-M253 WeakPolarHBondContact CD2-O 3.47Å; Y248-M253 HydrophobicContact CE1-CB 4.27Å; Y248-M253 HydrophobicContact CE1-CG 4.47Å; Y248-M253 HydrophobicContact CE2-CB 4.4Å; Y248-M253 HydrophobicContact CG-CB 3.61Å; Y248-M253 HydrophobicContact CG-CG 4.36Å; Y248-M253 PolarHBondContact O-N 3.16Å; N251-M253 VanDerWaalsContact C-N 3.32Å; N251-M253 HydrophobicContact CB-CG 4.06Å; N251-M253 PolarHBondContact O-N 2.94Å; M253-R597 HydrophobicContact CE-CG 4.21Å; M253-R597 HydrophobicContact SD-CG 4.17Å; M253-F600 VanDerWaalsContact C-CE1 3.45Å; M253-F600 HydrophobicContact CB-CE1 4.24Å; M253-F600 HydrophobicContact CB-CE2 4.28Å; M253-F600 HydrophobicContact CB-CZ 4.02Å; M253-F600 HydrophobicContact CE-CB 3.56Å; M253-F600 HydrophobicContact CE-CD1 3.82Å; M253-F600 HydrophobicContact CE-CD2 3.56Å; M253-F600 HydrophobicContact CE-CE1 4.41Å; M253-F600 HydrophobicContact CE-CE2 4.17Å; M253-F600 HydrophobicContact CE-CG 3.36Å; M253-F600 WeakPolarHBondContact O-CZ 3.47Å
254	Y	96.3	Very high	95.9	Very high	20 Å²	20	34.1 Å²	34.1	8%	0.078	17%	0.168	C	C	.	.			trans	-158.9	160.5	174.8	56	-96	0	0	0	108.2	Y249 R252 K260 L263	Y249-Y254 HydrophobicContact CD2-CE1 4.21Å; R252-Y254 WeakPolarHBondContact CD-OH 3.33Å; R252-Y254 PolarHBondContact NH1-OH 2.8Å; R252-Y254 PolarHBondContact O-N 2.77Å; Y254-K260 HydrophobicContact CD2-CB 3.7Å; Y254-K260 HydrophobicContact CD2-CG 4.28Å; Y254-K260 HydrophobicContact CE1-CG 4.42Å; Y254-K260 HydrophobicContact CE2-CB 3.71Å; Y254-K260 HydrophobicContact CE2-CD 4.06Å; Y254-K260 HydrophobicContact CE2-CG 3.79Å; Y254-K260 HydrophobicContact CG-CB 4.2Å; Y254-L263 HydrophobicContact CD1-CD1 3.8Å; Y254-L263 HydrophobicContact CG-CD1 4.49Å
255	L	95.1	Very high	96	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.016	17%	0.167	C	C	.	.			trans	-122.8	-49.5	177.2	-171.9	58.3	0	0	0	112.4	E259 L395 L398 Q399 S402 F601 H604 T611	L255-E259 PolarHBondContact N-OE2 3.15Å; L255-L395 HydrophobicContact CD1-CD1 4.03Å; L255-L398 HydrophobicContact CD1-CB 4.14Å; L255-L398 HydrophobicContact CD2-CB 4.43Å; L255-L398 HydrophobicContact CD2-CD1 4.28Å; L255-Q399 HydrophobicContact CD1-CB 4.48Å; L255-Q399 HydrophobicContact CD1-CG 3.54Å; L255-S402 WeakPolarHBondContact O-CB 3.36Å; L255-S402 PolarHBondContact O-OG 3.2Å; L255-F601 HydrophobicContact CB-CD1 4.34Å; L255-F601 HydrophobicContact CB-CE1 4.3Å; L255-H604 HydrophobicContact CD2-CB 3.51Å; L255-T611 HydrophobicContact CD2-CG2 3.42Å; L255-T611 VanDerWaalsContact CD2-CG2 3.42Å; L255-T611 HydrophobicContact CG-CG2 4.24Å
256	T	96.9	Very high	96.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-88.2	158.7	-175.5	75.3	0	0	0	0	112.3	S258 E259 K260 Q614	T256-S258 VanDerWaalsContact C-N 3.27Å; T256-S258 PolarHBondContact O-N 3.24Å; T256-S258 PolarHBondContact OG1-OG 2.89Å; T256-E259 PolarHBondContact N-OE2 3.43Å; T256-E259 PolarHBondContact O-N 3.29Å; T256-E259 WeakPolarHBondContact OG1-CG 3.24Å; T256-E259 PolarHBondContact OG1-N 2.93Å; T256-K260 PolarHBondContact O-N 2.99Å; T256-K260 VanDerWaalsContact O-N 3.14Å; T256-Q614 HydrophobicContact CG2-CB 3.76Å
257	P	96.9	Very high	96.1	Very high	13 Å²	13	33.8 Å²	33.8	8%	0.084	17%	0.165	C	C	.	.	H	α-helix	trans	-58.3	-39.6	175.6	-25.2	35.2	0	0	0	112.5	E259 K260 H261 S402 A406	P257-E259 VanDerWaalsContact C-N 3.35Å; P257-E259 PolarHBondContact O-N 3.31Å; P257-K260 WeakPolarHBondContact O-CB 3.37Å; P257-K260 PolarHBondContact O-N 3.4Å; P257-H261 VanDerWaalsContact O-CG 3.23Å; P257-H261 PolarHBondContact O-N 3Å; P257-H261 PolarHBondContact O-ND1 3.28Å; P257-S402 WeakPolarHBondContact CD-OG 3.32Å; P257-A406 HydrophobicContact CB-CB 4.11Å; P257-A406 HydrophobicContact CG-CB 4.3Å
258	S	94.2	Very high	96.2	Very high	75 Å²	75	30.4 Å²	30.4	52%	0.524	15%	0.147	S	C	.	.	H	α-helix	trans	-62.9	-38.8	179.5	72.5	0	0	0	0	112.7	T256 H261 M262	T256-S258 VanDerWaalsContact C-N 3.27Å; T256-S258 PolarHBondContact O-N 3.24Å; T256-S258 PolarHBondContact OG1-OG 2.89Å; S258-H261 PolarHBondContact O-N 3.44Å; S258-M262 VanDerWaalsContact O-CB 3.31Å; S258-M262 WeakPolarHBondContact O-CB 3.38Å; S258-M262 PolarHBondContact O-N 3.17Å
259	E	95.8	Very high	96.2	Very high	56 Å²	56	30 Å²	30	26%	0.262	15%	0.145	S	C	.	.	H	α-helix	trans	-65.1	-46.1	174.5	-70.7	171.2	156.7	0	0	110.9	L255 T256 P257 H261 M262 L263 H604	L255-E259 PolarHBondContact N-OE2 3.15Å; T256-E259 PolarHBondContact N-OE2 3.43Å; T256-E259 PolarHBondContact O-N 3.29Å; T256-E259 WeakPolarHBondContact OG1-CG 3.24Å; T256-E259 PolarHBondContact OG1-N 2.93Å; P257-E259 VanDerWaalsContact C-N 3.35Å; P257-E259 PolarHBondContact O-N 3.31Å; E259-H261 VanDerWaalsContact C-N 3.34Å; E259-H261 PolarHBondContact O-N 2.89Å; E259-M262 WeakPolarHBondContact O-CB 3.29Å; E259-M262 PolarHBondContact O-N 3.18Å; E259-L263 WeakPolarHBondContact O-CG 3.38Å; E259-L263 PolarHBondContact O-N 3.01Å; E259-H604 IonicContact OE1-CD2 2.59Å; E259-H604 IonicContact OE1-CE1 3.12Å; E259-H604 IonicContact OE1-NE2 2.82Å; E259-H604 PolarHBondContact OE1-NE2 3.5Å; E259-H604 IonicContact OE2-NE2 3.79Å
260	K	97.3	Very high	96.3	Very high	23 Å²	23	29.1 Å²	29.1	10%	0.1	14%	0.142	C	C	.	.	H	α-helix	trans	-54.8	-50	175.2	179	-169.3	173.8	-165.5	0	111.2	Y249 Y254 T256 P257 L263 E410	Y249-K260 HydrophobicContact CD2-CG 4.37Å; Y249-K260 HydrophobicContact CE2-CG 3.8Å; Y254-K260 HydrophobicContact CD2-CB 3.7Å; Y254-K260 HydrophobicContact CD2-CG 4.28Å; Y254-K260 HydrophobicContact CE1-CG 4.42Å; Y254-K260 HydrophobicContact CE2-CB 3.71Å; Y254-K260 HydrophobicContact CE2-CD 4.06Å; Y254-K260 HydrophobicContact CE2-CG 3.79Å; Y254-K260 HydrophobicContact CG-CB 4.2Å; T256-K260 PolarHBondContact O-N 2.99Å; T256-K260 VanDerWaalsContact O-N 3.14Å; P257-K260 WeakPolarHBondContact O-CB 3.37Å; P257-K260 PolarHBondContact O-N 3.4Å; K260-L263 PolarHBondContact O-N 3.08Å; K260-E410 IonicContact NZ-OE1 3.43Å; K260-E410 PolarHBondContact NZ-OE1 2.98Å; K260-E410 IonicContact NZ-OE2 2.71Å; K260-E410 PolarHBondContact NZ-OE2 3.45Å
261	H	97.3	Very high	96.3	Very high	8 Å²	8	25.2 Å²	25.2	4%	0.037	12%	0.124	C	C	.	.	H	α-helix	trans	-69.7	-33.3	-178.1	-59.9	158.5	0	0	0	112.3	P257 S258 E259 L263 L264 K265 V305 E410	P257-H261 VanDerWaalsContact O-CG 3.23Å; P257-H261 PolarHBondContact O-N 3Å; P257-H261 PolarHBondContact O-ND1 3.28Å; S258-H261 PolarHBondContact O-N 3.44Å; E259-H261 VanDerWaalsContact C-N 3.34Å; E259-H261 PolarHBondContact O-N 2.89Å; H261-L263 VanDerWaalsContact C-N 3.33Å; H261-L263 PolarHBondContact O-N 2.98Å; H261-L264 PolarHBondContact O-N 3.45Å; H261-K265 WeakPolarHBondContact O-CG 3.28Å; H261-K265 PolarHBondContact O-N 3.49Å; H261-K265 VanDerWaalsContact O-N 3.08Å; H261-V305 HydrophobicContact CB-CB 4.08Å; H261-V305 HydrophobicContact CB-CG1 4.23Å; H261-V305 HydrophobicContact CB-CG2 4.43Å; H261-E410 IonicContact CD2-OE1 2.78Å; H261-E410 IonicContact CE1-OE1 3.47Å; H261-E410 IonicContact NE2-OE1 3.68Å; H261-E410 PolarHBondContact NE2-OE1 3.43Å
262	M	96.9	Very high	96.5	Very high	39 Å²	39	23.2 Å²	23.2	19%	0.192	11%	0.11	C	C	.	.	H	α-helix	trans	-57	-45.8	175	-177.8	63.6	69.7	0	0	111.5	K163 N166 S258 E259 L264 K265 V266	K163-M262 HydrophobicContact CG-CE 4.33Å; K163-M262 HydrophobicContact CG-CG 4.25Å; K163-M262 HydrophobicContact CG-SD 4.22Å; N166-M262 HydrophobicContact CB-CE 4.46Å; N166-M262 HydrophobicContact CB-SD 3.56Å; N166-M262 VanDerWaalsContact CB-SD 3.56Å; N166-M262 WeakPolarHBondContact ND2-CE 3.5Å; S258-M262 VanDerWaalsContact O-CB 3.31Å; S258-M262 WeakPolarHBondContact O-CB 3.38Å; S258-M262 PolarHBondContact O-N 3.17Å; E259-M262 WeakPolarHBondContact O-CB 3.29Å; E259-M262 PolarHBondContact O-N 3.18Å; M262-L264 VanDerWaalsContact C-N 3.28Å; M262-L264 PolarHBondContact O-N 3.25Å; M262-K265 PolarHBondContact O-N 3.43Å; M262-V266 HydrophobicContact CG-CG2 4.21Å; M262-V266 VanDerWaalsContact O-CG2 3.28Å; M262-V266 WeakPolarHBondContact O-CG2 3.46Å; M262-V266 PolarHBondContact O-N 3.29Å; M262-V266 HydrophobicContact SD-CG2 4.01Å
263	L	97.5	Very high	96.6	Very high	11 Å²	11	16.5 Å²	16.5	6%	0.058	9%	0.085	C	C	.	.	H	α-helix	trans	-56.1	-44	179.8	-59.6	176	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 4.3Å; C245-L263 HydrophobicContact CB-CD2 4.15Å; Y248-L263 HydrophobicContact CD2-CD2 4.45Å; Y249-L263 HydrophobicContact CD2-CD1 4.44Å; Y254-L263 HydrophobicContact CD1-CD1 3.8Å; Y254-L263 HydrophobicContact CG-CD1 4.49Å; E259-L263 WeakPolarHBondContact O-CG 3.38Å; E259-L263 PolarHBondContact O-N 3.01Å; K260-L263 PolarHBondContact O-N 3.08Å; H261-L263 VanDerWaalsContact C-N 3.33Å; H261-L263 PolarHBondContact O-N 2.98Å; L263-V266 PolarHBondContact O-N 3.2Å; L263-M267 HydrophobicContact CB-CE 4.12Å; L263-M267 VanDerWaalsContact O-CG 3.28Å; L263-M267 WeakPolarHBondContact O-CG 3.46Å; L263-M267 PolarHBondContact O-N 2.79Å
264	L	97.4	Very high	96.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-69.2	-39.7	180	-62.8	175.3	0	0	0	112.4	Y249 H261 M262 M267 G268 F299 L302 V305 L315	Y249-L264 HydrophobicContact CD1-CD2 4.42Å; Y249-L264 HydrophobicContact CD2-CD2 4Å; Y249-L264 HydrophobicContact CD2-CG 4.14Å; Y249-L264 HydrophobicContact CE1-CD2 4.3Å; Y249-L264 HydrophobicContact CE2-CD1 3.85Å; Y249-L264 HydrophobicContact CE2-CD2 3.87Å; Y249-L264 HydrophobicContact CE2-CG 3.88Å; Y249-L264 HydrophobicContact CG-CD2 4.27Å; H261-L264 PolarHBondContact O-N 3.45Å; M262-L264 VanDerWaalsContact C-N 3.28Å; M262-L264 PolarHBondContact O-N 3.25Å; L264-M267 HydrophobicContact CD2-CE 4.11Å; L264-M267 HydrophobicContact CD2-SD 4.2Å; L264-M267 PolarHBondContact O-N 3.3Å; L264-G268 PolarHBondContact O-N 2.96Å; L264-F299 HydrophobicContact CB-CE1 4.2Å; L264-F299 HydrophobicContact CD2-CD1 4.37Å; L264-F299 HydrophobicContact CD2-CE1 4.19Å; L264-L302 HydrophobicContact CD1-CB 4.32Å; L264-L302 HydrophobicContact CD1-CD2 3.64Å; L264-L302 HydrophobicContact CD1-CG 4.15Å; L264-V305 HydrophobicContact CD1-CG1 4.42Å; L264-L315 HydrophobicContact CB-CD1 3.87Å; L264-L315 HydrophobicContact CB-CD2 4.1Å; L264-L315 HydrophobicContact CD1-CD1 4.05Å
265	K	97	Very high	96.6	Very high	17 Å²	17	14.6 Å²	14.6	7%	0.074	8%	0.077	C	C	.	.	H	α-helix	trans	-63.1	-42.8	175.5	-70	-176.3	-68.4	-165.3	0	111.5	N166 H261 M262 G268 F269 V305 P306 L307 I313 L315	N166-K265 WeakPolarHBondContact OD1-CB 3.49Å; N166-K265 WeakPolarHBondContact OD1-CD 3.47Å; N166-K265 WeakPolarHBondContact OD1-CE 3.08Å; H261-K265 WeakPolarHBondContact O-CG 3.28Å; H261-K265 PolarHBondContact O-N 3.49Å; H261-K265 VanDerWaalsContact O-N 3.08Å; M262-K265 PolarHBondContact O-N 3.43Å; K265-G268 PolarHBondContact O-N 2.9Å; K265-F269 PolarHBondContact O-N 3.15Å; K265-V305 HydrophobicContact CD-CG2 4.21Å; K265-V305 HydrophobicContact CG-CG2 3.87Å; K265-P306 PolarHBondContact NZ-O 3.35Å; K265-L307 HydrophobicContact CD-CD1 3.97Å; K265-I313 HydrophobicContact CD-CG2 4.01Å; K265-I313 HydrophobicContact CG-CG2 4.03Å; K265-L315 HydrophobicContact CG-CD2 4.37Å
266	V	97.6	Very high	96.5	Very high	3 Å²	3	14.9 Å²	14.9	2%	0.018	8%	0.08	C	C	.	.	H	α-helix	trans	-64.8	-41.1	176.1	174.6	0	0	0	0	111.4	G162 I165 N166 I241 C245 M262 L263 G270	G162-V266 VanDerWaalsContact O-CG2 3.3Å; G162-V266 WeakPolarHBondContact O-CG2 3.32Å; I165-V266 HydrophobicContact CD1-CG1 4.04Å; I165-V266 HydrophobicContact CG1-CG1 4.39Å; N166-V266 HydrophobicContact CB-CG2 4.27Å; I241-V266 HydrophobicContact CG2-CG1 3.6Å; C245-V266 VanDerWaalsContact SG-CG1 3.53Å; M262-V266 HydrophobicContact CG-CG2 4.21Å; M262-V266 VanDerWaalsContact O-CG2 3.28Å; M262-V266 WeakPolarHBondContact O-CG2 3.46Å; M262-V266 PolarHBondContact O-N 3.29Å; M262-V266 HydrophobicContact SD-CG2 4.01Å; L263-V266 PolarHBondContact O-N 3.2Å; V266-G270 WeakPolarHBondContact O-CA 3.36Å; V266-G270 PolarHBondContact O-N 3.25Å
267	M	97.8	Very high	96.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-57.9	-49.7	172.6	-70.7	176.2	-141.2	0	0	111.3	C245 V246 Y249 L263 L264 L271 I295 Y298 F299	C245-M267 HydrophobicContact CB-CE 3.92Å; C245-M267 HydrophobicContact CB-CG 3.97Å; C245-M267 WeakPolarHBondContact O-CE 3.28Å; V246-M267 HydrophobicContact CG2-CE 4.22Å; V246-M267 HydrophobicContact CG2-CG 4.19Å; V246-M267 HydrophobicContact CG2-SD 3.74Å; Y249-M267 HydrophobicContact CG-CE 4.28Å; L263-M267 HydrophobicContact CB-CE 4.12Å; L263-M267 VanDerWaalsContact O-CG 3.28Å; L263-M267 WeakPolarHBondContact O-CG 3.46Å; L263-M267 PolarHBondContact O-N 2.79Å; L264-M267 HydrophobicContact CD2-CE 4.11Å; L264-M267 HydrophobicContact CD2-SD 4.2Å; L264-M267 PolarHBondContact O-N 3.3Å; M267-L271 WeakPolarHBondContact O-CB 3.41Å; M267-L271 VanDerWaalsContact O-CG 3.29Å; M267-L271 WeakPolarHBondContact O-CG 3.44Å; M267-L271 PolarHBondContact O-N 3.29Å; M267-I295 HydrophobicContact CB-CG2 4.3Å; M267-I295 HydrophobicContact SD-CG1 4.14Å; M267-Y298 HydrophobicContact CE-CD2 4.39Å; M267-Y298 HydrophobicContact SD-CD2 4.11Å; M267-F299 HydrophobicContact CB-CE1 4.43Å; M267-F299 HydrophobicContact CB-CZ 4.27Å
268	G	95.9	Very high	96	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.7	-55	-175.6	0	0	0	0	0	112.3	L264 K265 G270 L271 Y272 Y318	L264-G268 PolarHBondContact O-N 2.96Å; K265-G268 PolarHBondContact O-N 2.9Å; G268-G270 VanDerWaalsContact C-N 3.35Å; G268-G270 PolarHBondContact O-N 3.2Å; G268-L271 PolarHBondContact O-N 2.68Å; G268-Y272 PolarHBondContact O-N 3.37Å; G268-Y318 WeakPolarHBondContact O-CB 3.27Å
269	F	97.3	Very high	95.9	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-71.9	-30.8	-178.8	-164.8	-129.7	0	0	0	112.6	I165 A169 T221 L224 K265 Y272 L273 Y318	I165-F269 HydrophobicContact CB-CD1 4Å; I165-F269 HydrophobicContact CB-CE1 4.41Å; I165-F269 HydrophobicContact CG1-CD1 4.49Å; I165-F269 WeakPolarHBondContact O-CD1 3.22Å; I165-F269 WeakPolarHBondContact O-CE1 3.32Å; A169-F269 HydrophobicContact CB-CD1 3.88Å; A169-F269 HydrophobicContact CB-CD2 4.45Å; A169-F269 HydrophobicContact CB-CE1 3.94Å; A169-F269 HydrophobicContact CB-CG 4.14Å; A169-F269 HydrophobicContact CB-CZ 4.25Å; T221-F269 HydrophobicContact CG2-CE2 3.93Å; T221-F269 HydrophobicContact CG2-CZ 3.9Å; L224-F269 HydrophobicContact CD2-CE1 4.32Å; K265-F269 PolarHBondContact O-N 3.15Å; F269-Y272 AromaticContact CD2-CD1 3.85Å; F269-Y272 HydrophobicContact CD2-CD1 3.85Å; F269-Y272 HydrophobicContact CD2-CG 4.36Å; F269-Y272 AromaticContact CE2-CD1 3.69Å; F269-Y272 HydrophobicContact CE2-CD1 3.69Å; F269-Y272 HydrophobicContact CE2-CE1 4.15Å; F269-Y272 WeakPolarHBondContact O-CB 3.46Å; F269-Y272 PolarHBondContact O-N 3.45Å; F269-L273 HydrophobicContact CD1-CD1 3.96Å; F269-L273 HydrophobicContact CD1-CG 4.39Å; F269-L273 HydrophobicContact CE1-CD1 3.81Å; F269-L273 HydrophobicContact CE1-CD2 4.43Å; F269-L273 HydrophobicContact CE1-CG 4.23Å; F269-L273 HydrophobicContact CE2-CD2 4.38Å; F269-L273 HydrophobicContact CE2-CG 4.42Å; F269-L273 HydrophobicContact CZ-CD1 4.29Å; F269-L273 HydrophobicContact CZ-CD2 4.09Å; F269-L273 HydrophobicContact CZ-CG 4.25Å; F269-L273 WeakPolarHBondContact O-CG 3.34Å; F269-L273 PolarHBondContact O-N 3.3Å; F269-Y318 HydrophobicContact CB-CD1 4.4Å; F269-Y318 HydrophobicContact CB-CE1 4Å; F269-Y318 HydrophobicContact CB-CE2 4.39Å; 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 VanDerWaalsContact CD2-CE1 3.5Å; F269-Y318 HydrophobicContact CE2-CE1 4.36Å; F269-Y318 HydrophobicContact CG-CE1 4.12Å
270	G	96.7	Very high	95.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.1	-47.2	172.3	0	0	0	0	0	112.1	V266 G268 Y272 L273 M274	V266-G270 WeakPolarHBondContact O-CA 3.36Å; V266-G270 PolarHBondContact O-N 3.25Å; G268-G270 VanDerWaalsContact C-N 3.35Å; G268-G270 PolarHBondContact O-N 3.2Å; G270-Y272 VanDerWaalsContact C-N 3.33Å; G270-Y272 PolarHBondContact O-N 2.85Å; G270-L273 PolarHBondContact O-N 3.25Å; G270-M274 WeakPolarHBondContact O-CB 3.44Å; G270-M274 WeakPolarHBondContact O-CG 3.48Å; G270-M274 PolarHBondContact O-N 2.96Å
271	L	96.8	Very high	95.9	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-61.4	-41	173.5	-73.1	-176.3	0	0	0	112.2	V242 M267 G268 M274 D275 I281 I290 L292 I295 I319 W332	V242-L271 HydrophobicContact CG1-CD2 4.45Å; M267-L271 WeakPolarHBondContact O-CB 3.41Å; M267-L271 VanDerWaalsContact O-CG 3.29Å; M267-L271 WeakPolarHBondContact O-CG 3.44Å; M267-L271 PolarHBondContact O-N 3.29Å; G268-L271 PolarHBondContact O-N 2.68Å; L271-M274 PolarHBondContact O-N 3.42Å; L271-D275 WeakPolarHBondContact O-CB 3.45Å; L271-D275 PolarHBondContact O-N 3.02Å; L271-D275 VanDerWaalsContact O-N 3.12Å; L271-I281 HydrophobicContact CD2-CG2 4.23Å; L271-I290 HydrophobicContact CD2-CD1 3.83Å; L271-L292 HydrophobicContact CD1-CD2 3.93Å; L271-L292 HydrophobicContact CD2-CD2 3.77Å; L271-I295 HydrophobicContact CD1-CD1 3.77Å; L271-I295 HydrophobicContact CD1-CG2 3.96Å; L271-I295 HydrophobicContact CD2-CD1 4.3Å; L271-I295 HydrophobicContact CG-CD1 4.2Å; L271-I319 HydrophobicContact CD1-CD1 3.85Å; L271-W332 HydrophobicContact CD1-CH2 4.13Å
272	Y	97	Very high	95.8	Very high	46 Å²	46	17.9 Å²	17.9	18%	0.18	10%	0.104	C	C	.	.	H	α-helix	trans	-60.5	-44	176.8	178.4	-94.7	0	0	0	112.2	T221 Q225 G268 F269 G270 M274 D275 Y318 T321	T221-Y272 HydrophobicContact CG2-CE1 3.77Å; Q225-Y272 VanDerWaalsContact NE2-CE1 3.33Å; G268-Y272 PolarHBondContact O-N 3.37Å; F269-Y272 AromaticContact CD2-CD1 3.85Å; F269-Y272 HydrophobicContact CD2-CD1 3.85Å; F269-Y272 HydrophobicContact CD2-CG 4.36Å; F269-Y272 AromaticContact CE2-CD1 3.69Å; F269-Y272 HydrophobicContact CE2-CD1 3.69Å; F269-Y272 HydrophobicContact CE2-CE1 4.15Å; F269-Y272 WeakPolarHBondContact O-CB 3.46Å; F269-Y272 PolarHBondContact O-N 3.45Å; G270-Y272 VanDerWaalsContact C-N 3.33Å; G270-Y272 PolarHBondContact O-N 2.85Å; Y272-M274 VanDerWaalsContact C-N 3.34Å; Y272-D275 PolarHBondContact O-N 3.4Å; Y272-Y318 HydrophobicContact CG-CD1 4.42Å; Y272-T321 WeakPolarHBondContact CE2-O 3.5Å
273	L	96	Very high	95.6	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-71.3	-27.8	177.3	-68	175.3	0	0	0	113.1	I165 L224 Q225 L228 Y234 L238 F269 G270	I165-L273 HydrophobicContact CB-CD1 4.21Å; I165-L273 HydrophobicContact CG2-CD1 4.06Å; L224-L273 HydrophobicContact CD2-CD1 3.82Å; L224-L273 HydrophobicContact CD2-CD2 4.16Å; Q225-L273 HydrophobicContact CG-CD2 3.63Å; L228-L273 HydrophobicContact CD1-CD1 4.34Å; Y234-L273 PolarHBondContact OH-O 2.85Å; L238-L273 HydrophobicContact CD1-CB 3.94Å; F269-L273 HydrophobicContact CD1-CD1 3.96Å; F269-L273 HydrophobicContact CD1-CG 4.39Å; F269-L273 HydrophobicContact CE1-CD1 3.81Å; F269-L273 HydrophobicContact CE1-CD2 4.43Å; F269-L273 HydrophobicContact CE1-CG 4.23Å; F269-L273 HydrophobicContact CE2-CD2 4.38Å; F269-L273 HydrophobicContact CE2-CG 4.42Å; F269-L273 HydrophobicContact CZ-CD1 4.29Å; F269-L273 HydrophobicContact CZ-CD2 4.09Å; F269-L273 HydrophobicContact CZ-CG 4.25Å; F269-L273 WeakPolarHBondContact O-CG 3.34Å; F269-L273 PolarHBondContact O-N 3.3Å; G270-L273 PolarHBondContact O-N 3.25Å
274	M	95.9	Very high	95.4	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-79.3	-16.3	177	-71	168.8	62.5	0	0	113.6	E235 L238 A239 V242 G270 L271 Y272 S279 I281 L284 I290	E235-M274 HydrophobicContact CB-CG 4.44Å; L238-M274 HydrophobicContact CB-CG 3.54Å; L238-M274 HydrophobicContact CB-SD 3.68Å; L238-M274 HydrophobicContact CD1-CG 3.82Å; L238-M274 HydrophobicContact CG-CG 4.35Å; A239-M274 HydrophobicContact CB-CE 3.64Å; A239-M274 HydrophobicContact CB-SD 4.41Å; V242-M274 HydrophobicContact CG2-SD 4.22Å; G270-M274 WeakPolarHBondContact O-CB 3.44Å; G270-M274 WeakPolarHBondContact O-CG 3.48Å; G270-M274 PolarHBondContact O-N 2.96Å; L271-M274 PolarHBondContact O-N 3.42Å; Y272-M274 VanDerWaalsContact C-N 3.34Å; M274-S279 CarbonylContact O-C 3.42Å; M274-S279 WeakPolarHBondContact O-CB 3.37Å; M274-S279 PolarHBondContact O-OG 2.9Å; M274-I281 HydrophobicContact CB-CG2 3.6Å; M274-L284 HydrophobicContact CE-CD1 3.45Å; M274-L284 VanDerWaalsContact CE-CD1 3.45Å; M274-I290 HydrophobicContact CE-CD1 4.2Å; M274-I290 HydrophobicContact CE-CG2 4.13Å
275	D	95.6	Very high	95.3	Very high	3 Å²	3	23.9 Å²	23.9	2%	0.016	13%	0.13	C	C	.	.	S	Bend	trans	-103.9	84.3	-177.9	-159.4	43.6	0	0	0	110.7	L271 Y272 I281 S322 A323 H324	L271-D275 WeakPolarHBondContact O-CB 3.45Å; L271-D275 PolarHBondContact O-N 3.02Å; L271-D275 VanDerWaalsContact O-N 3.12Å; Y272-D275 PolarHBondContact O-N 3.4Å; D275-I281 HydrophobicContact CB-CB 4.48Å; D275-I281 HydrophobicContact CB-CD1 4.06Å; D275-I281 HydrophobicContact CB-CG1 4.02Å; D275-I281 HydrophobicContact CB-CG2 3.83Å; D275-I281 PolarHBondContact OD1-N 3.17Å; D275-S322 VanDerWaalsContact OD2-CB 3.31Å; D275-S322 WeakPolarHBondContact OD2-CB 3.28Å; D275-S322 PolarHBondContact OD2-OG 3.07Å; D275-A323 VanDerWaalsContact O-CB 3.29Å; D275-A323 WeakPolarHBondContact O-CB 3.43Å; D275-A323 PolarHBondContact OD2-N 3.06Å; D275-H324 VanDerWaalsContact CG-ND1 3.33Å; D275-H324 IonicContact OD1-CE1 3.85Å; D275-H324 IonicContact OD1-CG 2.7Å; D275-H324 IonicContact OD1-ND1 3.9Å; D275-H324 PolarHBondContact OD1-ND1 3.36Å; D275-H324 IonicContact OD2-CG 3.75Å; D275-H324 PolarHBondContact OD2-N 2.91Å; D275-H324 IonicContact OD2-ND1 2.99Å; D275-H324 PolarHBondContact OD2-ND1 3.22Å
276	G	92.6	Very high	95.1	Very high	9 Å²	9	27 Å²	27	9%	0.093	16%	0.158	C	C	.	.	S	Bend	trans	-138.6	-156.1	-170.5	0	0	0	0	0	113.3	E229 S279 H324	E229-G276 WeakPolarHBondContact OE1-CA 3.47Å; G276-S279 PolarHBondContact N-O 2.87Å; G276-H324 PolarHBondContact O-CE1 3.46Å; G276-H324 VanDerWaalsContact O-CE1 3.22Å
277	S	90.9	Very high	94.9	Very high	99 Å²	99	34.4 Å²	34.4	69%	0.692	19%	0.191	S	C	*	.	S	Bend	trans	-72.8	-29.7	-177.1	70.8	0	0	0	0	113	E229	E229-S277 VanDerWaalsContact CD-OG 3.27Å; E229-S277 PolarHBondContact OE1-N 3.32Å; E229-S277 PolarHBondContact OE1-OG 2.71Å; E229-S277 PolarHBondContact OE2-OG 3.26Å
278	V	92.1	Very high	94.7	Very high	94 Å²	94	43.7 Å²	43.7	57%	0.57	23%	0.231	S	C	*	.	S	Bend	trans	-99	-31.6	-174.9	-177.9	0	0	0	0	112.9	E229	E229-V278 HydrophobicContact CB-CG2 4.06Å; E229-V278 HydrophobicContact CG-CG2 4.37Å
279	S	93.6	Very high	94.5	Very high	10 Å²	10	45.8 Å²	45.8	7%	0.07	24%	0.239	C	C	.	.			trans	-124.8	151.5	-173.9	169.2	0	0	0	0	111.1	E235 M274 G276	E235-S279 WeakPolarHBondContact CB-OG 2.99Å; E235-S279 WeakPolarHBondContact CG-OG 3.21Å; M274-S279 CarbonylContact O-C 3.42Å; M274-S279 WeakPolarHBondContact O-CB 3.37Å; M274-S279 PolarHBondContact O-OG 2.9Å; G276-S279 PolarHBondContact N-O 2.87Å
280	N	95.4	Very high	94.4	Very high	23 Å²	23	45.7 Å²	45.7	12%	0.123	24%	0.239	C	C	.	.			trans	-137.9	119.9	-179.9	178.7	-67.8	0	0	0	109.9	Y282 K283 L284 H324	N280-Y282 VanDerWaalsContact C-N 3.32Å; N280-Y282 PolarHBondContact O-N 3.47Å; N280-Y282 WeakPolarHBondContact OD1-CB 3.21Å; N280-Y282 PolarHBondContact OD1-N 3.13Å; N280-K283 HydrophobicContact CB-CB 4.38Å; N280-K283 HydrophobicContact CB-CD 4.13Å; N280-K283 HydrophobicContact CB-CG 4.25Å; N280-K283 PolarHBondContact O-N 3.24Å; N280-K283 PolarHBondContact OD1-N 3.32Å; N280-L284 PolarHBondContact O-N 3.09Å; N280-H324 PolarHBondContact ND2-CD2 3.08Å; N280-H324 PolarHBondContact ND2-CE1 2.87Å; N280-H324 PolarHBondContact ND2-ND1 3.3Å
281	I	96.1	Very high	94.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.9	-31.5	-173.2	60.4	176.6	0	0	0	112.9	L271 M274 D275 K283 L284 D285 I290 L292 W332	L271-I281 HydrophobicContact CD2-CG2 4.23Å; M274-I281 HydrophobicContact CB-CG2 3.6Å; D275-I281 HydrophobicContact CB-CB 4.48Å; D275-I281 HydrophobicContact CB-CD1 4.06Å; D275-I281 HydrophobicContact CB-CG1 4.02Å; D275-I281 HydrophobicContact CB-CG2 3.83Å; D275-I281 PolarHBondContact OD1-N 3.17Å; I281-K283 VanDerWaalsContact C-N 3.35Å; I281-K283 PolarHBondContact O-N 3.49Å; I281-L284 WeakPolarHBondContact O-CB 3.39Å; I281-L284 PolarHBondContact O-N 2.96Å; I281-D285 WeakPolarHBondContact O-CB 3.49Å; I281-D285 PolarHBondContact O-N 3.04Å; I281-I290 HydrophobicContact CB-CD1 4.05Å; I281-I290 HydrophobicContact CG2-CD1 4.42Å; I281-L292 HydrophobicContact CD1-CD2 4.41Å; I281-W332 HydrophobicContact CD1-CZ2 4.49Å
282	Y	94.9	Very high	94.3	Very high	12 Å²	12	49 Å²	49	5%	0.047	26%	0.256	C	S	.	.	H	α-helix	trans	-70.6	-33.2	179.4	-53.7	-79.2	0	0	0	111.9	N280 A286 L292 H324 N328 R331 W332	N280-Y282 VanDerWaalsContact C-N 3.32Å; N280-Y282 PolarHBondContact O-N 3.47Å; N280-Y282 WeakPolarHBondContact OD1-CB 3.21Å; N280-Y282 PolarHBondContact OD1-N 3.13Å; Y282-A286 WeakPolarHBondContact O-CB 3.17Å; Y282-A286 PolarHBondContact O-N 3.07Å; Y282-L292 HydrophobicContact CD1-CD1 3.8Å; Y282-L292 HydrophobicContact CE1-CD1 4.14Å; Y282-H324 HydrophobicContact CD2-CB 4.13Å; Y282-H324 HydrophobicContact CE2-CB 3.86Å; Y282-H324 VanDerWaalsContact CE2-O 3.27Å; Y282-H324 WeakPolarHBondContact CE2-O 3.31Å; Y282-N328 HydrophobicContact CD1-CB 3.77Å; Y282-N328 HydrophobicContact CD2-CB 4.15Å; Y282-N328 WeakPolarHBondContact CD2-ND2 3.42Å; Y282-N328 HydrophobicContact CE1-CB 3.35Å; Y282-N328 HydrophobicContact CE2-CB 3.78Å; Y282-N328 HydrophobicContact CG-CB 4.14Å; Y282-R331 HydrophobicContact CD1-CG 4.41Å; Y282-R331 HydrophobicContact CE1-CB 4.44Å; Y282-R331 HydrophobicContact CE1-CG 4.43Å; Y282-W332 HydrophobicContact CE1-CZ2 4.25Å; Y282-W332 AromaticContact CE1-NE1 3.53Å; Y282-W332 AromaticContact CZ-NE1 3.72Å; Y282-W332 PolarHBondContact OH-NE1 3.12Å
283	K	94.1	Very high	94.2	Very high	143 Å²	143	50.4 Å²	50.4	62%	0.622	27%	0.272	S	S	*	.	H	α-helix	trans	-71	-36.4	171.6	-67.5	-179.2	-174.1	169.1	0	111.9	N280 I281 A286 K287	N280-K283 HydrophobicContact CB-CB 4.38Å; N280-K283 HydrophobicContact CB-CD 4.13Å; N280-K283 HydrophobicContact CB-CG 4.25Å; N280-K283 PolarHBondContact O-N 3.24Å; N280-K283 PolarHBondContact OD1-N 3.32Å; I281-K283 VanDerWaalsContact C-N 3.35Å; I281-K283 PolarHBondContact O-N 3.49Å; K283-A286 PolarHBondContact O-N 2.96Å; K283-K287 WeakPolarHBondContact O-CG 3.49Å; K283-K287 PolarHBondContact O-N 2.77Å
284	L	93.6	Very high	94.2	Very high	10 Å²	10	53.3 Å²	53.3	5%	0.052	29%	0.285	C	S	.	.	H	α-helix	trans	-65	-41.8	173.8	-68.1	173.9	0	0	0	111.1	E235 M274 N280 I281 K287 K288 R289 I290	E235-L284 HydrophobicContact CB-CD1 4.45Å; E235-L284 HydrophobicContact CG-CD1 4.29Å; M274-L284 HydrophobicContact CE-CD1 3.45Å; M274-L284 VanDerWaalsContact CE-CD1 3.45Å; N280-L284 PolarHBondContact O-N 3.09Å; I281-L284 WeakPolarHBondContact O-CB 3.39Å; I281-L284 PolarHBondContact O-N 2.96Å; L284-K287 CarbonylContact O-C 3.52Å; L284-K287 WeakPolarHBondContact O-CB 3.24Å; L284-K287 PolarHBondContact O-N 2.88Å; L284-K288 PolarHBondContact O-N 2.87Å; L284-R289 HydrophobicContact CB-CB 4.23Å; L284-R289 HydrophobicContact CD2-CB 4.38Å; L284-R289 HydrophobicContact CD2-CG 4.24Å; L284-R289 VanDerWaalsContact O-CB 3.28Å; L284-R289 WeakPolarHBondContact O-CB 3.39Å; L284-R289 PolarHBondContact O-N 3.11Å; L284-I290 HydrophobicContact CB-CD1 4.08Å; L284-I290 HydrophobicContact CB-CG1 4.07Å
285	D	94.2	Very high	94.3	Very high	23 Å²	23	53.3 Å²	53.3	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-41.4	173.8	-177.6	82.7	0	0	0	112.5	I281 K287 K288 I290 L292 R331	I281-D285 WeakPolarHBondContact O-CB 3.49Å; I281-D285 PolarHBondContact O-N 3.04Å; D285-K287 PolarHBondContact O-N 3.26Å; D285-K288 VanDerWaalsContact O-CA 3.31Å; D285-K288 WeakPolarHBondContact O-CA 3.31Å; D285-K288 PolarHBondContact O-N 3.03Å; D285-I290 HydrophobicContact CB-CG1 4.25Å; D285-L292 HydrophobicContact CB-CD1 3.62Å; D285-L292 HydrophobicContact CB-CG 3.78Å; D285-L292 PolarHBondContact OD1-N 2.69Å; D285-R331 IonicContact OD2-CZ 2.71Å; D285-R331 IonicContact OD2-NH1 3.66Å; D285-R331 IonicContact OD2-NH2 3.63Å; D285-R331 PolarHBondContact OD2-NH2 2.69Å
286	A	93.1	Very high	94.3	Very high	81 Å²	81	53.8 Å²	53.8	67%	0.669	29%	0.288	S	S	*	.	H	α-helix	trans	-60.6	-31.6	174	0	0	0	0	0	112.8	Y282 K283 K288	Y282-A286 WeakPolarHBondContact O-CB 3.17Å; Y282-A286 PolarHBondContact O-N 3.07Å; K283-A286 PolarHBondContact O-N 2.96Å; A286-K288 PolarHBondContact O-N 3.21Å
287	K	93.3	Very high	94.4	Very high	160 Å²	160	59.9 Å²	59.9	70%	0.696	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	2.5	172	-66.2	175.2	-174.8	176.9	0	113.3	K283 L284 D285 R289	K283-K287 WeakPolarHBondContact O-CG 3.49Å; K283-K287 PolarHBondContact O-N 2.77Å; L284-K287 CarbonylContact O-C 3.52Å; L284-K287 WeakPolarHBondContact O-CB 3.24Å; L284-K287 PolarHBondContact O-N 2.88Å; D285-K287 PolarHBondContact O-N 3.26Å; K287-R289 PolarHBondContact O-N 2.88Å
288	K	93.1	Very high	94.6	Very high	194 Å²	194	55.8 Å²	55.8	84%	0.843	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	28.9	-172.5	-55.5	-176.1	178.4	-176.5	0	113.1	L284 D285 A286	L284-K288 PolarHBondContact O-N 2.87Å; D285-K288 VanDerWaalsContact O-CA 3.31Å; D285-K288 WeakPolarHBondContact O-CA 3.31Å; D285-K288 PolarHBondContact O-N 3.03Å; A286-K288 PolarHBondContact O-N 3.21Å
289	R	93.1	Very high	94.8	Very high	44 Å²	44	51.4 Å²	51.4	17%	0.166	25%	0.254	C	S	.	.	S	Bend	trans	-77.4	-32.7	-179.6	-179.1	53.1	176.6	94.7	-1.1	112.3	E236 A239 D240 N243 L284 K287	E236-R289 PolarHBondContact O-NH2 3.5Å; E236-R289 IonicContact OE2-CZ 2.72Å; E236-R289 IonicContact OE2-NE 2.82Å; E236-R289 PolarHBondContact OE2-NE 3.33Å; E236-R289 IonicContact OE2-NH2 3.72Å; E236-R289 PolarHBondContact OE2-NH2 2.94Å; A239-R289 HydrophobicContact CB-CG 4.28Å; A239-R289 VanDerWaalsContact CB-NH1 3.33Å; D240-R289 IonicContact OD1-CZ 3.49Å; D240-R289 IonicContact OD1-NH1 3.97Å; D240-R289 PolarHBondContact OD1-NH1 3.37Å; D240-R289 IonicContact OD1-NH2 2.82Å; D240-R289 PolarHBondContact OD1-NH2 3.13Å; D240-R289 IonicContact OD2-NH2 3.65Å; N243-R289 PolarHBondContact ND2-NH1 3.15Å; N243-R289 VanDerWaalsContact ND2-NH1 3.12Å; N243-R289 PolarHBondContact ND2-O 3.11Å; L284-R289 HydrophobicContact CB-CB 4.23Å; L284-R289 HydrophobicContact CD2-CB 4.38Å; L284-R289 HydrophobicContact CD2-CG 4.24Å; L284-R289 VanDerWaalsContact O-CB 3.28Å; L284-R289 WeakPolarHBondContact O-CB 3.39Å; L284-R289 PolarHBondContact O-N 3.11Å; K287-R289 PolarHBondContact O-N 2.88Å
290	I	94.8	Very high	94.7	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.026	27%	0.271	C	S	.	.	S	Bend	trans	-132.4	166.7	171.4	58.8	178.6	0	0	0	107.9	A239 L271 M274 I281 L284 D285 L292	A239-I290 HydrophobicContact CB-CG2 3.73Å; L271-I290 HydrophobicContact CD2-CD1 3.83Å; M274-I290 HydrophobicContact CE-CD1 4.2Å; M274-I290 HydrophobicContact CE-CG2 4.13Å; I281-I290 HydrophobicContact CB-CD1 4.05Å; I281-I290 HydrophobicContact CG2-CD1 4.42Å; L284-I290 HydrophobicContact CB-CD1 4.08Å; L284-I290 HydrophobicContact CB-CG1 4.07Å; D285-I290 HydrophobicContact CB-CG1 4.25Å; I290-L292 HydrophobicContact CD1-CD2 3.73Å; I290-L292 HydrophobicContact CD1-CG 4.3Å; I290-L292 HydrophobicContact CG1-CD2 4.35Å
291	N	95.2	Very high	94.4	Very high	65 Å²	65	58.8 Å²	58.8	35%	0.348	29%	0.285	S	S	.	.			trans	-123.3	93.2	177.8	-171.6	-31.5	0	0	0	110.1	S293 K294	N291-S293 PolarHBondContact O-N 3.16Å; N291-S293 WeakPolarHBondContact OD1-CB 3.48Å; N291-S293 PolarHBondContact OD1-N 3.28Å; N291-K294 PolarHBondContact O-N 2.68Å; N291-K294 PolarHBondContact OD1-N 3.44Å; N291-K294 VanDerWaalsContact OD1-N 3.09Å
292	L	95.6	Very high	94.3	Very high	5 Å²	5	59 Å²	59	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-65.9	-30	-178.5	-62.2	177.7	0	0	0	111.9	L271 I281 Y282 D285 I290 K294 I295 D296 W332	L271-L292 HydrophobicContact CD1-CD2 3.93Å; L271-L292 HydrophobicContact CD2-CD2 3.77Å; I281-L292 HydrophobicContact CD1-CD2 4.41Å; Y282-L292 HydrophobicContact CD1-CD1 3.8Å; Y282-L292 HydrophobicContact CE1-CD1 4.14Å; D285-L292 HydrophobicContact CB-CD1 3.62Å; D285-L292 HydrophobicContact CB-CG 3.78Å; D285-L292 PolarHBondContact OD1-N 2.69Å; I290-L292 HydrophobicContact CD1-CD2 3.73Å; I290-L292 HydrophobicContact CD1-CG 4.3Å; I290-L292 HydrophobicContact CG1-CD2 4.35Å; L292-K294 PolarHBondContact O-N 2.93Å; L292-I295 PolarHBondContact O-N 3.32Å; L292-D296 WeakPolarHBondContact O-CB 3.41Å; L292-D296 PolarHBondContact O-N 2.75Å; L292-W332 HydrophobicContact CB-CH2 4.07Å; L292-W332 HydrophobicContact CB-CZ2 4.42Å; L292-W332 HydrophobicContact CD1-CZ2 4.26Å; L292-W332 HydrophobicContact CD2-CH2 3.93Å; L292-W332 HydrophobicContact CD2-CZ2 4.22Å; L292-W332 HydrophobicContact CG-CH2 4.41Å
293	S	95.6	Very high	94.1	Very high	75 Å²	75	59.3 Å²	59.3	52%	0.524	29%	0.289	S	S	.	.	H	α-helix	trans	-65.3	-36.2	179.6	-59.9	0	0	0	0	113.3	N291 K297	N291-S293 PolarHBondContact O-N 3.16Å; N291-S293 WeakPolarHBondContact OD1-CB 3.48Å; N291-S293 PolarHBondContact OD1-N 3.28Å; S293-K297 WeakPolarHBondContact O-CB 3.24Å; S293-K297 PolarHBondContact O-N 3.02Å; S293-K297 VanDerWaalsContact O-N 3.1Å
294	K	96.2	Very high	94.1	Very high	64 Å²	64	52.6 Å²	52.6	28%	0.278	26%	0.259	S	S	.	.	H	α-helix	trans	-65.9	-45.4	174	-77	-170.5	-179.9	-169.7	0	111.2	V246 E250 N291 L292 K297 Y298	V246-K294 HydrophobicContact CG1-CB 4.23Å; V246-K294 HydrophobicContact CG1-CD 3.8Å; E250-K294 WeakPolarHBondContact OE1-CE 3.38Å; E250-K294 IonicContact OE1-NZ 2.9Å; E250-K294 PolarHBondContact OE1-NZ 2.82Å; E250-K294 IonicContact OE2-NZ 2.8Å; E250-K294 PolarHBondContact OE2-NZ 2.67Å; N291-K294 PolarHBondContact O-N 2.68Å; N291-K294 PolarHBondContact OD1-N 3.44Å; N291-K294 VanDerWaalsContact OD1-N 3.09Å; L292-K294 PolarHBondContact O-N 2.93Å; K294-K297 WeakPolarHBondContact O-CB 3.27Å; K294-K297 PolarHBondContact O-N 3.42Å; K294-Y298 HydrophobicContact CB-CE2 4.12Å; K294-Y298 WeakPolarHBondContact O-CD2 3.48Å; K294-Y298 VanDerWaalsContact O-CG 3.22Å; K294-Y298 PolarHBondContact O-N 3.37Å
295	I	96.9	Very high	94.2	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-64.5	-43.7	-179.8	-59	171.8	0	0	0	110.5	V242 V246 M267 L271 L292 K297 Y298 F299	V242-I295 HydrophobicContact CG1-CD1 3.67Å; V246-I295 HydrophobicContact CG2-CD1 3.96Å; V246-I295 HydrophobicContact CG2-CG1 3.63Å; M267-I295 HydrophobicContact CB-CG2 4.3Å; M267-I295 HydrophobicContact SD-CG1 4.14Å; L271-I295 HydrophobicContact CD1-CD1 3.77Å; L271-I295 HydrophobicContact CD1-CG2 3.96Å; L271-I295 HydrophobicContact CD2-CD1 4.3Å; L271-I295 HydrophobicContact CG-CD1 4.2Å; L292-I295 PolarHBondContact O-N 3.32Å; I295-K297 VanDerWaalsContact C-N 3.31Å; I295-K297 PolarHBondContact O-N 2.52Å; I295-Y298 PolarHBondContact O-N 3.49Å; I295-Y298 VanDerWaalsContact O-N 3.15Å; I295-F299 HydrophobicContact CG2-CD1 4.38Å; I295-F299 HydrophobicContact CG2-CD2 4.27Å; I295-F299 HydrophobicContact CG2-CE1 4.13Å; I295-F299 HydrophobicContact CG2-CE2 4.02Å; I295-F299 HydrophobicContact CG2-CG 4.46Å; I295-F299 HydrophobicContact CG2-CZ 3.94Å; I295-F299 PolarHBondContact O-N 2.9Å
296	D	95.8	Very high	94.3	Very high	13 Å²	13	52.5 Å²	52.5	7%	0.07	26%	0.261	C	S	.	.	H	α-helix	trans	-56.6	-44.8	173.6	-176.2	58.7	0	0	0	111.6	L292 Y298 F299 K300 W332 T333 C334	L292-D296 WeakPolarHBondContact O-CB 3.41Å; L292-D296 PolarHBondContact O-N 2.75Å; D296-Y298 PolarHBondContact O-N 3.43Å; D296-F299 PolarHBondContact O-N 3.29Å; D296-K300 VanDerWaalsContact O-CB 3.23Å; D296-K300 WeakPolarHBondContact O-CB 3.4Å; D296-K300 PolarHBondContact O-N 2.92Å; D296-W332 HydrophobicContact CB-CE3 3.7Å; D296-W332 HydrophobicContact CB-CZ3 3.85Å; D296-W332 WeakPolarHBondContact OD1-CA 3.31Å; D296-T333 VanDerWaalsContact CG-N 3.33Å; D296-T333 PolarHBondContact OD1-N 3.23Å; D296-T333 WeakPolarHBondContact OD2-CB 3.43Å; D296-T333 PolarHBondContact OD2-N 3.38Å; D296-T333 VanDerWaalsContact OD2-N 3.08Å; D296-T333 PolarHBondContact OD2-OG1 2.74Å; D296-C334 WeakPolarHBondContact OD1-CB 3.44Å; D296-C334 PolarHBondContact OD1-N 3.27Å; D296-C334 PolarHBondContact OD1-SG 2.61Å
297	K	95.2	Very high	94.4	Very high	136 Å²	136	49.1 Å²	49.1	59%	0.591	23%	0.231	S	C	*	.	H	α-helix	trans	-61.3	-44.2	175.7	-177.3	-174.3	174.2	-174.5	0	111.7	S293 K294 I295 K300 Q301	S293-K297 WeakPolarHBondContact O-CB 3.24Å; S293-K297 PolarHBondContact O-N 3.02Å; S293-K297 VanDerWaalsContact O-N 3.1Å; K294-K297 WeakPolarHBondContact O-CB 3.27Å; K294-K297 PolarHBondContact O-N 3.42Å; I295-K297 VanDerWaalsContact C-N 3.31Å; I295-K297 PolarHBondContact O-N 2.52Å; K297-K300 PolarHBondContact O-N 3.19Å; K297-Q301 WeakPolarHBondContact O-CB 3.39Å; K297-Q301 PolarHBondContact O-N 3.19Å
298	Y	95.5	Very high	94.5	Very high	14 Å²	14	42.3 Å²	42.3	6%	0.055	20%	0.202	C	C	.	.	H	α-helix	trans	-66.4	-42.6	179.8	-57.7	-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 3.73Å; Y249-Y298 HydrophobicContact CD1-CD2 3.73Å; Y249-Y298 HydrophobicContact CD1-CE1 4.03Å; Y249-Y298 AromaticContact CD1-CE2 3.91Å; Y249-Y298 HydrophobicContact CD1-CE2 3.91Å; Y249-Y298 AromaticContact CD1-CG 3.72Å; Y249-Y298 HydrophobicContact CD1-CG 3.72Å; Y249-Y298 AromaticContact CE1-CD1 3.73Å; Y249-Y298 HydrophobicContact CE1-CD1 3.73Å; Y249-Y298 HydrophobicContact CE1-CD2 4.23Å; Y249-Y298 HydrophobicContact CE1-CE1 4.26Å; Y249-Y298 AromaticContact CE1-CG 3.75Å; Y249-Y298 HydrophobicContact CE1-CG 3.75Å; E250-Y298 WeakPolarHBondContact CB-OH 3.3Å; M267-Y298 HydrophobicContact CE-CD2 4.39Å; M267-Y298 HydrophobicContact SD-CD2 4.11Å; K294-Y298 HydrophobicContact CB-CE2 4.12Å; K294-Y298 WeakPolarHBondContact O-CD2 3.48Å; K294-Y298 VanDerWaalsContact O-CG 3.22Å; K294-Y298 PolarHBondContact O-N 3.37Å; I295-Y298 PolarHBondContact O-N 3.49Å; I295-Y298 VanDerWaalsContact O-N 3.15Å; D296-Y298 PolarHBondContact O-N 3.43Å; Y298-K300 VanDerWaalsContact C-N 3.31Å; Y298-K300 PolarHBondContact O-N 3.49Å; Y298-Q301 CarbonylContact O-C 3.32Å; Y298-Q301 PolarHBondContact O-N 3.01Å; Y298-Q301 VanDerWaalsContact O-N 3.1Å; Y298-L302 PolarHBondContact O-N 3.09Å
299	F	95.1	Very high	94.5	Very high	1 Å²	1	33.4 Å²	33.4	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-69.4	-30.7	176.5	-72.6	5	0	0	0	112.2	L264 M267 I295 D296 Q301 L302 Q303 L315 I319 C334	L264-F299 HydrophobicContact CB-CE1 4.2Å; L264-F299 HydrophobicContact CD2-CD1 4.37Å; L264-F299 HydrophobicContact CD2-CE1 4.19Å; M267-F299 HydrophobicContact CB-CE1 4.43Å; M267-F299 HydrophobicContact CB-CZ 4.27Å; I295-F299 HydrophobicContact CG2-CD1 4.38Å; I295-F299 HydrophobicContact CG2-CD2 4.27Å; I295-F299 HydrophobicContact CG2-CE1 4.13Å; I295-F299 HydrophobicContact CG2-CE2 4.02Å; I295-F299 HydrophobicContact CG2-CG 4.46Å; I295-F299 HydrophobicContact CG2-CZ 3.94Å; I295-F299 PolarHBondContact O-N 2.9Å; D296-F299 PolarHBondContact O-N 3.29Å; F299-Q301 VanDerWaalsContact C-N 3.3Å; F299-L302 WeakPolarHBondContact CA-O 3.43Å; F299-L302 CarbonylContact O-C 3.25Å; F299-Q303 WeakPolarHBondContact O-CA 3.29Å; F299-Q303 WeakPolarHBondContact O-CG 3.28Å; F299-Q303 PolarHBondContact O-N 3Å; F299-L315 HydrophobicContact CB-CB 4.5Å; F299-L315 HydrophobicContact CD1-CB 3.82Å; F299-L315 HydrophobicContact CD1-CD1 3.82Å; F299-L315 HydrophobicContact CD1-CG 4.33Å; F299-L315 HydrophobicContact CD2-CB 3.84Å; F299-L315 HydrophobicContact CE1-CB 3.88Å; F299-L315 HydrophobicContact CE1-CD1 3.94Å; F299-L315 HydrophobicContact CE1-CD2 4.11Å; F299-L315 HydrophobicContact CE1-CG 4.2Å; F299-L315 HydrophobicContact CE2-CB 3.89Å; F299-L315 WeakPolarHBondContact CE2-O 3.24Å; F299-L315 HydrophobicContact CG-CB 3.8Å; F299-L315 HydrophobicContact CZ-CB 3.91Å; F299-L315 HydrophobicContact CZ-CD2 4.22Å; F299-L315 HydrophobicContact CZ-CG 4.5Å; F299-I319 HydrophobicContact CD2-CG1 4.25Å; F299-I319 HydrophobicContact CE2-CD1 4.39Å; F299-I319 HydrophobicContact CE2-CG1 4.23Å; F299-C334 HydrophobicContact CB-CB 3.72Å
300	K	91.4	Very high	94.6	Very high	98 Å²	98	31.3 Å²	31.3	43%	0.426	16%	0.157	S	C	.	.	H	α-helix	trans	-74.4	-21.4	171	-173.8	171.4	-170.5	108.6	0	112.8	D296 K297 Y298 T333 C334 Q342	D296-K300 VanDerWaalsContact O-CB 3.23Å; D296-K300 WeakPolarHBondContact O-CB 3.4Å; D296-K300 PolarHBondContact O-N 2.92Å; K297-K300 PolarHBondContact O-N 3.19Å; Y298-K300 VanDerWaalsContact C-N 3.31Å; Y298-K300 PolarHBondContact O-N 3.49Å; K300-T333 VanDerWaalsContact CD-OG1 3.3Å; K300-T333 WeakPolarHBondContact CD-OG1 3.07Å; K300-T333 PolarHBondContact NZ-O 3.26Å; K300-C334 HydrophobicContact CB-CB 3.98Å; K300-Q342 VanDerWaalsContact C-NE2 3.32Å; K300-Q342 PolarHBondContact O-NE2 3.04Å
301	Q	90.3	Very high	94.6	Very high	90 Å²	90	31.5 Å²	31.5	42%	0.421	16%	0.158	S	C	.	.	H	α-helix	trans	-84.3	-46.7	172.9	-178.6	175	2.4	0	0	110.2	K297 Y298 F299 Q342 Y343	K297-Q301 WeakPolarHBondContact O-CB 3.39Å; K297-Q301 PolarHBondContact O-N 3.19Å; Y298-Q301 CarbonylContact O-C 3.32Å; Y298-Q301 PolarHBondContact O-N 3.01Å; Y298-Q301 VanDerWaalsContact O-N 3.1Å; F299-Q301 VanDerWaalsContact C-N 3.3Å; Q301-Q342 PolarHBondContact O-NE2 3.32Å; Q301-Y343 WeakPolarHBondContact CG-OH 3.38Å; Q301-Y343 WeakPolarHBondContact O-CE2 3.41Å; Q301-Y343 PolarHBondContact O-OH 2.89Å
302	L	92.9	Very high	94.6	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.026	15%	0.147	C	C	.	.			trans	-126.7	105.9	178.1	177.8	55	0	0	0	108.1	L264 Y298 F299 V304 V305 L315 E410	L264-L302 HydrophobicContact CD1-CB 4.32Å; L264-L302 HydrophobicContact CD1-CD2 3.64Å; L264-L302 HydrophobicContact CD1-CG 4.15Å; Y298-L302 PolarHBondContact O-N 3.09Å; F299-L302 WeakPolarHBondContact CA-O 3.43Å; F299-L302 CarbonylContact O-C 3.25Å; L302-V304 WeakPolarHBondContact CD1-O 3.47Å; L302-V305 HydrophobicContact CD1-CG1 4.27Å; L302-V305 HydrophobicContact CD2-CG1 3.72Å; L302-V305 HydrophobicContact CG-CG1 3.82Å; L302-L315 VanDerWaalsContact O-CD1 3.26Å; L302-L315 WeakPolarHBondContact O-CD1 3.45Å; L302-E410 HydrophobicContact CD1-CB 4.03Å; L302-E410 HydrophobicContact CD1-CG 3.73Å; L302-E410 HydrophobicContact CD2-CG 4.22Å; L302-E410 WeakPolarHBondContact CD2-OE1 3.25Å
303	Q	91.7	Very high	94.6	Very high	19 Å²	19	29.6 Å²	29.6	9%	0.089	15%	0.147	C	C	.	.			trans	-86.5	-35.5	-171.2	-76.3	172.3	-12.4	0	0	113.7	F299 L315 S337	F299-Q303 WeakPolarHBondContact O-CA 3.29Å; F299-Q303 WeakPolarHBondContact O-CG 3.28Å; F299-Q303 PolarHBondContact O-N 3Å; Q303-L315 PolarHBondContact O-N 2.7Å; Q303-S337 PolarHBondContact NE2-OG 3.21Å
304	V	94.1	Very high	94.5	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	133.4	-169.7	-164.2	0	0	0	0	108.5	L302 Q312 S413 V417	L302-V304 WeakPolarHBondContact CD1-O 3.47Å; V304-Q312 HydrophobicContact CG1-CB 3.92Å; V304-S413 WeakPolarHBondContact CG1-OG 3.41Å; V304-V417 HydrophobicContact CB-CG2 4.24Å; V304-V417 HydrophobicContact CG1-CG1 4Å; V304-V417 HydrophobicContact CG1-CG2 3.68Å; V304-V417 HydrophobicContact CG2-CG2 3.59Å
305	V	95.3	Very high	94.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	158.5	174.9	-64.5	0	0	0	0	110.4	H261 L264 K265 L302 L307 I313 L315 S413	H261-V305 HydrophobicContact CB-CB 4.08Å; H261-V305 HydrophobicContact CB-CG1 4.23Å; H261-V305 HydrophobicContact CB-CG2 4.43Å; L264-V305 HydrophobicContact CD1-CG1 4.42Å; K265-V305 HydrophobicContact CD-CG2 4.21Å; K265-V305 HydrophobicContact CG-CG2 3.87Å; L302-V305 HydrophobicContact CD1-CG1 4.27Å; L302-V305 HydrophobicContact CD2-CG1 3.72Å; L302-V305 HydrophobicContact CG-CG1 3.82Å; V305-L307 PolarHBondContact O-N 2.99Å; V305-I313 HydrophobicContact CG2-CG2 3.71Å; V305-I313 PolarHBondContact N-O 2.98Å; V305-I313 WeakPolarHBondContact O-CG2 3.48Å; V305-I313 PolarHBondContact O-N 3.35Å; V305-L315 HydrophobicContact CG1-CD1 4.28Å; V305-L315 HydrophobicContact CG2-CD1 4.26Å; V305-L315 HydrophobicContact CG2-CD2 3.97Å; V305-L315 HydrophobicContact CG2-CG 4.18Å; V305-S413 VanDerWaalsContact C-OG 3.31Å
306	P	96.3	Very high	94.3	Very high	31 Å²	31	25.7 Å²	25.7	20%	0.201	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	129.2	173.5	-23.6	34.7	0	0	0	112.7	K265	K265-P306 PolarHBondContact NZ-O 3.35Å
307	L	94.6	Very high	94.2	Very high	11 Å²	11	30.5 Å²	30.5	6%	0.058	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	-58.3	169.6	-172.4	56.2	0	0	0	109.8	V170 E173 K265 V305 M311 I313	V170-L307 HydrophobicContact CG2-CD1 3.65Å; V170-L307 HydrophobicContact CG2-CG 4.09Å; E173-L307 HydrophobicContact CB-CD2 3.88Å; E173-L307 HydrophobicContact CG-CD2 3.93Å; K265-L307 HydrophobicContact CD-CD1 3.97Å; V305-L307 PolarHBondContact O-N 2.99Å; L307-M311 HydrophobicContact CB-CE 4.38Å; L307-M311 WeakPolarHBondContact CB-O 3.38Å; L307-M311 HydrophobicContact CD2-CE 3.75Å; L307-M311 HydrophobicContact CG-CE 4.06Å; L307-M311 PolarHBondContact N-O 3.08Å; L307-I313 HydrophobicContact CB-CB 4.03Å; L307-I313 HydrophobicContact CB-CG2 4Å; L307-I313 HydrophobicContact CD1-CB 4.49Å; L307-I313 HydrophobicContact CD1-CG2 4.26Å; L307-I313 HydrophobicContact CD2-CB 4.32Å
308	F	95.8	Very high	94.2	Very high	16 Å²	16	24.6 Å²	24.6	7%	0.07	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	127.8	175	-166.1	-79	0	0	0	110.6	Q77 A80 V81 Y84 V170 L174 D310 M311 F682	Q77-F308 VanDerWaalsContact NE2-CE2 3.35Å; A80-F308 HydrophobicContact CB-CD2 4.01Å; A80-F308 HydrophobicContact CB-CE2 3.46Å; A80-F308 VanDerWaalsContact CB-CE2 3.46Å; A80-F308 HydrophobicContact CB-CZ 3.96Å; V81-F308 HydrophobicContact CG2-CZ 3.94Å; Y84-F308 HydrophobicContact CD1-CD1 4.21Å; Y84-F308 AromaticContact CD1-CE1 3.79Å; Y84-F308 HydrophobicContact CD1-CE1 3.79Å; Y84-F308 AromaticContact CD2-CD1 3.76Å; Y84-F308 HydrophobicContact CD2-CD1 3.76Å; Y84-F308 HydrophobicContact CD2-CE1 4.13Å; Y84-F308 HydrophobicContact CE2-CD1 4.45Å; Y84-F308 AromaticContact CG-CD1 3.64Å; Y84-F308 HydrophobicContact CG-CD1 3.64Å; Y84-F308 AromaticContact CG-CE1 3.5Å; Y84-F308 HydrophobicContact CG-CE1 3.5Å; Y84-F308 VanDerWaalsContact 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 4.43Å; L174-F308 HydrophobicContact CD1-CD1 4.2Å; L174-F308 HydrophobicContact CD1-CD2 4.35Å; L174-F308 HydrophobicContact CD1-CG 4.07Å; L174-F308 HydrophobicContact CD2-CB 4.38Å; L174-F308 HydrophobicContact CD2-CD1 4.22Å; L174-F308 HydrophobicContact CD2-CG 4.47Å; F308-D310 PolarHBondContact O-N 2.98Å; F308-M311 HydrophobicContact CB-CE 4.32Å; F308-M311 PolarHBondContact N-O 3.4Å; F308-M311 VanDerWaalsContact N-O 3.09Å; F308-M311 WeakPolarHBondContact O-CA 3.48Å; F308-M311 VanDerWaalsContact O-CB 3.24Å; F308-M311 WeakPolarHBondContact O-CB 3.48Å; F308-M311 PolarHBondContact O-N 3.07Å; F308-F682 AromaticContact CE1-CE1 3.9Å; F308-F682 HydrophobicContact CE1-CE1 3.9Å; F308-F682 HydrophobicContact CZ-CE1 4.12Å
309	G	94	Very high	94.2	Very high	7 Å²	7	24 Å²	24	7%	0.072	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	-136.3	-176.6	0	0	0	0	0	112.5	M311 Q312	G309-M311 VanDerWaalsContact C-N 3.26Å; G309-M311 PolarHBondContact O-N 2.83Å; G309-Q312 PolarHBondContact O-NE2 3.39Å
310	D	95.1	Very high	94.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-4.2	170.9	64.5	-47.7	0	0	0	114.1	Y84 F308 Q312 L416 F623 R624 E625 F626 F627	Y84-D310 WeakPolarHBondContact CE2-OD1 3.42Å; Y84-D310 VanDerWaalsContact CZ-OD1 3.26Å; Y84-D310 PolarHBondContact OH-N 2.91Å; Y84-D310 PolarHBondContact OH-OD1 3.47Å; F308-D310 PolarHBondContact O-N 2.98Å; D310-Q312 PolarHBondContact O-N 3.39Å; D310-Q312 PolarHBondContact O-NE2 3.01Å; D310-L416 HydrophobicContact CB-CD1 4.39Å; D310-F623 WeakPolarHBondContact CB-O 3.47Å; D310-R624 WeakPolarHBondContact OD2-CA 3.32Å; D310-E625 PolarHBondContact OD1-N 2.67Å; D310-F626 WeakPolarHBondContact OD1-CB 3.37Å; D310-F626 PolarHBondContact OD1-N 3.37Å; D310-F626 WeakPolarHBondContact OD2-CB 3.39Å; D310-F626 PolarHBondContact OD2-N 3.14Å; D310-F626 VanDerWaalsContact OD2-N 3.13Å; D310-F627 HydrophobicContact CB-CD2 4.45Å; D310-F627 VanDerWaalsContact OD2-CD2 3.26Å; D310-F627 WeakPolarHBondContact OD2-CD2 3.43Å; D310-F627 PolarHBondContact OD2-N 2.93Å
311	M	95	Very high	94.2	Very high	9 Å²	9	26.2 Å²	26.2	4%	0.044	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	116.1	173.4	-169	179.6	60.5	0	0	109.9	E173 L174 M177 L307 F308 G309 F626	E173-M311 HydrophobicContact CB-CE 3.94Å; E173-M311 HydrophobicContact CB-SD 4.1Å; L174-M311 HydrophobicContact CD2-CE 3.54Å; L174-M311 HydrophobicContact CD2-SD 4.32Å; L174-M311 HydrophobicContact CG-CE 3.75Å; M177-M311 HydrophobicContact CE-SD 4.31Å; M177-M311 HydrophobicContact CG-SD 4.11Å; L307-M311 HydrophobicContact CB-CE 4.38Å; L307-M311 WeakPolarHBondContact CB-O 3.38Å; L307-M311 HydrophobicContact CD2-CE 3.75Å; L307-M311 HydrophobicContact CG-CE 4.06Å; L307-M311 PolarHBondContact N-O 3.08Å; F308-M311 HydrophobicContact CB-CE 4.32Å; F308-M311 PolarHBondContact N-O 3.4Å; F308-M311 VanDerWaalsContact N-O 3.09Å; F308-M311 WeakPolarHBondContact O-CA 3.48Å; F308-M311 VanDerWaalsContact O-CB 3.24Å; F308-M311 WeakPolarHBondContact O-CB 3.48Å; F308-M311 PolarHBondContact O-N 3.07Å; G309-M311 VanDerWaalsContact C-N 3.26Å; G309-M311 PolarHBondContact O-N 2.83Å; M311-F626 HydrophobicContact CB-CB 4.07Å; M311-F626 HydrophobicContact CB-CD2 4.15Å; M311-F626 HydrophobicContact CB-CG 4.04Å; M311-F626 HydrophobicContact CG-CD2 3.88Å; M311-F626 HydrophobicContact CG-CE2 4.14Å; M311-F626 HydrophobicContact CG-CG 4.22Å; M311-F626 HydrophobicContact SD-CD2 4.18Å; M311-F626 HydrophobicContact SD-CE2 4.46Å
312	Q	94.6	Very high	94.4	Very high	24 Å²	24	22.3 Å²	22.3	11%	0.112	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	160.6	-177.9	-47.3	-51.9	-52.4	0	0	111	V304 G309 D310 S413 L416 V417	V304-Q312 HydrophobicContact CG1-CB 3.92Å; G309-Q312 PolarHBondContact O-NE2 3.39Å; D310-Q312 PolarHBondContact O-N 3.39Å; D310-Q312 PolarHBondContact O-NE2 3.01Å; Q312-S413 VanDerWaalsContact OE1-CB 3.26Å; Q312-S413 PolarHBondContact OE1-OG 2.95Å; Q312-L416 HydrophobicContact CG-CB 3.97Å; Q312-L416 HydrophobicContact CG-CD1 3.94Å; Q312-V417 HydrophobicContact CB-CG1 3.59Å; Q312-V417 HydrophobicContact CG-CG1 4.05Å
313	I	94.4	Very high	94.4	Very high	6 Å²	6	25.1 Å²	25.1	3%	0.031	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	122.2	170.7	-177.6	62.7	0	0	0	110.6	K265 V305 L307 L315 Y318	K265-I313 HydrophobicContact CD-CG2 4.01Å; K265-I313 HydrophobicContact CG-CG2 4.03Å; V305-I313 HydrophobicContact CG2-CG2 3.71Å; V305-I313 PolarHBondContact N-O 2.98Å; V305-I313 WeakPolarHBondContact O-CG2 3.48Å; V305-I313 PolarHBondContact O-N 3.35Å; L307-I313 HydrophobicContact CB-CB 4.03Å; L307-I313 HydrophobicContact CB-CG2 4Å; L307-I313 HydrophobicContact CD1-CB 4.49Å; L307-I313 HydrophobicContact CD1-CG2 4.26Å; L307-I313 HydrophobicContact CD2-CB 4.32Å; I313-L315 PolarHBondContact O-N 3.09Å; I313-Y318 HydrophobicContact CD1-CE2 4.03Å; I313-Y318 HydrophobicContact CG1-CE2 3.68Å
314	E	94.6	Very high	94.6	Very high	55 Å²	55	26.6 Å²	26.6	26%	0.257	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	110.2	165.8	-170.3	-166.9	162.2	0	0	108.1	A316 R317 K320	E314-A316 PolarHBondContact O-N 2.93Å; E314-R317 HydrophobicContact CB-CB 4.43Å; E314-R317 WeakPolarHBondContact O-CB 3.3Å; E314-R317 PolarHBondContact O-N 3.43Å; E314-K320 IonicContact OE1-NZ 2.72Å; E314-K320 PolarHBondContact OE1-NZ 2.81Å; E314-K320 IonicContact OE2-NZ 3.65Å
315	L	94.6	Very high	94.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.1	-34.1	-172.6	-68.1	167	0	0	0	112.4	L264 K265 F299 L302 Q303 V305 I313 R317 Y318	L264-L315 HydrophobicContact CB-CD1 3.87Å; L264-L315 HydrophobicContact CB-CD2 4.1Å; L264-L315 HydrophobicContact CD1-CD1 4.05Å; K265-L315 HydrophobicContact CG-CD2 4.37Å; F299-L315 HydrophobicContact CB-CB 4.5Å; F299-L315 HydrophobicContact CD1-CB 3.82Å; F299-L315 HydrophobicContact CD1-CD1 3.82Å; F299-L315 HydrophobicContact CD1-CG 4.33Å; F299-L315 HydrophobicContact CD2-CB 3.84Å; F299-L315 HydrophobicContact CE1-CB 3.88Å; F299-L315 HydrophobicContact CE1-CD1 3.94Å; F299-L315 HydrophobicContact CE1-CD2 4.11Å; F299-L315 HydrophobicContact CE1-CG 4.2Å; F299-L315 HydrophobicContact CE2-CB 3.89Å; F299-L315 WeakPolarHBondContact CE2-O 3.24Å; F299-L315 HydrophobicContact CG-CB 3.8Å; F299-L315 HydrophobicContact CZ-CB 3.91Å; F299-L315 HydrophobicContact CZ-CD2 4.22Å; F299-L315 HydrophobicContact CZ-CG 4.5Å; L302-L315 VanDerWaalsContact O-CD1 3.26Å; L302-L315 WeakPolarHBondContact O-CD1 3.45Å; Q303-L315 PolarHBondContact O-N 2.7Å; V305-L315 HydrophobicContact CG1-CD1 4.28Å; V305-L315 HydrophobicContact CG2-CD1 4.26Å; V305-L315 HydrophobicContact CG2-CD2 3.97Å; V305-L315 HydrophobicContact CG2-CG 4.18Å; I313-L315 PolarHBondContact O-N 3.09Å; L315-R317 PolarHBondContact O-N 3.49Å; L315-Y318 PolarHBondContact O-N 3.24Å
316	A	93.8	Very high	94.5	Very high	3 Å²	3	33.5 Å²	33.5	3%	0.025	17%	0.172	C	C	.	.	H	α-helix	trans	-65.3	-17.8	175.7	0	0	0	0	0	113.3	E314 Y318 I319 K320 T335	E314-A316 PolarHBondContact O-N 2.93Å; A316-Y318 VanDerWaalsContact C-N 3.32Å; A316-Y318 PolarHBondContact O-N 2.86Å; A316-I319 WeakPolarHBondContact O-CB 3.47Å; A316-I319 PolarHBondContact O-N 3.25Å; A316-I319 VanDerWaalsContact O-N 3.15Å; A316-K320 WeakPolarHBondContact O-CG 3.49Å; A316-K320 PolarHBondContact O-N 3.48Å; A316-T335 HydrophobicContact CB-CG2 4.41Å
317	R	94.3	Very high	94.4	Very high	115 Å²	115	38.6 Å²	38.6	43%	0.434	19%	0.192	S	C	.	.	H	α-helix	trans	-60	-41.1	176	-178.4	-178.3	166.5	98.7	-6.3	111.6	E314 L315 I319 K320 T321	E314-R317 HydrophobicContact CB-CB 4.43Å; E314-R317 WeakPolarHBondContact O-CB 3.3Å; E314-R317 PolarHBondContact O-N 3.43Å; L315-R317 PolarHBondContact O-N 3.49Å; R317-I319 PolarHBondContact O-N 3.41Å; R317-K320 PolarHBondContact O-N 3.37Å; R317-T321 HydrophobicContact CG-CG2 4.35Å; R317-T321 WeakPolarHBondContact O-CB 3.5Å; R317-T321 WeakPolarHBondContact O-CG2 3.24Å; R317-T321 PolarHBondContact O-N 2.88Å; R317-T321 PolarHBondContact O-OG1 3.21Å
318	Y	95.2	Very high	94.4	Very high	12 Å²	12	39.9 Å²	39.9	5%	0.047	20%	0.199	C	C	.	.	H	α-helix	trans	-60.4	-35	177.2	-68.1	-56.9	0	0	0	112.2	G268 F269 Y272 I313 L315 A316 S322	G268-Y318 WeakPolarHBondContact O-CB 3.27Å; F269-Y318 HydrophobicContact CB-CD1 4.4Å; F269-Y318 HydrophobicContact CB-CE1 4Å; F269-Y318 HydrophobicContact CB-CE2 4.39Å; 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 VanDerWaalsContact CD2-CE1 3.5Å; F269-Y318 HydrophobicContact CE2-CE1 4.36Å; F269-Y318 HydrophobicContact CG-CE1 4.12Å; Y272-Y318 HydrophobicContact CG-CD1 4.42Å; I313-Y318 HydrophobicContact CD1-CE2 4.03Å; I313-Y318 HydrophobicContact CG1-CE2 3.68Å; L315-Y318 PolarHBondContact O-N 3.24Å; A316-Y318 VanDerWaalsContact C-N 3.32Å; A316-Y318 PolarHBondContact O-N 2.86Å; Y318-S322 PolarHBondContact O-N 3.22Å
319	I	95.3	Very high	94.2	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-73.6	-50.3	176.3	-54.2	-51.9	0	0	0	110.6	L271 F299 A316 R317 T321 S322 Y325 W332 T335	L271-I319 HydrophobicContact CD1-CD1 3.85Å; F299-I319 HydrophobicContact CD2-CG1 4.25Å; F299-I319 HydrophobicContact CE2-CD1 4.39Å; F299-I319 HydrophobicContact CE2-CG1 4.23Å; A316-I319 WeakPolarHBondContact O-CB 3.47Å; A316-I319 PolarHBondContact O-N 3.25Å; A316-I319 VanDerWaalsContact O-N 3.15Å; R317-I319 PolarHBondContact O-N 3.41Å; I319-T321 PolarHBondContact O-N 2.91Å; I319-T321 VanDerWaalsContact O-N 3.14Å; I319-S322 PolarHBondContact O-N 3.37Å; I319-S322 VanDerWaalsContact O-N 3.15Å; I319-S322 PolarHBondContact O-OG 3.02Å; I319-Y325 HydrophobicContact CG2-CD2 3.87Å; I319-Y325 HydrophobicContact CG2-CE2 4.08Å; I319-Y325 VanDerWaalsContact O-CB 3.28Å; I319-Y325 WeakPolarHBondContact O-CB 3.21Å; I319-Y325 WeakPolarHBondContact O-CD2 3.42Å; I319-W332 HydrophobicContact CD1-CH2 3.59Å; I319-W332 HydrophobicContact CD1-CZ2 3.95Å; I319-W332 HydrophobicContact CD1-CZ3 3.96Å; I319-W332 HydrophobicContact CG1-CE3 4.33Å; I319-W332 HydrophobicContact CG1-CH2 4.19Å; I319-W332 HydrophobicContact CG1-CZ2 4.49Å; I319-W332 HydrophobicContact CG1-CZ3 4.11Å; I319-W332 HydrophobicContact CG2-CD2 3.44Å; I319-W332 VanDerWaalsContact CG2-CD2 3.44Å; I319-W332 HydrophobicContact CG2-CE3 3.95Å; I319-W332 HydrophobicContact CG2-CG 3.72Å; I319-W332 HydrophobicContact CG2-CH2 4.27Å; I319-W332 HydrophobicContact CG2-CZ2 3.8Å; I319-W332 HydrophobicContact CG2-CZ3 4.34Å; I319-T335 HydrophobicContact CB-CG2 4.44Å; I319-T335 HydrophobicContact CG2-CG2 4.15Å
320	K	93.4	Very high	94.1	Very high	73 Å²	73	48.7 Å²	48.7	32%	0.317	25%	0.251	S	S	.	.	H	α-helix	trans	-60.3	-25.9	-178.1	-66.9	173	-164.8	168.7	0	113.1	E314 A316 R317 Y325 T335	E314-K320 IonicContact OE1-NZ 2.72Å; E314-K320 PolarHBondContact OE1-NZ 2.81Å; E314-K320 IonicContact OE2-NZ 3.65Å; A316-K320 WeakPolarHBondContact O-CG 3.49Å; A316-K320 PolarHBondContact O-N 3.48Å; R317-K320 PolarHBondContact O-N 3.37Å; K320-Y325 HydrophobicContact CB-CE1 4.29Å; K320-Y325 HydrophobicContact CG-CE1 4.32Å; K320-Y325 WeakPolarHBondContact O-CD1 3.36Å; K320-T335 WeakPolarHBondContact CE-O 3.43Å; K320-T335 HydrophobicContact CG-CG2 3.82Å
321	T	93	Very high	93.9	Very high	72 Å²	72	53.5 Å²	53.5	44%	0.442	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	2.6	-177.6	58	0	0	0	0	113.8	Y272 R317 I319	Y272-T321 WeakPolarHBondContact CE2-O 3.5Å; R317-T321 HydrophobicContact CG-CG2 4.35Å; R317-T321 WeakPolarHBondContact O-CB 3.5Å; R317-T321 WeakPolarHBondContact O-CG2 3.24Å; R317-T321 PolarHBondContact O-N 2.88Å; R317-T321 PolarHBondContact O-OG1 3.21Å; I319-T321 PolarHBondContact O-N 2.91Å; I319-T321 VanDerWaalsContact O-N 3.14Å
322	S	93.8	Very high	93.8	Very high	9 Å²	9	53.6 Å²	53.6	6%	0.063	27%	0.268	C	S	.	.	S	Bend	trans	-69.7	152.3	177.4	95.5	0	0	0	0	111.4	D275 Y318 I319 H324 Y325	D275-S322 VanDerWaalsContact OD2-CB 3.31Å; D275-S322 WeakPolarHBondContact OD2-CB 3.28Å; D275-S322 PolarHBondContact OD2-OG 3.07Å; Y318-S322 PolarHBondContact O-N 3.22Å; I319-S322 PolarHBondContact O-N 3.37Å; I319-S322 VanDerWaalsContact O-N 3.15Å; I319-S322 PolarHBondContact O-OG 3.02Å; S322-H324 VanDerWaalsContact C-N 3.25Å; S322-H324 PolarHBondContact O-N 3.23Å; S322-H324 VanDerWaalsContact O-N 3.15Å; S322-Y325 PolarHBondContact O-N 3.47Å
323	A	93.6	Very high	93.7	Very high	64 Å²	64	55.5 Å²	55.5	53%	0.529	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-33.7	-170.1	0	0	0	0	0	114.1	D275	D275-A323 VanDerWaalsContact O-CB 3.29Å; D275-A323 WeakPolarHBondContact O-CB 3.43Å; D275-A323 PolarHBondContact OD2-N 3.06Å
324	H	95.9	Very high	93.5	Very high	50 Å²	50	55.2 Å²	55.2	23%	0.231	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	24.2	-175.6	-50.2	100.1	0	0	0	113.4	D275 G276 N280 Y282 S322 E327 N328	D275-H324 VanDerWaalsContact CG-ND1 3.33Å; D275-H324 IonicContact OD1-CE1 3.85Å; D275-H324 IonicContact OD1-CG 2.7Å; D275-H324 IonicContact OD1-ND1 3.9Å; D275-H324 PolarHBondContact OD1-ND1 3.36Å; D275-H324 IonicContact OD2-CG 3.75Å; D275-H324 PolarHBondContact OD2-N 2.91Å; D275-H324 IonicContact OD2-ND1 2.99Å; D275-H324 PolarHBondContact OD2-ND1 3.22Å; G276-H324 PolarHBondContact O-CE1 3.46Å; G276-H324 VanDerWaalsContact O-CE1 3.22Å; N280-H324 PolarHBondContact ND2-CD2 3.08Å; N280-H324 PolarHBondContact ND2-CE1 2.87Å; N280-H324 PolarHBondContact ND2-ND1 3.3Å; Y282-H324 HydrophobicContact CD2-CB 4.13Å; Y282-H324 HydrophobicContact CE2-CB 3.86Å; Y282-H324 VanDerWaalsContact CE2-O 3.27Å; Y282-H324 WeakPolarHBondContact CE2-O 3.31Å; S322-H324 VanDerWaalsContact C-N 3.25Å; S322-H324 PolarHBondContact O-N 3.23Å; S322-H324 VanDerWaalsContact O-N 3.15Å; H324-E327 VanDerWaalsContact CA-OE2 3.27Å; H324-E327 WeakPolarHBondContact CA-OE2 3.38Å; H324-N328 PolarHBondContact O-ND2 2.72Å
325	Y	95	Very high	93.2	Very high	24 Å²	24	53.6 Å²	53.6	9%	0.094	27%	0.274	C	S	.	.	S	Bend	trans	-66.4	-44.5	-179.2	170.7	-110.4	0	0	0	113	I319 K320 S322 E327 N328 K329 W332 T335	I319-Y325 HydrophobicContact CG2-CD2 3.87Å; I319-Y325 HydrophobicContact CG2-CE2 4.08Å; I319-Y325 VanDerWaalsContact O-CB 3.28Å; I319-Y325 WeakPolarHBondContact O-CB 3.21Å; I319-Y325 WeakPolarHBondContact O-CD2 3.42Å; K320-Y325 HydrophobicContact CB-CE1 4.29Å; K320-Y325 HydrophobicContact CG-CE1 4.32Å; K320-Y325 WeakPolarHBondContact O-CD1 3.36Å; S322-Y325 PolarHBondContact O-N 3.47Å; Y325-E327 VanDerWaalsContact C-N 3.31Å; Y325-E327 PolarHBondContact O-N 2.94Å; Y325-N328 CarbonylContact O-C 3.34Å; Y325-N328 WeakPolarHBondContact O-CA 3.37Å; Y325-N328 PolarHBondContact O-N 3.4Å; Y325-K329 HydrophobicContact CD1-CG 4.29Å; Y325-K329 HydrophobicContact CE1-CD 4.28Å; Y325-K329 VanDerWaalsContact CE1-CE 3.41Å; Y325-K329 HydrophobicContact CE1-CG 3.82Å; Y325-K329 HydrophobicContact CE2-CG 4.13Å; Y325-K329 PolarHBondContact O-N 2.8Å; Y325-W332 AromaticContact CD2-CD1 3.99Å; Y325-W332 AromaticContact CE2-CD1 3.9Å; Y325-W332 HydrophobicContact CE2-CG 4.46Å; Y325-T335 HydrophobicContact CE2-CG2 3.91Å; Y325-T335 PolarHBondContact OH-OG1 3.14Å
326	E	93.3	Very high	92.6	Very high	122 Å²	122	58 Å²	58	57%	0.57	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-57.4	-40.8	-173.1	-77	-65.4	144.9	0	0	112.7	N328 K329	E326-N328 VanDerWaalsContact C-N 3.26Å; E326-N328 PolarHBondContact O-N 2.99Å; E326-K329 WeakPolarHBondContact OE1-CE 3.33Å; E326-K329 IonicContact OE1-NZ 3.54Å; E326-K329 PolarHBondContact OE1-NZ 3.08Å; E326-K329 WeakPolarHBondContact OE2-CE 3.26Å; E326-K329 IonicContact OE2-NZ 2.72Å; E326-K329 PolarHBondContact OE2-NZ 3.23Å
327	E	93.6	Very high	91.4	Very high	137 Å²	137	60 Å²	60	64%	0.64	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-75.4	-15.6	177.6	-48.7	89.1	-170.2	0	0	113.2	H324 Y325	H324-E327 VanDerWaalsContact CA-OE2 3.27Å; H324-E327 WeakPolarHBondContact CA-OE2 3.38Å; Y325-E327 VanDerWaalsContact C-N 3.31Å; Y325-E327 PolarHBondContact O-N 2.94Å
328	N	94.3	Very high	89.8	Confident	38 Å²	38	56.8 Å²	56.8	20%	0.203	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-121.2	17.6	-170.2	-65.6	-80.2	0	0	0	113.6	Y282 H324 Y325 E326 S330 R331	Y282-N328 HydrophobicContact CD1-CB 3.77Å; Y282-N328 HydrophobicContact CD2-CB 4.15Å; Y282-N328 WeakPolarHBondContact CD2-ND2 3.42Å; Y282-N328 HydrophobicContact CE1-CB 3.35Å; Y282-N328 HydrophobicContact CE2-CB 3.78Å; Y282-N328 HydrophobicContact CG-CB 4.14Å; H324-N328 PolarHBondContact O-ND2 2.72Å; Y325-N328 CarbonylContact O-C 3.34Å; Y325-N328 WeakPolarHBondContact O-CA 3.37Å; Y325-N328 PolarHBondContact O-N 3.4Å; E326-N328 VanDerWaalsContact C-N 3.26Å; E326-N328 PolarHBondContact O-N 2.99Å; N328-S330 PolarHBondContact O-N 2.88Å; N328-S330 VanDerWaalsContact O-N 3.08Å; N328-R331 HydrophobicContact CB-CG 4.29Å; N328-R331 VanDerWaalsContact O-CB 3.31Å; N328-R331 WeakPolarHBondContact O-CB 3.28Å; N328-R331 WeakPolarHBondContact O-CG 3.38Å; N328-R331 PolarHBondContact O-N 2.82Å
329	K	91.5	Very high	88.2	Confident	92 Å²	92	60.6 Å²	60.6	40%	0.4	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-49	-38.4	-179.9	-76.8	-179.6	162.1	168	0	114.2	Y325 E326 R331 W332	Y325-K329 HydrophobicContact CD1-CG 4.29Å; Y325-K329 HydrophobicContact CE1-CD 4.28Å; Y325-K329 VanDerWaalsContact CE1-CE 3.41Å; Y325-K329 HydrophobicContact CE1-CG 3.82Å; Y325-K329 HydrophobicContact CE2-CG 4.13Å; Y325-K329 PolarHBondContact O-N 2.8Å; E326-K329 WeakPolarHBondContact OE1-CE 3.33Å; E326-K329 IonicContact OE1-NZ 3.54Å; E326-K329 PolarHBondContact OE1-NZ 3.08Å; E326-K329 WeakPolarHBondContact OE2-CE 3.26Å; E326-K329 IonicContact OE2-NZ 2.72Å; E326-K329 PolarHBondContact OE2-NZ 3.23Å; K329-R331 PolarHBondContact O-N 2.68Å; K329-R331 VanDerWaalsContact O-N 3.12Å; K329-W332 PolarHBondContact O-N 3.27Å
330	S	92	Very high	86.7	Confident	117 Å²	117	64.5 Å²	64.5	82%	0.818	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-64.6	-13.9	-178.8	58.3	0	0	0	0	114.5	N328 W332	N328-S330 PolarHBondContact O-N 2.88Å; N328-S330 VanDerWaalsContact O-N 3.08Å; S330-W332 VanDerWaalsContact C-N 3.33Å
331	R	90	Very high	85.4	Confident	101 Å²	101	64.1 Å²	64.1	38%	0.381	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-79.5	-13.9	178.5	-60.8	-63.9	-59.9	-89.6	-2.8	113.5	Y282 D285 N328 K329	Y282-R331 HydrophobicContact CD1-CG 4.41Å; Y282-R331 HydrophobicContact CE1-CB 4.44Å; Y282-R331 HydrophobicContact CE1-CG 4.43Å; D285-R331 IonicContact OD2-CZ 2.71Å; D285-R331 IonicContact OD2-NH1 3.66Å; D285-R331 IonicContact OD2-NH2 3.63Å; D285-R331 PolarHBondContact OD2-NH2 2.69Å; N328-R331 HydrophobicContact CB-CG 4.29Å; N328-R331 VanDerWaalsContact O-CB 3.31Å; N328-R331 WeakPolarHBondContact O-CB 3.28Å; N328-R331 WeakPolarHBondContact O-CG 3.38Å; N328-R331 PolarHBondContact O-N 2.82Å; K329-R331 PolarHBondContact O-N 2.68Å; K329-R331 VanDerWaalsContact O-N 3.12Å
332	W	93.8	Very high	84	Confident	10 Å²	10	63.2 Å²	63.2	4%	0.038	37%	0.373	C	S	.	.			trans	-119.1	130.6	-168.1	-60.4	103.3	0	0	0	112	L271 I281 Y282 L292 D296 I319 Y325 K329 S330 T335	L271-W332 HydrophobicContact CD1-CH2 4.13Å; I281-W332 HydrophobicContact CD1-CZ2 4.49Å; Y282-W332 HydrophobicContact CE1-CZ2 4.25Å; Y282-W332 AromaticContact CE1-NE1 3.53Å; Y282-W332 AromaticContact CZ-NE1 3.72Å; Y282-W332 PolarHBondContact OH-NE1 3.12Å; L292-W332 HydrophobicContact CB-CH2 4.07Å; L292-W332 HydrophobicContact CB-CZ2 4.42Å; L292-W332 HydrophobicContact CD1-CZ2 4.26Å; L292-W332 HydrophobicContact CD2-CH2 3.93Å; L292-W332 HydrophobicContact CD2-CZ2 4.22Å; L292-W332 HydrophobicContact CG-CH2 4.41Å; D296-W332 HydrophobicContact CB-CE3 3.7Å; D296-W332 HydrophobicContact CB-CZ3 3.85Å; D296-W332 WeakPolarHBondContact OD1-CA 3.31Å; I319-W332 HydrophobicContact CD1-CH2 3.59Å; I319-W332 HydrophobicContact CD1-CZ2 3.95Å; I319-W332 HydrophobicContact CD1-CZ3 3.96Å; I319-W332 HydrophobicContact CG1-CE3 4.33Å; I319-W332 HydrophobicContact CG1-CH2 4.19Å; I319-W332 HydrophobicContact CG1-CZ2 4.49Å; I319-W332 HydrophobicContact CG1-CZ3 4.11Å; I319-W332 HydrophobicContact CG2-CD2 3.44Å; I319-W332 VanDerWaalsContact CG2-CD2 3.44Å; I319-W332 HydrophobicContact CG2-CE3 3.95Å; I319-W332 HydrophobicContact CG2-CG 3.72Å; I319-W332 HydrophobicContact CG2-CH2 4.27Å; I319-W332 HydrophobicContact CG2-CZ2 3.8Å; I319-W332 HydrophobicContact CG2-CZ3 4.34Å; Y325-W332 AromaticContact CD2-CD1 3.99Å; Y325-W332 AromaticContact CE2-CD1 3.9Å; Y325-W332 HydrophobicContact CE2-CG 4.46Å; K329-W332 PolarHBondContact O-N 3.27Å; S330-W332 VanDerWaalsContact C-N 3.33Å; W332-T335 HydrophobicContact CB-CG2 4Å
333	T	92.3	Very high	82.6	Confident	65 Å²	65	66 Å²	66	40%	0.399	38%	0.383	S	S	.	.	S	Bend	trans	-111.5	-14.1	175.7	69.3	0	0	0	0	112.9	D296 K300 T335	D296-T333 VanDerWaalsContact CG-N 3.33Å; D296-T333 PolarHBondContact OD1-N 3.23Å; D296-T333 WeakPolarHBondContact OD2-CB 3.43Å; D296-T333 PolarHBondContact OD2-N 3.38Å; D296-T333 VanDerWaalsContact OD2-N 3.08Å; D296-T333 PolarHBondContact OD2-OG1 2.74Å; K300-T333 VanDerWaalsContact CD-OG1 3.3Å; K300-T333 WeakPolarHBondContact CD-OG1 3.07Å; K300-T333 PolarHBondContact NZ-O 3.26Å; T333-T335 VanDerWaalsContact C-N 3.29Å
334	C	89.8	Confident	81.6	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-14.5	173.3	66.7	0	0	0	0	113.9	D296 F299 K300	D296-C334 WeakPolarHBondContact OD1-CB 3.44Å; D296-C334 PolarHBondContact OD1-N 3.27Å; D296-C334 PolarHBondContact OD1-SG 2.61Å; F299-C334 HydrophobicContact CB-CB 3.72Å; K300-C334 HydrophobicContact CB-CB 3.98Å
335	T	88.3	Confident	80.7	Confident	20 Å²	20	64.3 Å²	64.3	12%	0.123	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-12.4	-178	57.9	0	0	0	0	113.9	A316 I319 K320 Y325 W332 T333	A316-T335 HydrophobicContact CB-CG2 4.41Å; I319-T335 HydrophobicContact CB-CG2 4.44Å; I319-T335 HydrophobicContact CG2-CG2 4.15Å; K320-T335 WeakPolarHBondContact CE-O 3.43Å; K320-T335 HydrophobicContact CG-CG2 3.82Å; Y325-T335 HydrophobicContact CE2-CG2 3.91Å; Y325-T335 PolarHBondContact OH-OG1 3.14Å; W332-T335 HydrophobicContact CB-CG2 4Å; T333-T335 VanDerWaalsContact C-N 3.29Å
336	S	82.3	Confident	79.9	Confident	92 Å²	92	65.3 Å²	65.3	64%	0.643	38%	0.377	S	S	*	.			trans	-98.9	103.3	174.8	-58	0	0	0	0	110.2
337	S	68.2	Low	79.3	Confident	47 Å²	47	66.8 Å²	66.8	33%	0.329	38%	0.383	S	S	.	.			trans	-125.4	134.7	174.8	-54.8	0	0	0	0	109.6	Q303	Q303-S337 PolarHBondContact NE2-OG 3.21Å
338	G	61.4	Low	78.9	Confident	47 Å²	47	62.3 Å²	62.3	49%	0.485	36%	0.362	S	S	.	.			trans	-93.7	173.5	166.1	0	0	0	0	0	111	S340	G338-S340 PolarHBondContact O-N 3.4Å; G338-S340 VanDerWaalsContact O-N 3.1Å
339	S	61.5	Low	78.6	Confident	91 Å²	91	60.8 Å²	60.8	64%	0.636	35%	0.354	S	S	*	.	S	Bend	trans	-69.3	3.4	172.6	53.6	0	0	0	0	114.1
340	S	64.1	Low	78.6	Confident	83 Å²	83	61.7 Å²	61.7	58%	0.58	36%	0.362	S	S	*	.	S	Bend	trans	-78.7	133.6	177.5	56.5	0	0	0	0	111.2	G338 Q342 W414	G338-S340 PolarHBondContact O-N 3.4Å; G338-S340 VanDerWaalsContact O-N 3.1Å; S340-Q342 PolarHBondContact O-N 3.16Å; S340-W414 VanDerWaalsContact O-CZ2 3.29Å; S340-W414 WeakPolarHBondContact O-CZ2 3.46Å
341	P	65.6	Low	78.6	Confident	66 Å²	66	60.8 Å²	60.8	43%	0.429	35%	0.345	S	S	.	.			trans	-59.6	127.9	179.4	25.1	-33.3	0	0	0	110.9	Y343 W414	P341-Y343 PolarHBondContact O-N 3.06Å; P341-W414 VanDerWaalsContact CA-CH2 3.49Å; P341-W414 HydrophobicContact CB-CH2 4.22Å; P341-W414 HydrophobicContact CB-CZ3 4.18Å
342	Q	63	Low	78.8	Confident	52 Å²	52	56.3 Å²	56.3	24%	0.243	33%	0.329	C	S	.	.	S	Bend	trans	-67.5	-27.9	179.3	-172.2	179.9	17.7	0	0	112.4	K300 Q301 S340	K300-Q342 VanDerWaalsContact C-NE2 3.32Å; K300-Q342 PolarHBondContact O-NE2 3.04Å; Q301-Q342 PolarHBondContact O-NE2 3.32Å; S340-Q342 PolarHBondContact O-N 3.16Å
343	Y	65.8	Low	78.8	Confident	69 Å²	69	61.6 Å²	61.6	27%	0.271	35%	0.348	S	S	.	.			trans	-129.5	124.3	-179.8	-71.7	-79.1	0	0	0	110.4	Q301 P341	Q301-Y343 WeakPolarHBondContact CG-OH 3.38Å; Q301-Y343 WeakPolarHBondContact O-CE2 3.41Å; Q301-Y343 PolarHBondContact O-OH 2.89Å; P341-Y343 PolarHBondContact O-N 3.06Å
344	N	71.4	Confident	78.8	Confident	77 Å²	77	63 Å²	63	41%	0.412	35%	0.351	S	S	.	.			trans	-87.6	109.5	166.4	-170.4	-57	0	0	0	108.3	C346 E347 Q348	N344-C346 PolarHBondContact O-N 2.89Å; N344-C346 WeakPolarHBondContact OD1-CA 3.43Å; N344-C346 WeakPolarHBondContact OD1-CB 3.31Å; N344-C346 PolarHBondContact OD1-N 3.33Å; N344-E347 HydrophobicContact CB-CB 4.29Å; N344-E347 HydrophobicContact CB-CG 4.05Å; N344-E347 PolarHBondContact O-N 2.97Å; N344-E347 PolarHBondContact OD1-N 3.43Å; N344-E347 VanDerWaalsContact OD1-N 3.12Å; N344-Q348 PolarHBondContact O-N 3.02Å
345	I	77.8	Confident	79	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-61.5	-34.7	179.1	-171.7	63.1	0	0	0	111.2	E347 Q348 M349 E447 A450	I345-E347 VanDerWaalsContact C-N 3.33Å; I345-E347 PolarHBondContact O-N 3.32Å; I345-Q348 PolarHBondContact O-N 2.94Å; I345-M349 HydrophobicContact CG1-SD 4.39Å; I345-M349 WeakPolarHBondContact O-CG 3.33Å; I345-M349 PolarHBondContact O-N 3.49Å; I345-E447 HydrophobicContact CG2-CB 4.33Å; I345-E447 HydrophobicContact CG2-CG 3.98Å; I345-A450 HydrophobicContact CG1-CB 4.17Å; I345-A450 HydrophobicContact CG2-CB 3.96Å
346	C	77.6	Confident	79.2	Confident	45 Å²	45	65.9 Å²	65.9	30%	0.304	36%	0.364	S	S	.	.	H	α-helix	trans	-64.4	-35.3	-179.4	-53.8	0	0	0	0	112.5	N344 Q348 M349	N344-C346 PolarHBondContact O-N 2.89Å; N344-C346 WeakPolarHBondContact OD1-CA 3.43Å; N344-C346 WeakPolarHBondContact OD1-CB 3.31Å; N344-C346 PolarHBondContact OD1-N 3.33Å; C346-Q348 VanDerWaalsContact C-N 3.31Å; C346-M349 WeakPolarHBondContact O-CB 3.5Å; C346-M349 PolarHBondContact O-N 3.42Å
347	E	81.7	Confident	79.4	Confident	152 Å²	152	67.5 Å²	67.5	71%	0.71	36%	0.362	S	S	*	.	H	α-helix	trans	-67.7	-33.4	173.5	-69.6	-174.1	166.9	0	0	112	N344 I345	N344-E347 HydrophobicContact CB-CB 4.29Å; N344-E347 HydrophobicContact CB-CG 4.05Å; N344-E347 PolarHBondContact O-N 2.97Å; N344-E347 PolarHBondContact OD1-N 3.43Å; N344-E347 VanDerWaalsContact OD1-N 3.12Å; I345-E347 VanDerWaalsContact C-N 3.33Å; I345-E347 PolarHBondContact O-N 3.32Å
348	Q	84.6	Confident	80.5	Confident	43 Å²	43	72.1 Å²	72.1	20%	0.201	37%	0.373	C	S	.	.	H	α-helix	trans	-77.5	-21.7	178.7	-65.3	-173.1	79.5	0	0	113.1	N344 I345 C346 I350 Q351 I352 H407	N344-Q348 PolarHBondContact O-N 3.02Å; I345-Q348 PolarHBondContact O-N 2.94Å; C346-Q348 VanDerWaalsContact C-N 3.31Å; Q348-I350 PolarHBondContact O-N 2.86Å; Q348-Q351 PolarHBondContact O-N 3.34Å; Q348-I352 HydrophobicContact CB-CD1 4.44Å; Q348-I352 WeakPolarHBondContact O-CG1 3.45Å; Q348-I352 PolarHBondContact O-N 3.49Å; Q348-I352 VanDerWaalsContact O-N 3.11Å; Q348-H407 PolarHBondContact OE1-CE1 3.17Å; Q348-H407 PolarHBondContact OE1-ND1 2.98Å
349	M	89.1	Confident	82	Confident	7 Å²	7	70.1 Å²	70.1	3%	0.034	35%	0.351	C	S	.	.	H	α-helix	trans	-56.9	-33.8	-179.8	-72.5	-51.4	-65.8	0	0	113.3	I345 C346 I352 R353 A450 E453 V454 M457	I345-M349 HydrophobicContact CG1-SD 4.39Å; I345-M349 WeakPolarHBondContact O-CG 3.33Å; I345-M349 PolarHBondContact O-N 3.49Å; C346-M349 WeakPolarHBondContact O-CB 3.5Å; C346-M349 PolarHBondContact O-N 3.42Å; M349-I352 PolarHBondContact O-N 3.22Å; M349-R353 WeakPolarHBondContact O-CB 3.31Å; M349-R353 VanDerWaalsContact O-CG 3.23Å; M349-R353 WeakPolarHBondContact O-CG 3.43Å; M349-R353 PolarHBondContact O-N 2.91Å; M349-A450 HydrophobicContact CG-CB 3.75Å; M349-A450 HydrophobicContact SD-CB 3.84Å; M349-E453 HydrophobicContact CE-CB 3.53Å; M349-E453 HydrophobicContact CE-CG 4.31Å; M349-E453 VanDerWaalsContact CE-OE2 3.26Å; M349-E453 WeakPolarHBondContact CE-OE2 3.15Å; M349-V454 HydrophobicContact CE-CG2 3.92Å; M349-V454 HydrophobicContact SD-CG2 3.43Å; M349-V454 WeakPolarHBondContact SD-CG2 3.49Å; M349-M457 HydrophobicContact CE-CE 3.86Å
350	I	90.7	Very high	83.2	Confident	111 Å²	111	67.3 Å²	67.3	57%	0.569	33%	0.328	S	S	*	.	H	α-helix	trans	-61.2	-52.5	180	-60.6	174.9	0	0	0	109.9	Q348 I352 R353 E354	Q348-I350 PolarHBondContact O-N 2.86Å; I350-I352 PolarHBondContact O-N 3.19Å; I350-R353 PolarHBondContact O-N 3.39Å; I350-E354 WeakPolarHBondContact O-CG 3.03Å; I350-E354 PolarHBondContact O-N 2.9Å
351	Q	92.4	Very high	84.2	Confident	98 Å²	98	66.3 Å²	66.3	46%	0.458	32%	0.321	S	S	.	.	H	α-helix	trans	-63	-43.2	-179.9	-173.7	61.3	55.6	0	0	111.5	Q348 R353 E354 D355	Q348-Q351 PolarHBondContact O-N 3.34Å; Q351-R353 PolarHBondContact O-N 3.22Å; Q351-E354 PolarHBondContact O-N 2.67Å; Q351-D355 PolarHBondContact NE2-OD1 3.46Å; Q351-D355 PolarHBondContact NE2-OD2 2.62Å; Q351-D355 PolarHBondContact O-N 2.96Å
352	I	94	Very high	85.3	Confident	6 Å²	6	65.6 Å²	65.6	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-59.9	-46.9	179	-66.5	172.6	0	0	0	110.8	Q348 M349 I350 E354 D355 H356 W404 V454 M457	Q348-I352 HydrophobicContact CB-CD1 4.44Å; Q348-I352 WeakPolarHBondContact O-CG1 3.45Å; Q348-I352 PolarHBondContact O-N 3.49Å; Q348-I352 VanDerWaalsContact O-N 3.11Å; M349-I352 PolarHBondContact O-N 3.22Å; I350-I352 PolarHBondContact O-N 3.19Å; I352-E354 PolarHBondContact O-N 2.93Å; I352-D355 PolarHBondContact O-N 3.42Å; I352-H356 VanDerWaalsContact O-CB 3.29Å; I352-H356 WeakPolarHBondContact O-CB 3.27Å; I352-H356 PolarHBondContact O-N 3Å; I352-W404 HydrophobicContact CG2-CD2 4.33Å; I352-W404 HydrophobicContact CG2-CG 4.34Å; I352-W404 HydrophobicContact CG2-CZ2 4.38Å; I352-V454 HydrophobicContact CD1-CG2 3.92Å; I352-V454 HydrophobicContact CG2-CG2 4.39Å; I352-M457 HydrophobicContact CB-CE 4.49Å; I352-M457 HydrophobicContact CG2-CE 3.37Å; I352-M457 HydrophobicContact CG2-SD 4.02Å
353	R	92.5	Very high	86.4	Confident	121 Å²	121	63.4 Å²	63.4	46%	0.457	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-39.5	178.6	-71.5	175.3	-174.9	172.5	6.2	112.1	M349 I350 Q351 M357 E453 M457	M349-R353 WeakPolarHBondContact O-CB 3.31Å; M349-R353 VanDerWaalsContact O-CG 3.23Å; M349-R353 WeakPolarHBondContact O-CG 3.43Å; M349-R353 PolarHBondContact O-N 2.91Å; I350-R353 PolarHBondContact O-N 3.39Å; Q351-R353 PolarHBondContact O-N 3.22Å; R353-M357 WeakPolarHBondContact O-CB 3.42Å; R353-M357 PolarHBondContact O-N 3Å; R353-E453 IonicContact CZ-OE1 4Å; R353-E453 IonicContact CZ-OE2 3.97Å; R353-E453 IonicContact NE-OE2 3.73Å; R353-E453 PolarHBondContact NE-OE2 3.47Å; R353-E453 IonicContact NH2-OE1 2.84Å; R353-E453 PolarHBondContact NH2-OE1 2.86Å; R353-E453 IonicContact NH2-OE2 3.01Å; R353-E453 PolarHBondContact NH2-OE2 3.05Å; R353-M457 HydrophobicContact CG-CE 4.36Å; R353-M457 HydrophobicContact CG-SD 4.4Å
354	E	92.9	Very high	87	Confident	96 Å²	96	62.1 Å²	62.1	45%	0.449	31%	0.305	S	S	.	.	H	α-helix	trans	-63.8	-45.6	176.3	-76.4	-175.6	-173.1	0	0	112.3	I350 Q351 I352 M357 R358	I350-E354 WeakPolarHBondContact O-CG 3.03Å; I350-E354 PolarHBondContact O-N 2.9Å; Q351-E354 PolarHBondContact O-N 2.67Å; I352-E354 PolarHBondContact O-N 2.93Å; E354-M357 PolarHBondContact O-N 2.7Å; E354-R358 WeakPolarHBondContact O-CB 3.08Å; E354-R358 PolarHBondContact O-N 3.4Å
355	D	93.3	Very high	87.4	Confident	31 Å²	31	67.2 Å²	67.2	17%	0.166	32%	0.319	C	S	.	.	H	α-helix	trans	-69.6	-38	179.8	-68.5	-29.6	0	0	0	111.7	Q351 I352 R358 F359 L400	Q351-D355 PolarHBondContact NE2-OD1 3.46Å; Q351-D355 PolarHBondContact NE2-OD2 2.62Å; Q351-D355 PolarHBondContact O-N 2.96Å; I352-D355 PolarHBondContact O-N 3.42Å; D355-R358 PolarHBondContact O-N 3.23Å; D355-R358 IonicContact OD1-CZ 3.54Å; D355-R358 IonicContact OD1-NH1 3.36Å; D355-R358 PolarHBondContact OD1-NH1 3.44Å; D355-F359 VanDerWaalsContact O-CB 3.29Å; D355-F359 WeakPolarHBondContact O-CB 3.25Å; D355-F359 PolarHBondContact O-N 3.47Å; D355-L400 HydrophobicContact CB-CD1 3.91Å
356	H	92.4	Very high	87.5	Confident	49 Å²	49	70.5 Å²	70.5	23%	0.227	33%	0.332	C	S	.	.	H	α-helix	trans	-57.6	-51.2	171.8	176	-91	0	0	0	111.3	I352 R358 I360 W404 M457	I352-H356 VanDerWaalsContact O-CB 3.29Å; I352-H356 WeakPolarHBondContact O-CB 3.27Å; I352-H356 PolarHBondContact O-N 3Å; H356-R358 PolarHBondContact O-N 2.88Å; H356-I360 WeakPolarHBondContact NE2-CD1 3.44Å; H356-I360 WeakPolarHBondContact O-CB 3.5Å; H356-I360 WeakPolarHBondContact O-CG1 3.48Å; H356-I360 PolarHBondContact O-N 2.93Å; H356-W404 HydrophobicContact CB-CH2 3.63Å; H356-W404 HydrophobicContact CB-CZ2 3.8Å; H356-W404 AromaticContact CD2-CH2 3.64Å; H356-M457 HydrophobicContact CB-SD 3.76Å
357	M	88.5	Confident	87.3	Confident	125 Å²	125	70.2 Å²	70.2	62%	0.616	33%	0.33	S	S	*	.	H	α-helix	trans	-59.1	-48.6	178	179.6	61.8	73.1	0	0	111.6	R353 E354 S361	R353-M357 WeakPolarHBondContact O-CB 3.42Å; R353-M357 PolarHBondContact O-N 3Å; E354-M357 PolarHBondContact O-N 2.7Å; M357-S361 WeakPolarHBondContact O-CB 3.43Å; M357-S361 PolarHBondContact O-N 3.38Å; M357-S361 VanDerWaalsContact O-N 3.14Å; M357-S361 PolarHBondContact O-OG 3.39Å
358	R	91.3	Very high	86.5	Confident	145 Å²	145	67.9 Å²	67.9	55%	0.547	32%	0.323	S	S	.	.	H	α-helix	trans	-63.4	-49.3	-176.8	-167.9	-174.4	-58.3	127.2	6.6	111.5	E354 D355 H356 E362	E354-R358 WeakPolarHBondContact O-CB 3.08Å; E354-R358 PolarHBondContact O-N 3.4Å; D355-R358 PolarHBondContact O-N 3.23Å; D355-R358 IonicContact OD1-CZ 3.54Å; D355-R358 IonicContact OD1-NH1 3.36Å; D355-R358 PolarHBondContact OD1-NH1 3.44Å; H356-R358 PolarHBondContact O-N 2.88Å; R358-E362 PolarHBondContact O-N 3.49Å
359	F	92.8	Very high	85.4	Confident	4 Å²	4	68.2 Å²	68.2	2%	0.018	33%	0.33	C	S	.	.	H	α-helix	trans	-70.9	-46.3	-175.3	-177.2	-103.3	0	0	0	112.5	D355 S361 E362 L363 L393 Q396 L400 L461 M465	D355-F359 VanDerWaalsContact O-CB 3.29Å; D355-F359 WeakPolarHBondContact O-CB 3.25Å; D355-F359 PolarHBondContact O-N 3.47Å; F359-S361 VanDerWaalsContact C-N 3.31Å; F359-S361 PolarHBondContact O-N 2.96Å; F359-E362 PolarHBondContact O-N 2.96Å; F359-E362 VanDerWaalsContact O-N 3.15Å; F359-L363 HydrophobicContact CE1-CB 4.49Å; F359-L363 HydrophobicContact CE1-CD2 4.1Å; F359-L363 WeakPolarHBondContact O-CB 3.28Å; F359-L363 PolarHBondContact O-N 2.95Å; F359-L393 HydrophobicContact CE2-CD2 3.88Å; F359-L393 WeakPolarHBondContact CZ-O 3.32Å; F359-Q396 HydrophobicContact CD2-CG 3.93Å; F359-Q396 HydrophobicContact CE2-CB 3.91Å; F359-Q396 HydrophobicContact CE2-CG 3.79Å; F359-L400 HydrophobicContact CB-CD2 3.79Å; F359-L400 HydrophobicContact CD1-CD2 4.02Å; F359-L400 HydrophobicContact CG-CD2 3.95Å; F359-L461 HydrophobicContact CD1-CD1 4.04Å; F359-L461 HydrophobicContact CD1-CD2 4.04Å; F359-L461 HydrophobicContact CE1-CD1 3.89Å; F359-L461 HydrophobicContact CE1-CD2 4.19Å; F359-M465 HydrophobicContact CE1-SD 4.08Å; F359-M465 HydrophobicContact CZ-SD 4.29Å
360	I	86.3	Confident	84	Confident	33 Å²	33	70.2 Å²	70.2	17%	0.169	34%	0.339	C	S	.	.	H	α-helix	trans	-64.8	-38.7	179.9	-70.1	-174.9	0	0	0	111.2	H356 E362 L363 A364 L461 L464	H356-I360 WeakPolarHBondContact NE2-CD1 3.44Å; H356-I360 WeakPolarHBondContact O-CB 3.5Å; H356-I360 WeakPolarHBondContact O-CG1 3.48Å; H356-I360 PolarHBondContact O-N 2.93Å; I360-E362 VanDerWaalsContact C-N 3.26Å; I360-E362 PolarHBondContact O-N 3.24Å; I360-L363 PolarHBondContact O-N 3.3Å; I360-A364 VanDerWaalsContact O-CB 3.26Å; I360-A364 WeakPolarHBondContact O-CB 3.4Å; I360-A364 PolarHBondContact O-N 3.11Å; I360-L461 HydrophobicContact CD1-CB 4.44Å; I360-L461 HydrophobicContact CD1-CD1 4.32Å; I360-L461 HydrophobicContact CG1-CD1 3.98Å; I360-L464 HydrophobicContact CD1-CD1 4.06Å; I360-L464 HydrophobicContact CG1-CD1 4.33Å; I360-L464 HydrophobicContact CG2-CD1 3.99Å
361	S	84.6	Confident	82.3	Confident	61 Å²	61	70 Å²	70	43%	0.427	34%	0.343	S	S	.	.	H	α-helix	trans	-59.8	-38.9	175.5	-62.6	0	0	0	0	111.9	M357 F359 R365	M357-S361 WeakPolarHBondContact O-CB 3.43Å; M357-S361 PolarHBondContact O-N 3.38Å; M357-S361 VanDerWaalsContact O-N 3.14Å; M357-S361 PolarHBondContact O-OG 3.39Å; F359-S361 VanDerWaalsContact C-N 3.31Å; F359-S361 PolarHBondContact O-N 2.96Å; S361-R365 WeakPolarHBondContact O-CG 3.24Å
362	E	88.6	Confident	80.3	Confident	52 Å²	52	70.4 Å²	70.4	24%	0.243	35%	0.352	C	S	.	.	H	α-helix	trans	-70.4	-49.6	175.1	-171.2	171.9	-177.1	0	0	111.4	R358 F359 I360 A364 R365 Y366 K389 L393	R358-E362 PolarHBondContact O-N 3.49Å; F359-E362 PolarHBondContact O-N 2.96Å; F359-E362 VanDerWaalsContact O-N 3.15Å; I360-E362 VanDerWaalsContact C-N 3.26Å; I360-E362 PolarHBondContact O-N 3.24Å; E362-A364 VanDerWaalsContact C-N 3.34Å; E362-A364 PolarHBondContact O-N 2.76Å; E362-R365 WeakPolarHBondContact O-CB 3.3Å; E362-R365 PolarHBondContact O-N 3.35Å; E362-Y366 HydrophobicContact CG-CD2 4.48Å; E362-Y366 HydrophobicContact CG-CE2 3.97Å; E362-Y366 VanDerWaalsContact O-CD2 3.27Å; E362-Y366 WeakPolarHBondContact O-CD2 3.3Å; E362-K389 WeakPolarHBondContact OE1-CE 3.24Å; E362-K389 IonicContact OE1-NZ 2.88Å; E362-K389 PolarHBondContact OE1-NZ 3.19Å; E362-L393 HydrophobicContact CG-CD2 4.18Å
363	L	85.4	Confident	78.2	Confident	5 Å²	5	74.1 Å²	74.1	3%	0.026	38%	0.375	C	S	.	.	H	α-helix	trans	-57.3	-44.2	-179.8	-179.9	62.9	0	0	0	112.5	F359 I360 R365 Y366 S367 L461 L464 M465 M468 F472	F359-L363 HydrophobicContact CE1-CB 4.49Å; F359-L363 HydrophobicContact CE1-CD2 4.1Å; F359-L363 WeakPolarHBondContact O-CB 3.28Å; F359-L363 PolarHBondContact O-N 2.95Å; I360-L363 PolarHBondContact O-N 3.3Å; L363-R365 VanDerWaalsContact C-N 3.25Å; L363-R365 PolarHBondContact O-N 2.93Å; L363-Y366 PolarHBondContact O-N 3.11Å; L363-Y366 VanDerWaalsContact O-N 3.14Å; L363-S367 PolarHBondContact O-N 3.46Å; L363-S367 VanDerWaalsContact O-N 3.08Å; L363-L461 HydrophobicContact CD2-CD1 3.98Å; L363-L464 HydrophobicContact CD2-CB 4.19Å; L363-M465 HydrophobicContact CD2-SD 3.78Å; L363-M468 HydrophobicContact CD1-CG 4.47Å; L363-M468 HydrophobicContact CD1-SD 3.83Å; L363-F472 HydrophobicContact CD1-CZ 3.72Å
364	A	79.9	Confident	76.1	Confident	42 Å²	42	71.5 Å²	71.5	35%	0.347	39%	0.385	S	S	.	.	H	α-helix	trans	-61.1	-33.1	-179.1	0	0	0	0	0	112.7	I360 E362 Y366 S367 N368	I360-A364 VanDerWaalsContact O-CB 3.26Å; I360-A364 WeakPolarHBondContact O-CB 3.4Å; I360-A364 PolarHBondContact O-N 3.11Å; E362-A364 VanDerWaalsContact C-N 3.34Å; E362-A364 PolarHBondContact O-N 2.76Å; A364-Y366 VanDerWaalsContact C-N 3.34Å; A364-Y366 PolarHBondContact O-N 3.07Å; A364-S367 PolarHBondContact O-N 2.92Å; A364-N368 PolarHBondContact O-N 3.4Å
365	R	80.4	Confident	73.6	Confident	185 Å²	185	72.1 Å²	72.1	70%	0.698	40%	0.4	S	S	*	.	H	α-helix	trans	-63.5	-41.1	176.6	-68.9	171.1	64.9	-165.7	-0.8	111.7	S361 E362 L363 S369	S361-R365 WeakPolarHBondContact O-CG 3.24Å; E362-R365 WeakPolarHBondContact O-CB 3.3Å; E362-R365 PolarHBondContact O-N 3.35Å; L363-R365 VanDerWaalsContact C-N 3.25Å; L363-R365 PolarHBondContact O-N 2.93Å; R365-S369 PolarHBondContact O-N 3.18Å; R365-S369 VanDerWaalsContact O-N 3.09Å; R365-S369 PolarHBondContact O-OG 3.43Å
366	Y	78.6	Confident	71	Confident	70 Å²	70	73.9 Å²	73.9	28%	0.275	43%	0.426	S	S	.	.	H	α-helix	trans	-71.4	-38.6	177.5	-69.4	-88.4	0	0	0	111.3	E362 L363 A364 N368 S369 E370 K389 L390 L393	E362-Y366 HydrophobicContact CG-CD2 4.48Å; E362-Y366 HydrophobicContact CG-CE2 3.97Å; E362-Y366 VanDerWaalsContact O-CD2 3.27Å; E362-Y366 WeakPolarHBondContact O-CD2 3.3Å; L363-Y366 PolarHBondContact O-N 3.11Å; L363-Y366 VanDerWaalsContact O-N 3.14Å; A364-Y366 VanDerWaalsContact C-N 3.34Å; A364-Y366 PolarHBondContact O-N 3.07Å; Y366-N368 PolarHBondContact O-N 3.47Å; Y366-S369 WeakPolarHBondContact CA-OG 3.5Å; Y366-S369 PolarHBondContact O-N 3.27Å; Y366-S369 PolarHBondContact O-OG 3.39Å; Y366-E370 WeakPolarHBondContact O-CG 3.3Å; Y366-E370 PolarHBondContact O-N 2.83Å; Y366-E370 VanDerWaalsContact O-N 3.1Å; Y366-K389 HydrophobicContact CE1-CG 4.08Å; Y366-K389 WeakPolarHBondContact OH-CE 3.4Å; Y366-K389 WeakPolarHBondContact OH-CG 3.3Å; Y366-L390 HydrophobicContact CD1-CD2 4.19Å; Y366-L390 HydrophobicContact CG-CD2 4.39Å; Y366-L393 HydrophobicContact CD2-CD1 3.52Å; Y366-L393 HydrophobicContact CE2-CD1 3.74Å; Y366-L393 HydrophobicContact CG-CD1 3.98Å
367	S	72.9	Confident	68.6	Low	39 Å²	39	81.5 Å²	81.5	27%	0.273	45%	0.452	S	S	.	.	H	α-helix	trans	-60.2	-47.5	174.1	-172.5	0	0	0	0	112.1	L363 A364 S369 E370 V371	L363-S367 PolarHBondContact O-N 3.46Å; L363-S367 VanDerWaalsContact O-N 3.08Å; A364-S367 PolarHBondContact O-N 2.92Å; S367-S369 PolarHBondContact O-N 2.86Å; S367-E370 PolarHBondContact O-N 3.33Å; S367-V371 WeakPolarHBondContact O-CG2 3.33Å; S367-V371 PolarHBondContact O-N 3.31Å; S367-V371 VanDerWaalsContact O-N 3.15Å
368	N	66.2	Low	66.3	Low	102 Å²	102	84.8 Å²	84.8	55%	0.545	47%	0.466	S	S	.	.	H	α-helix	trans	-66.8	-37.1	-179.6	-70.8	-14.8	0	0	0	112.1	A364 Y366 E370 V371 V372	A364-N368 PolarHBondContact O-N 3.4Å; Y366-N368 PolarHBondContact O-N 3.47Å; N368-E370 VanDerWaalsContact C-N 3.34Å; N368-E370 PolarHBondContact O-N 2.8Å; N368-V371 PolarHBondContact O-N 3.31Å; N368-V372 WeakPolarHBondContact O-CB 3.26Å; N368-V372 VanDerWaalsContact O-CG2 3.26Å; N368-V372 WeakPolarHBondContact O-CG2 3.41Å; N368-V372 PolarHBondContact O-N 2.82Å
369	S	60.3	Low	64	Low	51 Å²	51	87.3 Å²	87.3	36%	0.357	48%	0.484	S	S	.	.	H	α-helix	trans	-64.5	-36.6	174.8	57.5	0	0	0	0	112.6	R365 Y366 S367 T373	R365-S369 PolarHBondContact O-N 3.18Å; R365-S369 VanDerWaalsContact O-N 3.09Å; R365-S369 PolarHBondContact O-OG 3.43Å; Y366-S369 WeakPolarHBondContact CA-OG 3.5Å; Y366-S369 PolarHBondContact O-N 3.27Å; Y366-S369 PolarHBondContact O-OG 3.39Å; S367-S369 PolarHBondContact O-N 2.86Å; S369-T373 WeakPolarHBondContact O-CB 3.37Å; S369-T373 VanDerWaalsContact O-CG2 3.29Å; S369-T373 WeakPolarHBondContact O-CG2 3.34Å; S369-T373 PolarHBondContact O-N 2.89Å; S369-T373 PolarHBondContact O-OG1 3.31Å
370	E	60.9	Low	62.4	Low	48 Å²	48	90.9 Å²	90.9	22%	0.224	52%	0.515	C	S	.	.	H	α-helix	trans	-64.3	-44.3	174.2	-64.8	-53.6	133.2	0	0	111.8	Y366 S367 N368 G374 K382 M468 V471	Y366-E370 WeakPolarHBondContact O-CG 3.3Å; Y366-E370 PolarHBondContact O-N 2.83Å; Y366-E370 VanDerWaalsContact O-N 3.1Å; S367-E370 PolarHBondContact O-N 3.33Å; N368-E370 VanDerWaalsContact C-N 3.34Å; N368-E370 PolarHBondContact O-N 2.8Å; E370-G374 PolarHBondContact O-N 2.98Å; E370-K382 WeakPolarHBondContact OE1-CE 3.41Å; E370-K382 IonicContact OE1-NZ 2.79Å; E370-K382 PolarHBondContact OE1-NZ 2.97Å; E370-K382 IonicContact OE2-NZ 3.7Å; E370-K382 PolarHBondContact OE2-NZ 3.42Å; E370-M468 HydrophobicContact CG-CE 4.22Å; E370-V471 HydrophobicContact CG-CG1 4.27Å; E370-V471 HydrophobicContact CG-CG2 4.3Å
371	V	55.1	Low	61.6	Low	106 Å²	106	96.1 Å²	96.1	64%	0.642	54%	0.538	S	S	*	.	H	α-helix	trans	-67.1	-39.9	-177.9	175.7	0	0	0	0	111.6	S367 N368	S367-V371 WeakPolarHBondContact O-CG2 3.33Å; S367-V371 PolarHBondContact O-N 3.31Å; S367-V371 VanDerWaalsContact O-N 3.15Å; N368-V371 PolarHBondContact O-N 3.31Å
372	V	49.6	Very low	61.5	Low	108 Å²	108	95.9 Å²	95.9	66%	0.655	53%	0.53	S	S	*	.	H	α-helix	trans	-76.3	-32.6	-179.1	174.8	0	0	0	0	112.3	N368 S375	N368-V372 WeakPolarHBondContact O-CB 3.26Å; N368-V372 VanDerWaalsContact O-CG2 3.26Å; N368-V372 WeakPolarHBondContact O-CG2 3.41Å; N368-V372 PolarHBondContact O-N 2.82Å; V372-S375 PolarHBondContact O-OG 3.27Å
373	T	51	Low	61.6	Low	84 Å²	84	97.2 Å²	97.2	52%	0.515	54%	0.541	S	S	.	.	H	α-helix	trans	-85.2	-20.1	180	56.4	0	0	0	0	113.7	S369 S375	S369-T373 WeakPolarHBondContact O-CB 3.37Å; S369-T373 VanDerWaalsContact O-CG2 3.29Å; S369-T373 WeakPolarHBondContact O-CG2 3.34Å; S369-T373 PolarHBondContact O-N 2.89Å; S369-T373 PolarHBondContact O-OG1 3.31Å; T373-S375 VanDerWaalsContact C-N 3.31Å; T373-S375 PolarHBondContact O-N 3.38Å
374	G	47.3	Very low	61.8	Low	65 Å²	65	100.1 Å²	100.1	67%	0.67	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-15.8	-179.9	0	0	0	0	0	115.8	E370	E370-G374 PolarHBondContact O-N 2.98Å
375	S	39.6	Very low	62.3	Low	109 Å²	109	101.6 Å²	101.6	76%	0.762	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	0.3	-175.1	54.5	0	0	0	0	115.2	V372 T373	V372-S375 PolarHBondContact O-OG 3.27Å; T373-S375 VanDerWaalsContact C-N 3.31Å; T373-S375 PolarHBondContact O-N 3.38Å
376	G	40.2	Very low	62.8	Low	68 Å²	68	97.4 Å²	97.4	70%	0.701	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.5	0.2	-174.9	0	0	0	0	0	118.9
377	R	41.1	Very low	63.4	Low	210 Å²	210	94.7 Å²	94.7	79%	0.792	55%	0.547	S	S	*	.			trans	-129.8	94.6	175.5	-73.8	-174.7	177.7	173.3	0.6	111.5	E379	R377-E379 PolarHBondContact O-N 3Å
378	Q	40.7	Very low	64.3	Low	194 Å²	194	96.4 Å²	96.4	91%	0.907	55%	0.547	S	S	*	.	S	Bend	trans	-61.5	127.1	153.5	-78.1	174.8	-22.6	0	0	108
379	E	43	Very low	65.6	Low	198 Å²	198	94.2 Å²	94.2	93%	0.925	53%	0.533	S	S	*	.			trans	75.6	55.4	162.4	-56.7	-177.4	164.8	0	0	119.8	R377	R377-E379 PolarHBondContact O-N 3Å
380	A	58.4	Low	67.1	Low	79 Å²	79	92 Å²	92	65%	0.653	52%	0.517	S	S	*	.			trans	-117.8	101.2	153.6	0	0	0	0	0	110.1	K382	A380-K382 PolarHBondContact O-N 3.24Å
381	Q	70.9	Confident	68.8	Low	143 Å²	143	89.9 Å²	89.9	67%	0.668	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-63.9	127.9	172.4	-168.5	176.1	7	0	0	109
382	K	82.5	Confident	70.7	Confident	56 Å²	56	87.4 Å²	87.4	24%	0.243	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-63.6	158.1	178	-61.7	176.5	-172.2	162.9	0	111.7	E370 A380 E386 Y387	E370-K382 WeakPolarHBondContact OE1-CE 3.41Å; E370-K382 IonicContact OE1-NZ 2.79Å; E370-K382 PolarHBondContact OE1-NZ 2.97Å; E370-K382 IonicContact OE2-NZ 3.7Å; E370-K382 PolarHBondContact OE2-NZ 3.42Å; A380-K382 PolarHBondContact O-N 3.24Å; K382-E386 HydrophobicContact CB-CB 4.1Å; K382-E386 HydrophobicContact CD-CB 4.48Å; K382-Y387 HydrophobicContact CB-CD1 4.35Å; K382-Y387 HydrophobicContact CB-CD2 4.18Å; K382-Y387 HydrophobicContact CB-CE1 3.91Å; K382-Y387 HydrophobicContact CB-CE2 3.76Å; K382-Y387 HydrophobicContact CB-CG 4.48Å; K382-Y387 HydrophobicContact CD-CD1 4.36Å; K382-Y387 HydrophobicContact CD-CE1 3.93Å; K382-Y387 HydrophobicContact CG-CE1 4.32Å; K382-Y387 WeakPolarHBondContact O-CE2 3.33Å
383	T	89.4	Confident	72.9	Confident	80 Å²	80	82.3 Å²	82.3	49%	0.491	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-73.8	158.9	175.7	64.7	0	0	0	0	111.9	A385 E386 Y387	T383-A385 PolarHBondContact O-N 2.97Å; T383-E386 WeakPolarHBondContact CB-OE2 3.48Å; T383-E386 PolarHBondContact N-OE2 3.34Å; T383-E386 PolarHBondContact O-N 2.88Å; T383-E386 WeakPolarHBondContact OG1-CG 3.42Å; T383-E386 PolarHBondContact OG1-N 2.93Å; T383-E386 PolarHBondContact OG1-OE2 3.28Å; T383-Y387 WeakPolarHBondContact O-CD2 3.32Å; T383-Y387 PolarHBondContact O-N 3.15Å; T383-Y387 VanDerWaalsContact O-N 3.13Å
384	D	89.4	Confident	74.9	Confident	65 Å²	65	78.3 Å²	78.3	35%	0.348	44%	0.435	S	S	.	.	H	α-helix	trans	-56.9	-33.1	176.1	-73.5	-5.4	0	0	0	112.4	R388 H478 R549	D384-R388 VanDerWaalsContact O-CB 3.25Å; D384-R388 WeakPolarHBondContact O-CB 3.22Å; D384-R388 PolarHBondContact O-N 3.35Å; D384-H478 IonicContact OD1-CD2 3.95Å; D384-H478 IonicContact OD1-CE1 2.7Å; D384-H478 IonicContact OD1-NE2 3.92Å; D384-H478 PolarHBondContact OD1-NE2 2.68Å; D384-R549 IonicContact OD1-NE 3.78Å; D384-R549 PolarHBondContact OD1-NE 2.97Å; D384-R549 IonicContact OD2-CZ 3.48Å; D384-R549 VanDerWaalsContact OD2-CZ 3.31Å; D384-R549 IonicContact OD2-NE 3.67Å; D384-R549 PolarHBondContact OD2-NE 2.58Å; D384-R549 IonicContact OD2-NH2 2.75Å; D384-R549 PolarHBondContact OD2-NH2 3.14Å
385	A	91.4	Very high	77.3	Confident	73 Å²	73	76.2 Å²	76.2	60%	0.603	41%	0.408	S	S	*	.	H	α-helix	trans	-69.6	-40.4	178.8	0	0	0	0	0	112.6	T383 R388 K389	T383-A385 PolarHBondContact O-N 2.97Å; A385-R388 PolarHBondContact O-N 3.26Å; A385-K389 PolarHBondContact O-N 2.97Å
386	E	89.4	Confident	80	Confident	98 Å²	98	75 Å²	75	46%	0.458	39%	0.39	S	S	.	.	H	α-helix	trans	-67.5	-43.6	176.9	-70.7	164	134.3	0	0	111.2	K382 T383 R388 K389 L390	K382-E386 HydrophobicContact CB-CB 4.1Å; K382-E386 HydrophobicContact CD-CB 4.48Å; T383-E386 WeakPolarHBondContact CB-OE2 3.48Å; T383-E386 PolarHBondContact N-OE2 3.34Å; T383-E386 PolarHBondContact O-N 2.88Å; T383-E386 WeakPolarHBondContact OG1-CG 3.42Å; T383-E386 PolarHBondContact OG1-N 2.93Å; T383-E386 PolarHBondContact OG1-OE2 3.28Å; E386-R388 VanDerWaalsContact C-N 3.34Å; E386-R388 PolarHBondContact O-N 3.42Å; E386-K389 PolarHBondContact O-N 2.58Å; E386-L390 PolarHBondContact O-N 3.01Å
387	Y	91.4	Very high	82.6	Confident	13 Å²	13	71.7 Å²	71.7	5%	0.051	36%	0.357	C	S	.	.	H	α-helix	trans	-63.2	-41.3	173.6	-71.2	-51.4	0	0	0	111.9	K382 T383 K389 L390 F391 H474 A475 H478 T479	K382-Y387 HydrophobicContact CB-CD1 4.35Å; K382-Y387 HydrophobicContact CB-CD2 4.18Å; K382-Y387 HydrophobicContact CB-CE1 3.91Å; K382-Y387 HydrophobicContact CB-CE2 3.76Å; K382-Y387 HydrophobicContact CB-CG 4.48Å; K382-Y387 HydrophobicContact CD-CD1 4.36Å; K382-Y387 HydrophobicContact CD-CE1 3.93Å; K382-Y387 HydrophobicContact CG-CE1 4.32Å; K382-Y387 WeakPolarHBondContact O-CE2 3.33Å; T383-Y387 WeakPolarHBondContact O-CD2 3.32Å; T383-Y387 PolarHBondContact O-N 3.15Å; T383-Y387 VanDerWaalsContact O-N 3.13Å; Y387-K389 VanDerWaalsContact C-N 3.3Å; Y387-K389 PolarHBondContact O-N 3.15Å; Y387-L390 PolarHBondContact O-N 3.07Å; Y387-F391 PolarHBondContact O-N 3.05Å; Y387-H474 AromaticContact CE1-CD2 3.49Å; Y387-H474 VanDerWaalsContact CE1-CD2 3.49Å; Y387-H474 WeakPolarHBondContact CE1-CD2 3.46Å; Y387-H474 AromaticContact CE1-NE2 3.75Å; Y387-H474 AromaticContact CZ-CD2 3.87Å; Y387-H474 AromaticContact CZ-NE2 3.61Å; Y387-H474 PolarHBondContact OH-NE2 2.85Å; Y387-H474 VanDerWaalsContact OH-NE2 3.14Å; Y387-A475 HydrophobicContact CD1-CB 3.75Å; Y387-H478 HydrophobicContact CD2-CB 4.23Å; Y387-H478 AromaticContact CD2-CD2 3.34Å; Y387-H478 WeakPolarHBondContact CD2-CD2 3.43Å; Y387-H478 AromaticContact CD2-CE1 3.78Å; Y387-H478 AromaticContact CD2-CG 3.57Å; Y387-H478 AromaticContact CD2-ND1 3.87Å; Y387-H478 AromaticContact CD2-NE2 3.49Å; Y387-H478 WeakPolarHBondContact CD2-NE2 3.42Å; Y387-H478 AromaticContact CE2-CE1 3.74Å; Y387-H478 AromaticContact CE2-CG 3.89Å; Y387-H478 AromaticContact CE2-ND1 3.74Å; Y387-H478 AromaticContact CE2-NE2 3.94Å; Y387-H478 HydrophobicContact CG-CB 4.28Å; Y387-H478 AromaticContact CG-CD2 3.91Å; Y387-T479 PolarHBondContact O-OG1 3.01Å
388	R	93.6	Very high	85.3	Confident	75 Å²	75	61.7 Å²	61.7	28%	0.283	32%	0.319	S	S	.	.	H	α-helix	trans	-61	-40.2	176.3	178.4	58.7	-166.5	-150.3	4	111.8	D384 A385 E386 L390 F391 D392 T479	D384-R388 VanDerWaalsContact O-CB 3.25Å; D384-R388 WeakPolarHBondContact O-CB 3.22Å; D384-R388 PolarHBondContact O-N 3.35Å; A385-R388 PolarHBondContact O-N 3.26Å; E386-R388 VanDerWaalsContact C-N 3.34Å; E386-R388 PolarHBondContact O-N 3.42Å; R388-L390 PolarHBondContact O-N 3.35Å; R388-F391 WeakPolarHBondContact O-CB 3.45Å; R388-F391 PolarHBondContact O-N 2.7Å; R388-D392 IonicContact CZ-OD1 3.94Å; R388-D392 VanDerWaalsContact CZ-OD1 3.24Å; R388-D392 IonicContact NE-OD1 3.84Å; R388-D392 PolarHBondContact NE-OD1 3.37Å; R388-D392 IonicContact NE-OD2 3.12Å; R388-D392 PolarHBondContact NE-OD2 3.34Å; R388-D392 IonicContact NH2-OD1 3.73Å; R388-D392 PolarHBondContact NH2-OD1 2.63Å; R388-D392 VanDerWaalsContact O-CG 3.28Å; R388-D392 PolarHBondContact O-N 2.97Å; R388-T479 HydrophobicContact CB-CG2 4.43Å; R388-T479 PolarHBondContact N-OG1 3.33Å
389	K	93.1	Very high	87.9	Confident	56 Å²	56	55.6 Å²	55.6	24%	0.243	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-39.8	177.9	-178.3	55	-179.5	170.6	0	112.3	E362 Y366 A385 E386 Y387 D392 L393	E362-K389 WeakPolarHBondContact OE1-CE 3.24Å; E362-K389 IonicContact OE1-NZ 2.88Å; E362-K389 PolarHBondContact OE1-NZ 3.19Å; Y366-K389 HydrophobicContact CE1-CG 4.08Å; Y366-K389 WeakPolarHBondContact OH-CE 3.4Å; Y366-K389 WeakPolarHBondContact OH-CG 3.3Å; A385-K389 PolarHBondContact O-N 2.97Å; E386-K389 PolarHBondContact O-N 2.58Å; Y387-K389 VanDerWaalsContact C-N 3.3Å; Y387-K389 PolarHBondContact O-N 3.15Å; K389-D392 PolarHBondContact O-N 2.93Å; K389-L393 WeakPolarHBondContact O-CG 3.29Å; K389-L393 PolarHBondContact O-N 2.95Å
390	L	91.8	Very high	90.4	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-66.5	-37.6	174.2	-69.9	169.7	0	0	0	112.1	Y366 E386 Y387 R388 L393 A394 V471 A475	Y366-L390 HydrophobicContact CD1-CD2 4.19Å; Y366-L390 HydrophobicContact CG-CD2 4.39Å; E386-L390 PolarHBondContact O-N 3.01Å; Y387-L390 PolarHBondContact O-N 3.07Å; R388-L390 PolarHBondContact O-N 3.35Å; L390-L393 PolarHBondContact O-N 3.03Å; L390-A394 WeakPolarHBondContact O-CB 3.31Å; L390-A394 PolarHBondContact O-N 3.01Å; L390-V471 HydrophobicContact CD1-CG1 3.88Å; L390-V471 HydrophobicContact CD2-CG1 4.4Å; L390-A475 HydrophobicContact CB-CB 3.63Å; L390-A475 HydrophobicContact CD1-CB 3.97Å; L390-A475 HydrophobicContact CG-CB 4.47Å
391	F	96	Very high	92.3	Very high	3 Å²	3	43 Å²	43	1%	0.013	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-45.8	170.7	169.8	-79.3	0	0	0	111.5	Y387 R388 L393 A394 L395 I476 T479 V480 Y602 L605	Y387-F391 PolarHBondContact O-N 3.05Å; R388-F391 WeakPolarHBondContact O-CB 3.45Å; R388-F391 PolarHBondContact O-N 2.7Å; F391-L393 PolarHBondContact O-N 2.51Å; F391-A394 PolarHBondContact O-N 3Å; F391-L395 PolarHBondContact O-N 3.45Å; F391-L395 VanDerWaalsContact O-N 3.1Å; F391-I476 HydrophobicContact CB-CG1 4.46Å; F391-I476 HydrophobicContact CD2-CB 4.26Å; F391-I476 HydrophobicContact CD2-CG1 3.99Å; F391-I476 HydrophobicContact CD2-CG2 4.13Å; F391-I476 HydrophobicContact CE2-CG2 4.39Å; F391-T479 HydrophobicContact CB-CG2 4.1Å; F391-T479 HydrophobicContact CD1-CG2 4.34Å; F391-T479 HydrophobicContact CD2-CG2 4.02Å; F391-T479 HydrophobicContact CG-CG2 3.91Å; F391-V480 HydrophobicContact CD2-CG2 4.48Å; F391-V480 HydrophobicContact CE2-CG2 3.92Å; F391-Y602 HydrophobicContact CE2-CD1 4.13Å; F391-Y602 HydrophobicContact CE2-CE1 4.08Å; F391-Y602 AromaticContact CZ-CD1 3.97Å; F391-Y602 HydrophobicContact CZ-CD1 3.97Å; F391-Y602 AromaticContact CZ-CE1 3.71Å; F391-Y602 HydrophobicContact CZ-CE1 3.71Å; F391-L605 HydrophobicContact CD2-CD1 3.97Å; F391-L605 HydrophobicContact CE1-CD1 3.98Å; F391-L605 HydrophobicContact CE2-CB 4.45Å; F391-L605 HydrophobicContact CE2-CD1 3.26Å; F391-L605 HydrophobicContact CE2-CG 4.45Å; F391-L605 HydrophobicContact CZ-CD1 3.24Å
392	D	95.1	Very high	93.5	Very high	55 Å²	55	36.6 Å²	36.6	29%	0.294	19%	0.189	S	C	.	.	H	α-helix	trans	-65.1	-40	179.5	-65.5	-35.1	0	0	0	111.1	R388 K389 L395 Q396	R388-D392 IonicContact CZ-OD1 3.94Å; R388-D392 VanDerWaalsContact CZ-OD1 3.24Å; R388-D392 IonicContact NE-OD1 3.84Å; R388-D392 PolarHBondContact NE-OD1 3.37Å; R388-D392 IonicContact NE-OD2 3.12Å; R388-D392 PolarHBondContact NE-OD2 3.34Å; R388-D392 IonicContact NH2-OD1 3.73Å; R388-D392 PolarHBondContact NH2-OD1 2.63Å; R388-D392 VanDerWaalsContact O-CG 3.28Å; R388-D392 PolarHBondContact O-N 2.97Å; K389-D392 PolarHBondContact O-N 2.93Å; D392-L395 PolarHBondContact O-N 3.26Å; D392-Q396 VanDerWaalsContact O-CB 3.24Å; D392-Q396 WeakPolarHBondContact O-CB 3.4Å; D392-Q396 PolarHBondContact O-N 3.41Å
393	L	94.6	Very high	94.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.1	-41.3	174.9	-73.9	172.1	0	0	0	112.3	F359 E362 Y366 K389 L390 F391 Q396 G397 F472	F359-L393 HydrophobicContact CE2-CD2 3.88Å; F359-L393 WeakPolarHBondContact CZ-O 3.32Å; E362-L393 HydrophobicContact CG-CD2 4.18Å; Y366-L393 HydrophobicContact CD2-CD1 3.52Å; Y366-L393 HydrophobicContact CE2-CD1 3.74Å; Y366-L393 HydrophobicContact CG-CD1 3.98Å; K389-L393 WeakPolarHBondContact O-CG 3.29Å; K389-L393 PolarHBondContact O-N 2.95Å; L390-L393 PolarHBondContact O-N 3.03Å; F391-L393 PolarHBondContact O-N 2.51Å; L393-Q396 PolarHBondContact O-N 3.24Å; L393-G397 PolarHBondContact O-N 3.28Å; L393-F472 HydrophobicContact CB-CE1 4.26Å
394	A	94.9	Very high	94.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-47.8	176.5	0	0	0	0	0	111.3	L390 F391 L398 F472 I476 L605 F608	L390-A394 WeakPolarHBondContact O-CB 3.31Å; L390-A394 PolarHBondContact O-N 3.01Å; F391-A394 PolarHBondContact O-N 3Å; A394-L398 VanDerWaalsContact O-CG 3.32Å; A394-L398 WeakPolarHBondContact O-CG 3.14Å; A394-L398 PolarHBondContact O-N 3.44Å; A394-L398 VanDerWaalsContact O-N 3.13Å; A394-F472 HydrophobicContact CB-CB 4.31Å; A394-F472 HydrophobicContact CB-CD1 3.71Å; A394-F472 HydrophobicContact CB-CD2 4.39Å; A394-F472 HydrophobicContact CB-CE1 4.02Å; A394-F472 HydrophobicContact CB-CG 3.91Å; A394-F472 HydrophobicContact CB-CZ 4.47Å; A394-I476 HydrophobicContact CB-CD1 3.86Å; A394-I476 HydrophobicContact CB-CG1 4.41Å; A394-L605 HydrophobicContact CB-CD2 4.21Å; A394-F608 HydrophobicContact CB-CD2 4.31Å; A394-F608 HydrophobicContact CB-CE2 3.94Å
395	L	96.6	Very high	94.8	Very high	22 Å²	22	31.1 Å²	31.1	12%	0.115	16%	0.157	C	C	.	.	H	α-helix	trans	-64.7	-46.2	177.8	-178	58.3	0	0	0	111.9	L255 F391 D392 G397 L398 Q399 F601 L605	L255-L395 HydrophobicContact CD1-CD1 4.03Å; F391-L395 PolarHBondContact O-N 3.45Å; F391-L395 VanDerWaalsContact O-N 3.1Å; D392-L395 PolarHBondContact O-N 3.26Å; L395-G397 VanDerWaalsContact C-N 3.34Å; L395-G397 PolarHBondContact O-N 2.9Å; L395-L398 PolarHBondContact O-N 3.14Å; L395-Q399 HydrophobicContact CD1-CG 4.28Å; L395-Q399 HydrophobicContact CG-CG 4.49Å; L395-Q399 WeakPolarHBondContact O-CB 3.33Å; L395-Q399 VanDerWaalsContact O-CG 3.3Å; L395-Q399 WeakPolarHBondContact O-CG 3.16Å; L395-Q399 PolarHBondContact O-N 2.84Å; L395-F601 HydrophobicContact CD1-CB 4.04Å; L395-F601 HydrophobicContact CD1-CD1 4.06Å; L395-F601 HydrophobicContact CD1-CD2 4.47Å; L395-F601 HydrophobicContact CD1-CG 3.94Å; L395-F601 HydrophobicContact CD2-CB 4.44Å; L395-F601 HydrophobicContact CD2-CD2 4.12Å; L395-F601 HydrophobicContact CD2-CG 4.32Å; L395-L605 HydrophobicContact CB-CD1 4.13Å; L395-L605 HydrophobicContact CB-CD2 4Å; L395-L605 HydrophobicContact CD1-CD1 4.29Å; L395-L605 HydrophobicContact CD1-CD2 4.3Å; L395-L605 HydrophobicContact CD1-CG 4.47Å; L395-L605 HydrophobicContact CD2-CD1 4.48Å
396	Q	96.1	Very high	94.9	Very high	82 Å²	82	27.8 Å²	27.8	38%	0.383	13%	0.129	S	C	.	.	H	α-helix	trans	-61.4	-42.1	179.7	-176	-179.4	3.3	0	0	111.7	F359 D392 L393 Q399 L400	F359-Q396 HydrophobicContact CD2-CG 3.93Å; F359-Q396 HydrophobicContact CE2-CB 3.91Å; F359-Q396 HydrophobicContact CE2-CG 3.79Å; D392-Q396 VanDerWaalsContact O-CB 3.24Å; D392-Q396 WeakPolarHBondContact O-CB 3.4Å; D392-Q396 PolarHBondContact O-N 3.41Å; L393-Q396 PolarHBondContact O-N 3.24Å; Q396-Q399 PolarHBondContact O-N 3.43Å; Q396-L400 WeakPolarHBondContact O-CB 3.31Å; Q396-L400 PolarHBondContact O-N 3.27Å
397	G	95.5	Very high	95.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.1	-43.2	177	0	0	0	0	0	112.6	L393 L395 Q399 L400 L401	L393-G397 PolarHBondContact O-N 3.28Å; L395-G397 VanDerWaalsContact C-N 3.34Å; L395-G397 PolarHBondContact O-N 2.9Å; G397-Q399 PolarHBondContact O-N 3.41Å; G397-L400 PolarHBondContact O-N 3.48Å; G397-L401 WeakPolarHBondContact O-CB 3.26Å; G397-L401 VanDerWaalsContact O-CG 3.3Å; G397-L401 WeakPolarHBondContact O-CG 3.34Å; G397-L401 PolarHBondContact O-N 3.44Å
398	L	97.1	Very high	95.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.1	-40.8	175.1	-70.5	172.2	0	0	0	112.4	L255 A394 L395 S402 L605 F608 T611 L612 C615	L255-L398 HydrophobicContact CD1-CB 4.14Å; L255-L398 HydrophobicContact CD2-CB 4.43Å; L255-L398 HydrophobicContact CD2-CD1 4.28Å; A394-L398 VanDerWaalsContact O-CG 3.32Å; A394-L398 WeakPolarHBondContact O-CG 3.14Å; A394-L398 PolarHBondContact O-N 3.44Å; A394-L398 VanDerWaalsContact O-N 3.13Å; L395-L398 PolarHBondContact O-N 3.14Å; L398-S402 VanDerWaalsContact O-CB 3.29Å; L398-S402 WeakPolarHBondContact O-CB 3.34Å; L398-S402 PolarHBondContact O-N 3.48Å; L398-L605 HydrophobicContact CD1-CD2 3.93Å; L398-F608 HydrophobicContact CD1-CD2 3.76Å; L398-F608 HydrophobicContact CD1-CE2 3.77Å; L398-F608 HydrophobicContact CD2-CE2 4.11Å; L398-F608 HydrophobicContact CG-CD2 4.36Å; L398-F608 HydrophobicContact CG-CE2 3.87Å; L398-T611 HydrophobicContact CD1-CG2 3.89Å; L398-T611 HydrophobicContact CD2-CG2 4.24Å; L398-L612 HydrophobicContact CD2-CB 3.93Å; L398-L612 HydrophobicContact CD2-CD1 3.84Å; L398-C615 HydrophobicContact CD2-CB 4.5Å; L398-C615 PolarHBondContact O-SG 3.21Å
399	Q	96.1	Very high	95.3	Very high	65 Å²	65	21.8 Å²	21.8	30%	0.304	11%	0.105	S	C	.	.	H	α-helix	trans	-64.9	-40.2	176.1	-74.1	173.9	-18.9	0	0	111.9	L255 L395 Q396 G397 S402 Q403	L255-Q399 HydrophobicContact CD1-CB 4.48Å; L255-Q399 HydrophobicContact CD1-CG 3.54Å; L395-Q399 HydrophobicContact CD1-CG 4.28Å; L395-Q399 HydrophobicContact CG-CG 4.49Å; L395-Q399 WeakPolarHBondContact O-CB 3.33Å; L395-Q399 VanDerWaalsContact O-CG 3.3Å; L395-Q399 WeakPolarHBondContact O-CG 3.16Å; L395-Q399 PolarHBondContact O-N 2.84Å; Q396-Q399 PolarHBondContact O-N 3.43Å; G397-Q399 PolarHBondContact O-N 3.41Å; Q399-S402 PolarHBondContact O-N 3.01Å; Q399-Q403 VanDerWaalsContact O-CG 3.25Å; Q399-Q403 WeakPolarHBondContact O-CG 3.26Å; Q399-Q403 PolarHBondContact O-N 3.21Å; Q399-Q403 PolarHBondContact O-NE2 2.6Å
400	L	95.9	Very high	95.4	Very high	14 Å²	14	19.7 Å²	19.7	7%	0.073	10%	0.096	C	C	.	.	H	α-helix	trans	-66.7	-47.1	179	-172.2	63.5	0	0	0	111.3	D355 F359 Q396 G397 S402 Q403 W404 L461	D355-L400 HydrophobicContact CB-CD1 3.91Å; F359-L400 HydrophobicContact CB-CD2 3.79Å; F359-L400 HydrophobicContact CD1-CD2 4.02Å; F359-L400 HydrophobicContact CG-CD2 3.95Å; Q396-L400 WeakPolarHBondContact O-CB 3.31Å; Q396-L400 PolarHBondContact O-N 3.27Å; G397-L400 PolarHBondContact O-N 3.48Å; L400-S402 VanDerWaalsContact C-N 3.33Å; L400-S402 PolarHBondContact O-N 3.17Å; L400-Q403 WeakPolarHBondContact O-CB 3.36Å; L400-Q403 PolarHBondContact O-N 3.02Å; L400-W404 HydrophobicContact CD1-CZ2 3.61Å; L400-W404 HydrophobicContact CD2-CH2 3.59Å; L400-W404 HydrophobicContact CD2-CZ2 3.45Å; L400-W404 VanDerWaalsContact CD2-CZ2 3.45Å; L400-W404 HydrophobicContact CD2-CZ3 4.47Å; L400-W404 HydrophobicContact CG-CD2 4.23Å; L400-W404 HydrophobicContact CG-CH2 3.78Å; L400-W404 HydrophobicContact CG-CZ2 3.34Å; L400-W404 HydrophobicContact CG-CZ3 4.39Å; L400-W404 PolarHBondContact O-N 2.81Å; L400-W404 VanDerWaalsContact O-N 3.1Å; L400-L461 HydrophobicContact CD2-CD2 4.2Å
401	L	96.4	Very high	95.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-57.7	-45.6	174.1	-73.2	168.2	0	0	0	111.7	G397 Q403 W404 S405 I458 L461 M465 L612 C615	G397-L401 WeakPolarHBondContact O-CB 3.26Å; G397-L401 VanDerWaalsContact O-CG 3.3Å; G397-L401 WeakPolarHBondContact O-CG 3.34Å; G397-L401 PolarHBondContact O-N 3.44Å; L401-Q403 VanDerWaalsContact C-N 3.35Å; L401-Q403 PolarHBondContact O-N 2.97Å; L401-W404 HydrophobicContact CD2-CE3 4.3Å; L401-W404 HydrophobicContact CD2-CZ3 4.43Å; L401-W404 PolarHBondContact O-N 3.29Å; L401-S405 PolarHBondContact O-N 2.91Å; L401-S405 PolarHBondContact O-OG 3.17Å; L401-S405 VanDerWaalsContact O-OG 3.08Å; L401-I458 HydrophobicContact CD2-CB 4.43Å; L401-I458 HydrophobicContact CD2-CG2 4.17Å; L401-I458 WeakPolarHBondContact CD2-O 3.44Å; L401-L461 HydrophobicContact CD1-CD2 4.4Å; L401-L461 HydrophobicContact CD1-CG 4.26Å; L401-L461 HydrophobicContact CD2-CB 3.86Å; L401-L461 HydrophobicContact CD2-CD2 3.79Å; L401-L461 HydrophobicContact CD2-CG 3.87Å; L401-L461 HydrophobicContact CG-CD2 3.82Å; L401-L461 HydrophobicContact CG-CG 4.11Å; L401-M465 HydrophobicContact CD1-CG 4.19Å; L401-L612 HydrophobicContact CD1-CD1 3.47Å; L401-L612 VanDerWaalsContact CD1-CD1 3.47Å; L401-C615 CarbonylContact C-O 3.58Å; L401-C615 HydrophobicContact CB-CB 4.19Å
402	S	97.3	Very high	95.4	Very high	7 Å²	7	20.4 Å²	20.4	5%	0.049	10%	0.1	C	C	.	.	H	α-helix	trans	-60.2	-42.4	176.8	178	0	0	0	0	112.6	L255 P257 L398 Q399 L400 W404 A406	L255-S402 WeakPolarHBondContact O-CB 3.36Å; L255-S402 PolarHBondContact O-OG 3.2Å; P257-S402 WeakPolarHBondContact CD-OG 3.32Å; L398-S402 VanDerWaalsContact O-CB 3.29Å; L398-S402 WeakPolarHBondContact O-CB 3.34Å; L398-S402 PolarHBondContact O-N 3.48Å; Q399-S402 PolarHBondContact O-N 3.01Å; L400-S402 VanDerWaalsContact C-N 3.33Å; L400-S402 PolarHBondContact O-N 3.17Å; S402-W404 PolarHBondContact O-N 2.95Å; S402-A406 WeakPolarHBondContact O-CB 3.36Å; S402-A406 PolarHBondContact O-N 3.13Å
403	Q	94.8	Very high	95.4	Very high	84 Å²	84	17.8 Å²	17.8	39%	0.393	9%	0.086	S	C	.	.	H	α-helix	trans	-60.6	-46.1	176.5	-73.7	167.9	42.8	0	0	111.5	Q399 L400 L401 A406 H407	Q399-Q403 VanDerWaalsContact O-CG 3.25Å; Q399-Q403 WeakPolarHBondContact O-CG 3.26Å; Q399-Q403 PolarHBondContact O-N 3.21Å; Q399-Q403 PolarHBondContact O-NE2 2.6Å; L400-Q403 WeakPolarHBondContact O-CB 3.36Å; L400-Q403 PolarHBondContact O-N 3.02Å; L401-Q403 VanDerWaalsContact C-N 3.35Å; L401-Q403 PolarHBondContact O-N 2.97Å; Q403-A406 PolarHBondContact O-N 2.92Å; Q403-H407 PolarHBondContact O-CD2 3.32Å; Q403-H407 PolarHBondContact O-N 3.01Å
404	W	96.4	Very high	95.4	Very high	3 Å²	3	18.7 Å²	18.7	1%	0.011	9%	0.089	C	C	.	.	H	α-helix	trans	-66.1	-47.1	179.9	-61	-14.2	0	0	0	112.3	I352 H356 L400 L401 S402 A406 H407 V408 V454 M457 I458 L461	I352-W404 HydrophobicContact CG2-CD2 4.33Å; I352-W404 HydrophobicContact CG2-CG 4.34Å; I352-W404 HydrophobicContact CG2-CZ2 4.38Å; H356-W404 HydrophobicContact CB-CH2 3.63Å; H356-W404 HydrophobicContact CB-CZ2 3.8Å; H356-W404 AromaticContact CD2-CH2 3.64Å; L400-W404 HydrophobicContact CD1-CZ2 3.61Å; L400-W404 HydrophobicContact CD2-CH2 3.59Å; L400-W404 HydrophobicContact CD2-CZ2 3.45Å; L400-W404 VanDerWaalsContact CD2-CZ2 3.45Å; L400-W404 HydrophobicContact CD2-CZ3 4.47Å; L400-W404 HydrophobicContact CG-CD2 4.23Å; L400-W404 HydrophobicContact CG-CH2 3.78Å; L400-W404 HydrophobicContact CG-CZ2 3.34Å; L400-W404 HydrophobicContact CG-CZ3 4.39Å; L400-W404 PolarHBondContact O-N 2.81Å; L400-W404 VanDerWaalsContact O-N 3.1Å; L401-W404 HydrophobicContact CD2-CE3 4.3Å; L401-W404 HydrophobicContact CD2-CZ3 4.43Å; L401-W404 PolarHBondContact O-N 3.29Å; S402-W404 PolarHBondContact O-N 2.95Å; W404-A406 VanDerWaalsContact C-N 3.29Å; W404-A406 PolarHBondContact O-N 3Å; W404-H407 WeakPolarHBondContact O-CB 3.2Å; W404-H407 PolarHBondContact O-N 3.43Å; W404-H407 VanDerWaalsContact O-N 3.11Å; W404-V408 PolarHBondContact O-N 3.34Å; W404-V408 VanDerWaalsContact O-N 3.1Å; W404-V454 HydrophobicContact CB-CG1 3.89Å; W404-M457 HydrophobicContact CE3-CB 4.23Å; W404-M457 HydrophobicContact CZ3-CB 4Å; W404-I458 HydrophobicContact CB-CD1 3.82Å; W404-I458 HydrophobicContact CB-CG1 3.55Å; W404-I458 HydrophobicContact CE3-CG1 4.03Å; W404-I458 HydrophobicContact CG-CG1 4.49Å; W404-L461 HydrophobicContact CH2-CD2 3.98Å; W404-L461 HydrophobicContact CZ3-CB 4.26Å; W404-L461 HydrophobicContact CZ3-CD2 3.71Å
405	S	96.5	Very high	95.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.2	-40.4	176.8	-58	0	0	0	0	111.5	L401 H407 V408 M409 C615	L401-S405 PolarHBondContact O-N 2.91Å; L401-S405 PolarHBondContact O-OG 3.17Å; L401-S405 VanDerWaalsContact O-OG 3.08Å; S405-H407 PolarHBondContact O-N 2.77Å; S405-V408 PolarHBondContact O-N 3.08Å; S405-M409 WeakPolarHBondContact O-CG 3.41Å; S405-M409 PolarHBondContact O-N 3.14Å; S405-C615 VanDerWaalsContact CB-O 3.24Å; S405-C615 WeakPolarHBondContact CB-O 3.25Å; S405-C615 PolarHBondContact OG-O 3.43Å
406	A	95.1	Very high	95.2	Very high	2 Å²	2	18.4 Å²	18.4	2%	0.017	9%	0.087	C	C	.	.	H	α-helix	trans	-60.2	-44.2	173.6	0	0	0	0	0	111.5	P257 S402 Q403 W404 V408 M409 E410	P257-A406 HydrophobicContact CB-CB 4.11Å; P257-A406 HydrophobicContact CG-CB 4.3Å; S402-A406 WeakPolarHBondContact O-CB 3.36Å; S402-A406 PolarHBondContact O-N 3.13Å; Q403-A406 PolarHBondContact O-N 2.92Å; W404-A406 VanDerWaalsContact C-N 3.29Å; W404-A406 PolarHBondContact O-N 3Å; A406-V408 PolarHBondContact O-N 3.29Å; A406-M409 PolarHBondContact O-N 3.1Å; A406-E410 WeakPolarHBondContact O-CB 3.48Å; A406-E410 VanDerWaalsContact O-CD 3.3Å; A406-E410 WeakPolarHBondContact O-CG 3.49Å; A406-E410 PolarHBondContact O-N 3.48Å
407	H	92.3	Very high	95.1	Very high	43 Å²	43	17.2 Å²	17.2	20%	0.199	9%	0.086	C	C	.	.	H	α-helix	trans	-58.9	-45.3	176.6	-73.8	-50.6	0	0	0	112.8	Q348 Q403 W404 S405 V411	Q348-H407 PolarHBondContact OE1-CE1 3.17Å; Q348-H407 PolarHBondContact OE1-ND1 2.98Å; Q403-H407 PolarHBondContact O-CD2 3.32Å; Q403-H407 PolarHBondContact O-N 3.01Å; W404-H407 WeakPolarHBondContact O-CB 3.2Å; W404-H407 PolarHBondContact O-N 3.43Å; W404-H407 VanDerWaalsContact O-N 3.11Å; S405-H407 PolarHBondContact O-N 2.77Å; H407-V411 VanDerWaalsContact O-CG2 3.3Å; H407-V411 WeakPolarHBondContact O-CG2 3.36Å; H407-V411 PolarHBondContact O-N 3.4Å; H407-V411 VanDerWaalsContact O-N 3.1Å
408	V	95.2	Very high	95	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.012	10%	0.095	C	C	.	.	H	α-helix	trans	-61.6	-50.6	177.8	-179.1	0	0	0	0	110.6	W404 S405 A406 E410 Y412 L451 V454 I455 I458 L618 L621	W404-V408 PolarHBondContact O-N 3.34Å; W404-V408 VanDerWaalsContact O-N 3.1Å; S405-V408 PolarHBondContact O-N 3.08Å; A406-V408 PolarHBondContact O-N 3.29Å; V408-E410 PolarHBondContact O-N 3.38Å; V408-Y412 WeakPolarHBondContact O-CB 3.08Å; V408-Y412 PolarHBondContact O-N 2.79Å; V408-L451 HydrophobicContact CG1-CD2 4.14Å; V408-V454 HydrophobicContact CG2-CB 3.99Å; V408-V454 HydrophobicContact CG2-CG1 3.55Å; V408-I455 HydrophobicContact CG1-CD1 4.32Å; V408-I455 HydrophobicContact CG1-CG1 4.25Å; V408-I455 HydrophobicContact CG2-CG1 4.3Å; V408-I458 HydrophobicContact CG2-CD1 4.18Å; V408-L618 HydrophobicContact CB-CD2 4.19Å; V408-L618 HydrophobicContact CG1-CD2 4.17Å; V408-L621 HydrophobicContact CG1-CD1 4.42Å
409	M	95.4	Very high	94.8	Very high	15 Å²	15	20.8 Å²	20.8	7%	0.074	11%	0.105	C	C	.	.	H	α-helix	trans	-67.7	-35.3	-177.6	-66.1	-56.2	91.7	0	0	112.8	S405 A406 Y412 S413 L618 L621	S405-M409 WeakPolarHBondContact O-CG 3.41Å; S405-M409 PolarHBondContact O-N 3.14Å; A406-M409 PolarHBondContact O-N 3.1Å; M409-Y412 PolarHBondContact O-N 3.1Å; M409-S413 WeakPolarHBondContact O-CB 3.36Å; M409-S413 PolarHBondContact O-N 2.87Å; M409-L618 HydrophobicContact CE-CB 4.45Å; M409-L618 HydrophobicContact CE-CD2 3.54Å; M409-L618 HydrophobicContact SD-CD2 4.47Å; M409-L621 HydrophobicContact CE-CD1 3.86Å; M409-L621 HydrophobicContact CE-CD2 3.59Å; M409-L621 HydrophobicContact CE-CG 3.59Å; M409-L621 HydrophobicContact SD-CG 4.49Å
410	E	94.1	Very high	94.7	Very high	13 Å²	13	18.3 Å²	18.3	6%	0.061	9%	0.094	C	C	.	.	H	α-helix	trans	-70.9	-40.1	179.8	-71.3	165.9	-171.5	0	0	111.4	K260 H261 L302 A406 V408 W414	K260-E410 IonicContact NZ-OE1 3.43Å; K260-E410 PolarHBondContact NZ-OE1 2.98Å; K260-E410 IonicContact NZ-OE2 2.71Å; K260-E410 PolarHBondContact NZ-OE2 3.45Å; H261-E410 IonicContact CD2-OE1 2.78Å; H261-E410 IonicContact CE1-OE1 3.47Å; H261-E410 IonicContact NE2-OE1 3.68Å; H261-E410 PolarHBondContact NE2-OE1 3.43Å; L302-E410 HydrophobicContact CD1-CB 4.03Å; L302-E410 HydrophobicContact CD1-CG 3.73Å; L302-E410 HydrophobicContact CD2-CG 4.22Å; L302-E410 WeakPolarHBondContact CD2-OE1 3.25Å; A406-E410 WeakPolarHBondContact O-CB 3.48Å; A406-E410 VanDerWaalsContact O-CD 3.3Å; A406-E410 WeakPolarHBondContact O-CG 3.49Å; A406-E410 PolarHBondContact O-N 3.48Å; V408-E410 PolarHBondContact O-N 3.38Å; E410-W414 WeakPolarHBondContact O-CB 3.39Å; E410-W414 PolarHBondContact O-N 3.19Å
411	V	93.1	Very high	94.6	Very high	14 Å²	14	20.2 Å²	20.2	9%	0.085	11%	0.105	C	C	.	.	H	α-helix	trans	-63.2	-46.7	172.5	170.8	0	0	0	0	110.4	H407 W414 K415 Y443	H407-V411 VanDerWaalsContact O-CG2 3.3Å; H407-V411 WeakPolarHBondContact O-CG2 3.36Å; H407-V411 PolarHBondContact O-N 3.4Å; H407-V411 VanDerWaalsContact O-N 3.1Å; V411-W414 PolarHBondContact O-N 2.87Å; V411-K415 HydrophobicContact CG1-CG 4.48Å; V411-K415 WeakPolarHBondContact O-CG 3.49Å; V411-K415 PolarHBondContact O-N 2.92Å; V411-K415 VanDerWaalsContact O-N 3.1Å; V411-Y443 HydrophobicContact CG1-CE1 4.27Å
412	Y	95	Very high	94.4	Very high	8 Å²	8	24.1 Å²	24.1	3%	0.031	12%	0.122	C	C	.	.	H	α-helix	trans	-59.2	-49.1	175.9	173.3	-115.5	0	0	0	112.7	V408 M409 W414 K415 L416 L621 M644	V408-Y412 WeakPolarHBondContact O-CB 3.08Å; V408-Y412 PolarHBondContact O-N 2.79Å; M409-Y412 PolarHBondContact O-N 3.1Å; Y412-W414 VanDerWaalsContact C-N 3.34Å; Y412-W414 PolarHBondContact O-N 3.48Å; Y412-K415 PolarHBondContact O-N 3.38Å; Y412-K415 VanDerWaalsContact O-N 3.17Å; Y412-L416 HydrophobicContact CD1-CD1 4.23Å; Y412-L416 HydrophobicContact CD2-CG 4.27Å; Y412-L416 HydrophobicContact CE1-CD1 3.63Å; Y412-L416 HydrophobicContact CE1-CG 4.33Å; Y412-L416 HydrophobicContact CE2-CD1 3.98Å; Y412-L416 HydrophobicContact CE2-CD2 3.82Å; Y412-L416 HydrophobicContact CE2-CG 3.85Å; Y412-L416 VanDerWaalsContact CZ-CD1 3.49Å; Y412-L416 PolarHBondContact O-N 3.15Å; Y412-L621 HydrophobicContact CD1-CD2 3.72Å; Y412-L621 HydrophobicContact CD2-CD2 3.84Å; Y412-L621 HydrophobicContact CE1-CD2 4.1Å; Y412-L621 HydrophobicContact CE2-CD2 4.23Å; Y412-L621 HydrophobicContact CG-CD2 3.55Å; Y412-M644 HydrophobicContact CD2-CE 4.45Å; Y412-M644 HydrophobicContact CD2-CG 4.19Å; Y412-M644 HydrophobicContact CD2-SD 4.49Å; Y412-M644 HydrophobicContact CE2-CG 3.66Å; Y412-M644 HydrophobicContact CE2-SD 4.33Å
413	S	94.9	Very high	94	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-56.8	-45.3	178	-173	0	0	0	0	112.3	V304 V305 Q312 M409 K415 L416	V304-S413 WeakPolarHBondContact CG1-OG 3.41Å; V305-S413 VanDerWaalsContact C-OG 3.31Å; Q312-S413 VanDerWaalsContact OE1-CB 3.26Å; Q312-S413 PolarHBondContact OE1-OG 2.95Å; M409-S413 WeakPolarHBondContact O-CB 3.36Å; M409-S413 PolarHBondContact O-N 2.87Å; S413-K415 PolarHBondContact O-N 2.85Å; S413-L416 PolarHBondContact O-N 2.96Å
414	W	93.9	Very high	93.8	Very high	18 Å²	18	32.3 Å²	32.3	7%	0.068	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-41.2	177.4	-171.6	95.5	0	0	0	112.5	S340 P341 E410 V411 Y412 V417 H418	S340-W414 VanDerWaalsContact O-CZ2 3.29Å; S340-W414 WeakPolarHBondContact O-CZ2 3.46Å; P341-W414 VanDerWaalsContact CA-CH2 3.49Å; P341-W414 HydrophobicContact CB-CH2 4.22Å; P341-W414 HydrophobicContact CB-CZ3 4.18Å; E410-W414 WeakPolarHBondContact O-CB 3.39Å; E410-W414 PolarHBondContact O-N 3.19Å; V411-W414 PolarHBondContact O-N 2.87Å; Y412-W414 VanDerWaalsContact C-N 3.34Å; Y412-W414 PolarHBondContact O-N 3.48Å; W414-V417 WeakPolarHBondContact O-CG2 2.94Å; W414-V417 PolarHBondContact O-N 3.39Å; W414-H418 AromaticContact CD1-CE1 3.87Å; W414-H418 AromaticContact CD1-ND1 3.86Å; W414-H418 AromaticContact CD2-ND1 3.49Å; W414-H418 AromaticContact CE2-CE1 3.62Å; W414-H418 AromaticContact CE2-CG 3.92Å; W414-H418 AromaticContact CE2-ND1 3.3Å; W414-H418 VanDerWaalsContact CE2-ND1 3.3Å; W414-H418 HydrophobicContact CE3-CB 4.2Å; W414-H418 AromaticContact CG-ND1 3.83Å; W414-H418 HydrophobicContact CH2-CB 3.85Å; W414-H418 AromaticContact CH2-CG 3.96Å; W414-H418 HydrophobicContact CZ2-CB 4.21Å; W414-H418 AromaticContact CZ2-CG 3.79Å; W414-H418 AromaticContact CZ2-ND1 3.66Å; W414-H418 HydrophobicContact CZ3-CB 3.85Å; W414-H418 AromaticContact NE1-CE1 3.44Å; W414-H418 PolarHBondContact NE1-CE1 3.09Å; W414-H418 AromaticContact NE1-ND1 3.56Å; W414-H418 PolarHBondContact O-N 3.1Å; W414-H418 PolarHBondContact O-ND1 3.44Å
415	K	93.7	Very high	93.6	Very high	13 Å²	13	34.1 Å²	34.1	6%	0.057	17%	0.171	C	C	.	.	H	α-helix	trans	-69.1	-34	180	-66.9	-82	-176.6	164.5	0	112.3	V411 Y412 S413 V417 H418 N442 Y443 E447	V411-K415 HydrophobicContact CG1-CG 4.48Å; V411-K415 WeakPolarHBondContact O-CG 3.49Å; V411-K415 PolarHBondContact O-N 2.92Å; V411-K415 VanDerWaalsContact O-N 3.1Å; Y412-K415 PolarHBondContact O-N 3.38Å; Y412-K415 VanDerWaalsContact O-N 3.17Å; S413-K415 PolarHBondContact O-N 2.85Å; K415-V417 VanDerWaalsContact C-N 3.32Å; K415-V417 PolarHBondContact O-N 3.23Å; K415-H418 CarbonylContact O-C 3.58Å; K415-H418 PolarHBondContact O-N 3.44Å; K415-N442 HydrophobicContact CD-CB 4.12Å; K415-N442 WeakPolarHBondContact CD-O 3.29Å; K415-N442 WeakPolarHBondContact CE-O 3.15Å; K415-N442 PolarHBondContact NZ-O 3.48Å; K415-N442 PolarHBondContact O-ND2 2.9Å; K415-Y443 HydrophobicContact CD-CE1 4.41Å; K415-Y443 HydrophobicContact CG-CE1 3.95Å; K415-E447 WeakPolarHBondContact CE-OE1 3.41Å; K415-E447 IonicContact NZ-OE1 3.2Å; K415-E447 PolarHBondContact NZ-OE1 3.49Å; K415-E447 IonicContact NZ-OE2 3.87Å
416	L	95.3	Very high	93.5	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-37.1	176.9	-74.6	-175.6	0	0	0	113.3	D310 Q312 Y412 S413 Y435 A438 T439 F627	D310-L416 HydrophobicContact CB-CD1 4.39Å; Q312-L416 HydrophobicContact CG-CB 3.97Å; Q312-L416 HydrophobicContact CG-CD1 3.94Å; Y412-L416 HydrophobicContact CD1-CD1 4.23Å; Y412-L416 HydrophobicContact CD2-CG 4.27Å; Y412-L416 HydrophobicContact CE1-CD1 3.63Å; Y412-L416 HydrophobicContact CE1-CG 4.33Å; Y412-L416 HydrophobicContact CE2-CD1 3.98Å; Y412-L416 HydrophobicContact CE2-CD2 3.82Å; Y412-L416 HydrophobicContact CE2-CG 3.85Å; Y412-L416 VanDerWaalsContact CZ-CD1 3.49Å; Y412-L416 PolarHBondContact O-N 3.15Å; S413-L416 PolarHBondContact O-N 2.96Å; L416-Y435 HydrophobicContact CD2-CE2 4.08Å; L416-A438 HydrophobicContact CD2-CB 4.16Å; L416-T439 HydrophobicContact CD2-CG2 4.12Å; L416-F627 HydrophobicContact CB-CE2 4.3Å; L416-F627 HydrophobicContact CB-CZ 4.41Å; L416-F627 HydrophobicContact CD1-CE2 4.31Å; L416-F627 HydrophobicContact CD2-CE2 3.84Å; L416-F627 HydrophobicContact CD2-CZ 4.32Å; L416-F627 HydrophobicContact CG-CE2 4.38Å
417	V	93.4	Very high	93.4	Very high	57 Å²	57	49.6 Å²	49.6	35%	0.345	24%	0.244	S	C	.	.	H	α-helix	trans	-90.5	-12	179.3	-55.6	0	0	0	0	113.7	V304 Q312 W414 K415 P419	V304-V417 HydrophobicContact CB-CG2 4.24Å; V304-V417 HydrophobicContact CG1-CG1 4Å; V304-V417 HydrophobicContact CG1-CG2 3.68Å; V304-V417 HydrophobicContact CG2-CG2 3.59Å; Q312-V417 HydrophobicContact CB-CG1 3.59Å; Q312-V417 HydrophobicContact CG-CG1 4.05Å; W414-V417 WeakPolarHBondContact O-CG2 2.94Å; W414-V417 PolarHBondContact O-N 3.39Å; K415-V417 VanDerWaalsContact C-N 3.32Å; K415-V417 PolarHBondContact O-N 3.23Å; V417-P419 WeakPolarHBondContact O-CD 3.41Å
418	H	93	Very high	93.6	Very high	41 Å²	41	47.7 Å²	47.7	19%	0.19	24%	0.235	C	C	.	.	S	Bend	trans	-119.2	68.6	175.3	-58	97.8	0	0	0	110.5	W414 K415 N442	W414-H418 AromaticContact CD1-CE1 3.87Å; W414-H418 AromaticContact CD1-ND1 3.86Å; W414-H418 AromaticContact CD2-ND1 3.49Å; W414-H418 AromaticContact CE2-CE1 3.62Å; W414-H418 AromaticContact CE2-CG 3.92Å; W414-H418 AromaticContact CE2-ND1 3.3Å; W414-H418 VanDerWaalsContact CE2-ND1 3.3Å; W414-H418 HydrophobicContact CE3-CB 4.2Å; W414-H418 AromaticContact CG-ND1 3.83Å; W414-H418 HydrophobicContact CH2-CB 3.85Å; W414-H418 AromaticContact CH2-CG 3.96Å; W414-H418 HydrophobicContact CZ2-CB 4.21Å; W414-H418 AromaticContact CZ2-CG 3.79Å; W414-H418 AromaticContact CZ2-ND1 3.66Å; W414-H418 HydrophobicContact CZ3-CB 3.85Å; W414-H418 AromaticContact NE1-CE1 3.44Å; W414-H418 PolarHBondContact NE1-CE1 3.09Å; W414-H418 AromaticContact NE1-ND1 3.56Å; W414-H418 PolarHBondContact O-N 3.1Å; W414-H418 PolarHBondContact O-ND1 3.44Å; K415-H418 CarbonylContact O-C 3.58Å; K415-H418 PolarHBondContact O-N 3.44Å; H418-N442 PolarHBondContact O-ND2 3.29Å
419	P	93.9	Very high	93.6	Very high	33 Å²	33	50 Å²	50	21%	0.214	25%	0.25	C	S	.	.			trans	-61.5	140.2	176.7	27.1	-34.5	0	0	0	110.5	V417 E434 R437 A438	V417-P419 WeakPolarHBondContact O-CD 3.41Å; P419-E434 HydrophobicContact CB-CG 4.47Å; P419-E434 HydrophobicContact CG-CG 4.21Å; P419-R437 HydrophobicContact CB-CB 3.91Å; P419-A438 HydrophobicContact CB-CB 4.17Å
420	T	93.4	Very high	93.5	Very high	13 Å²	13	54.5 Å²	54.5	8%	0.08	28%	0.275	C	S	.	.			trans	-71.1	172.2	-179.9	-156.2	0	0	0	0	111.9	N425 C428 R437 Y441	T420-N425 HydrophobicContact CG2-CB 4.2Å; T420-C428 HydrophobicContact CG2-CB 4.03Å; T420-R437 PolarHBondContact N-O 3.19Å; T420-R437 WeakPolarHBondContact O-CB 3.36Å; T420-R437 WeakPolarHBondContact O-CD 3.49Å; T420-R437 PolarHBondContact O-NH1 2.73Å; T420-Y441 WeakPolarHBondContact CG2-O 3.17Å
421	D	92.6	Very high	93.4	Very high	55 Å²	55	59.4 Å²	59.4	29%	0.294	31%	0.31	S	S	.	.			trans	-147.8	176.5	178.1	61.1	20.6	0	0	0	110.5	Y423 S424 N425	D421-Y423 HydrophobicContact CB-CD2 4.45Å; D421-Y423 PolarHBondContact O-N 3.14Å; D421-Y423 VanDerWaalsContact O-N 3.14Å; D421-Y423 WeakPolarHBondContact OD1-CB 3.35Å; D421-Y423 PolarHBondContact OD1-N 2.94Å; D421-S424 PolarHBondContact O-N 2.84Å; D421-S424 WeakPolarHBondContact OD1-CB 3.38Å; D421-S424 PolarHBondContact OD1-N 3.1Å; D421-S424 PolarHBondContact OD1-OG 2.62Å; D421-N425 PolarHBondContact O-N 3.22Å
422	K	92.2	Very high	93.5	Very high	82 Å²	82	59.2 Å²	59.2	36%	0.357	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.6	178.1	64.1	170.3	161.8	-156.8	0	114.6	N425 D430	K422-N425 WeakPolarHBondContact CA-O 3.13Å; K422-D430 WeakPolarHBondContact CD-OD1 3.5Å; K422-D430 WeakPolarHBondContact CD-OD2 3.43Å; K422-D430 WeakPolarHBondContact CE-OD1 3.4Å; K422-D430 WeakPolarHBondContact CE-OD2 3.24Å; K422-D430 VanDerWaalsContact CG-OD1 3.27Å; K422-D430 WeakPolarHBondContact CG-OD1 3.32Å; K422-D430 VanDerWaalsContact NZ-CG 3.35Å; K422-D430 IonicContact NZ-OD1 2.85Å; K422-D430 PolarHBondContact NZ-OD1 3.3Å; K422-D430 IonicContact NZ-OD2 2.72Å; K422-D430 PolarHBondContact NZ-OD2 3.13Å
423	Y	90.9	Very high	93.6	Very high	188 Å²	188	60 Å²	60	74%	0.737	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-36.4	-177.5	-56.1	-74.3	0	0	0	110.4	D421	D421-Y423 HydrophobicContact CB-CD2 4.45Å; D421-Y423 PolarHBondContact O-N 3.14Å; D421-Y423 VanDerWaalsContact O-N 3.14Å; D421-Y423 WeakPolarHBondContact OD1-CB 3.35Å; D421-Y423 PolarHBondContact OD1-N 2.94Å
424	S	90	Very high	93.6	Very high	75 Å²	75	64.6 Å²	64.6	52%	0.524	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-37.2	-179.5	-50.1	0	0	0	0	112.2	D421	D421-S424 PolarHBondContact O-N 2.84Å; D421-S424 WeakPolarHBondContact OD1-CB 3.38Å; D421-S424 PolarHBondContact OD1-N 3.1Å; D421-S424 PolarHBondContact OD1-OG 2.62Å
425	N	92.7	Very high	93.8	Very high	41 Å²	41	63.9 Å²	63.9	22%	0.219	33%	0.333	C	S	.	.			trans	-131.1	114.6	176.4	-175.6	-9.4	0	0	0	110.8	T420 D421 K422 D427 C428 Y441	T420-N425 HydrophobicContact CG2-CB 4.2Å; D421-N425 PolarHBondContact O-N 3.22Å; K422-N425 WeakPolarHBondContact CA-O 3.13Å; N425-D427 PolarHBondContact O-N 3.06Å; N425-D427 PolarHBondContact OD1-N 2.95Å; N425-C428 HydrophobicContact CB-CB 4.03Å; N425-C428 VanDerWaalsContact O-CB 3.29Å; N425-C428 WeakPolarHBondContact O-CB 3.18Å; N425-C428 PolarHBondContact O-N 2.89Å; N425-C428 VanDerWaalsContact O-N 3.11Å; N425-Y441 PolarHBondContact ND2-O 3.28Å
426	K	93.3	Very high	93.9	Very high	197 Å²	197	64.4 Å²	64.4	86%	0.857	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-25.5	-177.9	-67.6	176.9	-178.5	159.1	0	113.7	C428	K426-C428 VanDerWaalsContact C-N 3.29Å
427	D	93.7	Very high	94	Very high	129 Å²	129	66.9 Å²	66.9	69%	0.69	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-4	-179.6	-58.5	-38.6	0	0	0	112.2	N425 P429	N425-D427 PolarHBondContact O-N 3.06Å; N425-D427 PolarHBondContact OD1-N 2.95Å; D427-P429 WeakPolarHBondContact O-CD 3.34Å
428	C	95.1	Very high	94.1	Very high	4 Å²	4	64.1 Å²	64.1	3%	0.027	33%	0.328	C	S	.	.	S	Bend	trans	-85.5	115.9	178.1	-176.9	0	0	0	0	111.2	T420 N425 K426 Y441	T420-C428 HydrophobicContact CG2-CB 4.03Å; N425-C428 HydrophobicContact CB-CB 4.03Å; N425-C428 VanDerWaalsContact O-CB 3.29Å; N425-C428 WeakPolarHBondContact O-CB 3.18Å; N425-C428 PolarHBondContact O-N 2.89Å; N425-C428 VanDerWaalsContact O-N 3.11Å; K426-C428 VanDerWaalsContact C-N 3.29Å; C428-Y441 HydrophobicContact CB-CD1 4.47Å; C428-Y441 HydrophobicContact CB-CG 4.26Å
429	P	94.9	Very high	94.3	Very high	50 Å²	50	62.2 Å²	62.2	33%	0.325	32%	0.319	S	S	.	.			trans	-70.7	143.7	176.1	-17	31.7	0	0	0	112.5	D427 S431 A432	D427-P429 WeakPolarHBondContact O-CD 3.34Å; P429-S431 PolarHBondContact O-N 3.15Å; P429-S431 VanDerWaalsContact O-N 3.14Å; P429-A432 HydrophobicContact CB-CB 4.44Å; P429-A432 VanDerWaalsContact O-CB 3.31Å; P429-A432 WeakPolarHBondContact O-CB 3.38Å; P429-A432 PolarHBondContact O-N 2.9Å
430	D	93.3	Very high	94.4	Very high	110 Å²	110	65.2 Å²	65.2	59%	0.588	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.4	171.7	-74.6	-33.9	0	0	0	113.3	K422	K422-D430 WeakPolarHBondContact CD-OD1 3.5Å; K422-D430 WeakPolarHBondContact CD-OD2 3.43Å; K422-D430 WeakPolarHBondContact CE-OD1 3.4Å; K422-D430 WeakPolarHBondContact CE-OD2 3.24Å; K422-D430 VanDerWaalsContact CG-OD1 3.27Å; K422-D430 WeakPolarHBondContact CG-OD1 3.32Å; K422-D430 VanDerWaalsContact NZ-CG 3.35Å; K422-D430 IonicContact NZ-OD1 2.85Å; K422-D430 PolarHBondContact NZ-OD1 3.3Å; K422-D430 IonicContact NZ-OD2 2.72Å; K422-D430 PolarHBondContact NZ-OD2 3.13Å
431	S	93.7	Very high	94.5	Very high	115 Å²	115	66.7 Å²	66.7	80%	0.804	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-6.9	179.5	55.9	0	0	0	0	113.7	P429 E433	P429-S431 PolarHBondContact O-N 3.15Å; P429-S431 VanDerWaalsContact O-N 3.14Å; S431-E433 PolarHBondContact O-N 3.1Å
432	A	95	Very high	94.6	Very high	10 Å²	10	64.7 Å²	64.7	8%	0.083	32%	0.32	C	S	.	.	S	Bend	trans	-65.3	133.4	179.1	0	0	0	0	0	110.5	P429 R437 Y441	P429-A432 HydrophobicContact CB-CB 4.44Å; P429-A432 VanDerWaalsContact O-CB 3.31Å; P429-A432 WeakPolarHBondContact O-CB 3.38Å; P429-A432 PolarHBondContact O-N 2.9Å; A432-R437 HydrophobicContact CB-CG 3.67Å; A432-R437 WeakPolarHBondContact O-CD 3.35Å; A432-R437 PolarHBondContact O-NE 3.43Å; A432-Y441 HydrophobicContact CB-CD2 4.37Å; A432-Y441 HydrophobicContact CB-CE2 4.1Å
433	E	95.7	Very high	94.7	Very high	26 Å²	26	61.4 Å²	61.4	12%	0.121	31%	0.305	C	S	.	.			trans	-68.1	156.9	-179.5	65.2	-173.7	91.7	0	0	111.6	S431 Y435 E436 R437 R634 R635 F638 M642	S431-E433 PolarHBondContact O-N 3.1Å; E433-Y435 VanDerWaalsContact C-N 3.31Å; E433-Y435 PolarHBondContact O-N 3.46Å; E433-E436 HydrophobicContact CG-CB 4.07Å; E433-E436 PolarHBondContact O-N 2.76Å; E433-E436 VanDerWaalsContact O-N 3.09Å; E433-R437 PolarHBondContact O-N 3.43Å; E433-R634 IonicContact OE1-NH2 2.68Å; E433-R634 PolarHBondContact OE1-NH2 3.05Å; E433-R634 IonicContact OE2-CZ 3.41Å; E433-R634 IonicContact OE2-NH2 3.32Å; E433-R634 PolarHBondContact OE2-NH2 3.47Å; E433-R635 IonicContact OE1-CZ 3.68Å; E433-R635 VanDerWaalsContact OE1-CZ 3.3Å; E433-R635 IonicContact OE1-NE 2.79Å; E433-R635 PolarHBondContact OE1-NE 3.36Å; E433-R635 IonicContact OE1-NH2 3.66Å; E433-R635 PolarHBondContact OE1-NH2 3Å; E433-R635 IonicContact OE2-NE 3.49Å; E433-F638 WeakPolarHBondContact OE2-CE1 3.47Å; E433-M642 HydrophobicContact CG-CE 4.05Å; E433-M642 HydrophobicContact CG-SD 4.31Å
434	E	96.1	Very high	94.9	Very high	96 Å²	96	56.3 Å²	56.3	45%	0.449	29%	0.294	S	S	.	.	H	α-helix	trans	-56.6	-42.5	-170.3	-171.8	170.2	-152	0	0	113.2	P419 E436 R437 A438 F627	P419-E434 HydrophobicContact CB-CG 4.47Å; P419-E434 HydrophobicContact CG-CG 4.21Å; E434-E436 PolarHBondContact O-N 2.74Å; E434-R437 CarbonylContact O-C 3.54Å; E434-R437 PolarHBondContact O-N 2.79Å; E434-A438 VanDerWaalsContact O-CB 3.31Å; E434-A438 WeakPolarHBondContact O-CB 3.46Å; E434-A438 PolarHBondContact O-N 3.3Å; E434-F627 HydrophobicContact CG-CE1 4.31Å
435	Y	97.4	Very high	95.2	Very high	3 Å²	3	54.9 Å²	54.9	1%	0.012	28%	0.284	C	S	.	.	H	α-helix	trans	-65.8	-38.7	178.8	-169.3	-116.2	0	0	0	112.7	L416 E433 R437 A438 T439 R624 F627 F638 M642	L416-Y435 HydrophobicContact CD2-CE2 4.08Å; E433-Y435 VanDerWaalsContact C-N 3.31Å; E433-Y435 PolarHBondContact O-N 3.46Å; Y435-R437 VanDerWaalsContact C-N 3.31Å; Y435-R437 PolarHBondContact O-N 3.43Å; Y435-A438 WeakPolarHBondContact O-CB 3.26Å; Y435-A438 PolarHBondContact O-N 3.33Å; Y435-A438 VanDerWaalsContact O-N 3.13Å; Y435-T439 HydrophobicContact CD2-CG2 4.32Å; Y435-T439 HydrophobicContact CE1-CG2 4.28Å; Y435-T439 HydrophobicContact CE2-CG2 3.83Å; Y435-T439 PolarHBondContact O-N 3.32Å; Y435-T439 PolarHBondContact O-OG1 2.9Å; Y435-T439 VanDerWaalsContact O-OG1 3.08Å; Y435-R624 HydrophobicContact CE1-CB 4.3Å; Y435-R624 HydrophobicContact CE2-CB 4.2Å; Y435-R624 WeakPolarHBondContact OH-CD 2.98Å; Y435-F627 HydrophobicContact CD2-CB 3.69Å; Y435-F627 AromaticContact CD2-CD1 3.82Å; Y435-F627 HydrophobicContact CD2-CD1 3.82Å; Y435-F627 AromaticContact CD2-CD2 3.38Å; Y435-F627 HydrophobicContact CD2-CD2 3.38Å; Y435-F627 HydrophobicContact CD2-CE1 4.28Å; Y435-F627 AromaticContact CD2-CE2 3.92Å; Y435-F627 HydrophobicContact CD2-CE2 3.92Å; Y435-F627 AromaticContact CD2-CG 3.33Å; Y435-F627 HydrophobicContact CD2-CG 3.33Å; Y435-F627 HydrophobicContact CD2-CZ 4.33Å; Y435-F627 HydrophobicContact CE2-CB 4.29Å; Y435-F627 AromaticContact CE2-CD2 3.64Å; Y435-F627 HydrophobicContact CE2-CD2 3.64Å; Y435-F627 HydrophobicContact CE2-CE2 4.17Å; Y435-F627 HydrophobicContact CE2-CG 4.02Å; Y435-F627 HydrophobicContact CG-CB 4.05Å; Y435-F627 HydrophobicContact CG-CD1 4.36Å; Y435-F627 HydrophobicContact CG-CD2 4.49Å; Y435-F627 HydrophobicContact CG-CG 4.06Å; Y435-F638 HydrophobicContact CD1-CB 4.25Å; Y435-F638 AromaticContact CD1-CD1 3.84Å; Y435-F638 HydrophobicContact CD1-CD1 3.84Å; Y435-F638 AromaticContact CD1-CD2 3.57Å; Y435-F638 HydrophobicContact CD1-CD2 3.57Å; Y435-F638 HydrophobicContact CD1-CE1 4.02Å; Y435-F638 AromaticContact CD1-CE2 3.74Å; Y435-F638 HydrophobicContact CD1-CE2 3.74Å; Y435-F638 AromaticContact CD1-CG 3.62Å; Y435-F638 HydrophobicContact CD1-CG 3.62Å; Y435-F638 AromaticContact CD1-CZ 3.98Å; Y435-F638 HydrophobicContact CD1-CZ 3.98Å; Y435-F638 HydrophobicContact CE1-CB 4.33Å; Y435-F638 AromaticContact CE1-CD2 3.76Å; Y435-F638 HydrophobicContact CE1-CD2 3.76Å; Y435-F638 HydrophobicContact CE1-CE2 4.2Å; Y435-F638 HydrophobicContact CE1-CG 4.02Å; Y435-F638 HydrophobicContact CG-CD2 4.29Å; Y435-F638 HydrophobicContact CG-CE1 4.24Å; Y435-F638 AromaticContact CG-CE2 3.99Å; Y435-F638 HydrophobicContact CG-CE2 3.99Å; Y435-F638 AromaticContact CG-CZ 3.97Å; Y435-F638 HydrophobicContact CG-CZ 3.97Å; Y435-M642 HydrophobicContact CD1-CB 4.04Å; Y435-M642 HydrophobicContact CD1-SD 4.39Å; Y435-M642 HydrophobicContact CE1-CB 4.11Å
436	E	97.1	Very high	95.3	Very high	23 Å²	23	58.6 Å²	58.6	11%	0.107	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-36.8	175.8	-166.4	175.7	-154.5	0	0	111.9	E433 E434 A438 R440 Y441 M642	E433-E436 HydrophobicContact CG-CB 4.07Å; E433-E436 PolarHBondContact O-N 2.76Å; E433-E436 VanDerWaalsContact O-N 3.09Å; E434-E436 PolarHBondContact O-N 2.74Å; E436-A438 VanDerWaalsContact C-N 3.32Å; E436-R440 HydrophobicContact CG-CB 3.99Å; E436-R440 PolarHBondContact O-N 2.97Å; E436-R440 VanDerWaalsContact O-N 3.14Å; E436-R440 WeakPolarHBondContact OE1-CD 3.48Å; E436-R440 IonicContact OE1-CZ 3.08Å; E436-R440 IonicContact OE1-NH1 3.53Å; E436-R440 PolarHBondContact OE1-NH1 2.87Å; E436-Y441 VanDerWaalsContact CD-CE2 3.5Å; E436-Y441 HydrophobicContact CG-CD2 3.78Å; E436-Y441 HydrophobicContact CG-CE2 3.59Å; E436-Y441 PolarHBondContact O-N 3.12Å; E436-M642 HydrophobicContact CB-CE 3.73Å; E436-M642 HydrophobicContact CB-CG 4.1Å; E436-M642 HydrophobicContact CB-SD 3.78Å; E436-M642 HydrophobicContact CG-CE 3.87Å; E436-M642 HydrophobicContact CG-CG 4Å; E436-M642 HydrophobicContact CG-SD 4.23Å
437	R	96.1	Very high	95.3	Very high	56 Å²	56	50.3 Å²	50.3	21%	0.211	26%	0.264	C	S	.	.	H	α-helix	trans	-72.9	-24.9	173.8	-64.6	-170.9	-66.3	105.5	2	113	P419 T420 A432 E433 E434 Y435 N442	P419-R437 HydrophobicContact CB-CB 3.91Å; T420-R437 PolarHBondContact N-O 3.19Å; T420-R437 WeakPolarHBondContact O-CB 3.36Å; T420-R437 WeakPolarHBondContact O-CD 3.49Å; T420-R437 PolarHBondContact O-NH1 2.73Å; A432-R437 HydrophobicContact CB-CG 3.67Å; A432-R437 WeakPolarHBondContact O-CD 3.35Å; A432-R437 PolarHBondContact O-NE 3.43Å; E433-R437 PolarHBondContact O-N 3.43Å; E434-R437 CarbonylContact O-C 3.54Å; E434-R437 PolarHBondContact O-N 2.79Å; Y435-R437 VanDerWaalsContact C-N 3.31Å; Y435-R437 PolarHBondContact O-N 3.43Å; R437-N442 WeakPolarHBondContact O-CB 3.31Å
438	A	95.8	Very high	95.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-79.5	-33.9	176.4	0	0	0	0	0	112.5	L416 P419 E434 Y435 E436 N442	L416-A438 HydrophobicContact CD2-CB 4.16Å; P419-A438 HydrophobicContact CB-CB 4.17Å; E434-A438 VanDerWaalsContact O-CB 3.31Å; E434-A438 WeakPolarHBondContact O-CB 3.46Å; E434-A438 PolarHBondContact O-N 3.3Å; Y435-A438 WeakPolarHBondContact O-CB 3.26Å; Y435-A438 PolarHBondContact O-N 3.33Å; Y435-A438 VanDerWaalsContact O-N 3.13Å; E436-A438 VanDerWaalsContact C-N 3.32Å; A438-N442 VanDerWaalsContact O-CB 3.24Å; A438-N442 WeakPolarHBondContact O-CB 3.49Å; A438-N442 PolarHBondContact O-ND2 3.33Å
439	T	96.9	Very high	95.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-90.2	179.8	63.2	0	0	0	0	111.7	L416 Y435 Y441 N442 Y443 M642 M644	L416-T439 HydrophobicContact CD2-CG2 4.12Å; Y435-T439 HydrophobicContact CD2-CG2 4.32Å; Y435-T439 HydrophobicContact CE1-CG2 4.28Å; Y435-T439 HydrophobicContact CE2-CG2 3.83Å; Y435-T439 PolarHBondContact O-N 3.32Å; Y435-T439 PolarHBondContact O-OG1 2.9Å; Y435-T439 VanDerWaalsContact O-OG1 3.08Å; T439-Y441 VanDerWaalsContact C-N 3.34Å; T439-Y441 PolarHBondContact O-N 3.04Å; T439-Y441 VanDerWaalsContact O-N 3.12Å; T439-N442 PolarHBondContact O-N 3.37Å; T439-Y443 WeakPolarHBondContact O-CD2 3.36Å; T439-M642 PolarHBondContact OG1-O 3.14Å; T439-M644 HydrophobicContact CG2-CG 4.19Å; T439-M644 HydrophobicContact CG2-SD 3.89Å
440	R	95.9	Very high	95.6	Very high	96 Å²	96	44.2 Å²	44.2	36%	0.362	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-43.8	-51.4	-169	-174.6	-174.1	-179.2	-177	4.8	114.5	E436 E641 I647	E436-R440 HydrophobicContact CG-CB 3.99Å; E436-R440 PolarHBondContact O-N 2.97Å; E436-R440 VanDerWaalsContact O-N 3.14Å; E436-R440 WeakPolarHBondContact OE1-CD 3.48Å; E436-R440 IonicContact OE1-CZ 3.08Å; E436-R440 IonicContact OE1-NH1 3.53Å; E436-R440 PolarHBondContact OE1-NH1 2.87Å; R440-E641 WeakPolarHBondContact CB-O 3.48Å; R440-E641 WeakPolarHBondContact CD-O 3.33Å; R440-E641 WeakPolarHBondContact CG-O 3.42Å; R440-I647 HydrophobicContact CB-CD1 4.18Å
441	Y	95.9	Very high	95.7	Very high	44 Å²	44	39.2 Å²	39.2	17%	0.173	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-86.5	-9.5	-175.6	-66.6	-67.3	0	0	0	113.9	T420 N425 C428 A432 E436 T439	T420-Y441 WeakPolarHBondContact CG2-O 3.17Å; N425-Y441 PolarHBondContact ND2-O 3.28Å; C428-Y441 HydrophobicContact CB-CD1 4.47Å; C428-Y441 HydrophobicContact CB-CG 4.26Å; A432-Y441 HydrophobicContact CB-CD2 4.37Å; A432-Y441 HydrophobicContact CB-CE2 4.1Å; E436-Y441 VanDerWaalsContact CD-CE2 3.5Å; E436-Y441 HydrophobicContact CG-CD2 3.78Å; E436-Y441 HydrophobicContact CG-CE2 3.59Å; E436-Y441 PolarHBondContact O-N 3.12Å; T439-Y441 VanDerWaalsContact C-N 3.34Å; T439-Y441 PolarHBondContact O-N 3.04Å; T439-Y441 VanDerWaalsContact O-N 3.12Å
442	N	95.4	Very high	95.9	Very high	14 Å²	14	33.8 Å²	33.8	8%	0.075	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-89.9	-1.9	-172.7	-142.1	-1.9	0	0	0	113.9	K415 H418 R437 A438 T439	K415-N442 HydrophobicContact CD-CB 4.12Å; K415-N442 WeakPolarHBondContact CD-O 3.29Å; K415-N442 WeakPolarHBondContact CE-O 3.15Å; K415-N442 PolarHBondContact NZ-O 3.48Å; K415-N442 PolarHBondContact O-ND2 2.9Å; H418-N442 PolarHBondContact O-ND2 3.29Å; R437-N442 WeakPolarHBondContact O-CB 3.31Å; A438-N442 VanDerWaalsContact O-CB 3.24Å; A438-N442 WeakPolarHBondContact O-CB 3.49Å; A438-N442 PolarHBondContact O-ND2 3.33Å; T439-N442 PolarHBondContact O-N 3.37Å
443	Y	94.9	Very high	95.9	Very high	12 Å²	12	34 Å²	34	5%	0.047	16%	0.162	C	C	.	.			trans	-120.8	126.1	177.9	-59.4	-86.7	0	0	0	111.5	V411 K415 T439 E447 L451 M644	V411-Y443 HydrophobicContact CG1-CE1 4.27Å; K415-Y443 HydrophobicContact CD-CE1 4.41Å; K415-Y443 HydrophobicContact CG-CE1 3.95Å; T439-Y443 WeakPolarHBondContact O-CD2 3.36Å; Y443-E447 HydrophobicContact CD1-CB 4.25Å; Y443-L451 HydrophobicContact CD1-CD1 3.85Å; Y443-L451 HydrophobicContact CE1-CD1 3.69Å; Y443-M644 HydrophobicContact CD2-CE 4.21Å; Y443-M644 HydrophobicContact CD2-SD 4.42Å; Y443-M644 HydrophobicContact CE2-CE 3.58Å; Y443-M644 HydrophobicContact CE2-SD 3.75Å
444	T	94.1	Very high	95.9	Very high	82 Å²	82	32.8 Å²	32.8	50%	0.503	16%	0.156	S	C	.	.			trans	-68.9	168	167.8	61.6	0	0	0	0	111.3	E446 E447 K448	T444-E446 VanDerWaalsContact C-N 3.32Å; T444-E446 PolarHBondContact O-N 3.45Å; T444-E447 WeakPolarHBondContact CB-OE2 3.46Å; T444-E447 WeakPolarHBondContact CG2-OE2 3.33Å; T444-E447 PolarHBondContact N-OE2 3.4Å; T444-E447 PolarHBondContact O-N 3.49Å; T444-E447 VanDerWaalsContact OG1-CG 3.31Å; T444-E447 WeakPolarHBondContact OG1-CG 3.41Å; T444-E447 PolarHBondContact OG1-N 3.41Å; T444-E447 PolarHBondContact OG1-OE2 3.07Å; T444-K448 WeakPolarHBondContact O-CE 3.3Å; T444-K448 WeakPolarHBondContact O-CG 3.29Å; T444-K448 PolarHBondContact O-N 3.02Å; T444-K448 VanDerWaalsContact O-N 3.16Å
445	S	95.8	Very high	96	Very high	44 Å²	44	28.2 Å²	28.2	31%	0.308	13%	0.134	S	C	.	.	H	α-helix	trans	-56.3	-46.4	175.7	-174.1	0	0	0	0	112.1	K448 F449 H651	S445-K448 PolarHBondContact O-N 3.34Å; S445-F449 VanDerWaalsContact O-CD2 3.31Å; S445-F449 WeakPolarHBondContact O-CD2 3.23Å; S445-F449 WeakPolarHBondContact O-CG 3.42Å; S445-F449 PolarHBondContact O-N 3.39Å; S445-F449 VanDerWaalsContact O-N 3.13Å; S445-F449 VanDerWaalsContact OG-CE2 3.27Å; S445-F449 WeakPolarHBondContact OG-CE2 3.44Å; S445-H651 PolarHBondContact OG-CE1 3.16Å; S445-H651 VanDerWaalsContact OG-CE1 3.25Å; S445-H651 PolarHBondContact OG-NE2 3.45Å
446	E	94.3	Very high	95.8	Very high	119 Å²	119	28.3 Å²	28.3	56%	0.556	14%	0.136	S	C	*	.	H	α-helix	trans	-66.9	-40.3	-178.5	-58.2	-52.1	127.6	0	0	112.5	T444 K448 F449 A450	T444-E446 VanDerWaalsContact C-N 3.32Å; T444-E446 PolarHBondContact O-N 3.45Å; E446-K448 VanDerWaalsContact C-N 3.31Å; E446-K448 PolarHBondContact O-N 3.43Å; E446-F449 PolarHBondContact O-N 3.49Å; E446-A450 VanDerWaalsContact O-CB 3.3Å; E446-A450 WeakPolarHBondContact O-CB 3.5Å; E446-A450 PolarHBondContact O-N 3.32Å
447	E	94.9	Very high	95.7	Very high	24 Å²	24	27.8 Å²	27.8	11%	0.112	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-40.2	175.6	-74.9	168.4	122.8	0	0	111.4	I345 K415 Y443 T444 A450 L451	I345-E447 HydrophobicContact CG2-CB 4.33Å; I345-E447 HydrophobicContact CG2-CG 3.98Å; K415-E447 WeakPolarHBondContact CE-OE1 3.41Å; K415-E447 IonicContact NZ-OE1 3.2Å; K415-E447 PolarHBondContact NZ-OE1 3.49Å; K415-E447 IonicContact NZ-OE2 3.87Å; Y443-E447 HydrophobicContact CD1-CB 4.25Å; T444-E447 WeakPolarHBondContact CB-OE2 3.46Å; T444-E447 WeakPolarHBondContact CG2-OE2 3.33Å; T444-E447 PolarHBondContact N-OE2 3.4Å; T444-E447 PolarHBondContact O-N 3.49Å; T444-E447 VanDerWaalsContact OG1-CG 3.31Å; T444-E447 WeakPolarHBondContact OG1-CG 3.41Å; T444-E447 PolarHBondContact OG1-N 3.41Å; T444-E447 PolarHBondContact OG1-OE2 3.07Å; E447-A450 PolarHBondContact O-N 2.87Å; E447-L451 WeakPolarHBondContact O-CB 3.38Å; E447-L451 VanDerWaalsContact O-CG 3.25Å; E447-L451 WeakPolarHBondContact O-CG 3.14Å; E447-L451 PolarHBondContact O-N 3.47Å
448	K	96.4	Very high	95.7	Very high	33 Å²	33	25.1 Å²	25.1	14%	0.143	12%	0.124	C	C	.	.	H	α-helix	trans	-63.8	-44.6	176.9	-71.6	-177.9	-75.7	178	0	111.8	T444 S445 E446 L451 V452 I647 L648 H651	T444-K448 WeakPolarHBondContact O-CE 3.3Å; T444-K448 WeakPolarHBondContact O-CG 3.29Å; T444-K448 PolarHBondContact O-N 3.02Å; T444-K448 VanDerWaalsContact O-N 3.16Å; S445-K448 PolarHBondContact O-N 3.34Å; E446-K448 VanDerWaalsContact C-N 3.31Å; E446-K448 PolarHBondContact O-N 3.43Å; K448-L451 PolarHBondContact O-N 2.95Å; K448-V452 WeakPolarHBondContact O-CG2 3.5Å; K448-V452 PolarHBondContact O-N 3.36Å; K448-V452 VanDerWaalsContact O-N 3.13Å; K448-I647 HydrophobicContact CD-CG2 3.8Å; K448-L648 HydrophobicContact CB-CD2 4.01Å; K448-L648 HydrophobicContact CG-CD2 4.04Å; K448-H651 HydrophobicContact CD-CB 4.12Å; K448-H651 WeakPolarHBondContact CE-ND1 3.47Å; K448-H651 PolarHBondContact NZ-CE1 2.94Å; K448-H651 PolarHBondContact NZ-ND1 3.16Å
449	F	96.6	Very high	95.5	Very high	16 Å²	16	25.1 Å²	25.1	7%	0.07	12%	0.124	C	C	.	.	H	α-helix	trans	-63.9	-46.7	176.1	-64.2	-40.4	0	0	0	112	S445 E446 L451 V452 E453 H651 I652 T655 E657 M660	S445-F449 VanDerWaalsContact O-CD2 3.31Å; S445-F449 WeakPolarHBondContact O-CD2 3.23Å; S445-F449 WeakPolarHBondContact O-CG 3.42Å; S445-F449 PolarHBondContact O-N 3.39Å; S445-F449 VanDerWaalsContact O-N 3.13Å; S445-F449 VanDerWaalsContact OG-CE2 3.27Å; S445-F449 WeakPolarHBondContact OG-CE2 3.44Å; E446-F449 PolarHBondContact O-N 3.49Å; F449-L451 VanDerWaalsContact C-N 3.32Å; F449-L451 PolarHBondContact O-N 2.98Å; F449-V452 PolarHBondContact O-N 3.46Å; F449-V452 VanDerWaalsContact O-N 3.14Å; F449-E453 PolarHBondContact O-N 2.87Å; F449-H651 AromaticContact CD1-CD2 3.77Å; F449-H651 AromaticContact CE1-CD2 3.31Å; F449-H651 WeakPolarHBondContact CE1-CD2 3.42Å; F449-H651 AromaticContact CE1-NE2 3.51Å; F449-H651 AromaticContact CE2-NE2 3.74Å; 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 3.37Å; F449-I652 HydrophobicContact CD1-CG1 4.3Å; F449-I652 HydrophobicContact CE1-CG1 4.15Å; F449-T655 HydrophobicContact CZ-CG2 4.18Å; F449-T655 WeakPolarHBondContact CZ-OG1 3.4Å; F449-E657 HydrophobicContact CE1-CB 3.88Å; F449-E657 HydrophobicContact CE1-CG 4.12Å; F449-E657 HydrophobicContact CE2-CB 4.45Å; F449-E657 HydrophobicContact CE2-CG 4.2Å; F449-E657 HydrophobicContact CZ-CB 3.66Å; F449-E657 HydrophobicContact CZ-CG 3.86Å; F449-M660 HydrophobicContact CB-CG 4.19Å; F449-M660 HydrophobicContact CB-SD 4.16Å; F449-M660 HydrophobicContact CD1-CB 4.26Å; F449-M660 HydrophobicContact CD1-CG 3.6Å; F449-M660 HydrophobicContact CD1-SD 4.49Å; F449-M660 HydrophobicContact CE1-CB 4.46Å; F449-M660 HydrophobicContact CE1-CG 4.12Å; F449-M660 HydrophobicContact CG-CG 3.99Å
450	A	95.9	Very high	95.1	Very high	5 Å²	5	25.9 Å²	25.9	4%	0.041	13%	0.132	C	C	.	.	H	α-helix	trans	-57.7	-43.5	177.2	0	0	0	0	0	112.1	I345 M349 E446 E447 E453 V454	I345-A450 HydrophobicContact CG1-CB 4.17Å; I345-A450 HydrophobicContact CG2-CB 3.96Å; M349-A450 HydrophobicContact CG-CB 3.75Å; M349-A450 HydrophobicContact SD-CB 3.84Å; E446-A450 VanDerWaalsContact O-CB 3.3Å; E446-A450 WeakPolarHBondContact O-CB 3.5Å; E446-A450 PolarHBondContact O-N 3.32Å; E447-A450 PolarHBondContact O-N 2.87Å; A450-E453 PolarHBondContact O-N 3.4Å; A450-V454 WeakPolarHBondContact O-CG2 3.49Å; A450-V454 PolarHBondContact O-N 3.13Å
451	L	96.4	Very high	94.8	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.026	11%	0.114	C	C	.	.	H	α-helix	trans	-60.8	-46.2	175.6	-73.4	171.9	0	0	0	111.8	V408 Y443 E447 K448 F449 E453 V454 I455 L648	V408-L451 HydrophobicContact CG1-CD2 4.14Å; Y443-L451 HydrophobicContact CD1-CD1 3.85Å; Y443-L451 HydrophobicContact CE1-CD1 3.69Å; E447-L451 WeakPolarHBondContact O-CB 3.38Å; E447-L451 VanDerWaalsContact O-CG 3.25Å; E447-L451 WeakPolarHBondContact O-CG 3.14Å; E447-L451 PolarHBondContact O-N 3.47Å; K448-L451 PolarHBondContact O-N 2.95Å; F449-L451 VanDerWaalsContact C-N 3.32Å; F449-L451 PolarHBondContact O-N 2.98Å; L451-E453 VanDerWaalsContact C-N 3.32Å; L451-E453 PolarHBondContact O-N 3.45Å; L451-V454 PolarHBondContact O-N 3.38Å; L451-I455 WeakPolarHBondContact O-CB 3.22Å; L451-I455 WeakPolarHBondContact O-CD1 3.45Å; L451-I455 WeakPolarHBondContact O-CG1 3.29Å; L451-I455 PolarHBondContact O-N 3.27Å; L451-L648 HydrophobicContact CB-CD2 4.25Å; L451-L648 HydrophobicContact CD1-CD2 4.29Å
452	V	97.1	Very high	94.6	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.006	11%	0.112	C	C	.	.	H	α-helix	trans	-63	-39.2	178.7	174.6	0	0	0	0	111.7	K448 F449 I455 A456 L648 I652	K448-V452 WeakPolarHBondContact O-CG2 3.5Å; K448-V452 PolarHBondContact O-N 3.36Å; K448-V452 VanDerWaalsContact O-N 3.13Å; F449-V452 PolarHBondContact O-N 3.46Å; F449-V452 VanDerWaalsContact O-N 3.14Å; V452-I455 PolarHBondContact O-N 3.22Å; V452-A456 WeakPolarHBondContact O-CB 3.49Å; V452-A456 PolarHBondContact O-N 3.48Å; V452-L648 HydrophobicContact CG2-CB 3.74Å; V452-L648 HydrophobicContact CG2-CD1 4.39Å; V452-L648 HydrophobicContact CG2-CD2 4.21Å; V452-L648 HydrophobicContact CG2-CG 4.32Å; V452-I652 HydrophobicContact CB-CD1 4.3Å; V452-I652 HydrophobicContact CG1-CD1 3.78Å; V452-I652 HydrophobicContact CG2-CD1 4.17Å
453	E	95.1	Very high	94	Very high	15 Å²	15	20.2 Å²	20.2	7%	0.07	11%	0.111	C	C	.	.	H	α-helix	trans	-60	-47.2	174.6	-75.3	-173.3	-136.1	0	0	112.4	M349 R353 F449 A450 L451 I455 A456 M457 M660 Y663	M349-E453 HydrophobicContact CE-CB 3.53Å; M349-E453 HydrophobicContact CE-CG 4.31Å; M349-E453 VanDerWaalsContact CE-OE2 3.26Å; M349-E453 WeakPolarHBondContact CE-OE2 3.15Å; R353-E453 IonicContact CZ-OE1 4Å; R353-E453 IonicContact CZ-OE2 3.97Å; R353-E453 IonicContact NE-OE2 3.73Å; R353-E453 PolarHBondContact NE-OE2 3.47Å; R353-E453 IonicContact NH2-OE1 2.84Å; R353-E453 PolarHBondContact NH2-OE1 2.86Å; R353-E453 IonicContact NH2-OE2 3.01Å; R353-E453 PolarHBondContact NH2-OE2 3.05Å; F449-E453 PolarHBondContact O-N 2.87Å; A450-E453 PolarHBondContact O-N 3.4Å; L451-E453 VanDerWaalsContact C-N 3.32Å; L451-E453 PolarHBondContact O-N 3.45Å; E453-I455 VanDerWaalsContact C-N 3.34Å; E453-I455 PolarHBondContact O-N 3.38Å; E453-A456 PolarHBondContact O-N 3.14Å; E453-M457 HydrophobicContact CB-CE 4.29Å; E453-M457 WeakPolarHBondContact O-CE 3.45Å; E453-M457 WeakPolarHBondContact O-CG 3.44Å; E453-M457 PolarHBondContact O-N 3.45Å; E453-M660 HydrophobicContact CG-CE 3.64Å; E453-M660 HydrophobicContact CG-SD 3.64Å; E453-M660 WeakPolarHBondContact OE1-CE 3.31Å; E453-Y663 HydrophobicContact CG-CD1 4.4Å; E453-Y663 HydrophobicContact CG-CE1 4.26Å
454	V	96.6	Very high	93.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.2	-42.5	178.3	-178.3	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 3.43Å; M349-V454 WeakPolarHBondContact SD-CG2 3.49Å; I352-V454 HydrophobicContact CD1-CG2 3.92Å; I352-V454 HydrophobicContact CG2-CG2 4.39Å; W404-V454 HydrophobicContact CB-CG1 3.89Å; V408-V454 HydrophobicContact CG2-CB 3.99Å; V408-V454 HydrophobicContact CG2-CG1 3.55Å; A450-V454 WeakPolarHBondContact O-CG2 3.49Å; A450-V454 PolarHBondContact O-N 3.13Å; L451-V454 PolarHBondContact O-N 3.38Å; V454-A456 VanDerWaalsContact C-N 3.34Å; V454-A456 PolarHBondContact O-N 3.3Å; V454-M457 HydrophobicContact CG2-CE 4.27Å; V454-M457 PolarHBondContact O-N 3.04Å; V454-I458 HydrophobicContact CG1-CD1 3.9Å; V454-I458 HydrophobicContact CG1-CG1 4.39Å; V454-I458 WeakPolarHBondContact O-CD1 3.48Å; V454-I458 VanDerWaalsContact O-CG1 3.24Å; V454-I458 WeakPolarHBondContact O-CG1 3.37Å; V454-I458 PolarHBondContact O-N 3.41Å
455	I	96.7	Very high	93	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.1	-43.5	177.4	-67.5	168.3	0	0	0	111.1	V408 L451 V452 E453 I458 K459 L618 L621 L648 L670	V408-I455 HydrophobicContact CG1-CD1 4.32Å; V408-I455 HydrophobicContact CG1-CG1 4.25Å; V408-I455 HydrophobicContact CG2-CG1 4.3Å; L451-I455 WeakPolarHBondContact O-CB 3.22Å; L451-I455 WeakPolarHBondContact O-CD1 3.45Å; L451-I455 WeakPolarHBondContact O-CG1 3.29Å; L451-I455 PolarHBondContact O-N 3.27Å; V452-I455 PolarHBondContact O-N 3.22Å; E453-I455 VanDerWaalsContact C-N 3.34Å; E453-I455 PolarHBondContact O-N 3.38Å; I455-I458 PolarHBondContact O-N 2.82Å; I455-K459 HydrophobicContact CG2-CD 4.12Å; I455-K459 WeakPolarHBondContact O-CB 3.38Å; I455-K459 WeakPolarHBondContact O-CG 3.43Å; I455-K459 PolarHBondContact O-N 3.45Å; I455-L618 HydrophobicContact CB-CD1 4.35Å; I455-L618 HydrophobicContact CG1-CD1 3.97Å; I455-L618 HydrophobicContact CG2-CD1 3.97Å; I455-L621 HydrophobicContact CD1-CD1 4.41Å; I455-L648 HydrophobicContact CD1-CD1 3.95Å; I455-L670 HydrophobicContact CD1-CD1 4.1Å; I455-L670 HydrophobicContact CD1-CD2 4.43Å; I455-L670 HydrophobicContact CG2-CD2 4Å; I455-L670 HydrophobicContact CG2-CG 4.48Å
456	A	94.4	Very high	92.4	Very high	5 Å²	5	18 Å²	18	4%	0.041	10%	0.099	C	C	.	.	H	α-helix	trans	-66.8	-38.9	176.2	0	0	0	0	0	112.7	V452 E453 V454 K459 G460 Y663 Y666	V452-A456 WeakPolarHBondContact O-CB 3.49Å; V452-A456 PolarHBondContact O-N 3.48Å; E453-A456 PolarHBondContact O-N 3.14Å; V454-A456 VanDerWaalsContact C-N 3.34Å; V454-A456 PolarHBondContact O-N 3.3Å; A456-K459 PolarHBondContact O-N 3.41Å; A456-G460 WeakPolarHBondContact O-CA 3.26Å; A456-G460 PolarHBondContact O-N 2.69Å; A456-Y663 HydrophobicContact CB-CD1 3.3Å; A456-Y663 HydrophobicContact CB-CE1 3.88Å; A456-Y663 HydrophobicContact CB-CG 4.3Å; A456-Y666 HydrophobicContact CB-CD1 4.43Å; A456-Y666 HydrophobicContact CB-CD2 3.37Å; A456-Y666 HydrophobicContact CB-CE2 3.88Å; A456-Y666 HydrophobicContact CB-CG 3.67Å
457	M	94.6	Very high	91.7	Very high	13 Å²	13	20.6 Å²	20.6	6%	0.064	10%	0.104	C	C	.	.	H	α-helix	trans	-64.5	-40.1	174.7	-74.7	-173.6	-75.6	0	0	111.7	M349 I352 R353 H356 W404 E453 V454 L461	M349-M457 HydrophobicContact CE-CE 3.86Å; I352-M457 HydrophobicContact CB-CE 4.49Å; I352-M457 HydrophobicContact CG2-CE 3.37Å; I352-M457 HydrophobicContact CG2-SD 4.02Å; R353-M457 HydrophobicContact CG-CE 4.36Å; R353-M457 HydrophobicContact CG-SD 4.4Å; H356-M457 HydrophobicContact CB-SD 3.76Å; W404-M457 HydrophobicContact CE3-CB 4.23Å; W404-M457 HydrophobicContact CZ3-CB 4Å; E453-M457 HydrophobicContact CB-CE 4.29Å; E453-M457 WeakPolarHBondContact O-CE 3.45Å; E453-M457 WeakPolarHBondContact O-CG 3.44Å; E453-M457 PolarHBondContact O-N 3.45Å; V454-M457 HydrophobicContact CG2-CE 4.27Å; V454-M457 PolarHBondContact O-N 3.04Å; M457-L461 VanDerWaalsContact O-CB 3.26Å; M457-L461 WeakPolarHBondContact O-CB 3.47Å; M457-L461 PolarHBondContact O-N 3.42Å
458	I	95.7	Very high	91	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.3	-57.1	173.6	-68.5	161.4	0	0	0	110	L401 W404 V408 V454 I455 G460 L461 Q462 C616 L618	L401-I458 HydrophobicContact CD2-CB 4.43Å; L401-I458 HydrophobicContact CD2-CG2 4.17Å; L401-I458 WeakPolarHBondContact CD2-O 3.44Å; W404-I458 HydrophobicContact CB-CD1 3.82Å; W404-I458 HydrophobicContact CB-CG1 3.55Å; W404-I458 HydrophobicContact CE3-CG1 4.03Å; W404-I458 HydrophobicContact CG-CG1 4.49Å; V408-I458 HydrophobicContact CG2-CD1 4.18Å; V454-I458 HydrophobicContact CG1-CD1 3.9Å; V454-I458 HydrophobicContact CG1-CG1 4.39Å; V454-I458 WeakPolarHBondContact O-CD1 3.48Å; V454-I458 VanDerWaalsContact O-CG1 3.24Å; V454-I458 WeakPolarHBondContact O-CG1 3.37Å; V454-I458 PolarHBondContact O-N 3.41Å; I455-I458 PolarHBondContact O-N 2.82Å; I458-G460 PolarHBondContact O-N 2.85Å; I458-L461 PolarHBondContact O-N 3.49Å; I458-Q462 VanDerWaalsContact O-CB 3.29Å; I458-Q462 WeakPolarHBondContact O-CB 3.49Å; I458-Q462 PolarHBondContact O-N 2.72Å; I458-C616 HydrophobicContact CG2-CB 3.89Å; I458-L618 HydrophobicContact CD1-CD1 4.24Å; I458-L618 HydrophobicContact CD1-CD2 4.41Å
459	K	92.3	Very high	90.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66	-39.9	-175.4	-75.5	-177.8	179.1	-68.3	0	112.2	P31 I455 A456 Q462 V463 Y666 D669 D673	P31-K459 HydrophobicContact CB-CB 4.18Å; P31-K459 HydrophobicContact CB-CD 4.41Å; P31-K459 HydrophobicContact CB-CG 4.47Å; P31-K459 HydrophobicContact CG-CD 4.26Å; I455-K459 HydrophobicContact CG2-CD 4.12Å; I455-K459 WeakPolarHBondContact O-CB 3.38Å; I455-K459 WeakPolarHBondContact O-CG 3.43Å; I455-K459 PolarHBondContact O-N 3.45Å; A456-K459 PolarHBondContact O-N 3.41Å; K459-Q462 WeakPolarHBondContact O-CB 3.23Å; K459-Q462 PolarHBondContact O-N 2.83Å; K459-V463 WeakPolarHBondContact O-CG2 3.23Å; K459-V463 PolarHBondContact O-N 2.68Å; K459-V463 VanDerWaalsContact O-N 3.09Å; K459-Y666 HydrophobicContact CB-CD1 3.57Å; K459-Y666 HydrophobicContact CB-CE1 3.95Å; K459-Y666 HydrophobicContact CD-CD1 4.15Å; K459-Y666 HydrophobicContact CG-CD1 4.48Å; K459-D669 HydrophobicContact CD-CB 4.17Å; K459-D669 WeakPolarHBondContact CD-OD2 3.47Å; K459-D669 VanDerWaalsContact CE-OD2 3.22Å; K459-D669 WeakPolarHBondContact CE-OD2 3.49Å; K459-D669 IonicContact NZ-OD2 3.63Å; K459-D669 PolarHBondContact NZ-OD2 2.87Å; K459-D673 IonicContact NZ-OD1 3.64Å; K459-D673 PolarHBondContact NZ-OD1 2.78Å; K459-D673 IonicContact NZ-OD2 2.66Å; K459-D673 PolarHBondContact NZ-OD2 3.07Å
460	G	87.9	Confident	89.7	Confident	16 Å²	16	24.8 Å²	24.8	17%	0.165	14%	0.136	C	C	.	.	H	α-helix	trans	-62.7	-46.6	175.2	0	0	0	0	0	112.5	A456 I458 V463 L464	A456-G460 WeakPolarHBondContact O-CA 3.26Å; A456-G460 PolarHBondContact O-N 2.69Å; I458-G460 PolarHBondContact O-N 2.85Å; G460-V463 WeakPolarHBondContact O-CB 3.47Å; G460-V463 PolarHBondContact O-N 3.41Å; G460-L464 PolarHBondContact O-N 3.43Å
461	L	90.7	Very high	89.1	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-68.8	-35.1	175.9	176.9	59.5	0	0	0	111.9	F359 I360 L363 L400 L401 W404 M457 I458 V463 L464 M465	F359-L461 HydrophobicContact CD1-CD1 4.04Å; F359-L461 HydrophobicContact CD1-CD2 4.04Å; F359-L461 HydrophobicContact CE1-CD1 3.89Å; F359-L461 HydrophobicContact CE1-CD2 4.19Å; I360-L461 HydrophobicContact CD1-CB 4.44Å; I360-L461 HydrophobicContact CD1-CD1 4.32Å; I360-L461 HydrophobicContact CG1-CD1 3.98Å; L363-L461 HydrophobicContact CD2-CD1 3.98Å; L400-L461 HydrophobicContact CD2-CD2 4.2Å; L401-L461 HydrophobicContact CD1-CD2 4.4Å; L401-L461 HydrophobicContact CD1-CG 4.26Å; L401-L461 HydrophobicContact CD2-CB 3.86Å; L401-L461 HydrophobicContact CD2-CD2 3.79Å; L401-L461 HydrophobicContact CD2-CG 3.87Å; L401-L461 HydrophobicContact CG-CD2 3.82Å; L401-L461 HydrophobicContact CG-CG 4.11Å; W404-L461 HydrophobicContact CH2-CD2 3.98Å; W404-L461 HydrophobicContact CZ3-CB 4.26Å; W404-L461 HydrophobicContact CZ3-CD2 3.71Å; M457-L461 VanDerWaalsContact O-CB 3.26Å; M457-L461 WeakPolarHBondContact O-CB 3.47Å; M457-L461 PolarHBondContact O-N 3.42Å; I458-L461 PolarHBondContact O-N 3.49Å; L461-V463 VanDerWaalsContact C-N 3.29Å; L461-V463 PolarHBondContact O-N 2.88Å; L461-L464 HydrophobicContact CD1-CB 4.48Å; L461-L464 PolarHBondContact O-N 3.25Å; L461-L464 VanDerWaalsContact O-N 3.13Å; L461-M465 HydrophobicContact CD1-CG 3.86Å; L461-M465 HydrophobicContact CD1-SD 4.27Å; L461-M465 HydrophobicContact CG-CG 4.05Å; L461-M465 WeakPolarHBondContact O-CB 3.2Å; L461-M465 VanDerWaalsContact O-CG 3.26Å; L461-M465 WeakPolarHBondContact O-CG 3.5Å; L461-M465 PolarHBondContact O-N 3.42Å
462	Q	90.8	Very high	88.8	Confident	28 Å²	28	26 Å²	26	13%	0.131	14%	0.143	C	C	.	.	H	α-helix	trans	-56.9	-41.9	173.5	-172.3	-175	11.8	0	0	111.7	I458 K459 G466 L612 C616	I458-Q462 VanDerWaalsContact O-CB 3.29Å; I458-Q462 WeakPolarHBondContact O-CB 3.49Å; I458-Q462 PolarHBondContact O-N 2.72Å; K459-Q462 WeakPolarHBondContact O-CB 3.23Å; K459-Q462 PolarHBondContact O-N 2.83Å; Q462-G466 PolarHBondContact O-N 2.78Å; Q462-L612 HydrophobicContact CG-CD1 4.29Å; Q462-L612 HydrophobicContact CG-CD2 4.37Å; Q462-L612 HydrophobicContact CG-CG 4.14Å; Q462-C616 HydrophobicContact CG-CB 4.24Å
463	V	83.4	Confident	88.3	Confident	7 Å²	7	27.2 Å²	27.2	4%	0.042	15%	0.149	C	C	.	.	H	α-helix	trans	-58.3	-50.2	173.4	177.9	0	0	0	0	111	E30 P32 K459 G460 L461 M465 G466 R467	E30-V463 WeakPolarHBondContact O-CG2 3.38Å; P32-V463 VanDerWaalsContact CD-CG2 3.44Å; P32-V463 HydrophobicContact CG-CG2 4.26Å; K459-V463 WeakPolarHBondContact O-CG2 3.23Å; K459-V463 PolarHBondContact O-N 2.68Å; K459-V463 VanDerWaalsContact O-N 3.09Å; G460-V463 WeakPolarHBondContact O-CB 3.47Å; G460-V463 PolarHBondContact O-N 3.41Å; L461-V463 VanDerWaalsContact C-N 3.29Å; L461-V463 PolarHBondContact O-N 2.88Å; V463-M465 PolarHBondContact O-N 3.23Å; V463-G466 PolarHBondContact O-N 3.38Å; V463-R467 HydrophobicContact CG1-CG 4.42Å; V463-R467 WeakPolarHBondContact O-CG 3.28Å; V463-R467 PolarHBondContact O-N 3.07Å
464	L	82.2	Confident	87.9	Confident	61 Å²	61	30.4 Å²	30.4	32%	0.319	16%	0.164	S	C	.	.	H	α-helix	trans	-63.9	-43.4	-176.6	-64	178	0	0	0	111.5	I360 L363 G460 L461 R467 M468	I360-L464 HydrophobicContact CD1-CD1 4.06Å; I360-L464 HydrophobicContact CG1-CD1 4.33Å; I360-L464 HydrophobicContact CG2-CD1 3.99Å; L363-L464 HydrophobicContact CD2-CB 4.19Å; G460-L464 PolarHBondContact O-N 3.43Å; L461-L464 HydrophobicContact CD1-CB 4.48Å; L461-L464 PolarHBondContact O-N 3.25Å; L461-L464 VanDerWaalsContact O-N 3.13Å; L464-R467 PolarHBondContact O-N 3.09Å; L464-M468 PolarHBondContact O-N 3.02Å; L464-M468 VanDerWaalsContact O-N 3.17Å
465	M	85.8	Confident	87.6	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.6	-41.1	176.4	-66.8	-63.8	-73.5	0	0	111.4	F359 L363 L401 L461 V463 M468 E469 F472 F608 L612	F359-M465 HydrophobicContact CE1-SD 4.08Å; F359-M465 HydrophobicContact CZ-SD 4.29Å; L363-M465 HydrophobicContact CD2-SD 3.78Å; L401-M465 HydrophobicContact CD1-CG 4.19Å; L461-M465 HydrophobicContact CD1-CG 3.86Å; L461-M465 HydrophobicContact CD1-SD 4.27Å; L461-M465 HydrophobicContact CG-CG 4.05Å; L461-M465 WeakPolarHBondContact O-CB 3.2Å; L461-M465 VanDerWaalsContact O-CG 3.26Å; L461-M465 WeakPolarHBondContact O-CG 3.5Å; L461-M465 PolarHBondContact O-N 3.42Å; V463-M465 PolarHBondContact O-N 3.23Å; M465-M468 CarbonylContact O-C 3.47Å; M465-M468 PolarHBondContact O-N 3.28Å; M465-E469 PolarHBondContact O-N 2.94Å; M465-F472 HydrophobicContact CE-CE2 3.74Å; M465-F472 HydrophobicContact CE-CZ 4.08Å; M465-F472 HydrophobicContact SD-CE2 3.85Å; M465-F472 HydrophobicContact SD-CZ 4.1Å; M465-F608 HydrophobicContact CB-CZ 4.18Å; M465-F608 HydrophobicContact CE-CE2 3.95Å; M465-F608 HydrophobicContact CE-CZ 3.73Å; M465-L612 HydrophobicContact CB-CD1 3.86Å; M465-L612 HydrophobicContact CB-CD2 4.03Å; M465-L612 HydrophobicContact CG-CD1 4.44Å
466	G	82.2	Confident	87.4	Confident	29 Å²	29	30.4 Å²	30.4	30%	0.299	16%	0.164	S	C	.	.	H	α-helix	trans	-64.4	-40.1	175.1	0	0	0	0	0	113	Q462 V463 M468 E469	Q462-G466 PolarHBondContact O-N 2.78Å; V463-G466 PolarHBondContact O-N 3.38Å; G466-M468 PolarHBondContact O-N 2.82Å; G466-E469 WeakPolarHBondContact O-CB 3.07Å; G466-E469 PolarHBondContact O-N 2.82Å; G466-E469 VanDerWaalsContact O-N 3.08Å
467	R	79.3	Confident	87.3	Confident	174 Å²	174	32.9 Å²	32.9	66%	0.657	17%	0.172	S	C	*	.	H	α-helix	trans	-62.9	-31.9	174.3	-72.4	179	-171.8	-171.7	3.9	112.7	C28 V463 L464 E469	C28-R467 PolarHBondContact SG-NH2 3.21Å; V463-R467 HydrophobicContact CG1-CG 4.42Å; V463-R467 WeakPolarHBondContact O-CG 3.28Å; V463-R467 PolarHBondContact O-N 3.07Å; L464-R467 PolarHBondContact O-N 3.09Å; R467-E469 VanDerWaalsContact C-N 3.32Å
468	M	80.9	Confident	87.2	Confident	8 Å²	8	32.4 Å²	32.4	4%	0.039	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-0.1	176.7	-67.4	-125.3	74.3	0	0	113.4	L363 E370 L464 M465 G466 S470 V471 F472	L363-M468 HydrophobicContact CD1-CG 4.47Å; L363-M468 HydrophobicContact CD1-SD 3.83Å; E370-M468 HydrophobicContact CG-CE 4.22Å; L464-M468 PolarHBondContact O-N 3.02Å; L464-M468 VanDerWaalsContact O-N 3.17Å; M465-M468 CarbonylContact O-C 3.47Å; M465-M468 PolarHBondContact O-N 3.28Å; G466-M468 PolarHBondContact O-N 2.82Å; M468-S470 VanDerWaalsContact C-N 3.31Å; M468-S470 PolarHBondContact O-N 3.35Å; M468-V471 HydrophobicContact CE-CB 3.99Å; M468-V471 HydrophobicContact CE-CG1 4.1Å; M468-V471 HydrophobicContact CE-CG2 4.02Å; M468-V471 PolarHBondContact O-N 3.39Å; 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 3.94Å; M468-F472 HydrophobicContact CG-CE2 4.38Å; M468-F472 WeakPolarHBondContact O-CD2 3.31Å; M468-F472 PolarHBondContact O-N 3.24Å
469	E	84.6	Confident	87.2	Confident	55 Å²	55	32.9 Å²	32.9	26%	0.257	17%	0.173	S	C	.	.	H	α-helix	trans	-52	-46.6	-172.9	174.8	174.5	168.4	0	0	112.2	M465 G466 R467 V471 F472 N473 F608 S609	M465-E469 PolarHBondContact O-N 2.94Å; G466-E469 WeakPolarHBondContact O-CB 3.07Å; G466-E469 PolarHBondContact O-N 2.82Å; G466-E469 VanDerWaalsContact O-N 3.08Å; R467-E469 VanDerWaalsContact C-N 3.32Å; E469-V471 VanDerWaalsContact C-N 3.31Å; E469-V471 PolarHBondContact O-N 2.75Å; E469-F472 PolarHBondContact O-N 3.34Å; E469-N473 VanDerWaalsContact CG-ND2 3.26Å; E469-N473 WeakPolarHBondContact CG-ND2 3.25Å; E469-N473 WeakPolarHBondContact O-CB 3.39Å; E469-N473 PolarHBondContact O-N 2.83Å; E469-N473 PolarHBondContact O-ND2 3.42Å; E469-N473 PolarHBondContact OE1-ND2 3.18Å; E469-F608 HydrophobicContact CB-CD1 4.37Å; E469-F608 HydrophobicContact CB-CE1 4.4Å; E469-F608 HydrophobicContact CG-CD1 4.09Å; E469-S609 VanDerWaalsContact OE1-CB 3.3Å; E469-S609 WeakPolarHBondContact OE1-CB 3.32Å; E469-S609 PolarHBondContact OE1-OG 3.49Å; E469-S609 PolarHBondContact OE2-OG 2.94Å; E469-S609 VanDerWaalsContact OE2-OG 3.05Å
470	S	81.1	Confident	87.4	Confident	99 Å²	99	32.9 Å²	32.9	69%	0.692	17%	0.173	S	C	*	.	H	α-helix	trans	-61	-39.8	-179.4	-173.5	0	0	0	0	112.7	M468 H474	M468-S470 VanDerWaalsContact C-N 3.31Å; M468-S470 PolarHBondContact O-N 3.35Å; S470-H474 PolarHBondContact O-N 3.11Å
471	V	84.1	Confident	87.8	Confident	35 Å²	35	32.7 Å²	32.7	21%	0.212	17%	0.167	C	C	.	.	H	α-helix	trans	-71.4	-45.1	-179.8	176.5	0	0	0	0	109.9	E370 L390 M468 E469 H474 A475	E370-V471 HydrophobicContact CG-CG1 4.27Å; E370-V471 HydrophobicContact CG-CG2 4.3Å; L390-V471 HydrophobicContact CD1-CG1 3.88Å; L390-V471 HydrophobicContact CD2-CG1 4.4Å; M468-V471 HydrophobicContact CE-CB 3.99Å; M468-V471 HydrophobicContact CE-CG1 4.1Å; M468-V471 HydrophobicContact CE-CG2 4.02Å; M468-V471 PolarHBondContact O-N 3.39Å; E469-V471 VanDerWaalsContact C-N 3.31Å; E469-V471 PolarHBondContact O-N 2.75Å; V471-H474 PolarHBondContact O-N 3.16Å; V471-A475 WeakPolarHBondContact O-CB 3.39Å; V471-A475 PolarHBondContact O-N 3Å
472	F	88.9	Confident	88.1	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.6	-46.1	175.2	-70.7	-40.7	0	0	0	111.5	L363 L393 A394 M465 M468 E469 H474 A475 I476 F608	L363-F472 HydrophobicContact CD1-CZ 3.72Å; 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 4.39Å; A394-F472 HydrophobicContact CB-CE1 4.02Å; A394-F472 HydrophobicContact CB-CG 3.91Å; A394-F472 HydrophobicContact CB-CZ 4.47Å; M465-F472 HydrophobicContact CE-CE2 3.74Å; M465-F472 HydrophobicContact CE-CZ 4.08Å; M465-F472 HydrophobicContact SD-CE2 3.85Å; M465-F472 HydrophobicContact SD-CZ 4.1Å; 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 3.94Å; M468-F472 HydrophobicContact CG-CE2 4.38Å; M468-F472 WeakPolarHBondContact O-CD2 3.31Å; M468-F472 PolarHBondContact O-N 3.24Å; E469-F472 PolarHBondContact O-N 3.34Å; F472-H474 VanDerWaalsContact C-N 3.31Å; F472-H474 PolarHBondContact O-N 2.71Å; F472-A475 PolarHBondContact O-N 3.48Å; F472-I476 HydrophobicContact CB-CD1 4.03Å; F472-I476 VanDerWaalsContact O-CB 3.24Å; F472-I476 WeakPolarHBondContact O-CB 3.36Å; F472-I476 WeakPolarHBondContact O-CD1 3.17Å; F472-I476 WeakPolarHBondContact O-CG1 3.49Å; F472-I476 PolarHBondContact O-N 3Å; F472-F608 AromaticContact CD2-CE1 3.98Å; F472-F608 HydrophobicContact CD2-CE1 3.98Å; F472-F608 HydrophobicContact CD2-CE2 4.1Å; F472-F608 AromaticContact CD2-CZ 3.61Å; F472-F608 HydrophobicContact CD2-CZ 3.61Å; F472-F608 HydrophobicContact CE2-CZ 4.03Å; F472-F608 HydrophobicContact CG-CZ 4.49Å
473	N	86.6	Confident	88.3	Confident	26 Å²	26	32.9 Å²	32.9	14%	0.139	17%	0.173	C	C	.	.	H	α-helix	trans	-54.8	-46.3	179.8	-94.4	-34	0	0	0	112.3	E469 R477	E469-N473 VanDerWaalsContact CG-ND2 3.26Å; E469-N473 WeakPolarHBondContact CG-ND2 3.25Å; E469-N473 WeakPolarHBondContact O-CB 3.39Å; E469-N473 PolarHBondContact O-N 2.83Å; E469-N473 PolarHBondContact O-ND2 3.42Å; E469-N473 PolarHBondContact OE1-ND2 3.18Å; N473-R477 WeakPolarHBondContact O-CB 3.17Å; N473-R477 WeakPolarHBondContact O-CD 3.46Å; N473-R477 VanDerWaalsContact O-CG 3.24Å; N473-R477 WeakPolarHBondContact O-CG 3.32Å; N473-R477 PolarHBondContact O-N 3.05Å; N473-R477 PolarHBondContact O-NH1 2.82Å; N473-R477 PolarHBondContact OD1-NH1 3.36Å
474	H	86.3	Confident	89	Confident	82 Å²	82	32.9 Å²	32.9	38%	0.38	17%	0.173	S	C	.	.	H	α-helix	trans	-68.1	-48.2	178.1	-178.5	78.9	0	0	0	112	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 3.46Å; Y387-H474 AromaticContact CE1-NE2 3.75Å; Y387-H474 AromaticContact CZ-CD2 3.87Å; Y387-H474 AromaticContact CZ-NE2 3.61Å; Y387-H474 PolarHBondContact OH-NE2 2.85Å; Y387-H474 VanDerWaalsContact OH-NE2 3.14Å; S470-H474 PolarHBondContact O-N 3.11Å; V471-H474 PolarHBondContact O-N 3.16Å; F472-H474 VanDerWaalsContact C-N 3.31Å; F472-H474 PolarHBondContact O-N 2.71Å; H474-I476 PolarHBondContact O-N 3.48Å; H474-R477 PolarHBondContact O-N 3.48Å; H474-H478 PolarHBondContact O-N 3.33Å; H474-A551 WeakPolarHBondContact CE1-CB 3.43Å; H474-A551 WeakPolarHBondContact ND1-CB 3.21Å
475	A	90.2	Very high	89.7	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.7	-43.9	-179.8	0	0	0	0	0	112.5	Y387 L390 V471 F472 H478 T479	Y387-A475 HydrophobicContact CD1-CB 3.75Å; L390-A475 HydrophobicContact CB-CB 3.63Å; L390-A475 HydrophobicContact CD1-CB 3.97Å; L390-A475 HydrophobicContact CG-CB 4.47Å; V471-A475 WeakPolarHBondContact O-CB 3.39Å; V471-A475 PolarHBondContact O-N 3Å; F472-A475 PolarHBondContact O-N 3.48Å; A475-H478 PolarHBondContact O-N 3.43Å; A475-T479 WeakPolarHBondContact O-CB 3.47Å; A475-T479 PolarHBondContact O-N 2.84Å; A475-T479 PolarHBondContact O-OG1 3.13Å; A475-T479 VanDerWaalsContact O-OG1 3.11Å
476	I	93	Very high	90.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-50	178.7	-69.9	162.6	0	0	0	110.4	F391 A394 F472 H474 H478 T479 V480 L605 I606 F608	F391-I476 HydrophobicContact CB-CG1 4.46Å; F391-I476 HydrophobicContact CD2-CB 4.26Å; F391-I476 HydrophobicContact CD2-CG1 3.99Å; F391-I476 HydrophobicContact CD2-CG2 4.13Å; F391-I476 HydrophobicContact CE2-CG2 4.39Å; A394-I476 HydrophobicContact CB-CD1 3.86Å; A394-I476 HydrophobicContact CB-CG1 4.41Å; F472-I476 HydrophobicContact CB-CD1 4.03Å; F472-I476 VanDerWaalsContact O-CB 3.24Å; F472-I476 WeakPolarHBondContact O-CB 3.36Å; F472-I476 WeakPolarHBondContact O-CD1 3.17Å; F472-I476 WeakPolarHBondContact O-CG1 3.49Å; F472-I476 PolarHBondContact O-N 3Å; H474-I476 PolarHBondContact O-N 3.48Å; I476-H478 VanDerWaalsContact C-N 3.3Å; I476-H478 PolarHBondContact O-N 3.37Å; I476-T479 PolarHBondContact O-N 2.91Å; I476-V480 HydrophobicContact CG2-CG2 4.13Å; I476-V480 WeakPolarHBondContact O-CB 3.26Å; I476-V480 VanDerWaalsContact O-CG2 3.25Å; I476-V480 WeakPolarHBondContact O-CG2 3.38Å; I476-V480 PolarHBondContact O-N 3.41Å; I476-L605 HydrophobicContact CD1-CB 4.11Å; I476-L605 HydrophobicContact CD1-CD2 4.25Å; I476-L605 WeakPolarHBondContact CD1-O 3.16Å; I476-L605 HydrophobicContact CG1-CB 4.42Å; I476-L605 HydrophobicContact CG2-CB 3.71Å; I476-I606 HydrophobicContact CG2-CD1 4.04Å; I476-I606 HydrophobicContact CG2-CG1 4.46Å; I476-F608 HydrophobicContact CD1-CD2 4.27Å
477	R	92.3	Very high	90.9	Very high	57 Å²	57	31.9 Å²	31.9	22%	0.215	16%	0.161	C	C	.	.	H	α-helix	trans	-59.3	-42.6	179.6	-74.4	172.1	-177.9	72.2	-3.5	111.4	N473 H474 Y481 A551 I606	N473-R477 WeakPolarHBondContact O-CB 3.17Å; N473-R477 WeakPolarHBondContact O-CD 3.46Å; N473-R477 VanDerWaalsContact O-CG 3.24Å; N473-R477 WeakPolarHBondContact O-CG 3.32Å; N473-R477 PolarHBondContact O-N 3.05Å; N473-R477 PolarHBondContact O-NH1 2.82Å; N473-R477 PolarHBondContact OD1-NH1 3.36Å; H474-R477 PolarHBondContact O-N 3.48Å; R477-Y481 VanDerWaalsContact O-CB 3.29Å; R477-Y481 WeakPolarHBondContact O-CB 3.28Å; R477-Y481 PolarHBondContact O-N 3.11Å; R477-A551 WeakPolarHBondContact CB-O 3.38Å; R477-I606 HydrophobicContact CG-CD1 3.81Å
478	H	93.3	Very high	91.7	Very high	3 Å²	3	23.6 Å²	23.6	1%	0.014	13%	0.129	C	C	.	.	H	α-helix	trans	-62.4	-50.1	175.9	-175.6	104.3	0	0	0	112.2	D384 Y387 H474 A475 I476 Y481 A482 R550	D384-H478 IonicContact OD1-CD2 3.95Å; D384-H478 IonicContact OD1-CE1 2.7Å; D384-H478 IonicContact OD1-NE2 3.92Å; D384-H478 PolarHBondContact OD1-NE2 2.68Å; Y387-H478 HydrophobicContact CD2-CB 4.23Å; Y387-H478 AromaticContact CD2-CD2 3.34Å; Y387-H478 WeakPolarHBondContact CD2-CD2 3.43Å; Y387-H478 AromaticContact CD2-CE1 3.78Å; Y387-H478 AromaticContact CD2-CG 3.57Å; Y387-H478 AromaticContact CD2-ND1 3.87Å; Y387-H478 AromaticContact CD2-NE2 3.49Å; Y387-H478 WeakPolarHBondContact CD2-NE2 3.42Å; Y387-H478 AromaticContact CE2-CE1 3.74Å; Y387-H478 AromaticContact CE2-CG 3.89Å; Y387-H478 AromaticContact CE2-ND1 3.74Å; Y387-H478 AromaticContact CE2-NE2 3.94Å; Y387-H478 HydrophobicContact CG-CB 4.28Å; Y387-H478 AromaticContact CG-CD2 3.91Å; H474-H478 PolarHBondContact O-N 3.33Å; A475-H478 PolarHBondContact O-N 3.43Å; I476-H478 VanDerWaalsContact C-N 3.3Å; I476-H478 PolarHBondContact O-N 3.37Å; H478-Y481 PolarHBondContact O-N 2.86Å; H478-A482 VanDerWaalsContact O-CB 3.29Å; H478-A482 WeakPolarHBondContact O-CB 3.4Å; H478-A482 PolarHBondContact O-N 2.81Å; H478-R550 WeakPolarHBondContact CA-O 3.32Å
479	T	96.3	Very high	92.3	Very high	10 Å²	10	23.3 Å²	23.3	6%	0.061	13%	0.128	C	C	.	.	H	α-helix	trans	-63.7	-42.8	-179.5	-63.3	0	0	0	0	112.2	Y387 R388 F391 A475 I476 A482 A483	Y387-T479 PolarHBondContact O-OG1 3.01Å; R388-T479 HydrophobicContact CB-CG2 4.43Å; R388-T479 PolarHBondContact N-OG1 3.33Å; F391-T479 HydrophobicContact CB-CG2 4.1Å; F391-T479 HydrophobicContact CD1-CG2 4.34Å; F391-T479 HydrophobicContact CD2-CG2 4.02Å; F391-T479 HydrophobicContact CG-CG2 3.91Å; A475-T479 WeakPolarHBondContact O-CB 3.47Å; A475-T479 PolarHBondContact O-N 2.84Å; A475-T479 PolarHBondContact O-OG1 3.13Å; A475-T479 VanDerWaalsContact O-OG1 3.11Å; I476-T479 PolarHBondContact O-N 2.91Å; T479-A482 PolarHBondContact O-N 2.9Å; T479-A483 VanDerWaalsContact O-CB 3.32Å; T479-A483 WeakPolarHBondContact O-CB 3.45Å; T479-A483 PolarHBondContact O-N 2.51Å
480	V	96.6	Very high	92.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64	-44.7	178.2	170.5	0	0	0	0	110.6	F391 I476 L484 P554 Y602	F391-V480 HydrophobicContact CD2-CG2 4.48Å; F391-V480 HydrophobicContact CE2-CG2 3.92Å; I476-V480 HydrophobicContact CG2-CG2 4.13Å; I476-V480 WeakPolarHBondContact O-CB 3.26Å; I476-V480 VanDerWaalsContact O-CG2 3.25Å; I476-V480 WeakPolarHBondContact O-CG2 3.38Å; I476-V480 PolarHBondContact O-N 3.41Å; V480-L484 VanDerWaalsContact O-CB 3.3Å; V480-L484 WeakPolarHBondContact O-CB 3.03Å; V480-L484 PolarHBondContact O-N 2.61Å; V480-P554 VanDerWaalsContact CG1-CD 3.47Å; V480-P554 HydrophobicContact CG1-CG 4.24Å; V480-Y602 HydrophobicContact CB-CD2 4.41Å; V480-Y602 HydrophobicContact CG1-CD2 3.66Å; V480-Y602 HydrophobicContact CG1-CE2 4.07Å; V480-Y602 HydrophobicContact CG1-CG 4.1Å; V480-Y602 HydrophobicContact CG2-CD1 3.87Å; V480-Y602 HydrophobicContact CG2-CD2 4.11Å; V480-Y602 HydrophobicContact CG2-CE1 4.19Å; V480-Y602 HydrophobicContact CG2-CE2 4.4Å; V480-Y602 HydrophobicContact CG2-CG 3.83Å
481	Y	96	Very high	93.5	Very high	13 Å²	13	21.3 Å²	21.3	5%	0.051	12%	0.115	C	C	.	.	H	α-helix	trans	-60.3	-51.1	175.4	-175.8	-91.7	0	0	0	111.7	R477 H478 A483 L484 Q485 D520 P548 R550 V552	R477-Y481 VanDerWaalsContact O-CB 3.29Å; R477-Y481 WeakPolarHBondContact O-CB 3.28Å; R477-Y481 PolarHBondContact O-N 3.11Å; H478-Y481 PolarHBondContact O-N 2.86Å; Y481-A483 PolarHBondContact O-N 2.88Å; Y481-L484 PolarHBondContact O-N 2.86Å; Y481-Q485 HydrophobicContact CD1-CG 3.92Å; Y481-Q485 HydrophobicContact CD2-CG 4.29Å; Y481-Q485 HydrophobicContact CE1-CB 4.43Å; Y481-Q485 HydrophobicContact CE1-CG 3.51Å; Y481-Q485 HydrophobicContact CE2-CG 3.92Å; Y481-Q485 HydrophobicContact CG-CG 4.29Å; Y481-Q485 WeakPolarHBondContact O-CG 3.16Å; Y481-Q485 PolarHBondContact O-N 2.82Å; Y481-D520 WeakPolarHBondContact OH-CB 3.42Å; Y481-D520 PolarHBondContact OH-OD2 3.49Å; Y481-P548 HydrophobicContact CE1-CB 4.32Å; Y481-P548 HydrophobicContact CE1-CG 4.32Å; Y481-P548 WeakPolarHBondContact CE1-O 3.32Å; Y481-P548 WeakPolarHBondContact OH-CG 3.46Å; Y481-R550 WeakPolarHBondContact CB-O 3.37Å; Y481-R550 HydrophobicContact CD1-CB 3.95Å; Y481-R550 VanDerWaalsContact CD1-N 3.34Å; Y481-R550 HydrophobicContact CD2-CB 4.06Å; Y481-R550 HydrophobicContact CE1-CB 3.82Å; Y481-R550 HydrophobicContact CE1-CG 3.88Å; Y481-R550 HydrophobicContact CE2-CB 3.93Å; Y481-R550 HydrophobicContact CE2-CG 4.13Å; Y481-R550 HydrophobicContact CG-CB 4.06Å; Y481-V552 WeakPolarHBondContact CB-O 3.37Å; Y481-V552 HydrophobicContact CD2-CG1 4.33Å; Y481-V552 WeakPolarHBondContact CD2-O 3.39Å
482	A	95.8	Very high	94	Very high	7 Å²	7	19.7 Å²	19.7	6%	0.058	11%	0.105	C	C	.	.	H	α-helix	trans	-56.9	-50.2	-179.5	0	0	0	0	0	111.3	H478 T479 L484 Q485 D486 R549	H478-A482 VanDerWaalsContact O-CB 3.29Å; H478-A482 WeakPolarHBondContact O-CB 3.4Å; H478-A482 PolarHBondContact O-N 2.81Å; T479-A482 PolarHBondContact O-N 2.9Å; A482-L484 VanDerWaalsContact C-N 3.35Å; A482-L484 PolarHBondContact O-N 2.79Å; A482-Q485 PolarHBondContact O-N 3.29Å; A482-D486 VanDerWaalsContact O-CB 3.27Å; A482-D486 WeakPolarHBondContact O-CB 3.32Å; A482-D486 PolarHBondContact O-N 3.12Å; A482-R549 VanDerWaalsContact CB-CZ 3.49Å
483	A	96.6	Very high	94.3	Very high	25 Å²	25	20.8 Å²	20.8	21%	0.207	11%	0.109	C	C	.	.	H	α-helix	trans	-61.1	-41.6	178.3	0	0	0	0	0	112.5	T479 Y481 F487 F595	T479-A483 VanDerWaalsContact O-CB 3.32Å; T479-A483 WeakPolarHBondContact O-CB 3.45Å; T479-A483 PolarHBondContact O-N 2.51Å; Y481-A483 PolarHBondContact O-N 2.88Å; A483-F487 WeakPolarHBondContact O-CB 3.47Å; A483-F487 PolarHBondContact O-N 3.11Å; A483-F487 VanDerWaalsContact O-N 3.08Å; A483-F595 HydrophobicContact CB-CE2 4.4Å
484	L	96.8	Very high	94.6	Very high	6 Å²	6	23.2 Å²	23.2	3%	0.031	12%	0.12	C	C	.	.	H	α-helix	trans	-67.2	-43.9	179.1	-179.4	65	0	0	0	112.2	V480 Y481 A482 S488 V518 P554 V562 F595	V480-L484 VanDerWaalsContact O-CB 3.3Å; V480-L484 WeakPolarHBondContact O-CB 3.03Å; V480-L484 PolarHBondContact O-N 2.61Å; Y481-L484 PolarHBondContact O-N 2.86Å; A482-L484 VanDerWaalsContact C-N 3.35Å; A482-L484 PolarHBondContact O-N 2.79Å; L484-S488 VanDerWaalsContact O-CB 3.3Å; L484-S488 WeakPolarHBondContact O-CB 3.38Å; L484-S488 PolarHBondContact O-N 2.84Å; L484-S488 PolarHBondContact O-OG 3.28Å; L484-V518 HydrophobicContact CD1-CG2 4.1Å; L484-V518 HydrophobicContact CD2-CB 4.14Å; L484-V518 HydrophobicContact CD2-CG1 4.31Å; L484-V518 HydrophobicContact CG-CB 4.38Å; L484-V518 HydrophobicContact CG-CG2 4.27Å; L484-P554 HydrophobicContact CD2-CB 3.72Å; L484-P554 HydrophobicContact CD2-CG 3.94Å; L484-V562 HydrophobicContact CD1-CG1 4.3Å; L484-F595 HydrophobicContact CB-CZ 4.4Å; L484-F595 HydrophobicContact CD1-CE1 4.32Å; L484-F595 HydrophobicContact CD1-CZ 3.69Å
485	Q	96.6	Very high	94.9	Very high	5 Å²	5	19.6 Å²	19.6	2%	0.023	10%	0.104	C	C	.	.	H	α-helix	trans	-73.1	-42.3	-179.3	-63.8	-53.7	-38.1	0	0	111.9	Y481 A482 F487 S488 Q489 V518 V547	Y481-Q485 HydrophobicContact CD1-CG 3.92Å; Y481-Q485 HydrophobicContact CD2-CG 4.29Å; Y481-Q485 HydrophobicContact CE1-CB 4.43Å; Y481-Q485 HydrophobicContact CE1-CG 3.51Å; Y481-Q485 HydrophobicContact CE2-CG 3.92Å; Y481-Q485 HydrophobicContact CG-CG 4.29Å; Y481-Q485 WeakPolarHBondContact O-CG 3.16Å; Y481-Q485 PolarHBondContact O-N 2.82Å; A482-Q485 PolarHBondContact O-N 3.29Å; Q485-F487 VanDerWaalsContact C-N 3.29Å; Q485-F487 PolarHBondContact O-N 2.85Å; Q485-S488 PolarHBondContact O-N 3.12Å; Q485-S488 PolarHBondContact O-OG 3.29Å; Q485-Q489 VanDerWaalsContact O-CB 3.23Å; Q485-Q489 WeakPolarHBondContact O-CB 3.14Å; Q485-Q489 WeakPolarHBondContact O-CG 3.03Å; Q485-Q489 PolarHBondContact O-N 2.71Å; Q485-V518 PolarHBondContact NE2-O 3.49Å; Q485-V518 PolarHBondContact OE1-O 2.96Å; Q485-V547 HydrophobicContact CB-CG1 3.35Å; Q485-V547 HydrophobicContact CG-CG1 4.44Å
486	D	96.3	Very high	95	Very high	54 Å²	54	19.6 Å²	19.6	29%	0.289	10%	0.104	S	C	.	.	I	π-helix	trans	-60.5	-43.5	176.1	-68.1	-8.1	0	0	0	110.5	A482 V490 T491 V547 R549	A482-D486 VanDerWaalsContact O-CB 3.27Å; A482-D486 WeakPolarHBondContact O-CB 3.32Å; A482-D486 PolarHBondContact O-N 3.12Å; D486-V490 WeakPolarHBondContact O-CA 3.11Å; D486-V490 WeakPolarHBondContact O-CB 3.34Å; D486-V490 PolarHBondContact O-N 2.83Å; D486-V490 VanDerWaalsContact O-N 3.08Å; D486-T491 PolarHBondContact O-N 2.61Å; D486-T491 PolarHBondContact O-OG1 2.9Å; D486-V547 WeakPolarHBondContact OD1-CG1 3.22Å; D486-R549 VanDerWaalsContact CG-NH2 3.3Å; D486-R549 IonicContact OD1-CZ 2.93Å; D486-R549 IonicContact OD1-NH1 2.74Å; D486-R549 PolarHBondContact OD1-NH1 3Å; D486-R549 IonicContact OD1-NH2 3.7Å; D486-R549 PolarHBondContact OD1-NH2 3.24Å; D486-R549 VanDerWaalsContact OD1-NH2 3.07Å; D486-R549 IonicContact OD2-CZ 3.85Å; D486-R549 IonicContact OD2-NH1 3.57Å; D486-R549 IonicContact OD2-NH2 2.77Å; D486-R549 PolarHBondContact OD2-NH2 2.89Å
487	F	97.3	Very high	95.1	Very high	11 Å²	11	20.3 Å²	20.3	5%	0.048	11%	0.106	C	C	.	.	I	π-helix	trans	-63.6	-51.5	176.9	-178.5	-99	0	0	0	112.1	A483 Q485 T491 L492 L566 I592 F595	A483-F487 WeakPolarHBondContact O-CB 3.47Å; A483-F487 PolarHBondContact O-N 3.11Å; A483-F487 VanDerWaalsContact O-N 3.08Å; Q485-F487 VanDerWaalsContact C-N 3.29Å; Q485-F487 PolarHBondContact O-N 2.85Å; F487-T491 HydrophobicContact CD2-CG2 3.97Å; F487-T491 HydrophobicContact CE2-CG2 4.17Å; F487-T491 WeakPolarHBondContact O-CB 3.15Å; F487-T491 PolarHBondContact O-N 3.5Å; F487-L492 HydrophobicContact CD1-CD1 4.34Å; F487-L492 HydrophobicContact CD1-CG 4.19Å; F487-L492 HydrophobicContact CE1-CD1 3.94Å; F487-L492 HydrophobicContact CE1-CD2 3.74Å; F487-L492 HydrophobicContact CE1-CG 3.84Å; F487-L492 HydrophobicContact CE2-CD2 4.28Å; F487-L492 HydrophobicContact CZ-CD2 3.61Å; F487-L492 HydrophobicContact CZ-CG 4.18Å; F487-L492 WeakPolarHBondContact O-CG 3.49Å; F487-L492 PolarHBondContact O-N 2.88Å; F487-L566 HydrophobicContact CE1-CD1 3.59Å; F487-L566 HydrophobicContact CE1-CD2 3.78Å; F487-L566 HydrophobicContact CE1-CG 4.32Å; F487-L566 HydrophobicContact CZ-CD1 4.01Å; F487-L566 HydrophobicContact CZ-CD2 3.88Å; F487-I592 HydrophobicContact CZ-CG1 4.14Å; F487-F595 HydrophobicContact CB-CD2 3.79Å; F487-F595 HydrophobicContact CB-CE2 3.96Å; F487-F595 HydrophobicContact CB-CG 4.29Å; F487-F595 AromaticContact CD1-CD1 3.87Å; F487-F595 HydrophobicContact CD1-CD1 3.87Å; F487-F595 HydrophobicContact CD1-CD2 4.23Å; F487-F595 HydrophobicContact CD1-CE1 4.13Å; F487-F595 HydrophobicContact CD1-CE2 4.46Å; F487-F595 AromaticContact CD1-CG 3.93Å; F487-F595 HydrophobicContact CD1-CG 3.93Å; F487-F595 HydrophobicContact CD1-CZ 4.43Å; F487-F595 HydrophobicContact CD2-CB 3.66Å; F487-F595 HydrophobicContact CD2-CD2 4.06Å; F487-F595 AromaticContact CD2-CG 3.81Å; F487-F595 HydrophobicContact CD2-CG 3.81Å; F487-F595 HydrophobicContact CE1-CB 4.48Å; F487-F595 AromaticContact CE1-CD1 3.93Å; F487-F595 HydrophobicContact CE1-CD1 3.93Å; F487-F595 HydrophobicContact CE1-CE1 4.44Å; F487-F595 HydrophobicContact CE1-CG 4.19Å; F487-F595 HydrophobicContact CE2-CB 3.61Å; F487-F595 HydrophobicContact CE2-CG 4.07Å; F487-F595 HydrophobicContact CG-CB 4.12Å; F487-F595 HydrophobicContact CG-CD1 4.17Å; F487-F595 AromaticContact CG-CD2 3.76Å; F487-F595 HydrophobicContact CG-CD2 3.76Å; F487-F595 HydrophobicContact CG-CE2 4.22Å; F487-F595 AromaticContact CG-CG 3.73Å; F487-F595 HydrophobicContact CG-CG 3.73Å; F487-F595 HydrophobicContact CZ-CB 4.04Å; F487-F595 HydrophobicContact CZ-CD1 4.26Å; F487-F595 HydrophobicContact CZ-CG 4.24Å
488	S	95.4	Very high	95	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.099	C	C	.	.	I	π-helix	trans	-74.9	-38.1	-173.6	58.8	0	0	0	0	114.2	L484 Q485 R515	L484-S488 VanDerWaalsContact O-CB 3.3Å; L484-S488 WeakPolarHBondContact O-CB 3.38Å; L484-S488 PolarHBondContact O-N 2.84Å; L484-S488 PolarHBondContact O-OG 3.28Å; Q485-S488 PolarHBondContact O-N 3.12Å; Q485-S488 PolarHBondContact O-OG 3.29Å; S488-R515 WeakPolarHBondContact O-CG 3.26Å; S488-R515 PolarHBondContact O-NE 2.66Å
489	Q	94.6	Very high	94.9	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	10%	0.1	C	C	.	.	I	π-helix	trans	-83.5	-39.9	-178.1	-62.6	-170.6	29.6	0	0	112.4	Q485 R493 R515 C519 D520 W521 V547	Q485-Q489 VanDerWaalsContact O-CB 3.23Å; Q485-Q489 WeakPolarHBondContact O-CB 3.14Å; Q485-Q489 WeakPolarHBondContact O-CG 3.03Å; Q485-Q489 PolarHBondContact O-N 2.71Å; Q489-R493 VanDerWaalsContact O-CG 3.24Å; Q489-R493 WeakPolarHBondContact O-CG 3.17Å; Q489-R515 PolarHBondContact O-NH2 2.98Å; Q489-C519 HydrophobicContact CG-CB 4.1Å; Q489-D520 VanDerWaalsContact NE2-C 3.33Å; Q489-D520 PolarHBondContact NE2-O 3.44Å; Q489-W521 HydrophobicContact CB-CE3 4.42Å; Q489-W521 HydrophobicContact CB-CH2 3.91Å; Q489-W521 HydrophobicContact CB-CZ3 3.67Å; Q489-W521 HydrophobicContact CG-CD2 4.5Å; Q489-W521 HydrophobicContact CG-CE3 3.98Å; Q489-W521 HydrophobicContact CG-CH2 3.85Å; Q489-W521 HydrophobicContact CG-CZ2 4.38Å; Q489-W521 HydrophobicContact CG-CZ3 3.64Å; Q489-V547 HydrophobicContact CB-CG2 4.36Å
490	V	95.2	Very high	94.6	Very high	60 Å²	60	19.3 Å²	19.3	36%	0.364	11%	0.105	S	C	.	.	I	π-helix	trans	-107.9	-58.6	-171.8	-174.1	0	0	0	0	112.1	D486 L492 R493 I545 V547	D486-V490 WeakPolarHBondContact O-CA 3.11Å; D486-V490 WeakPolarHBondContact O-CB 3.34Å; D486-V490 PolarHBondContact O-N 2.83Å; D486-V490 VanDerWaalsContact O-N 3.08Å; V490-L492 VanDerWaalsContact C-N 3.34Å; V490-L492 PolarHBondContact O-N 2.79Å; V490-R493 VanDerWaalsContact O-CB 3.25Å; V490-R493 WeakPolarHBondContact O-CB 3.46Å; V490-R493 VanDerWaalsContact O-CG 3.26Å; V490-R493 WeakPolarHBondContact O-CG 3.4Å; V490-R493 PolarHBondContact O-N 3.04Å; V490-R493 VanDerWaalsContact O-N 3.08Å; V490-I545 HydrophobicContact CG2-CB 4.4Å; V490-V547 HydrophobicContact CG2-CG2 3.64Å
491	T	95.3	Very high	94.4	Very high	53 Å²	53	25.8 Å²	25.8	33%	0.325	13%	0.133	S	C	.	.	I	π-helix	trans	-62	-40.2	-174	-50.9	0	0	0	0	112.3	D486 F487 R493 P495 D591	D486-T491 PolarHBondContact O-N 2.61Å; D486-T491 PolarHBondContact O-OG1 2.9Å; F487-T491 HydrophobicContact CD2-CG2 3.97Å; F487-T491 HydrophobicContact CE2-CG2 4.17Å; F487-T491 WeakPolarHBondContact O-CB 3.15Å; F487-T491 PolarHBondContact O-N 3.5Å; T491-R493 PolarHBondContact O-N 3.05Å; T491-P495 VanDerWaalsContact O-CD 3.28Å; T491-P495 WeakPolarHBondContact O-CD 3.44Å; T491-D591 HydrophobicContact CG2-CB 3.95Å
492	L	95.4	Very high	94.1	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-6.6	179	-69	-171.9	0	0	0	114.5	F487 V490 E494 P495 L496 L511 I514	F487-L492 HydrophobicContact CD1-CD1 4.34Å; F487-L492 HydrophobicContact CD1-CG 4.19Å; F487-L492 HydrophobicContact CE1-CD1 3.94Å; F487-L492 HydrophobicContact CE1-CD2 3.74Å; F487-L492 HydrophobicContact CE1-CG 3.84Å; F487-L492 HydrophobicContact CE2-CD2 4.28Å; F487-L492 HydrophobicContact CZ-CD2 3.61Å; F487-L492 HydrophobicContact CZ-CG 4.18Å; F487-L492 WeakPolarHBondContact O-CG 3.49Å; F487-L492 PolarHBondContact O-N 2.88Å; V490-L492 VanDerWaalsContact C-N 3.34Å; V490-L492 PolarHBondContact O-N 2.79Å; L492-E494 PolarHBondContact O-N 3.23Å; L492-P495 HydrophobicContact CD2-CG 4.12Å; L492-P495 WeakPolarHBondContact O-CD 3.25Å; L492-P495 WeakPolarHBondContact O-CG 3.44Å; L492-L496 WeakPolarHBondContact O-CB 3.08Å; L492-L496 PolarHBondContact O-N 3.37Å; L492-L511 HydrophobicContact CD1-CD2 4.28Å; L492-L511 HydrophobicContact CD2-CD2 3.86Å; L492-I514 HydrophobicContact CD1-CB 4.38Å; L492-I514 HydrophobicContact CD1-CG2 3.74Å
493	R	94.6	Very high	93.8	Very high	22 Å²	22	37.9 Å²	37.9	8%	0.083	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-46.8	177.4	-68.5	176.2	68.4	-121.6	-6.9	112.1	Q489 V490 T491 L496 R497 D530 A532 D538	Q489-R493 VanDerWaalsContact O-CG 3.24Å; Q489-R493 WeakPolarHBondContact O-CG 3.17Å; V490-R493 VanDerWaalsContact O-CB 3.25Å; V490-R493 WeakPolarHBondContact O-CB 3.46Å; V490-R493 VanDerWaalsContact O-CG 3.26Å; V490-R493 WeakPolarHBondContact O-CG 3.4Å; V490-R493 PolarHBondContact O-N 3.04Å; V490-R493 VanDerWaalsContact O-N 3.08Å; T491-R493 PolarHBondContact O-N 3.05Å; R493-L496 PolarHBondContact O-N 3.26Å; R493-R497 VanDerWaalsContact O-CB 3.29Å; R493-R497 WeakPolarHBondContact O-CB 3.48Å; R493-R497 PolarHBondContact O-N 3.36Å; R493-D530 IonicContact CZ-OD1 3.53Å; R493-D530 IonicContact NE-OD1 3.67Å; R493-D530 PolarHBondContact NE-OD1 3.34Å; R493-D530 IonicContact NE-OD2 3.57Å; R493-D530 PolarHBondContact NE-OD2 2.91Å; R493-D530 IonicContact NH2-OD1 2.69Å; R493-D530 PolarHBondContact NH2-OD1 3Å; R493-A532 HydrophobicContact CB-CB 4.19Å; R493-D538 IonicContact CZ-OD1 3.23Å; R493-D538 IonicContact CZ-OD2 3.27Å; R493-D538 IonicContact NH1-OD1 3Å; R493-D538 IonicContact NH1-OD2 2.62Å; R493-D538 PolarHBondContact NH1-OD2 3.22Å; R493-D538 IonicContact NH2-OD1 3.89Å; R493-D538 PolarHBondContact NH2-OD1 3.08Å; R493-D538 IonicContact NH2-OD2 3.5Å; R493-D538 PolarHBondContact NH2-OD2 2.66Å
494	E	92.6	Very high	93.4	Very high	77 Å²	77	39.7 Å²	39.7	36%	0.36	19%	0.188	S	C	.	.	H	α-helix	trans	-66.3	-51	-176.9	-178.6	56.5	-157.9	0	0	112.9	L492 L496 R497 Q498 T588	L492-E494 PolarHBondContact O-N 3.23Å; E494-L496 VanDerWaalsContact C-N 3.27Å; E494-L496 PolarHBondContact O-N 3.02Å; E494-R497 WeakPolarHBondContact O-CB 3.36Å; E494-R497 PolarHBondContact O-N 3.28Å; E494-R497 IonicContact OE1-CZ 2.7Å; E494-R497 IonicContact OE1-NE 3.64Å; E494-R497 IonicContact OE1-NH2 2.72Å; E494-R497 PolarHBondContact OE1-NH2 3.43Å; E494-R497 IonicContact OE2-CZ 3.07Å; E494-R497 IonicContact OE2-NE 3.3Å; E494-R497 PolarHBondContact OE2-NE 2.73Å; E494-R497 IonicContact OE2-NH2 3.96Å; E494-R497 PolarHBondContact OE2-NH2 3.05Å; E494-Q498 WeakPolarHBondContact O-CG 3.37Å; E494-Q498 PolarHBondContact O-N 3.3Å; E494-Q498 PolarHBondContact OE1-NE2 2.79Å; E494-T588 HydrophobicContact CG-CG2 4.46Å
495	P	93	Very high	92.9	Very high	6 Å²	6	44.6 Å²	44.6	4%	0.039	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-33.2	175.1	21	-29.3	0	0	0	112.4	T491 L492 Q498 A499 L511 L584 T588	T491-P495 VanDerWaalsContact O-CD 3.28Å; T491-P495 WeakPolarHBondContact O-CD 3.44Å; L492-P495 HydrophobicContact CD2-CG 4.12Å; L492-P495 WeakPolarHBondContact O-CD 3.25Å; L492-P495 WeakPolarHBondContact O-CG 3.44Å; P495-Q498 PolarHBondContact O-N 3.35Å; P495-A499 WeakPolarHBondContact O-CB 3.36Å; P495-A499 PolarHBondContact O-N 3.4Å; P495-L511 HydrophobicContact CB-CD1 4Å; P495-L584 HydrophobicContact CB-CD2 4.46Å; P495-T588 HydrophobicContact CB-CG2 4.01Å; P495-T588 HydrophobicContact CG-CG2 4.21Å
496	L	92.9	Very high	92.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67.3	-45.2	174.6	-179.7	59.8	0	0	0	112	L492 R493 E494 Q498 A499 I500 Q508 L511 Q512 L533	L492-L496 WeakPolarHBondContact O-CB 3.08Å; L492-L496 PolarHBondContact O-N 3.37Å; R493-L496 PolarHBondContact O-N 3.26Å; E494-L496 VanDerWaalsContact C-N 3.27Å; E494-L496 PolarHBondContact O-N 3.02Å; L496-Q498 VanDerWaalsContact C-N 3.29Å; L496-Q498 PolarHBondContact O-N 2.87Å; L496-A499 WeakPolarHBondContact O-CB 3.34Å; L496-A499 PolarHBondContact O-N 3.22Å; L496-A499 VanDerWaalsContact O-N 3.16Å; L496-I500 HydrophobicContact CD1-CD1 4.03Å; L496-I500 HydrophobicContact CD1-CG1 4.36Å; L496-I500 HydrophobicContact CG-CD1 3.98Å; L496-I500 WeakPolarHBondContact O-CG1 3.36Å; L496-I500 PolarHBondContact O-N 2.97Å; L496-Q508 HydrophobicContact CD1-CG 3.91Å; L496-L511 HydrophobicContact CB-CD1 4.21Å; L496-L511 HydrophobicContact CD1-CB 4.15Å; L496-Q512 HydrophobicContact CD1-CG 3.88Å; L496-Q512 HydrophobicContact CD2-CG 4.41Å; L496-L533 HydrophobicContact CD2-CD2 4.14Å
497	R	94.1	Very high	92	Very high	15 Å²	15	46.3 Å²	46.3	6%	0.057	23%	0.226	C	C	.	.	H	α-helix	trans	-56.1	-46.1	174.7	-174.2	-170.1	72.7	70.6	2.4	111.1	R493 E494 I500 K501 A532 E536	R493-R497 VanDerWaalsContact O-CB 3.29Å; R493-R497 WeakPolarHBondContact O-CB 3.48Å; R493-R497 PolarHBondContact O-N 3.36Å; E494-R497 WeakPolarHBondContact O-CB 3.36Å; E494-R497 PolarHBondContact O-N 3.28Å; E494-R497 IonicContact OE1-CZ 2.7Å; E494-R497 IonicContact OE1-NE 3.64Å; E494-R497 IonicContact OE1-NH2 2.72Å; E494-R497 PolarHBondContact OE1-NH2 3.43Å; E494-R497 IonicContact OE2-CZ 3.07Å; E494-R497 IonicContact OE2-NE 3.3Å; E494-R497 PolarHBondContact OE2-NE 2.73Å; E494-R497 IonicContact OE2-NH2 3.96Å; E494-R497 PolarHBondContact OE2-NH2 3.05Å; R497-I500 PolarHBondContact O-N 3.36Å; R497-K501 VanDerWaalsContact O-CB 3.23Å; R497-K501 WeakPolarHBondContact O-CB 3.34Å; R497-K501 PolarHBondContact O-N 3.39Å; R497-A532 WeakPolarHBondContact CA-O 3.47Å; R497-A532 HydrophobicContact CB-CB 3.86Å; R497-A532 HydrophobicContact CG-CB 4.25Å; R497-E536 WeakPolarHBondContact CD-O 3.31Å
498	Q	89.6	Confident	91.6	Very high	13 Å²	13	47.9 Å²	47.9	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-65.9	-39.8	178.3	-68.4	-168	18.2	0	0	112.1	E494 P495 L496 I500 K501 K502 E585	E494-Q498 WeakPolarHBondContact O-CG 3.37Å; E494-Q498 PolarHBondContact O-N 3.3Å; E494-Q498 PolarHBondContact OE1-NE2 2.79Å; P495-Q498 PolarHBondContact O-N 3.35Å; L496-Q498 VanDerWaalsContact C-N 3.29Å; L496-Q498 PolarHBondContact O-N 2.87Å; Q498-I500 VanDerWaalsContact C-N 3.35Å; Q498-K501 PolarHBondContact O-N 3.38Å; Q498-K502 VanDerWaalsContact O-CB 3.26Å; Q498-K502 WeakPolarHBondContact O-CB 3.3Å; Q498-K502 WeakPolarHBondContact O-CG 3.47Å; Q498-K502 PolarHBondContact O-N 2.89Å; Q498-E585 VanDerWaalsContact NE2-CD 3.28Å; Q498-E585 PolarHBondContact NE2-OE2 2.79Å; Q498-E585 PolarHBondContact OE1-OE1 2.99Å; Q498-E585 PolarHBondContact OE1-OE2 3.24Å
499	A	91.3	Very high	91.3	Very high	3 Å²	3	50.1 Å²	50.1	3%	0.025	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-44.4	176.2	0	0	0	0	0	111.3	P495 L496 K503 K504 I507 Q508	P495-A499 WeakPolarHBondContact O-CB 3.36Å; P495-A499 PolarHBondContact O-N 3.4Å; L496-A499 WeakPolarHBondContact O-CB 3.34Å; L496-A499 PolarHBondContact O-N 3.22Å; L496-A499 VanDerWaalsContact O-N 3.16Å; A499-K503 CarbonylContact O-C 3.58Å; A499-K503 PolarHBondContact O-N 2.72Å; A499-K503 VanDerWaalsContact O-N 3.07Å; A499-K504 HydrophobicContact CB-CB 4.16Å; A499-K504 PolarHBondContact O-N 3.42Å; A499-I507 HydrophobicContact CB-CB 4.24Å; A499-I507 HydrophobicContact CB-CG2 3.94Å; A499-Q508 HydrophobicContact CB-CB 4.06Å
500	I	91.4	Very high	91.1	Very high	34 Å²	34	50.1 Å²	50.1	17%	0.174	25%	0.25	C	C	.	.	H	α-helix	trans	-65.8	-51.3	176.8	-65.5	165.3	0	0	0	110.5	L496 R497 Q498 K502 K503 Q508 L533	L496-I500 HydrophobicContact CD1-CD1 4.03Å; L496-I500 HydrophobicContact CD1-CG1 4.36Å; L496-I500 HydrophobicContact CG-CD1 3.98Å; L496-I500 WeakPolarHBondContact O-CG1 3.36Å; L496-I500 PolarHBondContact O-N 2.97Å; R497-I500 PolarHBondContact O-N 3.36Å; Q498-I500 VanDerWaalsContact C-N 3.35Å; I500-K502 VanDerWaalsContact C-N 3.33Å; I500-K502 PolarHBondContact O-N 3.23Å; I500-K503 PolarHBondContact O-N 3.08Å; I500-K503 VanDerWaalsContact O-N 3.11Å; I500-Q508 HydrophobicContact CG1-CG 4Å; I500-L533 WeakPolarHBondContact CD1-O 3.35Å
501	K	91.4	Very high	90.9	Very high	136 Å²	136	47.3 Å²	47.3	59%	0.591	23%	0.232	S	C	*	.	H	α-helix	trans	-58.1	-42.2	-179.8	-179.3	177.9	177.3	178.3	0	112.7	R497 Q498 K503	R497-K501 VanDerWaalsContact O-CB 3.23Å; R497-K501 WeakPolarHBondContact O-CB 3.34Å; R497-K501 PolarHBondContact O-N 3.39Å; Q498-K501 PolarHBondContact O-N 3.38Å; K501-K503 VanDerWaalsContact C-N 3.34Å
502	K	89	Confident	90.6	Very high	98 Å²	98	47.1 Å²	47.1	43%	0.426	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	8.7	-178.4	-61.3	175.4	-177.3	165.7	0	112.7	Q498 I500 K504 E585	Q498-K502 VanDerWaalsContact O-CB 3.26Å; Q498-K502 WeakPolarHBondContact O-CB 3.3Å; Q498-K502 WeakPolarHBondContact O-CG 3.47Å; Q498-K502 PolarHBondContact O-N 2.89Å; I500-K502 VanDerWaalsContact C-N 3.33Å; I500-K502 PolarHBondContact O-N 3.23Å; K502-K504 VanDerWaalsContact C-N 3.32Å; K502-K504 HydrophobicContact CB-CG 4.05Å; K502-K504 PolarHBondContact O-N 3.21Å; K502-E585 IonicContact NZ-OE1 2.66Å; K502-E585 PolarHBondContact NZ-OE1 2.82Å
503	K	89.5	Confident	90.3	Very high	175 Å²	175	47.2 Å²	47.2	76%	0.761	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	41.8	-179	-60.4	-176	177.3	-177.1	0	114.1	A499 I500 K501 N505	A499-K503 CarbonylContact O-C 3.58Å; A499-K503 PolarHBondContact O-N 2.72Å; A499-K503 VanDerWaalsContact O-N 3.07Å; I500-K503 PolarHBondContact O-N 3.08Å; I500-K503 VanDerWaalsContact O-N 3.11Å; K501-K503 VanDerWaalsContact C-N 3.34Å; K503-N505 PolarHBondContact O-N 3.04Å
504	K	88.1	Confident	90.2	Very high	63 Å²	63	46.2 Å²	46.2	27%	0.274	23%	0.225	S	C	.	.			trans	-89.1	68.6	177.1	-58.1	-66.5	-173.8	160.4	0	110.5	A499 K502 V506 I507 Q508 S583	A499-K504 HydrophobicContact CB-CB 4.16Å; A499-K504 PolarHBondContact O-N 3.42Å; K502-K504 VanDerWaalsContact C-N 3.32Å; K502-K504 HydrophobicContact CB-CG 4.05Å; K502-K504 PolarHBondContact O-N 3.21Å; K504-V506 PolarHBondContact O-N 3.22Å; K504-V506 VanDerWaalsContact O-N 3.13Å; K504-I507 HydrophobicContact CB-CB 4.22Å; K504-I507 HydrophobicContact CB-CD1 4.3Å; K504-I507 PolarHBondContact O-N 3.49Å; K504-I507 VanDerWaalsContact O-N 3.11Å; K504-Q508 PolarHBondContact O-N 3.21Å; K504-S583 PolarHBondContact NZ-OG 3.06Å
505	N	86.8	Confident	90.2	Very high	110 Å²	110	42.8 Å²	42.8	59%	0.588	21%	0.209	S	C	*	.	H	α-helix	trans	-54.9	-35.6	-172.1	-60.5	-19.8	0	0	0	114	K503 S509	K503-N505 PolarHBondContact O-N 3.04Å; N505-S509 WeakPolarHBondContact O-CB 3.3Å; N505-S509 PolarHBondContact O-N 2.81Å; N505-S509 PolarHBondContact O-OG 3.24Å
506	V	85.9	Confident	90	Very high	90 Å²	90	48.7 Å²	48.7	55%	0.545	23%	0.234	S	C	.	.	H	α-helix	trans	-66.5	-49.5	178.2	-177.6	0	0	0	0	111.2	K504 Q508 S509 V510 L580	K504-V506 PolarHBondContact O-N 3.22Å; K504-V506 VanDerWaalsContact O-N 3.13Å; V506-Q508 VanDerWaalsContact C-N 3.33Å; V506-Q508 PolarHBondContact O-N 2.97Å; V506-S509 PolarHBondContact O-N 3.37Å; V506-S509 PolarHBondContact O-OG 2.9Å; V506-V510 WeakPolarHBondContact O-CG2 3.39Å; V506-V510 PolarHBondContact O-N 2.89Å; V506-V510 VanDerWaalsContact O-N 3.17Å; V506-L580 HydrophobicContact CB-CD2 4.3Å; V506-L580 HydrophobicContact CG1-CD2 3.76Å
507	I	87.7	Confident	89.8	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-43.5	177.3	-64.8	175.5	0	0	0	110.2	A499 K504 S509 V510 L511 L569 L580 L584	A499-I507 HydrophobicContact CB-CB 4.24Å; A499-I507 HydrophobicContact CB-CG2 3.94Å; K504-I507 HydrophobicContact CB-CB 4.22Å; K504-I507 HydrophobicContact CB-CD1 4.3Å; K504-I507 PolarHBondContact O-N 3.49Å; K504-I507 VanDerWaalsContact O-N 3.11Å; I507-S509 VanDerWaalsContact C-N 3.31Å; I507-S509 PolarHBondContact O-N 3.25Å; I507-V510 PolarHBondContact O-N 2.88Å; I507-L511 HydrophobicContact CG2-CD1 3.67Å; I507-L511 HydrophobicContact CG2-CG 4.13Å; I507-L511 WeakPolarHBondContact O-CB 3.41Å; I507-L511 VanDerWaalsContact O-CG 3.31Å; I507-L511 WeakPolarHBondContact O-CG 3.23Å; I507-L511 PolarHBondContact O-N 2.99Å; I507-L569 HydrophobicContact CG1-CD2 4.37Å; I507-L569 HydrophobicContact CG2-CD2 4.26Å; I507-L580 HydrophobicContact CG1-CD2 4.1Å; I507-L584 HydrophobicContact CD1-CD2 4.14Å; I507-L584 HydrophobicContact CD1-CG 4.2Å; I507-L584 HydrophobicContact CG2-CD2 3.88Å
508	Q	89.9	Confident	89.7	Confident	44 Å²	44	48.8 Å²	48.8	21%	0.206	24%	0.236	C	C	.	.	H	α-helix	trans	-56.2	-46	175.4	-179.7	-174.9	-10.1	0	0	111.3	L496 A499 I500 K504 V506 V510 L511 Q512	L496-Q508 HydrophobicContact CD1-CG 3.91Å; A499-Q508 HydrophobicContact CB-CB 4.06Å; I500-Q508 HydrophobicContact CG1-CG 4Å; K504-Q508 PolarHBondContact O-N 3.21Å; V506-Q508 VanDerWaalsContact C-N 3.33Å; V506-Q508 PolarHBondContact O-N 2.97Å; Q508-V510 PolarHBondContact O-N 3.31Å; Q508-L511 PolarHBondContact O-N 3.47Å; Q508-Q512 HydrophobicContact CG-CG 4.38Å; Q508-Q512 WeakPolarHBondContact O-CB 3.24Å; Q508-Q512 WeakPolarHBondContact O-CG 3.37Å; Q508-Q512 PolarHBondContact O-N 2.91Å
509	S	88.7	Confident	89.9	Confident	47 Å²	47	49.1 Å²	49.1	33%	0.329	24%	0.24	S	C	.	.	H	α-helix	trans	-62.7	-40.7	-179.1	69.9	0	0	0	0	112.8	N505 V506 I507 A513	N505-S509 WeakPolarHBondContact O-CB 3.3Å; N505-S509 PolarHBondContact O-N 2.81Å; N505-S509 PolarHBondContact O-OG 3.24Å; V506-S509 PolarHBondContact O-N 3.37Å; V506-S509 PolarHBondContact O-OG 2.9Å; I507-S509 VanDerWaalsContact C-N 3.31Å; I507-S509 PolarHBondContact O-N 3.25Å; S509-A513 VanDerWaalsContact O-CB 3.3Å; S509-A513 WeakPolarHBondContact O-CB 3.3Å; S509-A513 PolarHBondContact O-N 2.79Å
510	V	89.6	Confident	90.1	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-69.2	-46.7	177.8	178	0	0	0	0	110.9	I56 V506 I507 Q508 Q512 A513 I514 M565 L569	I56-V510 HydrophobicContact CD1-CG2 3.81Å; V506-V510 WeakPolarHBondContact O-CG2 3.39Å; V506-V510 PolarHBondContact O-N 2.89Å; V506-V510 VanDerWaalsContact O-N 3.17Å; I507-V510 PolarHBondContact O-N 2.88Å; Q508-V510 PolarHBondContact O-N 3.31Å; V510-Q512 VanDerWaalsContact C-N 3.33Å; V510-Q512 PolarHBondContact O-N 3.35Å; V510-A513 WeakPolarHBondContact O-CB 3.3Å; V510-A513 PolarHBondContact O-N 3.27Å; V510-I514 HydrophobicContact CG1-CD1 4.18Å; V510-I514 WeakPolarHBondContact O-CG1 3.2Å; V510-I514 PolarHBondContact O-N 3.44Å; V510-M565 HydrophobicContact CG1-CB 3.87Å; V510-M565 HydrophobicContact CG1-CG 4.35Å; V510-L569 HydrophobicContact CB-CD2 4.16Å; V510-L569 HydrophobicContact CG1-CD1 4.14Å; V510-L569 HydrophobicContact CG1-CD2 4.04Å; V510-L569 HydrophobicContact CG1-CG 4Å
511	L	91.8	Very high	90.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-40.5	178.4	-69.9	176.6	0	0	0	112.1	L492 P495 L496 I507 Q508 I514 R515 L569	L492-L511 HydrophobicContact CD1-CD2 4.28Å; L492-L511 HydrophobicContact CD2-CD2 3.86Å; P495-L511 HydrophobicContact CB-CD1 4Å; L496-L511 HydrophobicContact CB-CD1 4.21Å; L496-L511 HydrophobicContact CD1-CB 4.15Å; I507-L511 HydrophobicContact CG2-CD1 3.67Å; I507-L511 HydrophobicContact CG2-CG 4.13Å; I507-L511 WeakPolarHBondContact O-CB 3.41Å; I507-L511 VanDerWaalsContact O-CG 3.31Å; I507-L511 WeakPolarHBondContact O-CG 3.23Å; I507-L511 PolarHBondContact O-N 2.99Å; Q508-L511 PolarHBondContact O-N 3.47Å; L511-I514 PolarHBondContact O-N 2.68Å; L511-R515 WeakPolarHBondContact O-CG 3.25Å; L511-R515 PolarHBondContact O-N 2.86Å; L511-R515 VanDerWaalsContact O-N 3.12Å; L511-L569 HydrophobicContact CD2-CD1 3.64Å; L511-L569 HydrophobicContact CG-CD1 4.26Å
512	Q	89.8	Confident	90.1	Very high	49 Å²	49	49.8 Å²	49.8	23%	0.229	25%	0.245	C	C	.	.	H	α-helix	trans	-69.2	-37.5	174.5	-73	-176	-4.1	0	0	112.3	L496 Q508 V510 I514 R515 K516	L496-Q512 HydrophobicContact CD1-CG 3.88Å; L496-Q512 HydrophobicContact CD2-CG 4.41Å; Q508-Q512 HydrophobicContact CG-CG 4.38Å; Q508-Q512 WeakPolarHBondContact O-CB 3.24Å; Q508-Q512 WeakPolarHBondContact O-CG 3.37Å; Q508-Q512 PolarHBondContact O-N 2.91Å; V510-Q512 VanDerWaalsContact C-N 3.33Å; V510-Q512 PolarHBondContact O-N 3.35Å; Q512-I514 VanDerWaalsContact C-N 3.32Å; Q512-I514 PolarHBondContact O-N 3.23Å; Q512-R515 PolarHBondContact O-N 3.5Å; Q512-K516 WeakPolarHBondContact O-CB 3.43Å; Q512-K516 VanDerWaalsContact O-CG 3.28Å; Q512-K516 WeakPolarHBondContact O-CG 3.06Å; Q512-K516 PolarHBondContact O-N 2.81Å
513	A	88.9	Confident	90.2	Very high	4 Å²	4	50.5 Å²	50.5	3%	0.033	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-42.4	175	0	0	0	0	0	111.3	S509 V510 K516 T517 M565	S509-A513 VanDerWaalsContact O-CB 3.3Å; S509-A513 WeakPolarHBondContact O-CB 3.3Å; S509-A513 PolarHBondContact O-N 2.79Å; V510-A513 WeakPolarHBondContact O-CB 3.3Å; V510-A513 PolarHBondContact O-N 3.27Å; A513-K516 PolarHBondContact O-N 3.47Å; A513-T517 WeakPolarHBondContact O-CB 3.34Å; A513-T517 PolarHBondContact O-N 3.33Å; A513-T517 PolarHBondContact O-OG1 2.89Å; A513-M565 HydrophobicContact CB-CE 4.48Å; A513-M565 HydrophobicContact CB-SD 3.75Å
514	I	91.6	Very high	90.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.3	-55	172.9	-68.7	162	0	0	0	110.2	L492 V510 L511 Q512 K516 T517 V518 V562 M565 L566	L492-I514 HydrophobicContact CD1-CB 4.38Å; L492-I514 HydrophobicContact CD1-CG2 3.74Å; V510-I514 HydrophobicContact CG1-CD1 4.18Å; V510-I514 WeakPolarHBondContact O-CG1 3.2Å; V510-I514 PolarHBondContact O-N 3.44Å; L511-I514 PolarHBondContact O-N 2.68Å; Q512-I514 VanDerWaalsContact C-N 3.32Å; Q512-I514 PolarHBondContact O-N 3.23Å; I514-K516 VanDerWaalsContact C-N 3.33Å; I514-K516 PolarHBondContact O-N 3.4Å; I514-T517 WeakPolarHBondContact O-CB 3.36Å; I514-T517 PolarHBondContact O-N 3.28Å; I514-V518 WeakPolarHBondContact O-CG2 3.28Å; I514-V518 PolarHBondContact O-N 2.91Å; I514-V562 HydrophobicContact CG2-CG1 4.24Å; I514-V562 HydrophobicContact CG2-CG2 4.21Å; I514-M565 HydrophobicContact CB-CE 4.44Å; I514-M565 HydrophobicContact CD1-CB 3.86Å; I514-M565 HydrophobicContact CG1-CB 3.76Å; I514-M565 HydrophobicContact CG1-CE 3.67Å; I514-M565 HydrophobicContact CG1-SD 4.01Å; I514-L566 HydrophobicContact CD1-CD2 3.55Å; I514-L566 HydrophobicContact CD1-CG 3.85Å
515	R	92.6	Very high	90	Very high	6 Å²	6	48.2 Å²	48.2	2%	0.023	27%	0.265	C	S	.	.	H	α-helix	trans	-57.4	-43.7	-179.4	-67.9	180	97.8	-161.6	20.2	112.4	S488 Q489 L511 Q512 T517 V518 C519 E526	S488-R515 WeakPolarHBondContact O-CG 3.26Å; S488-R515 PolarHBondContact O-NE 2.66Å; Q489-R515 PolarHBondContact O-NH2 2.98Å; L511-R515 WeakPolarHBondContact O-CG 3.25Å; L511-R515 PolarHBondContact O-N 2.86Å; L511-R515 VanDerWaalsContact O-N 3.12Å; Q512-R515 PolarHBondContact O-N 3.5Å; R515-T517 VanDerWaalsContact C-N 3.25Å; R515-T517 PolarHBondContact O-N 3.39Å; R515-V518 PolarHBondContact O-N 3.49Å; R515-C519 VanDerWaalsContact CA-SG 3.56Å; R515-C519 WeakPolarHBondContact O-CB 3.24Å; R515-C519 PolarHBondContact O-N 3.26Å; R515-C519 PolarHBondContact O-SG 2.68Å; R515-C519 VanDerWaalsContact O-SG 3.32Å; R515-E526 IonicContact CZ-OE1 3.58Å; R515-E526 IonicContact NH1-OE1 3.77Å; R515-E526 PolarHBondContact NH1-OE1 3.3Å
516	K	88.6	Confident	90.2	Very high	130 Å²	130	45.1 Å²	45.1	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-65.4	-26.6	177.9	-72.8	176.6	-178.6	-177.8	0	113.8	Q512 A513 I514	Q512-K516 WeakPolarHBondContact O-CB 3.43Å; Q512-K516 VanDerWaalsContact O-CG 3.28Å; Q512-K516 WeakPolarHBondContact O-CG 3.06Å; Q512-K516 PolarHBondContact O-N 2.81Å; A513-K516 PolarHBondContact O-N 3.47Å; I514-K516 VanDerWaalsContact C-N 3.33Å; I514-K516 PolarHBondContact O-N 3.4Å
517	T	89.2	Confident	90.5	Very high	8 Å²	8	42 Å²	42	5%	0.049	23%	0.228	C	C	.	.	H	α-helix	trans	-78.9	-34.5	-177.8	-56.3	0	0	0	0	112.1	F52 A513 I514 R515 Q558	F52-T517 HydrophobicContact CD1-CG2 3.88Å; F52-T517 HydrophobicContact CE1-CG2 4.27Å; F52-T517 HydrophobicContact CG-CG2 4.43Å; A513-T517 WeakPolarHBondContact O-CB 3.34Å; A513-T517 PolarHBondContact O-N 3.33Å; A513-T517 PolarHBondContact O-OG1 2.89Å; I514-T517 WeakPolarHBondContact O-CB 3.36Å; I514-T517 PolarHBondContact O-N 3.28Å; R515-T517 VanDerWaalsContact C-N 3.25Å; R515-T517 PolarHBondContact O-N 3.39Å; T517-Q558 HydrophobicContact CG2-CG 4.25Å; T517-Q558 PolarHBondContact O-NE2 2.98Å; T517-Q558 VanDerWaalsContact O-NE2 3.15Å
518	V	92.3	Very high	90.4	Very high	8 Å²	8	49.6 Å²	49.6	5%	0.048	26%	0.261	C	S	.	.	H	α-helix	trans	-131.4	-16.7	-167.9	-59	0	0	0	0	116.6	L484 Q485 I514 R515 D520 Q558 V562	L484-V518 HydrophobicContact CD1-CG2 4.1Å; L484-V518 HydrophobicContact CD2-CB 4.14Å; L484-V518 HydrophobicContact CD2-CG1 4.31Å; L484-V518 HydrophobicContact CG-CB 4.38Å; L484-V518 HydrophobicContact CG-CG2 4.27Å; Q485-V518 PolarHBondContact NE2-O 3.49Å; Q485-V518 PolarHBondContact OE1-O 2.96Å; I514-V518 WeakPolarHBondContact O-CG2 3.28Å; I514-V518 PolarHBondContact O-N 2.91Å; R515-V518 PolarHBondContact O-N 3.49Å; V518-D520 PolarHBondContact O-N 3.43Å; V518-D520 VanDerWaalsContact O-N 3.1Å; V518-Q558 HydrophobicContact CG1-CB 3.89Å; V518-Q558 HydrophobicContact CG1-CG 4.1Å; V518-V562 HydrophobicContact CB-CG2 4.36Å; V518-V562 HydrophobicContact CG1-CG2 3.43Å; V518-V562 VanDerWaalsContact CG1-CG2 3.43Å; V518-V562 HydrophobicContact CG2-CG2 3.99Å
519	C	94.7	Very high	90.4	Very high	21 Å²	21	52.5 Å²	52.5	14%	0.142	28%	0.279	C	S	.	.			trans	-66.7	114.6	-178	-71.9	0	0	0	0	110.9	Q489 R515 W521	Q489-C519 HydrophobicContact CG-CB 4.1Å; R515-C519 VanDerWaalsContact CA-SG 3.56Å; R515-C519 WeakPolarHBondContact O-CB 3.24Å; R515-C519 PolarHBondContact O-N 3.26Å; R515-C519 PolarHBondContact O-SG 2.68Å; R515-C519 VanDerWaalsContact O-SG 3.32Å; C519-W521 HydrophobicContact CB-CD2 4.31Å; C519-W521 HydrophobicContact CB-CZ2 3.76Å
520	D	94.1	Very high	90.4	Very high	53 Å²	53	50.3 Å²	50.3	28%	0.283	26%	0.263	S	S	.	.			trans	-99.3	92.1	168.3	-178.1	29.1	0	0	0	108.8	Y481 Q489 V518 P548 R550	Y481-D520 WeakPolarHBondContact OH-CB 3.42Å; Y481-D520 PolarHBondContact OH-OD2 3.49Å; Q489-D520 VanDerWaalsContact NE2-C 3.33Å; Q489-D520 PolarHBondContact NE2-O 3.44Å; V518-D520 PolarHBondContact O-N 3.43Å; V518-D520 VanDerWaalsContact O-N 3.1Å; D520-P548 WeakPolarHBondContact O-CG 3.43Å; D520-R550 IonicContact OD2-CZ 3.56Å; D520-R550 IonicContact OD2-NE 2.78Å; D520-R550 PolarHBondContact OD2-NE 3.07Å; D520-R550 IonicContact OD2-NH2 3.65Å; D520-R550 PolarHBondContact OD2-NH2 3.47Å
521	W	92.8	Very high	90.4	Very high	27 Å²	27	50.6 Å²	50.6	10%	0.102	27%	0.265	C	S	.	.			trans	-72.5	135	-177.5	-57.5	101.7	0	0	0	110.7	Q489 C519 T523 G524 H525 E526 P527 I545	Q489-W521 HydrophobicContact CB-CE3 4.42Å; Q489-W521 HydrophobicContact CB-CH2 3.91Å; Q489-W521 HydrophobicContact CB-CZ3 3.67Å; Q489-W521 HydrophobicContact CG-CD2 4.5Å; Q489-W521 HydrophobicContact CG-CE3 3.98Å; Q489-W521 HydrophobicContact CG-CH2 3.85Å; Q489-W521 HydrophobicContact CG-CZ2 4.38Å; Q489-W521 HydrophobicContact CG-CZ3 3.64Å; C519-W521 HydrophobicContact CB-CD2 4.31Å; C519-W521 HydrophobicContact CB-CZ2 3.76Å; W521-T523 PolarHBondContact O-N 3.16Å; W521-T523 VanDerWaalsContact O-N 3.1Å; W521-G524 WeakPolarHBondContact O-CA 3.36Å; W521-G524 PolarHBondContact O-N 2.69Å; W521-H525 WeakPolarHBondContact CB-O 3.15Å; W521-E526 HydrophobicContact CH2-CG 4.41Å; W521-E526 HydrophobicContact CZ2-CB 4.23Å; W521-E526 HydrophobicContact CZ2-CG 3.7Å; W521-P527 VanDerWaalsContact CE3-CD 3.47Å; W521-P527 HydrophobicContact CE3-CG 4.18Å; W521-P527 HydrophobicContact CH2-CG 4.32Å; W521-P527 HydrophobicContact CZ3-CG 3.89Å; W521-I545 HydrophobicContact CZ3-CD1 4.28Å; W521-I545 HydrophobicContact CZ3-CG2 4.13Å
522	E	91.6	Very high	90.3	Very high	107 Å²	107	50.7 Å²	50.7	50%	0.5	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-37.1	179.3	-177.1	72.5	-174.2	0	0	112.9	G524 P548	E522-G524 VanDerWaalsContact C-N 3.3Å; E522-G524 PolarHBondContact O-N 3.26Å; E522-P548 VanDerWaalsContact OE2-CB 3.28Å; E522-P548 WeakPolarHBondContact OE2-CB 3.4Å
523	T	89.4	Confident	90.3	Very high	112 Å²	112	50.1 Å²	50.1	69%	0.687	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	4.8	179.7	56.5	0	0	0	0	113.8	W521 H525	W521-T523 PolarHBondContact O-N 3.16Å; W521-T523 VanDerWaalsContact O-N 3.1Å; T523-H525 PolarHBondContact O-N 3.48Å; T523-H525 PolarHBondContact O-ND1 2.85Å; T523-H525 VanDerWaalsContact O-ND1 3.12Å; T523-H525 PolarHBondContact OG1-O 3.26Å
524	G	87.5	Confident	90.3	Very high	55 Å²	55	57.3 Å²	57.3	57%	0.567	29%	0.29	S	S	*	.	S	Bend	trans	74.7	-3.6	-175.7	0	0	0	0	0	115.4	W521 E522	W521-G524 WeakPolarHBondContact O-CA 3.36Å; W521-G524 PolarHBondContact O-N 2.69Å; E522-G524 VanDerWaalsContact C-N 3.3Å; E522-G524 PolarHBondContact O-N 3.26Å
525	H	86.8	Confident	90.1	Very high	136 Å²	136	57.8 Å²	57.8	63%	0.63	30%	0.295	S	S	*	.	S	Bend	trans	-141.8	149.8	-176.5	-51.8	84.4	0	0	0	111.3	W521 T523	W521-H525 WeakPolarHBondContact CB-O 3.15Å; T523-H525 PolarHBondContact O-N 3.48Å; T523-H525 PolarHBondContact O-ND1 2.85Å; T523-H525 VanDerWaalsContact O-ND1 3.12Å; T523-H525 PolarHBondContact OG1-O 3.26Å
526	E	90.8	Very high	89.9	Confident	45 Å²	45	62.8 Å²	62.8	21%	0.21	32%	0.319	C	S	.	.			trans	-63.3	137.6	177.8	-175.3	173.7	-149.7	0	0	111.3	R515 W521 F528 L533	R515-E526 IonicContact CZ-OE1 3.58Å; R515-E526 IonicContact NH1-OE1 3.77Å; R515-E526 PolarHBondContact NH1-OE1 3.3Å; W521-E526 HydrophobicContact CH2-CG 4.41Å; W521-E526 HydrophobicContact CZ2-CB 4.23Å; W521-E526 HydrophobicContact CZ2-CG 3.7Å; E526-F528 VanDerWaalsContact O-CD2 3.25Å; E526-F528 WeakPolarHBondContact O-CD2 3.45Å; E526-F528 WeakPolarHBondContact O-CE2 3.28Å; E526-F528 PolarHBondContact O-N 2.79Å; E526-L533 HydrophobicContact CG-CD1 4.31Å
527	P	91.3	Very high	90	Very high	25 Å²	25	64 Å²	64	16%	0.162	32%	0.324	C	S	.	.			trans	-71.2	89.6	178.2	27.9	-34.7	0	0	0	111.4	W521 N529 D530 I545	W521-P527 VanDerWaalsContact CE3-CD 3.47Å; W521-P527 HydrophobicContact CE3-CG 4.18Å; W521-P527 HydrophobicContact CH2-CG 4.32Å; W521-P527 HydrophobicContact CZ3-CG 3.89Å; P527-N529 WeakPolarHBondContact CB-OD1 3.41Å; P527-N529 PolarHBondContact O-N 2.86Å; P527-D530 VanDerWaalsContact O-CB 3.3Å; P527-D530 WeakPolarHBondContact O-CB 3.34Å; P527-D530 PolarHBondContact O-N 3.24Å; P527-I545 HydrophobicContact CG-CD1 4.21Å
528	F	87.3	Confident	90	Very high	162 Å²	162	66.8 Å²	66.8	71%	0.711	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-15.4	178.9	-62.2	-71.5	0	0	0	114.3	E526 D530	E526-F528 VanDerWaalsContact O-CD2 3.25Å; E526-F528 WeakPolarHBondContact O-CD2 3.45Å; E526-F528 WeakPolarHBondContact O-CE2 3.28Å; E526-F528 PolarHBondContact O-N 2.79Å; F528-D530 VanDerWaalsContact C-N 3.31Å
529	N	88.6	Confident	89.8	Confident	106 Å²	106	69.4 Å²	69.4	57%	0.567	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-2.8	175.6	62.8	-35	0	0	0	114.2	P527	P527-N529 WeakPolarHBondContact CB-OD1 3.41Å; P527-N529 PolarHBondContact O-N 2.86Å
530	D	89.6	Confident	88.8	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	40%	0.396	C	S	.	.			trans	-59.5	121.2	178.6	-176.9	5.9	0	0	0	111.9	R493 P527 F528 A532 L533 F543	R493-D530 IonicContact CZ-OD1 3.53Å; R493-D530 IonicContact NE-OD1 3.67Å; R493-D530 PolarHBondContact NE-OD1 3.34Å; R493-D530 IonicContact NE-OD2 3.57Å; R493-D530 PolarHBondContact NE-OD2 2.91Å; R493-D530 IonicContact NH2-OD1 2.69Å; R493-D530 PolarHBondContact NH2-OD1 3Å; P527-D530 VanDerWaalsContact O-CB 3.3Å; P527-D530 WeakPolarHBondContact O-CB 3.34Å; P527-D530 PolarHBondContact O-N 3.24Å; F528-D530 VanDerWaalsContact C-N 3.31Å; D530-A532 PolarHBondContact O-N 3.48Å; D530-A532 VanDerWaalsContact OD1-CB 3.3Å; D530-A532 WeakPolarHBondContact OD1-CB 3.5Å; D530-A532 PolarHBondContact OD1-N 3.5Å; D530-L533 HydrophobicContact CB-CB 4.45Å; D530-L533 HydrophobicContact CB-CD1 4.24Å; D530-L533 HydrophobicContact CB-CG 4.43Å; D530-L533 PolarHBondContact O-N 3.21Å; D530-F543 HydrophobicContact CB-CE1 4.01Å; D530-F543 HydrophobicContact CB-CZ 4.11Å
531	P	88.6	Confident	87.9	Confident	9 Å²	9	82.2 Å²	82.2	6%	0.058	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-60.3	-29.4	175.7	25.9	-35.5	0	0	0	112.6	L533 R534 G535 E536 D538 F543	P531-L533 VanDerWaalsContact C-N 3.3Å; P531-L533 PolarHBondContact O-N 3.35Å; P531-R534 CarbonylContact O-C 3.49Å; P531-R534 PolarHBondContact O-N 3.43Å; P531-G535 PolarHBondContact O-N 2.96Å; P531-E536 CarbonylContact C-O 3.6Å; P531-E536 HydrophobicContact CB-CB 4.27Å; P531-E536 PolarHBondContact O-N 2.73Å; P531-D538 WeakPolarHBondContact CG-OD1 3.29Å; P531-F543 HydrophobicContact CG-CB 4.32Å; P531-F543 HydrophobicContact CG-CD2 4.4Å; P531-F543 HydrophobicContact CG-CG 4.33Å
532	A	90.3	Very high	87.2	Confident	1 Å²	1	83 Å²	83	1%	0.008	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-63.1	-35.3	178.7	0	0	0	0	0	112.5	R493 R497 D530 R534 G535	R493-A532 HydrophobicContact CB-CB 4.19Å; R497-A532 WeakPolarHBondContact CA-O 3.47Å; R497-A532 HydrophobicContact CB-CB 3.86Å; R497-A532 HydrophobicContact CG-CB 4.25Å; D530-A532 PolarHBondContact O-N 3.48Å; D530-A532 VanDerWaalsContact OD1-CB 3.3Å; D530-A532 WeakPolarHBondContact OD1-CB 3.5Å; D530-A532 PolarHBondContact OD1-N 3.5Å; A532-R534 PolarHBondContact O-N 3.45Å; A532-G535 PolarHBondContact O-N 3.19Å
533	L	90.4	Very high	87.1	Confident	38 Å²	38	80 Å²	80	20%	0.199	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-66.9	-18.3	174.6	-85.1	171.6	0	0	0	113.4	L496 I500 E526 D530 P531	L496-L533 HydrophobicContact CD2-CD2 4.14Å; I500-L533 WeakPolarHBondContact CD1-O 3.35Å; E526-L533 HydrophobicContact CG-CD1 4.31Å; D530-L533 HydrophobicContact CB-CB 4.45Å; D530-L533 HydrophobicContact CB-CD1 4.24Å; D530-L533 HydrophobicContact CB-CG 4.43Å; D530-L533 PolarHBondContact O-N 3.21Å; P531-L533 VanDerWaalsContact C-N 3.3Å; P531-L533 PolarHBondContact O-N 3.35Å
534	R	88.4	Confident	87	Confident	155 Å²	155	81.7 Å²	81.7	59%	0.585	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-97.7	-3.1	173.3	-66.1	-178.2	-76	171.4	-2.5	113.1	P531 A532 E536	P531-R534 CarbonylContact O-C 3.49Å; P531-R534 PolarHBondContact O-N 3.43Å; A532-R534 PolarHBondContact O-N 3.45Å; R534-E536 VanDerWaalsContact C-N 3.32Å
535	G	86.8	Confident	87.2	Confident	9 Å²	9	80.2 Å²	80.2	9%	0.093	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	4.7	-176.7	0	0	0	0	0	114.7	P531 A532	P531-G535 PolarHBondContact O-N 2.96Å; A532-G535 PolarHBondContact O-N 3.19Å
536	E	89.8	Confident	87.5	Confident	112 Å²	112	81.1 Å²	81.1	52%	0.523	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-91.1	153.4	-179.1	-63.9	179.9	-174.8	0	0	111.4	R497 P531 R534	R497-E536 WeakPolarHBondContact CD-O 3.31Å; P531-E536 CarbonylContact C-O 3.6Å; P531-E536 HydrophobicContact CB-CB 4.27Å; P531-E536 PolarHBondContact O-N 2.73Å; R534-E536 VanDerWaalsContact C-N 3.32Å
537	K	89.9	Confident	87.6	Confident	156 Å²	156	80.1 Å²	80.1	68%	0.678	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-75.3	158.7	175.5	-73.2	-170.5	173.8	-169.5	0	110.7
538	D	89.7	Confident	87.8	Confident	65 Å²	65	79.2 Å²	79.2	35%	0.348	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-58.9	146.6	173	-66.1	-9.2	0	0	0	111.4	R493 P531 F543	R493-D538 IonicContact CZ-OD1 3.23Å; R493-D538 IonicContact CZ-OD2 3.27Å; R493-D538 IonicContact NH1-OD1 3Å; R493-D538 IonicContact NH1-OD2 2.62Å; R493-D538 PolarHBondContact NH1-OD2 3.22Å; R493-D538 IonicContact NH2-OD1 3.89Å; R493-D538 PolarHBondContact NH2-OD1 3.08Å; R493-D538 IonicContact NH2-OD2 3.5Å; R493-D538 PolarHBondContact NH2-OD2 2.66Å; P531-D538 WeakPolarHBondContact CG-OD1 3.29Å; D538-F543 HydrophobicContact CB-CB 4.32Å
539	P	86.9	Confident	88	Confident	64 Å²	64	75 Å²	75	42%	0.416	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-62.3	162.6	176.8	28.4	-34.9	0	0	0	110.6	S541 G542	P539-S541 PolarHBondContact O-N 3.44Å; P539-G542 WeakPolarHBondContact CG-O 2.98Å; P539-G542 PolarHBondContact O-N 3.43Å
540	K	74.9	Confident	88.1	Confident	228 Å²	228	75.9 Å²	75.9	99%	0.991	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.6	179.6	-69	-172.5	179.5	-179.3	0	113.6
541	S	75.6	Confident	88.1	Confident	114 Å²	114	77.9 Å²	77.9	80%	0.797	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-3.7	174	55.8	0	0	0	0	114.5	P539	P539-S541 PolarHBondContact O-N 3.44Å
542	G	77.8	Confident	88.2	Confident	43 Å²	43	81.1 Å²	81.1	44%	0.443	41%	0.41	S	S	.	.			trans	81.9	159.2	-173.2	0	0	0	0	0	114	P539	P539-G542 WeakPolarHBondContact CG-O 2.98Å; P539-G542 PolarHBondContact O-N 3.43Å
543	F	88.4	Confident	88.2	Confident	46 Å²	46	82 Å²	82	20%	0.202	42%	0.419	C	S	.	.			trans	-120.5	116.5	167.2	-173.3	-90.6	0	0	0	107.9	D530 P531 D538 I545	D530-F543 HydrophobicContact CB-CE1 4.01Å; D530-F543 HydrophobicContact CB-CZ 4.11Å; P531-F543 HydrophobicContact CG-CB 4.32Å; P531-F543 HydrophobicContact CG-CD2 4.4Å; P531-F543 HydrophobicContact CG-CG 4.33Å; D538-F543 HydrophobicContact CB-CB 4.32Å; F543-I545 HydrophobicContact CD1-CG1 4.13Å; F543-I545 HydrophobicContact CE1-CD1 4.12Å; F543-I545 HydrophobicContact CE1-CG1 3.81Å
544	D	88.6	Confident	88.2	Confident	147 Å²	147	81.2 Å²	81.2	79%	0.786	42%	0.416	S	S	*	.			trans	-106.6	140.5	-173.8	-173.2	29	0	0	0	111.3
545	I	91.9	Very high	88.2	Confident	24 Å²	24	75.6 Å²	75.6	12%	0.123	40%	0.4	C	S	.	.			trans	-124.5	114.1	175.8	-58.4	-176	0	0	0	107.3	V490 W521 P527 F543 V547	V490-I545 HydrophobicContact CG2-CB 4.4Å; W521-I545 HydrophobicContact CZ3-CD1 4.28Å; W521-I545 HydrophobicContact CZ3-CG2 4.13Å; P527-I545 HydrophobicContact CG-CD1 4.21Å; F543-I545 HydrophobicContact CD1-CG1 4.13Å; F543-I545 HydrophobicContact CE1-CD1 4.12Å; F543-I545 HydrophobicContact CE1-CG1 3.81Å; I545-V547 PolarHBondContact O-N 3.49Å
546	K	91.7	Very high	88.1	Confident	155 Å²	155	76.3 Å²	76.3	67%	0.674	40%	0.404	S	S	*	.			trans	-75.2	111.8	172	-171.8	-174	177.7	-165.8	0	109.6
547	V	94.4	Very high	87.9	Confident	23 Å²	23	71 Å²	71	14%	0.139	38%	0.38	C	S	.	.			trans	-87.8	133.9	179	-173.9	0	0	0	0	110.2	Q485 D486 Q489 V490 I545	Q485-V547 HydrophobicContact CB-CG1 3.35Å; Q485-V547 HydrophobicContact CG-CG1 4.44Å; D486-V547 WeakPolarHBondContact OD1-CG1 3.22Å; Q489-V547 HydrophobicContact CB-CG2 4.36Å; V490-V547 HydrophobicContact CG2-CG2 3.64Å; I545-V547 PolarHBondContact O-N 3.49Å
548	P	93.8	Very high	87.9	Confident	7 Å²	7	65.9 Å²	65.9	5%	0.045	36%	0.358	C	S	.	.			trans	-63.9	162.6	175.3	18.1	-26.8	0	0	0	112.9	Y481 D520 E522	Y481-P548 HydrophobicContact CE1-CB 4.32Å; Y481-P548 HydrophobicContact CE1-CG 4.32Å; Y481-P548 WeakPolarHBondContact CE1-O 3.32Å; Y481-P548 WeakPolarHBondContact OH-CG 3.46Å; D520-P548 WeakPolarHBondContact O-CG 3.43Å; E522-P548 VanDerWaalsContact OE2-CB 3.28Å; E522-P548 WeakPolarHBondContact OE2-CB 3.4Å
549	R	93	Very high	88	Confident	72 Å²	72	63.3 Å²	63.3	27%	0.272	34%	0.344	S	S	.	.			trans	-124.6	118.7	167.7	-66.3	-61.3	178.8	-127.1	10.2	110.4	D384 A482 D486	D384-R549 IonicContact OD1-NE 3.78Å; D384-R549 PolarHBondContact OD1-NE 2.97Å; D384-R549 IonicContact OD2-CZ 3.48Å; D384-R549 VanDerWaalsContact OD2-CZ 3.31Å; D384-R549 IonicContact OD2-NE 3.67Å; D384-R549 PolarHBondContact OD2-NE 2.58Å; D384-R549 IonicContact OD2-NH2 2.75Å; D384-R549 PolarHBondContact OD2-NH2 3.14Å; A482-R549 VanDerWaalsContact CB-CZ 3.49Å; D486-R549 VanDerWaalsContact CG-NH2 3.3Å; D486-R549 IonicContact OD1-CZ 2.93Å; D486-R549 IonicContact OD1-NH1 2.74Å; D486-R549 PolarHBondContact OD1-NH1 3Å; D486-R549 IonicContact OD1-NH2 3.7Å; D486-R549 PolarHBondContact OD1-NH2 3.24Å; D486-R549 VanDerWaalsContact OD1-NH2 3.07Å; D486-R549 IonicContact OD2-CZ 3.85Å; D486-R549 IonicContact OD2-NH1 3.57Å; D486-R549 IonicContact OD2-NH2 2.77Å; D486-R549 PolarHBondContact OD2-NH2 2.89Å
550	R	90.3	Very high	88.1	Confident	126 Å²	126	61.3 Å²	61.3	48%	0.475	33%	0.328	S	S	.	.			trans	-128.9	148.1	177.6	-61.7	-173.1	-177	-85.5	3.2	110.4	H478 Y481 D520 V552	H478-R550 WeakPolarHBondContact CA-O 3.32Å; Y481-R550 WeakPolarHBondContact CB-O 3.37Å; Y481-R550 HydrophobicContact CD1-CB 3.95Å; Y481-R550 VanDerWaalsContact CD1-N 3.34Å; Y481-R550 HydrophobicContact CD2-CB 4.06Å; Y481-R550 HydrophobicContact CE1-CB 3.82Å; Y481-R550 HydrophobicContact CE1-CG 3.88Å; Y481-R550 HydrophobicContact CE2-CB 3.93Å; Y481-R550 HydrophobicContact CE2-CG 4.13Å; Y481-R550 HydrophobicContact CG-CB 4.06Å; D520-R550 IonicContact OD2-CZ 3.56Å; D520-R550 IonicContact OD2-NE 2.78Å; D520-R550 PolarHBondContact OD2-NE 3.07Å; D520-R550 IonicContact OD2-NH2 3.65Å; D520-R550 PolarHBondContact OD2-NH2 3.47Å; R550-V552 VanDerWaalsContact C-N 3.28Å; R550-V552 HydrophobicContact CB-CG1 4.05Å; R550-V552 PolarHBondContact O-N 2.85Å
551	A	89.6	Confident	88.7	Confident	42 Å²	42	50.9 Å²	50.9	35%	0.347	28%	0.283	S	S	.	.	S	Bend	trans	-91.2	52.1	175.6	0	0	0	0	0	111.8	H474 R477	H474-A551 WeakPolarHBondContact CE1-CB 3.43Å; H474-A551 WeakPolarHBondContact ND1-CB 3.21Å; R477-A551 WeakPolarHBondContact CB-O 3.38Å
552	V	89.9	Confident	89.5	Confident	77 Å²	77	45.4 Å²	45.4	47%	0.467	25%	0.245	S	C	.	.			trans	-142	131.7	177.6	66.7	0	0	0	0	111	Y481 R550	Y481-V552 WeakPolarHBondContact CB-O 3.37Å; Y481-V552 HydrophobicContact CD2-CG1 4.33Å; Y481-V552 WeakPolarHBondContact CD2-O 3.39Å; R550-V552 VanDerWaalsContact C-N 3.28Å; R550-V552 HydrophobicContact CB-CG1 4.05Å; R550-V552 PolarHBondContact O-N 2.85Å
553	G	89.8	Confident	90.2	Very high	18 Å²	18	45.1 Å²	45.1	19%	0.186	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-75.5	166	174.7	0	0	0	0	0	112.7
554	P	91.1	Very high	90.3	Very high	22 Å²	22	43.1 Å²	43.1	14%	0.143	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-64.9	157.9	168.3	30.9	-36.3	0	0	0	111	V480 L484 Q558 L559	V480-P554 VanDerWaalsContact CG1-CD 3.47Å; V480-P554 HydrophobicContact CG1-CG 4.24Å; L484-P554 HydrophobicContact CD2-CB 3.72Å; L484-P554 HydrophobicContact CD2-CG 3.94Å; P554-Q558 HydrophobicContact CB-CB 3.92Å; P554-L559 HydrophobicContact CB-CB 4.47Å; P554-L559 HydrophobicContact CG-CB 4.04Å; P554-L559 HydrophobicContact CG-CD1 4.35Å
555	S	88.3	Confident	90.4	Very high	37 Å²	37	36.1 Å²	36.1	26%	0.259	19%	0.185	S	C	.	.	P	Polyproline II helix	trans	-64.3	160.9	166.6	67.3	0	0	0	0	111.2	T557 Q558 L559	S555-T557 VanDerWaalsContact C-N 3.25Å; S555-T557 PolarHBondContact O-N 3.02Å; S555-T557 PolarHBondContact OG-OG1 3.27Å; S555-Q558 PolarHBondContact O-N 3.07Å; S555-Q558 WeakPolarHBondContact OG-CB 3.33Å; S555-Q558 VanDerWaalsContact OG-CG 3.25Å; S555-Q558 WeakPolarHBondContact OG-CG 3.29Å; S555-Q558 PolarHBondContact OG-N 3.45Å; S555-Q558 VanDerWaalsContact OG-N 3.16Å; S555-Q558 PolarHBondContact OG-OE1 2.88Å; S555-L559 PolarHBondContact O-N 2.76Å
556	S	85.2	Confident	90.4	Very high	24 Å²	24	35 Å²	35	17%	0.168	18%	0.179	C	C	.	.	H	α-helix	trans	-57.5	-39.1	175.5	56.6	0	0	0	0	112	T44 Y560	T44-S556 PolarHBondContact OG1-OG 3.47Å; S556-Y560 VanDerWaalsContact O-CB 3.24Å; S556-Y560 WeakPolarHBondContact O-CB 3.19Å; S556-Y560 PolarHBondContact O-N 3.44Å
557	T	85.5	Confident	90.5	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-51	173.2	43.6	0	0	0	0	112.5	F46 D48 F52 S555 L559 Y560 M561	F46-T557 VanDerWaalsContact CA-CG2 3.47Å; F46-T557 HydrophobicContact CB-CG2 3.91Å; F46-T557 HydrophobicContact CD1-CG2 3.91Å; F46-T557 HydrophobicContact CG-CG2 4.43Å; D48-T557 VanDerWaalsContact CG-CG2 3.49Å; D48-T557 WeakPolarHBondContact OD1-CG2 3.19Å; D48-T557 PolarHBondContact OD1-OG1 3Å; D48-T557 PolarHBondContact OD2-OG1 3.34Å; F52-T557 WeakPolarHBondContact CE2-OG1 3.24Å; S555-T557 VanDerWaalsContact C-N 3.25Å; S555-T557 PolarHBondContact O-N 3.02Å; S555-T557 PolarHBondContact OG-OG1 3.27Å; T557-L559 VanDerWaalsContact C-N 3.34Å; T557-L559 PolarHBondContact O-N 3.03Å; T557-Y560 PolarHBondContact O-N 3.14Å; T557-M561 VanDerWaalsContact O-CB 3.3Å; T557-M561 WeakPolarHBondContact O-CB 3.21Å; T557-M561 WeakPolarHBondContact O-CG 3.48Å; T557-M561 PolarHBondContact O-N 3.23Å
558	Q	89.4	Confident	90.2	Very high	48 Å²	48	27.4 Å²	27.4	22%	0.224	15%	0.145	C	C	.	.	H	α-helix	trans	-57.3	-49.6	179.8	-79	176.6	-39	0	0	110.8	F52 T517 V518 P554 S555 M561 V562	F52-Q558 HydrophobicContact CE1-CG 3.87Å; F52-Q558 HydrophobicContact CZ-CG 3.75Å; T517-Q558 HydrophobicContact CG2-CG 4.25Å; T517-Q558 PolarHBondContact O-NE2 2.98Å; T517-Q558 VanDerWaalsContact O-NE2 3.15Å; V518-Q558 HydrophobicContact CG1-CB 3.89Å; V518-Q558 HydrophobicContact CG1-CG 4.1Å; P554-Q558 HydrophobicContact CB-CB 3.92Å; S555-Q558 PolarHBondContact O-N 3.07Å; S555-Q558 WeakPolarHBondContact OG-CB 3.33Å; S555-Q558 VanDerWaalsContact OG-CG 3.25Å; S555-Q558 WeakPolarHBondContact OG-CG 3.29Å; S555-Q558 PolarHBondContact OG-N 3.45Å; S555-Q558 VanDerWaalsContact OG-N 3.16Å; S555-Q558 PolarHBondContact OG-OE1 2.88Å; Q558-M561 PolarHBondContact O-N 3.42Å; Q558-V562 WeakPolarHBondContact O-CB 3.29Å; Q558-V562 VanDerWaalsContact O-CG2 3.26Å; Q558-V562 WeakPolarHBondContact O-CG2 3.07Å; Q558-V562 PolarHBondContact O-N 3.09Å
559	L	91.9	Very high	90.1	Very high	10 Å²	10	27 Å²	27	5%	0.052	14%	0.143	C	C	.	.	H	α-helix	trans	-65	-43.5	-179	-173.7	60.7	0	0	0	111.8	P554 S555 T557 R563 Y602	P554-L559 HydrophobicContact CB-CB 4.47Å; P554-L559 HydrophobicContact CG-CB 4.04Å; P554-L559 HydrophobicContact CG-CD1 4.35Å; S555-L559 PolarHBondContact O-N 2.76Å; T557-L559 VanDerWaalsContact C-N 3.34Å; T557-L559 PolarHBondContact O-N 3.03Å; L559-R563 HydrophobicContact CD1-CG 4.16Å; L559-R563 HydrophobicContact CG-CG 4.47Å; L559-R563 WeakPolarHBondContact O-CB 3.49Å; L559-R563 WeakPolarHBondContact O-CG 3.28Å; L559-R563 PolarHBondContact O-N 3.44Å; L559-Y602 HydrophobicContact CD1-CD2 4.17Å
560	Y	89.1	Confident	90	Very high	22 Å²	22	24.6 Å²	24.6	9%	0.086	14%	0.135	C	C	.	.	H	α-helix	trans	-61.5	-46.5	176.6	177.5	-97	0	0	0	112.3	F46 A63 H66 A156 S556 T557 R563 T564	F46-Y560 HydrophobicContact CD1-CD1 4.34Å; F46-Y560 HydrophobicContact CD1-CG 4.28Å; F46-Y560 AromaticContact CE1-CD1 3.93Å; F46-Y560 HydrophobicContact CE1-CD1 3.93Å; F46-Y560 AromaticContact CE1-CD2 3.95Å; F46-Y560 HydrophobicContact CE1-CD2 3.95Å; F46-Y560 AromaticContact CE1-CG 3.46Å; F46-Y560 HydrophobicContact CE1-CG 3.46Å; F46-Y560 VanDerWaalsContact CE1-CG 3.46Å; F46-Y560 HydrophobicContact CE2-CD2 4.49Å; F46-Y560 HydrophobicContact CZ-CD1 4.11Å; F46-Y560 AromaticContact CZ-CD2 3.61Å; F46-Y560 HydrophobicContact CZ-CD2 3.61Å; F46-Y560 HydrophobicContact CZ-CE2 4.14Å; F46-Y560 AromaticContact CZ-CG 3.6Å; F46-Y560 HydrophobicContact CZ-CG 3.6Å; A63-Y560 HydrophobicContact CB-CD1 4.29Å; A63-Y560 HydrophobicContact CB-CE1 3.73Å; H66-Y560 AromaticContact ND1-CE2 3.66Å; H66-Y560 AromaticContact ND1-CZ 3.71Å; H66-Y560 PolarHBondContact ND1-OH 3.29Å; A156-Y560 HydrophobicContact CB-CE2 4.23Å; S556-Y560 VanDerWaalsContact O-CB 3.24Å; S556-Y560 WeakPolarHBondContact O-CB 3.19Å; S556-Y560 PolarHBondContact O-N 3.44Å; T557-Y560 PolarHBondContact O-N 3.14Å; Y560-R563 PolarHBondContact O-N 2.92Å; Y560-T564 VanDerWaalsContact O-CB 3.24Å; Y560-T564 WeakPolarHBondContact O-CB 3.44Å; Y560-T564 PolarHBondContact O-N 3.1Å; Y560-T564 PolarHBondContact O-OG1 2.9Å
561	M	87.4	Confident	89.7	Confident	9 Å²	9	19.8 Å²	19.8	4%	0.044	12%	0.122	C	C	.	.	H	α-helix	trans	-64.8	-45.7	-179.3	-71.1	-64.7	-71.5	0	0	111.4	I60 T557 Q558 M565	I60-M561 HydrophobicContact CG1-CE 4.03Å; T557-M561 VanDerWaalsContact O-CB 3.3Å; T557-M561 WeakPolarHBondContact O-CB 3.21Å; T557-M561 WeakPolarHBondContact O-CG 3.48Å; T557-M561 PolarHBondContact O-N 3.23Å; Q558-M561 PolarHBondContact O-N 3.42Å; M561-M565 HydrophobicContact CB-CE 4.16Å; M561-M565 VanDerWaalsContact O-CB 3.3Å; M561-M565 WeakPolarHBondContact O-CB 3.37Å; M561-M565 WeakPolarHBondContact O-CE 3.47Å; M561-M565 VanDerWaalsContact O-CG 3.29Å; M561-M565 WeakPolarHBondContact O-CG 3.27Å; M561-M565 PolarHBondContact O-N 3.44Å
562	V	92	Very high	88.6	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.5	-51.2	176.5	170	0	0	0	0	110.8	L484 I514 V518 Q558 T564 M565 L566 F595	L484-V562 HydrophobicContact CD1-CG1 4.3Å; I514-V562 HydrophobicContact CG2-CG1 4.24Å; I514-V562 HydrophobicContact CG2-CG2 4.21Å; V518-V562 HydrophobicContact CB-CG2 4.36Å; V518-V562 HydrophobicContact CG1-CG2 3.43Å; V518-V562 VanDerWaalsContact CG1-CG2 3.43Å; V518-V562 HydrophobicContact CG2-CG2 3.99Å; Q558-V562 WeakPolarHBondContact O-CB 3.29Å; Q558-V562 VanDerWaalsContact O-CG2 3.26Å; Q558-V562 WeakPolarHBondContact O-CG2 3.07Å; Q558-V562 PolarHBondContact O-N 3.09Å; V562-T564 PolarHBondContact O-N 3.11Å; V562-M565 PolarHBondContact O-N 3.48Å; V562-L566 HydrophobicContact CG1-CD1 3.7Å; V562-L566 HydrophobicContact CG1-CG 4.31Å; V562-L566 WeakPolarHBondContact O-CB 3.47Å; V562-L566 VanDerWaalsContact O-CG 3.24Å; V562-L566 WeakPolarHBondContact O-CG 3.45Å; V562-L566 PolarHBondContact O-N 3.1Å; V562-F595 HydrophobicContact CG1-CE1 4.18Å
563	R	93.1	Very high	87.1	Confident	37 Å²	37	25.5 Å²	25.5	14%	0.14	14%	0.139	C	C	.	.	H	α-helix	trans	-59.9	-49.1	-179.8	-72.1	175.2	57	68.7	8.4	111.5	L559 Y560 M565 L566 E567 H596 S599 F600	L559-R563 HydrophobicContact CD1-CG 4.16Å; L559-R563 HydrophobicContact CG-CG 4.47Å; L559-R563 WeakPolarHBondContact O-CB 3.49Å; L559-R563 WeakPolarHBondContact O-CG 3.28Å; L559-R563 PolarHBondContact O-N 3.44Å; Y560-R563 PolarHBondContact O-N 2.92Å; R563-M565 VanDerWaalsContact C-N 3.35Å; R563-M565 PolarHBondContact O-N 3.26Å; R563-L566 PolarHBondContact O-N 3.44Å; R563-E567 VanDerWaalsContact O-CB 3.26Å; R563-E567 WeakPolarHBondContact O-CB 3.49Å; R563-E567 PolarHBondContact O-N 2.77Å; R563-H596 PolarHBondContact NH1-O 3.34Å; R563-S599 PolarHBondContact NH1-O 2.84Å; R563-S599 PolarHBondContact NH1-OG 3.3Å; R563-F600 VanDerWaalsContact NH1-N 3.17Å
564	T	90.8	Very high	85.1	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.018	14%	0.143	C	C	.	.	H	α-helix	trans	-61.7	-40.6	-179.5	-55.9	0	0	0	0	112.3	Y59 F152 Y560 V562 S568	Y59-T564 HydrophobicContact CD1-CG2 3.78Å; Y59-T564 HydrophobicContact CE1-CG2 4.15Å; F152-T564 HydrophobicContact CE1-CG2 4.15Å; Y560-T564 VanDerWaalsContact O-CB 3.24Å; Y560-T564 WeakPolarHBondContact O-CB 3.44Å; Y560-T564 PolarHBondContact O-N 3.1Å; Y560-T564 PolarHBondContact O-OG1 2.9Å; V562-T564 PolarHBondContact O-N 3.11Å; T564-S568 PolarHBondContact O-N 3.39Å; T564-S568 VanDerWaalsContact O-N 3.15Å
565	M	90.2	Very high	82.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68	-43.4	176.7	-76.6	-170.5	-74.8	0	0	111.8	Y59 V510 A513 I514 M561 V562 R563 S568 L569	Y59-M565 HydrophobicContact CD2-CG 4.02Å; Y59-M565 HydrophobicContact CE2-CG 3.96Å; Y59-M565 HydrophobicContact CG-CG 4.37Å; V510-M565 HydrophobicContact CG1-CB 3.87Å; V510-M565 HydrophobicContact CG1-CG 4.35Å; A513-M565 HydrophobicContact CB-CE 4.48Å; A513-M565 HydrophobicContact CB-SD 3.75Å; I514-M565 HydrophobicContact CB-CE 4.44Å; I514-M565 HydrophobicContact CD1-CB 3.86Å; I514-M565 HydrophobicContact CG1-CB 3.76Å; I514-M565 HydrophobicContact CG1-CE 3.67Å; I514-M565 HydrophobicContact CG1-SD 4.01Å; M561-M565 HydrophobicContact CB-CE 4.16Å; M561-M565 VanDerWaalsContact O-CB 3.3Å; M561-M565 WeakPolarHBondContact O-CB 3.37Å; M561-M565 WeakPolarHBondContact O-CE 3.47Å; M561-M565 VanDerWaalsContact O-CG 3.29Å; M561-M565 WeakPolarHBondContact O-CG 3.27Å; M561-M565 PolarHBondContact O-N 3.44Å; V562-M565 PolarHBondContact O-N 3.48Å; R563-M565 VanDerWaalsContact C-N 3.35Å; R563-M565 PolarHBondContact O-N 3.26Å; M565-S568 PolarHBondContact O-N 3.27Å; M565-S568 PolarHBondContact O-OG 2.96Å; M565-L569 PolarHBondContact O-N 3.35Å
566	L	92.8	Very high	81.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.2	-43.8	175.8	-71.8	174.3	0	0	0	111.9	F487 I514 V562 R563 S568 L569 I570 I592 F595	F487-L566 HydrophobicContact CE1-CD1 3.59Å; F487-L566 HydrophobicContact CE1-CD2 3.78Å; F487-L566 HydrophobicContact CE1-CG 4.32Å; F487-L566 HydrophobicContact CZ-CD1 4.01Å; F487-L566 HydrophobicContact CZ-CD2 3.88Å; I514-L566 HydrophobicContact CD1-CD2 3.55Å; I514-L566 HydrophobicContact CD1-CG 3.85Å; V562-L566 HydrophobicContact CG1-CD1 3.7Å; V562-L566 HydrophobicContact CG1-CG 4.31Å; V562-L566 WeakPolarHBondContact O-CB 3.47Å; V562-L566 VanDerWaalsContact O-CG 3.24Å; V562-L566 WeakPolarHBondContact O-CG 3.45Å; V562-L566 PolarHBondContact O-N 3.1Å; R563-L566 PolarHBondContact O-N 3.44Å; L566-S568 PolarHBondContact O-N 3.1Å; L566-L569 HydrophobicContact CD2-CD1 4.34Å; L566-L569 WeakPolarHBondContact O-CB 3.17Å; L566-L569 PolarHBondContact O-N 3.22Å; L566-I570 PolarHBondContact O-N 3.01Å; L566-I592 HydrophobicContact CB-CG2 3.92Å; L566-I592 HydrophobicContact CD2-CG1 4.32Å; L566-I592 HydrophobicContact CD2-CG2 3.89Å; L566-I592 HydrophobicContact CG-CG2 4.38Å; L566-F595 HydrophobicContact CD1-CD1 3.67Å; L566-F595 HydrophobicContact CD1-CE1 4.03Å
567	E	92.4	Very high	79.5	Confident	12 Å²	12	38.8 Å²	38.8	6%	0.056	21%	0.208	C	C	.	.	H	α-helix	trans	-54.8	-42.9	175.8	-163.1	-162.9	136.1	0	0	110.7	F152 S154 E155 R563 L569 I570 A571	F152-E567 HydrophobicContact CE2-CB 4.18Å; F152-E567 HydrophobicContact CE2-CG 3.81Å; F152-E567 VanDerWaalsContact CE2-OE1 3.24Å; F152-E567 WeakPolarHBondContact CE2-OE1 3.44Å; F152-E567 HydrophobicContact CZ-CB 3.83Å; F152-E567 VanDerWaalsContact CZ-CD 3.46Å; F152-E567 HydrophobicContact CZ-CG 3.8Å; F152-E567 VanDerWaalsContact CZ-OE1 3.28Å; F152-E567 WeakPolarHBondContact CZ-OE1 3.47Å; S154-E567 VanDerWaalsContact CA-OE1 3.29Å; S154-E567 WeakPolarHBondContact CA-OE1 3.42Å; S154-E567 PolarHBondContact OG-OE2 3.48Å; E155-E567 VanDerWaalsContact CG-OE1 3.3Å; E155-E567 WeakPolarHBondContact CG-OE1 3.49Å; E155-E567 PolarHBondContact N-OE1 3.36Å; E155-E567 PolarHBondContact N-OE2 2.78Å; R563-E567 VanDerWaalsContact O-CB 3.26Å; R563-E567 WeakPolarHBondContact O-CB 3.49Å; R563-E567 PolarHBondContact O-N 2.77Å; E567-L569 VanDerWaalsContact C-N 3.27Å; E567-L569 PolarHBondContact O-N 3.05Å; E567-I570 WeakPolarHBondContact O-CG1 3.18Å; E567-I570 PolarHBondContact O-N 3.26Å; E567-A571 WeakPolarHBondContact O-CB 3.22Å; E567-A571 PolarHBondContact O-N 2.66Å
568	S	89.6	Confident	78.7	Confident	7 Å²	7	46 Å²	46	5%	0.049	24%	0.239	C	C	.	.	H	α-helix	trans	-65.4	-25.5	177.4	79.2	0	0	0	0	114.4	Y59 T564 M565 L566	Y59-S568 WeakPolarHBondContact OH-CB 3.38Å; Y59-S568 PolarHBondContact OH-OG 2.95Å; T564-S568 PolarHBondContact O-N 3.39Å; T564-S568 VanDerWaalsContact O-N 3.15Å; M565-S568 PolarHBondContact O-N 3.27Å; M565-S568 PolarHBondContact O-OG 2.96Å; L566-S568 PolarHBondContact O-N 3.1Å
569	L	89.8	Confident	78.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-74.9	-33.9	175.8	-67.7	175.3	0	0	0	112.2	I507 V510 L511 M565 L566 E567 L580 R581 L584 I592	I507-L569 HydrophobicContact CG1-CD2 4.37Å; I507-L569 HydrophobicContact CG2-CD2 4.26Å; V510-L569 HydrophobicContact CB-CD2 4.16Å; V510-L569 HydrophobicContact CG1-CD1 4.14Å; V510-L569 HydrophobicContact CG1-CD2 4.04Å; V510-L569 HydrophobicContact CG1-CG 4Å; L511-L569 HydrophobicContact CD2-CD1 3.64Å; L511-L569 HydrophobicContact CG-CD1 4.26Å; M565-L569 PolarHBondContact O-N 3.35Å; L566-L569 HydrophobicContact CD2-CD1 4.34Å; L566-L569 WeakPolarHBondContact O-CB 3.17Å; L566-L569 PolarHBondContact O-N 3.22Å; E567-L569 VanDerWaalsContact C-N 3.27Å; E567-L569 PolarHBondContact O-N 3.05Å; L569-L580 HydrophobicContact CD2-CD1 4.32Å; L569-R581 VanDerWaalsContact O-CA 3.25Å; L569-R581 WeakPolarHBondContact O-CA 3.25Å; L569-R581 PolarHBondContact O-N 2.98Å; L569-R581 VanDerWaalsContact O-N 3.07Å; L569-L584 HydrophobicContact CB-CD1 4.07Å; L569-I592 HydrophobicContact CD1-CD1 4.29Å
570	I	91	Very high	77.9	Confident	21 Å²	21	46.8 Å²	46.8	11%	0.108	25%	0.246	C	C	.	.	H	α-helix	trans	-97.4	-4.2	-177	60.1	172	0	0	0	113.5	L566 E567 R581 I589 I592 E593 H596	L566-I570 PolarHBondContact O-N 3.01Å; E567-I570 WeakPolarHBondContact O-CG1 3.18Å; E567-I570 PolarHBondContact O-N 3.26Å; I570-R581 WeakPolarHBondContact O-CD 3.36Å; I570-R581 PolarHBondContact O-NH1 3.38Å; I570-I589 HydrophobicContact CG2-CG2 4.38Å; I570-I592 HydrophobicContact CD1-CG2 4.38Å; I570-I592 HydrophobicContact CG2-CB 3.87Å; I570-I592 HydrophobicContact CG2-CD1 4.46Å; I570-I592 HydrophobicContact CG2-CG2 3.5Å; I570-E593 HydrophobicContact CD1-CG 3.9Å; I570-E593 HydrophobicContact CG2-CG 4.31Å; I570-H596 HydrophobicContact CD1-CB 4.44Å
571	A	85.4	Confident	77.8	Confident	25 Å²	25	48.5 Å²	48.5	21%	0.207	25%	0.252	C	S	.	.			trans	-65.7	130.6	179.1	0	0	0	0	0	113.2	F152 E567	F152-A571 HydrophobicContact CD2-CB 3.64Å; F152-A571 HydrophobicContact CE2-CB 4.07Å; E567-A571 WeakPolarHBondContact O-CB 3.22Å; E567-A571 PolarHBondContact O-N 2.66Å
572	D	66.8	Low	77.6	Confident	121 Å²	121	51.5 Å²	51.5	65%	0.647	27%	0.274	S	S	*	.			trans	-82.6	-15.1	177.2	-79.3	-41.6	0	0	0	113.7	S574 T579 R581	D572-S574 PolarHBondContact O-N 3.43Å; D572-T579 WeakPolarHBondContact O-CG2 3.25Å; D572-R581 WeakPolarHBondContact OD1-CD 3.43Å; D572-R581 IonicContact OD1-NE 3.36Å; D572-R581 PolarHBondContact OD1-NE 2.85Å
573	K	57.7	Low	77.1	Confident	118 Å²	118	52.8 Å²	52.8	51%	0.513	28%	0.283	S	S	.	.			trans	-93.5	96.9	-179.1	-73.5	179.8	176.7	171.3	0	111.4	D240	D240-K573 IonicContact OD1-NZ 2.76Å; D240-K573 PolarHBondContact OD1-NZ 3.16Å; D240-K573 IonicContact OD2-NZ 2.59Å; D240-K573 PolarHBondContact OD2-NZ 3.42Å
574	S	47.3	Very low	76.8	Confident	40 Å²	40	52 Å²	52	28%	0.28	28%	0.281	S	S	.	.			trans	-132.8	129.7	150.7	85.4	0	0	0	0	107.6	K150 D572 S576 T579	K150-S574 CarbonylContact O-C 3.6Å; K150-S574 VanDerWaalsContact O-CA 3.27Å; K150-S574 WeakPolarHBondContact O-CA 3.46Å; D572-S574 PolarHBondContact O-N 3.43Å; S574-S576 PolarHBondContact O-N 2.8Å; S574-S576 PolarHBondContact OG-OG 3.42Å; S574-T579 WeakPolarHBondContact OG-CG2 3.3Å
575	G	45.2	Very low	76.4	Confident	47 Å²	47	55.8 Å²	55.8	49%	0.485	30%	0.299	S	S	.	.	S	Bend	trans	-71.3	23.9	176.8	0	0	0	0	0	114.8	K150	K150-G575 PolarHBondContact O-N 3.45Å
576	S	50.7	Low	76	Confident	68 Å²	68	58 Å²	58	48%	0.476	32%	0.322	S	S	.	.	S	Bend	trans	-105.4	153.5	172.6	83.6	0	0	0	0	109.8	S574 K578	S574-S576 PolarHBondContact O-N 2.8Å; S574-S576 PolarHBondContact OG-OG 3.42Å; S576-K578 PolarHBondContact O-N 2.8Å; S576-K578 PolarHBondContact OG-N 3.2Å; S576-K578 PolarHBondContact OG-O 3.1Å
577	K	51.4	Low	75.7	Confident	225 Å²	225	62.2 Å²	62.2	98%	0.978	35%	0.349	S	S	*	.	S	Bend	trans	-62.2	-6.7	176.2	-83.4	-177	175.2	178.9	0	114.2
578	K	69.6	Low	75.6	Confident	153 Å²	153	62 Å²	62	67%	0.665	35%	0.349	S	S	*	.	S	Bend	trans	-140.6	104.2	-179.8	-74.5	-170.3	177.5	179.8	0	111.7	S576	S576-K578 PolarHBondContact O-N 2.8Å; S576-K578 PolarHBondContact OG-N 3.2Å; S576-K578 PolarHBondContact OG-O 3.1Å
579	T	80.8	Confident	75.5	Confident	23 Å²	23	62.6 Å²	62.6	14%	0.141	35%	0.351	C	S	.	.			trans	-73.2	163	170.5	57.8	0	0	0	0	111.5	D572 S574 R581 S582	D572-T579 WeakPolarHBondContact O-CG2 3.25Å; S574-T579 WeakPolarHBondContact OG-CG2 3.3Å; T579-R581 VanDerWaalsContact C-N 3.27Å; T579-R581 PolarHBondContact O-N 2.74Å; T579-S582 PolarHBondContact N-OG 3.24Å; T579-S582 PolarHBondContact O-N 2.97Å; T579-S582 PolarHBondContact O-OG 3.36Å; T579-S582 WeakPolarHBondContact OG1-CB 3.44Å; T579-S582 PolarHBondContact OG1-N 3.5Å; T579-S582 VanDerWaalsContact OG1-N 3.16Å
580	L	84.1	Confident	75.5	Confident	52 Å²	52	68 Å²	68	27%	0.272	38%	0.379	S	S	.	.	S	Bend	trans	-60.4	-40.8	172.3	-62.6	-179.3	0	0	0	111	V506 I507 L569 S582 S583	V506-L580 HydrophobicContact CB-CD2 4.3Å; V506-L580 HydrophobicContact CG1-CD2 3.76Å; I507-L580 HydrophobicContact CG1-CD2 4.1Å; L569-L580 HydrophobicContact CD2-CD1 4.32Å; L580-S582 VanDerWaalsContact C-N 3.34Å; L580-S582 PolarHBondContact O-N 3.37Å; L580-S583 PolarHBondContact O-N 3.19Å
581	R	85.6	Confident	75.6	Confident	57 Å²	57	70.4 Å²	70.4	22%	0.215	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-54.1	-45.5	174.5	-168.9	-168.6	-179.2	76.5	3.4	112.8	L569 I570 D572 T579 S583 L584 I589 E593	L569-R581 VanDerWaalsContact O-CA 3.25Å; L569-R581 WeakPolarHBondContact O-CA 3.25Å; L569-R581 PolarHBondContact O-N 2.98Å; L569-R581 VanDerWaalsContact O-N 3.07Å; I570-R581 WeakPolarHBondContact O-CD 3.36Å; I570-R581 PolarHBondContact O-NH1 3.38Å; D572-R581 WeakPolarHBondContact OD1-CD 3.43Å; D572-R581 IonicContact OD1-NE 3.36Å; D572-R581 PolarHBondContact OD1-NE 2.85Å; T579-R581 VanDerWaalsContact C-N 3.27Å; T579-R581 PolarHBondContact O-N 2.74Å; R581-S583 PolarHBondContact O-N 3.31Å; R581-L584 PolarHBondContact O-N 3.44Å; R581-I589 HydrophobicContact CG-CD1 3.9Å; R581-I589 HydrophobicContact CG-CG1 4.49Å; R581-I589 VanDerWaalsContact CZ-CG2 3.48Å; R581-I589 VanDerWaalsContact NH1-CG2 3.34Å; R581-E593 IonicContact CZ-OE1 3.08Å; R581-E593 IonicContact NH1-OE1 3.99Å; R581-E593 PolarHBondContact NH1-OE1 3.28Å; R581-E593 IonicContact NH2-OE1 2.66Å; R581-E593 PolarHBondContact NH2-OE1 3.07Å
582	S	83.5	Confident	76	Confident	72 Å²	72	69.3 Å²	69.3	50%	0.503	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-62.4	-14.1	-179.9	72.9	0	0	0	0	114.5	T579 L580	T579-S582 PolarHBondContact N-OG 3.24Å; T579-S582 PolarHBondContact O-N 2.97Å; T579-S582 PolarHBondContact O-OG 3.36Å; T579-S582 WeakPolarHBondContact OG1-CB 3.44Å; T579-S582 PolarHBondContact OG1-N 3.5Å; T579-S582 VanDerWaalsContact OG1-N 3.16Å; L580-S582 VanDerWaalsContact C-N 3.34Å; L580-S582 PolarHBondContact O-N 3.37Å
583	S	82.4	Confident	77.2	Confident	27 Å²	27	65.5 Å²	65.5	19%	0.189	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-103.1	2	178.8	-71.5	0	0	0	0	113.8	K504 L580 R581	K504-S583 PolarHBondContact NZ-OG 3.06Å; L580-S583 PolarHBondContact O-N 3.19Å; R581-S583 PolarHBondContact O-N 3.31Å
584	L	85.8	Confident	78.9	Confident	20 Å²	20	65.5 Å²	65.5	11%	0.105	36%	0.362	C	S	.	.	S	Bend	trans	-99.5	159.4	173.1	-67.8	171.6	0	0	0	110.8	P495 I507 L569 R581 I589 I592	P495-L584 HydrophobicContact CB-CD2 4.46Å; I507-L584 HydrophobicContact CD1-CD2 4.14Å; I507-L584 HydrophobicContact CD1-CG 4.2Å; I507-L584 HydrophobicContact CG2-CD2 3.88Å; L569-L584 HydrophobicContact CB-CD1 4.07Å; R581-L584 PolarHBondContact O-N 3.44Å; L584-I589 HydrophobicContact CB-CD1 4Å; L584-I589 HydrophobicContact CB-CG1 3.67Å; L584-I589 HydrophobicContact CD1-CG1 4.36Å; L584-I592 HydrophobicContact CD1-CD1 4.12Å
585	E	82.2	Confident	81.2	Confident	84 Å²	84	64.2 Å²	64.2	39%	0.393	35%	0.351	S	S	.	.			trans	-90.3	151.4	176.6	-77.2	-172.1	-174.9	0	0	111.8	Q498 K502 T588 I589	Q498-E585 VanDerWaalsContact NE2-CD 3.28Å; Q498-E585 PolarHBondContact NE2-OE2 2.79Å; Q498-E585 PolarHBondContact OE1-OE1 2.99Å; Q498-E585 PolarHBondContact OE1-OE2 3.24Å; K502-E585 IonicContact NZ-OE1 2.66Å; K502-E585 PolarHBondContact NZ-OE1 2.82Å; E585-T588 PolarHBondContact N-OG1 3.4Å; E585-T588 PolarHBondContact O-N 3.35Å; E585-T588 VanDerWaalsContact O-N 3.09Å; E585-T588 PolarHBondContact O-OG1 3.21Å; E585-I589 WeakPolarHBondContact O-CG1 3.48Å; E585-I589 PolarHBondContact O-N 3.46Å; E585-I589 VanDerWaalsContact O-N 3.07Å
586	G	82.7	Confident	83.6	Confident	47 Å²	47	62.7 Å²	62.7	49%	0.485	33%	0.331	S	S	.	.	H	α-helix	trans	-48.4	-52.8	-174.8	0	0	0	0	0	114.5	T588 I589 L590	G586-T588 PolarHBondContact O-N 3.36Å; G586-I589 PolarHBondContact O-N 3.05Å; G586-L590 PolarHBondContact O-N 3.4Å
587	P	86.9	Confident	85.6	Confident	88 Å²	88	66.3 Å²	66.3	57%	0.571	33%	0.334	S	S	*	.	H	α-helix	trans	-59.7	-43.2	178.8	-25.5	35.4	0	0	0	113.3	I589 L590 D591	P587-I589 VanDerWaalsContact C-N 3.29Å; P587-I589 PolarHBondContact O-N 2.78Å; P587-L590 WeakPolarHBondContact O-CB 3.43Å; P587-L590 PolarHBondContact O-N 3.03Å; P587-L590 VanDerWaalsContact O-N 3.14Å; P587-D591 PolarHBondContact O-N 2.87Å
588	T	88.6	Confident	87.6	Confident	8 Å²	8	59 Å²	59	5%	0.049	30%	0.303	C	S	.	.	H	α-helix	trans	-66.5	-30.9	-179.5	58.6	0	0	0	0	113	E494 P495 E585 G586 I592	E494-T588 HydrophobicContact CG-CG2 4.46Å; P495-T588 HydrophobicContact CB-CG2 4.01Å; P495-T588 HydrophobicContact CG-CG2 4.21Å; E585-T588 PolarHBondContact N-OG1 3.4Å; E585-T588 PolarHBondContact O-N 3.35Å; E585-T588 VanDerWaalsContact O-N 3.09Å; E585-T588 PolarHBondContact O-OG1 3.21Å; G586-T588 PolarHBondContact O-N 3.36Å; T588-I592 WeakPolarHBondContact O-CD1 3.45Å; T588-I592 VanDerWaalsContact O-CG1 3.28Å; T588-I592 WeakPolarHBondContact O-CG1 3.31Å; T588-I592 PolarHBondContact O-N 2.89Å; T588-I592 VanDerWaalsContact O-N 3.16Å
589	I	87.6	Confident	88.8	Confident	19 Å²	19	51.7 Å²	51.7	10%	0.097	27%	0.272	C	S	.	.	H	α-helix	trans	-66.4	-44.8	174	-68.2	168.8	0	0	0	109.9	I570 R581 L584 E585 G586 P587 D591 I592 E593	I570-I589 HydrophobicContact CG2-CG2 4.38Å; R581-I589 HydrophobicContact CG-CD1 3.9Å; R581-I589 HydrophobicContact CG-CG1 4.49Å; R581-I589 VanDerWaalsContact CZ-CG2 3.48Å; R581-I589 VanDerWaalsContact NH1-CG2 3.34Å; L584-I589 HydrophobicContact CB-CD1 4Å; L584-I589 HydrophobicContact CB-CG1 3.67Å; L584-I589 HydrophobicContact CD1-CG1 4.36Å; E585-I589 WeakPolarHBondContact O-CG1 3.48Å; E585-I589 PolarHBondContact O-N 3.46Å; E585-I589 VanDerWaalsContact O-N 3.07Å; G586-I589 PolarHBondContact O-N 3.05Å; P587-I589 VanDerWaalsContact C-N 3.29Å; P587-I589 PolarHBondContact O-N 2.78Å; I589-D591 VanDerWaalsContact C-N 3.31Å; I589-D591 PolarHBondContact O-N 3.28Å; I589-I592 PolarHBondContact O-N 3.37Å; I589-E593 HydrophobicContact CG2-CG 4.36Å; I589-E593 WeakPolarHBondContact CG2-OE1 3.42Å; I589-E593 WeakPolarHBondContact O-CB 3.28Å; I589-E593 WeakPolarHBondContact O-CG 3.48Å; I589-E593 PolarHBondContact O-N 2.86Å
590	L	90.3	Very high	89.5	Confident	112 Å²	112	52.1 Å²	52.1	59%	0.586	27%	0.272	S	S	*	.	H	α-helix	trans	-62.7	-38.5	178	-65.8	173.1	0	0	0	111.9	G586 P587 E593 K594	G586-L590 PolarHBondContact O-N 3.4Å; P587-L590 WeakPolarHBondContact O-CB 3.43Å; P587-L590 PolarHBondContact O-N 3.03Å; P587-L590 VanDerWaalsContact O-N 3.14Å; L590-E593 PolarHBondContact O-N 3.44Å; L590-K594 WeakPolarHBondContact O-CB 3.49Å; L590-K594 PolarHBondContact O-N 2.77Å
591	D	92.8	Very high	90.1	Very high	72 Å²	72	50.7 Å²	50.7	39%	0.385	26%	0.264	S	S	.	.	H	α-helix	trans	-63.6	-42.9	176.1	-67.7	-32.6	0	0	0	111.8	T491 P587 I589 K594 F595	T491-D591 HydrophobicContact CG2-CB 3.95Å; P587-D591 PolarHBondContact O-N 2.87Å; I589-D591 VanDerWaalsContact C-N 3.31Å; I589-D591 PolarHBondContact O-N 3.28Å; D591-K594 PolarHBondContact O-N 2.9Å; D591-F595 PolarHBondContact O-N 3.44Å
592	I	93.6	Very high	90.6	Very high	2 Å²	2	48 Å²	48	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-66.3	-46.1	176.6	-64.6	164.5	0	0	0	110.6	F487 L566 L569 I570 L584 T588 I589 K594 F595 H596	F487-I592 HydrophobicContact CZ-CG1 4.14Å; L566-I592 HydrophobicContact CB-CG2 3.92Å; L566-I592 HydrophobicContact CD2-CG1 4.32Å; L566-I592 HydrophobicContact CD2-CG2 3.89Å; L566-I592 HydrophobicContact CG-CG2 4.38Å; L569-I592 HydrophobicContact CD1-CD1 4.29Å; I570-I592 HydrophobicContact CD1-CG2 4.38Å; I570-I592 HydrophobicContact CG2-CB 3.87Å; I570-I592 HydrophobicContact CG2-CD1 4.46Å; I570-I592 HydrophobicContact CG2-CG2 3.5Å; L584-I592 HydrophobicContact CD1-CD1 4.12Å; T588-I592 WeakPolarHBondContact O-CD1 3.45Å; T588-I592 VanDerWaalsContact O-CG1 3.28Å; T588-I592 WeakPolarHBondContact O-CG1 3.31Å; T588-I592 PolarHBondContact O-N 2.89Å; T588-I592 VanDerWaalsContact O-N 3.16Å; I589-I592 PolarHBondContact O-N 3.37Å; I592-K594 VanDerWaalsContact C-N 3.3Å; I592-K594 PolarHBondContact O-N 3.35Å; I592-F595 PolarHBondContact O-N 3.44Å; I592-H596 WeakPolarHBondContact O-CB 3.45Å; I592-H596 PolarHBondContact O-N 2.93Å
593	E	92.1	Very high	91	Very high	41 Å²	41	47.7 Å²	47.7	19%	0.192	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-40.6	177.3	-76.6	175.9	-177.7	0	0	111.9	I570 R581 I589 L590 H596 R597	I570-E593 HydrophobicContact CD1-CG 3.9Å; I570-E593 HydrophobicContact CG2-CG 4.31Å; R581-E593 IonicContact CZ-OE1 3.08Å; R581-E593 IonicContact NH1-OE1 3.99Å; R581-E593 PolarHBondContact NH1-OE1 3.28Å; R581-E593 IonicContact NH2-OE1 2.66Å; R581-E593 PolarHBondContact NH2-OE1 3.07Å; I589-E593 HydrophobicContact CG2-CG 4.36Å; I589-E593 WeakPolarHBondContact CG2-OE1 3.42Å; I589-E593 WeakPolarHBondContact O-CB 3.28Å; I589-E593 WeakPolarHBondContact O-CG 3.48Å; I589-E593 PolarHBondContact O-N 2.86Å; L590-E593 PolarHBondContact O-N 3.44Å; E593-H596 PolarHBondContact O-N 2.97Å; E593-R597 VanDerWaalsContact O-CB 3.28Å; E593-R597 WeakPolarHBondContact O-CB 3.33Å; E593-R597 PolarHBondContact O-N 3.47Å
594	K	93.6	Very high	91.6	Very high	119 Å²	119	47.7 Å²	47.7	52%	0.517	25%	0.245	S	C	.	.	H	α-helix	trans	-61.8	-53.8	177.4	-177	-179.5	178.1	-174.1	0	110.9	L590 D591 I592 H596 R597 E598	L590-K594 WeakPolarHBondContact O-CB 3.49Å; L590-K594 PolarHBondContact O-N 2.77Å; D591-K594 PolarHBondContact O-N 2.9Å; I592-K594 VanDerWaalsContact C-N 3.3Å; I592-K594 PolarHBondContact O-N 3.35Å; K594-H596 VanDerWaalsContact C-N 3.34Å; K594-H596 PolarHBondContact O-N 3.4Å; K594-R597 PolarHBondContact O-N 3.08Å; K594-E598 WeakPolarHBondContact CE-OE1 3.41Å; K594-E598 VanDerWaalsContact CG-OE1 3.28Å; K594-E598 WeakPolarHBondContact CG-OE1 3.47Å; K594-E598 WeakPolarHBondContact O-CG 3.37Å; K594-E598 PolarHBondContact O-N 2.73Å
595	F	96.2	Very high	92	Very high	12 Å²	12	46.8 Å²	46.8	5%	0.053	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-41	178.6	-177.6	-94.2	0	0	0	111.9	A483 L484 F487 V562 L566 D591 I592 R597 E598 S599 Y602	A483-F595 HydrophobicContact CB-CE2 4.4Å; L484-F595 HydrophobicContact CB-CZ 4.4Å; L484-F595 HydrophobicContact CD1-CE1 4.32Å; L484-F595 HydrophobicContact CD1-CZ 3.69Å; F487-F595 HydrophobicContact CB-CD2 3.79Å; F487-F595 HydrophobicContact CB-CE2 3.96Å; F487-F595 HydrophobicContact CB-CG 4.29Å; F487-F595 AromaticContact CD1-CD1 3.87Å; F487-F595 HydrophobicContact CD1-CD1 3.87Å; F487-F595 HydrophobicContact CD1-CD2 4.23Å; F487-F595 HydrophobicContact CD1-CE1 4.13Å; F487-F595 HydrophobicContact CD1-CE2 4.46Å; F487-F595 AromaticContact CD1-CG 3.93Å; F487-F595 HydrophobicContact CD1-CG 3.93Å; F487-F595 HydrophobicContact CD1-CZ 4.43Å; F487-F595 HydrophobicContact CD2-CB 3.66Å; F487-F595 HydrophobicContact CD2-CD2 4.06Å; F487-F595 AromaticContact CD2-CG 3.81Å; F487-F595 HydrophobicContact CD2-CG 3.81Å; F487-F595 HydrophobicContact CE1-CB 4.48Å; F487-F595 AromaticContact CE1-CD1 3.93Å; F487-F595 HydrophobicContact CE1-CD1 3.93Å; F487-F595 HydrophobicContact CE1-CE1 4.44Å; F487-F595 HydrophobicContact CE1-CG 4.19Å; F487-F595 HydrophobicContact CE2-CB 3.61Å; F487-F595 HydrophobicContact CE2-CG 4.07Å; F487-F595 HydrophobicContact CG-CB 4.12Å; F487-F595 HydrophobicContact CG-CD1 4.17Å; F487-F595 AromaticContact CG-CD2 3.76Å; F487-F595 HydrophobicContact CG-CD2 3.76Å; F487-F595 HydrophobicContact CG-CE2 4.22Å; F487-F595 AromaticContact CG-CG 3.73Å; F487-F595 HydrophobicContact CG-CG 3.73Å; F487-F595 HydrophobicContact CZ-CB 4.04Å; F487-F595 HydrophobicContact CZ-CD1 4.26Å; F487-F595 HydrophobicContact CZ-CG 4.24Å; V562-F595 HydrophobicContact CG1-CE1 4.18Å; L566-F595 HydrophobicContact CD1-CD1 3.67Å; L566-F595 HydrophobicContact CD1-CE1 4.03Å; D591-F595 PolarHBondContact O-N 3.44Å; I592-F595 PolarHBondContact O-N 3.44Å; F595-R597 VanDerWaalsContact C-N 3.32Å; F595-R597 PolarHBondContact O-N 3.03Å; F595-E598 PolarHBondContact O-N 3.11Å; F595-S599 WeakPolarHBondContact O-CB 3.42Å; F595-S599 PolarHBondContact O-N 3.45Å; F595-S599 PolarHBondContact O-OG 2.9Å; F595-Y602 HydrophobicContact CE2-CE2 4.39Å; F595-Y602 HydrophobicContact CZ-CE2 4.42Å
596	H	94.4	Very high	92.4	Very high	15 Å²	15	44.1 Å²	44.1	7%	0.069	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-37.5	177.4	-173.8	-103	0	0	0	112.1	E155 R563 I570 I592 E593 K594 S599	E155-H596 IonicContact OE2-CE1 2.85Å; R563-H596 PolarHBondContact NH1-O 3.34Å; I570-H596 HydrophobicContact CD1-CB 4.44Å; I592-H596 WeakPolarHBondContact O-CB 3.45Å; I592-H596 PolarHBondContact O-N 2.93Å; E593-H596 PolarHBondContact O-N 2.97Å; K594-H596 VanDerWaalsContact C-N 3.34Å; K594-H596 PolarHBondContact O-N 3.4Å; H596-S599 PolarHBondContact O-OG 3.26Å
597	R	92.8	Very high	92.8	Very high	145 Å²	145	43.6 Å²	43.6	55%	0.547	22%	0.215	S	C	.	.	H	α-helix	trans	-72.2	-47.1	176.9	-165.5	-178.2	-55.4	128.9	7.9	112.1	M253 E593 K594 F595 S599 F600	M253-R597 HydrophobicContact CE-CG 4.21Å; M253-R597 HydrophobicContact SD-CG 4.17Å; E593-R597 VanDerWaalsContact O-CB 3.28Å; E593-R597 WeakPolarHBondContact O-CB 3.33Å; E593-R597 PolarHBondContact O-N 3.47Å; K594-R597 PolarHBondContact O-N 3.08Å; F595-R597 VanDerWaalsContact C-N 3.32Å; F595-R597 PolarHBondContact O-N 3.03Å; R597-S599 PolarHBondContact O-N 2.82Å; R597-F600 VanDerWaalsContact O-CB 3.23Å; R597-F600 WeakPolarHBondContact O-CB 3.34Å; R597-F600 PolarHBondContact O-N 3.08Å
598	E	93.3	Very high	93	Very high	70 Å²	70	39.4 Å²	39.4	33%	0.327	19%	0.188	S	C	.	.	H	α-helix	trans	-65.4	-39.3	-179.5	-70.3	178	-159.3	0	0	112.2	K594 F595 F600 Y602	K594-E598 WeakPolarHBondContact CE-OE1 3.41Å; K594-E598 VanDerWaalsContact CG-OE1 3.28Å; K594-E598 WeakPolarHBondContact CG-OE1 3.47Å; K594-E598 WeakPolarHBondContact O-CG 3.37Å; K594-E598 PolarHBondContact O-N 2.73Å; F595-E598 PolarHBondContact O-N 3.11Å; E598-F600 PolarHBondContact O-N 2.99Å; E598-F600 VanDerWaalsContact O-N 3.14Å; E598-Y602 WeakPolarHBondContact O-CE1 3.3Å
599	S	95.9	Very high	92.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-72.1	-1.9	179.4	62	0	0	0	0	114.8	R563 F595 H596 R597 F601 Y602	R563-S599 PolarHBondContact NH1-O 2.84Å; R563-S599 PolarHBondContact NH1-OG 3.3Å; F595-S599 WeakPolarHBondContact O-CB 3.42Å; F595-S599 PolarHBondContact O-N 3.45Å; F595-S599 PolarHBondContact O-OG 2.9Å; H596-S599 PolarHBondContact O-OG 3.26Å; R597-S599 PolarHBondContact O-N 2.82Å; S599-F601 VanDerWaalsContact C-N 3.33Å; S599-F601 PolarHBondContact O-N 3.25Å; S599-Y602 VanDerWaalsContact CB-CD2 3.48Å; S599-Y602 VanDerWaalsContact CB-CE2 3.45Å; S599-Y602 PolarHBondContact O-N 3.33Å
600	F	95.7	Very high	93	Very high	33 Å²	33	42.1 Å²	42.1	15%	0.145	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-61.1	-42.3	176.7	178.8	-93.8	0	0	0	111.7	Y248 M253 R563 R597 E598 Y602	Y248-F600 HydrophobicContact CD2-CE2 4.47Å; Y248-F600 AromaticContact CE2-CE2 3.75Å; Y248-F600 HydrophobicContact CE2-CE2 3.75Å; Y248-F600 HydrophobicContact CE2-CZ 4.22Å; M253-F600 VanDerWaalsContact C-CE1 3.45Å; M253-F600 HydrophobicContact CB-CE1 4.24Å; M253-F600 HydrophobicContact CB-CE2 4.28Å; M253-F600 HydrophobicContact CB-CZ 4.02Å; M253-F600 HydrophobicContact CE-CB 3.56Å; M253-F600 HydrophobicContact CE-CD1 3.82Å; M253-F600 HydrophobicContact CE-CD2 3.56Å; M253-F600 HydrophobicContact CE-CE1 4.41Å; M253-F600 HydrophobicContact CE-CE2 4.17Å; M253-F600 HydrophobicContact CE-CG 3.36Å; M253-F600 WeakPolarHBondContact O-CZ 3.47Å; R563-F600 VanDerWaalsContact NH1-N 3.17Å; R597-F600 VanDerWaalsContact O-CB 3.23Å; R597-F600 WeakPolarHBondContact O-CB 3.34Å; R597-F600 PolarHBondContact O-N 3.08Å; E598-F600 PolarHBondContact O-N 2.99Å; E598-F600 VanDerWaalsContact O-N 3.14Å; F600-Y602 VanDerWaalsContact C-N 3.34Å; F600-Y602 PolarHBondContact O-N 3.09Å
601	F	96.3	Very high	93.1	Very high	22 Å²	22	37 Å²	37	10%	0.096	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-86.1	-0.5	-176.9	-60.2	-72	0	0	0	114	L255 L395 S599 T603 H604 L605	L255-F601 HydrophobicContact CB-CD1 4.34Å; L255-F601 HydrophobicContact CB-CE1 4.3Å; L395-F601 HydrophobicContact CD1-CB 4.04Å; L395-F601 HydrophobicContact CD1-CD1 4.06Å; L395-F601 HydrophobicContact CD1-CD2 4.47Å; L395-F601 HydrophobicContact CD1-CG 3.94Å; L395-F601 HydrophobicContact CD2-CB 4.44Å; L395-F601 HydrophobicContact CD2-CD2 4.12Å; L395-F601 HydrophobicContact CD2-CG 4.32Å; S599-F601 VanDerWaalsContact C-N 3.33Å; S599-F601 PolarHBondContact O-N 3.25Å; F601-T603 PolarHBondContact O-N 3.35Å; F601-H604 PolarHBondContact O-N 3.13Å; F601-L605 HydrophobicContact CB-CD1 4.18Å; F601-L605 WeakPolarHBondContact O-CG 3.26Å; F601-L605 PolarHBondContact O-N 3.32Å
602	Y	96	Very high	93.1	Very high	1 Å²	1	34 Å²	34	0%	0.004	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-40.4	-173.5	-72.6	0.6	0	0	0	112.2	F391 V480 L559 F595 E598 S599 F600 H604 L605 I606	F391-Y602 HydrophobicContact CE2-CD1 4.13Å; F391-Y602 HydrophobicContact CE2-CE1 4.08Å; F391-Y602 AromaticContact CZ-CD1 3.97Å; F391-Y602 HydrophobicContact CZ-CD1 3.97Å; F391-Y602 AromaticContact CZ-CE1 3.71Å; F391-Y602 HydrophobicContact CZ-CE1 3.71Å; V480-Y602 HydrophobicContact CB-CD2 4.41Å; V480-Y602 HydrophobicContact CG1-CD2 3.66Å; V480-Y602 HydrophobicContact CG1-CE2 4.07Å; V480-Y602 HydrophobicContact CG1-CG 4.1Å; V480-Y602 HydrophobicContact CG2-CD1 3.87Å; V480-Y602 HydrophobicContact CG2-CD2 4.11Å; V480-Y602 HydrophobicContact CG2-CE1 4.19Å; V480-Y602 HydrophobicContact CG2-CE2 4.4Å; V480-Y602 HydrophobicContact CG2-CG 3.83Å; L559-Y602 HydrophobicContact CD1-CD2 4.17Å; F595-Y602 HydrophobicContact CE2-CE2 4.39Å; F595-Y602 HydrophobicContact CZ-CE2 4.42Å; E598-Y602 WeakPolarHBondContact O-CE1 3.3Å; S599-Y602 VanDerWaalsContact CB-CD2 3.48Å; S599-Y602 VanDerWaalsContact CB-CE2 3.45Å; S599-Y602 PolarHBondContact O-N 3.33Å; F600-Y602 VanDerWaalsContact C-N 3.34Å; F600-Y602 PolarHBondContact O-N 3.09Å; Y602-H604 PolarHBondContact O-N 3.1Å; Y602-L605 PolarHBondContact O-N 2.93Å; Y602-I606 WeakPolarHBondContact O-CB 3.12Å; Y602-I606 WeakPolarHBondContact O-CG1 3.15Å; Y602-I606 PolarHBondContact O-N 3.41Å
603	T	92.6	Very high	93	Very high	64 Å²	64	37.3 Å²	37.3	39%	0.393	17%	0.173	S	C	.	.	H	α-helix	trans	-61.2	-45.7	176.9	-52.9	0	0	0	0	111.3	F601 L605 I606 N607	F601-T603 PolarHBondContact O-N 3.35Å; T603-L605 PolarHBondContact O-N 3.37Å; T603-I606 PolarHBondContact O-N 3.34Å; T603-N607 WeakPolarHBondContact O-CB 3.35Å; T603-N607 PolarHBondContact O-N 2.84Å
604	H	93.8	Very high	93	Very high	28 Å²	28	38.4 Å²	38.4	13%	0.13	18%	0.179	C	C	.	.	H	α-helix	trans	-61	-45	177.3	-61.4	94.2	0	0	0	112.3	L255 E259 F601 Y602 N607 F608 T611	L255-H604 HydrophobicContact CD2-CB 3.51Å; E259-H604 IonicContact OE1-CD2 2.59Å; E259-H604 IonicContact OE1-CE1 3.12Å; E259-H604 IonicContact OE1-NE2 2.82Å; E259-H604 PolarHBondContact OE1-NE2 3.5Å; E259-H604 IonicContact OE2-NE2 3.79Å; F601-H604 PolarHBondContact O-N 3.13Å; Y602-H604 PolarHBondContact O-N 3.1Å; H604-N607 CarbonylContact O-C 3.52Å; H604-N607 PolarHBondContact O-N 2.96Å; H604-F608 PolarHBondContact O-N 3.45Å; H604-T611 HydrophobicContact CB-CG2 4.03Å; H604-T611 PolarHBondContact O-OG1 3.44Å
605	L	93.6	Very high	93.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-71.7	-34.6	-178.3	-69.1	169.3	0	0	0	112.5	F391 A394 L395 L398 I476 F601 Y602 T603 N607 F608	F391-L605 HydrophobicContact CD2-CD1 3.97Å; F391-L605 HydrophobicContact CE1-CD1 3.98Å; F391-L605 HydrophobicContact CE2-CB 4.45Å; F391-L605 HydrophobicContact CE2-CD1 3.26Å; F391-L605 HydrophobicContact CE2-CG 4.45Å; F391-L605 HydrophobicContact CZ-CD1 3.24Å; A394-L605 HydrophobicContact CB-CD2 4.21Å; L395-L605 HydrophobicContact CB-CD1 4.13Å; L395-L605 HydrophobicContact CB-CD2 4Å; L395-L605 HydrophobicContact CD1-CD1 4.29Å; L395-L605 HydrophobicContact CD1-CD2 4.3Å; L395-L605 HydrophobicContact CD1-CG 4.47Å; L395-L605 HydrophobicContact CD2-CD1 4.48Å; L398-L605 HydrophobicContact CD1-CD2 3.93Å; I476-L605 HydrophobicContact CD1-CB 4.11Å; I476-L605 HydrophobicContact CD1-CD2 4.25Å; I476-L605 WeakPolarHBondContact CD1-O 3.16Å; I476-L605 HydrophobicContact CG1-CB 4.42Å; I476-L605 HydrophobicContact CG2-CB 3.71Å; F601-L605 HydrophobicContact CB-CD1 4.18Å; F601-L605 WeakPolarHBondContact O-CG 3.26Å; F601-L605 PolarHBondContact O-N 3.32Å; Y602-L605 PolarHBondContact O-N 2.93Å; T603-L605 PolarHBondContact O-N 3.37Å; L605-N607 VanDerWaalsContact C-N 3.28Å; L605-F608 WeakPolarHBondContact O-CB 3.24Å; L605-F608 PolarHBondContact O-N 3.18Å
606	I	91.3	Very high	93	Very high	29 Å²	29	32.3 Å²	32.3	15%	0.149	15%	0.153	C	C	.	.	H	α-helix	trans	-65.1	-37.6	172	-68.6	-70.2	0	0	0	110.3	I476 R477 Y602 T603 F608	I476-I606 HydrophobicContact CG2-CD1 4.04Å; I476-I606 HydrophobicContact CG2-CG1 4.46Å; R477-I606 HydrophobicContact CG-CD1 3.81Å; Y602-I606 WeakPolarHBondContact O-CB 3.12Å; Y602-I606 WeakPolarHBondContact O-CG1 3.15Å; Y602-I606 PolarHBondContact O-N 3.41Å; T603-I606 PolarHBondContact O-N 3.34Å; I606-F608 VanDerWaalsContact C-N 3.29Å; I606-F608 PolarHBondContact O-N 3.35Å
607	N	91.3	Very high	93	Very high	35 Å²	35	34.5 Å²	34.5	19%	0.187	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	46.8	174.1	-61.3	-23.5	0	0	0	111.5	T603 H604 L605 S609 E610 T611	T603-N607 WeakPolarHBondContact O-CB 3.35Å; T603-N607 PolarHBondContact O-N 2.84Å; H604-N607 CarbonylContact O-C 3.52Å; H604-N607 PolarHBondContact O-N 2.96Å; L605-N607 VanDerWaalsContact C-N 3.28Å; N607-S609 VanDerWaalsContact C-N 3.34Å; N607-S609 PolarHBondContact O-N 2.9Å; N607-E610 PolarHBondContact O-N 3.49Å; N607-T611 WeakPolarHBondContact O-CB 3.12Å; N607-T611 PolarHBondContact O-N 2.97Å; N607-T611 PolarHBondContact O-OG1 3.49Å
608	F	90.5	Very high	93.2	Very high	1 Å²	1	27.6 Å²	27.6	0%	0.004	14%	0.138	C	C	.	.	H	α-helix	trans	-54.7	-45.8	-171.3	-179.3	-96.9	0	0	0	113.2	A394 L398 M465 E469 F472 I476 H604 L605 I606 T611 L612	A394-F608 HydrophobicContact CB-CD2 4.31Å; A394-F608 HydrophobicContact CB-CE2 3.94Å; L398-F608 HydrophobicContact CD1-CD2 3.76Å; L398-F608 HydrophobicContact CD1-CE2 3.77Å; L398-F608 HydrophobicContact CD2-CE2 4.11Å; L398-F608 HydrophobicContact CG-CD2 4.36Å; L398-F608 HydrophobicContact CG-CE2 3.87Å; M465-F608 HydrophobicContact CB-CZ 4.18Å; M465-F608 HydrophobicContact CE-CE2 3.95Å; M465-F608 HydrophobicContact CE-CZ 3.73Å; E469-F608 HydrophobicContact CB-CD1 4.37Å; E469-F608 HydrophobicContact CB-CE1 4.4Å; E469-F608 HydrophobicContact CG-CD1 4.09Å; F472-F608 AromaticContact CD2-CE1 3.98Å; F472-F608 HydrophobicContact CD2-CE1 3.98Å; F472-F608 HydrophobicContact CD2-CE2 4.1Å; F472-F608 AromaticContact CD2-CZ 3.61Å; F472-F608 HydrophobicContact CD2-CZ 3.61Å; F472-F608 HydrophobicContact CE2-CZ 4.03Å; F472-F608 HydrophobicContact CG-CZ 4.49Å; I476-F608 HydrophobicContact CD1-CD2 4.27Å; H604-F608 PolarHBondContact O-N 3.45Å; L605-F608 WeakPolarHBondContact O-CB 3.24Å; L605-F608 PolarHBondContact O-N 3.18Å; I606-F608 VanDerWaalsContact C-N 3.29Å; I606-F608 PolarHBondContact O-N 3.35Å; F608-T611 PolarHBondContact O-N 3.32Å; F608-L612 HydrophobicContact CE1-CD2 4.05Å; F608-L612 HydrophobicContact CZ-CD2 4.5Å; F608-L612 VanDerWaalsContact O-CB 3.28Å; F608-L612 WeakPolarHBondContact O-CB 3.45Å; F608-L612 PolarHBondContact O-N 3.07Å
609	S	88.1	Confident	93.3	Very high	14 Å²	14	24.2 Å²	24.2	10%	0.098	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-46.3	-175.7	-156.3	0	0	0	0	112.6	Q39 E469 N607 L612 Q613	Q39-S609 VanDerWaalsContact NE2-CB 3.27Å; Q39-S609 PolarHBondContact NE2-OG 3.28Å; E469-S609 VanDerWaalsContact OE1-CB 3.3Å; E469-S609 WeakPolarHBondContact OE1-CB 3.32Å; E469-S609 PolarHBondContact OE1-OG 3.49Å; E469-S609 PolarHBondContact OE2-OG 2.94Å; E469-S609 VanDerWaalsContact OE2-OG 3.05Å; N607-S609 VanDerWaalsContact C-N 3.34Å; N607-S609 PolarHBondContact O-N 2.9Å; S609-L612 PolarHBondContact O-N 3.42Å; S609-Q613 PolarHBondContact O-N 2.77Å
610	E	88.8	Confident	93.3	Very high	69 Å²	69	25.6 Å²	25.6	32%	0.322	13%	0.129	S	C	.	.	H	α-helix	trans	-66.6	-44.2	176.5	-175.5	179.9	-169.1	0	0	111.1	N607 L612 Q613 Q614	N607-E610 PolarHBondContact O-N 3.49Å; E610-L612 VanDerWaalsContact C-N 3.29Å; E610-L612 PolarHBondContact O-N 3.39Å; E610-Q613 PolarHBondContact O-N 3.38Å; E610-Q614 WeakPolarHBondContact O-CG 3.29Å; E610-Q614 PolarHBondContact O-N 3.32Å; E610-Q614 PolarHBondContact OE1-NE2 2.89Å
611	T	93.1	Very high	93.4	Very high	4 Å²	4	24.2 Å²	24.2	3%	0.025	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-38.7	178.7	-56.3	0	0	0	0	111.6	L255 L398 H604 N607 F608 Q613 Q614 C615	L255-T611 HydrophobicContact CD2-CG2 3.42Å; L255-T611 VanDerWaalsContact CD2-CG2 3.42Å; L255-T611 HydrophobicContact CG-CG2 4.24Å; L398-T611 HydrophobicContact CD1-CG2 3.89Å; L398-T611 HydrophobicContact CD2-CG2 4.24Å; H604-T611 HydrophobicContact CB-CG2 4.03Å; H604-T611 PolarHBondContact O-OG1 3.44Å; N607-T611 WeakPolarHBondContact O-CB 3.12Å; N607-T611 PolarHBondContact O-N 2.97Å; N607-T611 PolarHBondContact O-OG1 3.49Å; F608-T611 PolarHBondContact O-N 3.32Å; T611-Q613 VanDerWaalsContact C-N 3.34Å; T611-Q613 PolarHBondContact O-N 3.44Å; T611-Q614 PolarHBondContact O-N 3.33Å; T611-C615 WeakPolarHBondContact O-CB 3.29Å; T611-C615 PolarHBondContact O-N 3.5Å; T611-C615 PolarHBondContact O-SG 2.93Å; T611-C615 VanDerWaalsContact O-SG 3.39Å
612	L	93.1	Very high	93.5	Very high	9 Å²	9	23.1 Å²	23.1	5%	0.047	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-45.4	176.7	179.7	62.1	0	0	0	111.1	L398 L401 Q462 M465 F608 S609 E610 C615 C616	L398-L612 HydrophobicContact CD2-CB 3.93Å; L398-L612 HydrophobicContact CD2-CD1 3.84Å; L401-L612 HydrophobicContact CD1-CD1 3.47Å; L401-L612 VanDerWaalsContact CD1-CD1 3.47Å; Q462-L612 HydrophobicContact CG-CD1 4.29Å; Q462-L612 HydrophobicContact CG-CD2 4.37Å; Q462-L612 HydrophobicContact CG-CG 4.14Å; M465-L612 HydrophobicContact CB-CD1 3.86Å; M465-L612 HydrophobicContact CB-CD2 4.03Å; M465-L612 HydrophobicContact CG-CD1 4.44Å; F608-L612 HydrophobicContact CE1-CD2 4.05Å; F608-L612 HydrophobicContact CZ-CD2 4.5Å; F608-L612 VanDerWaalsContact O-CB 3.28Å; F608-L612 WeakPolarHBondContact O-CB 3.45Å; F608-L612 PolarHBondContact O-N 3.07Å; S609-L612 PolarHBondContact O-N 3.42Å; E610-L612 VanDerWaalsContact C-N 3.29Å; E610-L612 PolarHBondContact O-N 3.39Å; L612-C615 PolarHBondContact O-N 3.37Å; L612-C616 PolarHBondContact O-N 2.94Å; L612-C616 PolarHBondContact O-SG 3.32Å; L612-C616 VanDerWaalsContact O-SG 3.33Å
613	Q	90.4	Very high	93.6	Very high	72 Å²	72	23.1 Å²	23.1	34%	0.336	12%	0.118	S	C	.	.	H	α-helix	trans	-63.1	-45	176	-66.6	177	3.4	0	0	111.5	S609 E610 T611 C615 C616 D617	S609-Q613 PolarHBondContact O-N 2.77Å; E610-Q613 PolarHBondContact O-N 3.38Å; T611-Q613 VanDerWaalsContact C-N 3.34Å; T611-Q613 PolarHBondContact O-N 3.44Å; Q613-C615 VanDerWaalsContact C-N 3.3Å; Q613-C615 PolarHBondContact O-N 2.95Å; Q613-C616 CarbonylContact O-C 3.33Å; Q613-C616 PolarHBondContact O-N 3.37Å; Q613-D617 PolarHBondContact O-N 2.85Å; Q613-D617 VanDerWaalsContact O-N 3.13Å
614	Q	91.8	Very high	93.8	Very high	65 Å²	65	20.1 Å²	20.1	30%	0.304	10%	0.1	S	C	.	.	H	α-helix	trans	-65.5	-30.8	179.4	-66.3	175.3	4.8	0	0	113.2	T256 E610 T611 C616	T256-Q614 HydrophobicContact CG2-CB 3.76Å; E610-Q614 WeakPolarHBondContact O-CG 3.29Å; E610-Q614 PolarHBondContact O-N 3.32Å; E610-Q614 PolarHBondContact OE1-NE2 2.89Å; T611-Q614 PolarHBondContact O-N 3.33Å; Q614-C616 VanDerWaalsContact C-N 3.28Å
615	C	95.8	Very high	94	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-73.6	-17.9	173.3	-74.5	0	0	0	0	113.3	L398 L401 S405 T611 L612 Q613	L398-C615 HydrophobicContact CD2-CB 4.5Å; L398-C615 PolarHBondContact O-SG 3.21Å; L401-C615 CarbonylContact C-O 3.58Å; L401-C615 HydrophobicContact CB-CB 4.19Å; S405-C615 VanDerWaalsContact CB-O 3.24Å; S405-C615 WeakPolarHBondContact CB-O 3.25Å; S405-C615 PolarHBondContact OG-O 3.43Å; T611-C615 WeakPolarHBondContact O-CB 3.29Å; T611-C615 PolarHBondContact O-N 3.5Å; T611-C615 PolarHBondContact O-SG 2.93Å; T611-C615 VanDerWaalsContact O-SG 3.39Å; L612-C615 PolarHBondContact O-N 3.37Å; Q613-C615 VanDerWaalsContact C-N 3.3Å; Q613-C615 PolarHBondContact O-N 2.95Å
616	C	95.1	Very high	94.2	Very high	3 Å²	3	20.9 Å²	20.9	2%	0.02	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	12.5	-176.3	-62.9	0	0	0	0	113.4	I458 Q462 L612 Q613 Q614 L618	I458-C616 HydrophobicContact CG2-CB 3.89Å; Q462-C616 HydrophobicContact CG-CB 4.24Å; L612-C616 PolarHBondContact O-N 2.94Å; L612-C616 PolarHBondContact O-SG 3.32Å; L612-C616 VanDerWaalsContact O-SG 3.33Å; Q613-C616 CarbonylContact O-C 3.33Å; Q613-C616 PolarHBondContact O-N 3.37Å; Q614-C616 VanDerWaalsContact C-N 3.28Å; C616-L618 PolarHBondContact O-N 2.7Å
617	D	93.5	Very high	94.4	Very high	60 Å²	60	20.1 Å²	20.1	32%	0.321	10%	0.099	S	C	.	.			trans	-72.8	113.6	-174.9	-175.7	15.5	0	0	0	112.1	Q613 S619	Q613-D617 PolarHBondContact O-N 2.85Å; Q613-D617 VanDerWaalsContact O-N 3.13Å; D617-S619 WeakPolarHBondContact OD1-CB 3.27Å; D617-S619 PolarHBondContact OD1-N 3.45Å; D617-S619 PolarHBondContact OD1-OG 3.48Å
618	L	97.1	Very high	94.6	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.092	C	C	.	.			trans	-121.1	12.8	176.6	-57.2	173.3	0	0	0	112.1	V408 M409 I455 I458 C616 Q620 L621 L670	V408-L618 HydrophobicContact CB-CD2 4.19Å; V408-L618 HydrophobicContact CG1-CD2 4.17Å; M409-L618 HydrophobicContact CE-CB 4.45Å; M409-L618 HydrophobicContact CE-CD2 3.54Å; M409-L618 HydrophobicContact SD-CD2 4.47Å; I455-L618 HydrophobicContact CB-CD1 4.35Å; I455-L618 HydrophobicContact CG1-CD1 3.97Å; I455-L618 HydrophobicContact CG2-CD1 3.97Å; I458-L618 HydrophobicContact CD1-CD1 4.24Å; I458-L618 HydrophobicContact CD1-CD2 4.41Å; C616-L618 PolarHBondContact O-N 2.7Å; L618-Q620 PolarHBondContact O-N 3.36Å; L618-Q620 VanDerWaalsContact O-N 3.14Å; L618-L621 HydrophobicContact CB-CD1 4.42Å; L618-L621 PolarHBondContact O-N 3.31Å; L618-L670 HydrophobicContact CB-CD2 3.73Å; L618-L670 HydrophobicContact CD1-CD2 3.98Å
619	S	95.6	Very high	94.9	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-60.7	-24.2	-174.8	59.5	0	0	0	0	114.3	D617 L621 F623 D673 S674 Y677	D617-S619 WeakPolarHBondContact OD1-CB 3.27Å; D617-S619 PolarHBondContact OD1-N 3.45Å; D617-S619 PolarHBondContact OD1-OG 3.48Å; S619-L621 PolarHBondContact O-N 3.33Å; S619-F623 VanDerWaalsContact O-CD2 3.26Å; S619-F623 WeakPolarHBondContact O-CD2 3.38Å; S619-F623 WeakPolarHBondContact O-CE2 3.24Å; S619-D673 WeakPolarHBondContact CB-O 3.26Å; S619-S674 PolarHBondContact O-OG 2.9Å; S619-Y677 WeakPolarHBondContact OG-CD2 3.36Å
620	Q	96.8	Very high	95.2	Very high	29 Å²	29	22.9 Å²	22.9	14%	0.136	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-76.4	-7.3	-173.6	-54.8	-54.7	-60.4	0	0	114	L618 W622	L618-Q620 PolarHBondContact O-N 3.36Å; L618-Q620 VanDerWaalsContact O-N 3.14Å; Q620-W622 VanDerWaalsContact C-N 3.29Å; Q620-W622 PolarHBondContact O-N 2.95Å
621	L	97.5	Very high	95.5	Very high	3 Å²	3	20.5 Å²	20.5	2%	0.016	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-67.5	-27	179	-70.2	175.1	0	0	0	113.3	V408 M409 Y412 I455 L618 S619 M644 L670	V408-L621 HydrophobicContact CG1-CD1 4.42Å; M409-L621 HydrophobicContact CE-CD1 3.86Å; M409-L621 HydrophobicContact CE-CD2 3.59Å; M409-L621 HydrophobicContact CE-CG 3.59Å; M409-L621 HydrophobicContact SD-CG 4.49Å; Y412-L621 HydrophobicContact CD1-CD2 3.72Å; Y412-L621 HydrophobicContact CD2-CD2 3.84Å; Y412-L621 HydrophobicContact CE1-CD2 4.1Å; Y412-L621 HydrophobicContact CE2-CD2 4.23Å; Y412-L621 HydrophobicContact CG-CD2 3.55Å; I455-L621 HydrophobicContact CD1-CD1 4.41Å; L618-L621 HydrophobicContact CB-CD1 4.42Å; L618-L621 PolarHBondContact O-N 3.31Å; S619-L621 PolarHBondContact O-N 3.33Å; L621-M644 HydrophobicContact CB-CB 4.19Å; L621-M644 WeakPolarHBondContact O-CB 3.32Å; L621-L670 HydrophobicContact CD1-CD1 3.87Å; L621-L670 HydrophobicContact CD1-CD2 4.08Å
622	W	98.3	Very high	95.5	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-37.8	-178.3	-176.5	86.3	0	0	0	113.4	Q620 R624 P645 Y671 S674 L687 E690 I691 E694	Q620-W622 VanDerWaalsContact C-N 3.29Å; Q620-W622 PolarHBondContact O-N 2.95Å; W622-R624 VanDerWaalsContact O-CD 3.27Å; W622-R624 WeakPolarHBondContact O-CD 3.32Å; W622-R624 PolarHBondContact O-NH1 3.49Å; W622-P645 HydrophobicContact CB-CG 4.17Å; W622-Y671 AromaticContact CD1-CE1 3.59Å; W622-Y671 AromaticContact NE1-CE1 3.84Å; W622-S674 WeakPolarHBondContact CB-OG 3.37Å; W622-L687 HydrophobicContact CZ3-CD2 4.48Å; W622-E690 HydrophobicContact CH2-CB 3.91Å; W622-E690 HydrophobicContact CZ2-CB 4.21Å; W622-I691 HydrophobicContact CD2-CD1 4.29Å; W622-I691 HydrophobicContact CD2-CG1 3.67Å; W622-I691 HydrophobicContact CE3-CD1 3.82Å; W622-I691 HydrophobicContact CE3-CG1 3.57Å; W622-I691 HydrophobicContact CH2-CD1 4.29Å; W622-I691 HydrophobicContact CH2-CG1 3.45Å; W622-I691 VanDerWaalsContact CH2-CG1 3.45Å; W622-I691 HydrophobicContact CZ2-CB 4.37Å; W622-I691 HydrophobicContact CZ2-CG1 3.53Å; W622-I691 HydrophobicContact CZ3-CD1 3.82Å; W622-I691 HydrophobicContact CZ3-CG1 3.46Å; W622-I691 VanDerWaalsContact CZ3-CG1 3.46Å; W622-E694 PolarHBondContact NE1-OE1 3.24Å; W622-E694 VanDerWaalsContact NE1-OE1 3.15Å; W622-E694 PolarHBondContact NE1-OE2 2.91Å
623	F	97.9	Very high	95.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.153	C	C	.	.			trans	-66.3	145.5	-174.5	-62	-69.7	0	0	0	112.3	D310 S619 S674 Y677 A678 F682 L687 I691	D310-F623 WeakPolarHBondContact CB-O 3.47Å; S619-F623 VanDerWaalsContact O-CD2 3.26Å; S619-F623 WeakPolarHBondContact O-CD2 3.38Å; S619-F623 WeakPolarHBondContact O-CE2 3.24Å; F623-S674 VanDerWaalsContact CZ-O 3.31Å; F623-S674 WeakPolarHBondContact CZ-O 3.49Å; F623-Y677 HydrophobicContact CE2-CD1 4.03Å; F623-Y677 HydrophobicContact CE2-CG 4.3Å; F623-Y677 HydrophobicContact CZ-CD1 4.33Å; F623-A678 HydrophobicContact CE1-CB 4.22Å; F623-A678 HydrophobicContact CZ-CB 4.09Å; F623-F682 HydrophobicContact CD1-CD2 4.19Å; F623-F682 AromaticContact CD1-CE2 3.71Å; F623-F682 HydrophobicContact CD1-CE2 3.71Å; F623-F682 AromaticContact CD2-CE2 3.77Å; F623-F682 HydrophobicContact CD2-CE2 3.77Å; 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 4.23Å; F623-F682 AromaticContact CE2-CE2 3.67Å; F623-F682 HydrophobicContact CE2-CE2 3.67Å; F623-F682 AromaticContact CG-CE2 3.79Å; F623-F682 HydrophobicContact CG-CE2 3.79Å; F623-F682 AromaticContact CZ-CD2 3.71Å; F623-F682 HydrophobicContact CZ-CD2 3.71Å; F623-F682 AromaticContact CZ-CE2 3.58Å; F623-F682 HydrophobicContact CZ-CE2 3.58Å; F623-L687 HydrophobicContact CE1-CD1 4.15Å; F623-I691 HydrophobicContact CE1-CD1 4.3Å; F623-I691 HydrophobicContact CZ-CD1 4.46Å
624	R	97.6	Very high	95.6	Very high	1 Å²	1	33 Å²	33	0%	0.004	17%	0.166	C	C	.	.			trans	-157.4	27.3	-167.9	53.9	-149	177.4	-142.3	12	114.8	D310 Y435 W622 F626 F627 L628 F638 S643 E694	D310-R624 WeakPolarHBondContact OD2-CA 3.32Å; Y435-R624 HydrophobicContact CE1-CB 4.3Å; Y435-R624 HydrophobicContact CE2-CB 4.2Å; Y435-R624 WeakPolarHBondContact OH-CD 2.98Å; W622-R624 VanDerWaalsContact O-CD 3.27Å; W622-R624 WeakPolarHBondContact O-CD 3.32Å; W622-R624 PolarHBondContact O-NH1 3.49Å; R624-F626 VanDerWaalsContact C-N 3.29Å; R624-F626 PolarHBondContact O-N 3.13Å; R624-F627 PolarHBondContact O-N 3.41Å; R624-L628 HydrophobicContact CG-CD1 4.49Å; R624-L628 WeakPolarHBondContact O-CG 3.29Å; R624-L628 PolarHBondContact O-N 2.83Å; R624-F638 HydrophobicContact CB-CD2 4.25Å; R624-F638 HydrophobicContact CB-CE2 4.34Å; R624-F638 HydrophobicContact CG-CD2 3.88Å; R624-F638 HydrophobicContact CG-CE2 4.38Å; R624-S643 PolarHBondContact NH1-OG 2.89Å; R624-E694 IonicContact CZ-OE2 3.21Å; R624-E694 IonicContact NH1-OE2 2.77Å; R624-E694 IonicContact NH2-OE1 3.69Å; R624-E694 IonicContact NH2-OE2 2.78Å; R624-E694 PolarHBondContact NH2-OE2 3.46Å
625	E	97.1	Very high	95.6	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.009	17%	0.167	C	C	.	.	H	α-helix	trans	-66	-29.5	-175.7	-64.1	-60.8	124.5	0	0	113.2	Y84 R87 D310 E629	Y84-E625 HydrophobicContact CD1-CB 4.37Å; Y84-E625 HydrophobicContact CD1-CG 4.29Å; Y84-E625 HydrophobicContact CD2-CB 4.29Å; Y84-E625 HydrophobicContact CE1-CB 3.92Å; Y84-E625 HydrophobicContact CE1-CG 3.78Å; Y84-E625 HydrophobicContact CE2-CB 3.83Å; Y84-E625 PolarHBondContact OH-N 3.15Å; R87-E625 IonicContact CZ-OE1 3.69Å; R87-E625 IonicContact CZ-OE2 3.97Å; R87-E625 IonicContact NE-OE1 3.69Å; R87-E625 PolarHBondContact NE-OE1 3.26Å; R87-E625 IonicContact NE-OE2 3.94Å; R87-E625 PolarHBondContact NE-OE2 3.38Å; R87-E625 IonicContact NH2-OE1 2.84Å; R87-E625 PolarHBondContact NH2-OE1 3.24Å; R87-E625 IonicContact NH2-OE2 3.22Å; D310-E625 PolarHBondContact OD1-N 2.67Å; E625-E629 PolarHBondContact O-N 3.02Å
626	F	96.7	Very high	95.5	Very high	43 Å²	43	40.4 Å²	40.4	19%	0.189	20%	0.2	C	C	.	.	H	α-helix	trans	-67.9	-50	176.1	163	-96.4	0	0	0	110.7	M177 D310 M311 R624 L628 E629 L630	M177-F626 HydrophobicContact CB-CD2 4.14Å; M177-F626 HydrophobicContact CB-CE2 4.16Å; M177-F626 HydrophobicContact CE-CB 4.27Å; M177-F626 HydrophobicContact CE-CD2 4.33Å; M177-F626 HydrophobicContact CG-CD2 4.06Å; M177-F626 HydrophobicContact SD-CB 4.32Å; M177-F626 HydrophobicContact SD-CD2 3.72Å; D310-F626 WeakPolarHBondContact OD1-CB 3.37Å; D310-F626 PolarHBondContact OD1-N 3.37Å; D310-F626 WeakPolarHBondContact OD2-CB 3.39Å; D310-F626 PolarHBondContact OD2-N 3.14Å; D310-F626 VanDerWaalsContact OD2-N 3.13Å; M311-F626 HydrophobicContact CB-CB 4.07Å; M311-F626 HydrophobicContact CB-CD2 4.15Å; M311-F626 HydrophobicContact CB-CG 4.04Å; M311-F626 HydrophobicContact CG-CD2 3.88Å; M311-F626 HydrophobicContact CG-CE2 4.14Å; M311-F626 HydrophobicContact CG-CG 4.22Å; M311-F626 HydrophobicContact SD-CD2 4.18Å; M311-F626 HydrophobicContact SD-CE2 4.46Å; R624-F626 VanDerWaalsContact C-N 3.29Å; R624-F626 PolarHBondContact O-N 3.13Å; F626-L628 VanDerWaalsContact C-N 3.28Å; F626-L628 PolarHBondContact O-N 3.36Å; F626-E629 PolarHBondContact O-N 3.47Å; F626-L630 HydrophobicContact CD1-CD1 4.23Å; F626-L630 HydrophobicContact CE1-CD1 3.56Å; F626-L630 HydrophobicContact CE1-CG 4.39Å; F626-L630 HydrophobicContact CE2-CD1 4.2Å; F626-L630 HydrophobicContact CE2-CD2 4.42Å; F626-L630 HydrophobicContact CE2-CG 4.34Å; F626-L630 HydrophobicContact CZ-CD1 3.56Å; F626-L630 HydrophobicContact CZ-CD2 4.46Å; F626-L630 HydrophobicContact CZ-CG 4.19Å; F626-L630 WeakPolarHBondContact O-CG 3.48Å; F626-L630 PolarHBondContact O-N 3.07Å; F626-L630 VanDerWaalsContact O-N 3.1Å
627	F	96.3	Very high	95.6	Very high	12 Å²	12	42 Å²	42	5%	0.053	21%	0.207	C	C	.	.	H	α-helix	trans	-63.5	-33.4	176.2	-78.3	-79.8	0	0	0	112.7	D310 L416 E434 Y435 R624 L630 T631 F638	D310-F627 HydrophobicContact CB-CD2 4.45Å; D310-F627 VanDerWaalsContact OD2-CD2 3.26Å; D310-F627 WeakPolarHBondContact OD2-CD2 3.43Å; D310-F627 PolarHBondContact OD2-N 2.93Å; L416-F627 HydrophobicContact CB-CE2 4.3Å; L416-F627 HydrophobicContact CB-CZ 4.41Å; L416-F627 HydrophobicContact CD1-CE2 4.31Å; L416-F627 HydrophobicContact CD2-CE2 3.84Å; L416-F627 HydrophobicContact CD2-CZ 4.32Å; L416-F627 HydrophobicContact CG-CE2 4.38Å; E434-F627 HydrophobicContact CG-CE1 4.31Å; Y435-F627 HydrophobicContact CD2-CB 3.69Å; Y435-F627 AromaticContact CD2-CD1 3.82Å; Y435-F627 HydrophobicContact CD2-CD1 3.82Å; Y435-F627 AromaticContact CD2-CD2 3.38Å; Y435-F627 HydrophobicContact CD2-CD2 3.38Å; Y435-F627 HydrophobicContact CD2-CE1 4.28Å; Y435-F627 AromaticContact CD2-CE2 3.92Å; Y435-F627 HydrophobicContact CD2-CE2 3.92Å; Y435-F627 AromaticContact CD2-CG 3.33Å; Y435-F627 HydrophobicContact CD2-CG 3.33Å; Y435-F627 HydrophobicContact CD2-CZ 4.33Å; Y435-F627 HydrophobicContact CE2-CB 4.29Å; Y435-F627 AromaticContact CE2-CD2 3.64Å; Y435-F627 HydrophobicContact CE2-CD2 3.64Å; Y435-F627 HydrophobicContact CE2-CE2 4.17Å; Y435-F627 HydrophobicContact CE2-CG 4.02Å; Y435-F627 HydrophobicContact CG-CB 4.05Å; Y435-F627 HydrophobicContact CG-CD1 4.36Å; Y435-F627 HydrophobicContact CG-CD2 4.49Å; Y435-F627 HydrophobicContact CG-CG 4.06Å; R624-F627 PolarHBondContact O-N 3.41Å; F627-L630 HydrophobicContact CD1-CD1 4.37Å; F627-L630 PolarHBondContact O-N 3.43Å; F627-T631 VanDerWaalsContact O-CG2 3.25Å; F627-T631 WeakPolarHBondContact O-CG2 3.2Å; F627-T631 PolarHBondContact O-N 2.94Å; F627-F638 HydrophobicContact CB-CE2 3.8Å; F627-F638 HydrophobicContact CB-CZ 3.88Å
628	L	96.3	Very high	95.7	Very high	11 Å²	11	39.6 Å²	39.6	6%	0.058	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-44.9	173.3	-74.9	173.6	0	0	0	112.2	R624 F626 L630 T631 R635 F638	R624-L628 HydrophobicContact CG-CD1 4.49Å; R624-L628 WeakPolarHBondContact O-CG 3.29Å; R624-L628 PolarHBondContact O-N 2.83Å; F626-L628 VanDerWaalsContact C-N 3.28Å; F626-L628 PolarHBondContact O-N 3.36Å; L628-L630 VanDerWaalsContact C-N 3.3Å; L628-L630 PolarHBondContact O-N 3.34Å; L628-T631 WeakPolarHBondContact O-CB 2.94Å; L628-T631 PolarHBondContact O-N 2.93Å; L628-T631 VanDerWaalsContact O-N 3.11Å; L628-T631 PolarHBondContact O-OG1 3.47Å; L628-R635 HydrophobicContact CD2-CB 4.07Å; L628-F638 HydrophobicContact CB-CE2 4.45Å; L628-F638 HydrophobicContact CD2-CD2 3.63Å; L628-F638 HydrophobicContact CD2-CE2 3.48Å; L628-F638 VanDerWaalsContact CD2-CE2 3.48Å; L628-F638 HydrophobicContact CD2-CG 4.29Å; L628-F638 HydrophobicContact CD2-CZ 4.01Å; L628-F638 HydrophobicContact CG-CD2 3.98Å; L628-F638 HydrophobicContact CG-CE2 3.63Å; L628-F638 HydrophobicContact CG-CZ 4.44Å
629	E	96.5	Very high	95.8	Very high	20 Å²	20	41.2 Å²	41.2	9%	0.093	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-41.7	176.3	-177	66.9	-160.7	0	0	111.2	M177 K178 C179 S180 E625 F626 T631 M632	M177-E629 WeakPolarHBondContact O-CG 3.26Å; M177-E629 HydrophobicContact SD-CB 4.42Å; M177-E629 HydrophobicContact SD-CG 4.38Å; K178-E629 HydrophobicContact CD-CG 4.25Å; C179-E629 WeakPolarHBondContact CA-OE1 3.47Å; C179-E629 WeakPolarHBondContact CB-OE1 3.28Å; C179-E629 PolarHBondContact N-OE1 3.27Å; S180-E629 WeakPolarHBondContact CB-OE2 3.37Å; S180-E629 PolarHBondContact N-OE1 3.15Å; S180-E629 VanDerWaalsContact OG-CD 3.29Å; S180-E629 PolarHBondContact OG-OE1 3.13Å; S180-E629 VanDerWaalsContact OG-OE1 3.12Å; S180-E629 PolarHBondContact OG-OE2 3.41Å; E625-E629 PolarHBondContact O-N 3.02Å; F626-E629 PolarHBondContact O-N 3.47Å; E629-T631 PolarHBondContact O-N 3.25Å; E629-M632 PolarHBondContact O-N 2.88Å
630	L	94.6	Very high	95.8	Very high	77 Å²	77	42.3 Å²	42.3	40%	0.403	21%	0.21	S	C	.	.	H	α-helix	trans	-62.9	-22.9	177.2	-67.4	-176.2	0	0	0	113.7	F626 F627 L628 M632	F626-L630 HydrophobicContact CD1-CD1 4.23Å; F626-L630 HydrophobicContact CE1-CD1 3.56Å; F626-L630 HydrophobicContact CE1-CG 4.39Å; F626-L630 HydrophobicContact CE2-CD1 4.2Å; F626-L630 HydrophobicContact CE2-CD2 4.42Å; F626-L630 HydrophobicContact CE2-CG 4.34Å; F626-L630 HydrophobicContact CZ-CD1 3.56Å; F626-L630 HydrophobicContact CZ-CD2 4.46Å; F626-L630 HydrophobicContact CZ-CG 4.19Å; F626-L630 WeakPolarHBondContact O-CG 3.48Å; F626-L630 PolarHBondContact O-N 3.07Å; F626-L630 VanDerWaalsContact O-N 3.1Å; F627-L630 HydrophobicContact CD1-CD1 4.37Å; F627-L630 PolarHBondContact O-N 3.43Å; L628-L630 VanDerWaalsContact C-N 3.3Å; L628-L630 PolarHBondContact O-N 3.34Å; L630-M632 PolarHBondContact O-N 3.33Å
631	T	94.8	Very high	95.8	Very high	20 Å²	20	44.7 Å²	44.7	12%	0.123	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-6.4	174.4	78	0	0	0	0	113.5	F627 L628 E629 G633 R634 R635 F638	F627-T631 VanDerWaalsContact O-CG2 3.25Å; F627-T631 WeakPolarHBondContact O-CG2 3.2Å; F627-T631 PolarHBondContact O-N 2.94Å; L628-T631 WeakPolarHBondContact O-CB 2.94Å; L628-T631 PolarHBondContact O-N 2.93Å; L628-T631 VanDerWaalsContact O-N 3.11Å; L628-T631 PolarHBondContact O-OG1 3.47Å; E629-T631 PolarHBondContact O-N 3.25Å; T631-G633 PolarHBondContact O-N 3.3Å; T631-G633 VanDerWaalsContact O-N 3.17Å; T631-R634 WeakPolarHBondContact O-CB 3.08Å; T631-R634 PolarHBondContact O-N 3.34Å; T631-R635 HydrophobicContact CG2-CB 3.94Å; T631-R635 HydrophobicContact CG2-CG 3.95Å; T631-R635 PolarHBondContact OG1-N 2.93Å; T631-F638 HydrophobicContact CG2-CE1 4.07Å; T631-F638 HydrophobicContact CG2-CZ 3.85Å
632	M	93.3	Very high	95.8	Very high	141 Å²	141	44.7 Å²	44.7	70%	0.695	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	37.1	178.6	-60.9	-179.5	-75.7	0	0	113.3	R91 E629 L630	R91-M632 VanDerWaalsContact CZ-C 3.46Å; R91-M632 PolarHBondContact NH1-O 3.13Å; R91-M632 PolarHBondContact NH2-O 3.43Å; E629-M632 PolarHBondContact O-N 2.88Å; L630-M632 PolarHBondContact O-N 3.33Å
633	G	91.5	Very high	95.8	Very high	45 Å²	45	44.7 Å²	44.7	46%	0.464	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.1	7.4	178.7	0	0	0	0	0	115	T631	T631-G633 PolarHBondContact O-N 3.3Å; T631-G633 VanDerWaalsContact O-N 3.17Å
634	R	93.1	Very high	95.8	Very high	161 Å²	161	44.8 Å²	44.8	61%	0.608	22%	0.222	S	C	*	.	S	Bend	trans	-68.9	-35.4	171.4	-173.2	-179.9	70.8	117.7	7.4	111.7	E433 T631	E433-R634 IonicContact OE1-NH2 2.68Å; E433-R634 PolarHBondContact OE1-NH2 3.05Å; E433-R634 IonicContact OE2-CZ 3.41Å; E433-R634 IonicContact OE2-NH2 3.32Å; E433-R634 PolarHBondContact OE2-NH2 3.47Å; T631-R634 WeakPolarHBondContact O-CB 3.08Å; T631-R634 PolarHBondContact O-N 3.34Å
635	R	93	Very high	95.8	Very high	84 Å²	84	44.8 Å²	44.8	32%	0.317	22%	0.222	S	C	.	.			trans	-113.8	134.5	175.3	-66.5	-70.9	-167.8	173.2	0	109.3	E433 L628 T631 F638	E433-R635 IonicContact OE1-CZ 3.68Å; E433-R635 VanDerWaalsContact OE1-CZ 3.3Å; E433-R635 IonicContact OE1-NE 2.79Å; E433-R635 PolarHBondContact OE1-NE 3.36Å; E433-R635 IonicContact OE1-NH2 3.66Å; E433-R635 PolarHBondContact OE1-NH2 3Å; E433-R635 IonicContact OE2-NE 3.49Å; L628-R635 HydrophobicContact CD2-CB 4.07Å; T631-R635 HydrophobicContact CG2-CB 3.94Å; T631-R635 HydrophobicContact CG2-CG 3.95Å; T631-R635 PolarHBondContact OG1-N 2.93Å; R635-F638 HydrophobicContact CG-CD1 4.33Å; R635-F638 HydrophobicContact CG-CE1 4.12Å
636	I	93.6	Very high	95.8	Very high	136 Å²	136	45 Å²	45	70%	0.697	22%	0.222	S	C	*	.	S	Bend	trans	-89.8	-29.9	166.8	-169.2	60.4	0	0	0	111.4	R87	R87-I636 PolarHBondContact NH1-O 3.15Å
637	Q	95.9	Very high	95.9	Very high	37 Å²	37	43.7 Å²	43.7	17%	0.173	22%	0.217	C	C	.	.	S	Bend	trans	-155.9	159.9	171	-168.6	45.4	-86.9	0	0	108.7	E690	Q637-E690 PolarHBondContact NE2-OE2 3.34Å
638	F	97.1	Very high	96	Very high	9 Å²	9	43.2 Å²	43.2	4%	0.039	22%	0.215	C	C	.	.			trans	-87.2	149	172.1	-65.6	-71	0	0	0	111.5	E433 Y435 R624 F627 L628 T631 R635 M642	E433-F638 WeakPolarHBondContact OE2-CE1 3.47Å; Y435-F638 HydrophobicContact CD1-CB 4.25Å; Y435-F638 AromaticContact CD1-CD1 3.84Å; Y435-F638 HydrophobicContact CD1-CD1 3.84Å; Y435-F638 AromaticContact CD1-CD2 3.57Å; Y435-F638 HydrophobicContact CD1-CD2 3.57Å; Y435-F638 HydrophobicContact CD1-CE1 4.02Å; Y435-F638 AromaticContact CD1-CE2 3.74Å; Y435-F638 HydrophobicContact CD1-CE2 3.74Å; Y435-F638 AromaticContact CD1-CG 3.62Å; Y435-F638 HydrophobicContact CD1-CG 3.62Å; Y435-F638 AromaticContact CD1-CZ 3.98Å; Y435-F638 HydrophobicContact CD1-CZ 3.98Å; Y435-F638 HydrophobicContact CE1-CB 4.33Å; Y435-F638 AromaticContact CE1-CD2 3.76Å; Y435-F638 HydrophobicContact CE1-CD2 3.76Å; Y435-F638 HydrophobicContact CE1-CE2 4.2Å; Y435-F638 HydrophobicContact CE1-CG 4.02Å; Y435-F638 HydrophobicContact CG-CD2 4.29Å; Y435-F638 HydrophobicContact CG-CE1 4.24Å; Y435-F638 AromaticContact CG-CE2 3.99Å; Y435-F638 HydrophobicContact CG-CE2 3.99Å; Y435-F638 AromaticContact CG-CZ 3.97Å; Y435-F638 HydrophobicContact CG-CZ 3.97Å; R624-F638 HydrophobicContact CB-CD2 4.25Å; R624-F638 HydrophobicContact CB-CE2 4.34Å; R624-F638 HydrophobicContact CG-CD2 3.88Å; R624-F638 HydrophobicContact CG-CE2 4.38Å; F627-F638 HydrophobicContact CB-CE2 3.8Å; F627-F638 HydrophobicContact CB-CZ 3.88Å; L628-F638 HydrophobicContact CB-CE2 4.45Å; L628-F638 HydrophobicContact CD2-CD2 3.63Å; L628-F638 HydrophobicContact CD2-CE2 3.48Å; L628-F638 VanDerWaalsContact CD2-CE2 3.48Å; L628-F638 HydrophobicContact CD2-CG 4.29Å; L628-F638 HydrophobicContact CD2-CZ 4.01Å; L628-F638 HydrophobicContact CG-CD2 3.98Å; L628-F638 HydrophobicContact CG-CE2 3.63Å; L628-F638 HydrophobicContact CG-CZ 4.44Å; T631-F638 HydrophobicContact CG2-CE1 4.07Å; T631-F638 HydrophobicContact CG2-CZ 3.85Å; R635-F638 HydrophobicContact CG-CD1 4.33Å; R635-F638 HydrophobicContact CG-CE1 4.12Å; F638-M642 HydrophobicContact CB-CB 4.29Å; F638-M642 HydrophobicContact CB-SD 4.29Å; F638-M642 HydrophobicContact CD1-SD 3.77Å; F638-M642 HydrophobicContact CG-SD 4.37Å
639	P	97.4	Very high	96.1	Very high	34 Å²	34	42.7 Å²	42.7	22%	0.221	21%	0.213	C	C	.	.			trans	-74.5	163.5	177.6	36.1	-38.9	0	0	0	111.9	E641 M642	P639-E641 VanDerWaalsContact C-N 3.27Å; P639-E641 WeakPolarHBondContact CB-OE1 3.49Å; P639-E641 WeakPolarHBondContact CB-OE2 3.3Å; P639-E641 HydrophobicContact CG-CG 4.3Å; P639-E641 WeakPolarHBondContact CG-OE1 3.35Å; P639-E641 PolarHBondContact O-N 3.38Å; P639-M642 HydrophobicContact CG-CE 3.79Å; P639-M642 HydrophobicContact CG-CG 4.07Å; P639-M642 HydrophobicContact CG-SD 4.12Å; P639-M642 PolarHBondContact O-N 3.12Å
640	I	97.3	Very high	96.2	Very high	24 Å²	24	43.4 Å²	43.4	12%	0.123	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-63.5	-28.7	-169.3	66.2	177.7	0	0	0	113.4	M642 S643 W646 E694 L697	I640-M642 PolarHBondContact O-N 3.34Å; I640-S643 WeakPolarHBondContact O-CB 3.23Å; I640-S643 PolarHBondContact O-N 3.29Å; I640-W646 HydrophobicContact CB-CG 4.24Å; I640-E694 HydrophobicContact CG2-CG 3.87Å; I640-L697 HydrophobicContact CD1-CD2 4.07Å; I640-L697 HydrophobicContact CD1-CG 4.37Å; I640-L697 HydrophobicContact CG2-CD2 4.16Å
641	E	95.5	Very high	96.3	Very high	78 Å²	78	40.9 Å²	40.9	36%	0.364	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-67.1	-11.5	175.7	64.8	-87	-164.3	0	0	114	R440 P639 I647	R440-E641 WeakPolarHBondContact CB-O 3.48Å; R440-E641 WeakPolarHBondContact CD-O 3.33Å; R440-E641 WeakPolarHBondContact CG-O 3.42Å; P639-E641 VanDerWaalsContact C-N 3.27Å; P639-E641 WeakPolarHBondContact CB-OE1 3.49Å; P639-E641 WeakPolarHBondContact CB-OE2 3.3Å; P639-E641 HydrophobicContact CG-CG 4.3Å; P639-E641 WeakPolarHBondContact CG-OE1 3.35Å; P639-E641 PolarHBondContact O-N 3.38Å; E641-I647 WeakPolarHBondContact O-CD1 3.47Å; E641-I647 VanDerWaalsContact O-CG1 3.26Å; E641-I647 WeakPolarHBondContact O-CG1 3.3Å
642	M	97.8	Very high	96.5	Very high	4 Å²	4	40 Å²	40	2%	0.02	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-100.3	-8.9	172.2	-55.7	-173.9	-168.3	0	0	112.8	E433 Y435 E436 T439 F638 P639 I640	E433-M642 HydrophobicContact CG-CE 4.05Å; E433-M642 HydrophobicContact CG-SD 4.31Å; Y435-M642 HydrophobicContact CD1-CB 4.04Å; Y435-M642 HydrophobicContact CD1-SD 4.39Å; Y435-M642 HydrophobicContact CE1-CB 4.11Å; E436-M642 HydrophobicContact CB-CE 3.73Å; E436-M642 HydrophobicContact CB-CG 4.1Å; E436-M642 HydrophobicContact CB-SD 3.78Å; E436-M642 HydrophobicContact CG-CE 3.87Å; E436-M642 HydrophobicContact CG-CG 4Å; E436-M642 HydrophobicContact CG-SD 4.23Å; T439-M642 PolarHBondContact OG1-O 3.14Å; F638-M642 HydrophobicContact CB-CB 4.29Å; F638-M642 HydrophobicContact CB-SD 4.29Å; F638-M642 HydrophobicContact CD1-SD 3.77Å; F638-M642 HydrophobicContact CG-SD 4.37Å; P639-M642 HydrophobicContact CG-CE 3.79Å; P639-M642 HydrophobicContact CG-CG 4.07Å; P639-M642 HydrophobicContact CG-SD 4.12Å; P639-M642 PolarHBondContact O-N 3.12Å; I640-M642 PolarHBondContact O-N 3.34Å
643	S	97.9	Very high	96.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.165	C	C	.	.			trans	-84.9	122.8	-176.1	-173.9	0	0	0	0	111.1	R624 I640 W646 I647 E694	R624-S643 PolarHBondContact NH1-OG 2.89Å; I640-S643 WeakPolarHBondContact O-CB 3.23Å; I640-S643 PolarHBondContact O-N 3.29Å; S643-W646 PolarHBondContact O-N 2.93Å; S643-I647 VanDerWaalsContact O-CG1 3.28Å; S643-I647 WeakPolarHBondContact O-CG1 3.24Å; S643-I647 PolarHBondContact O-N 3.05Å; S643-E694 WeakPolarHBondContact CB-OE1 3.35Å; S643-E694 PolarHBondContact OG-OE1 3.41Å
644	M	97.7	Very high	96.9	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-58.2	-46.3	-173.3	-71.7	-60.5	-60.2	0	0	114.4	Y412 T439 Y443 L621 W646 I647 L648	Y412-M644 HydrophobicContact CD2-CE 4.45Å; Y412-M644 HydrophobicContact CD2-CG 4.19Å; Y412-M644 HydrophobicContact CD2-SD 4.49Å; Y412-M644 HydrophobicContact CE2-CG 3.66Å; Y412-M644 HydrophobicContact CE2-SD 4.33Å; T439-M644 HydrophobicContact CG2-CG 4.19Å; T439-M644 HydrophobicContact CG2-SD 3.89Å; Y443-M644 HydrophobicContact CD2-CE 4.21Å; Y443-M644 HydrophobicContact CD2-SD 4.42Å; Y443-M644 HydrophobicContact CE2-CE 3.58Å; Y443-M644 HydrophobicContact CE2-SD 3.75Å; L621-M644 HydrophobicContact CB-CB 4.19Å; L621-M644 WeakPolarHBondContact O-CB 3.32Å; M644-W646 VanDerWaalsContact C-N 3.29Å; M644-W646 PolarHBondContact O-N 3Å; M644-I647 PolarHBondContact O-N 3.11Å; M644-I647 HydrophobicContact SD-CD1 4.15Å; M644-L648 VanDerWaalsContact O-CG 3.32Å; M644-L648 WeakPolarHBondContact O-CG 3.42Å; M644-L648 PolarHBondContact O-N 3.19Å; M644-L648 VanDerWaalsContact O-N 3.13Å
645	P	98.1	Very high	97	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-54.7	-46.4	176.2	-27.3	36.4	0	0	0	112.1	W622 L648 T649 L670 Y671	W622-P645 HydrophobicContact CB-CG 4.17Å; P645-L648 PolarHBondContact O-N 3.08Å; P645-T649 WeakPolarHBondContact O-CB 3.48Å; P645-T649 PolarHBondContact O-N 2.8Å; P645-T649 PolarHBondContact O-OG1 2.84Å; P645-L670 HydrophobicContact CB-CB 4.14Å; P645-L670 HydrophobicContact CB-CD1 4.33Å; P645-L670 HydrophobicContact CG-CB 4.03Å; P645-L670 HydrophobicContact CG-CD1 4.38Å; P645-Y671 HydrophobicContact CB-CD1 4.37Å; P645-Y671 HydrophobicContact CB-CD2 4.21Å; P645-Y671 HydrophobicContact CB-CE1 3.94Å; P645-Y671 HydrophobicContact CB-CE2 3.76Å; P645-Y671 HydrophobicContact CB-CG 4.49Å; P645-Y671 HydrophobicContact CG-CD1 4.45Å; P645-Y671 HydrophobicContact CG-CE1 4.15Å
646	W	98.4	Very high	97.2	Very high	6 Å²	6	32.4 Å²	32.4	2%	0.023	16%	0.162	C	C	.	.	H	α-helix	trans	-71.6	-39.1	-180	-170.7	-118	0	0	0	113.6	I640 S643 M644 L648 T649 D650 L653 C698 Q701 F702	I640-W646 HydrophobicContact CB-CG 4.24Å; S643-W646 PolarHBondContact O-N 2.93Å; M644-W646 VanDerWaalsContact C-N 3.29Å; M644-W646 PolarHBondContact O-N 3Å; W646-L648 PolarHBondContact O-N 2.77Å; W646-T649 HydrophobicContact CE3-CG2 4.12Å; W646-T649 HydrophobicContact CZ3-CG2 3.88Å; W646-T649 PolarHBondContact O-N 3.43Å; W646-D650 HydrophobicContact CD2-CB 4.05Å; W646-D650 HydrophobicContact CG-CB 4.44Å; W646-D650 HydrophobicContact CH2-CB 4.47Å; W646-D650 HydrophobicContact CZ2-CB 3.92Å; W646-D650 WeakPolarHBondContact CZ2-OD1 3.4Å; W646-D650 WeakPolarHBondContact O-CB 3.39Å; W646-D650 PolarHBondContact O-N 3.31Å; W646-L653 HydrophobicContact CH2-CD1 4.23Å; W646-C698 HydrophobicContact CD2-CB 3.91Å; W646-C698 HydrophobicContact CE3-CB 3.46Å; W646-C698 VanDerWaalsContact CE3-CB 3.46Å; W646-C698 VanDerWaalsContact CG-SG 3.59Å; W646-C698 HydrophobicContact CH2-CB 4.22Å; W646-C698 WeakPolarHBondContact CH2-O 3.32Å; W646-C698 HydrophobicContact CZ3-CB 3.64Å; W646-C698 VanDerWaalsContact CZ3-O 3.29Å; W646-C698 WeakPolarHBondContact CZ3-O 3.43Å; W646-Q701 HydrophobicContact CH2-CB 3.79Å; W646-Q701 HydrophobicContact CZ2-CB 3.8Å; W646-F702 HydrophobicContact CH2-CB 4.45Å; W646-F702 HydrophobicContact CZ3-CB 4.4Å
647	I	98.4	Very high	97.4	Very high	16 Å²	16	29 Å²	29	8%	0.082	14%	0.143	C	C	.	.	H	α-helix	trans	-54.8	-42.5	175.1	-71.5	162.4	0	0	0	110.6	R440 K448 E641 S643 M644 H651	R440-I647 HydrophobicContact CB-CD1 4.18Å; K448-I647 HydrophobicContact CD-CG2 3.8Å; E641-I647 WeakPolarHBondContact O-CD1 3.47Å; E641-I647 VanDerWaalsContact O-CG1 3.26Å; E641-I647 WeakPolarHBondContact O-CG1 3.3Å; S643-I647 VanDerWaalsContact O-CG1 3.28Å; S643-I647 WeakPolarHBondContact O-CG1 3.24Å; S643-I647 PolarHBondContact O-N 3.05Å; M644-I647 PolarHBondContact O-N 3.11Å; M644-I647 HydrophobicContact SD-CD1 4.15Å; I647-H651 VanDerWaalsContact O-CB 3.22Å; I647-H651 WeakPolarHBondContact O-CB 3.49Å; I647-H651 PolarHBondContact O-N 3.33Å
648	L	98.3	Very high	97.2	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-72.4	-46.4	-179.9	-65.1	178.2	0	0	0	111.8	K448 L451 V452 I455 M644 P645 W646 L670	K448-L648 HydrophobicContact CB-CD2 4.01Å; K448-L648 HydrophobicContact CG-CD2 4.04Å; L451-L648 HydrophobicContact CB-CD2 4.25Å; L451-L648 HydrophobicContact CD1-CD2 4.29Å; V452-L648 HydrophobicContact CG2-CB 3.74Å; V452-L648 HydrophobicContact CG2-CD1 4.39Å; V452-L648 HydrophobicContact CG2-CD2 4.21Å; V452-L648 HydrophobicContact CG2-CG 4.32Å; I455-L648 HydrophobicContact CD1-CD1 3.95Å; M644-L648 VanDerWaalsContact O-CG 3.32Å; M644-L648 WeakPolarHBondContact O-CG 3.42Å; M644-L648 PolarHBondContact O-N 3.19Å; M644-L648 VanDerWaalsContact O-N 3.13Å; P645-L648 PolarHBondContact O-N 3.08Å; W646-L648 PolarHBondContact O-N 2.77Å; L648-L670 HydrophobicContact CD1-CD1 4.3Å
649	T	98	Very high	97.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.6	-51.8	179.4	-59.4	0	0	0	0	112.3	P645 W646 H651 I652 L653 V664 S667 L668 F702	P645-T649 WeakPolarHBondContact O-CB 3.48Å; P645-T649 PolarHBondContact O-N 2.8Å; P645-T649 PolarHBondContact O-OG1 2.84Å; W646-T649 HydrophobicContact CE3-CG2 4.12Å; W646-T649 HydrophobicContact CZ3-CG2 3.88Å; W646-T649 PolarHBondContact O-N 3.43Å; T649-H651 VanDerWaalsContact C-N 3.26Å; T649-H651 PolarHBondContact O-N 2.97Å; T649-I652 PolarHBondContact O-N 2.74Å; T649-L653 HydrophobicContact CG2-CD1 4.37Å; T649-L653 PolarHBondContact O-N 3.03Å; T649-V664 HydrophobicContact CG2-CG2 3.89Å; T649-S667 WeakPolarHBondContact CA-OG 3.37Å; T649-S667 PolarHBondContact OG1-OG 3.09Å; T649-L668 HydrophobicContact CG2-CD1 4.19Å; T649-F702 HydrophobicContact CG2-CD2 3.9Å; T649-F702 HydrophobicContact CG2-CE2 4.33Å
650	D	98.1	Very high	96.9	Very high	36 Å²	36	30.1 Å²	30.1	19%	0.193	16%	0.158	C	C	.	.	H	α-helix	trans	-65.3	-32.5	-175	-166.2	51.2	0	0	0	111.8	W646 I652 L653 E654 K705	W646-D650 HydrophobicContact CD2-CB 4.05Å; W646-D650 HydrophobicContact CG-CB 4.44Å; W646-D650 HydrophobicContact CH2-CB 4.47Å; W646-D650 HydrophobicContact CZ2-CB 3.92Å; W646-D650 WeakPolarHBondContact CZ2-OD1 3.4Å; W646-D650 WeakPolarHBondContact O-CB 3.39Å; W646-D650 PolarHBondContact O-N 3.31Å; D650-I652 VanDerWaalsContact C-N 3.31Å; D650-I652 PolarHBondContact O-N 2.94Å; D650-L653 PolarHBondContact O-N 2.97Å; D650-L653 VanDerWaalsContact O-N 3.15Å; D650-E654 VanDerWaalsContact O-CB 3.3Å; D650-E654 WeakPolarHBondContact O-CB 3.35Å; D650-E654 PolarHBondContact O-N 2.8Å; D650-K705 VanDerWaalsContact CG-NZ 3.35Å; D650-K705 WeakPolarHBondContact OD1-CE 3.42Å; D650-K705 IonicContact OD1-NZ 2.69Å; D650-K705 PolarHBondContact OD1-NZ 2.92Å; D650-K705 IonicContact OD2-NZ 2.68Å; D650-K705 PolarHBondContact OD2-NZ 3.3Å
651	H	98.2	Very high	96.8	Very high	23 Å²	23	29 Å²	29	11%	0.106	15%	0.152	C	C	.	.	H	α-helix	trans	-60	-39.8	176.5	-174.3	65.5	0	0	0	112.5	S445 K448 F449 I647 T649 T655	S445-H651 PolarHBondContact OG-CE1 3.16Å; S445-H651 VanDerWaalsContact OG-CE1 3.25Å; S445-H651 PolarHBondContact OG-NE2 3.45Å; K448-H651 HydrophobicContact CD-CB 4.12Å; K448-H651 WeakPolarHBondContact CE-ND1 3.47Å; K448-H651 PolarHBondContact NZ-CE1 2.94Å; K448-H651 PolarHBondContact NZ-ND1 3.16Å; F449-H651 AromaticContact CD1-CD2 3.77Å; F449-H651 AromaticContact CE1-CD2 3.31Å; F449-H651 WeakPolarHBondContact CE1-CD2 3.42Å; F449-H651 AromaticContact CE1-NE2 3.51Å; F449-H651 AromaticContact CE2-NE2 3.74Å; 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 3.37Å; I647-H651 VanDerWaalsContact O-CB 3.22Å; I647-H651 WeakPolarHBondContact O-CB 3.49Å; I647-H651 PolarHBondContact O-N 3.33Å; T649-H651 VanDerWaalsContact C-N 3.26Å; T649-H651 PolarHBondContact O-N 2.97Å; H651-T655 VanDerWaalsContact CE1-CG2 3.49Å; H651-T655 WeakPolarHBondContact CE1-CG2 3.43Å; H651-T655 WeakPolarHBondContact O-CB 3.29Å; H651-T655 VanDerWaalsContact O-CG2 3.29Å; H651-T655 WeakPolarHBondContact O-CG2 3.3Å; H651-T655 PolarHBondContact O-N 3.41Å; H651-T655 PolarHBondContact O-OG1 3.26Å
652	I	97.9	Very high	96.7	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-67.6	-42.4	175.3	-62.9	170.7	0	0	0	110.6	F449 V452 T649 D650 E654 T655 K656 M660 M661 V664	F449-I652 HydrophobicContact CD1-CG1 4.3Å; F449-I652 HydrophobicContact CE1-CG1 4.15Å; V452-I652 HydrophobicContact CB-CD1 4.3Å; V452-I652 HydrophobicContact CG1-CD1 3.78Å; V452-I652 HydrophobicContact CG2-CD1 4.17Å; T649-I652 PolarHBondContact O-N 2.74Å; D650-I652 VanDerWaalsContact C-N 3.31Å; D650-I652 PolarHBondContact O-N 2.94Å; I652-E654 PolarHBondContact O-N 3.48Å; I652-T655 PolarHBondContact O-OG1 3.3Å; I652-K656 WeakPolarHBondContact O-CA 3.49Å; I652-K656 PolarHBondContact O-N 3.29Å; I652-M660 HydrophobicContact CD1-CB 4.04Å; I652-M660 HydrophobicContact CG1-CB 4.01Å; I652-M660 HydrophobicContact CG2-CB 4.11Å; I652-M661 HydrophobicContact CG2-CE 4.25Å; I652-V664 HydrophobicContact CB-CG2 4.16Å; I652-V664 HydrophobicContact CD1-CB 4.24Å; I652-V664 HydrophobicContact CD1-CG2 4.31Å; I652-V664 HydrophobicContact CG2-CB 4.15Å; I652-V664 HydrophobicContact CG2-CG2 4.19Å
653	L	96.3	Very high	96.5	Very high	2 Å²	2	31 Å²	31	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-66	-37.6	-179.8	-65	175.5	0	0	0	112.7	W646 T649 D650 V664 F702 K705 L706 Q709	W646-L653 HydrophobicContact CH2-CD1 4.23Å; T649-L653 HydrophobicContact CG2-CD1 4.37Å; T649-L653 PolarHBondContact O-N 3.03Å; D650-L653 PolarHBondContact O-N 2.97Å; D650-L653 VanDerWaalsContact O-N 3.15Å; L653-V664 HydrophobicContact CD2-CG2 4.46Å; L653-F702 HydrophobicContact CD1-CB 4.3Å; L653-F702 HydrophobicContact CD1-CD2 3.76Å; L653-F702 HydrophobicContact CD1-CE2 4.5Å; L653-F702 HydrophobicContact CD1-CG 4.34Å; L653-F702 HydrophobicContact CD2-CD2 4.19Å; L653-F702 HydrophobicContact CD2-CE2 4.18Å; L653-F702 HydrophobicContact CG-CD2 4.4Å; L653-K705 HydrophobicContact CB-CB 4.29Å; L653-K705 HydrophobicContact CB-CD 4.14Å; L653-K705 HydrophobicContact CD1-CB 4.3Å; L653-K705 HydrophobicContact CD1-CD 4.39Å; L653-L706 HydrophobicContact CD2-CB 4.3Å; L653-Q709 PolarHBondContact O-NE2 2.86Å; L653-Q709 VanDerWaalsContact O-NE2 3.13Å
654	E	96.6	Very high	96.4	Very high	119 Å²	119	31 Å²	31	56%	0.556	16%	0.158	S	C	*	.	H	α-helix	trans	-77.7	-44	-177.5	-163.8	63.4	-148.5	0	0	111.6	D650 I652 K656 K705	D650-E654 VanDerWaalsContact O-CB 3.3Å; D650-E654 WeakPolarHBondContact O-CB 3.35Å; D650-E654 PolarHBondContact O-N 2.8Å; I652-E654 PolarHBondContact O-N 3.48Å; E654-K656 VanDerWaalsContact C-N 3.31Å; E654-K705 IonicContact OE2-NZ 3.71Å; E654-K705 PolarHBondContact OE2-NZ 3.05Å
655	T	96.6	Very high	96.3	Very high	62 Å²	62	31.2 Å²	31.2	38%	0.38	16%	0.16	S	C	.	.	H	α-helix	trans	-75	-22.6	177.4	58.1	0	0	0	0	112.9	F449 H651 I652 E657	F449-T655 HydrophobicContact CZ-CG2 4.18Å; F449-T655 WeakPolarHBondContact CZ-OG1 3.4Å; H651-T655 VanDerWaalsContact CE1-CG2 3.49Å; H651-T655 WeakPolarHBondContact CE1-CG2 3.43Å; H651-T655 WeakPolarHBondContact O-CB 3.29Å; H651-T655 VanDerWaalsContact O-CG2 3.29Å; H651-T655 WeakPolarHBondContact O-CG2 3.3Å; H651-T655 PolarHBondContact O-N 3.41Å; H651-T655 PolarHBondContact O-OG1 3.26Å; I652-T655 PolarHBondContact O-OG1 3.3Å; T655-E657 PolarHBondContact O-N 3.34Å
656	K	97	Very high	96.1	Very high	89 Å²	89	32.1 Å²	32.1	39%	0.387	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	31.5	-176.1	-44	-174.8	-175.1	-140.6	0	111.8	I652 E654 A658 Q709 N744	I652-K656 WeakPolarHBondContact O-CA 3.49Å; I652-K656 PolarHBondContact O-N 3.29Å; E654-K656 VanDerWaalsContact C-N 3.31Å; K656-A658 PolarHBondContact O-N 2.91Å; K656-A658 VanDerWaalsContact O-N 3.16Å; K656-Q709 HydrophobicContact CD-CB 4.1Å; K656-N744 PolarHBondContact O-ND2 2.66Å
657	E	96.2	Very high	95.9	Very high	66 Å²	66	31.8 Å²	31.8	31%	0.308	16%	0.162	S	C	.	.			trans	-63.3	114.8	-173.4	177.4	46.4	-122.9	0	0	110.9	F449 T655 S659 M660 M661	F449-E657 HydrophobicContact CE1-CB 3.88Å; F449-E657 HydrophobicContact CE1-CG 4.12Å; F449-E657 HydrophobicContact CE2-CB 4.45Å; F449-E657 HydrophobicContact CE2-CG 4.2Å; F449-E657 HydrophobicContact CZ-CB 3.66Å; F449-E657 HydrophobicContact CZ-CG 3.86Å; T655-E657 PolarHBondContact O-N 3.34Å; E657-S659 VanDerWaalsContact C-N 3.32Å; E657-S659 WeakPolarHBondContact CG-OG 3.27Å; E657-S659 PolarHBondContact O-N 3.5Å; E657-S659 WeakPolarHBondContact OE1-CB 3.31Å; E657-S659 PolarHBondContact OE1-N 3.17Å; E657-S659 PolarHBondContact OE1-OG 2.96Å; E657-M660 HydrophobicContact CB-CB 4.22Å; E657-M660 HydrophobicContact CB-CG 4.41Å; E657-M660 HydrophobicContact CG-CB 3.96Å; E657-M660 HydrophobicContact CG-CG 3.71Å; E657-M660 PolarHBondContact O-N 3.23Å; E657-M661 PolarHBondContact O-N 3.25Å; E657-M661 VanDerWaalsContact O-N 3.12Å
658	A	93.2	Very high	95.7	Very high	26 Å²	26	31.1 Å²	31.1	22%	0.215	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-34.5	-171.3	0	0	0	0	0	112.9	K656 M660 S743 N744	K656-A658 PolarHBondContact O-N 2.91Å; K656-A658 VanDerWaalsContact O-N 3.16Å; A658-M660 VanDerWaalsContact C-N 3.28Å; A658-M660 PolarHBondContact O-N 3.43Å; A658-S743 WeakPolarHBondContact CB-O 3.31Å; A658-N744 HydrophobicContact CB-CB 4.33Å
659	S	93.4	Very high	95.5	Very high	68 Å²	68	31.8 Å²	31.8	48%	0.476	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-25.7	178.5	60.2	0	0	0	0	112.8	E657 Y663	E657-S659 VanDerWaalsContact C-N 3.32Å; E657-S659 WeakPolarHBondContact CG-OG 3.27Å; E657-S659 PolarHBondContact O-N 3.5Å; E657-S659 WeakPolarHBondContact OE1-CB 3.31Å; E657-S659 PolarHBondContact OE1-N 3.17Å; E657-S659 PolarHBondContact OE1-OG 2.96Å; S659-Y663 WeakPolarHBondContact O-CD2 3.35Å; S659-Y663 VanDerWaalsContact O-CE2 3.32Å; S659-Y663 WeakPolarHBondContact O-CE2 3.17Å
660	M	94.8	Very high	95.5	Very high	8 Å²	8	31.8 Å²	31.8	4%	0.039	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-8.8	-174.6	-63.8	-63	117.1	0	0	113.6	F449 E453 I652 E657 A658 E662 Y663 V664	F449-M660 HydrophobicContact CB-CG 4.19Å; F449-M660 HydrophobicContact CB-SD 4.16Å; F449-M660 HydrophobicContact CD1-CB 4.26Å; F449-M660 HydrophobicContact CD1-CG 3.6Å; F449-M660 HydrophobicContact CD1-SD 4.49Å; F449-M660 HydrophobicContact CE1-CB 4.46Å; F449-M660 HydrophobicContact CE1-CG 4.12Å; F449-M660 HydrophobicContact CG-CG 3.99Å; E453-M660 HydrophobicContact CG-CE 3.64Å; E453-M660 HydrophobicContact CG-SD 3.64Å; E453-M660 WeakPolarHBondContact OE1-CE 3.31Å; I652-M660 HydrophobicContact CD1-CB 4.04Å; I652-M660 HydrophobicContact CG1-CB 4.01Å; I652-M660 HydrophobicContact CG2-CB 4.11Å; E657-M660 HydrophobicContact CB-CB 4.22Å; E657-M660 HydrophobicContact CB-CG 4.41Å; E657-M660 HydrophobicContact CG-CB 3.96Å; E657-M660 HydrophobicContact CG-CG 3.71Å; E657-M660 PolarHBondContact O-N 3.23Å; A658-M660 VanDerWaalsContact C-N 3.28Å; A658-M660 PolarHBondContact O-N 3.43Å; M660-E662 PolarHBondContact O-N 3.47Å; M660-Y663 WeakPolarHBondContact O-CA 3.49Å; M660-Y663 WeakPolarHBondContact O-CB 3.3Å; M660-Y663 PolarHBondContact O-N 2.97Å; M660-Y663 HydrophobicContact SD-CD2 4.44Å; M660-V664 PolarHBondContact O-N 3.39Å
661	M	94.8	Very high	95.4	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-60.3	-33	-176	-164	57.2	58.9	0	0	113.1	I652 E657 Y663 V664 L706 R745 Y746 L749	I652-M661 HydrophobicContact CG2-CE 4.25Å; E657-M661 PolarHBondContact O-N 3.25Å; E657-M661 VanDerWaalsContact O-N 3.12Å; M661-Y663 PolarHBondContact O-N 3.18Å; M661-V664 WeakPolarHBondContact O-CG1 3.35Å; M661-L706 HydrophobicContact SD-CD1 4.19Å; M661-R745 HydrophobicContact CB-CB 4.48Å; M661-Y746 HydrophobicContact CE-CD1 4.4Å; M661-Y746 HydrophobicContact CE-CE1 3.58Å; M661-Y746 HydrophobicContact CG-CD1 3.66Å; M661-Y746 HydrophobicContact CG-CE1 3.82Å; M661-Y746 HydrophobicContact SD-CD1 3.86Å; M661-Y746 HydrophobicContact SD-CE1 3.59Å; M661-Y746 VanDerWaalsContact SD-CE1 3.59Å; M661-L749 HydrophobicContact CG-CD1 3.73Å; M661-L749 HydrophobicContact SD-CD1 3.68Å
662	E	93.7	Very high	95.2	Very high	50 Å²	50	29.8 Å²	29.8	23%	0.234	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-75.5	-10.9	176.3	-56.5	-170.1	174.3	0	0	113.2	M660 R745 T748	M660-E662 PolarHBondContact O-N 3.47Å; E662-R745 HydrophobicContact CG-CB 3.96Å; E662-R745 IonicContact OE1-CZ 3.8Å; E662-R745 IonicContact OE1-NE 3.03Å; E662-R745 PolarHBondContact OE1-NE 3.39Å; E662-R745 IonicContact OE1-NH2 2.61Å; E662-R745 PolarHBondContact OE1-NH2 3.02Å; E662-T748 HydrophobicContact CG-CG2 4.24Å
663	Y	93.6	Very high	95	Very high	74 Å²	74	31 Å²	31	29%	0.29	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-98.6	-14.4	-175.6	-64.1	-107.9	0	0	0	113.2	E453 A456 S659 M660 M661 L665 Y666	E453-Y663 HydrophobicContact CG-CD1 4.4Å; E453-Y663 HydrophobicContact CG-CE1 4.26Å; A456-Y663 HydrophobicContact CB-CD1 3.3Å; A456-Y663 HydrophobicContact CB-CE1 3.88Å; A456-Y663 HydrophobicContact CB-CG 4.3Å; S659-Y663 WeakPolarHBondContact O-CD2 3.35Å; S659-Y663 VanDerWaalsContact O-CE2 3.32Å; S659-Y663 WeakPolarHBondContact O-CE2 3.17Å; M660-Y663 WeakPolarHBondContact O-CA 3.49Å; M660-Y663 WeakPolarHBondContact O-CB 3.3Å; M660-Y663 PolarHBondContact O-N 2.97Å; M660-Y663 HydrophobicContact SD-CD2 4.44Å; M661-Y663 PolarHBondContact O-N 3.18Å; Y663-L665 VanDerWaalsContact C-N 3.28Å; Y663-L665 PolarHBondContact O-N 2.9Å; Y663-Y666 WeakPolarHBondContact O-CB 3.49Å; Y663-Y666 PolarHBondContact O-N 3.5Å; Y663-Y666 VanDerWaalsContact O-N 3.07Å
664	V	96.1	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60	-34.4	-167.6	72.1	0	0	0	0	113.5	T649 I652 L653 M660 M661 Y666 S667 L668 F702 L749	T649-V664 HydrophobicContact CG2-CG2 3.89Å; I652-V664 HydrophobicContact CB-CG2 4.16Å; I652-V664 HydrophobicContact CD1-CB 4.24Å; I652-V664 HydrophobicContact CD1-CG2 4.31Å; I652-V664 HydrophobicContact CG2-CB 4.15Å; I652-V664 HydrophobicContact CG2-CG2 4.19Å; L653-V664 HydrophobicContact CD2-CG2 4.46Å; M660-V664 PolarHBondContact O-N 3.39Å; M661-V664 WeakPolarHBondContact O-CG1 3.35Å; V664-Y666 VanDerWaalsContact C-N 3.34Å; V664-Y666 PolarHBondContact O-N 3.19Å; V664-S667 PolarHBondContact O-N 3.39Å; V664-S667 PolarHBondContact O-OG 3.43Å; V664-L668 PolarHBondContact O-N 3.08Å; V664-F702 HydrophobicContact CG1-CE2 3.94Å; V664-F702 HydrophobicContact CG1-CZ 4.11Å; V664-F702 HydrophobicContact CG2-CE2 3.8Å; V664-L749 HydrophobicContact CG1-CD1 3.94Å; V664-L749 HydrophobicContact CG1-CD2 3.78Å; V664-L749 HydrophobicContact CG1-CG 4.49Å
665	L	94.6	Very high	94.9	Very high	7 Å²	7	25.5 Å²	25.5	4%	0.037	13%	0.134	C	C	.	.	H	α-helix	trans	-68	-30.4	179.4	-65.1	179.7	0	0	0	113.1	I29 E30 Y663 S667 L668 D669 F702 L749 Q752 L764	I29-L665 HydrophobicContact CD1-CD1 3.7Å; I29-L665 HydrophobicContact CG1-CD1 4.24Å; E30-L665 HydrophobicContact CG-CD1 4.38Å; Y663-L665 VanDerWaalsContact C-N 3.28Å; Y663-L665 PolarHBondContact O-N 2.9Å; L665-S667 VanDerWaalsContact C-N 3.32Å; L665-S667 PolarHBondContact O-N 3.4Å; L665-L668 PolarHBondContact O-N 3.45Å; L665-D669 PolarHBondContact O-N 3.49Å; L665-F702 HydrophobicContact CD2-CE1 4.31Å; L665-F702 HydrophobicContact CD2-CE2 4.42Å; L665-F702 HydrophobicContact CD2-CZ 3.72Å; L665-L749 HydrophobicContact CD1-CD2 3.79Å; L665-L749 HydrophobicContact CD2-CD2 4.32Å; L665-L749 HydrophobicContact CG-CD2 3.74Å; L665-Q752 HydrophobicContact CD1-CG 3.79Å; L665-L764 HydrophobicContact CD2-CD2 4.48Å
666	Y	93.8	Very high	94.7	Very high	19 Å²	19	26.7 Å²	26.7	8%	0.075	14%	0.135	C	C	.	.	H	α-helix	trans	-67	-33.7	176.7	-66.3	-73.2	0	0	0	112.6	C28 I29 A456 K459 Y663 V664 L668 D669	C28-Y666 PolarHBondContact O-OH 3.09Å; C28-Y666 VanDerWaalsContact O-OH 3.07Å; I29-Y666 VanDerWaalsContact C-CZ 3.43Å; I29-Y666 VanDerWaalsContact CA-OH 3.32Å; I29-Y666 WeakPolarHBondContact CA-OH 3.36Å; I29-Y666 HydrophobicContact CB-CE2 4.41Å; I29-Y666 WeakPolarHBondContact O-CE2 3.38Å; I29-Y666 VanDerWaalsContact O-CZ 3.31Å; A456-Y666 HydrophobicContact CB-CD1 4.43Å; A456-Y666 HydrophobicContact CB-CD2 3.37Å; A456-Y666 HydrophobicContact CB-CE2 3.88Å; A456-Y666 HydrophobicContact CB-CG 3.67Å; K459-Y666 HydrophobicContact CB-CD1 3.57Å; K459-Y666 HydrophobicContact CB-CE1 3.95Å; K459-Y666 HydrophobicContact CD-CD1 4.15Å; K459-Y666 HydrophobicContact CG-CD1 4.48Å; Y663-Y666 WeakPolarHBondContact O-CB 3.49Å; Y663-Y666 PolarHBondContact O-N 3.5Å; Y663-Y666 VanDerWaalsContact O-N 3.07Å; V664-Y666 VanDerWaalsContact C-N 3.34Å; V664-Y666 PolarHBondContact O-N 3.19Å; Y666-L668 VanDerWaalsContact C-N 3.35Å; Y666-D669 PolarHBondContact O-N 2.85Å
667	S	95.1	Very high	94.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-70.1	-34.3	174	69.5	0	0	0	0	112.1	T649 V664 L665 D669 L670	T649-S667 WeakPolarHBondContact CA-OG 3.37Å; T649-S667 PolarHBondContact OG1-OG 3.09Å; V664-S667 PolarHBondContact O-N 3.39Å; V664-S667 PolarHBondContact O-OG 3.43Å; L665-S667 VanDerWaalsContact C-N 3.32Å; L665-S667 PolarHBondContact O-N 3.4Å; S667-D669 VanDerWaalsContact C-N 3.33Å; S667-L670 WeakPolarHBondContact O-CB 3.34Å; S667-L670 WeakPolarHBondContact O-CD1 3.37Å; S667-L670 VanDerWaalsContact O-CG 3.27Å; S667-L670 WeakPolarHBondContact O-CG 3.39Å; S667-L670 PolarHBondContact O-N 3.41Å
668	L	94	Very high	94.4	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-71.4	-30.5	175.9	-163	74.4	0	0	0	111.8	T649 V664 L665 Y666 L670 Y671 F699 L757	T649-L668 HydrophobicContact CG2-CD1 4.19Å; V664-L668 PolarHBondContact O-N 3.08Å; L665-L668 PolarHBondContact O-N 3.45Å; Y666-L668 VanDerWaalsContact C-N 3.35Å; L668-L670 PolarHBondContact O-N 3.26Å; L668-Y671 HydrophobicContact CD1-CD2 4.1Å; L668-Y671 HydrophobicContact CD1-CE2 3.98Å; L668-Y671 HydrophobicContact CG-CD2 4.45Å; L668-Y671 VanDerWaalsContact O-CD2 3.25Å; L668-Y671 WeakPolarHBondContact O-CD2 3.41Å; L668-Y671 PolarHBondContact O-N 2.91Å; L668-F699 HydrophobicContact CD2-CD2 3.91Å; L668-F699 HydrophobicContact CD2-CE2 4.19Å; L668-L757 HydrophobicContact CD2-CD2 3.89Å; L668-L757 HydrophobicContact CG-CD2 4.28Å
669	D	94.4	Very high	94.3	Very high	15 Å²	15	24.2 Å²	24.2	8%	0.08	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-15.5	176.8	-172.1	68.1	0	0	0	114.1	P31 K459 L665 Y666 S667 Y671 N672 D673	P31-D669 HydrophobicContact CG-CB 3.67Å; P31-D669 VanDerWaalsContact CG-OD1 3.32Å; P31-D669 WeakPolarHBondContact CG-OD1 3.46Å; P31-D669 WeakPolarHBondContact CG-OD2 3.41Å; K459-D669 HydrophobicContact CD-CB 4.17Å; K459-D669 WeakPolarHBondContact CD-OD2 3.47Å; K459-D669 VanDerWaalsContact CE-OD2 3.22Å; K459-D669 WeakPolarHBondContact CE-OD2 3.49Å; K459-D669 IonicContact NZ-OD2 3.63Å; K459-D669 PolarHBondContact NZ-OD2 2.87Å; L665-D669 PolarHBondContact O-N 3.49Å; Y666-D669 PolarHBondContact O-N 2.85Å; S667-D669 VanDerWaalsContact C-N 3.33Å; D669-Y671 PolarHBondContact O-N 3.49Å; D669-Y671 VanDerWaalsContact O-N 3.09Å; D669-N672 WeakPolarHBondContact O-CA 3.47Å; D669-N672 VanDerWaalsContact O-CB 3.31Å; D669-N672 WeakPolarHBondContact O-CB 3.39Å; D669-N672 PolarHBondContact O-N 2.72Å; D669-N672 PolarHBondContact OD1-ND2 3.22Å; D669-D673 PolarHBondContact O-N 2.98Å
670	L	96.6	Very high	94.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.4	-25.4	172.1	-63.3	174	0	0	0	112.8	I455 L618 L621 P645 L648 S667 L668 N672 D673 S674	I455-L670 HydrophobicContact CD1-CD1 4.1Å; I455-L670 HydrophobicContact CD1-CD2 4.43Å; I455-L670 HydrophobicContact CG2-CD2 4Å; I455-L670 HydrophobicContact CG2-CG 4.48Å; L618-L670 HydrophobicContact CB-CD2 3.73Å; L618-L670 HydrophobicContact CD1-CD2 3.98Å; L621-L670 HydrophobicContact CD1-CD1 3.87Å; L621-L670 HydrophobicContact CD1-CD2 4.08Å; P645-L670 HydrophobicContact CB-CB 4.14Å; P645-L670 HydrophobicContact CB-CD1 4.33Å; P645-L670 HydrophobicContact CG-CB 4.03Å; P645-L670 HydrophobicContact CG-CD1 4.38Å; L648-L670 HydrophobicContact CD1-CD1 4.3Å; S667-L670 WeakPolarHBondContact O-CB 3.34Å; S667-L670 WeakPolarHBondContact O-CD1 3.37Å; S667-L670 VanDerWaalsContact O-CG 3.27Å; S667-L670 WeakPolarHBondContact O-CG 3.39Å; S667-L670 PolarHBondContact O-N 3.41Å; L668-L670 PolarHBondContact O-N 3.26Å; L670-N672 VanDerWaalsContact C-N 3.33Å; L670-D673 PolarHBondContact O-N 3.49Å; L670-S674 PolarHBondContact O-N 3.13Å; L670-S674 VanDerWaalsContact O-N 3.07Å; L670-S674 PolarHBondContact O-OG 2.88Å
671	Y	97.3	Very high	93.9	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-67.3	-32.6	172.3	-70.1	-64.9	0	0	0	112.6	W622 P645 L668 D669 S674 A675 I691 E694 V695	W622-Y671 AromaticContact CD1-CE1 3.59Å; W622-Y671 AromaticContact NE1-CE1 3.84Å; P645-Y671 HydrophobicContact CB-CD1 4.37Å; P645-Y671 HydrophobicContact CB-CD2 4.21Å; P645-Y671 HydrophobicContact CB-CE1 3.94Å; P645-Y671 HydrophobicContact CB-CE2 3.76Å; P645-Y671 HydrophobicContact CB-CG 4.49Å; P645-Y671 HydrophobicContact CG-CD1 4.45Å; P645-Y671 HydrophobicContact CG-CE1 4.15Å; L668-Y671 HydrophobicContact CD1-CD2 4.1Å; L668-Y671 HydrophobicContact CD1-CE2 3.98Å; L668-Y671 HydrophobicContact CG-CD2 4.45Å; L668-Y671 VanDerWaalsContact O-CD2 3.25Å; L668-Y671 WeakPolarHBondContact O-CD2 3.41Å; L668-Y671 PolarHBondContact O-N 2.91Å; D669-Y671 PolarHBondContact O-N 3.49Å; D669-Y671 VanDerWaalsContact O-N 3.09Å; Y671-S674 PolarHBondContact O-N 3.21Å; Y671-A675 WeakPolarHBondContact O-CB 3.36Å; Y671-A675 PolarHBondContact O-N 2.89Å; Y671-I691 HydrophobicContact CD1-CG2 4.16Å; Y671-E694 HydrophobicContact CE1-CG 4.16Å; Y671-E694 PolarHBondContact OH-OE1 3.5Å; Y671-V695 HydrophobicContact CD1-CG2 3.63Å; Y671-V695 HydrophobicContact CD2-CG2 3.6Å; Y671-V695 HydrophobicContact CE1-CG2 4.15Å; Y671-V695 HydrophobicContact CE2-CG2 4.14Å; Y671-V695 HydrophobicContact CG-CG2 3.31Å
672	N	94.1	Very high	93.8	Very high	17 Å²	17	31.1 Å²	31.1	9%	0.091	15%	0.145	C	C	.	.	H	α-helix	trans	-66	-43.9	174.2	-75.2	-37.1	0	0	0	111.1	D669 L670 S674 A675 H676 Q756 L758	D669-N672 WeakPolarHBondContact O-CA 3.47Å; D669-N672 VanDerWaalsContact O-CB 3.31Å; D669-N672 WeakPolarHBondContact O-CB 3.39Å; D669-N672 PolarHBondContact O-N 2.72Å; D669-N672 PolarHBondContact OD1-ND2 3.22Å; L670-N672 VanDerWaalsContact C-N 3.33Å; N672-S674 VanDerWaalsContact C-N 3.32Å; N672-S674 PolarHBondContact O-N 3.13Å; N672-A675 PolarHBondContact O-N 3.43Å; N672-H676 VanDerWaalsContact O-CB 3.29Å; N672-H676 WeakPolarHBondContact O-CB 3.5Å; N672-H676 PolarHBondContact O-N 2.89Å; N672-Q756 PolarHBondContact ND2-O 3.26Å; N672-L758 PolarHBondContact OD1-N 3.37Å
673	D	93.6	Very high	93.9	Very high	28 Å²	28	34.5 Å²	34.5	15%	0.15	17%	0.165	C	C	.	.	H	α-helix	trans	-58	-48.8	176	-59.7	-14.4	0	0	0	110.3	K459 S619 D669 L670 Y677	K459-D673 IonicContact NZ-OD1 3.64Å; K459-D673 PolarHBondContact NZ-OD1 2.78Å; K459-D673 IonicContact NZ-OD2 2.66Å; K459-D673 PolarHBondContact NZ-OD2 3.07Å; S619-D673 WeakPolarHBondContact CB-O 3.26Å; D669-D673 PolarHBondContact O-N 2.98Å; L670-D673 PolarHBondContact O-N 3.49Å; D673-Y677 WeakPolarHBondContact O-CB 3.25Å; D673-Y677 PolarHBondContact O-N 3.32Å
674	S	96.1	Very high	93.9	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.5	-44.2	-179.3	-52.7	0	0	0	0	111.8	S619 W622 F623 L670 Y671 N672 Y677 A678	S619-S674 PolarHBondContact O-OG 2.9Å; W622-S674 WeakPolarHBondContact CB-OG 3.37Å; F623-S674 VanDerWaalsContact CZ-O 3.31Å; F623-S674 WeakPolarHBondContact CZ-O 3.49Å; L670-S674 PolarHBondContact O-N 3.13Å; L670-S674 VanDerWaalsContact O-N 3.07Å; L670-S674 PolarHBondContact O-OG 2.88Å; Y671-S674 PolarHBondContact O-N 3.21Å; N672-S674 VanDerWaalsContact C-N 3.32Å; N672-S674 PolarHBondContact O-N 3.13Å; S674-Y677 PolarHBondContact O-N 3.33Å; S674-A678 WeakPolarHBondContact O-CB 3.44Å; S674-A678 PolarHBondContact O-N 2.89Å
675	A	94.2	Very high	93.7	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.033	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-45.1	179.3	0	0	0	0	0	112.1	Y671 N672 Y677 A678 L679 Y688 I691 L758	Y671-A675 WeakPolarHBondContact O-CB 3.36Å; Y671-A675 PolarHBondContact O-N 2.89Å; N672-A675 PolarHBondContact O-N 3.43Å; A675-Y677 VanDerWaalsContact C-N 3.3Å; A675-Y677 PolarHBondContact O-N 2.97Å; A675-A678 PolarHBondContact O-N 3.44Å; A675-L679 WeakPolarHBondContact O-CG 3.31Å; A675-L679 PolarHBondContact O-N 2.86Å; A675-Y688 HydrophobicContact CB-CD2 3.93Å; A675-Y688 HydrophobicContact CB-CE2 3.9Å; A675-I691 HydrophobicContact CB-CG2 4.14Å; A675-L758 HydrophobicContact CB-CD2 3.42Å; A675-L758 VanDerWaalsContact CB-CD2 3.42Å
676	H	92	Very high	93.8	Very high	87 Å²	87	44.3 Å²	44.3	40%	0.403	21%	0.211	S	C	.	.	H	α-helix	trans	-60.1	-42.8	175.2	179	-93.2	0	0	0	110.9	N672 L679 T680	N672-H676 VanDerWaalsContact O-CB 3.29Å; N672-H676 WeakPolarHBondContact O-CB 3.5Å; N672-H676 PolarHBondContact O-N 2.89Å; H676-L679 PolarHBondContact O-N 2.95Å; H676-T680 PolarHBondContact CE1-OG1 3.01Å; H676-T680 WeakPolarHBondContact O-CB 3.3Å; H676-T680 WeakPolarHBondContact O-CG2 3.46Å; H676-T680 PolarHBondContact O-N 3.16Å; H676-T680 PolarHBondContact O-OG1 3.41Å
677	Y	93.5	Very high	93.9	Very high	44 Å²	44	43.4 Å²	43.4	17%	0.173	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-42.1	177	-157.6	-79.4	0	0	0	112.2	S619 F623 D673 S674 A675 L679 R681 F682	S619-Y677 WeakPolarHBondContact OG-CD2 3.36Å; F623-Y677 HydrophobicContact CE2-CD1 4.03Å; F623-Y677 HydrophobicContact CE2-CG 4.3Å; F623-Y677 HydrophobicContact CZ-CD1 4.33Å; D673-Y677 WeakPolarHBondContact O-CB 3.25Å; D673-Y677 PolarHBondContact O-N 3.32Å; S674-Y677 PolarHBondContact O-N 3.33Å; A675-Y677 VanDerWaalsContact C-N 3.3Å; A675-Y677 PolarHBondContact O-N 2.97Å; Y677-L679 VanDerWaalsContact C-N 3.31Å; Y677-L679 PolarHBondContact O-N 2.95Å; Y677-R681 HydrophobicContact CD1-CB 3.68Å; Y677-R681 HydrophobicContact CD1-CG 4.27Å; Y677-R681 HydrophobicContact CD2-CB 4.23Å; Y677-R681 HydrophobicContact CD2-CG 3.9Å; Y677-R681 HydrophobicContact CE1-CB 3.53Å; Y677-R681 HydrophobicContact CE1-CG 4.17Å; Y677-R681 HydrophobicContact CE2-CB 4.13Å; Y677-R681 HydrophobicContact CE2-CG 3.83Å; Y677-R681 HydrophobicContact CG-CB 4.02Å; Y677-R681 HydrophobicContact CG-CG 4.12Å; Y677-R681 WeakPolarHBondContact O-CA 3.32Å; Y677-R681 WeakPolarHBondContact O-CB 3.46Å; Y677-R681 PolarHBondContact O-N 3.15Å; Y677-F682 HydrophobicContact CD1-CD1 4.43Å; Y677-F682 AromaticContact CD1-CD2 3.77Å; Y677-F682 HydrophobicContact CD1-CD2 3.77Å; Y677-F682 HydrophobicContact CD1-CE1 4.36Å; Y677-F682 AromaticContact CD1-CE2 3.69Å; Y677-F682 HydrophobicContact CD1-CE2 3.69Å; Y677-F682 HydrophobicContact CD1-CG 4.16Å; Y677-F682 HydrophobicContact CD1-CZ 4Å; Y677-F682 HydrophobicContact CE1-CD1 4.02Å; Y677-F682 HydrophobicContact CE1-CD2 4.11Å; Y677-F682 AromaticContact CE1-CE1 3.71Å; Y677-F682 HydrophobicContact CE1-CE1 3.71Å; Y677-F682 AromaticContact CE1-CE2 3.8Å; Y677-F682 HydrophobicContact CE1-CE2 3.8Å; Y677-F682 HydrophobicContact CE1-CG 4.22Å; Y677-F682 AromaticContact CE1-CZ 3.59Å; Y677-F682 HydrophobicContact CE1-CZ 3.59Å; Y677-F682 PolarHBondContact O-N 2.73Å
678	A	93.7	Very high	94	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.215	C	C	.	.	I	π-helix	trans	-60.7	-39.2	176.6	0	0	0	0	0	112.4	F623 S674 A675 N683 K684 L687 I691	F623-A678 HydrophobicContact CE1-CB 4.22Å; F623-A678 HydrophobicContact CZ-CB 4.09Å; S674-A678 WeakPolarHBondContact O-CB 3.44Å; S674-A678 PolarHBondContact O-N 2.89Å; A675-A678 PolarHBondContact O-N 3.44Å; A678-N683 WeakPolarHBondContact O-CA 3.24Å; A678-N683 PolarHBondContact O-N 3.03Å; A678-K684 PolarHBondContact O-N 3.46Å; A678-K684 VanDerWaalsContact O-N 3.15Å; A678-L687 HydrophobicContact CB-CB 3.97Å; A678-I691 HydrophobicContact CB-CD1 4.03Å
679	L	91.9	Very high	94.1	Very high	85 Å²	85	49.3 Å²	49.3	45%	0.445	24%	0.236	S	C	.	.	I	π-helix	trans	-79.2	-40	-179	-68.5	173.8	0	0	0	113.3	A675 H676 Y677 Y688	A675-L679 WeakPolarHBondContact O-CG 3.31Å; A675-L679 PolarHBondContact O-N 2.86Å; H676-L679 PolarHBondContact O-N 2.95Å; Y677-L679 VanDerWaalsContact C-N 3.31Å; Y677-L679 PolarHBondContact O-N 2.95Å; L679-Y688 HydrophobicContact CD1-CD2 3.67Å; L679-Y688 HydrophobicContact CD1-CE2 3.74Å; L679-Y688 HydrophobicContact CD1-CG 4.43Å; L679-Y688 HydrophobicContact CD2-CD2 3.96Å; L679-Y688 HydrophobicContact CD2-CG 3.92Å; L679-Y688 HydrophobicContact CG-CD2 3.74Å; L679-Y688 HydrophobicContact CG-CE2 4.33Å; L679-Y688 HydrophobicContact CG-CG 4.21Å
680	T	88.5	Confident	94.3	Very high	78 Å²	78	50.7 Å²	50.7	48%	0.479	24%	0.242	S	C	.	.	I	π-helix	trans	-102.2	-31.5	-169.8	62.5	0	0	0	0	114.4	H676	H676-T680 PolarHBondContact CE1-OG1 3.01Å; H676-T680 WeakPolarHBondContact O-CB 3.3Å; H676-T680 WeakPolarHBondContact O-CG2 3.46Å; H676-T680 PolarHBondContact O-N 3.16Å; H676-T680 PolarHBondContact O-OG1 3.41Å
681	R	90.3	Very high	94.3	Very high	142 Å²	142	50.7 Å²	50.7	54%	0.536	24%	0.242	S	C	.	.	I	π-helix	trans	-103.1	-53.5	-178.1	-62	-63.7	-173.1	-179.1	-1.1	111.7	Y677	Y677-R681 HydrophobicContact CD1-CB 3.68Å; Y677-R681 HydrophobicContact CD1-CG 4.27Å; Y677-R681 HydrophobicContact CD2-CB 4.23Å; Y677-R681 HydrophobicContact CD2-CG 3.9Å; Y677-R681 HydrophobicContact CE1-CB 3.53Å; Y677-R681 HydrophobicContact CE1-CG 4.17Å; Y677-R681 HydrophobicContact CE2-CB 4.13Å; Y677-R681 HydrophobicContact CE2-CG 3.83Å; Y677-R681 HydrophobicContact CG-CB 4.02Å; Y677-R681 HydrophobicContact CG-CG 4.12Å; Y677-R681 WeakPolarHBondContact O-CA 3.32Å; Y677-R681 WeakPolarHBondContact O-CB 3.46Å; Y677-R681 PolarHBondContact O-N 3.15Å
682	F	92.9	Very high	94.3	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.009	26%	0.256	C	S	.	.	I	π-helix	trans	-75.6	-31.1	176.2	-68.3	-36.9	0	0	0	112.6	V81 Y84 T85 F308 F623 Y677 K684 L687	V81-F682 HydrophobicContact CB-CD1 4.48Å; V81-F682 HydrophobicContact CG1-CB 4.33Å; V81-F682 HydrophobicContact CG1-CD1 3.96Å; V81-F682 WeakPolarHBondContact CG1-O 3.38Å; V81-F682 HydrophobicContact CG2-CD1 3.99Å; V81-F682 HydrophobicContact CG2-CE1 4.45Å; Y84-F682 HydrophobicContact CD1-CE1 4.02Å; Y84-F682 AromaticContact CD1-CZ 3.9Å; Y84-F682 HydrophobicContact CD1-CZ 3.9Å; Y84-F682 HydrophobicContact CE1-CE1 4.33Å; Y84-F682 HydrophobicContact CE1-CE2 4.16Å; Y84-F682 AromaticContact CE1-CZ 3.74Å; Y84-F682 HydrophobicContact CE1-CZ 3.74Å; T85-F682 HydrophobicContact CG2-CB 4.36Å; T85-F682 HydrophobicContact CG2-CD1 4.33Å; T85-F682 HydrophobicContact CG2-CG 4.27Å; F308-F682 AromaticContact CE1-CE1 3.9Å; F308-F682 HydrophobicContact CE1-CE1 3.9Å; F308-F682 HydrophobicContact CZ-CE1 4.12Å; F623-F682 HydrophobicContact CD1-CD2 4.19Å; F623-F682 AromaticContact CD1-CE2 3.71Å; F623-F682 HydrophobicContact CD1-CE2 3.71Å; F623-F682 AromaticContact CD2-CE2 3.77Å; F623-F682 HydrophobicContact CD2-CE2 3.77Å; 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 4.23Å; F623-F682 AromaticContact CE2-CE2 3.67Å; F623-F682 HydrophobicContact CE2-CE2 3.67Å; F623-F682 AromaticContact CG-CE2 3.79Å; F623-F682 HydrophobicContact CG-CE2 3.79Å; F623-F682 AromaticContact CZ-CD2 3.71Å; F623-F682 HydrophobicContact CZ-CD2 3.71Å; F623-F682 AromaticContact CZ-CE2 3.58Å; F623-F682 HydrophobicContact CZ-CE2 3.58Å; Y677-F682 HydrophobicContact CD1-CD1 4.43Å; Y677-F682 AromaticContact CD1-CD2 3.77Å; Y677-F682 HydrophobicContact CD1-CD2 3.77Å; Y677-F682 HydrophobicContact CD1-CE1 4.36Å; Y677-F682 AromaticContact CD1-CE2 3.69Å; Y677-F682 HydrophobicContact CD1-CE2 3.69Å; Y677-F682 HydrophobicContact CD1-CG 4.16Å; Y677-F682 HydrophobicContact CD1-CZ 4Å; Y677-F682 HydrophobicContact CE1-CD1 4.02Å; Y677-F682 HydrophobicContact CE1-CD2 4.11Å; Y677-F682 AromaticContact CE1-CE1 3.71Å; Y677-F682 HydrophobicContact CE1-CE1 3.71Å; Y677-F682 AromaticContact CE1-CE2 3.8Å; Y677-F682 HydrophobicContact CE1-CE2 3.8Å; Y677-F682 HydrophobicContact CE1-CG 4.22Å; Y677-F682 AromaticContact CE1-CZ 3.59Å; Y677-F682 HydrophobicContact CE1-CZ 3.59Å; Y677-F682 PolarHBondContact O-N 2.73Å; F682-K684 HydrophobicContact CB-CG 4.47Å; F682-K684 PolarHBondContact O-N 3.49Å; F682-K684 PolarHBondContact O-NZ 3Å; F682-L687 HydrophobicContact CB-CD1 4.05Å; F682-L687 HydrophobicContact CD2-CD1 3.71Å; F682-L687 HydrophobicContact CG-CD1 4.17Å
683	N	95.2	Very high	94.4	Very high	121 Å²	121	55.8 Å²	55.8	65%	0.647	28%	0.276	S	S	*	.			trans	50.6	56.8	-177.7	-168	20.7	0	0	0	111.2	A678	A678-N683 WeakPolarHBondContact O-CA 3.24Å; A678-N683 PolarHBondContact O-N 3.03Å
684	K	93.7	Very high	94.6	Very high	62 Å²	62	55.2 Å²	55.2	27%	0.27	27%	0.273	S	S	.	.			trans	-133.4	123.4	178.5	-61.8	-64	164.5	-69.4	0	110.8	T85 A678 F682 F686 L687	T85-K684 HydrophobicContact CG2-CG 4.04Å; T85-K684 WeakPolarHBondContact OG1-CE 3.39Å; A678-K684 PolarHBondContact O-N 3.46Å; A678-K684 VanDerWaalsContact O-N 3.15Å; F682-K684 HydrophobicContact CB-CG 4.47Å; F682-K684 PolarHBondContact O-N 3.49Å; F682-K684 PolarHBondContact O-NZ 3Å; K684-F686 HydrophobicContact CB-CD1 4.11Å; K684-F686 HydrophobicContact CB-CE1 3.86Å; K684-F686 HydrophobicContact CB-CZ 4.47Å; K684-F686 HydrophobicContact CD-CE1 4.11Å; K684-F686 HydrophobicContact CG-CE1 4.04Å; K684-L687 HydrophobicContact CB-CB 4.44Å; K684-L687 HydrophobicContact CB-CD1 4.01Å; K684-L687 HydrophobicContact CB-CG 4.13Å; K684-L687 HydrophobicContact CG-CD1 4.39Å
685	Q	93.1	Very high	94.6	Very high	159 Å²	159	55.8 Å²	55.8	74%	0.743	28%	0.276	S	S	*	.	H	α-helix	trans	-64.6	-49.4	179.6	-69.4	176.9	-8.8	0	0	111.9	L687 Y688 D689	Q685-L687 PolarHBondContact O-N 3.4Å; Q685-L687 VanDerWaalsContact O-N 3.07Å; Q685-Y688 CarbonylContact O-C 3.59Å; Q685-Y688 WeakPolarHBondContact O-CA 3.26Å; Q685-Y688 WeakPolarHBondContact O-CB 3.12Å; Q685-Y688 PolarHBondContact O-N 3.13Å; Q685-D689 VanDerWaalsContact O-CG 3.28Å; Q685-D689 PolarHBondContact O-N 3.21Å
686	F	96.2	Very high	94.7	Very high	66 Å²	66	60.9 Å²	60.9	29%	0.289	30%	0.303	S	S	.	.	H	α-helix	trans	-58.5	-30.4	-175.7	75	-95.6	0	0	0	113.9	T85 K684 E690	T85-F686 WeakPolarHBondContact O-CZ 3.48Å; K684-F686 HydrophobicContact CB-CD1 4.11Å; K684-F686 HydrophobicContact CB-CE1 3.86Å; K684-F686 HydrophobicContact CB-CZ 4.47Å; K684-F686 HydrophobicContact CD-CE1 4.11Å; K684-F686 HydrophobicContact CG-CE1 4.04Å; F686-E690 WeakPolarHBondContact O-CB 3.36Å; F686-E690 VanDerWaalsContact O-CG 3.27Å; F686-E690 WeakPolarHBondContact O-CG 3.43Å; F686-E690 PolarHBondContact O-N 3.12Å; F686-E690 VanDerWaalsContact O-N 3.09Å
687	L	96.4	Very high	94.9	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-67.9	-42.8	174.3	-69.8	178.4	0	0	0	111	T85 W622 F623 A678 F682 K684 Q685 E690 I691	T85-L687 HydrophobicContact CG2-CD1 3.9Å; W622-L687 HydrophobicContact CZ3-CD2 4.48Å; F623-L687 HydrophobicContact CE1-CD1 4.15Å; A678-L687 HydrophobicContact CB-CB 3.97Å; F682-L687 HydrophobicContact CB-CD1 4.05Å; F682-L687 HydrophobicContact CD2-CD1 3.71Å; F682-L687 HydrophobicContact CG-CD1 4.17Å; K684-L687 HydrophobicContact CB-CB 4.44Å; K684-L687 HydrophobicContact CB-CD1 4.01Å; K684-L687 HydrophobicContact CB-CG 4.13Å; K684-L687 HydrophobicContact CG-CD1 4.39Å; Q685-L687 PolarHBondContact O-N 3.4Å; Q685-L687 VanDerWaalsContact O-N 3.07Å; L687-E690 PolarHBondContact O-N 2.89Å; L687-I691 WeakPolarHBondContact O-CD1 3.45Å; L687-I691 VanDerWaalsContact O-CG1 3.24Å; L687-I691 WeakPolarHBondContact O-CG1 3.41Å; L687-I691 PolarHBondContact O-N 2.92Å
688	Y	96.5	Very high	95	Very high	39 Å²	39	58.9 Å²	58.9	15%	0.153	30%	0.298	C	S	.	.	H	α-helix	trans	-65.7	-42.9	174.8	-179.4	-93.2	0	0	0	111.5	A675 L679 Q685 E690 I691 E692 R760	A675-Y688 HydrophobicContact CB-CD2 3.93Å; A675-Y688 HydrophobicContact CB-CE2 3.9Å; L679-Y688 HydrophobicContact CD1-CD2 3.67Å; L679-Y688 HydrophobicContact CD1-CE2 3.74Å; L679-Y688 HydrophobicContact CD1-CG 4.43Å; L679-Y688 HydrophobicContact CD2-CD2 3.96Å; L679-Y688 HydrophobicContact CD2-CG 3.92Å; L679-Y688 HydrophobicContact CG-CD2 3.74Å; L679-Y688 HydrophobicContact CG-CE2 4.33Å; L679-Y688 HydrophobicContact CG-CG 4.21Å; Q685-Y688 CarbonylContact O-C 3.59Å; Q685-Y688 WeakPolarHBondContact O-CA 3.26Å; Q685-Y688 WeakPolarHBondContact O-CB 3.12Å; Q685-Y688 PolarHBondContact O-N 3.13Å; Y688-E690 VanDerWaalsContact C-N 3.25Å; Y688-E690 PolarHBondContact O-N 2.91Å; Y688-I691 PolarHBondContact O-N 2.99Å; Y688-E692 HydrophobicContact CE1-CB 4.27Å; Y688-E692 WeakPolarHBondContact O-CB 3.31Å; Y688-E692 PolarHBondContact O-N 3.5Å; Y688-R760 PolarHBondContact OH-NH1 3.45Å
689	D	96	Very high	95.2	Very high	87 Å²	87	59.9 Å²	59.9	47%	0.465	30%	0.302	S	S	.	.	H	α-helix	trans	-57.9	-40.6	178.2	-58.5	-24	0	0	0	111.2	Q685 A693	Q685-D689 VanDerWaalsContact O-CG 3.28Å; Q685-D689 PolarHBondContact O-N 3.21Å; D689-A693 VanDerWaalsContact O-CB 3.31Å; D689-A693 WeakPolarHBondContact O-CB 3.29Å; D689-A693 PolarHBondContact O-N 3.37Å
690	E	97.6	Very high	95.3	Very high	44 Å²	44	60.3 Å²	60.3	21%	0.206	31%	0.305	C	S	.	.	H	α-helix	trans	-70.3	-41.9	176.4	-73.4	173.3	-175.1	0	0	112.8	R87 W622 Q637 F686 L687 Y688 E692 A693 E694	R87-E690 IonicContact CZ-OE1 2.55Å; R87-E690 IonicContact CZ-OE2 3.73Å; R87-E690 IonicContact NH1-OE1 3.27Å; R87-E690 PolarHBondContact NH1-OE1 3.29Å; R87-E690 IonicContact NH1-OE2 2.68Å; R87-E690 IonicContact NH2-OE1 3.84Å; R87-E690 PolarHBondContact NH2-OE1 2.93Å; R87-E690 IonicContact NH2-OE2 3.63Å; R87-E690 PolarHBondContact NH2-OE2 3.3Å; W622-E690 HydrophobicContact CH2-CB 3.91Å; W622-E690 HydrophobicContact CZ2-CB 4.21Å; Q637-E690 PolarHBondContact NE2-OE2 3.34Å; F686-E690 WeakPolarHBondContact O-CB 3.36Å; F686-E690 VanDerWaalsContact O-CG 3.27Å; F686-E690 WeakPolarHBondContact O-CG 3.43Å; F686-E690 PolarHBondContact O-N 3.12Å; F686-E690 VanDerWaalsContact O-N 3.09Å; L687-E690 PolarHBondContact O-N 2.89Å; Y688-E690 VanDerWaalsContact C-N 3.25Å; Y688-E690 PolarHBondContact O-N 2.91Å; E690-E692 VanDerWaalsContact C-N 3.33Å; E690-A693 PolarHBondContact O-N 2.72Å; E690-E694 WeakPolarHBondContact O-CB 3.16Å; E690-E694 PolarHBondContact O-N 3.35Å
691	I	97.3	Very high	95.7	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-45.6	174	-68.5	164.5	0	0	0	110.1	W622 F623 Y671 A675 A678 L687 Y688 E694 V695 L758	W622-I691 HydrophobicContact CD2-CD1 4.29Å; W622-I691 HydrophobicContact CD2-CG1 3.67Å; W622-I691 HydrophobicContact CE3-CD1 3.82Å; W622-I691 HydrophobicContact CE3-CG1 3.57Å; W622-I691 HydrophobicContact CH2-CD1 4.29Å; W622-I691 HydrophobicContact CH2-CG1 3.45Å; W622-I691 VanDerWaalsContact CH2-CG1 3.45Å; W622-I691 HydrophobicContact CZ2-CB 4.37Å; W622-I691 HydrophobicContact CZ2-CG1 3.53Å; W622-I691 HydrophobicContact CZ3-CD1 3.82Å; W622-I691 HydrophobicContact CZ3-CG1 3.46Å; W622-I691 VanDerWaalsContact CZ3-CG1 3.46Å; F623-I691 HydrophobicContact CE1-CD1 4.3Å; F623-I691 HydrophobicContact CZ-CD1 4.46Å; 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 3.45Å; L687-I691 VanDerWaalsContact O-CG1 3.24Å; L687-I691 WeakPolarHBondContact O-CG1 3.41Å; L687-I691 PolarHBondContact O-N 2.92Å; Y688-I691 PolarHBondContact O-N 2.99Å; I691-E694 PolarHBondContact O-N 3.45Å; I691-V695 HydrophobicContact CG2-CG2 4.39Å; I691-V695 WeakPolarHBondContact O-CB 3.41Å; I691-V695 WeakPolarHBondContact O-CG2 3.4Å; I691-V695 PolarHBondContact O-N 2.92Å; I691-L758 HydrophobicContact CG2-CD2 4.2Å
692	E	96.4	Very high	96.1	Very high	61 Å²	61	52.8 Å²	52.8	29%	0.285	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-45	180	-178	174.5	-104.2	0	0	111.7	Y688 E690 E694 V695 N696 L758 R760	Y688-E692 HydrophobicContact CE1-CB 4.27Å; Y688-E692 WeakPolarHBondContact O-CB 3.31Å; Y688-E692 PolarHBondContact O-N 3.5Å; E690-E692 VanDerWaalsContact C-N 3.33Å; E692-E694 VanDerWaalsContact C-N 3.33Å; E692-E694 PolarHBondContact O-N 3.18Å; E692-V695 PolarHBondContact O-N 3.49Å; E692-N696 WeakPolarHBondContact O-CB 3.23Å; E692-N696 PolarHBondContact O-N 3.37Å; E692-L758 HydrophobicContact CB-CD1 4.13Å; E692-L758 HydrophobicContact CG-CD1 4.24Å; E692-R760 IonicContact OE1-CZ 2.83Å; E692-R760 VanDerWaalsContact OE1-CZ 3.23Å; E692-R760 IonicContact OE1-NH1 2.67Å; E692-R760 PolarHBondContact OE1-NH1 2.78Å; E692-R760 IonicContact OE1-NH2 3.46Å; E692-R760 PolarHBondContact OE1-NH2 2.73Å
693	A	96.3	Very high	96.3	Very high	63 Å²	63	52.8 Å²	52.8	52%	0.521	27%	0.27	S	S	.	.	H	α-helix	trans	-62.5	-40.2	176.2	0	0	0	0	0	112.2	D689 E690 N696 L697	D689-A693 VanDerWaalsContact O-CB 3.31Å; D689-A693 WeakPolarHBondContact O-CB 3.29Å; D689-A693 PolarHBondContact O-N 3.37Å; E690-A693 PolarHBondContact O-N 2.72Å; A693-N696 PolarHBondContact O-N 2.94Å; A693-L697 PolarHBondContact O-N 2.95Å
694	E	98.1	Very high	96.3	Very high	15 Å²	15	54.1 Å²	54.1	7%	0.07	27%	0.267	C	S	.	.	H	α-helix	trans	-65.9	-47.2	176.1	-174.5	169.4	141.9	0	0	111.7	W622 R624 I640 S643 Y671 E690 I691 E692 N696 L697 C698	W622-E694 PolarHBondContact NE1-OE1 3.24Å; W622-E694 VanDerWaalsContact NE1-OE1 3.15Å; W622-E694 PolarHBondContact NE1-OE2 2.91Å; R624-E694 IonicContact CZ-OE2 3.21Å; R624-E694 IonicContact NH1-OE2 2.77Å; R624-E694 IonicContact NH2-OE1 3.69Å; R624-E694 IonicContact NH2-OE2 2.78Å; R624-E694 PolarHBondContact NH2-OE2 3.46Å; I640-E694 HydrophobicContact CG2-CG 3.87Å; S643-E694 WeakPolarHBondContact CB-OE1 3.35Å; S643-E694 PolarHBondContact OG-OE1 3.41Å; Y671-E694 HydrophobicContact CE1-CG 4.16Å; Y671-E694 PolarHBondContact OH-OE1 3.5Å; E690-E694 WeakPolarHBondContact O-CB 3.16Å; E690-E694 PolarHBondContact O-N 3.35Å; I691-E694 PolarHBondContact O-N 3.45Å; E692-E694 VanDerWaalsContact C-N 3.33Å; E692-E694 PolarHBondContact O-N 3.18Å; E694-N696 VanDerWaalsContact C-N 3.29Å; E694-N696 PolarHBondContact O-N 3.28Å; E694-L697 PolarHBondContact O-N 3.06Å; E694-C698 VanDerWaalsContact O-CB 3.31Å; E694-C698 WeakPolarHBondContact O-CB 3.48Å; E694-C698 PolarHBondContact O-N 3.42Å; E694-C698 PolarHBondContact O-SG 3.45Å; E694-C698 VanDerWaalsContact O-SG 3.38Å
695	V	97.4	Very high	96.5	Very high	12 Å²	12	53.2 Å²	53.2	7%	0.073	26%	0.263	C	S	.	.	H	α-helix	trans	-58.2	-42.4	175.4	167.3	0	0	0	0	111	Y671 I691 E692 L697 C698 F699 L757 L758	Y671-V695 HydrophobicContact CD1-CG2 3.63Å; Y671-V695 HydrophobicContact CD2-CG2 3.6Å; Y671-V695 HydrophobicContact CE1-CG2 4.15Å; Y671-V695 HydrophobicContact CE2-CG2 4.14Å; Y671-V695 HydrophobicContact CG-CG2 3.31Å; I691-V695 HydrophobicContact CG2-CG2 4.39Å; I691-V695 WeakPolarHBondContact O-CB 3.41Å; I691-V695 WeakPolarHBondContact O-CG2 3.4Å; I691-V695 PolarHBondContact O-N 2.92Å; E692-V695 PolarHBondContact O-N 3.49Å; V695-L697 VanDerWaalsContact C-N 3.35Å; V695-L697 PolarHBondContact O-N 2.82Å; V695-C698 PolarHBondContact O-N 3.22Å; V695-F699 WeakPolarHBondContact O-CB 3.34Å; V695-F699 PolarHBondContact O-N 3.11Å; V695-L757 HydrophobicContact CG1-CD2 3.65Å; V695-L757 HydrophobicContact CG1-CG 4.06Å; V695-L758 HydrophobicContact CB-CD1 3.75Å; V695-L758 HydrophobicContact CG1-CD1 3.83Å; V695-L758 HydrophobicContact CG1-CG 4.32Å; V695-L758 HydrophobicContact CG2-CD1 3.85Å; V695-L758 HydrophobicContact CG2-CG 4.34Å
696	N	94.8	Very high	96.7	Very high	112 Å²	112	45.6 Å²	45.6	60%	0.599	23%	0.228	S	C	*	.	H	α-helix	trans	-59.5	-45.9	179.6	-165.8	46.4	0	0	0	111.7	E692 A693 E694 D700	E692-N696 WeakPolarHBondContact O-CB 3.23Å; E692-N696 PolarHBondContact O-N 3.37Å; A693-N696 PolarHBondContact O-N 2.94Å; E694-N696 VanDerWaalsContact C-N 3.29Å; E694-N696 PolarHBondContact O-N 3.28Å; N696-D700 PolarHBondContact O-N 2.87Å
697	L	96.3	Very high	96.8	Very high	89 Å²	89	42.6 Å²	42.6	47%	0.466	22%	0.215	S	C	.	.	H	α-helix	trans	-67.2	-48.3	177	176.9	61.1	0	0	0	112.5	I640 A693 E694 V695 F699 Q701	I640-L697 HydrophobicContact CD1-CD2 4.07Å; I640-L697 HydrophobicContact CD1-CG 4.37Å; I640-L697 HydrophobicContact CG2-CD2 4.16Å; A693-L697 PolarHBondContact O-N 2.95Å; E694-L697 PolarHBondContact O-N 3.06Å; V695-L697 VanDerWaalsContact C-N 3.35Å; V695-L697 PolarHBondContact O-N 2.82Å; L697-F699 VanDerWaalsContact C-N 3.35Å; L697-Q701 PolarHBondContact O-N 3.18Å
698	C	96.9	Very high	96.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.1	-37.3	-178	-74	0	0	0	0	111.9	W646 E694 V695 Q701 F702	W646-C698 HydrophobicContact CD2-CB 3.91Å; W646-C698 HydrophobicContact CE3-CB 3.46Å; W646-C698 VanDerWaalsContact CE3-CB 3.46Å; W646-C698 VanDerWaalsContact CG-SG 3.59Å; W646-C698 HydrophobicContact CH2-CB 4.22Å; W646-C698 WeakPolarHBondContact CH2-O 3.32Å; W646-C698 HydrophobicContact CZ3-CB 3.64Å; W646-C698 VanDerWaalsContact CZ3-O 3.29Å; W646-C698 WeakPolarHBondContact CZ3-O 3.43Å; E694-C698 VanDerWaalsContact O-CB 3.31Å; E694-C698 WeakPolarHBondContact O-CB 3.48Å; E694-C698 PolarHBondContact O-N 3.42Å; E694-C698 PolarHBondContact O-SG 3.45Å; E694-C698 VanDerWaalsContact O-SG 3.38Å; V695-C698 PolarHBondContact O-N 3.22Å; C698-Q701 PolarHBondContact O-N 3.13Å; C698-F702 WeakPolarHBondContact O-CB 3.29Å; C698-F702 PolarHBondContact O-N 3.2Å
699	F	96.4	Very high	96.8	Very high	21 Å²	21	42.8 Å²	42.8	9%	0.092	22%	0.219	C	C	.	.	H	α-helix	trans	-70.7	-37.2	-179.9	-168.2	-103	0	0	0	112.3	L668 V695 L697 Q701 F702 V703 L757 I762 L764 L767	L668-F699 HydrophobicContact CD2-CD2 3.91Å; L668-F699 HydrophobicContact CD2-CE2 4.19Å; V695-F699 WeakPolarHBondContact O-CB 3.34Å; V695-F699 PolarHBondContact O-N 3.11Å; L697-F699 VanDerWaalsContact C-N 3.35Å; F699-Q701 VanDerWaalsContact C-N 3.33Å; F699-Q701 PolarHBondContact O-N 3.17Å; F699-F702 HydrophobicContact CD2-CD1 4.35Å; F699-F702 HydrophobicContact CE2-CD1 4.14Å; F699-F702 WeakPolarHBondContact O-CB 3.39Å; F699-F702 PolarHBondContact O-N 2.79Å; F699-V703 HydrophobicContact CD1-CG2 4.07Å; F699-V703 HydrophobicContact CE1-CG2 3.66Å; F699-V703 HydrophobicContact CZ-CG2 3.9Å; F699-V703 WeakPolarHBondContact O-CG2 3.15Å; F699-V703 PolarHBondContact O-N 3.41Å; F699-L757 HydrophobicContact CD2-CD2 4.05Å; F699-L757 HydrophobicContact CE2-CD2 4.47Å; F699-I762 HydrophobicContact CE1-CG2 3.72Å; F699-I762 HydrophobicContact CZ-CB 4.36Å; F699-I762 HydrophobicContact CZ-CG2 3.57Å; F699-L764 HydrophobicContact CZ-CD1 4.38Å; F699-L767 HydrophobicContact CE1-CD1 3.69Å; F699-L767 HydrophobicContact CZ-CD1 4.2Å
700	D	95.8	Very high	96.9	Very high	93 Å²	93	38.6 Å²	38.6	50%	0.497	20%	0.197	S	C	.	.	H	α-helix	trans	-60.5	-44.2	171.2	-86.1	-13.9	0	0	0	111.5	N696 V703 Y704	N696-D700 PolarHBondContact O-N 2.87Å; D700-V703 PolarHBondContact O-N 2.7Å; D700-Y704 WeakPolarHBondContact O-CB 3.26Å; D700-Y704 PolarHBondContact O-N 2.55Å
701	Q	96.3	Very high	97	Very high	63 Å²	63	36.7 Å²	36.7	29%	0.294	19%	0.187	S	C	.	.	H	α-helix	trans	-64.3	-40.3	174.2	-68.9	-172.6	38.8	0	0	112.1	W646 L697 C698 F699 Y704 K705	W646-Q701 HydrophobicContact CH2-CB 3.79Å; W646-Q701 HydrophobicContact CZ2-CB 3.8Å; L697-Q701 PolarHBondContact O-N 3.18Å; C698-Q701 PolarHBondContact O-N 3.13Å; F699-Q701 VanDerWaalsContact C-N 3.33Å; F699-Q701 PolarHBondContact O-N 3.17Å; Q701-Y704 PolarHBondContact O-N 3.36Å; Q701-K705 WeakPolarHBondContact O-CB 3.49Å; Q701-K705 WeakPolarHBondContact O-CG 3.2Å; Q701-K705 PolarHBondContact O-N 3.35Å
702	F	97.8	Very high	97	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.5	-53.3	176.4	175.9	-86.3	0	0	0	110.7	W646 T649 L653 V664 L665 C698 F699 Y704 K705 L706 L764	W646-F702 HydrophobicContact CH2-CB 4.45Å; W646-F702 HydrophobicContact CZ3-CB 4.4Å; T649-F702 HydrophobicContact CG2-CD2 3.9Å; T649-F702 HydrophobicContact CG2-CE2 4.33Å; L653-F702 HydrophobicContact CD1-CB 4.3Å; L653-F702 HydrophobicContact CD1-CD2 3.76Å; L653-F702 HydrophobicContact CD1-CE2 4.5Å; L653-F702 HydrophobicContact CD1-CG 4.34Å; L653-F702 HydrophobicContact CD2-CD2 4.19Å; L653-F702 HydrophobicContact CD2-CE2 4.18Å; L653-F702 HydrophobicContact CG-CD2 4.4Å; V664-F702 HydrophobicContact CG1-CE2 3.94Å; V664-F702 HydrophobicContact CG1-CZ 4.11Å; V664-F702 HydrophobicContact CG2-CE2 3.8Å; L665-F702 HydrophobicContact CD2-CE1 4.31Å; L665-F702 HydrophobicContact CD2-CE2 4.42Å; L665-F702 HydrophobicContact CD2-CZ 3.72Å; C698-F702 WeakPolarHBondContact O-CB 3.29Å; C698-F702 PolarHBondContact O-N 3.2Å; F699-F702 HydrophobicContact CD2-CD1 4.35Å; F699-F702 HydrophobicContact CE2-CD1 4.14Å; F699-F702 WeakPolarHBondContact O-CB 3.39Å; F699-F702 PolarHBondContact O-N 2.79Å; F702-Y704 VanDerWaalsContact C-N 3.32Å; F702-Y704 PolarHBondContact O-N 3.08Å; F702-K705 PolarHBondContact O-N 3.19Å; F702-L706 HydrophobicContact CD1-CD2 4.47Å; F702-L706 HydrophobicContact CE1-CD2 3.65Å; F702-L706 HydrophobicContact CZ-CD2 3.81Å; F702-L706 WeakPolarHBondContact O-CB 3.23Å; F702-L706 PolarHBondContact O-N 2.97Å; F702-L764 HydrophobicContact CD1-CD1 4.38Å; F702-L764 HydrophobicContact CE1-CD1 3.88Å; F702-L764 HydrophobicContact CE1-CD2 4Å
703	V	97.4	Very high	97.1	Very high	1 Å²	1	36 Å²	36	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-41.9	179.5	173	0	0	0	0	110.9	F699 D700 A707 L764 L767	F699-V703 HydrophobicContact CD1-CG2 4.07Å; F699-V703 HydrophobicContact CE1-CG2 3.66Å; F699-V703 HydrophobicContact CZ-CG2 3.9Å; F699-V703 WeakPolarHBondContact O-CG2 3.15Å; F699-V703 PolarHBondContact O-N 3.41Å; D700-V703 PolarHBondContact O-N 2.7Å; V703-A707 WeakPolarHBondContact O-CB 3.38Å; V703-A707 PolarHBondContact O-N 3.2Å; V703-L764 HydrophobicContact CG2-CD1 4.1Å; V703-L767 HydrophobicContact CG1-CB 3.93Å; V703-L767 HydrophobicContact CG2-CB 4.42Å; V703-L767 HydrophobicContact CG2-CD1 4.04Å
704	Y	96.4	Very high	97.2	Very high	149 Å²	149	33.3 Å²	33.3	58%	0.584	16%	0.162	S	C	*	.	H	α-helix	trans	-62.8	-56.8	178.1	179.8	-91.7	0	0	0	111.9	D700 Q701 F702 L706 A707 D708	D700-Y704 WeakPolarHBondContact O-CB 3.26Å; D700-Y704 PolarHBondContact O-N 2.55Å; Q701-Y704 PolarHBondContact O-N 3.36Å; F702-Y704 VanDerWaalsContact C-N 3.32Å; F702-Y704 PolarHBondContact O-N 3.08Å; Y704-L706 VanDerWaalsContact C-N 3.3Å; Y704-L706 PolarHBondContact O-N 3.29Å; Y704-A707 PolarHBondContact O-N 3.01Å; Y704-D708 VanDerWaalsContact O-CB 3.23Å; Y704-D708 WeakPolarHBondContact O-CB 3.47Å; Y704-D708 PolarHBondContact O-N 2.95Å
705	K	97.4	Very high	97.2	Very high	43 Å²	43	32.6 Å²	32.6	19%	0.187	16%	0.159	C	C	.	.	H	α-helix	trans	-62.1	-38.9	-178	-71.1	-169.7	179.3	-164	0	111.5	D650 L653 E654 Q701 F702 Q709	D650-K705 VanDerWaalsContact CG-NZ 3.35Å; D650-K705 WeakPolarHBondContact OD1-CE 3.42Å; D650-K705 IonicContact OD1-NZ 2.69Å; D650-K705 PolarHBondContact OD1-NZ 2.92Å; D650-K705 IonicContact OD2-NZ 2.68Å; D650-K705 PolarHBondContact OD2-NZ 3.3Å; L653-K705 HydrophobicContact CB-CB 4.29Å; L653-K705 HydrophobicContact CB-CD 4.14Å; L653-K705 HydrophobicContact CD1-CB 4.3Å; L653-K705 HydrophobicContact CD1-CD 4.39Å; E654-K705 IonicContact OE2-NZ 3.71Å; E654-K705 PolarHBondContact OE2-NZ 3.05Å; Q701-K705 WeakPolarHBondContact O-CB 3.49Å; Q701-K705 WeakPolarHBondContact O-CG 3.2Å; Q701-K705 PolarHBondContact O-N 3.35Å; F702-K705 PolarHBondContact O-N 3.19Å; K705-Q709 VanDerWaalsContact O-CG 3.23Å; K705-Q709 WeakPolarHBondContact O-CG 3.43Å; K705-Q709 PolarHBondContact O-N 3.46Å; K705-Q709 VanDerWaalsContact O-N 3.15Å; K705-Q709 PolarHBondContact O-NE2 3.37Å
706	L	97.4	Very high	97.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69	-47.9	179.3	-177.3	60	0	0	0	111.8	L653 M661 F702 Y704 D708 Q709 I710 Y746 L749 L764 I768	L653-L706 HydrophobicContact CD2-CB 4.3Å; M661-L706 HydrophobicContact SD-CD1 4.19Å; F702-L706 HydrophobicContact CD1-CD2 4.47Å; F702-L706 HydrophobicContact CE1-CD2 3.65Å; F702-L706 HydrophobicContact CZ-CD2 3.81Å; F702-L706 WeakPolarHBondContact O-CB 3.23Å; F702-L706 PolarHBondContact O-N 2.97Å; Y704-L706 VanDerWaalsContact C-N 3.3Å; Y704-L706 PolarHBondContact O-N 3.29Å; L706-D708 PolarHBondContact O-N 3.02Å; L706-Q709 VanDerWaalsContact O-CG 3.31Å; L706-Q709 WeakPolarHBondContact O-CG 3.2Å; L706-I710 HydrophobicContact CD1-CD1 3.78Å; L706-I710 HydrophobicContact CD1-CG1 4.21Å; L706-I710 HydrophobicContact CG-CD1 3.73Å; L706-I710 WeakPolarHBondContact O-CB 3.36Å; L706-I710 WeakPolarHBondContact O-CD1 3.49Å; L706-I710 WeakPolarHBondContact O-CG1 3.46Å; L706-I710 PolarHBondContact O-N 3.25Å; L706-Y746 HydrophobicContact CD1-CD1 3.96Å; L706-Y746 HydrophobicContact CD1-CE1 4.11Å; L706-L749 HydrophobicContact CD1-CD1 3.68Å; L706-L749 HydrophobicContact CD2-CB 4.37Å; L706-L749 HydrophobicContact CD2-CD1 4Å; L706-L764 HydrophobicContact CD2-CD2 4.24Å; L706-I768 HydrophobicContact CD2-CD1 3.89Å; L706-I768 HydrophobicContact CG-CD1 4.33Å
707	A	97.8	Very high	97.3	Very high	3 Å²	3	29.9 Å²	29.9	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-66	-39.8	179.2	0	0	0	0	0	112.2	V703 Y704 I710 F711 I768 R771	V703-A707 WeakPolarHBondContact O-CB 3.38Å; V703-A707 PolarHBondContact O-N 3.2Å; Y704-A707 PolarHBondContact O-N 3.01Å; A707-I710 PolarHBondContact O-N 2.81Å; A707-F711 PolarHBondContact O-N 3.46Å; A707-I768 HydrophobicContact CB-CG2 4.36Å; A707-R771 HydrophobicContact CB-CB 3.64Å; A707-R771 HydrophobicContact CB-CG 4.29Å
708	D	96.7	Very high	97.4	Very high	39 Å²	39	25.6 Å²	25.6	21%	0.209	12%	0.122	C	C	.	.	H	α-helix	trans	-59.9	-49.5	177.4	-175.5	70.3	0	0	0	111.5	Y704 L706 F711 A712 Q886	Y704-D708 VanDerWaalsContact O-CB 3.23Å; Y704-D708 WeakPolarHBondContact O-CB 3.47Å; Y704-D708 PolarHBondContact O-N 2.95Å; L706-D708 PolarHBondContact O-N 3.02Å; D708-F711 PolarHBondContact O-N 2.72Å; D708-A712 WeakPolarHBondContact O-CB 3.33Å; D708-A712 PolarHBondContact O-N 3.14Å; D708-Q886 PolarHBondContact OD1-NE2 3.23Å
709	Q	96.8	Very high	97.5	Very high	3 Å²	3	25.6 Å²	25.6	1%	0.014	12%	0.122	C	C	.	.	H	α-helix	trans	-69.8	-33.6	178.9	73.1	-170.8	-86.1	0	0	113.4	L653 K656 K705 L706 Y713 Y746	L653-Q709 PolarHBondContact O-NE2 2.86Å; L653-Q709 VanDerWaalsContact O-NE2 3.13Å; K656-Q709 HydrophobicContact CD-CB 4.1Å; K705-Q709 VanDerWaalsContact O-CG 3.23Å; K705-Q709 WeakPolarHBondContact O-CG 3.43Å; K705-Q709 PolarHBondContact O-N 3.46Å; K705-Q709 VanDerWaalsContact O-N 3.15Å; K705-Q709 PolarHBondContact O-NE2 3.37Å; L706-Q709 VanDerWaalsContact O-CG 3.31Å; L706-Q709 WeakPolarHBondContact O-CG 3.2Å; Q709-Y713 WeakPolarHBondContact O-CB 3.27Å; Q709-Y713 PolarHBondContact O-N 2.82Å; Q709-Y746 HydrophobicContact CG-CE1 3.82Å; Q709-Y746 PolarHBondContact OE1-OH 3.28Å
710	I	98.1	Very high	97.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.8	-49	174.7	-75.9	170.1	0	0	0	110.5	L706 A707 Y713 Y714 Y746 L750 I768 V772 L812	L706-I710 HydrophobicContact CD1-CD1 3.78Å; L706-I710 HydrophobicContact CD1-CG1 4.21Å; L706-I710 HydrophobicContact CG-CD1 3.73Å; L706-I710 WeakPolarHBondContact O-CB 3.36Å; L706-I710 WeakPolarHBondContact O-CD1 3.49Å; L706-I710 WeakPolarHBondContact O-CG1 3.46Å; L706-I710 PolarHBondContact O-N 3.25Å; A707-I710 PolarHBondContact O-N 2.81Å; I710-Y713 PolarHBondContact O-N 3.31Å; I710-Y714 HydrophobicContact CG2-CD2 3.93Å; I710-Y714 HydrophobicContact CG2-CE2 4.02Å; I710-Y714 VanDerWaalsContact O-CD2 3.3Å; I710-Y714 WeakPolarHBondContact O-CD2 3.42Å; I710-Y714 PolarHBondContact O-N 2.87Å; I710-Y746 HydrophobicContact CD1-CD1 4.13Å; I710-Y746 HydrophobicContact CD1-CG 4.3Å; I710-Y746 HydrophobicContact CG1-CD1 3.58Å; I710-Y746 HydrophobicContact CG1-CD2 4.13Å; I710-Y746 HydrophobicContact CG1-CE1 4.06Å; I710-Y746 HydrophobicContact CG1-CG 3.62Å; I710-L750 HydrophobicContact CD1-CD2 4Å; I710-L750 HydrophobicContact CD1-CG 4.21Å; I710-L750 HydrophobicContact CG2-CD2 4.3Å; I710-I768 HydrophobicContact CD1-CD1 4.08Å; I710-I768 HydrophobicContact CD1-CG2 4.24Å; I710-V772 HydrophobicContact CG2-CG2 4.49Å; I710-L812 HydrophobicContact CG2-CD2 4.25Å
711	F	98.4	Very high	97.5	Very high	3 Å²	3	25 Å²	25	1%	0.013	12%	0.12	C	C	.	.	H	α-helix	trans	-62	-47.1	178.6	177.4	-103.7	0	0	0	111.3	A707 D708 Y713 Y714 K715 V772 A775 V776 T808 L812 Q886 Y887	A707-F711 PolarHBondContact O-N 3.46Å; D708-F711 PolarHBondContact O-N 2.72Å; F711-Y713 VanDerWaalsContact C-N 3.32Å; F711-Y713 PolarHBondContact O-N 2.82Å; F711-Y714 PolarHBondContact O-N 2.72Å; F711-K715 WeakPolarHBondContact O-CB 3.47Å; F711-K715 PolarHBondContact O-N 2.84Å; F711-V772 HydrophobicContact CD2-CG1 4.42Å; F711-A775 HydrophobicContact CB-CB 4.39Å; F711-A775 HydrophobicContact CD1-CB 3.74Å; F711-A775 HydrophobicContact CD2-CB 3.74Å; F711-A775 HydrophobicContact CE1-CB 3.83Å; F711-A775 HydrophobicContact CE2-CB 3.85Å; F711-A775 HydrophobicContact CG-CB 3.68Å; F711-A775 HydrophobicContact CZ-CB 3.88Å; F711-A775 WeakPolarHBondContact CZ-O 3.38Å; F711-V776 HydrophobicContact CD2-CG2 4.46Å; F711-V776 HydrophobicContact CE2-CG2 3.84Å; F711-T808 HydrophobicContact CE2-CG2 4.25Å; F711-L812 HydrophobicContact CD2-CD1 4.23Å; F711-Q886 HydrophobicContact CD1-CB 4.42Å; F711-Q886 HydrophobicContact CD1-CG 4.46Å; F711-Q886 HydrophobicContact CE1-CB 4.47Å; F711-Q886 VanDerWaalsContact CE1-O 3.26Å; F711-Q886 WeakPolarHBondContact CE1-O 3.31Å; F711-Y887 AromaticContact CE1-CD1 3.87Å; F711-Y887 HydrophobicContact CE1-CD1 3.87Å; F711-Y887 HydrophobicContact CE1-CE1 4.02Å; F711-Y887 HydrophobicContact CZ-CD1 4.49Å
712	A	98.1	Very high	97.5	Very high	15 Å²	15	25.7 Å²	25.7	12%	0.124	13%	0.125	C	C	.	.	H	α-helix	trans	-58.5	-43.3	176.8	0	0	0	0	0	112.1	D708 K715 V716 Q886	D708-A712 WeakPolarHBondContact O-CB 3.33Å; D708-A712 PolarHBondContact O-N 3.14Å; A712-K715 PolarHBondContact O-N 2.83Å; A712-V716 VanDerWaalsContact O-CG2 3.24Å; A712-V716 WeakPolarHBondContact O-CG2 3.26Å; A712-V716 PolarHBondContact O-N 3.15Å; A712-Q886 HydrophobicContact CB-CB 3.83Å
713	Y	98.1	Very high	97.5	Very high	32 Å²	32	25.7 Å²	25.7	13%	0.125	13%	0.125	C	C	.	.	H	α-helix	trans	-59	-53.5	177.9	173	-100.7	0	0	0	112	Q709 I710 F711 K715 V716 M717 P742 N744 Y746	Q709-Y713 WeakPolarHBondContact O-CB 3.27Å; Q709-Y713 PolarHBondContact O-N 2.82Å; I710-Y713 PolarHBondContact O-N 3.31Å; F711-Y713 VanDerWaalsContact C-N 3.32Å; F711-Y713 PolarHBondContact O-N 2.82Å; Y713-K715 VanDerWaalsContact C-N 3.31Å; Y713-K715 PolarHBondContact O-N 3.46Å; Y713-V716 PolarHBondContact O-N 3.29Å; Y713-M717 HydrophobicContact CD1-CE 4.42Å; Y713-M717 HydrophobicContact CE1-CE 3.45Å; Y713-M717 VanDerWaalsContact CE1-CE 3.45Å; Y713-M717 HydrophobicContact CE2-CE 4.29Å; Y713-M717 WeakPolarHBondContact O-CB 3.41Å; Y713-M717 PolarHBondContact O-N 3.1Å; Y713-M717 WeakPolarHBondContact OH-CE 3.19Å; Y713-P742 WeakPolarHBondContact CE2-O 3.5Å; Y713-N744 HydrophobicContact CD2-CB 4.07Å; Y713-N744 HydrophobicContact CE2-CB 3.68Å; Y713-N744 PolarHBondContact OH-N 2.72Å; Y713-Y746 AromaticContact CD1-CD2 3.89Å; Y713-Y746 HydrophobicContact CD1-CD2 3.89Å; Y713-Y746 AromaticContact CD1-CE2 4Å; Y713-Y746 HydrophobicContact CD1-CE2 4Å; Y713-Y746 HydrophobicContact CD2-CE2 4.1Å; Y713-Y746 HydrophobicContact CE1-CD2 4.3Å; Y713-Y746 HydrophobicContact CG-CD2 4.1Å; Y713-Y746 AromaticContact CG-CE2 3.71Å; Y713-Y746 HydrophobicContact CG-CE2 3.71Å
714	Y	98.3	Very high	97.4	Very high	6 Å²	6	29.7 Å²	29.7	2%	0.024	15%	0.146	C	C	.	.	H	α-helix	trans	-70.1	-27.8	-179.3	-74.4	-68.6	0	0	0	112.8	I710 F711 M717 A718 L750 L811 L812 Y815	I710-Y714 HydrophobicContact CG2-CD2 3.93Å; I710-Y714 HydrophobicContact CG2-CE2 4.02Å; I710-Y714 VanDerWaalsContact O-CD2 3.3Å; I710-Y714 WeakPolarHBondContact O-CD2 3.42Å; I710-Y714 PolarHBondContact O-N 2.87Å; F711-Y714 PolarHBondContact O-N 2.72Å; Y714-M717 HydrophobicContact CD1-SD 4.11Å; Y714-M717 HydrophobicContact CE1-CE 4.5Å; Y714-M717 HydrophobicContact CE1-SD 4.36Å; Y714-A718 WeakPolarHBondContact O-CB 3.42Å; Y714-A718 PolarHBondContact O-N 2.85Å; Y714-L750 HydrophobicContact CE2-CD1 4.14Å; Y714-L811 HydrophobicContact CD1-CB 3.85Å; Y714-L811 HydrophobicContact CD1-CD1 4.43Å; Y714-L811 HydrophobicContact CG-CB 4.48Å; Y714-L812 HydrophobicContact CD2-CD2 3.45Å; Y714-L812 VanDerWaalsContact CD2-CD2 3.45Å; Y714-L812 HydrophobicContact CD2-CG 4.37Å; Y714-L812 HydrophobicContact CE2-CD2 4.2Å; Y714-L812 HydrophobicContact CG-CD2 3.9Å; Y714-L812 HydrophobicContact CG-CG 4.36Å; Y714-Y815 HydrophobicContact CE1-CE2 4.18Å; Y714-Y815 AromaticContact CZ-CE2 3.81Å; Y714-Y815 WeakPolarHBondContact OH-CE2 3.48Å
715	K	98.3	Very high	97.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66.7	-48.7	171.1	-178.7	64.7	64.6	72.3	0	112	F711 A712 Y713 M717 A718 G719 S779 I804 N805 T808 Q886 L888	F711-K715 WeakPolarHBondContact O-CB 3.47Å; F711-K715 PolarHBondContact O-N 2.84Å; A712-K715 PolarHBondContact O-N 2.83Å; Y713-K715 VanDerWaalsContact C-N 3.31Å; Y713-K715 PolarHBondContact O-N 3.46Å; K715-M717 PolarHBondContact O-N 2.96Å; K715-A718 PolarHBondContact O-N 2.93Å; K715-G719 PolarHBondContact O-N 2.88Å; K715-S779 PolarHBondContact NZ-OG 3.13Å; K715-I804 HydrophobicContact CD-CG2 3.69Å; K715-N805 VanDerWaalsContact CE-OD1 3.3Å; K715-N805 WeakPolarHBondContact CE-OD1 3.29Å; K715-N805 PolarHBondContact NZ-OD1 3.34Å; K715-T808 HydrophobicContact CB-CG2 4.29Å; K715-T808 HydrophobicContact CD-CG2 4.42Å; K715-T808 VanDerWaalsContact CD-OG1 3.3Å; K715-T808 WeakPolarHBondContact CD-OG1 3.24Å; K715-T808 WeakPolarHBondContact CE-OG1 3.42Å; K715-Q886 WeakPolarHBondContact CG-O 3.47Å; K715-Q886 PolarHBondContact NZ-O 3.5Å; K715-L888 WeakPolarHBondContact CD-O 3.33Å; K715-L888 PolarHBondContact NZ-O 3.42Å
716	V	98.1	Very high	97.2	Very high	26 Å²	26	34.3 Å²	34.3	16%	0.158	17%	0.165	C	C	.	.	H	α-helix	trans	-62.6	-36.2	177.7	177.1	0	0	0	0	110.5	A712 Y713 S720 P741 G890 L894	A712-V716 VanDerWaalsContact O-CG2 3.24Å; A712-V716 WeakPolarHBondContact O-CG2 3.26Å; A712-V716 PolarHBondContact O-N 3.15Å; Y713-V716 PolarHBondContact O-N 3.29Å; V716-S720 WeakPolarHBondContact O-CB 3.04Å; V716-S720 PolarHBondContact O-N 3.36Å; V716-S720 PolarHBondContact O-OG 3Å; V716-P741 HydrophobicContact CG1-CB 3.69Å; V716-P741 HydrophobicContact CG1-CG 4.02Å; V716-G890 VanDerWaalsContact CG2-C 3.44Å; V716-G890 WeakPolarHBondContact CG2-O 3.4Å; V716-L894 HydrophobicContact CG1-CD1 4.01Å
717	M	97.4	Very high	97.1	Very high	41 Å²	41	36.7 Å²	36.7	20%	0.202	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-50.1	172.5	-175.7	-179.7	-69.3	0	0	111.5	Y713 Y714 K715 S720 L721 L811	Y713-M717 HydrophobicContact CD1-CE 4.42Å; Y713-M717 HydrophobicContact CE1-CE 3.45Å; Y713-M717 VanDerWaalsContact CE1-CE 3.45Å; Y713-M717 HydrophobicContact CE2-CE 4.29Å; Y713-M717 WeakPolarHBondContact O-CB 3.41Å; Y713-M717 PolarHBondContact O-N 3.1Å; Y713-M717 WeakPolarHBondContact OH-CE 3.19Å; Y714-M717 HydrophobicContact CD1-SD 4.11Å; Y714-M717 HydrophobicContact CE1-CE 4.5Å; Y714-M717 HydrophobicContact CE1-SD 4.36Å; K715-M717 PolarHBondContact O-N 2.96Å; M717-S720 PolarHBondContact O-N 3.03Å; M717-S720 VanDerWaalsContact O-N 3.12Å; M717-L721 HydrophobicContact CG-CD1 3.97Å; M717-L721 HydrophobicContact CG-CG 4.36Å; M717-L721 WeakPolarHBondContact O-CB 3.45Å; M717-L721 VanDerWaalsContact O-CG 3.28Å; M717-L721 WeakPolarHBondContact O-CG 3.27Å; M717-L721 PolarHBondContact O-N 2.94Å; M717-L811 HydrophobicContact CB-CD1 4.21Å; M717-L811 HydrophobicContact CG-CD1 3.94Å; M717-L811 HydrophobicContact SD-CD1 3.94Å; M717-L811 HydrophobicContact SD-CD2 4.22Å
718	A	97.9	Very high	96.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.7	-51.6	177.7	0	0	0	0	0	112.2	Y714 K715 S720 L721 L722 I804 M807 T808 L811	Y714-A718 WeakPolarHBondContact O-CB 3.42Å; Y714-A718 PolarHBondContact O-N 2.85Å; K715-A718 PolarHBondContact O-N 2.93Å; A718-S720 PolarHBondContact O-N 3.15Å; A718-L721 PolarHBondContact O-N 3.22Å; A718-L722 PolarHBondContact O-N 3.31Å; A718-L722 VanDerWaalsContact O-N 3.12Å; A718-I804 HydrophobicContact CB-CG2 4.21Å; A718-M807 HydrophobicContact CB-CB 4.01Å; A718-M807 HydrophobicContact CB-CG 3.9Å; A718-T808 VanDerWaalsContact CB-OG1 3.29Å; A718-T808 WeakPolarHBondContact CB-OG1 3.41Å; A718-L811 HydrophobicContact CB-CD1 4.11Å
719	G	97.6	Very high	96.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.1	-31.8	175.9	0	0	0	0	0	112.5	K715 L723 Y898	K715-G719 PolarHBondContact O-N 2.88Å; G719-L723 WeakPolarHBondContact O-CB 3.49Å; G719-L723 PolarHBondContact O-N 3.41Å; G719-L723 VanDerWaalsContact O-N 3.17Å; G719-Y898 PolarHBondContact O-OH 3.14Å
720	S	96.7	Very high	96.6	Very high	13 Å²	13	41.2 Å²	41.2	9%	0.091	20%	0.201	C	C	.	.	H	α-helix	trans	-74.7	-38.2	177.7	-65.4	0	0	0	0	113.6	V716 M717 A718 R728 P741	V716-S720 WeakPolarHBondContact O-CB 3.04Å; V716-S720 PolarHBondContact O-N 3.36Å; V716-S720 PolarHBondContact O-OG 3Å; M717-S720 PolarHBondContact O-N 3.03Å; M717-S720 VanDerWaalsContact O-N 3.12Å; A718-S720 PolarHBondContact O-N 3.15Å; S720-R728 PolarHBondContact O-NH2 3.28Å; S720-R728 VanDerWaalsContact O-NH2 3.15Å; S720-P741 VanDerWaalsContact OG-CD 3.3Å; S720-P741 WeakPolarHBondContact OG-CD 3.44Å
721	L	96.3	Very high	96.4	Very high	89 Å²	89	42.1 Å²	42.1	47%	0.466	21%	0.208	S	C	.	.	H	α-helix	trans	-64.5	-44.5	178	-73.6	171.3	0	0	0	111.2	M717 A718 K725 M807 L811	M717-L721 HydrophobicContact CG-CD1 3.97Å; M717-L721 HydrophobicContact CG-CG 4.36Å; M717-L721 WeakPolarHBondContact O-CB 3.45Å; M717-L721 VanDerWaalsContact O-CG 3.28Å; M717-L721 WeakPolarHBondContact O-CG 3.27Å; M717-L721 PolarHBondContact O-N 2.94Å; A718-L721 PolarHBondContact O-N 3.22Å; L721-K725 PolarHBondContact O-NZ 2.67Å; L721-M807 HydrophobicContact CD1-CE 3.51Å; L721-L811 HydrophobicContact CD1-CD1 4.26Å
722	L	97	Very high	96.1	Very high	76 Å²	76	48.6 Å²	48.6	40%	0.398	24%	0.235	S	C	.	.	H	α-helix	trans	-82.3	-14.8	-177.3	-62.4	-180	0	0	0	113.9	A718 D724 E803 I804 M807 Y898	A718-L722 PolarHBondContact O-N 3.31Å; A718-L722 VanDerWaalsContact O-N 3.12Å; L722-D724 PolarHBondContact O-N 2.96Å; L722-E803 HydrophobicContact CD1-CG 4.42Å; L722-I804 HydrophobicContact CD1-CG1 3.95Å; L722-M807 HydrophobicContact CD1-CB 3.97Å; L722-M807 HydrophobicContact CD1-CG 4.39Å; L722-Y898 VanDerWaalsContact C-OH 3.22Å
723	L	97.1	Very high	96	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	26%	0.261	C	S	.	.	S	Bend	trans	-65.6	134	178.5	-171.2	66.6	0	0	0	111	G719 K725 L727 R728 I738 L894 A897 Y898 I901	G719-L723 WeakPolarHBondContact O-CB 3.49Å; G719-L723 PolarHBondContact O-N 3.41Å; G719-L723 VanDerWaalsContact O-N 3.17Å; L723-K725 PolarHBondContact O-N 3.32Å; L723-K725 PolarHBondContact O-NZ 3.47Å; L723-L727 HydrophobicContact CD1-CD2 4.3Å; L723-R728 HydrophobicContact CD2-CG 3.9Å; L723-R728 HydrophobicContact CG-CG 4.34Å; L723-I738 HydrophobicContact CD2-CD1 3.83Å; L723-I738 HydrophobicContact CD2-CG2 4.13Å; L723-L894 HydrophobicContact CD2-CD2 3.99Å; L723-A897 HydrophobicContact CD1-CB 4.18Å; L723-A897 HydrophobicContact CD2-CB 4.36Å; L723-Y898 WeakPolarHBondContact CA-OH 3.27Å; L723-Y898 HydrophobicContact CB-CE2 4.48Å; L723-Y898 HydrophobicContact CD1-CD2 4.36Å; L723-Y898 HydrophobicContact CD1-CE1 4.17Å; L723-Y898 HydrophobicContact CD1-CE2 4Å; L723-Y898 PolarHBondContact N-OH 3.42Å; L723-I901 HydrophobicContact CD1-CD1 3.64Å
724	D	96.2	Very high	95.8	Very high	84 Å²	84	59.3 Å²	59.3	45%	0.449	29%	0.288	S	S	.	.			trans	-55.2	130.5	-179	177.1	53.5	0	0	0	112.1	L722 R726 L727 R728	L722-D724 PolarHBondContact O-N 2.96Å; D724-R726 WeakPolarHBondContact OD2-CA 3.39Å; D724-R726 WeakPolarHBondContact OD2-CB 3.47Å; D724-R726 PolarHBondContact OD2-N 3.4Å; D724-R726 VanDerWaalsContact OD2-N 3.16Å; D724-L727 HydrophobicContact CB-CB 4.17Å; D724-L727 PolarHBondContact OD2-N 2.75Å; D724-R728 WeakPolarHBondContact O-CG 3.49Å; D724-R728 PolarHBondContact O-N 3Å
725	K	94.4	Very high	95.5	Very high	125 Å²	125	62.3 Å²	62.3	54%	0.543	32%	0.321	S	S	.	.	H	α-helix	trans	-75.8	-31.3	-173.7	-59.1	-66.8	174.9	-83.3	0	111.1	L721 L723 R728 S729	L721-K725 PolarHBondContact O-NZ 2.67Å; L723-K725 PolarHBondContact O-N 3.32Å; L723-K725 PolarHBondContact O-NZ 3.47Å; K725-R728 PolarHBondContact O-N 3.39Å; K725-S729 PolarHBondContact O-N 2.78Å
726	R	94.7	Very high	95.2	Very high	164 Å²	164	65.2 Å²	65.2	62%	0.619	35%	0.345	S	S	*	.	H	α-helix	trans	-68.1	-47.3	177.3	-178.4	60.6	-176.7	-108.8	3.2	110.4	D724 R728 S729 E730	D724-R726 WeakPolarHBondContact OD2-CA 3.39Å; D724-R726 WeakPolarHBondContact OD2-CB 3.47Å; D724-R726 PolarHBondContact OD2-N 3.4Å; D724-R726 VanDerWaalsContact OD2-N 3.16Å; R726-R728 VanDerWaalsContact C-N 3.3Å; R726-R728 PolarHBondContact O-N 3.06Å; R726-S729 PolarHBondContact O-N 2.91Å; R726-S729 PolarHBondContact O-OG 2.94Å; R726-E730 HydrophobicContact CG-CG 4.45Å; R726-E730 IonicContact CZ-OE1 3.49Å; R726-E730 VanDerWaalsContact CZ-OE1 3.25Å; R726-E730 IonicContact NE-OE1 3.89Å; R726-E730 PolarHBondContact NE-OE1 3.43Å; R726-E730 IonicContact NH2-OE1 2.76Å; R726-E730 PolarHBondContact NH2-OE1 2.72Å; R726-E730 WeakPolarHBondContact O-CG 3.33Å; R726-E730 PolarHBondContact O-N 2.85Å
727	L	94.4	Very high	95	Very high	51 Å²	51	66.9 Å²	66.9	27%	0.267	36%	0.355	S	S	.	.	H	α-helix	trans	-53.3	-46.8	174.1	178.5	63.9	0	0	0	111.7	L723 D724 S729 E730 C731 I901	L723-L727 HydrophobicContact CD1-CD2 4.3Å; D724-L727 HydrophobicContact CB-CB 4.17Å; D724-L727 PolarHBondContact OD2-N 2.75Å; L727-S729 VanDerWaalsContact C-N 3.29Å; L727-S729 PolarHBondContact O-N 2.82Å; L727-E730 PolarHBondContact O-N 2.93Å; L727-C731 WeakPolarHBondContact O-CB 3.44Å; L727-C731 PolarHBondContact O-N 2.92Å; L727-C731 PolarHBondContact O-SG 3.4Å; L727-I901 HydrophobicContact CD2-CD1 3.65Å; L727-I901 HydrophobicContact CD2-CG1 3.73Å
728	R	92.4	Very high	94.9	Very high	27 Å²	27	66.1 Å²	66.1	10%	0.102	35%	0.352	C	S	.	.	H	α-helix	trans	-56.2	-42.9	176	-74.2	-179.5	175.9	-80.6	2.1	112.6	S720 L723 D724 K725 R726 K732 I738	S720-R728 PolarHBondContact O-NH2 3.28Å; S720-R728 VanDerWaalsContact O-NH2 3.15Å; L723-R728 HydrophobicContact CD2-CG 3.9Å; L723-R728 HydrophobicContact CG-CG 4.34Å; D724-R728 WeakPolarHBondContact O-CG 3.49Å; D724-R728 PolarHBondContact O-N 3Å; K725-R728 PolarHBondContact O-N 3.39Å; R726-R728 VanDerWaalsContact C-N 3.3Å; R726-R728 PolarHBondContact O-N 3.06Å; R728-K732 WeakPolarHBondContact O-CB 3.45Å; R728-K732 PolarHBondContact O-N 3.32Å; R728-K732 VanDerWaalsContact O-N 3.07Å; R728-I738 PolarHBondContact NH1-O 2.86Å; R728-I738 VanDerWaalsContact NH1-O 3.12Å
729	S	93.7	Very high	94.5	Very high	49 Å²	49	73.8 Å²	73.8	34%	0.343	39%	0.387	S	S	.	.	H	α-helix	trans	-67.9	-40.1	178.6	69.6	0	0	0	0	112.6	K725 R726 L727 K732 N733	K725-S729 PolarHBondContact O-N 2.78Å; R726-S729 PolarHBondContact O-N 2.91Å; R726-S729 PolarHBondContact O-OG 2.94Å; L727-S729 VanDerWaalsContact C-N 3.29Å; L727-S729 PolarHBondContact O-N 2.82Å; S729-K732 WeakPolarHBondContact O-CB 3.41Å; S729-K732 PolarHBondContact O-N 3.1Å; S729-N733 PolarHBondContact O-N 3.48Å; S729-N733 PolarHBondContact O-ND2 3.25Å; S729-N733 PolarHBondContact O-OD1 3.41Å
730	E	94.8	Very high	94.1	Very high	63 Å²	63	80 Å²	80	29%	0.294	42%	0.42	S	S	.	.	H	α-helix	trans	-66.2	-45.9	177.1	-65.5	-61.2	160.9	0	0	111.4	R726 L727 K732 N733 Q734	R726-E730 HydrophobicContact CG-CG 4.45Å; R726-E730 IonicContact CZ-OE1 3.49Å; R726-E730 VanDerWaalsContact CZ-OE1 3.25Å; R726-E730 IonicContact NE-OE1 3.89Å; R726-E730 PolarHBondContact NE-OE1 3.43Å; R726-E730 IonicContact NH2-OE1 2.76Å; R726-E730 PolarHBondContact NH2-OE1 2.72Å; R726-E730 WeakPolarHBondContact O-CG 3.33Å; R726-E730 PolarHBondContact O-N 2.85Å; L727-E730 PolarHBondContact O-N 2.93Å; E730-K732 VanDerWaalsContact C-N 3.26Å; E730-K732 PolarHBondContact O-N 3.34Å; E730-N733 PolarHBondContact O-N 3.41Å; E730-N733 VanDerWaalsContact O-N 3.1Å; E730-Q734 WeakPolarHBondContact O-CG 3.46Å; E730-Q734 PolarHBondContact O-N 2.99Å
731	C	93.7	Very high	93.9	Very high	20 Å²	20	81.4 Å²	81.4	14%	0.135	43%	0.428	C	S	.	.	H	α-helix	trans	-59.1	-38.5	174.9	-69.8	0	0	0	0	111.9	L727 Q734 G735 A736 I738	L727-C731 WeakPolarHBondContact O-CB 3.44Å; L727-C731 PolarHBondContact O-N 2.92Å; L727-C731 PolarHBondContact O-SG 3.4Å; C731-Q734 PolarHBondContact O-N 3.32Å; C731-G735 PolarHBondContact O-N 2.99Å; C731-A736 WeakPolarHBondContact CB-O 3.44Å; C731-A736 CarbonylContact O-C 3.58Å; C731-A736 VanDerWaalsContact O-C 3.25Å; C731-A736 WeakPolarHBondContact O-CA 3.34Å; C731-A736 PolarHBondContact O-N 3.01Å; C731-I738 HydrophobicContact CB-CD1 4.48Å; C731-I738 HydrophobicContact CB-CG1 4.35Å
732	K	93.4	Very high	93.8	Very high	138 Å²	138	82.4 Å²	82.4	60%	0.6	44%	0.441	S	S	*	.	H	α-helix	trans	-63	-45	174.1	-174.9	180	-178.3	-176.1	0	111.7	R728 S729 E730 Q734 G735 T737	R728-K732 WeakPolarHBondContact O-CB 3.45Å; R728-K732 PolarHBondContact O-N 3.32Å; R728-K732 VanDerWaalsContact O-N 3.07Å; S729-K732 WeakPolarHBondContact O-CB 3.41Å; S729-K732 PolarHBondContact O-N 3.1Å; E730-K732 VanDerWaalsContact C-N 3.26Å; E730-K732 PolarHBondContact O-N 3.34Å; K732-Q734 PolarHBondContact O-N 2.93Å; K732-G735 PolarHBondContact O-N 3.35Å; K732-G735 VanDerWaalsContact O-N 3.11Å; K732-T737 HydrophobicContact CB-CG2 4.44Å; K732-T737 HydrophobicContact CG-CG2 4.35Å
733	N	94.8	Very high	93.6	Very high	124 Å²	124	83.2 Å²	83.2	66%	0.663	45%	0.452	S	S	*	.	H	α-helix	trans	-64.2	-29.5	179	-65.2	-17.5	0	0	0	112.5	S729 E730 G735	S729-N733 PolarHBondContact O-N 3.48Å; S729-N733 PolarHBondContact O-ND2 3.25Å; S729-N733 PolarHBondContact O-OD1 3.41Å; E730-N733 PolarHBondContact O-N 3.41Å; E730-N733 VanDerWaalsContact O-N 3.1Å; N733-G735 VanDerWaalsContact C-N 3.31Å
734	Q	94.1	Very high	93.5	Very high	148 Å²	148	84.1 Å²	84.1	69%	0.692	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	3.3	176.8	-66.1	173.7	3.6	0	0	113.7	E730 C731 K732 A736	E730-Q734 WeakPolarHBondContact O-CG 3.46Å; E730-Q734 PolarHBondContact O-N 2.99Å; C731-Q734 PolarHBondContact O-N 3.32Å; K732-Q734 PolarHBondContact O-N 2.93Å; Q734-A736 VanDerWaalsContact C-N 3.29Å; Q734-A736 PolarHBondContact O-N 2.88Å
735	G	91.8	Very high	93.4	Very high	69 Å²	69	85.6 Å²	85.6	71%	0.711	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	8	-177.9	0	0	0	0	0	115	C731 K732 N733	C731-G735 PolarHBondContact O-N 2.99Å; K732-G735 PolarHBondContact O-N 3.35Å; K732-G735 VanDerWaalsContact O-N 3.11Å; N733-G735 VanDerWaalsContact C-N 3.31Å
736	A	93.6	Very high	93.4	Very high	61 Å²	61	79.9 Å²	79.9	50%	0.504	43%	0.432	S	S	.	.			trans	-107.8	48.5	179.9	0	0	0	0	0	111.9	C731 Q734 I738	C731-A736 WeakPolarHBondContact CB-O 3.44Å; C731-A736 CarbonylContact O-C 3.58Å; C731-A736 VanDerWaalsContact O-C 3.25Å; C731-A736 WeakPolarHBondContact O-CA 3.34Å; C731-A736 PolarHBondContact O-N 3.01Å; Q734-A736 VanDerWaalsContact C-N 3.29Å; Q734-A736 PolarHBondContact O-N 2.88Å; A736-I738 PolarHBondContact O-N 3.16Å
737	T	93.6	Very high	93.3	Very high	62 Å²	62	75 Å²	75	38%	0.38	42%	0.416	S	S	.	.			trans	-57.5	124.5	-172.8	-54	0	0	0	0	112.6	K732 H739	K732-T737 HydrophobicContact CB-CG2 4.44Å; K732-T737 HydrophobicContact CG-CG2 4.35Å; T737-H739 PolarHBondContact O-N 3.02Å
738	I	93.9	Very high	93	Very high	25 Å²	25	73.1 Å²	73.1	13%	0.128	41%	0.407	C	S	.	.			trans	-81.4	99.4	170.4	-53.8	172.7	0	0	0	108.4	L723 R728 C731 A736 L894 A897	L723-I738 HydrophobicContact CD2-CD1 3.83Å; L723-I738 HydrophobicContact CD2-CG2 4.13Å; R728-I738 PolarHBondContact NH1-O 2.86Å; R728-I738 VanDerWaalsContact NH1-O 3.12Å; C731-I738 HydrophobicContact CB-CD1 4.48Å; C731-I738 HydrophobicContact CB-CG1 4.35Å; A736-I738 PolarHBondContact O-N 3.16Å; I738-L894 HydrophobicContact CG2-CD2 4.44Å; I738-A897 HydrophobicContact CD1-CB 3.87Å
739	H	90.3	Very high	93	Very high	161 Å²	161	71.9 Å²	71.9	75%	0.745	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-57.4	140.7	-177.8	-66.7	-78	0	0	0	112.7	T737	T737-H739 PolarHBondContact O-N 3.02Å
740	L	90.3	Very high	93	Very high	131 Å²	131	69.5 Å²	69.5	69%	0.686	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-73.1	143.8	170.7	-120.4	69.7	0	0	0	109.4
741	P	92.5	Very high	92.9	Very high	41 Å²	41	71.4 Å²	71.4	27%	0.266	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-63.9	139.9	173.6	25	-33.1	0	0	0	111.1	V716 S720	V716-P741 HydrophobicContact CG1-CB 3.69Å; V716-P741 HydrophobicContact CG1-CG 4.02Å; S720-P741 VanDerWaalsContact OG-CD 3.3Å; S720-P741 WeakPolarHBondContact OG-CD 3.44Å
742	P	92.3	Very high	92.6	Very high	111 Å²	111	70.4 Å²	70.4	72%	0.721	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-58.3	141.8	168.1	-21.7	33	0	0	0	110.9	Y713	Y713-P742 WeakPolarHBondContact CE2-O 3.5Å
743	S	94.3	Very high	92.3	Very high	92 Å²	92	70.5 Å²	70.5	64%	0.643	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-72.4	154.2	171.2	-166.4	0	0	0	0	110.8	A658	A658-S743 WeakPolarHBondContact CB-O 3.31Å
744	N	94.6	Very high	91.8	Very high	21 Å²	21	68.2 Å²	68.2	11%	0.112	37%	0.368	C	S	.	.			trans	-144.9	167.9	180	-149.9	-51.1	0	0	0	110.9	K656 A658 Y713 Y746	K656-N744 PolarHBondContact O-ND2 2.66Å; A658-N744 HydrophobicContact CB-CB 4.33Å; Y713-N744 HydrophobicContact CD2-CB 4.07Å; Y713-N744 HydrophobicContact CE2-CB 3.68Å; Y713-N744 PolarHBondContact OH-N 2.72Å; N744-Y746 HydrophobicContact CB-CD2 4.01Å; N744-Y746 HydrophobicContact CB-CE2 3.55Å; N744-Y746 PolarHBondContact ND2-OH 3.43Å
745	R	93.1	Very high	91.5	Very high	115 Å²	115	61.6 Å²	61.6	43%	0.434	34%	0.338	S	S	.	.			trans	-121.2	58.3	-168.9	-63.9	-66	-63.5	-178.4	-3.6	112.3	M661 E662 E747	M661-R745 HydrophobicContact CB-CB 4.48Å; E662-R745 HydrophobicContact CG-CB 3.96Å; E662-R745 IonicContact OE1-CZ 3.8Å; E662-R745 IonicContact OE1-NE 3.03Å; E662-R745 PolarHBondContact OE1-NE 3.39Å; E662-R745 IonicContact OE1-NH2 2.61Å; E662-R745 PolarHBondContact OE1-NH2 3.02Å; R745-E747 VanDerWaalsContact C-N 3.35Å
746	Y	95.4	Very high	91.2	Very high	4 Å²	4	61.1 Å²	61.1	2%	0.016	32%	0.317	C	S	.	.			trans	-81.1	-11.6	177.5	-60.7	-66.8	0	0	0	114.4	M661 L706 Q709 I710 Y713 N744 T748 L749 L750	M661-Y746 HydrophobicContact CE-CD1 4.4Å; M661-Y746 HydrophobicContact CE-CE1 3.58Å; M661-Y746 HydrophobicContact CG-CD1 3.66Å; M661-Y746 HydrophobicContact CG-CE1 3.82Å; M661-Y746 HydrophobicContact SD-CD1 3.86Å; M661-Y746 HydrophobicContact SD-CE1 3.59Å; M661-Y746 VanDerWaalsContact SD-CE1 3.59Å; L706-Y746 HydrophobicContact CD1-CD1 3.96Å; L706-Y746 HydrophobicContact CD1-CE1 4.11Å; Q709-Y746 HydrophobicContact CG-CE1 3.82Å; Q709-Y746 PolarHBondContact OE1-OH 3.28Å; I710-Y746 HydrophobicContact CD1-CD1 4.13Å; I710-Y746 HydrophobicContact CD1-CG 4.3Å; I710-Y746 HydrophobicContact CG1-CD1 3.58Å; I710-Y746 HydrophobicContact CG1-CD2 4.13Å; I710-Y746 HydrophobicContact CG1-CE1 4.06Å; I710-Y746 HydrophobicContact CG1-CG 3.62Å; Y713-Y746 AromaticContact CD1-CD2 3.89Å; Y713-Y746 HydrophobicContact CD1-CD2 3.89Å; Y713-Y746 AromaticContact CD1-CE2 4Å; Y713-Y746 HydrophobicContact CD1-CE2 4Å; Y713-Y746 HydrophobicContact CD2-CE2 4.1Å; Y713-Y746 HydrophobicContact CE1-CD2 4.3Å; Y713-Y746 HydrophobicContact CG-CD2 4.1Å; 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 3.55Å; N744-Y746 PolarHBondContact ND2-OH 3.43Å; Y746-T748 VanDerWaalsContact C-N 3.33Å; Y746-T748 PolarHBondContact O-N 3.34Å; Y746-L749 PolarHBondContact O-N 3.28Å; Y746-L750 WeakPolarHBondContact O-CG 3.36Å; Y746-L750 PolarHBondContact O-N 3.07Å
747	E	91.6	Very high	91.1	Very high	62 Å²	62	58.7 Å²	58.7	29%	0.29	30%	0.295	S	S	.	.	H	α-helix	trans	-61.7	-38.2	-169.6	-55.2	-171.2	158.3	0	0	113.3	R745 L750 K751 Y815	R745-E747 VanDerWaalsContact C-N 3.35Å; E747-L750 PolarHBondContact O-N 3.38Å; E747-K751 VanDerWaalsContact O-CG 3.26Å; E747-K751 WeakPolarHBondContact O-CG 3.46Å; E747-K751 PolarHBondContact O-N 2.99Å; E747-K751 VanDerWaalsContact O-N 3.14Å; E747-Y815 HydrophobicContact CB-CE1 4.08Å; E747-Y815 HydrophobicContact CG-CE1 3.71Å; E747-Y815 PolarHBondContact OE1-OH 3.24Å
748	T	89.5	Confident	91	Very high	12 Å²	12	56.6 Å²	56.6	7%	0.074	28%	0.281	C	S	.	.	H	α-helix	trans	-69.4	-39.3	179.9	58.7	0	0	0	0	110.9	P27 E662 Y746 K751 Q752	P27-T748 HydrophobicContact CB-CG2 4.36Å; P27-T748 HydrophobicContact CG-CG2 4.07Å; E662-T748 HydrophobicContact CG-CG2 4.24Å; Y746-T748 VanDerWaalsContact C-N 3.33Å; Y746-T748 PolarHBondContact O-N 3.34Å; T748-K751 PolarHBondContact O-N 3.34Å; T748-Q752 WeakPolarHBondContact O-CG 3.27Å; T748-Q752 PolarHBondContact O-NE2 3.48Å
749	L	92.6	Very high	90.6	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-42.8	173.7	-62.8	176.8	0	0	0	111.9	I29 M661 V664 L665 L706 Y746 K751 Q752	I29-L749 HydrophobicContact CD1-CD2 4.13Å; M661-L749 HydrophobicContact CG-CD1 3.73Å; M661-L749 HydrophobicContact SD-CD1 3.68Å; V664-L749 HydrophobicContact CG1-CD1 3.94Å; V664-L749 HydrophobicContact CG1-CD2 3.78Å; V664-L749 HydrophobicContact CG1-CG 4.49Å; L665-L749 HydrophobicContact CD1-CD2 3.79Å; L665-L749 HydrophobicContact CD2-CD2 4.32Å; L665-L749 HydrophobicContact CG-CD2 3.74Å; L706-L749 HydrophobicContact CD1-CD1 3.68Å; L706-L749 HydrophobicContact CD2-CB 4.37Å; L706-L749 HydrophobicContact CD2-CD1 4Å; Y746-L749 PolarHBondContact O-N 3.28Å; L749-K751 PolarHBondContact O-N 3.07Å; L749-Q752 PolarHBondContact O-N 2.98Å; L749-Q752 VanDerWaalsContact O-N 3.13Å
750	L	93.3	Very high	90.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-23.5	175.9	-72.7	165.4	0	0	0	112.5	I710 Y714 Y746 E747 N765 I768 Y815 L816	I710-L750 HydrophobicContact CD1-CD2 4Å; I710-L750 HydrophobicContact CD1-CG 4.21Å; I710-L750 HydrophobicContact CG2-CD2 4.3Å; Y714-L750 HydrophobicContact CE2-CD1 4.14Å; Y746-L750 WeakPolarHBondContact O-CG 3.36Å; Y746-L750 PolarHBondContact O-N 3.07Å; E747-L750 PolarHBondContact O-N 3.38Å; L750-N765 WeakPolarHBondContact O-CB 3.37Å; L750-N765 PolarHBondContact O-ND2 3.22Å; L750-I768 HydrophobicContact CD2-CD1 4.27Å; L750-I768 HydrophobicContact CD2-CG2 3.85Å; L750-Y815 HydrophobicContact CD1-CD2 4.08Å; L750-Y815 HydrophobicContact CD1-CG 4.07Å; L750-L816 HydrophobicContact CD2-CD1 4.17Å; L750-L816 HydrophobicContact CD2-CD2 3.5Å; L750-L816 VanDerWaalsContact CD2-CD2 3.5Å; L750-L816 HydrophobicContact CD2-CG 4.02Å
751	K	91.9	Very high	90.4	Very high	102 Å²	102	53.7 Å²	53.7	44%	0.443	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-7.5	177.9	-72.8	171.1	-176.3	-179	0	113.7	P27 E747 T748 L749 R753	P27-K751 HydrophobicContact CG-CD 4.49Å; E747-K751 VanDerWaalsContact O-CG 3.26Å; E747-K751 WeakPolarHBondContact O-CG 3.46Å; E747-K751 PolarHBondContact O-N 2.99Å; E747-K751 VanDerWaalsContact O-N 3.14Å; T748-K751 PolarHBondContact O-N 3.34Å; L749-K751 PolarHBondContact O-N 3.07Å; K751-R753 WeakPolarHBondContact O-CG 3.26Å; K751-R753 PolarHBondContact O-N 3.1Å
752	Q	88.1	Confident	90.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.286	C	S	.	.			trans	-73.7	118.5	-177.4	-59.8	-48.3	-50.7	0	0	111.6	I29 E30 L665 T748 L749 V755 L764 N765	I29-Q752 HydrophobicContact CD1-CG 3.97Å; I29-Q752 VanDerWaalsContact CD1-NE2 3.29Å; I29-Q752 HydrophobicContact CG1-CG 4.47Å; I29-Q752 VanDerWaalsContact CG1-NE2 3.29Å; E30-Q752 PolarHBondContact OE1-OE1 2.64Å; L665-Q752 HydrophobicContact CD1-CG 3.79Å; T748-Q752 WeakPolarHBondContact O-CG 3.27Å; T748-Q752 PolarHBondContact O-NE2 3.48Å; L749-Q752 PolarHBondContact O-N 2.98Å; L749-Q752 VanDerWaalsContact O-N 3.13Å; Q752-V755 HydrophobicContact CB-CG2 3.95Å; Q752-L764 HydrophobicContact CB-CB 4.15Å; Q752-L764 HydrophobicContact CB-CD2 4.32Å; Q752-L764 PolarHBondContact O-N 3.49Å; Q752-N765 WeakPolarHBondContact O-CB 3.49Å; Q752-N765 PolarHBondContact O-N 3.15Å
753	R	85.7	Confident	90.3	Very high	139 Å²	139	50.5 Å²	50.5	53%	0.525	26%	0.263	S	S	.	.	S	Bend	trans	-107.6	-13.9	-178.4	-53.8	-54.5	-67.8	-83.3	-3.5	113.6	K751 D763	K751-R753 WeakPolarHBondContact O-CG 3.26Å; K751-R753 PolarHBondContact O-N 3.1Å; R753-D763 IonicContact NE-OD1 3.31Å; R753-D763 IonicContact NE-OD2 2.8Å; R753-D763 IonicContact NH2-OD2 2.76Å; R753-D763 VanDerWaalsContact O-CA 3.26Å; R753-D763 WeakPolarHBondContact O-CA 3.35Å; R753-D763 WeakPolarHBondContact O-CB 3.12Å
754	H	85.8	Confident	90.3	Very high	77 Å²	77	46.1 Å²	46.1	36%	0.356	23%	0.232	S	C	.	.			trans	-156.4	58.4	-171.9	53.7	65.3	0	0	0	113.1	Q26 Q756 S761 I762	Q26-H754 PolarHBondContact NE2-CE1 3.28Å; Q26-H754 PolarHBondContact OE1-CE1 3.06Å; Q26-H754 PolarHBondContact OE1-NE2 2.78Å; H754-Q756 PolarHBondContact O-N 3.43Å; H754-Q756 PolarHBondContact O-NE2 2.91Å; H754-S761 WeakPolarHBondContact CB-OG 3.18Å; H754-I762 CarbonylContact C-O 3.6Å; H754-I762 WeakPolarHBondContact CA-O 3.4Å; H754-I762 PolarHBondContact N-O 3.49Å
755	V	87.3	Confident	90.4	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.055	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	123.9	175.3	-173.5	0	0	0	0	109.5	E30 Q752 L757 I762 L764	E30-V755 VanDerWaalsContact OE1-CA 3.24Å; E30-V755 WeakPolarHBondContact OE1-CA 3.22Å; E30-V755 VanDerWaalsContact OE1-CG2 3.32Å; E30-V755 WeakPolarHBondContact OE1-CG2 3.37Å; Q752-V755 HydrophobicContact CB-CG2 3.95Å; V755-L757 PolarHBondContact O-N 3.31Å; V755-I762 HydrophobicContact CB-CB 4.3Å; V755-I762 PolarHBondContact N-O 3.4Å; V755-I762 PolarHBondContact O-N 3.47Å; V755-L764 HydrophobicContact CG2-CB 3.9Å; V755-L764 HydrophobicContact CG2-CD2 4.38Å
756	Q	86.3	Confident	90.5	Very high	59 Å²	59	47.7 Å²	47.7	28%	0.276	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	106.9	-178.8	-61.5	-67.5	-23.9	0	0	109.9	P33 N672 H754 R760	P33-Q756 HydrophobicContact CB-CB 4.44Å; P33-Q756 HydrophobicContact CB-CG 3.98Å; N672-Q756 PolarHBondContact ND2-O 3.26Å; H754-Q756 PolarHBondContact O-N 3.43Å; H754-Q756 PolarHBondContact O-NE2 2.91Å; Q756-R760 WeakPolarHBondContact CA-O 3.33Å
757	L	90.9	Very high	90.6	Very high	9 Å²	9	49.3 Å²	49.3	5%	0.047	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	121.9	-177	-167.4	62.2	0	0	0	110.9	L668 V695 F699 V755 G759 R760	L668-L757 HydrophobicContact CD2-CD2 3.89Å; L668-L757 HydrophobicContact CG-CD2 4.28Å; V695-L757 HydrophobicContact CG1-CD2 3.65Å; V695-L757 HydrophobicContact CG1-CG 4.06Å; F699-L757 HydrophobicContact CD2-CD2 4.05Å; F699-L757 HydrophobicContact CE2-CD2 4.47Å; V755-L757 PolarHBondContact O-N 3.31Å; L757-G759 PolarHBondContact O-N 3.17Å; L757-R760 PolarHBondContact N-O 3.47Å; L757-R760 WeakPolarHBondContact O-CB 3.26Å; L757-R760 WeakPolarHBondContact O-CD 3.39Å; L757-R760 PolarHBondContact O-N 3.07Å
758	L	91.9	Very high	90.8	Very high	18 Å²	18	46.4 Å²	46.4	9%	0.094	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	36.7	-175.3	-54.6	-175	0	0	0	113.4	N672 A675 I691 E692 V695 R760	N672-L758 PolarHBondContact OD1-N 3.37Å; 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 4.13Å; E692-L758 HydrophobicContact CG-CD1 4.24Å; V695-L758 HydrophobicContact CB-CD1 3.75Å; V695-L758 HydrophobicContact CG1-CD1 3.83Å; V695-L758 HydrophobicContact CG1-CG 4.32Å; V695-L758 HydrophobicContact CG2-CD1 3.85Å; V695-L758 HydrophobicContact CG2-CG 4.34Å; L758-R760 VanDerWaalsContact C-N 3.28Å; L758-R760 WeakPolarHBondContact O-CD 3.3Å; L758-R760 PolarHBondContact O-N 3.06Å; L758-R760 PolarHBondContact O-NH1 2.79Å
759	G	85.1	Confident	91.2	Very high	77 Å²	77	46.8 Å²	46.8	79%	0.794	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.9	1.1	-176.8	0	0	0	0	0	115.2	L757	L757-G759 PolarHBondContact O-N 3.17Å
760	R	86.9	Confident	91.4	Very high	106 Å²	106	51.2 Å²	51.2	40%	0.4	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	150.3	173	-67.8	71.2	169.8	-176	-3.7	109.8	Y688 E692 Q756 L757 L758 I762	Y688-R760 PolarHBondContact OH-NH1 3.45Å; E692-R760 IonicContact OE1-CZ 2.83Å; E692-R760 VanDerWaalsContact OE1-CZ 3.23Å; E692-R760 IonicContact OE1-NH1 2.67Å; E692-R760 PolarHBondContact OE1-NH1 2.78Å; E692-R760 IonicContact OE1-NH2 3.46Å; E692-R760 PolarHBondContact OE1-NH2 2.73Å; Q756-R760 WeakPolarHBondContact CA-O 3.33Å; L757-R760 PolarHBondContact N-O 3.47Å; L757-R760 WeakPolarHBondContact O-CB 3.26Å; L757-R760 WeakPolarHBondContact O-CD 3.39Å; L757-R760 PolarHBondContact O-N 3.07Å; L758-R760 VanDerWaalsContact C-N 3.28Å; L758-R760 WeakPolarHBondContact O-CD 3.3Å; L758-R760 PolarHBondContact O-N 3.06Å; L758-R760 PolarHBondContact O-NH1 2.79Å; R760-I762 HydrophobicContact CB-CD1 3.73Å; R760-I762 HydrophobicContact CB-CG1 4.21Å; R760-I762 HydrophobicContact CG-CD1 4.48Å
761	S	89.8	Confident	91.6	Very high	73 Å²	73	55.6 Å²	55.6	51%	0.51	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	109.8	167.4	-174.6	0	0	0	0	108.9	H754	H754-S761 WeakPolarHBondContact CB-OG 3.18Å
762	I	89.4	Confident	91.9	Very high	42 Å²	42	50.8 Å²	50.8	22%	0.215	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.6	-173.1	-51.7	-63.8	0	0	0	111	F699 H754 V755 R760 L764 L767	F699-I762 HydrophobicContact CE1-CG2 3.72Å; F699-I762 HydrophobicContact CZ-CB 4.36Å; F699-I762 HydrophobicContact CZ-CG2 3.57Å; H754-I762 CarbonylContact C-O 3.6Å; H754-I762 WeakPolarHBondContact CA-O 3.4Å; H754-I762 PolarHBondContact N-O 3.49Å; V755-I762 HydrophobicContact CB-CB 4.3Å; V755-I762 PolarHBondContact N-O 3.4Å; V755-I762 PolarHBondContact O-N 3.47Å; R760-I762 HydrophobicContact CB-CD1 3.73Å; R760-I762 HydrophobicContact CB-CG1 4.21Å; R760-I762 HydrophobicContact CG-CD1 4.48Å; I762-L764 PolarHBondContact O-N 3.09Å; I762-L764 VanDerWaalsContact O-N 3.11Å; I762-L767 HydrophobicContact CG2-CD1 3.67Å
763	D	93.3	Very high	92.4	Very high	43 Å²	43	51.7 Å²	51.7	23%	0.23	26%	0.258	C	S	.	.			trans	-80.7	89.2	171.6	-168.8	-19.1	0	0	0	110.4	R753 N765 R766 L767	R753-D763 IonicContact NE-OD1 3.31Å; R753-D763 IonicContact NE-OD2 2.8Å; R753-D763 IonicContact NH2-OD2 2.76Å; R753-D763 VanDerWaalsContact O-CA 3.26Å; R753-D763 WeakPolarHBondContact O-CA 3.35Å; R753-D763 WeakPolarHBondContact O-CB 3.12Å; D763-N765 VanDerWaalsContact C-N 3.35Å; D763-N765 WeakPolarHBondContact OD1-CB 3.41Å; D763-N765 PolarHBondContact OD1-N 3.5Å; D763-R766 HydrophobicContact CB-CB 3.85Å; D763-R766 VanDerWaalsContact CG-CB 3.43Å; D763-R766 PolarHBondContact O-N 2.99Å; D763-R766 PolarHBondContact OD1-N 2.86Å; D763-L767 WeakPolarHBondContact O-CG 3.48Å; D763-L767 PolarHBondContact O-N 2.97Å; D763-L767 VanDerWaalsContact O-N 3.16Å
764	L	93.9	Very high	92.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-38.7	179.6	-177.8	62	0	0	0	111.7	L665 F699 F702 V703 L706 Q752 V755 I762 R766 L767 I768	L665-L764 HydrophobicContact CD2-CD2 4.48Å; F699-L764 HydrophobicContact CZ-CD1 4.38Å; F702-L764 HydrophobicContact CD1-CD1 4.38Å; F702-L764 HydrophobicContact CE1-CD1 3.88Å; F702-L764 HydrophobicContact CE1-CD2 4Å; V703-L764 HydrophobicContact CG2-CD1 4.1Å; L706-L764 HydrophobicContact CD2-CD2 4.24Å; Q752-L764 HydrophobicContact CB-CB 4.15Å; Q752-L764 HydrophobicContact CB-CD2 4.32Å; Q752-L764 PolarHBondContact O-N 3.49Å; V755-L764 HydrophobicContact CG2-CB 3.9Å; V755-L764 HydrophobicContact CG2-CD2 4.38Å; I762-L764 PolarHBondContact O-N 3.09Å; I762-L764 VanDerWaalsContact O-N 3.11Å; L764-R766 VanDerWaalsContact C-N 3.31Å; L764-R766 PolarHBondContact O-N 3.22Å; L764-L767 PolarHBondContact O-N 3.33Å; L764-I768 HydrophobicContact CD1-CD1 4.13Å; L764-I768 HydrophobicContact CD1-CG1 4.21Å; 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 3.3Å; L764-I768 WeakPolarHBondContact O-CG1 3.37Å; L764-I768 PolarHBondContact O-N 2.85Å
765	N	96.1	Very high	93.5	Very high	13 Å²	13	44.7 Å²	44.7	7%	0.07	24%	0.243	C	C	.	.	H	α-helix	trans	-55.9	-46.8	174.4	176	-79.7	0	0	0	111.2	L750 Q752 D763 L767 I768 T769 Y815 L816	L750-N765 WeakPolarHBondContact O-CB 3.37Å; L750-N765 PolarHBondContact O-ND2 3.22Å; Q752-N765 WeakPolarHBondContact O-CB 3.49Å; Q752-N765 PolarHBondContact O-N 3.15Å; D763-N765 VanDerWaalsContact C-N 3.35Å; D763-N765 WeakPolarHBondContact OD1-CB 3.41Å; D763-N765 PolarHBondContact OD1-N 3.5Å; N765-L767 PolarHBondContact O-N 3.37Å; N765-I768 PolarHBondContact O-N 3.39Å; N765-T769 VanDerWaalsContact O-CB 3.31Å; N765-T769 WeakPolarHBondContact O-CB 3.46Å; N765-T769 PolarHBondContact O-N 3.44Å; N765-T769 PolarHBondContact O-OG1 2.84Å; N765-Y815 PolarHBondContact ND2-O 3.14Å; N765-L816 VanDerWaalsContact ND2-CD2 3.33Å; N765-L816 WeakPolarHBondContact ND2-CD2 3.29Å
766	R	95.8	Very high	94	Very high	156 Å²	156	44.4 Å²	44.4	59%	0.589	24%	0.241	S	C	*	.	H	α-helix	trans	-60	-46.9	176.9	176.7	-177.7	172.2	122.6	-0.8	111.7	D763 L764 T769 Q770	D763-R766 HydrophobicContact CB-CB 3.85Å; D763-R766 VanDerWaalsContact CG-CB 3.43Å; D763-R766 PolarHBondContact O-N 2.99Å; D763-R766 PolarHBondContact OD1-N 2.86Å; L764-R766 VanDerWaalsContact C-N 3.31Å; L764-R766 PolarHBondContact O-N 3.22Å; R766-T769 PolarHBondContact O-N 2.75Å; R766-Q770 WeakPolarHBondContact O-CG 3.39Å; R766-Q770 PolarHBondContact O-N 3.05Å; R766-Q770 VanDerWaalsContact O-N 3.09Å
767	L	96.6	Very high	94.5	Very high	39 Å²	39	43.7 Å²	43.7	20%	0.204	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-42.5	-179.2	-67.4	175.3	0	0	0	111.8	F699 V703 I762 D763 L764 N765 Q770 R771	F699-L767 HydrophobicContact CE1-CD1 3.69Å; F699-L767 HydrophobicContact CZ-CD1 4.2Å; V703-L767 HydrophobicContact CG1-CB 3.93Å; V703-L767 HydrophobicContact CG2-CB 4.42Å; V703-L767 HydrophobicContact CG2-CD1 4.04Å; I762-L767 HydrophobicContact CG2-CD1 3.67Å; D763-L767 WeakPolarHBondContact O-CG 3.48Å; D763-L767 PolarHBondContact O-N 2.97Å; D763-L767 VanDerWaalsContact O-N 3.16Å; L764-L767 PolarHBondContact O-N 3.33Å; N765-L767 PolarHBondContact O-N 3.37Å; L767-Q770 PolarHBondContact O-N 3.42Å; L767-R771 WeakPolarHBondContact O-CD 3.44Å; L767-R771 PolarHBondContact O-NH1 3.48Å
768	I	97.4	Very high	94.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63	-47.1	174.6	-67.1	168.4	0	0	0	110.2	L706 A707 I710 L750 L764 N765 Q770 R771 V772 L816	L706-I768 HydrophobicContact CD2-CD1 3.89Å; L706-I768 HydrophobicContact CG-CD1 4.33Å; A707-I768 HydrophobicContact CB-CG2 4.36Å; I710-I768 HydrophobicContact CD1-CD1 4.08Å; I710-I768 HydrophobicContact CD1-CG2 4.24Å; L750-I768 HydrophobicContact CD2-CD1 4.27Å; L750-I768 HydrophobicContact CD2-CG2 3.85Å; L764-I768 HydrophobicContact CD1-CD1 4.13Å; L764-I768 HydrophobicContact CD1-CG1 4.21Å; 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 3.3Å; L764-I768 WeakPolarHBondContact O-CG1 3.37Å; L764-I768 PolarHBondContact O-N 2.85Å; N765-I768 PolarHBondContact O-N 3.39Å; I768-Q770 VanDerWaalsContact C-N 3.27Å; I768-Q770 PolarHBondContact O-N 2.85Å; I768-R771 PolarHBondContact O-N 2.99Å; I768-R771 VanDerWaalsContact O-N 3.08Å; I768-V772 HydrophobicContact CG2-CG2 3.76Å; I768-V772 WeakPolarHBondContact O-CB 3.43Å; I768-V772 WeakPolarHBondContact O-CG2 3.42Å; I768-V772 PolarHBondContact O-N 3.04Å; I768-L816 HydrophobicContact CG2-CD1 4.2Å; I768-L816 HydrophobicContact CG2-CD2 4.49Å
769	T	97.9	Very high	95.1	Very high	20 Å²	20	47.5 Å²	47.5	12%	0.123	25%	0.252	C	S	.	.	H	α-helix	trans	-54.7	-42.5	-180	-60.9	0	0	0	0	111.8	N765 R766 R771 V772 S773 L816 T817 L818	N765-T769 VanDerWaalsContact O-CB 3.31Å; N765-T769 WeakPolarHBondContact O-CB 3.46Å; N765-T769 PolarHBondContact O-N 3.44Å; N765-T769 PolarHBondContact O-OG1 2.84Å; R766-T769 PolarHBondContact O-N 2.75Å; T769-R771 PolarHBondContact O-N 2.99Å; T769-V772 PolarHBondContact O-N 2.87Å; T769-S773 WeakPolarHBondContact O-CB 3.35Å; T769-S773 PolarHBondContact O-N 3.02Å; T769-L816 WeakPolarHBondContact OG1-CD2 3.34Å; T769-T817 WeakPolarHBondContact CG2-O 3.45Å; T769-L818 HydrophobicContact CG2-CD2 4.02Å
770	Q	96.7	Very high	95.8	Very high	93 Å²	93	43.8 Å²	43.8	44%	0.435	21%	0.214	S	C	.	.	H	α-helix	trans	-58.8	-46.5	177.2	-70.9	170.2	-15.3	0	0	112.5	R766 L767 I768 A774	R766-Q770 WeakPolarHBondContact O-CG 3.39Å; R766-Q770 PolarHBondContact O-N 3.05Å; R766-Q770 VanDerWaalsContact O-N 3.09Å; L767-Q770 PolarHBondContact O-N 3.42Å; I768-Q770 VanDerWaalsContact C-N 3.27Å; I768-Q770 PolarHBondContact O-N 2.85Å; Q770-A774 PolarHBondContact O-N 2.86Å
771	R	97.3	Very high	96.2	Very high	92 Å²	92	42.3 Å²	42.3	35%	0.347	21%	0.211	S	C	.	.	H	α-helix	trans	-73.3	-40	-178.5	-76.9	79.8	177.8	168.2	-0.7	111.3	A707 L767 I768 T769 A774 A775	A707-R771 HydrophobicContact CB-CB 3.64Å; A707-R771 HydrophobicContact CB-CG 4.29Å; L767-R771 WeakPolarHBondContact O-CD 3.44Å; L767-R771 PolarHBondContact O-NH1 3.48Å; I768-R771 PolarHBondContact O-N 2.99Å; I768-R771 VanDerWaalsContact O-N 3.08Å; T769-R771 PolarHBondContact O-N 2.99Å; R771-A774 PolarHBondContact O-N 2.95Å; R771-A775 WeakPolarHBondContact O-CB 3.26Å; R771-A775 PolarHBondContact O-N 3.19Å
772	V	98	Very high	96.5	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-43	177.2	170.6	0	0	0	0	111	I710 F711 I768 T769 A775 V776 L812 L816 L818	I710-V772 HydrophobicContact CG2-CG2 4.49Å; F711-V772 HydrophobicContact CD2-CG1 4.42Å; I768-V772 HydrophobicContact CG2-CG2 3.76Å; I768-V772 WeakPolarHBondContact O-CB 3.43Å; I768-V772 WeakPolarHBondContact O-CG2 3.42Å; I768-V772 PolarHBondContact O-N 3.04Å; T769-V772 PolarHBondContact O-N 2.87Å; V772-A775 WeakPolarHBondContact O-CB 3.36Å; V772-A775 PolarHBondContact O-N 3.41Å; V772-A775 VanDerWaalsContact O-N 3.16Å; V772-V776 WeakPolarHBondContact O-CG2 3.29Å; V772-V776 PolarHBondContact O-N 3.24Å; V772-L812 HydrophobicContact CG1-CD1 3.57Å; 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 3.89Å; V772-L816 HydrophobicContact CG2-CD1 4.03Å; V772-L818 HydrophobicContact CG1-CD2 4.38Å
773	S	97.6	Very high	96.9	Very high	20 Å²	20	37.9 Å²	37.9	14%	0.14	18%	0.183	C	C	.	.	H	α-helix	trans	-57.2	-51.5	174.8	-176.1	0	0	0	0	110.6	T769 A775 V776 Y777 M824	T769-S773 WeakPolarHBondContact O-CB 3.35Å; T769-S773 PolarHBondContact O-N 3.02Å; S773-A775 VanDerWaalsContact C-N 3.26Å; S773-A775 PolarHBondContact O-N 3.19Å; S773-V776 WeakPolarHBondContact O-CB 3.38Å; S773-V776 PolarHBondContact O-N 3.29Å; S773-Y777 VanDerWaalsContact O-CD2 3.27Å; S773-Y777 WeakPolarHBondContact O-CD2 3.35Å; S773-Y777 PolarHBondContact O-N 3.43Å; S773-M824 WeakPolarHBondContact OG-CE 3.37Å
774	A	97.7	Very high	97.1	Very high	58 Å²	58	35.9 Å²	35.9	48%	0.479	17%	0.172	S	C	.	.	H	α-helix	trans	-58.1	-36.5	175.8	0	0	0	0	0	113.1	Q770 R771 K778	Q770-A774 PolarHBondContact O-N 2.86Å; R771-A774 PolarHBondContact O-N 2.95Å; A774-K778 WeakPolarHBondContact O-CB 3.26Å; A774-K778 PolarHBondContact O-N 3.03Å
775	A	97.8	Very high	97.2	Very high	11 Å²	11	36.2 Å²	36.2	9%	0.091	18%	0.176	C	C	.	.	H	α-helix	trans	-68.2	-36.2	175.9	0	0	0	0	0	112.9	F711 R771 V772 S773 S779 Y887	F711-A775 HydrophobicContact CB-CB 4.39Å; F711-A775 HydrophobicContact CD1-CB 3.74Å; F711-A775 HydrophobicContact CD2-CB 3.74Å; F711-A775 HydrophobicContact CE1-CB 3.83Å; F711-A775 HydrophobicContact CE2-CB 3.85Å; F711-A775 HydrophobicContact CG-CB 3.68Å; F711-A775 HydrophobicContact CZ-CB 3.88Å; F711-A775 WeakPolarHBondContact CZ-O 3.38Å; R771-A775 WeakPolarHBondContact O-CB 3.26Å; R771-A775 PolarHBondContact O-N 3.19Å; V772-A775 WeakPolarHBondContact O-CB 3.36Å; V772-A775 PolarHBondContact O-N 3.41Å; V772-A775 VanDerWaalsContact O-N 3.16Å; S773-A775 VanDerWaalsContact C-N 3.26Å; S773-A775 PolarHBondContact O-N 3.19Å; A775-S779 WeakPolarHBondContact O-CB 3.44Å; A775-S779 PolarHBondContact O-N 3.04Å; A775-Y887 HydrophobicContact CB-CE1 4.11Å
776	V	97.9	Very high	97.2	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-65.3	-47.9	173.5	176	0	0	0	0	110.5	F711 V772 S773 K778 S779 L780 L812 M824	F711-V776 HydrophobicContact CD2-CG2 4.46Å; F711-V776 HydrophobicContact CE2-CG2 3.84Å; V772-V776 WeakPolarHBondContact O-CG2 3.29Å; V772-V776 PolarHBondContact O-N 3.24Å; S773-V776 WeakPolarHBondContact O-CB 3.38Å; S773-V776 PolarHBondContact O-N 3.29Å; V776-K778 VanDerWaalsContact C-N 3.34Å; V776-K778 PolarHBondContact O-N 2.97Å; V776-S779 WeakPolarHBondContact O-CB 3.08Å; V776-S779 PolarHBondContact O-N 3.42Å; V776-S779 VanDerWaalsContact O-N 3.1Å; V776-L780 HydrophobicContact CG1-CD1 4.14Å; V776-L780 WeakPolarHBondContact O-CG 3.14Å; V776-L780 PolarHBondContact O-N 2.77Å; V776-L812 HydrophobicContact CG2-CD1 4.25Å; V776-M824 HydrophobicContact CB-SD 4.15Å; V776-M824 HydrophobicContact CG1-SD 3.55Å; V776-M824 VanDerWaalsContact CG1-SD 3.55Å
777	Y	97.6	Very high	97.3	Very high	45 Å²	45	31.1 Å²	31.1	18%	0.176	16%	0.155	C	C	.	.	H	α-helix	trans	-55.9	-48.6	174.4	-80.9	-75.4	0	0	0	111.5	S773 S779 L780 E781 D819 M824 E827	S773-Y777 VanDerWaalsContact O-CD2 3.27Å; S773-Y777 WeakPolarHBondContact O-CD2 3.35Å; S773-Y777 PolarHBondContact O-N 3.43Å; Y777-S779 VanDerWaalsContact C-N 3.26Å; Y777-S779 PolarHBondContact O-N 2.68Å; Y777-L780 PolarHBondContact O-N 2.98Å; Y777-L780 VanDerWaalsContact O-N 3.15Å; Y777-E781 WeakPolarHBondContact O-CB 3.44Å; Y777-E781 PolarHBondContact O-N 3Å; Y777-D819 PolarHBondContact OH-OD2 3.23Å; Y777-M824 HydrophobicContact CD1-CB 4.43Å; Y777-M824 HydrophobicContact CD2-CE 4.47Å; Y777-M824 HydrophobicContact CE1-CB 3.92Å; Y777-M824 HydrophobicContact CE1-CG 4.04Å; Y777-M824 HydrophobicContact CE2-CE 3.84Å; Y777-M824 HydrophobicContact CE2-CG 4.06Å; Y777-M824 HydrophobicContact CE2-SD 4.34Å; Y777-E827 HydrophobicContact CE1-CB 4.06Å; Y777-E827 HydrophobicContact CE1-CG 4.14Å; Y777-E827 WeakPolarHBondContact CE1-OE2 3.29Å; Y777-E827 PolarHBondContact OH-OE2 3Å
778	K	97.6	Very high	97.3	Very high	106 Å²	106	32.6 Å²	32.6	46%	0.461	16%	0.161	S	C	.	.	H	α-helix	trans	-59.7	-35.9	176.9	-176.1	172.4	175.8	-175.8	0	112.8	A774 V776 L782 Y887	A774-K778 WeakPolarHBondContact O-CB 3.26Å; A774-K778 PolarHBondContact O-N 3.03Å; V776-K778 VanDerWaalsContact C-N 3.34Å; V776-K778 PolarHBondContact O-N 2.97Å; K778-L782 VanDerWaalsContact O-CB 3.26Å; K778-L782 WeakPolarHBondContact O-CB 3.37Å; K778-L782 PolarHBondContact O-N 3.27Å; K778-Y887 HydrophobicContact CB-CD1 4.3Å; K778-Y887 HydrophobicContact CB-CE1 4.33Å; K778-Y887 HydrophobicContact CD-CD1 4.03Å; K778-Y887 HydrophobicContact CD-CE1 3.69Å; K778-Y887 HydrophobicContact CD-CE2 4.2Å; K778-Y887 HydrophobicContact CD-CG 4.43Å; K778-Y887 HydrophobicContact CG-CD1 4.03Å; K778-Y887 HydrophobicContact CG-CE1 4.15Å; K778-Y887 HydrophobicContact CG-CG 4.44Å
779	S	97.8	Very high	97.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67.3	-40.1	175.3	-101.1	0	0	0	0	113.5	K715 A775 V776 Y777 A783 N805 Y887	K715-S779 PolarHBondContact NZ-OG 3.13Å; A775-S779 WeakPolarHBondContact O-CB 3.44Å; A775-S779 PolarHBondContact O-N 3.04Å; V776-S779 WeakPolarHBondContact O-CB 3.08Å; V776-S779 PolarHBondContact O-N 3.42Å; V776-S779 VanDerWaalsContact O-N 3.1Å; Y777-S779 VanDerWaalsContact C-N 3.26Å; Y777-S779 PolarHBondContact O-N 2.68Å; S779-A783 WeakPolarHBondContact O-CB 3.43Å; S779-A783 PolarHBondContact O-N 3.11Å; S779-A783 VanDerWaalsContact O-N 3.09Å; S779-N805 WeakPolarHBondContact CB-OD1 3.39Å; S779-Y887 VanDerWaalsContact OG-C 3.29Å; S779-Y887 WeakPolarHBondContact OG-CA 3.44Å; S779-Y887 PolarHBondContact OG-O 2.87Å
780	L	97.9	Very high	97.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-70.2	-44.7	177.3	-67.7	169.8	0	0	0	110.9	V776 Y777 L782 A783 I784 L802 N805 F821 M824 A828	V776-L780 HydrophobicContact CG1-CD1 4.14Å; V776-L780 WeakPolarHBondContact O-CG 3.14Å; V776-L780 PolarHBondContact O-N 2.77Å; Y777-L780 PolarHBondContact O-N 2.98Å; Y777-L780 VanDerWaalsContact O-N 3.15Å; L780-L782 VanDerWaalsContact C-N 3.31Å; L780-L782 PolarHBondContact O-N 3.36Å; L780-A783 PolarHBondContact O-N 3.28Å; L780-I784 WeakPolarHBondContact O-CG1 3.31Å; L780-I784 PolarHBondContact O-N 3.45Å; L780-L802 HydrophobicContact CD2-CD2 3.82Å; L780-N805 HydrophobicContact CD2-CB 3.88Å; L780-F821 HydrophobicContact CD2-CE2 3.94Å; L780-F821 HydrophobicContact CD2-CZ 4.04Å; L780-M824 HydrophobicContact CD1-CB 3.76Å; L780-A828 HydrophobicContact CB-CB 3.75Å
781	E	96.9	Very high	97.1	Very high	75 Å²	75	31 Å²	31	35%	0.35	16%	0.155	S	C	.	.	H	α-helix	trans	-55.4	-47.5	174.2	179.9	54.9	-135.9	0	0	111.3	Y777 A783 I784 G785 R838	Y777-E781 WeakPolarHBondContact O-CB 3.44Å; Y777-E781 PolarHBondContact O-N 3Å; E781-A783 PolarHBondContact O-N 3.21Å; E781-I784 PolarHBondContact O-N 3.46Å; E781-G785 PolarHBondContact O-N 3.03Å; E781-R838 IonicContact OE1-CZ 3.58Å; E781-R838 VanDerWaalsContact OE1-CZ 3.27Å; E781-R838 IonicContact OE1-NH1 3.37Å; E781-R838 PolarHBondContact OE1-NH1 2.81Å; E781-R838 IonicContact OE1-NH2 2.72Å; E781-R838 PolarHBondContact OE1-NH2 2.75Å; E781-R838 IonicContact OE2-CZ 3.9Å; E781-R838 IonicContact OE2-NH1 2.71Å; E781-R838 PolarHBondContact OE2-NH1 2.74Å
782	L	96.1	Very high	97	Very high	20 Å²	20	26.8 Å²	26.8	11%	0.105	14%	0.14	C	C	.	.	H	α-helix	trans	-64.5	-40.3	178.9	-173	71.7	0	0	0	112	K778 L780 R786 Q880 A883 L888	K778-L782 VanDerWaalsContact O-CB 3.26Å; K778-L782 WeakPolarHBondContact O-CB 3.37Å; K778-L782 PolarHBondContact O-N 3.27Å; L780-L782 VanDerWaalsContact C-N 3.31Å; L780-L782 PolarHBondContact O-N 3.36Å; L782-R786 VanDerWaalsContact O-CB 3.27Å; L782-R786 WeakPolarHBondContact O-CB 3.48Å; L782-R786 PolarHBondContact O-N 3.09Å; L782-Q880 PolarHBondContact O-OE1 3.02Å; L782-A883 HydrophobicContact CD1-CB 3.99Å; L782-A883 HydrophobicContact CD2-CB 3.44Å; L782-A883 VanDerWaalsContact CD2-CB 3.44Å; L782-A883 HydrophobicContact CG-CB 4.39Å; L782-L888 HydrophobicContact CD2-CD2 3.45Å; L782-L888 VanDerWaalsContact CD2-CD2 3.45Å; L782-L888 HydrophobicContact CD2-CG 3.73Å; L782-L888 HydrophobicContact CG-CD2 3.97Å
783	A	97.2	Very high	97	Very high	2 Å²	2	26.8 Å²	26.8	2%	0.017	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-46.3	177.9	0	0	0	0	0	111.5	S779 L780 E781 R786 F787 L798 L801 L802	S779-A783 WeakPolarHBondContact O-CB 3.43Å; S779-A783 PolarHBondContact O-N 3.11Å; S779-A783 VanDerWaalsContact O-N 3.09Å; L780-A783 PolarHBondContact O-N 3.28Å; E781-A783 PolarHBondContact O-N 3.21Å; A783-R786 PolarHBondContact O-N 3.38Å; A783-F787 PolarHBondContact O-N 2.74Å; A783-L798 HydrophobicContact CB-CD1 4.06Å; A783-L798 WeakPolarHBondContact O-CD1 3.43Å; A783-L801 HydrophobicContact CB-CD2 3.58Å; A783-L801 HydrophobicContact CB-CG 3.94Å; A783-L802 HydrophobicContact CB-CD2 4.39Å
784	I	97.6	Very high	97	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-69.6	-47.6	-179.9	-63.2	167.2	0	0	0	110.8	L780 E781 R786 F787 E788 F825 A828 N829 R838 I839	L780-I784 WeakPolarHBondContact O-CG1 3.31Å; L780-I784 PolarHBondContact O-N 3.45Å; E781-I784 PolarHBondContact O-N 3.46Å; I784-R786 PolarHBondContact O-N 2.94Å; I784-F787 WeakPolarHBondContact O-CA 3.47Å; I784-F787 WeakPolarHBondContact O-CB 3.21Å; I784-F787 PolarHBondContact O-N 3.26Å; I784-E788 PolarHBondContact O-N 3.08Å; I784-F825 HydrophobicContact CD1-CE2 4.37Å; I784-A828 HydrophobicContact CD1-CB 4.05Å; I784-N829 HydrophobicContact CD1-CB 3.86Å; I784-R838 HydrophobicContact CG2-CB 3.87Å; I784-I839 HydrophobicContact CG1-CD1 4.24Å; I784-I839 HydrophobicContact CG1-CG1 4.35Å; I784-I839 HydrophobicContact CG2-CG1 4.24Å
785	G	96.6	Very high	97	Very high	8 Å²	8	23.3 Å²	23.3	8%	0.082	11%	0.112	C	C	.	.	H	α-helix	trans	-63.4	-25.9	178.1	0	0	0	0	0	113.3	E781 E788 S789 Q880	E781-G785 PolarHBondContact O-N 3.03Å; G785-E788 WeakPolarHBondContact CA-OE2 3.27Å; G785-S789 PolarHBondContact O-N 3.42Å; G785-Q880 VanDerWaalsContact C-CD 3.49Å
786	R	95.3	Very high	97	Very high	57 Å²	57	23.5 Å²	23.5	22%	0.215	11%	0.112	C	C	.	.	H	α-helix	trans	-68.4	-44.7	172	-171.4	173.5	174.7	147.1	-15.2	110.9	L782 A783 I784 E788 S789 E790 E797 Q880	L782-R786 VanDerWaalsContact O-CB 3.27Å; L782-R786 WeakPolarHBondContact O-CB 3.48Å; L782-R786 PolarHBondContact O-N 3.09Å; A783-R786 PolarHBondContact O-N 3.38Å; I784-R786 PolarHBondContact O-N 2.94Å; R786-E788 VanDerWaalsContact C-N 3.31Å; R786-E788 PolarHBondContact O-N 2.99Å; R786-S789 PolarHBondContact O-N 3.46Å; R786-S789 VanDerWaalsContact O-N 3.11Å; R786-S789 PolarHBondContact O-OG 3.11Å; R786-E790 IonicContact NE-OE1 3.47Å; R786-E790 PolarHBondContact O-N 3.08Å; R786-E797 IonicContact CZ-OE1 2.71Å; R786-E797 IonicContact NE-OE1 2.79Å; R786-E797 IonicContact NH2-OE1 3.36Å; R786-E797 PolarHBondContact NH2-OE1 3.28Å; R786-Q880 VanDerWaalsContact CB-OE1 3.26Å; R786-Q880 VanDerWaalsContact N-OE1 3.12Å
787	F	97.6	Very high	97	Very high	5 Å²	5	23.9 Å²	23.9	2%	0.022	11%	0.113	C	C	.	.	H	α-helix	trans	-59.4	-42.3	174.9	176.3	-120.5	0	0	0	111.7	A783 I784 S789 E790 S794 I795 L798 I839 H842 V843	A783-F787 PolarHBondContact O-N 2.74Å; I784-F787 WeakPolarHBondContact O-CA 3.47Å; I784-F787 WeakPolarHBondContact O-CB 3.21Å; I784-F787 PolarHBondContact O-N 3.26Å; F787-S789 PolarHBondContact O-N 3.18Å; F787-E790 PolarHBondContact O-N 3.38Å; F787-E790 VanDerWaalsContact O-O 3.12Å; F787-S794 WeakPolarHBondContact CD2-OG 3.21Å; F787-I795 HydrophobicContact CD2-CB 4.33Å; F787-I795 HydrophobicContact CE1-CG1 4.48Å; F787-I795 HydrophobicContact CE2-CB 3.61Å; F787-I795 HydrophobicContact CE2-CD1 4.49Å; F787-I795 HydrophobicContact CE2-CG1 3.86Å; F787-I795 HydrophobicContact CZ-CB 4.02Å; F787-I795 HydrophobicContact CZ-CD1 4.02Å; F787-I795 HydrophobicContact CZ-CG1 3.84Å; F787-L798 HydrophobicContact CB-CB 4.35Å; F787-L798 HydrophobicContact CB-CD1 4.31Å; F787-L798 HydrophobicContact CB-CD2 3.88Å; F787-L798 HydrophobicContact CB-CG 4.4Å; F787-L798 HydrophobicContact CD1-CD2 3.75Å; F787-L798 HydrophobicContact CD2-CD2 4.32Å; F787-L798 HydrophobicContact CE1-CD2 4.37Å; F787-L798 HydrophobicContact CG-CD2 3.72Å; F787-I839 HydrophobicContact CD1-CG2 4.41Å; F787-I839 HydrophobicContact CE1-CG2 3.97Å; F787-H842 HydrophobicContact CD1-CB 4.32Å; F787-H842 AromaticContact CD1-CD2 3.68Å; F787-H842 HydrophobicContact CE1-CB 3.97Å; F787-H842 AromaticContact CE1-CD2 3.51Å; F787-H842 AromaticContact CZ-CD2 3.74Å; F787-H842 PolarHBondContact O-CD2 3.12Å; F787-H842 VanDerWaalsContact O-CD2 3.28Å; F787-H842 PolarHBondContact O-NE2 2.9Å; F787-V843 HydrophobicContact CE1-CG2 4.1Å; F787-V843 HydrophobicContact CZ-CG2 3.85Å
788	E	96.9	Very high	97	Very high	69 Å²	69	22 Å²	22	32%	0.322	11%	0.107	S	C	.	.	H	α-helix	trans	-60.6	-24.4	176	-69.3	174	152.4	0	0	113.7	I784 G785 R786 R838 H842	I784-E788 PolarHBondContact O-N 3.08Å; G785-E788 WeakPolarHBondContact CA-OE2 3.27Å; R786-E788 VanDerWaalsContact C-N 3.31Å; R786-E788 PolarHBondContact O-N 2.99Å; E788-R838 WeakPolarHBondContact OE1-CB 3.4Å; E788-R838 IonicContact OE1-CZ 2.82Å; E788-R838 IonicContact OE1-NE 2.81Å; E788-R838 PolarHBondContact OE1-NE 2.86Å; E788-R838 IonicContact OE1-NH2 2.75Å; E788-R838 IonicContact OE2-CZ 3.66Å; E788-R838 IonicContact OE2-NE 2.68Å; E788-R838 PolarHBondContact OE2-NE 3.41Å; E788-R838 IonicContact OE2-NH2 3.18Å; E788-R838 PolarHBondContact OE2-NH2 3.27Å; E788-H842 WeakPolarHBondContact CA-NE2 3.42Å; E788-H842 HydrophobicContact CG-CB 4.33Å; E788-H842 PolarHBondContact O-CE1 2.9Å
789	S	95.5	Very high	97.1	Very high	22 Å²	22	18.2 Å²	18.2	15%	0.154	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-3.5	176	70.8	0	0	0	0	114.5	G785 R786 F787 R877 D878	G785-S789 PolarHBondContact O-N 3.42Å; R786-S789 PolarHBondContact O-N 3.46Å; R786-S789 VanDerWaalsContact O-N 3.11Å; R786-S789 PolarHBondContact O-OG 3.11Å; F787-S789 PolarHBondContact O-N 3.18Å; S789-R877 WeakPolarHBondContact O-CB 3.41Å; S789-D878 WeakPolarHBondContact CB-O 3.4Å
790	E	95.4	Very high	97	Very high	40 Å²	40	18.7 Å²	18.7	19%	0.187	10%	0.096	C	C	.	.	S	Bend	trans	-125.5	169.5	-173.2	-65.4	-150.8	-133.2	0	0	112.5	R786 F787 S794 H842 R906	R786-E790 IonicContact NE-OE1 3.47Å; R786-E790 PolarHBondContact O-N 3.08Å; F787-E790 PolarHBondContact O-N 3.38Å; F787-E790 VanDerWaalsContact O-O 3.12Å; E790-S794 VanDerWaalsContact CB-OG 3.29Å; E790-S794 WeakPolarHBondContact CB-OG 3.49Å; E790-H842 PolarHBondContact O-NE2 3.22Å; E790-R906 IonicContact OE2-CZ 3.65Å; E790-R906 IonicContact OE2-NH1 3.59Å; E790-R906 PolarHBondContact OE2-NH1 2.92Å; E790-R906 IonicContact OE2-NH2 3.55Å; E790-R906 PolarHBondContact OE2-NH2 3.33Å
791	D	96	Very high	97	Very high	18 Å²	18	18.8 Å²	18.8	10%	0.096	10%	0.097	C	C	.	.			trans	-77.6	169.7	178.9	66.7	12.9	0	0	0	113	T793 S794 E846 R866 R906	D791-T793 PolarHBondContact O-N 2.93Å; D791-T793 PolarHBondContact OD1-N 2.9Å; D791-T793 PolarHBondContact OD1-OG1 2.71Å; D791-S794 WeakPolarHBondContact O-CB 3.38Å; D791-S794 PolarHBondContact O-N 2.96Å; D791-S794 PolarHBondContact O-OG 2.66Å; D791-E846 WeakPolarHBondContact CA-OE2 3.38Å; D791-R866 IonicContact OD2-CZ 2.73Å; D791-R866 IonicContact OD2-NH2 3.26Å; D791-R866 PolarHBondContact OD2-NH2 2.88Å; D791-R906 IonicContact OD1-CZ 2.87Å; D791-R906 IonicContact OD1-NE 3.76Å; D791-R906 IonicContact OD1-NH2 2.74Å; D791-R906 PolarHBondContact OD1-NH2 3.16Å; D791-R906 VanDerWaalsContact OD1-NH2 3.12Å
792	L	96.9	Very high	97.1	Very high	3 Å²	3	15.6 Å²	15.6	2%	0.016	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-53.5	-28.7	-178.5	-173.7	61.9	0	0	0	113.8	S794 I795 V843 E846 L847 F851 I917	L792-S794 PolarHBondContact O-N 2.88Å; L792-I795 WeakPolarHBondContact O-CB 3.3Å; L792-I795 VanDerWaalsContact O-CG2 3.29Å; L792-I795 WeakPolarHBondContact O-CG2 3.37Å; L792-I795 PolarHBondContact O-N 3.26Å; L792-V843 HydrophobicContact CD1-CB 4.36Å; L792-V843 HydrophobicContact CD1-CG1 4.07Å; L792-V843 HydrophobicContact CD1-CG2 3.98Å; L792-E846 HydrophobicContact CB-CB 4.11Å; L792-L847 HydrophobicContact CD2-CD2 3.83Å; L792-L847 HydrophobicContact CD2-CG 4.45Å; L792-F851 HydrophobicContact CD2-CB 4.39Å; L792-F851 HydrophobicContact CD2-CD2 4.24Å; L792-F851 HydrophobicContact CD2-CG 4.4Å; L792-I917 HydrophobicContact CD1-CD1 3.94Å; L792-I917 HydrophobicContact CD1-CG1 4.41Å; L792-I917 HydrophobicContact CD2-CD1 4.25Å; L792-I917 HydrophobicContact CG-CD1 4.28Å
793	T	97.4	Very high	97.2	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.006	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-66.9	-25.5	-178.1	72.7	0	0	0	0	113.1	D791 I795 Y855 Y905 R906 V909	D791-T793 PolarHBondContact O-N 2.93Å; D791-T793 PolarHBondContact OD1-N 2.9Å; D791-T793 PolarHBondContact OD1-OG1 2.71Å; T793-I795 PolarHBondContact O-N 3.25Å; T793-Y855 WeakPolarHBondContact CG2-OH 3.38Å; T793-Y905 WeakPolarHBondContact CB-O 3.5Å; T793-R906 PolarHBondContact OG1-NE 2.96Å; T793-V909 HydrophobicContact CG2-CG2 3.79Å
794	S	97.6	Very high	97.2	Very high	5 Å²	5	18.1 Å²	18.1	4%	0.035	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-72	-8.4	179.1	69.5	0	0	0	0	113.8	F787 E790 D791 L792 V796 E797 L798	F787-S794 WeakPolarHBondContact CD2-OG 3.21Å; E790-S794 VanDerWaalsContact CB-OG 3.29Å; E790-S794 WeakPolarHBondContact CB-OG 3.49Å; D791-S794 WeakPolarHBondContact O-CB 3.38Å; D791-S794 PolarHBondContact O-N 2.96Å; D791-S794 PolarHBondContact O-OG 2.66Å; L792-S794 PolarHBondContact O-N 2.88Å; S794-V796 PolarHBondContact O-N 2.94Å; S794-V796 VanDerWaalsContact O-N 3.11Å; S794-E797 WeakPolarHBondContact O-CA 3.38Å; S794-E797 WeakPolarHBondContact O-CB 3.48Å; S794-E797 PolarHBondContact O-N 2.88Å; S794-L798 PolarHBondContact O-N 3.46Å; S794-L798 VanDerWaalsContact O-N 3.09Å
795	I	98.1	Very high	97.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60	-26.4	180	-155.2	177.9	0	0	0	113	F787 L792 T793 L798 D799 V843 V916 I917 L920	F787-I795 HydrophobicContact CD2-CB 4.33Å; F787-I795 HydrophobicContact CE1-CG1 4.48Å; F787-I795 HydrophobicContact CE2-CB 3.61Å; F787-I795 HydrophobicContact CE2-CD1 4.49Å; F787-I795 HydrophobicContact CE2-CG1 3.86Å; F787-I795 HydrophobicContact CZ-CB 4.02Å; F787-I795 HydrophobicContact CZ-CD1 4.02Å; F787-I795 HydrophobicContact CZ-CG1 3.84Å; L792-I795 WeakPolarHBondContact O-CB 3.3Å; L792-I795 VanDerWaalsContact O-CG2 3.29Å; L792-I795 WeakPolarHBondContact O-CG2 3.37Å; L792-I795 PolarHBondContact O-N 3.26Å; T793-I795 PolarHBondContact O-N 3.25Å; I795-L798 HydrophobicContact CG1-CD2 4.37Å; I795-L798 WeakPolarHBondContact O-CB 3.3Å; I795-L798 PolarHBondContact O-N 3.37Å; I795-D799 PolarHBondContact O-N 3.26Å; I795-V843 HydrophobicContact CD1-CG2 3.79Å; I795-V916 HydrophobicContact CB-CG1 4.48Å; I795-V916 HydrophobicContact CD1-CG1 4.19Å; I795-V916 HydrophobicContact CG1-CG1 3.89Å; I795-V916 HydrophobicContact CG2-CB 4.42Å; I795-V916 HydrophobicContact CG2-CG1 4.14Å; I795-I917 HydrophobicContact CD1-CB 4.47Å; I795-I917 HydrophobicContact CD1-CG1 3.62Å; I795-I917 HydrophobicContact CG2-CG1 4.33Å; I795-L920 HydrophobicContact CD1-CD1 4.11Å; I795-L920 HydrophobicContact CG1-CD1 3.99Å
796	V	98.1	Very high	97.3	Very high	15 Å²	15	23.1 Å²	23.1	9%	0.091	11%	0.11	C	C	.	.	H	α-helix	trans	-70.7	-36.1	175.5	-175.3	0	0	0	0	111.3	S794 G800 Y902 Y905	S794-V796 PolarHBondContact O-N 2.94Å; S794-V796 VanDerWaalsContact O-N 3.11Å; V796-G800 PolarHBondContact O-N 2.78Å; V796-Y902 HydrophobicContact CG1-CD1 4.01Å; V796-Y902 HydrophobicContact CG1-CE1 4.22Å; V796-Y905 HydrophobicContact CB-CG 4.29Å; V796-Y905 HydrophobicContact CG1-CD1 4.09Å; V796-Y905 HydrophobicContact CG1-CD2 4.13Å; V796-Y905 HydrophobicContact CG1-CE1 4.3Å; V796-Y905 HydrophobicContact CG1-CE2 4.33Å; V796-Y905 HydrophobicContact CG1-CG 3.99Å; V796-Y905 HydrophobicContact CG2-CD1 4.22Å; V796-Y905 HydrophobicContact CG2-CG 4.37Å
797	E	97.6	Very high	97.5	Very high	10 Å²	10	22.5 Å²	22.5	5%	0.047	11%	0.109	C	C	.	.	H	α-helix	trans	-66.7	-40	171.8	-177.1	172	167.1	0	0	110.5	R786 S794 G800 L801 Y902	R786-E797 IonicContact CZ-OE1 2.71Å; R786-E797 IonicContact NE-OE1 2.79Å; R786-E797 IonicContact NH2-OE1 3.36Å; R786-E797 PolarHBondContact NH2-OE1 3.28Å; S794-E797 WeakPolarHBondContact O-CA 3.38Å; S794-E797 WeakPolarHBondContact O-CB 3.48Å; S794-E797 PolarHBondContact O-N 2.88Å; E797-G800 PolarHBondContact O-N 2.87Å; E797-L801 WeakPolarHBondContact O-CB 3.17Å; E797-L801 PolarHBondContact O-N 3.42Å; E797-Y902 HydrophobicContact CB-CD2 3.95Å; E797-Y902 HydrophobicContact CB-CG 3.9Å; E797-Y902 HydrophobicContact CG-CD2 3.76Å; E797-Y902 HydrophobicContact CG-CG 4.2Å
798	L	98.1	Very high	97.5	Very high	6 Å²	6	22.3 Å²	22.3	3%	0.031	11%	0.109	C	C	.	.	H	α-helix	trans	-58.2	-52.3	175.1	173.6	66.6	0	0	0	111.8	A783 F787 S794 I795 G800 L801 L802 I839 L920	A783-L798 HydrophobicContact CB-CD1 4.06Å; A783-L798 WeakPolarHBondContact O-CD1 3.43Å; F787-L798 HydrophobicContact CB-CB 4.35Å; F787-L798 HydrophobicContact CB-CD1 4.31Å; F787-L798 HydrophobicContact CB-CD2 3.88Å; F787-L798 HydrophobicContact CB-CG 4.4Å; F787-L798 HydrophobicContact CD1-CD2 3.75Å; F787-L798 HydrophobicContact CD2-CD2 4.32Å; F787-L798 HydrophobicContact CE1-CD2 4.37Å; F787-L798 HydrophobicContact CG-CD2 3.72Å; S794-L798 PolarHBondContact O-N 3.46Å; S794-L798 VanDerWaalsContact O-N 3.09Å; I795-L798 HydrophobicContact CG1-CD2 4.37Å; I795-L798 WeakPolarHBondContact O-CB 3.3Å; I795-L798 PolarHBondContact O-N 3.37Å; L798-G800 VanDerWaalsContact C-N 3.31Å; L798-G800 PolarHBondContact O-N 3.11Å; L798-L801 PolarHBondContact O-N 3.33Å; L798-L801 VanDerWaalsContact O-N 3.14Å; L798-L802 HydrophobicContact CD1-CD1 4.03Å; L798-L802 HydrophobicContact CD1-CD2 4.4Å; L798-L802 HydrophobicContact CD1-CG 3.96Å; L798-L802 HydrophobicContact CG-CD1 3.95Å; L798-L802 HydrophobicContact CG-CG 4.27Å; L798-L802 WeakPolarHBondContact O-CG 3.45Å; L798-L802 PolarHBondContact O-N 3.33Å; L798-I839 HydrophobicContact CD2-CD1 3.93Å; L798-I839 HydrophobicContact CD2-CG1 3.97Å; L798-I839 HydrophobicContact CD2-CG2 4.26Å; L798-L920 HydrophobicContact CD2-CD1 4.16Å
799	D	97.8	Very high	97.6	Very high	26 Å²	26	20.1 Å²	20.1	14%	0.139	10%	0.098	C	C	.	.	H	α-helix	trans	-59.2	-43.6	-179.9	-175.8	59.8	0	0	0	111.4	I795 L801 L802 E803 V916 R919	I795-D799 PolarHBondContact O-N 3.26Å; D799-L801 VanDerWaalsContact C-N 3.34Å; D799-L801 PolarHBondContact O-N 2.92Å; D799-L802 PolarHBondContact O-N 3.44Å; D799-E803 WeakPolarHBondContact O-CB 3.29Å; D799-E803 PolarHBondContact O-N 3.11Å; D799-V916 HydrophobicContact CB-CG1 3.67Å; D799-V916 HydrophobicContact CB-CG2 4.14Å; D799-R919 IonicContact OD1-CZ 2.73Å; D799-R919 IonicContact OD1-NH1 3.65Å; D799-R919 IonicContact OD1-NH2 2.93Å; D799-R919 PolarHBondContact OD1-NH2 3.33Å; D799-R919 IonicContact OD2-CZ 3.47Å; D799-R919 IonicContact OD2-NH1 2.91Å; D799-R919 PolarHBondContact OD2-NH1 3.34Å; D799-R919 IonicContact OD2-NH2 3.24Å; D799-R919 PolarHBondContact OD2-NH2 3.37Å
800	G	97.2	Very high	97.7	Very high	10 Å²	10	26 Å²	26	10%	0.103	12%	0.121	C	C	.	.	H	α-helix	trans	-58	-43.8	174.4	0	0	0	0	0	113.4	V796 E797 L798 E803 I804 Y902	V796-G800 PolarHBondContact O-N 2.78Å; E797-G800 PolarHBondContact O-N 2.87Å; L798-G800 VanDerWaalsContact C-N 3.31Å; L798-G800 PolarHBondContact O-N 3.11Å; G800-E803 PolarHBondContact O-N 3.1Å; G800-I804 WeakPolarHBondContact O-CG1 3.44Å; G800-I804 PolarHBondContact O-N 3.16Å; G800-I804 VanDerWaalsContact O-N 3.08Å; G800-Y902 VanDerWaalsContact CA-OH 3.3Å; G800-Y902 WeakPolarHBondContact CA-OH 3.29Å
801	L	97.8	Very high	97.8	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.016	12%	0.115	C	C	.	.	H	α-helix	trans	-70.9	-37.8	178.8	-176.4	57.4	0	0	0	112.3	A783 E797 L798 D799 E803 I804 N805 L888	A783-L801 HydrophobicContact CB-CD2 3.58Å; A783-L801 HydrophobicContact CB-CG 3.94Å; E797-L801 WeakPolarHBondContact O-CB 3.17Å; E797-L801 PolarHBondContact O-N 3.42Å; L798-L801 PolarHBondContact O-N 3.33Å; L798-L801 VanDerWaalsContact O-N 3.14Å; D799-L801 VanDerWaalsContact C-N 3.34Å; D799-L801 PolarHBondContact O-N 2.92Å; L801-E803 VanDerWaalsContact C-N 3.29Å; L801-E803 PolarHBondContact O-N 3.28Å; L801-I804 PolarHBondContact O-N 3.4Å; L801-N805 PolarHBondContact O-N 2.74Å; L801-N805 PolarHBondContact O-ND2 3.32Å; L801-N805 VanDerWaalsContact O-ND2 3.11Å; L801-L888 HydrophobicContact CD2-CD2 4.04Å
802	L	98	Very high	97.9	Very high	7 Å²	7	23.9 Å²	23.9	4%	0.037	11%	0.111	C	C	.	.	H	α-helix	trans	-62	-38.4	172.7	-71	176.7	0	0	0	111.3	L780 A783 L798 D799 N805 R806 F825 I839 L920	L780-L802 HydrophobicContact CD2-CD2 3.82Å; A783-L802 HydrophobicContact CB-CD2 4.39Å; L798-L802 HydrophobicContact CD1-CD1 4.03Å; L798-L802 HydrophobicContact CD1-CD2 4.4Å; L798-L802 HydrophobicContact CD1-CG 3.96Å; L798-L802 HydrophobicContact CG-CD1 3.95Å; L798-L802 HydrophobicContact CG-CG 4.27Å; L798-L802 WeakPolarHBondContact O-CG 3.45Å; L798-L802 PolarHBondContact O-N 3.33Å; D799-L802 PolarHBondContact O-N 3.44Å; L802-N805 CarbonylContact O-C 3.52Å; L802-N805 WeakPolarHBondContact O-CB 3.37Å; L802-N805 PolarHBondContact O-N 3.24Å; L802-R806 PolarHBondContact O-N 2.66Å; L802-F825 HydrophobicContact CD1-CD2 4.46Å; L802-F825 HydrophobicContact CD1-CE2 3.66Å; L802-F825 HydrophobicContact CD1-CZ 4.23Å; L802-F825 HydrophobicContact CD2-CD2 3.95Å; L802-F825 HydrophobicContact CD2-CE2 3.86Å; L802-F825 HydrophobicContact CG-CE2 4.42Å; L802-I839 HydrophobicContact CD1-CD1 4.43Å; L802-L920 HydrophobicContact CD1-CD2 4.17Å
803	E	98.1	Very high	97.9	Very high	74 Å²	74	26 Å²	26	35%	0.346	13%	0.126	S	C	.	.	H	α-helix	trans	-70.7	-35.2	177.6	-165.2	55	-149.8	0	0	112.4	L722 D799 G800 L801 N805 R806 M807	L722-E803 HydrophobicContact CD1-CG 4.42Å; D799-E803 WeakPolarHBondContact O-CB 3.29Å; D799-E803 PolarHBondContact O-N 3.11Å; G800-E803 PolarHBondContact O-N 3.1Å; L801-E803 VanDerWaalsContact C-N 3.29Å; L801-E803 PolarHBondContact O-N 3.28Å; E803-N805 VanDerWaalsContact C-N 3.32Å; E803-N805 PolarHBondContact O-N 3.44Å; E803-R806 PolarHBondContact O-N 3.12Å; E803-R806 IonicContact OE1-NE 3.07Å; E803-R806 WeakPolarHBondContact OE2-CD 3.23Å; E803-R806 IonicContact OE2-NE 3.36Å; E803-R806 PolarHBondContact OE2-NE 3.39Å; E803-M807 WeakPolarHBondContact O-CB 3.41Å; E803-M807 PolarHBondContact O-N 2.91Å
804	I	98.4	Very high	97.8	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-62.3	-41.5	168.9	-68.1	166.7	0	0	0	110.7	K715 A718 L722 G800 L801 M807 T808 H889 Y898	K715-I804 HydrophobicContact CD-CG2 3.69Å; A718-I804 HydrophobicContact CB-CG2 4.21Å; L722-I804 HydrophobicContact CD1-CG1 3.95Å; G800-I804 WeakPolarHBondContact O-CG1 3.44Å; G800-I804 PolarHBondContact O-N 3.16Å; G800-I804 VanDerWaalsContact O-N 3.08Å; L801-I804 PolarHBondContact O-N 3.4Å; I804-M807 PolarHBondContact O-N 3.43Å; I804-T808 WeakPolarHBondContact O-CB 3.37Å; I804-T808 PolarHBondContact O-N 3.49Å; I804-T808 PolarHBondContact O-OG1 2.87Å; I804-H889 HydrophobicContact CD1-CB 4.43Å; I804-Y898 HydrophobicContact CD1-CD1 4.44Å; I804-Y898 HydrophobicContact CD1-CD2 4.17Å; I804-Y898 HydrophobicContact CD1-CE1 4.04Å; I804-Y898 HydrophobicContact CD1-CE2 3.75Å; I804-Y898 HydrophobicContact CD1-CG 4.49Å
805	N	98.3	Very high	97.7	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.016	16%	0.158	C	C	.	.	H	α-helix	trans	-65.1	-40.4	176.1	-75.4	-45.3	0	0	0	111.8	K715 S779 L780 L801 L802 E803 T808 H809 F821	K715-N805 VanDerWaalsContact CE-OD1 3.3Å; K715-N805 WeakPolarHBondContact CE-OD1 3.29Å; K715-N805 PolarHBondContact NZ-OD1 3.34Å; S779-N805 WeakPolarHBondContact CB-OD1 3.39Å; L780-N805 HydrophobicContact CD2-CB 3.88Å; L801-N805 PolarHBondContact O-N 2.74Å; L801-N805 PolarHBondContact O-ND2 3.32Å; L801-N805 VanDerWaalsContact O-ND2 3.11Å; L802-N805 CarbonylContact O-C 3.52Å; L802-N805 WeakPolarHBondContact O-CB 3.37Å; L802-N805 PolarHBondContact O-N 3.24Å; E803-N805 VanDerWaalsContact C-N 3.32Å; E803-N805 PolarHBondContact O-N 3.44Å; N805-T808 WeakPolarHBondContact O-CB 3.09Å; N805-T808 PolarHBondContact O-N 2.91Å; N805-H809 WeakPolarHBondContact O-CB 3.13Å; N805-H809 PolarHBondContact O-N 3.48Å; N805-F821 HydrophobicContact CB-CE2 4.11Å
806	R	98.2	Very high	97.5	Very high	111 Å²	111	34.7 Å²	34.7	42%	0.419	16%	0.159	S	C	.	.	H	α-helix	trans	-60.3	-45.7	173.5	-171.9	-170.5	-59.6	-79	-2.7	111.5	L802 E803 T808 H809 K810 F821	L802-R806 PolarHBondContact O-N 2.66Å; E803-R806 PolarHBondContact O-N 3.12Å; E803-R806 IonicContact OE1-NE 3.07Å; E803-R806 WeakPolarHBondContact OE2-CD 3.23Å; E803-R806 IonicContact OE2-NE 3.36Å; E803-R806 PolarHBondContact OE2-NE 3.39Å; R806-T808 VanDerWaalsContact C-N 3.33Å; R806-T808 PolarHBondContact O-N 3.2Å; R806-H809 WeakPolarHBondContact O-CB 3.48Å; R806-H809 PolarHBondContact O-N 3.24Å; R806-K810 WeakPolarHBondContact O-CB 3.49Å; R806-K810 PolarHBondContact O-N 3.45Å; R806-F821 VanDerWaalsContact CA-CE2 3.41Å; R806-F821 HydrophobicContact CB-CD1 4.31Å; R806-F821 HydrophobicContact CB-CD2 4.23Å; R806-F821 HydrophobicContact CB-CE1 3.97Å; R806-F821 HydrophobicContact CB-CE2 3.88Å; R806-F821 HydrophobicContact CB-CG 4.41Å; R806-F821 HydrophobicContact CB-CZ 3.74Å; R806-F821 HydrophobicContact CG-CD1 4.09Å; R806-F821 HydrophobicContact CG-CD2 4.46Å; R806-F821 HydrophobicContact CG-CE1 4.19Å; R806-F821 HydrophobicContact CG-CG 4.22Å; R806-F821 HydrophobicContact CG-CZ 4.41Å; R806-F821 VanDerWaalsContact N-CE2 3.32Å; R806-F821 VanDerWaalsContact NH1-CD1 3.28Å
807	M	98.3	Very high	97.4	Very high	43 Å²	43	40 Å²	40	21%	0.212	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-37.7	176.9	-174.2	58.1	179.3	0	0	111.7	A718 L721 L722 E803 I804 K810 L811	A718-M807 HydrophobicContact CB-CB 4.01Å; A718-M807 HydrophobicContact CB-CG 3.9Å; L721-M807 HydrophobicContact CD1-CE 3.51Å; L722-M807 HydrophobicContact CD1-CB 3.97Å; L722-M807 HydrophobicContact CD1-CG 4.39Å; E803-M807 WeakPolarHBondContact O-CB 3.41Å; E803-M807 PolarHBondContact O-N 2.91Å; I804-M807 PolarHBondContact O-N 3.43Å; M807-K810 PolarHBondContact O-N 3.32Å; M807-K810 HydrophobicContact SD-CD 4.35Å; M807-L811 HydrophobicContact CE-CD1 4.37Å; M807-L811 HydrophobicContact CE-CD2 4.02Å; M807-L811 HydrophobicContact CE-CG 4.13Å; M807-L811 HydrophobicContact CG-CD1 4.43Å; M807-L811 VanDerWaalsContact O-CG 3.29Å; M807-L811 WeakPolarHBondContact O-CG 3.46Å; M807-L811 PolarHBondContact O-N 2.95Å
808	T	98.4	Very high	97.3	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-48.5	174.1	-54.6	0	0	0	0	111.1	F711 K715 A718 I804 N805 R806 K810 L811 L812	F711-T808 HydrophobicContact CE2-CG2 4.25Å; K715-T808 HydrophobicContact CB-CG2 4.29Å; K715-T808 HydrophobicContact CD-CG2 4.42Å; K715-T808 VanDerWaalsContact CD-OG1 3.3Å; K715-T808 WeakPolarHBondContact CD-OG1 3.24Å; K715-T808 WeakPolarHBondContact CE-OG1 3.42Å; A718-T808 VanDerWaalsContact CB-OG1 3.29Å; A718-T808 WeakPolarHBondContact CB-OG1 3.41Å; I804-T808 WeakPolarHBondContact O-CB 3.37Å; I804-T808 PolarHBondContact O-N 3.49Å; I804-T808 PolarHBondContact O-OG1 2.87Å; N805-T808 WeakPolarHBondContact O-CB 3.09Å; N805-T808 PolarHBondContact O-N 2.91Å; R806-T808 VanDerWaalsContact C-N 3.33Å; R806-T808 PolarHBondContact O-N 3.2Å; T808-K810 VanDerWaalsContact C-N 3.33Å; T808-K810 PolarHBondContact O-N 2.82Å; T808-L811 PolarHBondContact O-N 3.35Å; T808-L812 HydrophobicContact CG2-CD1 3.8Å; T808-L812 WeakPolarHBondContact O-CD1 3.45Å; T808-L812 VanDerWaalsContact O-CG 3.31Å; T808-L812 WeakPolarHBondContact O-CG 3.26Å; T808-L812 PolarHBondContact O-N 3.33Å
809	H	98.5	Very high	97.2	Very high	23 Å²	23	44.2 Å²	44.2	11%	0.106	21%	0.214	C	C	.	.	H	α-helix	trans	-55.7	-46.7	174.3	172.7	-79.1	0	0	0	111.4	N805 R806 L811 L812 S813 D819 F821	N805-H809 WeakPolarHBondContact O-CB 3.13Å; N805-H809 PolarHBondContact O-N 3.48Å; R806-H809 WeakPolarHBondContact O-CB 3.48Å; R806-H809 PolarHBondContact O-N 3.24Å; H809-L811 PolarHBondContact O-N 2.86Å; H809-L812 PolarHBondContact O-N 3.38Å; H809-S813 PolarHBondContact CE1-OG 2.92Å; H809-S813 PolarHBondContact ND1-OG 2.89Å; H809-S813 VanDerWaalsContact O-CB 3.29Å; H809-S813 WeakPolarHBondContact O-CB 3.38Å; H809-S813 PolarHBondContact O-N 2.6Å; H809-S813 PolarHBondContact O-OG 3.22Å; H809-D819 PolarHBondContact NE2-O 2.86Å; H809-F821 HydrophobicContact CB-CD2 3.88Å
810	K	97.9	Very high	97.1	Very high	145 Å²	145	46.3 Å²	46.3	63%	0.63	23%	0.231	S	C	*	.	H	α-helix	trans	-60.9	-43.2	178	-174	176.7	-176.5	176.2	0	112.6	R806 M807 T808	R806-K810 WeakPolarHBondContact O-CB 3.49Å; R806-K810 PolarHBondContact O-N 3.45Å; M807-K810 PolarHBondContact O-N 3.32Å; M807-K810 HydrophobicContact SD-CD 4.35Å; T808-K810 VanDerWaalsContact C-N 3.33Å; T808-K810 PolarHBondContact O-N 2.82Å
811	L	97.5	Very high	97.1	Very high	13 Å²	13	46.5 Å²	46.5	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-65.2	-40.3	179.2	-71.5	172.1	0	0	0	112.2	Y714 M717 A718 L721 M807 T808 H809 R814	Y714-L811 HydrophobicContact CD1-CB 3.85Å; Y714-L811 HydrophobicContact CD1-CD1 4.43Å; Y714-L811 HydrophobicContact CG-CB 4.48Å; M717-L811 HydrophobicContact CB-CD1 4.21Å; M717-L811 HydrophobicContact CG-CD1 3.94Å; M717-L811 HydrophobicContact SD-CD1 3.94Å; M717-L811 HydrophobicContact SD-CD2 4.22Å; A718-L811 HydrophobicContact CB-CD1 4.11Å; L721-L811 HydrophobicContact CD1-CD1 4.26Å; M807-L811 HydrophobicContact CE-CD1 4.37Å; M807-L811 HydrophobicContact CE-CD2 4.02Å; M807-L811 HydrophobicContact CE-CG 4.13Å; M807-L811 HydrophobicContact CG-CD1 4.43Å; M807-L811 VanDerWaalsContact O-CG 3.29Å; M807-L811 WeakPolarHBondContact O-CG 3.46Å; M807-L811 PolarHBondContact O-N 2.95Å; T808-L811 PolarHBondContact O-N 3.35Å; H809-L811 PolarHBondContact O-N 2.86Å; L811-R814 PolarHBondContact O-NE 2.95Å
812	L	97.6	Very high	97	Very high	1 Å²	1	50 Å²	50	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-71.8	-39.3	178.5	-70.1	164.4	0	0	0	112.3	I710 F711 Y714 V772 V776 T808 H809 R814 Y815 L816 L818	I710-L812 HydrophobicContact CG2-CD2 4.25Å; F711-L812 HydrophobicContact CD2-CD1 4.23Å; Y714-L812 HydrophobicContact CD2-CD2 3.45Å; Y714-L812 VanDerWaalsContact CD2-CD2 3.45Å; Y714-L812 HydrophobicContact CD2-CG 4.37Å; Y714-L812 HydrophobicContact CE2-CD2 4.2Å; Y714-L812 HydrophobicContact CG-CD2 3.9Å; Y714-L812 HydrophobicContact CG-CG 4.36Å; V772-L812 HydrophobicContact CG1-CD1 3.57Å; V772-L812 HydrophobicContact CG1-CD2 3.98Å; V772-L812 HydrophobicContact CG1-CG 4.27Å; V776-L812 HydrophobicContact CG2-CD1 4.25Å; T808-L812 HydrophobicContact CG2-CD1 3.8Å; T808-L812 WeakPolarHBondContact O-CD1 3.45Å; T808-L812 VanDerWaalsContact O-CG 3.31Å; T808-L812 WeakPolarHBondContact O-CG 3.26Å; T808-L812 PolarHBondContact O-N 3.33Å; H809-L812 PolarHBondContact O-N 3.38Å; L812-R814 PolarHBondContact O-N 3.06Å; L812-Y815 PolarHBondContact O-N 2.94Å; L812-L816 HydrophobicContact CD2-CD1 4.41Å; L812-L816 PolarHBondContact O-N 2.87Å; L812-L818 HydrophobicContact CB-CD1 3.93Å; L812-L818 HydrophobicContact CD1-CD1 4.46Å
813	S	97.2	Very high	96.9	Very high	48 Å²	48	51.6 Å²	51.6	34%	0.336	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-10.8	-178.4	-61.7	0	0	0	0	113.9	H809 Y815 L816	H809-S813 PolarHBondContact CE1-OG 2.92Å; H809-S813 PolarHBondContact ND1-OG 2.89Å; H809-S813 VanDerWaalsContact O-CB 3.29Å; H809-S813 WeakPolarHBondContact O-CB 3.38Å; H809-S813 PolarHBondContact O-N 2.6Å; H809-S813 PolarHBondContact O-OG 3.22Å; S813-Y815 VanDerWaalsContact C-N 3.25Å; S813-Y815 PolarHBondContact O-N 3.41Å; S813-L816 WeakPolarHBondContact CA-O 3.25Å
814	R	95.9	Very high	96.9	Very high	139 Å²	139	48 Å²	48	53%	0.525	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-24.1	171.2	-65.3	-176.8	-64.6	164.9	2.2	113.1	L811 L812	L811-R814 PolarHBondContact O-NE 2.95Å; L812-R814 PolarHBondContact O-N 3.06Å
815	Y	93.9	Very high	96.9	Very high	45 Å²	45	49.4 Å²	49.4	18%	0.176	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	-24	-175.8	-42.6	-84.1	0	0	0	112.8	Y714 E747 L750 N765 L812 S813	Y714-Y815 HydrophobicContact CE1-CE2 4.18Å; Y714-Y815 AromaticContact CZ-CE2 3.81Å; Y714-Y815 WeakPolarHBondContact OH-CE2 3.48Å; E747-Y815 HydrophobicContact CB-CE1 4.08Å; E747-Y815 HydrophobicContact CG-CE1 3.71Å; E747-Y815 PolarHBondContact OE1-OH 3.24Å; L750-Y815 HydrophobicContact CD1-CD2 4.08Å; L750-Y815 HydrophobicContact CD1-CG 4.07Å; N765-Y815 PolarHBondContact ND2-O 3.14Å; L812-Y815 PolarHBondContact O-N 2.94Å; S813-Y815 VanDerWaalsContact C-N 3.25Å; S813-Y815 PolarHBondContact O-N 3.41Å
816	L	95.3	Very high	96.7	Very high	5 Å²	5	54.1 Å²	54.1	3%	0.026	27%	0.269	C	S	.	.	S	Bend	trans	-117.7	147.8	-176	-55.5	-177.8	0	0	0	110.9	L750 N765 I768 T769 V772 L812 S813 L818	L750-L816 HydrophobicContact CD2-CD1 4.17Å; L750-L816 HydrophobicContact CD2-CD2 3.5Å; L750-L816 VanDerWaalsContact CD2-CD2 3.5Å; L750-L816 HydrophobicContact CD2-CG 4.02Å; N765-L816 VanDerWaalsContact ND2-CD2 3.33Å; N765-L816 WeakPolarHBondContact ND2-CD2 3.29Å; I768-L816 HydrophobicContact CG2-CD1 4.2Å; I768-L816 HydrophobicContact CG2-CD2 4.49Å; T769-L816 WeakPolarHBondContact OG1-CD2 3.34Å; V772-L816 HydrophobicContact CB-CD1 4.01Å; V772-L816 HydrophobicContact CG1-CD1 3.89Å; V772-L816 HydrophobicContact CG2-CD1 4.03Å; L812-L816 HydrophobicContact CD2-CD1 4.41Å; L812-L816 PolarHBondContact O-N 2.87Å; S813-L816 WeakPolarHBondContact CA-O 3.25Å; L816-L818 HydrophobicContact CB-CG 4.41Å; L816-L818 PolarHBondContact O-N 3.44Å
817	T	96	Very high	96.7	Very high	126 Å²	126	53.9 Å²	53.9	77%	0.773	27%	0.272	S	S	*	.			trans	-92.7	99.3	171.7	-52.7	0	0	0	0	109.4	T769	T769-T817 WeakPolarHBondContact CG2-O 3.45Å
818	L	95.4	Very high	96.6	Very high	23 Å²	23	52 Å²	52	12%	0.12	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-101.4	157.6	175.2	-60.5	175	0	0	0	110.1	T769 V772 L812 L816 M824	T769-L818 HydrophobicContact CG2-CD2 4.02Å; V772-L818 HydrophobicContact CG1-CD2 4.38Å; L812-L818 HydrophobicContact CB-CD1 3.93Å; L812-L818 HydrophobicContact CD1-CD1 4.46Å; L816-L818 HydrophobicContact CB-CG 4.41Å; L816-L818 PolarHBondContact O-N 3.44Å; L818-M824 HydrophobicContact CB-CE 3.99Å; L818-M824 HydrophobicContact CD2-CE 4.49Å
819	D	95.8	Very high	96.5	Very high	81 Å²	81	52.1 Å²	52.1	43%	0.433	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-55.7	156.2	164.6	-51.6	-39	0	0	0	110.1	Y777 H809 F821 M824	Y777-D819 PolarHBondContact OH-OD2 3.23Å; H809-D819 PolarHBondContact NE2-O 2.86Å; D819-F821 PolarHBondContact O-N 3.49Å; D819-M824 HydrophobicContact CB-CE 3.72Å; D819-M824 HydrophobicContact CB-CG 3.92Å
820	S	96	Very high	96.4	Very high	71 Å²	71	56.5 Å²	56.5	50%	0.497	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-60.4	142.9	177.9	76.3	0	0	0	0	109.9	D822 A823 M824	S820-D822 PolarHBondContact O-N 3.39Å; S820-A823 PolarHBondContact O-N 3.14Å; S820-A823 WeakPolarHBondContact OG-CB 3.32Å; S820-A823 PolarHBondContact OG-N 3.33Å; S820-M824 PolarHBondContact O-N 2.83Å
821	F	97.6	Very high	96.2	Very high	14 Å²	14	51.5 Å²	51.5	6%	0.061	27%	0.265	C	S	.	.	H	α-helix	trans	-55.6	-37.5	-180	178.8	-94	0	0	0	112	L780 N805 R806 H809 D819 M824 F825	L780-F821 HydrophobicContact CD2-CE2 3.94Å; L780-F821 HydrophobicContact CD2-CZ 4.04Å; N805-F821 HydrophobicContact CB-CE2 4.11Å; R806-F821 VanDerWaalsContact CA-CE2 3.41Å; R806-F821 HydrophobicContact CB-CD1 4.31Å; R806-F821 HydrophobicContact CB-CD2 4.23Å; R806-F821 HydrophobicContact CB-CE1 3.97Å; R806-F821 HydrophobicContact CB-CE2 3.88Å; R806-F821 HydrophobicContact CB-CG 4.41Å; R806-F821 HydrophobicContact CB-CZ 3.74Å; R806-F821 HydrophobicContact CG-CD1 4.09Å; R806-F821 HydrophobicContact CG-CD2 4.46Å; R806-F821 HydrophobicContact CG-CE1 4.19Å; R806-F821 HydrophobicContact CG-CG 4.22Å; R806-F821 HydrophobicContact CG-CZ 4.41Å; R806-F821 VanDerWaalsContact N-CE2 3.32Å; R806-F821 VanDerWaalsContact NH1-CD1 3.28Å; H809-F821 HydrophobicContact CB-CD2 3.88Å; D819-F821 PolarHBondContact O-N 3.49Å; F821-M824 PolarHBondContact O-N 2.94Å; F821-F825 HydrophobicContact CE1-CB 4.27Å; F821-F825 VanDerWaalsContact O-CB 3.25Å; F821-F825 WeakPolarHBondContact O-CB 3.45Å; F821-F825 PolarHBondContact O-N 3.31Å
822	D	95.2	Very high	95.9	Very high	77 Å²	77	56 Å²	56	41%	0.412	29%	0.293	S	S	.	.	H	α-helix	trans	-65.2	-40.5	178.4	-170.4	64.2	0	0	0	112.1	S820 F825 R826	S820-D822 PolarHBondContact O-N 3.39Å; D822-F825 PolarHBondContact O-N 2.97Å; D822-R826 WeakPolarHBondContact O-CB 3.5Å; D822-R826 VanDerWaalsContact O-CG 3.26Å; D822-R826 WeakPolarHBondContact O-CG 3.49Å; D822-R826 PolarHBondContact O-N 3.49Å; D822-R826 IonicContact OD1-NE 3.52Å; D822-R826 IonicContact OD1-NH2 3.49Å; D822-R826 IonicContact OD2-CZ 3.53Å; D822-R826 IonicContact OD2-NE 3.55Å; D822-R826 PolarHBondContact OD2-NE 3.2Å; D822-R826 IonicContact OD2-NH2 2.94Å
823	A	95.8	Very high	95.6	Very high	39 Å²	39	62 Å²	62	32%	0.322	33%	0.334	S	S	.	.	H	α-helix	trans	-62.8	-49.2	174.8	0	0	0	0	0	111.1	S820 F825 R826 E827	S820-A823 PolarHBondContact O-N 3.14Å; S820-A823 WeakPolarHBondContact OG-CB 3.32Å; S820-A823 PolarHBondContact OG-N 3.33Å; A823-F825 VanDerWaalsContact C-N 3.31Å; A823-F825 PolarHBondContact O-N 3.08Å; A823-R826 PolarHBondContact O-N 3.47Å; A823-E827 WeakPolarHBondContact O-CB 3.48Å; A823-E827 PolarHBondContact O-N 3.39Å
824	M	97.9	Very high	95.1	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-59.6	-42.2	178	-63.5	-171	161.1	0	0	112.1	S773 V776 Y777 L780 L818 D819 S820 F821 A828	S773-M824 WeakPolarHBondContact OG-CE 3.37Å; V776-M824 HydrophobicContact CB-SD 4.15Å; V776-M824 HydrophobicContact CG1-SD 3.55Å; V776-M824 VanDerWaalsContact CG1-SD 3.55Å; Y777-M824 HydrophobicContact CD1-CB 4.43Å; Y777-M824 HydrophobicContact CD2-CE 4.47Å; Y777-M824 HydrophobicContact CE1-CB 3.92Å; Y777-M824 HydrophobicContact CE1-CG 4.04Å; Y777-M824 HydrophobicContact CE2-CE 3.84Å; Y777-M824 HydrophobicContact CE2-CG 4.06Å; Y777-M824 HydrophobicContact CE2-SD 4.34Å; L780-M824 HydrophobicContact CD1-CB 3.76Å; L818-M824 HydrophobicContact CB-CE 3.99Å; L818-M824 HydrophobicContact CD2-CE 4.49Å; D819-M824 HydrophobicContact CB-CE 3.72Å; D819-M824 HydrophobicContact CB-CG 3.92Å; S820-M824 PolarHBondContact O-N 2.83Å; F821-M824 PolarHBondContact O-N 2.94Å; M824-A828 PolarHBondContact O-N 2.67Å
825	F	97.8	Very high	94.7	Very high	29 Å²	29	58.8 Å²	58.8	13%	0.127	33%	0.334	C	S	.	.	H	α-helix	trans	-66	-47.2	178	171.1	-110	0	0	0	111.9	I784 L802 F821 D822 A823 E827 A828 N829 I839	I784-F825 HydrophobicContact CD1-CE2 4.37Å; L802-F825 HydrophobicContact CD1-CD2 4.46Å; L802-F825 HydrophobicContact CD1-CE2 3.66Å; L802-F825 HydrophobicContact CD1-CZ 4.23Å; L802-F825 HydrophobicContact CD2-CD2 3.95Å; L802-F825 HydrophobicContact CD2-CE2 3.86Å; L802-F825 HydrophobicContact CG-CE2 4.42Å; F821-F825 HydrophobicContact CE1-CB 4.27Å; F821-F825 VanDerWaalsContact O-CB 3.25Å; F821-F825 WeakPolarHBondContact O-CB 3.45Å; F821-F825 PolarHBondContact O-N 3.31Å; D822-F825 PolarHBondContact O-N 2.97Å; A823-F825 VanDerWaalsContact C-N 3.31Å; A823-F825 PolarHBondContact O-N 3.08Å; F825-E827 VanDerWaalsContact C-N 3.3Å; F825-E827 PolarHBondContact O-N 3Å; F825-A828 PolarHBondContact O-N 3.03Å; F825-N829 WeakPolarHBondContact O-CB 3.46Å; F825-N829 PolarHBondContact O-N 3.27Å; F825-I839 HydrophobicContact CE2-CD1 3.79Å; F825-I839 HydrophobicContact CZ-CD1 3.67Å
826	R	95.5	Very high	94.7	Very high	102 Å²	102	60.4 Å²	60.4	39%	0.385	34%	0.34	S	S	.	.	H	α-helix	trans	-61.7	-40.5	177.4	-74.6	176.9	-174.1	-87.8	-4.9	111.4	D822 A823 N829 H830 N831 V832	D822-R826 WeakPolarHBondContact O-CB 3.5Å; D822-R826 VanDerWaalsContact O-CG 3.26Å; D822-R826 WeakPolarHBondContact O-CG 3.49Å; D822-R826 PolarHBondContact O-N 3.49Å; D822-R826 IonicContact OD1-NE 3.52Å; D822-R826 IonicContact OD1-NH2 3.49Å; D822-R826 IonicContact OD2-CZ 3.53Å; D822-R826 IonicContact OD2-NE 3.55Å; D822-R826 PolarHBondContact OD2-NE 3.2Å; D822-R826 IonicContact OD2-NH2 2.94Å; A823-R826 PolarHBondContact O-N 3.47Å; R826-N829 CarbonylContact O-C 3.58Å; R826-N829 PolarHBondContact O-N 3.27Å; R826-H830 PolarHBondContact O-N 2.95Å; R826-N831 HydrophobicContact CB-CB 4.49Å; R826-N831 PolarHBondContact O-N 2.94Å; R826-V832 HydrophobicContact CB-CG2 3.75Å
827	E	96.6	Very high	94.6	Very high	106 Å²	106	60.2 Å²	60.2	50%	0.495	34%	0.339	S	S	.	.	H	α-helix	trans	-62.8	-51.6	176.7	-176.7	173.8	170.6	0	0	111.3	Y777 A823 F825 N829 H830 V832	Y777-E827 HydrophobicContact CE1-CB 4.06Å; Y777-E827 HydrophobicContact CE1-CG 4.14Å; Y777-E827 WeakPolarHBondContact CE1-OE2 3.29Å; Y777-E827 PolarHBondContact OH-OE2 3Å; A823-E827 WeakPolarHBondContact O-CB 3.48Å; A823-E827 PolarHBondContact O-N 3.39Å; F825-E827 VanDerWaalsContact C-N 3.3Å; F825-E827 PolarHBondContact O-N 3Å; E827-N829 VanDerWaalsContact C-N 3.25Å; E827-N829 PolarHBondContact O-N 2.69Å; E827-H830 WeakPolarHBondContact O-CA 3.44Å; E827-H830 PolarHBondContact O-CD2 3.29Å; E827-H830 PolarHBondContact O-N 2.88Å; E827-V832 HydrophobicContact CB-CG2 4.34Å
828	A	96.6	Very high	94.7	Very high	5 Å²	5	55.4 Å²	55.4	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-61.2	-34.5	176.3	0	0	0	0	0	112.6	L780 I784 M824 F825 H830 R838	L780-A828 HydrophobicContact CB-CB 3.75Å; I784-A828 HydrophobicContact CD1-CB 4.05Å; M824-A828 PolarHBondContact O-N 2.67Å; F825-A828 PolarHBondContact O-N 3.03Å; A828-H830 PolarHBondContact O-N 3.09Å; A828-R838 WeakPolarHBondContact O-CD 3.35Å; A828-R838 PolarHBondContact O-NH1 2.93Å
829	N	97	Very high	94.8	Very high	3 Å²	3	54.3 Å²	54.3	2%	0.016	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	2.5	175.3	-164.3	26.5	0	0	0	113.2	I784 F825 R826 E827 N831 G837 R838 I839	I784-N829 HydrophobicContact CD1-CB 3.86Å; F825-N829 WeakPolarHBondContact O-CB 3.46Å; F825-N829 PolarHBondContact O-N 3.27Å; R826-N829 CarbonylContact O-C 3.58Å; R826-N829 PolarHBondContact O-N 3.27Å; E827-N829 VanDerWaalsContact C-N 3.25Å; E827-N829 PolarHBondContact O-N 2.69Å; N829-N831 HydrophobicContact CB-CB 4.43Å; N829-N831 PolarHBondContact O-N 2.97Å; N829-G837 CarbonylContact O-C 3.54Å; N829-G837 WeakPolarHBondContact O-CA 3.43Å; N829-R838 PolarHBondContact O-N 3.26Å; N829-R838 WeakPolarHBondContact OD1-CB 3.45Å; N829-R838 PolarHBondContact OD1-N 2.88Å; N829-I839 WeakPolarHBondContact OD1-CG1 3.48Å; N829-I839 PolarHBondContact OD1-N 3.11Å
830	H	95.9	Very high	94.9	Very high	115 Å²	115	51 Å²	51	53%	0.532	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	33.4	-175	-62.4	-177.9	0	0	0	113.8	R826 E827 A828 A834 R838	R826-H830 PolarHBondContact O-N 2.95Å; E827-H830 WeakPolarHBondContact O-CA 3.44Å; E827-H830 PolarHBondContact O-CD2 3.29Å; E827-H830 PolarHBondContact O-N 2.88Å; A828-H830 PolarHBondContact O-N 3.09Å; H830-A834 WeakPolarHBondContact O-CB 3.21Å; H830-R838 HydrophobicContact CB-CG 4.22Å
831	N	94.3	Very high	94.8	Very high	40 Å²	40	52.3 Å²	52.3	21%	0.214	29%	0.285	C	S	.	.			trans	-110.1	35.2	-174.8	-162.1	37.3	0	0	0	112.9	R826 N829 A834 G837	R826-N831 HydrophobicContact CB-CB 4.49Å; R826-N831 PolarHBondContact O-N 2.94Å; N829-N831 HydrophobicContact CB-CB 4.43Å; N829-N831 PolarHBondContact O-N 2.97Å; N831-A834 PolarHBondContact OD1-O 3.28Å; N831-G837 PolarHBondContact OD1-N 3.17Å
832	V	91.4	Very high	94.9	Very high	107 Å²	107	52.5 Å²	52.5	65%	0.648	29%	0.286	S	S	*	.	S	Bend	trans	-108.7	-53.4	175.6	-180	0	0	0	0	110.4	R826 E827	R826-V832 HydrophobicContact CB-CG2 3.75Å; E827-V832 HydrophobicContact CB-CG2 4.34Å
833	S	89.7	Confident	95	Very high	126 Å²	126	48.8 Å²	48.8	88%	0.881	27%	0.266	S	S	*	.	S	Bend	trans	-95.4	-6.8	177.2	54.6	0	0	0	0	113.5
834	A	88.1	Confident	95	Very high	39 Å²	39	49.5 Å²	49.5	32%	0.322	26%	0.262	S	S	.	.	S	Bend	trans	-117.9	150.1	176.9	0	0	0	0	0	110.8	H830 N831 Y836	H830-A834 WeakPolarHBondContact O-CB 3.21Å; N831-A834 PolarHBondContact OD1-O 3.28Å; A834-Y836 VanDerWaalsContact C-N 3.33Å
835	P	87.7	Confident	95	Very high	81 Å²	81	54.6 Å²	54.6	53%	0.526	28%	0.281	S	S	.	.	S	Bend	trans	-75.4	-19.3	-179.1	29.2	-34.9	0	0	0	113.9	Q924	P835-Q924 PolarHBondContact O-NE2 3.46Å
836	Y	92.9	Very high	94.9	Very high	80 Å²	80	53.3 Å²	53.3	31%	0.314	28%	0.276	S	S	.	.	S	Bend	trans	-132.6	128.6	-178.9	-49.7	-68.4	0	0	0	109.4	A834 T840 Q924 V928	A834-Y836 VanDerWaalsContact C-N 3.33Å; Y836-T840 HydrophobicContact CD1-CG2 4.5Å; Y836-Q924 HydrophobicContact CD1-CG 4.34Å; Y836-Q924 HydrophobicContact CE1-CG 3.77Å; Y836-V928 HydrophobicContact CD1-CB 4.34Å; Y836-V928 HydrophobicContact CD1-CG1 3.68Å; Y836-V928 HydrophobicContact CE1-CB 3.59Å; Y836-V928 HydrophobicContact CE1-CG1 3.41Å; Y836-V928 VanDerWaalsContact CE1-CG1 3.41Å; Y836-V928 HydrophobicContact CE1-CG2 4.06Å; Y836-V928 HydrophobicContact CE2-CG2 4.1Å; Y836-V928 HydrophobicContact CG-CG1 4.42Å
837	G	94.5	Very high	95	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.257	C	S	.	.			trans	-78.5	166.8	177.6	0	0	0	0	0	113.3	N829 N831 I839 T840 L841	N829-G837 CarbonylContact O-C 3.54Å; N829-G837 WeakPolarHBondContact O-CA 3.43Å; N831-G837 PolarHBondContact OD1-N 3.17Å; G837-I839 VanDerWaalsContact C-N 3.29Å; G837-I839 PolarHBondContact O-N 3.12Å; G837-T840 WeakPolarHBondContact O-CB 3.43Å; G837-T840 PolarHBondContact O-N 2.89Å; G837-T840 VanDerWaalsContact O-N 3.1Å; G837-L841 WeakPolarHBondContact O-CG 3.46Å; G837-L841 PolarHBondContact O-N 3.12Å; G837-L841 VanDerWaalsContact O-N 3.11Å
838	R	97	Very high	94.9	Very high	25 Å²	25	45.8 Å²	45.8	9%	0.094	25%	0.246	C	C	.	.	H	α-helix	trans	-50.9	-43.6	176.4	-72.7	167	63.8	-175.4	10.4	113.5	E781 I784 E788 A828 N829 H830 T840 L841 H842	E781-R838 IonicContact OE1-CZ 3.58Å; E781-R838 VanDerWaalsContact OE1-CZ 3.27Å; E781-R838 IonicContact OE1-NH1 3.37Å; E781-R838 PolarHBondContact OE1-NH1 2.81Å; E781-R838 IonicContact OE1-NH2 2.72Å; E781-R838 PolarHBondContact OE1-NH2 2.75Å; E781-R838 IonicContact OE2-CZ 3.9Å; E781-R838 IonicContact OE2-NH1 2.71Å; E781-R838 PolarHBondContact OE2-NH1 2.74Å; I784-R838 HydrophobicContact CG2-CB 3.87Å; E788-R838 WeakPolarHBondContact OE1-CB 3.4Å; E788-R838 IonicContact OE1-CZ 2.82Å; E788-R838 IonicContact OE1-NE 2.81Å; E788-R838 PolarHBondContact OE1-NE 2.86Å; E788-R838 IonicContact OE1-NH2 2.75Å; E788-R838 IonicContact OE2-CZ 3.66Å; E788-R838 IonicContact OE2-NE 2.68Å; E788-R838 PolarHBondContact OE2-NE 3.41Å; E788-R838 IonicContact OE2-NH2 3.18Å; E788-R838 PolarHBondContact OE2-NH2 3.27Å; A828-R838 WeakPolarHBondContact O-CD 3.35Å; A828-R838 PolarHBondContact O-NH1 2.93Å; N829-R838 PolarHBondContact O-N 3.26Å; N829-R838 WeakPolarHBondContact OD1-CB 3.45Å; N829-R838 PolarHBondContact OD1-N 2.88Å; H830-R838 HydrophobicContact CB-CG 4.22Å; R838-T840 PolarHBondContact O-N 2.76Å; R838-L841 PolarHBondContact O-N 2.54Å; R838-H842 WeakPolarHBondContact O-CB 3.41Å; R838-H842 PolarHBondContact O-N 3.03Å
839	I	97.9	Very high	94.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-46.3	178.4	-63	165.6	0	0	0	111	I784 F787 L798 L802 F825 N829 G837 L841 H842 V843 L920	I784-I839 HydrophobicContact CG1-CD1 4.24Å; I784-I839 HydrophobicContact CG1-CG1 4.35Å; I784-I839 HydrophobicContact CG2-CG1 4.24Å; F787-I839 HydrophobicContact CD1-CG2 4.41Å; F787-I839 HydrophobicContact CE1-CG2 3.97Å; L798-I839 HydrophobicContact CD2-CD1 3.93Å; L798-I839 HydrophobicContact CD2-CG1 3.97Å; L798-I839 HydrophobicContact CD2-CG2 4.26Å; L802-I839 HydrophobicContact CD1-CD1 4.43Å; F825-I839 HydrophobicContact CE2-CD1 3.79Å; F825-I839 HydrophobicContact CZ-CD1 3.67Å; N829-I839 WeakPolarHBondContact OD1-CG1 3.48Å; N829-I839 PolarHBondContact OD1-N 3.11Å; G837-I839 VanDerWaalsContact C-N 3.29Å; G837-I839 PolarHBondContact O-N 3.12Å; I839-L841 PolarHBondContact O-N 3.12Å; I839-H842 PolarHBondContact O-N 2.93Å; I839-V843 WeakPolarHBondContact O-CG2 3.33Å; I839-V843 PolarHBondContact O-N 2.8Å; I839-L920 HydrophobicContact CG2-CB 4.25Å; I839-L920 HydrophobicContact CG2-CD1 4.19Å
840	T	96.8	Very high	94.8	Very high	11 Å²	11	50.8 Å²	50.8	7%	0.067	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-43.7	179.3	-57.6	0	0	0	0	111.4	Y836 G837 R838 V843 F844 L921 V928	Y836-T840 HydrophobicContact CD1-CG2 4.5Å; G837-T840 WeakPolarHBondContact O-CB 3.43Å; G837-T840 PolarHBondContact O-N 2.89Å; G837-T840 VanDerWaalsContact O-N 3.1Å; R838-T840 PolarHBondContact O-N 2.76Å; T840-V843 PolarHBondContact O-N 3.31Å; T840-F844 PolarHBondContact O-N 3.34Å; T840-F844 VanDerWaalsContact O-N 3.12Å; T840-L921 HydrophobicContact CG2-CG 4.11Å; T840-V928 HydrophobicContact CG2-CG1 4.15Å
841	L	95.9	Very high	94.9	Very high	100 Å²	100	45.3 Å²	45.3	52%	0.524	24%	0.24	S	C	.	.	H	α-helix	trans	-64.5	-43.1	178.6	-63.4	174.5	0	0	0	111.5	G837 R838 I839 F844 W845	G837-L841 WeakPolarHBondContact O-CG 3.46Å; G837-L841 PolarHBondContact O-N 3.12Å; G837-L841 VanDerWaalsContact O-N 3.11Å; R838-L841 PolarHBondContact O-N 2.54Å; I839-L841 PolarHBondContact O-N 3.12Å; L841-F844 PolarHBondContact O-N 3.23Å; L841-W845 WeakPolarHBondContact O-CB 3.46Å; L841-W845 PolarHBondContact O-N 2.59Å
842	H	97.7	Very high	95	Very high	17 Å²	17	43.5 Å²	43.5	8%	0.079	23%	0.23	C	C	.	.	H	α-helix	trans	-68.1	-37.3	177.7	-167.1	59.2	0	0	0	112.4	F787 E788 E790 R838 I839 F844 W845 E846	F787-H842 HydrophobicContact CD1-CB 4.32Å; F787-H842 AromaticContact CD1-CD2 3.68Å; F787-H842 HydrophobicContact CE1-CB 3.97Å; F787-H842 AromaticContact CE1-CD2 3.51Å; F787-H842 AromaticContact CZ-CD2 3.74Å; F787-H842 PolarHBondContact O-CD2 3.12Å; F787-H842 VanDerWaalsContact O-CD2 3.28Å; F787-H842 PolarHBondContact O-NE2 2.9Å; E788-H842 WeakPolarHBondContact CA-NE2 3.42Å; E788-H842 HydrophobicContact CG-CB 4.33Å; E788-H842 PolarHBondContact O-CE1 2.9Å; E790-H842 PolarHBondContact O-NE2 3.22Å; R838-H842 WeakPolarHBondContact O-CB 3.41Å; R838-H842 PolarHBondContact O-N 3.03Å; I839-H842 PolarHBondContact O-N 2.93Å; H842-F844 VanDerWaalsContact C-N 3.34Å; H842-F844 PolarHBondContact O-N 3.19Å; H842-W845 WeakPolarHBondContact O-CB 3.4Å; H842-W845 PolarHBondContact O-N 2.94Å; H842-E846 IonicContact CE1-OE1 3.76Å; H842-E846 PolarHBondContact CE1-OE1 3.32Å; H842-E846 WeakPolarHBondContact NE2-CG 3.42Å; H842-E846 IonicContact NE2-OE1 2.82Å; H842-E846 WeakPolarHBondContact O-CB 3.48Å; H842-E846 WeakPolarHBondContact O-CG 3.48Å; H842-E846 PolarHBondContact O-N 2.95Å
843	V	97.9	Very high	95.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.5	-47.7	172.6	166.5	0	0	0	0	110.5	F787 L792 I795 I839 T840 W845 E846 L847 I917 L921	F787-V843 HydrophobicContact CE1-CG2 4.1Å; F787-V843 HydrophobicContact CZ-CG2 3.85Å; L792-V843 HydrophobicContact CD1-CB 4.36Å; L792-V843 HydrophobicContact CD1-CG1 4.07Å; L792-V843 HydrophobicContact CD1-CG2 3.98Å; I795-V843 HydrophobicContact CD1-CG2 3.79Å; I839-V843 WeakPolarHBondContact O-CG2 3.33Å; I839-V843 PolarHBondContact O-N 2.8Å; T840-V843 PolarHBondContact O-N 3.31Å; V843-W845 PolarHBondContact O-N 3.16Å; V843-E846 PolarHBondContact O-N 2.86Å; V843-L847 HydrophobicContact CG1-CD1 4.02Å; V843-L847 HydrophobicContact CG1-CG 4.38Å; V843-L847 WeakPolarHBondContact O-CB 3.35Å; V843-L847 WeakPolarHBondContact O-CG 3.48Å; V843-L847 PolarHBondContact O-N 2.99Å; V843-I917 HydrophobicContact CG1-CG2 4.2Å; V843-L921 HydrophobicContact CB-CD1 4.36Å; V843-L921 HydrophobicContact CG1-CD2 4.21Å; V843-L921 HydrophobicContact CG2-CD1 4.06Å
844	F	96.8	Very high	95.5	Very high	54 Å²	54	32.6 Å²	32.6	24%	0.237	16%	0.159	C	C	.	.	H	α-helix	trans	-63.6	-41	176.6	175.9	-109.1	0	0	0	112.5	T840 L841 H842 L847 N848 V929 E932	T840-F844 PolarHBondContact O-N 3.34Å; T840-F844 VanDerWaalsContact O-N 3.12Å; L841-F844 PolarHBondContact O-N 3.23Å; H842-F844 VanDerWaalsContact C-N 3.34Å; H842-F844 PolarHBondContact O-N 3.19Å; F844-L847 WeakPolarHBondContact O-CB 3.39Å; F844-L847 PolarHBondContact O-N 3.21Å; F844-N848 WeakPolarHBondContact O-CB 3.18Å; F844-N848 PolarHBondContact O-N 3.22Å; F844-V929 HydrophobicContact CB-CG2 4.36Å; F844-E932 HydrophobicContact CD2-CB 3.89Å; F844-E932 HydrophobicContact CE1-CB 4.33Å; F844-E932 HydrophobicContact CE1-CG 4.45Å; F844-E932 HydrophobicContact CE2-CB 3.26Å; F844-E932 HydrophobicContact CE2-CG 4.15Å; F844-E932 HydrophobicContact CZ-CB 3.53Å; F844-E932 HydrophobicContact CZ-CG 4.09Å
845	W	96.4	Very high	96	Very high	106 Å²	106	30.9 Å²	30.9	40%	0.402	14%	0.144	S	C	.	.	H	α-helix	trans	-56	-52.6	175.4	-177.2	-86.3	0	0	0	111.6	L841 H842 V843 L847 N848 Y849 F875	L841-W845 WeakPolarHBondContact O-CB 3.46Å; L841-W845 PolarHBondContact O-N 2.59Å; H842-W845 WeakPolarHBondContact O-CB 3.4Å; H842-W845 PolarHBondContact O-N 2.94Å; V843-W845 PolarHBondContact O-N 3.16Å; W845-L847 VanDerWaalsContact C-N 3.3Å; W845-L847 PolarHBondContact O-N 3.17Å; W845-N848 PolarHBondContact O-N 3.26Å; W845-Y849 AromaticContact CD1-CD2 3.98Å; W845-Y849 AromaticContact CD2-CD2 3.66Å; W845-Y849 HydrophobicContact CD2-CD2 3.66Å; W845-Y849 AromaticContact CD2-CE2 3.62Å; W845-Y849 HydrophobicContact CD2-CE2 3.62Å; W845-Y849 AromaticContact CE2-CD2 3.53Å; W845-Y849 AromaticContact CE2-CE2 3.61Å; W845-Y849 HydrophobicContact CE3-CD2 4.2Å; W845-Y849 AromaticContact CE3-CE2 3.68Å; W845-Y849 HydrophobicContact CE3-CE2 3.68Å; W845-Y849 AromaticContact CG-CD2 3.94Å; W845-Y849 HydrophobicContact CG-CD2 3.94Å; W845-Y849 HydrophobicContact CG-CE2 4.33Å; W845-Y849 HydrophobicContact CH2-CD2 4.46Å; W845-Y849 AromaticContact CH2-CE2 3.72Å; W845-Y849 HydrophobicContact CH2-CE2 3.72Å; W845-Y849 AromaticContact CZ2-CD2 3.96Å; W845-Y849 HydrophobicContact CZ2-CD2 3.96Å; W845-Y849 AromaticContact CZ2-CE2 3.67Å; W845-Y849 HydrophobicContact CZ2-CE2 3.67Å; W845-Y849 AromaticContact CZ3-CE2 3.73Å; W845-Y849 HydrophobicContact CZ3-CE2 3.73Å; W845-Y849 AromaticContact NE1-CD2 3.72Å; W845-Y849 VanDerWaalsContact O-CD2 3.27Å; W845-Y849 WeakPolarHBondContact O-CD2 3.28Å; W845-Y849 PolarHBondContact O-N 3.3Å; W845-F875 HydrophobicContact CZ2-CZ 4.17Å
846	E	97.2	Very high	96.5	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.009	12%	0.12	C	C	.	.	H	α-helix	trans	-67.1	-31	178.6	-69.6	-64.1	138.5	0	0	112.4	D791 L792 H842 V843 D850 F851 R877	D791-E846 WeakPolarHBondContact CA-OE2 3.38Å; L792-E846 HydrophobicContact CB-CB 4.11Å; H842-E846 IonicContact CE1-OE1 3.76Å; H842-E846 PolarHBondContact CE1-OE1 3.32Å; H842-E846 WeakPolarHBondContact NE2-CG 3.42Å; H842-E846 IonicContact NE2-OE1 2.82Å; H842-E846 WeakPolarHBondContact O-CB 3.48Å; H842-E846 WeakPolarHBondContact O-CG 3.48Å; H842-E846 PolarHBondContact O-N 2.95Å; V843-E846 PolarHBondContact O-N 2.86Å; E846-D850 WeakPolarHBondContact O-CA 3.5Å; E846-D850 WeakPolarHBondContact O-CB 3.32Å; E846-D850 PolarHBondContact O-N 3.45Å; E846-F851 PolarHBondContact O-N 2.77Å; E846-R877 IonicContact OE1-CZ 2.7Å; E846-R877 IonicContact OE1-NE 3.43Å; E846-R877 PolarHBondContact OE1-NE 3.38Å; E846-R877 VanDerWaalsContact OE1-NE 3.08Å; E846-R877 IonicContact OE1-NH2 2.69Å; E846-R877 IonicContact OE2-CZ 3.85Å; E846-R877 IonicContact OE2-NE 3.29Å; E846-R877 IonicContact OE2-NH2 2.71Å; E846-R877 PolarHBondContact OE2-NH2 2.98Å
847	L	96.8	Very high	96.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.109	C	C	.	.	I	π-helix	trans	-61	-51.6	171.4	-74.8	172.5	0	0	0	110.8	L792 V843 F844 W845 F851 L852 V929 F1006	L792-L847 HydrophobicContact CD2-CD2 3.83Å; L792-L847 HydrophobicContact CD2-CG 4.45Å; V843-L847 HydrophobicContact CG1-CD1 4.02Å; V843-L847 HydrophobicContact CG1-CG 4.38Å; V843-L847 WeakPolarHBondContact O-CB 3.35Å; V843-L847 WeakPolarHBondContact O-CG 3.48Å; V843-L847 PolarHBondContact O-N 2.99Å; F844-L847 WeakPolarHBondContact O-CB 3.39Å; F844-L847 PolarHBondContact O-N 3.21Å; W845-L847 VanDerWaalsContact C-N 3.3Å; W845-L847 PolarHBondContact O-N 3.17Å; L847-F851 HydrophobicContact CD2-CB 3.8Å; L847-F851 HydrophobicContact CD2-CD1 3.49Å; L847-F851 VanDerWaalsContact CD2-CD1 3.49Å; L847-F851 HydrophobicContact CD2-CE1 4.21Å; L847-F851 HydrophobicContact CD2-CG 3.73Å; L847-L852 WeakPolarHBondContact O-CB 3.09Å; L847-L852 WeakPolarHBondContact O-CG 3.3Å; L847-L852 PolarHBondContact O-N 2.92Å; L847-V929 HydrophobicContact CD1-CG1 3.61Å; L847-F1006 HydrophobicContact CD1-CD1 4.43Å; L847-F1006 HydrophobicContact CD1-CD2 4.32Å; L847-F1006 HydrophobicContact CD1-CE1 3.94Å; L847-F1006 HydrophobicContact CD1-CE2 3.84Å; L847-F1006 HydrophobicContact CD1-CZ 3.63Å; 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 4.21Å; L847-F1006 HydrophobicContact CG-CE2 4.29Å
848	N	94.7	Very high	96.9	Very high	50 Å²	50	27.5 Å²	27.5	27%	0.267	13%	0.126	S	C	.	.	I	π-helix	trans	-67	-42.6	-175.9	-173.5	71.7	0	0	0	113.1	F844 W845	F844-N848 WeakPolarHBondContact O-CB 3.18Å; F844-N848 PolarHBondContact O-N 3.22Å; W845-N848 PolarHBondContact O-N 3.26Å
849	Y	93.9	Very high	96.7	Very high	107 Å²	107	27.8 Å²	27.8	42%	0.42	14%	0.136	S	C	.	.	I	π-helix	trans	-97.1	-20	-171.4	-69.6	-71.1	0	0	0	115.1	W845 P853	W845-Y849 AromaticContact CD1-CD2 3.98Å; W845-Y849 AromaticContact CD2-CD2 3.66Å; W845-Y849 HydrophobicContact CD2-CD2 3.66Å; W845-Y849 AromaticContact CD2-CE2 3.62Å; W845-Y849 HydrophobicContact CD2-CE2 3.62Å; W845-Y849 AromaticContact CE2-CD2 3.53Å; W845-Y849 AromaticContact CE2-CE2 3.61Å; W845-Y849 HydrophobicContact CE3-CD2 4.2Å; W845-Y849 AromaticContact CE3-CE2 3.68Å; W845-Y849 HydrophobicContact CE3-CE2 3.68Å; W845-Y849 AromaticContact CG-CD2 3.94Å; W845-Y849 HydrophobicContact CG-CD2 3.94Å; W845-Y849 HydrophobicContact CG-CE2 4.33Å; W845-Y849 HydrophobicContact CH2-CD2 4.46Å; W845-Y849 AromaticContact CH2-CE2 3.72Å; W845-Y849 HydrophobicContact CH2-CE2 3.72Å; W845-Y849 AromaticContact CZ2-CD2 3.96Å; W845-Y849 HydrophobicContact CZ2-CD2 3.96Å; W845-Y849 AromaticContact CZ2-CE2 3.67Å; W845-Y849 HydrophobicContact CZ2-CE2 3.67Å; W845-Y849 AromaticContact CZ3-CE2 3.73Å; W845-Y849 HydrophobicContact CZ3-CE2 3.73Å; W845-Y849 AromaticContact NE1-CD2 3.72Å; W845-Y849 VanDerWaalsContact O-CD2 3.27Å; W845-Y849 WeakPolarHBondContact O-CD2 3.28Å; W845-Y849 PolarHBondContact O-N 3.3Å; Y849-P853 WeakPolarHBondContact O-CG 3.47Å
850	D	96.7	Very high	96.4	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.032	18%	0.177	C	C	.	.	I	π-helix	trans	-126.9	-56.2	-177	-166.4	14	0	0	0	112.6	E846 P853 N854 R866 R877	E846-D850 WeakPolarHBondContact O-CA 3.5Å; E846-D850 WeakPolarHBondContact O-CB 3.32Å; E846-D850 PolarHBondContact O-N 3.45Å; D850-P853 WeakPolarHBondContact O-CD 3.48Å; D850-N854 WeakPolarHBondContact O-CB 3.4Å; D850-N854 PolarHBondContact O-N 3.5Å; D850-N854 PolarHBondContact OD1-ND2 3.31Å; D850-R866 IonicContact OD1-CZ 3.79Å; D850-R866 IonicContact OD1-NH1 3.81Å; D850-R866 PolarHBondContact OD1-NH1 3.34Å; D850-R866 IonicContact OD1-NH2 3.92Å; D850-R866 IonicContact OD2-CZ 2.98Å; D850-R866 IonicContact OD2-NH1 2.66Å; D850-R866 PolarHBondContact OD2-NH1 3.49Å; D850-R866 IonicContact OD2-NH2 2.77Å; D850-R866 PolarHBondContact OD2-NH2 3.39Å; D850-R877 IonicContact OD2-NH2 2.66Å; D850-R877 PolarHBondContact OD2-NH2 3.01Å
851	F	97.8	Very high	96.3	Very high	1 Å²	1	36.8 Å²	36.8	0%	0.004	20%	0.197	C	C	.	.	I	π-helix	trans	-61.2	-55.8	-172.7	-178.5	-102	0	0	0	113	L792 E846 L847 Y855 F864 V909 F914 N1002 F1006	L792-F851 HydrophobicContact CD2-CB 4.39Å; L792-F851 HydrophobicContact CD2-CD2 4.24Å; L792-F851 HydrophobicContact CD2-CG 4.4Å; E846-F851 PolarHBondContact O-N 2.77Å; L847-F851 HydrophobicContact CD2-CB 3.8Å; L847-F851 HydrophobicContact CD2-CD1 3.49Å; L847-F851 VanDerWaalsContact CD2-CD1 3.49Å; L847-F851 HydrophobicContact CD2-CE1 4.21Å; L847-F851 HydrophobicContact CD2-CG 3.73Å; F851-Y855 HydrophobicContact CB-CD2 4.44Å; F851-Y855 HydrophobicContact CD2-CD1 4.38Å; F851-Y855 HydrophobicContact CD2-CD2 4.1Å; F851-Y855 AromaticContact CD2-CG 3.99Å; F851-Y855 HydrophobicContact CD2-CG 3.99Å; F851-Y855 HydrophobicContact CE2-CG 4.4Å; F851-Y855 VanDerWaalsContact O-CB 3.31Å; F851-Y855 WeakPolarHBondContact O-CB 3.46Å; F851-Y855 PolarHBondContact O-N 3.1Å; F851-F864 HydrophobicContact CE1-CE1 4.29Å; F851-F864 HydrophobicContact CE1-CZ 4.43Å; F851-F864 HydrophobicContact CE2-CB 4.13Å; F851-F864 AromaticContact CE2-CD1 3.96Å; F851-F864 HydrophobicContact CE2-CD1 3.96Å; F851-F864 AromaticContact CE2-CD2 3.97Å; F851-F864 HydrophobicContact CE2-CD2 3.97Å; F851-F864 HydrophobicContact CE2-CE1 4.33Å; F851-F864 HydrophobicContact CE2-CE2 4.36Å; F851-F864 AromaticContact CE2-CG 3.77Å; F851-F864 HydrophobicContact CE2-CG 3.77Å; F851-F864 AromaticContact CZ-CD1 3.71Å; F851-F864 HydrophobicContact CZ-CD1 3.71Å; F851-F864 AromaticContact CZ-CD2 3.86Å; F851-F864 HydrophobicContact CZ-CD2 3.86Å; F851-F864 AromaticContact CZ-CE1 3.61Å; F851-F864 HydrophobicContact CZ-CE1 3.61Å; F851-F864 AromaticContact CZ-CE2 3.78Å; F851-F864 HydrophobicContact CZ-CE2 3.78Å; 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 4.05Å; F851-V909 HydrophobicContact CE2-CG1 3.92Å; F851-V909 HydrophobicContact CE2-CG2 4.28Å; F851-F914 HydrophobicContact CZ-CZ 4.5Å; F851-N1002 HydrophobicContact CE1-CB 4.38Å; F851-F1006 HydrophobicContact CE1-CB 4.25Å; F851-F1006 HydrophobicContact CE1-CD2 4.07Å; F851-F1006 HydrophobicContact CZ-CD2 4.47Å
852	L	96.7	Very high	96.3	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-58.4	-50.9	-178	-64.2	179.3	0	0	0	112	L847 L933 V936 R998 E999 N1002 A1003	L847-L852 WeakPolarHBondContact O-CB 3.09Å; L847-L852 WeakPolarHBondContact O-CG 3.3Å; L847-L852 PolarHBondContact O-N 2.92Å; L852-L933 HydrophobicContact CD1-CD2 3.84Å; L852-L933 HydrophobicContact CD2-CD2 4.45Å; L852-V936 HydrophobicContact CD1-CG1 4.18Å; L852-R998 WeakPolarHBondContact O-CD 3.31Å; L852-E999 HydrophobicContact CB-CB 4.33Å; L852-E999 HydrophobicContact CB-CG 4.18Å; L852-E999 WeakPolarHBondContact O-CG 3.46Å; L852-N1002 HydrophobicContact CD2-CB 3.79Å; L852-N1002 PolarHBondContact O-ND2 3.38Å; L852-A1003 HydrophobicContact CD1-CB 4.48Å; L852-A1003 HydrophobicContact CD2-CB 3.76Å; L852-A1003 VanDerWaalsContact CD2-N 3.31Å
853	P	96.6	Very high	96.2	Very high	4 Å²	4	39 Å²	39	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-76.6	-35.4	-176.4	27.6	-35.6	0	0	0	114.2	Y849 D850 Q995 R998 E999	Y849-P853 WeakPolarHBondContact O-CG 3.47Å; D850-P853 WeakPolarHBondContact O-CD 3.48Å; P853-Q995 VanDerWaalsContact CA-NE2 3.28Å; P853-Q995 PolarHBondContact O-NE2 2.97Å; P853-R998 PolarHBondContact O-NE 3.32Å; P853-E999 HydrophobicContact CB-CG 4.31Å
854	N	96.9	Very high	96.3	Very high	1 Å²	1	39 Å²	39	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-103.3	-5.9	-165.3	-60.5	-37.1	0	0	0	114.8	D850 R866 T867 F871 Q873	D850-N854 WeakPolarHBondContact O-CB 3.4Å; D850-N854 PolarHBondContact O-N 3.5Å; D850-N854 PolarHBondContact OD1-ND2 3.31Å; N854-R866 CarbonylContact O-C 3.59Å; N854-R866 WeakPolarHBondContact O-CA 3.43Å; N854-T867 HydrophobicContact CB-CG2 4.43Å; N854-T867 WeakPolarHBondContact O-CB 3.36Å; N854-T867 WeakPolarHBondContact O-CG2 3.36Å; N854-T867 PolarHBondContact O-N 3.08Å; N854-F871 PolarHBondContact OD1-O 3.48Å; N854-Q873 PolarHBondContact ND2-O 2.97Å; N854-Q873 PolarHBondContact OD1-N 3.2Å
855	Y	97.8	Very high	96.3	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.008	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	148.1	-175.5	-75.3	-106.7	0	0	0	114.3	T793 F851 F864 V865 R866 V909 R998 N1002	T793-Y855 WeakPolarHBondContact CG2-OH 3.38Å; F851-Y855 HydrophobicContact CB-CD2 4.44Å; F851-Y855 HydrophobicContact CD2-CD1 4.38Å; F851-Y855 HydrophobicContact CD2-CD2 4.1Å; F851-Y855 AromaticContact CD2-CG 3.99Å; F851-Y855 HydrophobicContact CD2-CG 3.99Å; F851-Y855 HydrophobicContact CE2-CG 4.4Å; F851-Y855 VanDerWaalsContact O-CB 3.31Å; F851-Y855 WeakPolarHBondContact O-CB 3.46Å; F851-Y855 PolarHBondContact O-N 3.1Å; Y855-F864 HydrophobicContact CD1-CB 3.76Å; Y855-F864 HydrophobicContact CG-CB 4.36Å; Y855-V865 CarbonylContact C-O 3.6Å; Y855-V865 WeakPolarHBondContact CA-O 3.46Å; Y855-R866 HydrophobicContact CE1-CG 4.15Å; Y855-R866 HydrophobicContact CE2-CG 4.29Å; Y855-R866 PolarHBondContact OH-NH2 2.94Å; Y855-V909 HydrophobicContact CD1-CG2 4.27Å; Y855-V909 HydrophobicContact CE1-CB 4.48Å; Y855-V909 HydrophobicContact CE1-CG2 3.67Å; Y855-R998 VanDerWaalsContact C-NH1 3.33Å; Y855-R998 PolarHBondContact O-NH1 3.37Å; Y855-N1002 PolarHBondContact O-ND2 3.16Å
856	C	97.6	Very high	96.3	Very high	4 Å²	4	38.7 Å²	38.7	3%	0.027	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115.6	-179.4	-54.7	0	0	0	0	108.8	F864 V865 R998 C1152	C856-F864 CarbonylContact O-C 3.37Å; C856-F864 VanDerWaalsContact O-CA 3.25Å; C856-F864 WeakPolarHBondContact O-CA 3.46Å; C856-V865 HydrophobicContact CB-CG2 4.19Å; C856-V865 PolarHBondContact N-O 3.48Å; C856-V865 PolarHBondContact O-N 3.49Å; C856-R998 PolarHBondContact SG-NH1 2.69Å; C856-C1152 VanDerWaalsContact SG-C 3.59Å; C856-C1152 PolarHBondContact SG-O 3Å
857	Y	98.2	Very high	96.2	Very high	20 Å²	20	39.4 Å²	39.4	8%	0.078	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	140.1	173.7	-170.9	-125.8	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-F864 VanDerWaalsContact CB-CE1 3.48Å; Y857-F864 HydrophobicContact CD2-CD1 4.01Å; Y857-F864 AromaticContact CD2-CD2 3.73Å; Y857-F864 HydrophobicContact CD2-CD2 3.73Å; Y857-F864 AromaticContact CD2-CE1 3.72Å; Y857-F864 HydrophobicContact CD2-CE1 3.72Å; Y857-F864 AromaticContact CD2-CE2 3.4Å; Y857-F864 HydrophobicContact CD2-CE2 3.4Å; Y857-F864 VanDerWaalsContact CD2-CE2 3.4Å; Y857-F864 HydrophobicContact CD2-CG 4Å; Y857-F864 AromaticContact CD2-CZ 3.39Å; Y857-F864 HydrophobicContact CD2-CZ 3.39Å; Y857-F864 HydrophobicContact CE2-CD2 4.3Å; Y857-F864 AromaticContact CE2-CE2 3.82Å; Y857-F864 HydrophobicContact CE2-CE2 3.82Å; Y857-F864 HydrophobicContact CE2-CZ 4.08Å; Y857-F864 HydrophobicContact CG-CD1 4.33Å; Y857-F864 AromaticContact CG-CE1 3.9Å; Y857-F864 HydrophobicContact CG-CE1 3.9Å; Y857-F864 HydrophobicContact CG-CE2 4.35Å; Y857-F864 AromaticContact CG-CZ 3.89Å; Y857-F864 HydrophobicContact CG-CZ 3.89Å; Y857-L1005 HydrophobicContact CD1-CD1 3.54Å; Y857-L1005 HydrophobicContact CD1-CD2 3.82Å; Y857-L1005 HydrophobicContact CD1-CG 4.32Å; Y857-L1005 HydrophobicContact CE1-CD1 4.32Å; Y857-L1005 HydrophobicContact CE1-CD2 3.72Å; Y857-L1005 HydrophobicContact CG-CD1 3.71Å; Y857-L1009 HydrophobicContact CE2-CD1 3.96Å; Y857-D1155 HydrophobicContact CD1-CB 3.99Å; Y857-D1155 PolarHBondContact O-N 2.65Å
858	N	96.9	Very high	96	Very high	66 Å²	66	40.4 Å²	40.4	35%	0.353	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	100.2	169.5	179.6	-33.2	0	0	0	108.9	S860 T861 N862 R863	N858-S860 PolarHBondContact O-N 3.12Å; N858-S860 WeakPolarHBondContact OD1-CB 3.19Å; N858-S860 PolarHBondContact OD1-N 3.49Å; N858-S860 VanDerWaalsContact OD1-N 3.17Å; N858-T861 PolarHBondContact O-N 3.32Å; N858-T861 VanDerWaalsContact O-N 3.11Å; N858-T861 PolarHBondContact O-OG1 2.98Å; N858-T861 PolarHBondContact OD1-N 2.94Å; N858-T861 PolarHBondContact OD1-OG1 3.47Å; N858-N862 PolarHBondContact O-N 3.47Å; N858-R863 PolarHBondContact N-O 3.39Å; N858-R863 PolarHBondContact O-N 3.15Å
859	G	93.1	Very high	95.8	Very high	31 Å²	31	45.2 Å²	45.2	32%	0.32	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.9	-175.6	0	0	0	0	0	113.9	Y857 T861 D1155	Y857-G859 VanDerWaalsContact CE1-CA 3.5Å; G859-T861 VanDerWaalsContact C-N 3.31Å; G859-T861 PolarHBondContact O-N 2.94Å; G859-D1155 PolarHBondContact N-OD2 2.96Å
860	S	92.6	Very high	95.7	Very high	122 Å²	122	44.9 Å²	44.9	85%	0.853	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-32	175.8	-61.2	0	0	0	0	112.6	N858	N858-S860 PolarHBondContact O-N 3.12Å; N858-S860 WeakPolarHBondContact OD1-CB 3.19Å; N858-S860 PolarHBondContact OD1-N 3.49Å; N858-S860 VanDerWaalsContact OD1-N 3.17Å
861	T	94.2	Very high	95.4	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	-10.4	-179.8	63.2	0	0	0	0	113.7	N858 G859 R863	N858-T861 PolarHBondContact O-N 3.32Å; N858-T861 VanDerWaalsContact O-N 3.11Å; N858-T861 PolarHBondContact O-OG1 2.98Å; N858-T861 PolarHBondContact OD1-N 2.94Å; N858-T861 PolarHBondContact OD1-OG1 3.47Å; G859-T861 VanDerWaalsContact C-N 3.31Å; G859-T861 PolarHBondContact O-N 2.94Å; T861-R863 VanDerWaalsContact C-N 3.28Å; T861-R863 PolarHBondContact O-N 2.89Å
862	N	95.4	Very high	95.1	Very high	49 Å²	49	47.1 Å²	47.1	26%	0.262	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	45	-169.2	-164.7	22.4	0	0	0	112.9	Y857 N858 L1009	Y857-N862 PolarHBondContact OH-OD1 3.5Å; N858-N862 PolarHBondContact O-N 3.47Å; N862-L1009 WeakPolarHBondContact OD1-CD2 3.41Å
863	R	97.2	Very high	94.8	Very high	114 Å²	114	52 Å²	52	43%	0.43	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.1	-179.8	-69	179.3	179.9	-168.4	-2	111.1	N858 T861 F908 V909	N858-R863 PolarHBondContact N-O 3.39Å; N858-R863 PolarHBondContact O-N 3.15Å; T861-R863 VanDerWaalsContact C-N 3.28Å; T861-R863 PolarHBondContact O-N 2.89Å; R863-F908 HydrophobicContact CB-CD2 4.22Å; R863-F908 HydrophobicContact CG-CD2 3.74Å; R863-F908 HydrophobicContact CG-CE2 4.17Å; R863-V909 CarbonylContact C-O 3.5Å; R863-V909 WeakPolarHBondContact CA-O 3.47Å
864	F	98.1	Very high	94.4	Very high	1 Å²	1	59 Å²	59	0%	0.004	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	139.6	167.6	-63.3	-101.2	0	0	0	110.4	F851 Y855 C856 Y857 F908 V909 F914 L1005 L1009	F851-F864 HydrophobicContact CE1-CE1 4.29Å; F851-F864 HydrophobicContact CE1-CZ 4.43Å; F851-F864 HydrophobicContact CE2-CB 4.13Å; F851-F864 AromaticContact CE2-CD1 3.96Å; F851-F864 HydrophobicContact CE2-CD1 3.96Å; F851-F864 AromaticContact CE2-CD2 3.97Å; F851-F864 HydrophobicContact CE2-CD2 3.97Å; F851-F864 HydrophobicContact CE2-CE1 4.33Å; F851-F864 HydrophobicContact CE2-CE2 4.36Å; F851-F864 AromaticContact CE2-CG 3.77Å; F851-F864 HydrophobicContact CE2-CG 3.77Å; F851-F864 AromaticContact CZ-CD1 3.71Å; F851-F864 HydrophobicContact CZ-CD1 3.71Å; F851-F864 AromaticContact CZ-CD2 3.86Å; F851-F864 HydrophobicContact CZ-CD2 3.86Å; F851-F864 AromaticContact CZ-CE1 3.61Å; F851-F864 HydrophobicContact CZ-CE1 3.61Å; F851-F864 AromaticContact CZ-CE2 3.78Å; F851-F864 HydrophobicContact CZ-CE2 3.78Å; 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 3.37Å; C856-F864 VanDerWaalsContact O-CA 3.25Å; C856-F864 WeakPolarHBondContact O-CA 3.46Å; Y857-F864 VanDerWaalsContact CB-CE1 3.48Å; Y857-F864 HydrophobicContact CD2-CD1 4.01Å; Y857-F864 AromaticContact CD2-CD2 3.73Å; Y857-F864 HydrophobicContact CD2-CD2 3.73Å; Y857-F864 AromaticContact CD2-CE1 3.72Å; Y857-F864 HydrophobicContact CD2-CE1 3.72Å; Y857-F864 AromaticContact CD2-CE2 3.4Å; Y857-F864 HydrophobicContact CD2-CE2 3.4Å; Y857-F864 VanDerWaalsContact CD2-CE2 3.4Å; Y857-F864 HydrophobicContact CD2-CG 4Å; Y857-F864 AromaticContact CD2-CZ 3.39Å; Y857-F864 HydrophobicContact CD2-CZ 3.39Å; Y857-F864 HydrophobicContact CE2-CD2 4.3Å; Y857-F864 AromaticContact CE2-CE2 3.82Å; Y857-F864 HydrophobicContact CE2-CE2 3.82Å; Y857-F864 HydrophobicContact CE2-CZ 4.08Å; Y857-F864 HydrophobicContact CG-CD1 4.33Å; Y857-F864 AromaticContact CG-CE1 3.9Å; Y857-F864 HydrophobicContact CG-CE1 3.9Å; Y857-F864 HydrophobicContact CG-CE2 4.35Å; Y857-F864 AromaticContact CG-CZ 3.89Å; Y857-F864 HydrophobicContact CG-CZ 3.89Å; F864-F908 CarbonylContact O-C 3.46Å; F864-F908 WeakPolarHBondContact O-CA 3.3Å; F864-F908 WeakPolarHBondContact O-CB 3.38Å; F864-V909 HydrophobicContact CB-CB 4.2Å; F864-V909 PolarHBondContact N-O 3.4Å; F864-V909 PolarHBondContact O-N 3.49Å; F864-F914 HydrophobicContact CD2-CE2 4.38Å; F864-F914 HydrophobicContact CE2-CE2 4.09Å; F864-F914 AromaticContact CE2-CZ 3.98Å; F864-F914 HydrophobicContact CE2-CZ 3.98Å; F864-L1005 HydrophobicContact CE1-CD1 4.34Å; F864-L1005 HydrophobicContact CZ-CB 3.95Å; F864-L1005 HydrophobicContact CZ-CD1 4.34Å; F864-L1009 HydrophobicContact CE2-CD1 3.55Å; F864-L1009 HydrophobicContact CZ-CD1 4.01Å
865	V	97.2	Very high	93.9	Very high	70 Å²	70	63.6 Å²	63.6	42%	0.424	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	156.2	174	-65	0	0	0	0	110.2	Y855 C856 F908	Y855-V865 CarbonylContact C-O 3.6Å; Y855-V865 WeakPolarHBondContact CA-O 3.46Å; C856-V865 HydrophobicContact CB-CG2 4.19Å; C856-V865 PolarHBondContact N-O 3.48Å; C856-V865 PolarHBondContact O-N 3.49Å; V865-F908 HydrophobicContact CG1-CB 4.47Å
866	R	95.9	Very high	93.5	Very high	84 Å²	84	71.6 Å²	71.6	32%	0.317	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	151	179	-71.1	-173.9	175.7	-78.2	-1.8	111.9	D791 D850 N854 Y855	D791-R866 IonicContact OD2-CZ 2.73Å; D791-R866 IonicContact OD2-NH2 3.26Å; D791-R866 PolarHBondContact OD2-NH2 2.88Å; D850-R866 IonicContact OD1-CZ 3.79Å; D850-R866 IonicContact OD1-NH1 3.81Å; D850-R866 PolarHBondContact OD1-NH1 3.34Å; D850-R866 IonicContact OD1-NH2 3.92Å; D850-R866 IonicContact OD2-CZ 2.98Å; D850-R866 IonicContact OD2-NH1 2.66Å; D850-R866 PolarHBondContact OD2-NH1 3.49Å; D850-R866 IonicContact OD2-NH2 2.77Å; D850-R866 PolarHBondContact OD2-NH2 3.39Å; N854-R866 CarbonylContact O-C 3.59Å; N854-R866 WeakPolarHBondContact O-CA 3.43Å; Y855-R866 HydrophobicContact CE1-CG 4.15Å; Y855-R866 HydrophobicContact CE2-CG 4.29Å; Y855-R866 PolarHBondContact OH-NH2 2.94Å
867	T	95.7	Very high	93.2	Very high	17 Å²	17	74.1 Å²	74.1	10%	0.104	39%	0.387	C	S	.	.			trans	-71.1	179.1	176.2	-167.9	0	0	0	0	112.3	N854 F871 R998 C1152	N854-T867 HydrophobicContact CB-CG2 4.43Å; N854-T867 WeakPolarHBondContact O-CB 3.36Å; N854-T867 WeakPolarHBondContact O-CG2 3.36Å; N854-T867 PolarHBondContact O-N 3.08Å; T867-F871 HydrophobicContact CG2-CB 3.89Å; T867-F871 WeakPolarHBondContact CG2-O 3.43Å; T867-R998 PolarHBondContact OG1-NH2 3.4Å; T867-C1152 WeakPolarHBondContact CB-O 3.31Å; T867-C1152 PolarHBondContact OG1-O 2.91Å
868	V	93.8	Very high	92.8	Very high	20 Å²	20	79.8 Å²	79.8	12%	0.121	42%	0.419	C	S	.	.			trans	-74.1	152.7	176.8	-66.2	0	0	0	0	111.4	P870 F871 S872 F1147 Q1151 C1152	V868-P870 VanDerWaalsContact C-CD 3.43Å; V868-P870 VanDerWaalsContact O-N 3.14Å; V868-F871 HydrophobicContact CG2-CB 4.35Å; V868-F871 HydrophobicContact CG2-CD2 3.97Å; V868-F871 PolarHBondContact O-N 3.24Å; V868-S872 PolarHBondContact O-N 3.43Å; V868-F1147 HydrophobicContact CG1-CB 3.96Å; V868-F1147 HydrophobicContact CG1-CG 4.1Å; V868-F1147 HydrophobicContact CG2-CD1 4.34Å; V868-F1147 HydrophobicContact CG2-CD2 4.07Å; V868-F1147 HydrophobicContact CG2-CE1 4.38Å; V868-F1147 HydrophobicContact CG2-CE2 4.1Å; V868-F1147 HydrophobicContact CG2-CG 4.19Å; V868-F1147 HydrophobicContact CG2-CZ 4.26Å; V868-Q1151 HydrophobicContact CG1-CG 4.02Å; V868-C1152 HydrophobicContact CG2-CB 4.09Å
869	L	89.6	Confident	92.4	Very high	152 Å²	152	86 Å²	86	80%	0.796	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-47.7	-44.2	-174.5	-176	67.2	0	0	0	115.2	F871 S872	L869-F871 PolarHBondContact O-N 3.06Å; L869-F871 VanDerWaalsContact O-N 3.16Å; L869-S872 PolarHBondContact O-N 3.41Å
870	P	91.3	Very high	92.1	Very high	100 Å²	100	87.3 Å²	87.3	65%	0.649	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-66.1	-17.4	-179.2	-20.6	33.4	0	0	0	114.9	V868 F1147	V868-P870 VanDerWaalsContact C-CD 3.43Å; V868-P870 VanDerWaalsContact O-N 3.14Å; P870-F1147 HydrophobicContact CG-CE1 4.31Å
871	F	90.3	Very high	91.8	Very high	26 Å²	26	86.7 Å²	86.7	11%	0.114	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-109.7	-0.7	-179.4	-76.6	-100.1	0	0	0	112.4	N854 T867 V868 L869 Q873 K990 T991 F1147 C1152 F1153	N854-F871 PolarHBondContact OD1-O 3.48Å; T867-F871 HydrophobicContact CG2-CB 3.89Å; T867-F871 WeakPolarHBondContact CG2-O 3.43Å; V868-F871 HydrophobicContact CG2-CB 4.35Å; V868-F871 HydrophobicContact CG2-CD2 3.97Å; V868-F871 PolarHBondContact O-N 3.24Å; L869-F871 PolarHBondContact O-N 3.06Å; L869-F871 VanDerWaalsContact O-N 3.16Å; F871-Q873 PolarHBondContact O-N 2.88Å; F871-K990 HydrophobicContact CZ-CB 4.3Å; F871-T991 HydrophobicContact CE1-CG2 4.27Å; F871-T991 HydrophobicContact CZ-CG2 3.94Å; F871-F1147 HydrophobicContact CE2-CE2 4.23Å; F871-F1147 HydrophobicContact CE2-CZ 4.12Å; F871-C1152 VanDerWaalsContact CD2-SG 3.53Å; F871-F1153 AromaticContact CD1-CE1 3.98Å; F871-F1153 HydrophobicContact CD1-CE1 3.98Å; F871-F1153 AromaticContact CD1-CZ 3.97Å; F871-F1153 HydrophobicContact CD1-CZ 3.97Å; F871-F1153 AromaticContact CE1-CE1 3.84Å; F871-F1153 HydrophobicContact CE1-CE1 3.84Å; F871-F1153 AromaticContact CE1-CZ 3.45Å; F871-F1153 HydrophobicContact CE1-CZ 3.45Å; F871-F1153 VanDerWaalsContact CE1-CZ 3.45Å; F871-F1153 AromaticContact CZ-CZ 3.92Å; F871-F1153 HydrophobicContact CZ-CZ 3.92Å
872	S	92.4	Very high	91.2	Very high	27 Å²	27	90.6 Å²	90.6	19%	0.189	45%	0.451	C	S	.	.			trans	-75.2	106.8	174.7	-165	0	0	0	0	109.2	V868 L869 E874	V868-S872 PolarHBondContact O-N 3.43Å; L869-S872 PolarHBondContact O-N 3.41Å; S872-E874 PolarHBondContact O-N 3.42Å; S872-E874 PolarHBondContact OG-OE1 2.99Å
873	Q	90.4	Very high	90.9	Very high	104 Å²	104	90 Å²	90	49%	0.486	45%	0.453	S	S	.	.			trans	-84.1	95.3	174.9	-59.3	-175.9	31.5	0	0	108.6	N854 F871	N854-Q873 PolarHBondContact ND2-O 2.97Å; N854-Q873 PolarHBondContact OD1-N 3.2Å; F871-Q873 PolarHBondContact O-N 2.88Å
874	E	86.9	Confident	90.7	Very high	152 Å²	152	89.4 Å²	89.4	71%	0.71	46%	0.455	S	S	*	.			trans	-74.3	129.7	177.7	-64.9	-65.1	159	0	0	110.9	S872	S872-E874 PolarHBondContact O-N 3.42Å; S872-E874 PolarHBondContact OG-OE1 2.99Å
875	F	87.6	Confident	90.6	Very high	97 Å²	97	91 Å²	91	43%	0.425	47%	0.465	S	S	.	.			trans	-115.2	127.7	169.9	178.6	-97	0	0	0	109.3	W845 R877	W845-F875 HydrophobicContact CZ2-CZ 4.17Å; F875-R877 HydrophobicContact CD1-CG 4.17Å; F875-R877 PolarHBondContact O-N 3.41Å
876	Q	89.7	Confident	90.6	Very high	169 Å²	169	88.7 Å²	88.7	79%	0.79	45%	0.45	S	S	*	.			trans	-70.5	119.1	179.2	-177.4	175.4	-5.6	0	0	110
877	R	91.1	Very high	90.6	Very high	58 Å²	58	85.9 Å²	85.9	22%	0.219	44%	0.44	C	S	.	.			trans	-99.5	138.8	174.7	-61.9	-179.5	-178.3	83.3	-12.9	110.5	S789 E846 D850 F875 K879	S789-R877 WeakPolarHBondContact O-CB 3.41Å; E846-R877 IonicContact OE1-CZ 2.7Å; E846-R877 IonicContact OE1-NE 3.43Å; E846-R877 PolarHBondContact OE1-NE 3.38Å; E846-R877 VanDerWaalsContact OE1-NE 3.08Å; E846-R877 IonicContact OE1-NH2 2.69Å; E846-R877 IonicContact OE2-CZ 3.85Å; E846-R877 IonicContact OE2-NE 3.29Å; E846-R877 IonicContact OE2-NH2 2.71Å; E846-R877 PolarHBondContact OE2-NH2 2.98Å; D850-R877 IonicContact OD2-NH2 2.66Å; D850-R877 PolarHBondContact OD2-NH2 3.01Å; F875-R877 HydrophobicContact CD1-CG 4.17Å; F875-R877 PolarHBondContact O-N 3.41Å; R877-K879 PolarHBondContact O-N 3.34Å
878	D	89.8	Confident	90.7	Very high	139 Å²	139	85.6 Å²	85.6	74%	0.743	44%	0.438	S	S	*	.			trans	-75.6	114.8	177	-73	-27.4	0	0	0	110.3	S789 Q880	S789-D878 WeakPolarHBondContact CB-O 3.4Å; D878-Q880 PolarHBondContact O-N 3.08Å
879	K	88.2	Confident	90.8	Very high	197 Å²	197	84.7 Å²	84.7	86%	0.857	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-69.5	129.2	-180	-76.9	-168.5	175.1	-174.1	0	111.5	R877	R877-K879 PolarHBondContact O-N 3.34Å
880	Q	87.6	Confident	91.1	Very high	57 Å²	57	77.8 Å²	77.8	27%	0.266	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-69.1	139.7	174.6	-158	-177.7	40.6	0	0	111.7	L782 G785 R786 D878	L782-Q880 PolarHBondContact O-OE1 3.02Å; G785-Q880 VanDerWaalsContact C-CD 3.49Å; R786-Q880 VanDerWaalsContact CB-OE1 3.26Å; R786-Q880 VanDerWaalsContact N-OE1 3.12Å; D878-Q880 PolarHBondContact O-N 3.08Å
881	P	85.6	Confident	91.3	Very high	110 Å²	110	74.7 Å²	74.7	71%	0.714	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-67.8	142.3	176.2	26.6	-35	0	0	0	112.3	A883	P881-A883 PolarHBondContact O-N 3.36Å
882	N	80.6	Confident	91.6	Very high	160 Å²	160	81.7 Å²	81.7	86%	0.856	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-66.9	120.9	179.7	-77.3	-26.8	0	0	0	111.8
883	A	89.1	Confident	91.7	Very high	36 Å²	36	83 Å²	83	30%	0.298	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-91.3	170.6	172.2	0	0	0	0	0	112.6	L782 P881 Y887	L782-A883 HydrophobicContact CD1-CB 3.99Å; L782-A883 HydrophobicContact CD2-CB 3.44Å; L782-A883 VanDerWaalsContact CD2-CB 3.44Å; L782-A883 HydrophobicContact CG-CB 4.39Å; P881-A883 PolarHBondContact O-N 3.36Å; A883-Y887 HydrophobicContact CB-CD2 4.4Å
884	Q	94.1	Very high	92	Very high	101 Å²	101	78.2 Å²	78.2	47%	0.472	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-60.7	145.6	172.9	-68.8	177.2	-15.8	0	0	111.5	Q886 Y887	Q884-Q886 HydrophobicContact CB-CG 4.24Å; Q884-Q886 PolarHBondContact O-N 3.25Å; Q884-Q886 VanDerWaalsContact O-N 3.1Å; Q884-Y887 HydrophobicContact CB-CD2 3.96Å; Q884-Y887 HydrophobicContact CB-CE2 4.12Å; Q884-Y887 PolarHBondContact O-N 3.47Å
885	P	96.4	Very high	92.5	Very high	34 Å²	34	72.4 Å²	72.4	22%	0.221	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-57.4	-30.3	-173.6	-27.6	35.5	0	0	0	115.7	Y887 L888 G890 K892	P885-Y887 PolarHBondContact O-N 3.5Å; P885-L888 CarbonylContact O-C 3.52Å; P885-L888 PolarHBondContact O-N 3.34Å; P885-G890 CarbonylContact C-O 3.39Å; P885-G890 WeakPolarHBondContact CB-O 3.28Å; P885-G890 CarbonylContact O-C 3.03Å; P885-G890 WeakPolarHBondContact O-CA 3.36Å; P885-G890 PolarHBondContact O-N 2.94Å; P885-K892 HydrophobicContact CG-CG 3.85Å
886	Q	95.7	Very high	92.9	Very high	22 Å²	22	73.6 Å²	73.6	10%	0.103	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-63.3	-21.7	177.5	64.9	-159.4	40.7	0	0	113.9	D708 F711 A712 K715 Q884 L888 G890	D708-Q886 PolarHBondContact OD1-NE2 3.23Å; F711-Q886 HydrophobicContact CD1-CB 4.42Å; F711-Q886 HydrophobicContact CD1-CG 4.46Å; F711-Q886 HydrophobicContact CE1-CB 4.47Å; F711-Q886 VanDerWaalsContact CE1-O 3.26Å; F711-Q886 WeakPolarHBondContact CE1-O 3.31Å; A712-Q886 HydrophobicContact CB-CB 3.83Å; K715-Q886 WeakPolarHBondContact CG-O 3.47Å; K715-Q886 PolarHBondContact NZ-O 3.5Å; Q884-Q886 HydrophobicContact CB-CG 4.24Å; Q884-Q886 PolarHBondContact O-N 3.25Å; Q884-Q886 VanDerWaalsContact O-N 3.1Å; Q886-L888 VanDerWaalsContact C-N 3.33Å; Q886-G890 PolarHBondContact N-O 3.22Å
887	Y	97.5	Very high	93.2	Very high	26 Å²	26	65.9 Å²	65.9	10%	0.102	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-83	-13.3	174.1	-60.1	-63.3	0	0	0	113.1	F711 A775 K778 S779 A883 Q884 P885	F711-Y887 AromaticContact CE1-CD1 3.87Å; F711-Y887 HydrophobicContact CE1-CD1 3.87Å; F711-Y887 HydrophobicContact CE1-CE1 4.02Å; F711-Y887 HydrophobicContact CZ-CD1 4.49Å; A775-Y887 HydrophobicContact CB-CE1 4.11Å; K778-Y887 HydrophobicContact CB-CD1 4.3Å; K778-Y887 HydrophobicContact CB-CE1 4.33Å; K778-Y887 HydrophobicContact CD-CD1 4.03Å; K778-Y887 HydrophobicContact CD-CE1 3.69Å; K778-Y887 HydrophobicContact CD-CE2 4.2Å; K778-Y887 HydrophobicContact CD-CG 4.43Å; K778-Y887 HydrophobicContact CG-CD1 4.03Å; K778-Y887 HydrophobicContact CG-CE1 4.15Å; K778-Y887 HydrophobicContact CG-CG 4.44Å; S779-Y887 VanDerWaalsContact OG-C 3.29Å; S779-Y887 WeakPolarHBondContact OG-CA 3.44Å; S779-Y887 PolarHBondContact OG-O 2.87Å; A883-Y887 HydrophobicContact CB-CD2 4.4Å; Q884-Y887 HydrophobicContact CB-CD2 3.96Å; Q884-Y887 HydrophobicContact CB-CE2 4.12Å; Q884-Y887 PolarHBondContact O-N 3.47Å; P885-Y887 PolarHBondContact O-N 3.5Å
888	L	96.1	Very high	93.5	Very high	11 Å²	11	63.5 Å²	63.5	6%	0.058	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-118.8	176.5	-63.8	172.2	0	0	0	109.9	K715 L782 L801 P885 Q886 N895	K715-L888 WeakPolarHBondContact CD-O 3.33Å; K715-L888 PolarHBondContact NZ-O 3.42Å; L782-L888 HydrophobicContact CD2-CD2 3.45Å; L782-L888 VanDerWaalsContact CD2-CD2 3.45Å; L782-L888 HydrophobicContact CD2-CG 3.73Å; L782-L888 HydrophobicContact CG-CD2 3.97Å; L801-L888 HydrophobicContact CD2-CD2 4.04Å; P885-L888 CarbonylContact O-C 3.52Å; P885-L888 PolarHBondContact O-N 3.34Å; Q886-L888 VanDerWaalsContact C-N 3.33Å; L888-N895 WeakPolarHBondContact CB-OD1 3.44Å
889	H	96.3	Very high	93.8	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-1.2	-175.2	-48.2	85.8	0	0	0	113.6	I804 L894 N895 Y898	I804-H889 HydrophobicContact CD1-CB 4.43Å; H889-L894 HydrophobicContact CB-CB 4.11Å; H889-L894 WeakPolarHBondContact O-CD1 3.25Å; H889-N895 VanDerWaalsContact CB-OD1 3.23Å; H889-N895 WeakPolarHBondContact CB-OD1 3.49Å; H889-N895 PolarHBondContact N-OD1 3.01Å; H889-N895 VanDerWaalsContact N-OD1 3.08Å; H889-N895 PolarHBondContact ND1-OD1 3.31Å; H889-Y898 HydrophobicContact CB-CD2 3.84Å; H889-Y898 HydrophobicContact CB-CE2 4.44Å; H889-Y898 VanDerWaalsContact CD2-CB 3.4Å; H889-Y898 WeakPolarHBondContact CD2-CB 3.4Å; H889-Y898 AromaticContact CD2-CD2 3.56Å; H889-Y898 AromaticContact CD2-CG 3.51Å; H889-Y898 AromaticContact CG-CD2 3.9Å
890	G	95.6	Very high	94.1	Very high	6 Å²	6	53.7 Å²	53.7	6%	0.062	31%	0.306	C	S	.	.	S	Bend	trans	116	-53.6	174.6	0	0	0	0	0	114.2	V716 P885 Q886	V716-G890 VanDerWaalsContact CG2-C 3.44Å; V716-G890 WeakPolarHBondContact CG2-O 3.4Å; P885-G890 CarbonylContact C-O 3.39Å; P885-G890 WeakPolarHBondContact CB-O 3.28Å; P885-G890 CarbonylContact O-C 3.03Å; P885-G890 WeakPolarHBondContact O-CA 3.36Å; P885-G890 PolarHBondContact O-N 2.94Å; Q886-G890 PolarHBondContact N-O 3.22Å
891	S	96.8	Very high	94.5	Very high	35 Å²	35	53.2 Å²	53.2	25%	0.245	30%	0.304	C	S	.	.	S	Bend	trans	-135.9	165.1	-176.7	77.1	0	0	0	0	111.8	A893 L894 N895	S891-A893 VanDerWaalsContact C-N 3.28Å; S891-A893 PolarHBondContact O-N 3.41Å; S891-L894 PolarHBondContact O-N 2.84Å; S891-L894 WeakPolarHBondContact OG-CG 3.4Å; S891-L894 PolarHBondContact OG-N 3.4Å; S891-N895 WeakPolarHBondContact O-CB 3.49Å; S891-N895 PolarHBondContact O-N 3.46Å
892	K	96.3	Very high	95.1	Very high	173 Å²	173	49.5 Å²	49.5	75%	0.752	28%	0.277	S	S	*	.	H	α-helix	trans	-58.5	-40.7	176.9	-65.9	-176.3	-179.8	179.1	0	112.1	P885 N895 L896	P885-K892 HydrophobicContact CG-CG 3.85Å; K892-N895 PolarHBondContact O-N 3.05Å; K892-L896 PolarHBondContact O-N 3.05Å; K892-L896 VanDerWaalsContact O-N 3.11Å
893	A	95.2	Very high	95.8	Very high	54 Å²	54	43.4 Å²	43.4	45%	0.446	25%	0.251	S	S	.	.	H	α-helix	trans	-65.2	-42.4	178.1	0	0	0	0	0	112	S891 L896 A897	S891-A893 VanDerWaalsContact C-N 3.28Å; S891-A893 PolarHBondContact O-N 3.41Å; A893-L896 PolarHBondContact O-N 3Å; A893-A897 WeakPolarHBondContact O-CB 3.31Å; A893-A897 PolarHBondContact O-N 2.96Å
894	L	96.6	Very high	96.1	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-68.3	-41.4	176.9	-68.8	174.3	0	0	0	111.7	V716 L723 I738 H889 S891 L896 A897 Y898	V716-L894 HydrophobicContact CG1-CD1 4.01Å; L723-L894 HydrophobicContact CD2-CD2 3.99Å; I738-L894 HydrophobicContact CG2-CD2 4.44Å; H889-L894 HydrophobicContact CB-CB 4.11Å; H889-L894 WeakPolarHBondContact O-CD1 3.25Å; S891-L894 PolarHBondContact O-N 2.84Å; S891-L894 WeakPolarHBondContact OG-CG 3.4Å; S891-L894 PolarHBondContact OG-N 3.4Å; L894-L896 VanDerWaalsContact C-N 3.28Å; L894-L896 PolarHBondContact O-N 2.76Å; L894-A897 PolarHBondContact O-N 3Å; L894-Y898 HydrophobicContact CB-CD2 4.43Å; L894-Y898 VanDerWaalsContact O-CD2 3.31Å; L894-Y898 WeakPolarHBondContact O-CD2 3.19Å; L894-Y898 PolarHBondContact O-N 2.99Å
895	N	96.6	Very high	96.3	Very high	31 Å²	31	44.4 Å²	44.4	17%	0.166	26%	0.256	C	S	.	.	H	α-helix	trans	-55.8	-44.2	174.7	-76.4	-11	0	0	0	111.5	L888 H889 S891 K892 S899	L888-N895 WeakPolarHBondContact CB-OD1 3.44Å; H889-N895 VanDerWaalsContact CB-OD1 3.23Å; H889-N895 WeakPolarHBondContact CB-OD1 3.49Å; H889-N895 PolarHBondContact N-OD1 3.01Å; H889-N895 VanDerWaalsContact N-OD1 3.08Å; H889-N895 PolarHBondContact ND1-OD1 3.31Å; S891-N895 WeakPolarHBondContact O-CB 3.49Å; S891-N895 PolarHBondContact O-N 3.46Å; K892-N895 PolarHBondContact O-N 3.05Å; N895-S899 WeakPolarHBondContact O-CB 3.43Å; N895-S899 PolarHBondContact O-N 3.24Å
896	L	95.9	Very high	96.2	Very high	122 Å²	122	45.9 Å²	45.9	64%	0.639	26%	0.257	S	S	*	.	H	α-helix	trans	-68.1	-42.2	178.4	-171.8	150.7	0	0	0	112	K892 A893 L894 S900	K892-L896 PolarHBondContact O-N 3.05Å; K892-L896 VanDerWaalsContact O-N 3.11Å; A893-L896 PolarHBondContact O-N 3Å; L894-L896 VanDerWaalsContact C-N 3.28Å; L894-L896 PolarHBondContact O-N 2.76Å; L896-S900 WeakPolarHBondContact O-CB 3.43Å; L896-S900 PolarHBondContact O-N 3.15Å; L896-S900 PolarHBondContact O-OG 3.37Å
897	A	96.2	Very high	96.2	Very high	7 Å²	7	51 Å²	51	6%	0.058	29%	0.285	C	S	.	.	H	α-helix	trans	-61.9	-50	178.8	0	0	0	0	0	111.4	L723 I738 A893 L894 S900 I901	L723-A897 HydrophobicContact CD1-CB 4.18Å; L723-A897 HydrophobicContact CD2-CB 4.36Å; I738-A897 HydrophobicContact CD1-CB 3.87Å; A893-A897 WeakPolarHBondContact O-CB 3.31Å; A893-A897 PolarHBondContact O-N 2.96Å; L894-A897 PolarHBondContact O-N 3Å; A897-S900 WeakPolarHBondContact O-CB 3.49Å; A897-S900 PolarHBondContact O-N 3.23Å; A897-I901 WeakPolarHBondContact O-CG1 3.45Å; A897-I901 PolarHBondContact O-N 2.94Å
898	Y	97.1	Very high	96.2	Very high	7 Å²	7	50.8 Å²	50.8	3%	0.027	29%	0.285	C	S	.	.	H	α-helix	trans	-67.4	-41.1	178.5	-80.7	-71.6	0	0	0	112.7	G719 L722 L723 I804 H889 L894 S900 I901 Y902	G719-Y898 PolarHBondContact O-OH 3.14Å; L722-Y898 VanDerWaalsContact C-OH 3.22Å; L723-Y898 WeakPolarHBondContact CA-OH 3.27Å; L723-Y898 HydrophobicContact CB-CE2 4.48Å; L723-Y898 HydrophobicContact CD1-CD2 4.36Å; L723-Y898 HydrophobicContact CD1-CE1 4.17Å; L723-Y898 HydrophobicContact CD1-CE2 4Å; L723-Y898 PolarHBondContact N-OH 3.42Å; I804-Y898 HydrophobicContact CD1-CD1 4.44Å; I804-Y898 HydrophobicContact CD1-CD2 4.17Å; I804-Y898 HydrophobicContact CD1-CE1 4.04Å; I804-Y898 HydrophobicContact CD1-CE2 3.75Å; I804-Y898 HydrophobicContact CD1-CG 4.49Å; H889-Y898 HydrophobicContact CB-CD2 3.84Å; H889-Y898 HydrophobicContact CB-CE2 4.44Å; H889-Y898 VanDerWaalsContact CD2-CB 3.4Å; H889-Y898 WeakPolarHBondContact CD2-CB 3.4Å; H889-Y898 AromaticContact CD2-CD2 3.56Å; H889-Y898 AromaticContact CD2-CG 3.51Å; H889-Y898 AromaticContact CG-CD2 3.9Å; L894-Y898 HydrophobicContact CB-CD2 4.43Å; L894-Y898 VanDerWaalsContact O-CD2 3.31Å; L894-Y898 WeakPolarHBondContact O-CD2 3.19Å; L894-Y898 PolarHBondContact O-N 2.99Å; Y898-S900 VanDerWaalsContact C-N 3.25Å; Y898-S900 PolarHBondContact O-N 3.22Å; Y898-I901 HydrophobicContact CD1-CD1 4.09Å; Y898-I901 HydrophobicContact CE1-CD1 4.44Å; Y898-I901 WeakPolarHBondContact O-CB 3.26Å; Y898-I901 PolarHBondContact O-N 3.34Å; Y898-I901 VanDerWaalsContact O-N 3.12Å; 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 3.4Å; Y898-Y902 PolarHBondContact O-N 3.05Å
899	S	95.5	Very high	96.3	Very high	55 Å²	55	50.2 Å²	50.2	39%	0.385	28%	0.282	S	S	.	.	H	α-helix	trans	-59.5	-38.2	174.1	-178.6	0	0	0	0	111.8	N895 G903	N895-S899 WeakPolarHBondContact O-CB 3.43Å; N895-S899 PolarHBondContact O-N 3.24Å; S899-G903 PolarHBondContact O-N 2.82Å
900	S	95.3	Very high	96.4	Very high	75 Å²	75	50.2 Å²	50.2	52%	0.524	28%	0.282	S	S	.	.	H	α-helix	trans	-66.9	-40.8	173.8	-56.3	0	0	0	0	112.8	L896 A897 Y898 G903	L896-S900 WeakPolarHBondContact O-CB 3.43Å; L896-S900 PolarHBondContact O-N 3.15Å; L896-S900 PolarHBondContact O-OG 3.37Å; A897-S900 WeakPolarHBondContact O-CB 3.49Å; A897-S900 PolarHBondContact O-N 3.23Å; Y898-S900 VanDerWaalsContact C-N 3.25Å; Y898-S900 PolarHBondContact O-N 3.22Å; S900-G903 PolarHBondContact O-N 3.24Å
901	I	96.5	Very high	96.4	Very high	47 Å²	47	52.9 Å²	52.9	24%	0.241	30%	0.298	C	S	.	.	H	α-helix	trans	-58.9	-52.5	175.6	-70.5	165.5	0	0	0	109.7	L723 L727 A897 Y898 G903 S904	L723-I901 HydrophobicContact CD1-CD1 3.64Å; L727-I901 HydrophobicContact CD2-CD1 3.65Å; L727-I901 HydrophobicContact CD2-CG1 3.73Å; A897-I901 WeakPolarHBondContact O-CG1 3.45Å; A897-I901 PolarHBondContact O-N 2.94Å; Y898-I901 HydrophobicContact CD1-CD1 4.09Å; Y898-I901 HydrophobicContact CE1-CD1 4.44Å; Y898-I901 WeakPolarHBondContact O-CB 3.26Å; Y898-I901 PolarHBondContact O-N 3.34Å; Y898-I901 VanDerWaalsContact O-N 3.12Å; I901-G903 VanDerWaalsContact C-N 3.3Å; I901-G903 PolarHBondContact O-N 3.04Å; I901-S904 PolarHBondContact O-N 3.42Å; I901-S904 PolarHBondContact O-OG 3.43Å
902	Y	97.4	Very high	96.4	Very high	33 Å²	33	53 Å²	53	13%	0.129	30%	0.298	C	S	.	.	H	α-helix	trans	-77.2	-16.5	-175.3	-60	-57.4	0	0	0	113.6	V796 E797 G800 Y898 S904 Y905	V796-Y902 HydrophobicContact CG1-CD1 4.01Å; V796-Y902 HydrophobicContact CG1-CE1 4.22Å; E797-Y902 HydrophobicContact CB-CD2 3.95Å; E797-Y902 HydrophobicContact CB-CG 3.9Å; E797-Y902 HydrophobicContact CG-CD2 3.76Å; E797-Y902 HydrophobicContact CG-CG 4.2Å; G800-Y902 VanDerWaalsContact CA-OH 3.3Å; G800-Y902 WeakPolarHBondContact CA-OH 3.29Å; 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 3.4Å; Y898-Y902 PolarHBondContact O-N 3.05Å; Y902-S904 PolarHBondContact O-N 2.84Å; Y902-S904 VanDerWaalsContact O-N 3.13Å; Y902-Y905 HydrophobicContact CD1-CD2 4.35Å; Y902-Y905 HydrophobicContact CD1-CE2 4.49Å; Y902-Y905 PolarHBondContact O-N 2.75Å
903	G	96	Very high	96.4	Very high	31 Å²	31	44.7 Å²	44.7	32%	0.32	26%	0.262	S	S	.	.	H	α-helix	trans	-52.1	-32.2	168.6	0	0	0	0	0	113.3	S899 S900 I901 Y905 R906	S899-G903 PolarHBondContact O-N 2.82Å; S900-G903 PolarHBondContact O-N 3.24Å; I901-G903 VanDerWaalsContact C-N 3.3Å; I901-G903 PolarHBondContact O-N 3.04Å; G903-Y905 PolarHBondContact O-N 2.91Å; G903-Y905 VanDerWaalsContact O-N 3.16Å; G903-R906 PolarHBondContact O-N 2.87Å
904	S	95.7	Very high	96.5	Very high	83 Å²	83	42.3 Å²	42.3	58%	0.58	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-17	177.4	-55.5	0	0	0	0	114.3	I901 Y902	I901-S904 PolarHBondContact O-N 3.42Å; I901-S904 PolarHBondContact O-OG 3.43Å; Y902-S904 PolarHBondContact O-N 2.84Å; Y902-S904 VanDerWaalsContact O-N 3.13Å
905	Y	96.7	Very high	96.5	Very high	76 Å²	76	47.4 Å²	47.4	30%	0.298	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-0.8	-177.2	-63.9	-90.9	0	0	0	113.2	T793 V796 Y902 G903 F908 P912 H913	T793-Y905 WeakPolarHBondContact CB-O 3.5Å; V796-Y905 HydrophobicContact CB-CG 4.29Å; V796-Y905 HydrophobicContact CG1-CD1 4.09Å; V796-Y905 HydrophobicContact CG1-CD2 4.13Å; V796-Y905 HydrophobicContact CG1-CE1 4.3Å; V796-Y905 HydrophobicContact CG1-CE2 4.33Å; V796-Y905 HydrophobicContact CG1-CG 3.99Å; V796-Y905 HydrophobicContact CG2-CD1 4.22Å; V796-Y905 HydrophobicContact CG2-CG 4.37Å; Y902-Y905 HydrophobicContact CD1-CD2 4.35Å; Y902-Y905 HydrophobicContact CD1-CE2 4.49Å; Y902-Y905 PolarHBondContact O-N 2.75Å; G903-Y905 PolarHBondContact O-N 2.91Å; G903-Y905 VanDerWaalsContact O-N 3.16Å; Y905-F908 HydrophobicContact CD1-CZ 4.45Å; Y905-P912 HydrophobicContact CD1-CB 4.24Å; Y905-P912 HydrophobicContact CD1-CG 4.04Å; Y905-P912 HydrophobicContact CE1-CB 3.86Å; Y905-P912 HydrophobicContact CE1-CG 3.88Å; Y905-H913 PolarHBondContact O-NE2 3.27Å
906	R	95.4	Very high	96.5	Very high	64 Å²	64	46.4 Å²	46.4	24%	0.242	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-21.1	-172.8	-57.1	-54.9	-59.6	-92.6	0.7	114.4	E790 D791 T793 G903	E790-R906 IonicContact OE2-CZ 3.65Å; E790-R906 IonicContact OE2-NH1 3.59Å; E790-R906 PolarHBondContact OE2-NH1 2.92Å; E790-R906 IonicContact OE2-NH2 3.55Å; E790-R906 PolarHBondContact OE2-NH2 3.33Å; D791-R906 IonicContact OD1-CZ 2.87Å; D791-R906 IonicContact OD1-NE 3.76Å; D791-R906 IonicContact OD1-NH2 2.74Å; D791-R906 PolarHBondContact OD1-NH2 3.16Å; D791-R906 VanDerWaalsContact OD1-NH2 3.12Å; T793-R906 PolarHBondContact OG1-NE 2.96Å; G903-R906 PolarHBondContact O-N 2.87Å
907	N	95.8	Very high	96.6	Very high	129 Å²	129	40.6 Å²	40.6	69%	0.69	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-0.8	-171.2	-55.4	107.3	0	0	0	114.6
908	F	97.9	Very high	96.6	Very high	22 Å²	22	40.2 Å²	40.2	10%	0.096	23%	0.227	C	C	.	.			trans	-154	166.3	179.2	75.7	-82.3	0	0	0	111.2	R863 F864 V865 Y905 P912 H913	R863-F908 HydrophobicContact CB-CD2 4.22Å; R863-F908 HydrophobicContact CG-CD2 3.74Å; R863-F908 HydrophobicContact CG-CE2 4.17Å; F864-F908 CarbonylContact O-C 3.46Å; F864-F908 WeakPolarHBondContact O-CA 3.3Å; F864-F908 WeakPolarHBondContact O-CB 3.38Å; V865-F908 HydrophobicContact CG1-CB 4.47Å; Y905-F908 HydrophobicContact CD1-CZ 4.45Å; F908-P912 HydrophobicContact CE2-CG 4.27Å; F908-P912 HydrophobicContact CZ-CG 4.23Å; F908-H913 AromaticContact CD2-CE1 3.92Å; F908-H913 AromaticContact CE2-CE1 3.62Å; F908-H913 AromaticContact CE2-ND1 3.9Å; F908-H913 AromaticContact CZ-CE1 3.82Å; F908-H913 PolarHBondContact O-CE1 3.1Å; F908-H913 PolarHBondContact O-NE2 3.13Å; F908-H913 VanDerWaalsContact O-NE2 3.15Å
909	V	98.4	Very high	96.4	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-120.1	130.3	164.7	177.8	0	0	0	0	108.4	T793 F851 Y855 R863 F864 H913 F914	T793-V909 HydrophobicContact CG2-CG2 3.79Å; F851-V909 HydrophobicContact CD2-CG2 4.3Å; F851-V909 HydrophobicContact CE2-CB 4.05Å; F851-V909 HydrophobicContact CE2-CG1 3.92Å; F851-V909 HydrophobicContact CE2-CG2 4.28Å; Y855-V909 HydrophobicContact CD1-CG2 4.27Å; Y855-V909 HydrophobicContact CE1-CB 4.48Å; Y855-V909 HydrophobicContact CE1-CG2 3.67Å; R863-V909 CarbonylContact C-O 3.5Å; R863-V909 WeakPolarHBondContact CA-O 3.47Å; F864-V909 HydrophobicContact CB-CB 4.2Å; F864-V909 PolarHBondContact N-O 3.4Å; F864-V909 PolarHBondContact O-N 3.49Å; V909-H913 HydrophobicContact CG1-CB 4.03Å; V909-F914 HydrophobicContact CG1-CE2 3.99Å; V909-F914 HydrophobicContact CG1-CZ 4.34Å
910	G	96.6	Very high	96.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.234	C	C	.	.			trans	-160.9	-162.3	-178.4	0	0	0	0	0	112.3	P912 H913 F914	G910-P912 VanDerWaalsContact O-N 3.17Å; G910-H913 PolarHBondContact N-ND1 3.21Å; G910-H913 WeakPolarHBondContact O-CB 3.49Å; G910-H913 PolarHBondContact O-N 3.37Å; G910-F914 VanDerWaalsContact O-CD2 3.23Å; G910-F914 WeakPolarHBondContact O-CD2 3.36Å; G910-F914 PolarHBondContact O-N 2.58Å; G910-F914 VanDerWaalsContact O-N 3.12Å
911	P	96.4	Very high	96.4	Very high	62 Å²	62	41 Å²	41	40%	0.403	21%	0.213	S	C	.	.	H	α-helix	trans	-46.7	-44.4	-175.8	-29.6	35.2	0	0	0	116.4	H913 F914 Q915	P911-H913 VanDerWaalsContact C-N 3.28Å; P911-H913 PolarHBondContact O-N 3.43Å; P911-F914 PolarHBondContact O-N 3.18Å; P911-Q915 WeakPolarHBondContact O-CB 3.47Å; P911-Q915 PolarHBondContact O-N 3.32Å
912	P	96.2	Very high	96.3	Very high	37 Å²	37	40.1 Å²	40.1	24%	0.24	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-34.9	179.4	24	-34.1	0	0	0	112.9	Y905 F908 G910 V916	Y905-P912 HydrophobicContact CD1-CB 4.24Å; Y905-P912 HydrophobicContact CD1-CG 4.04Å; Y905-P912 HydrophobicContact CE1-CB 3.86Å; Y905-P912 HydrophobicContact CE1-CG 3.88Å; F908-P912 HydrophobicContact CE2-CG 4.27Å; F908-P912 HydrophobicContact CZ-CG 4.23Å; G910-P912 VanDerWaalsContact O-N 3.17Å; P912-V916 WeakPolarHBondContact O-CG2 3.38Å; P912-V916 PolarHBondContact O-N 3.32Å
913	H	98	Very high	96.1	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70.5	-47.1	176.6	-51.6	84.7	0	0	0	111	Y905 F908 V909 G910 P911 Q915 V916 I917	Y905-H913 PolarHBondContact O-NE2 3.27Å; F908-H913 AromaticContact CD2-CE1 3.92Å; F908-H913 AromaticContact CE2-CE1 3.62Å; F908-H913 AromaticContact CE2-ND1 3.9Å; F908-H913 AromaticContact CZ-CE1 3.82Å; F908-H913 PolarHBondContact O-CE1 3.1Å; F908-H913 PolarHBondContact O-NE2 3.13Å; F908-H913 VanDerWaalsContact O-NE2 3.15Å; V909-H913 HydrophobicContact CG1-CB 4.03Å; G910-H913 PolarHBondContact N-ND1 3.21Å; G910-H913 WeakPolarHBondContact O-CB 3.49Å; G910-H913 PolarHBondContact O-N 3.37Å; P911-H913 VanDerWaalsContact C-N 3.28Å; P911-H913 PolarHBondContact O-N 3.43Å; H913-Q915 VanDerWaalsContact C-N 3.3Å; H913-Q915 PolarHBondContact O-N 3.12Å; H913-V916 PolarHBondContact O-N 3.39Å; H913-V916 VanDerWaalsContact O-N 3.17Å; H913-I917 VanDerWaalsContact O-CG1 3.27Å; H913-I917 WeakPolarHBondContact O-CG1 3.44Å; H913-I917 PolarHBondContact O-N 3.15Å
914	F	97.1	Very high	95.9	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-37.1	178.3	-74.4	-78	0	0	0	112.6	F851 F864 V909 G910 P911 I917 C918 F1006 L1009 I1010 S1013	F851-F914 HydrophobicContact CZ-CZ 4.5Å; F864-F914 HydrophobicContact CD2-CE2 4.38Å; F864-F914 HydrophobicContact CE2-CE2 4.09Å; F864-F914 AromaticContact CE2-CZ 3.98Å; F864-F914 HydrophobicContact CE2-CZ 3.98Å; V909-F914 HydrophobicContact CG1-CE2 3.99Å; V909-F914 HydrophobicContact CG1-CZ 4.34Å; G910-F914 VanDerWaalsContact O-CD2 3.23Å; G910-F914 WeakPolarHBondContact O-CD2 3.36Å; G910-F914 PolarHBondContact O-N 2.58Å; G910-F914 VanDerWaalsContact O-N 3.12Å; P911-F914 PolarHBondContact O-N 3.18Å; F914-I917 PolarHBondContact O-N 3.44Å; F914-C918 VanDerWaalsContact O-CB 3.27Å; F914-C918 WeakPolarHBondContact O-CB 3.31Å; F914-C918 PolarHBondContact O-N 3.46Å; F914-F1006 HydrophobicContact CD1-CD2 4.42Å; F914-F1006 HydrophobicContact CD1-CE2 4.16Å; 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 3.57Å; F914-F1006 HydrophobicContact CE1-CE2 3.57Å; F914-F1006 HydrophobicContact CE1-CG 4.17Å; F914-F1006 HydrophobicContact CE1-CZ 4.42Å; F914-F1006 HydrophobicContact CZ-CD2 4.09Å; F914-F1006 HydrophobicContact CZ-CE2 4.47Å; F914-L1009 HydrophobicContact CD1-CB 4.21Å; F914-L1009 HydrophobicContact CD2-CB 4.38Å; F914-L1009 HydrophobicContact CE1-CB 3.94Å; F914-L1009 HydrophobicContact CE2-CB 4.16Å; F914-L1009 HydrophobicContact CE2-CD1 3.94Å; F914-L1009 HydrophobicContact CG-CB 4.44Å; F914-L1009 HydrophobicContact CZ-CB 3.94Å; F914-L1009 HydrophobicContact CZ-CD1 3.91Å; F914-I1010 HydrophobicContact CD1-CB 4.34Å; F914-I1010 HydrophobicContact CD1-CD1 4.11Å; F914-S1013 VanDerWaalsContact CB-OG 3.25Å; F914-S1013 WeakPolarHBondContact CB-OG 3.25Å
915	Q	95.8	Very high	95.8	Very high	111 Å²	111	42.9 Å²	42.9	52%	0.519	21%	0.209	S	C	.	.	H	α-helix	trans	-62.8	-41.8	174.9	-171	179.1	11.6	0	0	112	P911 H913 R919	P911-Q915 WeakPolarHBondContact O-CB 3.47Å; P911-Q915 PolarHBondContact O-N 3.32Å; H913-Q915 VanDerWaalsContact C-N 3.3Å; H913-Q915 PolarHBondContact O-N 3.12Å; Q915-R919 WeakPolarHBondContact O-CG 3.29Å; Q915-R919 PolarHBondContact O-N 3.32Å; Q915-R919 VanDerWaalsContact O-N 3.15Å
916	V	97.6	Very high	95.8	Very high	9 Å²	9	39.5 Å²	39.5	6%	0.055	20%	0.196	C	C	.	.	H	α-helix	trans	-69.5	-43.5	176.9	172.7	0	0	0	0	111.3	I795 D799 P912 H913 C918 R919 L920	I795-V916 HydrophobicContact CB-CG1 4.48Å; I795-V916 HydrophobicContact CD1-CG1 4.19Å; I795-V916 HydrophobicContact CG1-CG1 3.89Å; I795-V916 HydrophobicContact CG2-CB 4.42Å; I795-V916 HydrophobicContact CG2-CG1 4.14Å; D799-V916 HydrophobicContact CB-CG1 3.67Å; D799-V916 HydrophobicContact CB-CG2 4.14Å; P912-V916 WeakPolarHBondContact O-CG2 3.38Å; P912-V916 PolarHBondContact O-N 3.32Å; H913-V916 PolarHBondContact O-N 3.39Å; H913-V916 VanDerWaalsContact O-N 3.17Å; V916-C918 VanDerWaalsContact C-N 3.27Å; V916-C918 PolarHBondContact O-N 3.22Å; V916-R919 PolarHBondContact O-N 2.89Å; V916-L920 HydrophobicContact CG1-CD1 3.71Å; V916-L920 HydrophobicContact CG1-CG 4.17Å; V916-L920 WeakPolarHBondContact O-CB 3.4Å; V916-L920 WeakPolarHBondContact O-CG 3.46Å; V916-L920 PolarHBondContact O-N 2.8Å
917	I	97.6	Very high	95.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.8	-45.7	175.4	-67.7	165.3	0	0	0	109.7	L792 I795 V843 H913 F914 L920 L921 F1006 I1010	L792-I917 HydrophobicContact CD1-CD1 3.94Å; L792-I917 HydrophobicContact CD1-CG1 4.41Å; L792-I917 HydrophobicContact CD2-CD1 4.25Å; L792-I917 HydrophobicContact CG-CD1 4.28Å; I795-I917 HydrophobicContact CD1-CB 4.47Å; I795-I917 HydrophobicContact CD1-CG1 3.62Å; I795-I917 HydrophobicContact CG2-CG1 4.33Å; V843-I917 HydrophobicContact CG1-CG2 4.2Å; H913-I917 VanDerWaalsContact O-CG1 3.27Å; H913-I917 WeakPolarHBondContact O-CG1 3.44Å; H913-I917 PolarHBondContact O-N 3.15Å; F914-I917 PolarHBondContact O-N 3.44Å; I917-L920 PolarHBondContact O-N 3.07Å; I917-L921 HydrophobicContact CG2-CD1 4.12Å; I917-L921 HydrophobicContact CG2-CD2 3.78Å; I917-L921 HydrophobicContact CG2-CG 4.47Å; I917-L921 VanDerWaalsContact O-CB 3.28Å; I917-L921 WeakPolarHBondContact O-CB 3.38Å; I917-L921 WeakPolarHBondContact O-CD1 3.47Å; I917-L921 PolarHBondContact O-N 3.32Å; I917-F1006 HydrophobicContact CD1-CE2 4.39Å; I917-F1006 HydrophobicContact CG2-CZ 4.33Å; I917-I1010 HydrophobicContact CB-CD1 4.15Å; I917-I1010 HydrophobicContact CG2-CD1 3.81Å
918	C	95.5	Very high	95.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-57.5	-53.1	178.9	-173.7	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 3.31Å; F914-C918 PolarHBondContact O-N 3.46Å; V916-C918 VanDerWaalsContact C-N 3.27Å; V916-C918 PolarHBondContact O-N 3.22Å; C918-L920 PolarHBondContact O-N 3.11Å; C918-G922 PolarHBondContact O-N 3.34Å; C918-I926 HydrophobicContact CB-CD1 4.47Å; C918-I1010 HydrophobicContact CB-CD1 4.06Å; C918-L1014 WeakPolarHBondContact SG-CA 3.43Å; C918-L1014 VanDerWaalsContact SG-CD1 3.59Å; C918-E1017 PolarHBondContact SG-OE2 2.89Å
919	R	94	Very high	95.6	Very high	107 Å²	107	33.2 Å²	33.2	40%	0.404	18%	0.177	S	C	.	.	H	α-helix	trans	-59.4	-43.6	179	-72.8	169.9	55.6	-138.4	-14.9	113.3	D799 Q915 V916 E1017	D799-R919 IonicContact OD1-CZ 2.73Å; D799-R919 IonicContact OD1-NH1 3.65Å; D799-R919 IonicContact OD1-NH2 2.93Å; D799-R919 PolarHBondContact OD1-NH2 3.33Å; D799-R919 IonicContact OD2-CZ 3.47Å; D799-R919 IonicContact OD2-NH1 2.91Å; D799-R919 PolarHBondContact OD2-NH1 3.34Å; D799-R919 IonicContact OD2-NH2 3.24Å; D799-R919 PolarHBondContact OD2-NH2 3.37Å; Q915-R919 WeakPolarHBondContact O-CG 3.29Å; Q915-R919 PolarHBondContact O-N 3.32Å; Q915-R919 VanDerWaalsContact O-N 3.15Å; V916-R919 PolarHBondContact O-N 2.89Å; R919-E1017 WeakPolarHBondContact CG-OE1 3.37Å; R919-E1017 VanDerWaalsContact CG-OE2 3.23Å; R919-E1017 WeakPolarHBondContact CG-OE2 3.3Å; R919-E1017 PolarHBondContact N-OE2 3.31Å
920	L	95.9	Very high	95.4	Very high	31 Å²	31	33.7 Å²	33.7	16%	0.162	18%	0.18	C	C	.	.	H	α-helix	trans	-79.6	-30.3	-174.5	-66	-178.4	0	0	0	113.4	I795 L798 L802 I839 V916 I917 C918	I795-L920 HydrophobicContact CD1-CD1 4.11Å; I795-L920 HydrophobicContact CG1-CD1 3.99Å; L798-L920 HydrophobicContact CD2-CD1 4.16Å; L802-L920 HydrophobicContact CD1-CD2 4.17Å; I839-L920 HydrophobicContact CG2-CB 4.25Å; I839-L920 HydrophobicContact CG2-CD1 4.19Å; V916-L920 HydrophobicContact CG1-CD1 3.71Å; V916-L920 HydrophobicContact CG1-CG 4.17Å; V916-L920 WeakPolarHBondContact O-CB 3.4Å; V916-L920 WeakPolarHBondContact O-CG 3.46Å; V916-L920 PolarHBondContact O-N 2.8Å; I917-L920 PolarHBondContact O-N 3.07Å; C918-L920 PolarHBondContact O-N 3.11Å
921	L	94.8	Very high	95.3	Very high	15 Å²	15	37.2 Å²	37.2	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-83.9	-35.4	177.8	-87.6	57.8	0	0	0	112.1	T840 V843 I917 G925 I926 V929	T840-L921 HydrophobicContact CG2-CG 4.11Å; V843-L921 HydrophobicContact CB-CD1 4.36Å; V843-L921 HydrophobicContact CG1-CD2 4.21Å; V843-L921 HydrophobicContact CG2-CD1 4.06Å; I917-L921 HydrophobicContact CG2-CD1 4.12Å; I917-L921 HydrophobicContact CG2-CD2 3.78Å; I917-L921 HydrophobicContact CG2-CG 4.47Å; I917-L921 VanDerWaalsContact O-CB 3.28Å; I917-L921 WeakPolarHBondContact O-CB 3.38Å; I917-L921 WeakPolarHBondContact O-CD1 3.47Å; I917-L921 PolarHBondContact O-N 3.32Å; L921-G925 WeakPolarHBondContact O-CA 3.43Å; L921-G925 PolarHBondContact O-N 3.36Å; L921-G925 VanDerWaalsContact O-N 3.12Å; L921-I926 HydrophobicContact CB-CG1 4.18Å; L921-V929 HydrophobicContact CD2-CG2 3.86Å
922	G	93.9	Very high	95.2	Very high	29 Å²	29	37 Å²	37	30%	0.299	19%	0.19	S	C	.	.	H	α-helix	trans	57.6	-173.2	-168.8	0	0	0	0	0	112.7	C918 Q924 G925 I926	C918-G922 PolarHBondContact O-N 3.34Å; G922-Q924 VanDerWaalsContact C-N 3.34Å; G922-Q924 PolarHBondContact O-N 3.06Å; G922-G925 PolarHBondContact O-N 2.96Å; G922-I926 VanDerWaalsContact O-CG1 3.25Å; G922-I926 WeakPolarHBondContact O-CG1 3.38Å; G922-I926 PolarHBondContact O-N 3.48Å
923	Y	93.4	Very high	95.2	Very high	93 Å²	93	35.3 Å²	35.3	37%	0.365	18%	0.179	S	C	.	.	H	α-helix	trans	-55.9	-46.2	-177.8	-66.4	-70.6	0	0	0	113.5	G925 I926 A927 L1014 E1018 R1085 L1086	Y923-G925 PolarHBondContact O-N 3.02Å; Y923-I926 PolarHBondContact O-N 3.35Å; Y923-A927 VanDerWaalsContact O-CB 3.32Å; Y923-A927 WeakPolarHBondContact O-CB 3.19Å; Y923-A927 PolarHBondContact O-N 3.45Å; Y923-L1014 HydrophobicContact CD1-CD1 4.26Å; Y923-L1014 HydrophobicContact CD1-CD2 4.07Å; Y923-L1014 HydrophobicContact CE1-CD1 3.8Å; Y923-L1014 HydrophobicContact CE1-CD2 3.92Å; Y923-L1014 HydrophobicContact CE1-CG 4.23Å; Y923-E1018 VanDerWaalsContact CE1-OE1 3.23Å; Y923-E1018 WeakPolarHBondContact CE1-OE1 3.44Å; Y923-E1018 VanDerWaalsContact CZ-OE1 3.27Å; Y923-E1018 WeakPolarHBondContact OH-CG 3.3Å; Y923-E1018 PolarHBondContact OH-OE1 3.19Å; Y923-R1085 PolarHBondContact OH-NE 3.39Å; Y923-R1085 VanDerWaalsContact OH-NE 3.14Å; Y923-R1085 PolarHBondContact OH-NH2 3.48Å; Y923-L1086 HydrophobicContact CD1-CD1 4.28Å; Y923-L1086 HydrophobicContact CE1-CD1 3.99Å; Y923-L1086 HydrophobicContact CE1-CG 4.18Å
924	Q	91.9	Very high	95	Very high	109 Å²	109	35.5 Å²	35.5	51%	0.509	18%	0.18	S	C	.	.	H	α-helix	trans	-66.4	-40	-176.1	-177.4	172.5	-20	0	0	112.1	P835 Y836 G922 V928	P835-Q924 PolarHBondContact O-NE2 3.46Å; Y836-Q924 HydrophobicContact CD1-CG 4.34Å; Y836-Q924 HydrophobicContact CE1-CG 3.77Å; G922-Q924 VanDerWaalsContact C-N 3.34Å; G922-Q924 PolarHBondContact O-N 3.06Å; Q924-V928 PolarHBondContact O-N 2.79Å
925	G	93.8	Very high	95	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-68.3	-42.3	175.5	0	0	0	0	0	112.4	L921 G922 Y923 A927 V928 V929	L921-G925 WeakPolarHBondContact O-CA 3.43Å; L921-G925 PolarHBondContact O-N 3.36Å; L921-G925 VanDerWaalsContact O-N 3.12Å; G922-G925 PolarHBondContact O-N 2.96Å; Y923-G925 PolarHBondContact O-N 3.02Å; G925-A927 VanDerWaalsContact C-N 3.35Å; G925-A927 PolarHBondContact O-N 3.5Å; G925-V928 WeakPolarHBondContact O-CG1 3.37Å; G925-V928 PolarHBondContact O-N 3.03Å; G925-V929 VanDerWaalsContact O-CG2 3.3Å; G925-V929 WeakPolarHBondContact O-CG2 3.4Å; G925-V929 PolarHBondContact O-N 3.36Å; G925-V929 VanDerWaalsContact O-N 3.08Å
926	I	95.2	Very high	95	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-63	-44	177	-65.8	165.9	0	0	0	110.5	C918 L921 G922 Y923 V928 V929 M930 I1010 L1014	C918-I926 HydrophobicContact CB-CD1 4.47Å; L921-I926 HydrophobicContact CB-CG1 4.18Å; G922-I926 VanDerWaalsContact O-CG1 3.25Å; G922-I926 WeakPolarHBondContact O-CG1 3.38Å; G922-I926 PolarHBondContact O-N 3.48Å; Y923-I926 PolarHBondContact O-N 3.35Å; I926-V928 PolarHBondContact O-N 2.69Å; I926-V929 PolarHBondContact O-N 3.04Å; I926-M930 HydrophobicContact CG2-CE 4.07Å; I926-M930 HydrophobicContact CG2-CG 4.37Å; I926-M930 HydrophobicContact CG2-SD 4.3Å; I926-M930 WeakPolarHBondContact O-CG 3.34Å; I926-M930 PolarHBondContact O-N 3.2Å; I926-I1010 HydrophobicContact CD1-CG1 4.37Å; I926-I1010 HydrophobicContact CG1-CG1 4.21Å; I926-I1010 HydrophobicContact CG2-CG1 4.33Å; I926-I1010 HydrophobicContact CG2-CG2 4.29Å; I926-L1014 HydrophobicContact CD1-CD1 4.16Å; I926-L1014 HydrophobicContact CD1-CD2 4.14Å
927	A	93.7	Very high	94.9	Very high	54 Å²	54	36.3 Å²	36.3	45%	0.446	18%	0.183	S	C	.	.	H	α-helix	trans	-60.1	-47.1	179.5	0	0	0	0	0	112.3	Y923 G925 M930 E931	Y923-A927 VanDerWaalsContact O-CB 3.32Å; Y923-A927 WeakPolarHBondContact O-CB 3.19Å; Y923-A927 PolarHBondContact O-N 3.45Å; G925-A927 VanDerWaalsContact C-N 3.35Å; G925-A927 PolarHBondContact O-N 3.5Å; A927-M930 PolarHBondContact O-N 3.18Å; A927-E931 WeakPolarHBondContact O-CG 3.24Å; A927-E931 PolarHBondContact O-N 3.47Å
928	V	94.9	Very high	94.9	Very high	29 Å²	29	40.6 Å²	40.6	18%	0.176	20%	0.202	C	C	.	.	H	α-helix	trans	-65.9	-39.6	178.3	68.1	0	0	0	0	111.7	Y836 T840 Q924 G925 I926 M930 E931 E932	Y836-V928 HydrophobicContact CD1-CB 4.34Å; Y836-V928 HydrophobicContact CD1-CG1 3.68Å; Y836-V928 HydrophobicContact CE1-CB 3.59Å; Y836-V928 HydrophobicContact CE1-CG1 3.41Å; Y836-V928 VanDerWaalsContact CE1-CG1 3.41Å; Y836-V928 HydrophobicContact CE1-CG2 4.06Å; Y836-V928 HydrophobicContact CE2-CG2 4.1Å; Y836-V928 HydrophobicContact CG-CG1 4.42Å; T840-V928 HydrophobicContact CG2-CG1 4.15Å; Q924-V928 PolarHBondContact O-N 2.79Å; G925-V928 WeakPolarHBondContact O-CG1 3.37Å; G925-V928 PolarHBondContact O-N 3.03Å; I926-V928 PolarHBondContact O-N 2.69Å; V928-M930 PolarHBondContact O-N 3.32Å; V928-E931 PolarHBondContact O-N 3.41Å; V928-E932 HydrophobicContact CG2-CG 4.33Å; V928-E932 WeakPolarHBondContact O-CG 3.43Å; V928-E932 PolarHBondContact O-N 2.91Å
929	V	96.1	Very high	94.9	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-44.7	177	170.6	0	0	0	0	110.7	F844 L847 L921 G925 I926 E931 E932 L933 F1006	F844-V929 HydrophobicContact CB-CG2 4.36Å; L847-V929 HydrophobicContact CD1-CG1 3.61Å; L921-V929 HydrophobicContact CD2-CG2 3.86Å; G925-V929 VanDerWaalsContact O-CG2 3.3Å; G925-V929 WeakPolarHBondContact O-CG2 3.4Å; G925-V929 PolarHBondContact O-N 3.36Å; G925-V929 VanDerWaalsContact O-N 3.08Å; I926-V929 PolarHBondContact O-N 3.04Å; V929-E931 PolarHBondContact O-N 3.42Å; V929-E932 PolarHBondContact O-N 2.91Å; V929-L933 HydrophobicContact CG1-CD1 4.01Å; V929-L933 HydrophobicContact CG1-CG 4.28Å; V929-L933 WeakPolarHBondContact O-CB 3.49Å; V929-L933 VanDerWaalsContact O-CG 3.25Å; V929-L933 WeakPolarHBondContact O-CG 3.47Å; V929-L933 PolarHBondContact O-N 2.7Å; V929-F1006 HydrophobicContact CG1-CD1 4.44Å; V929-F1006 HydrophobicContact CG1-CE1 3.71Å; V929-F1006 HydrophobicContact CG1-CZ 4.34Å
930	M	94.6	Very high	95	Very high	9 Å²	9	40.6 Å²	40.6	4%	0.044	22%	0.216	C	C	.	.	H	α-helix	trans	-61.4	-42.5	176.2	-74.9	-171.2	170.1	0	0	112.4	I926 A927 V928 L933 L934 C1007 I1010 E1011 M1092 I1096	I926-M930 HydrophobicContact CG2-CE 4.07Å; I926-M930 HydrophobicContact CG2-CG 4.37Å; I926-M930 HydrophobicContact CG2-SD 4.3Å; I926-M930 WeakPolarHBondContact O-CG 3.34Å; I926-M930 PolarHBondContact O-N 3.2Å; A927-M930 PolarHBondContact O-N 3.18Å; V928-M930 PolarHBondContact O-N 3.32Å; M930-L933 PolarHBondContact O-N 3.13Å; M930-L934 WeakPolarHBondContact O-CG 3.29Å; M930-L934 PolarHBondContact O-N 3Å; M930-C1007 HydrophobicContact CE-CB 4.28Å; M930-C1007 WeakPolarHBondContact CE-O 3.43Å; M930-I1010 HydrophobicContact CE-CG2 3.48Å; M930-I1010 VanDerWaalsContact CE-CG2 3.48Å; M930-E1011 HydrophobicContact CE-CB 4.41Å; M930-M1092 HydrophobicContact CE-CE 3.82Å; M930-M1092 HydrophobicContact CE-SD 4.19Å; M930-M1092 HydrophobicContact SD-CB 4.48Å; M930-M1092 HydrophobicContact SD-CE 4.35Å; M930-M1092 HydrophobicContact SD-SD 3.93Å; M930-I1096 HydrophobicContact CB-CD1 4.43Å; M930-I1096 HydrophobicContact SD-CD1 4.39Å
931	E	94.5	Very high	95	Very high	75 Å²	75	39.1 Å²	39.1	35%	0.35	21%	0.208	S	C	.	.	H	α-helix	trans	-64	-43	176.8	-75	-67.8	171.1	0	0	112.5	A927 V928 V929 L934 K935 R1099	A927-E931 WeakPolarHBondContact O-CG 3.24Å; A927-E931 PolarHBondContact O-N 3.47Å; V928-E931 PolarHBondContact O-N 3.41Å; V929-E931 PolarHBondContact O-N 3.42Å; E931-L934 WeakPolarHBondContact O-CB 3.46Å; E931-L934 PolarHBondContact O-N 2.95Å; E931-K935 WeakPolarHBondContact O-CG 3.41Å; E931-K935 PolarHBondContact O-N 3.39Å; E931-K935 VanDerWaalsContact O-N 3.1Å; E931-R1099 IonicContact OE1-CZ 3.36Å; E931-R1099 IonicContact OE1-NH1 3.69Å; E931-R1099 PolarHBondContact OE1-NH1 2.99Å; E931-R1099 IonicContact OE1-NH2 3.65Å; E931-R1099 IonicContact OE2-CZ 2.77Å; E931-R1099 IonicContact OE2-NH1 2.97Å; E931-R1099 PolarHBondContact OE2-NH1 3.11Å; E931-R1099 IonicContact OE2-NH2 3.7Å; E931-R1099 PolarHBondContact OE2-NH2 3.18Å
932	E	95.3	Very high	95	Very high	56 Å²	56	42.4 Å²	42.4	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-68	-38.8	176.6	-67	-55	136.8	0	0	111.8	F844 V928 V929 L934 K935 V936	F844-E932 HydrophobicContact CD2-CB 3.89Å; F844-E932 HydrophobicContact CE1-CB 4.33Å; F844-E932 HydrophobicContact CE1-CG 4.45Å; F844-E932 HydrophobicContact CE2-CB 3.26Å; F844-E932 HydrophobicContact CE2-CG 4.15Å; F844-E932 HydrophobicContact CZ-CB 3.53Å; F844-E932 HydrophobicContact CZ-CG 4.09Å; V928-E932 HydrophobicContact CG2-CG 4.33Å; V928-E932 WeakPolarHBondContact O-CG 3.43Å; V928-E932 PolarHBondContact O-N 2.91Å; V929-E932 PolarHBondContact O-N 2.91Å; E932-L934 VanDerWaalsContact C-N 3.31Å; E932-L934 PolarHBondContact O-N 3.5Å; E932-K935 WeakPolarHBondContact O-CA 3.5Å; E932-K935 WeakPolarHBondContact O-CB 3.27Å; E932-K935 PolarHBondContact O-N 3.03Å; E932-K935 IonicContact OE1-NZ 2.68Å; E932-K935 PolarHBondContact OE1-NZ 2.88Å; E932-K935 WeakPolarHBondContact OE2-CD 3.44Å; E932-K935 IonicContact OE2-NZ 3.44Å; E932-V936 WeakPolarHBondContact O-CG2 3.46Å; E932-V936 PolarHBondContact O-N 3.23Å
933	L	95.6	Very high	95.1	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-38.6	172.8	-72.4	179.2	0	0	0	112	L852 V929 M930 K935 V936 V937 A1003 F1006	L852-L933 HydrophobicContact CD1-CD2 3.84Å; L852-L933 HydrophobicContact CD2-CD2 4.45Å; V929-L933 HydrophobicContact CG1-CD1 4.01Å; V929-L933 HydrophobicContact CG1-CG 4.28Å; V929-L933 WeakPolarHBondContact O-CB 3.49Å; V929-L933 VanDerWaalsContact O-CG 3.25Å; V929-L933 WeakPolarHBondContact O-CG 3.47Å; V929-L933 PolarHBondContact O-N 2.7Å; M930-L933 PolarHBondContact O-N 3.13Å; L933-K935 VanDerWaalsContact C-N 3.3Å; L933-K935 PolarHBondContact O-N 2.88Å; L933-V936 PolarHBondContact O-N 2.89Å; L933-V937 WeakPolarHBondContact O-CG2 3.45Å; L933-V937 PolarHBondContact O-N 3.47Å; L933-A1003 HydrophobicContact CD2-CB 4.21Å; L933-F1006 HydrophobicContact CD1-CB 4.27Å; L933-F1006 HydrophobicContact CD1-CD1 3.49Å; L933-F1006 VanDerWaalsContact CD1-CD1 3.49Å; L933-F1006 HydrophobicContact CD1-CE1 4.18Å; L933-F1006 HydrophobicContact CD1-CG 4.11Å
934	L	95	Very high	95.1	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-38	172.1	-80.1	175.4	0	0	0	112.2	M930 E931 E932 V937 K938 I1096 I1100 F1103	M930-L934 WeakPolarHBondContact O-CG 3.29Å; M930-L934 PolarHBondContact O-N 3Å; E931-L934 WeakPolarHBondContact O-CB 3.46Å; E931-L934 PolarHBondContact O-N 2.95Å; E932-L934 VanDerWaalsContact C-N 3.31Å; E932-L934 PolarHBondContact O-N 3.5Å; L934-V937 PolarHBondContact O-N 2.94Å; L934-K938 VanDerWaalsContact O-CB 3.31Å; L934-K938 WeakPolarHBondContact O-CB 3.25Å; L934-K938 PolarHBondContact O-N 3.44Å; L934-I1096 HydrophobicContact CD1-CD1 3.8Å; L934-I1096 HydrophobicContact CD2-CD1 4.4Å; L934-I1096 HydrophobicContact CD2-CG2 3.99Å; L934-I1096 HydrophobicContact CG-CD1 4.14Å; L934-I1100 HydrophobicContact CD2-CD1 4.12Å; L934-I1100 HydrophobicContact CD2-CG1 3.66Å; L934-F1103 HydrophobicContact CD2-CE2 4.31Å
935	K	95.8	Very high	95.3	Very high	114 Å²	114	36.1 Å²	36.1	50%	0.496	20%	0.203	S	C	.	.	H	α-helix	trans	-67	-39.8	174.7	-67.3	171.6	-170.9	169.9	0	111.7	E931 E932 L933 K938 S939	E931-K935 WeakPolarHBondContact O-CG 3.41Å; E931-K935 PolarHBondContact O-N 3.39Å; E931-K935 VanDerWaalsContact O-N 3.1Å; E932-K935 WeakPolarHBondContact O-CA 3.5Å; E932-K935 WeakPolarHBondContact O-CB 3.27Å; E932-K935 PolarHBondContact O-N 3.03Å; E932-K935 IonicContact OE1-NZ 2.68Å; E932-K935 PolarHBondContact OE1-NZ 2.88Å; E932-K935 WeakPolarHBondContact OE2-CD 3.44Å; E932-K935 IonicContact OE2-NZ 3.44Å; L933-K935 VanDerWaalsContact C-N 3.3Å; L933-K935 PolarHBondContact O-N 2.88Å; K935-K938 PolarHBondContact O-N 3.41Å; K935-S939 WeakPolarHBondContact O-CB 3.26Å; K935-S939 PolarHBondContact O-N 3.33Å
936	V	95.4	Very high	95.4	Very high	24 Å²	24	37 Å²	37	15%	0.145	21%	0.207	C	C	.	.	H	α-helix	trans	-60.6	-50.5	173.6	173.6	0	0	0	0	110.3	L852 E932 L933 K938 S939 L940	L852-V936 HydrophobicContact CD1-CG1 4.18Å; E932-V936 WeakPolarHBondContact O-CG2 3.46Å; E932-V936 PolarHBondContact O-N 3.23Å; L933-V936 PolarHBondContact O-N 2.89Å; V936-K938 VanDerWaalsContact C-N 3.33Å; V936-K938 PolarHBondContact O-N 3.46Å; V936-S939 WeakPolarHBondContact O-CB 3.19Å; V936-S939 PolarHBondContact O-N 3.14Å; V936-S939 VanDerWaalsContact O-N 3.15Å; V936-L940 HydrophobicContact CG1-CD1 4.07Å; V936-L940 WeakPolarHBondContact O-CG 3.32Å; V936-L940 PolarHBondContact O-N 3.15Å
937	V	96.9	Very high	95.4	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.018	23%	0.233	C	C	.	.	H	α-helix	trans	-59.9	-43.3	177.8	171.4	0	0	0	0	111.3	L933 L934 S939 L940 L941 V1000 A1003 I1100	L933-V937 WeakPolarHBondContact O-CG2 3.45Å; L933-V937 PolarHBondContact O-N 3.47Å; L934-V937 PolarHBondContact O-N 2.94Å; V937-S939 PolarHBondContact O-N 3.39Å; V937-L940 PolarHBondContact O-N 3.35Å; 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 3.49Å; V937-L941 WeakPolarHBondContact O-CG 3.42Å; V937-L941 PolarHBondContact O-N 2.93Å; V937-V1000 HydrophobicContact CG1-CG1 4.06Å; V937-V1000 HydrophobicContact CG2-CG1 4.38Å; V937-A1003 HydrophobicContact CG2-CB 3.77Å; V937-I1100 HydrophobicContact CG1-CD1 4.13Å; V937-I1100 HydrophobicContact CG1-CG1 4.08Å; V937-I1100 HydrophobicContact CG1-CG2 4.2Å
938	K	96.9	Very high	95.4	Very high	91 Å²	91	41.8 Å²	41.8	40%	0.396	22%	0.219	S	C	.	.	H	α-helix	trans	-58.9	-47.4	174.8	-175.7	-179.9	179.1	-179.7	0	111.6	L934 K935 V936 L940 L941 Q942 F1103	L934-K938 VanDerWaalsContact O-CB 3.31Å; L934-K938 WeakPolarHBondContact O-CB 3.25Å; L934-K938 PolarHBondContact O-N 3.44Å; K935-K938 PolarHBondContact O-N 3.41Å; V936-K938 VanDerWaalsContact C-N 3.33Å; V936-K938 PolarHBondContact O-N 3.46Å; K938-L940 PolarHBondContact O-N 3.44Å; K938-L941 PolarHBondContact O-N 3.11Å; K938-Q942 HydrophobicContact CG-CG 4.41Å; K938-Q942 VanDerWaalsContact O-CB 3.31Å; K938-Q942 WeakPolarHBondContact O-CB 3.32Å; K938-Q942 WeakPolarHBondContact O-CG 3.45Å; K938-Q942 PolarHBondContact O-N 3.45Å; K938-F1103 HydrophobicContact CB-CD1 4.3Å; K938-F1103 HydrophobicContact CB-CD2 3.71Å; K938-F1103 HydrophobicContact CB-CE1 4.28Å; K938-F1103 HydrophobicContact CB-CE2 3.67Å; K938-F1103 HydrophobicContact CB-CG 4.05Å; K938-F1103 HydrophobicContact CB-CZ 3.97Å; K938-F1103 HydrophobicContact CD-CD1 4.06Å; K938-F1103 HydrophobicContact CD-CE1 3.9Å; K938-F1103 HydrophobicContact CD-CZ 4.26Å; K938-F1103 HydrophobicContact CG-CD1 3.9Å; K938-F1103 HydrophobicContact CG-CD2 4.14Å; K938-F1103 HydrophobicContact CG-CE1 4.11Å; K938-F1103 HydrophobicContact CG-CE2 4.33Å; K938-F1103 HydrophobicContact CG-CG 3.94Å; K938-F1103 HydrophobicContact CG-CZ 4.32Å
939	S	96.2	Very high	95.4	Very high	84 Å²	84	40.6 Å²	40.6	59%	0.587	21%	0.211	S	C	*	.	H	α-helix	trans	-59.2	-46.5	179.4	-173.7	0	0	0	0	111.5	K935 V936 V937 G943	K935-S939 WeakPolarHBondContact O-CB 3.26Å; K935-S939 PolarHBondContact O-N 3.33Å; V936-S939 WeakPolarHBondContact O-CB 3.19Å; V936-S939 PolarHBondContact O-N 3.14Å; V936-S939 VanDerWaalsContact O-N 3.15Å; V937-S939 PolarHBondContact O-N 3.39Å; S939-G943 VanDerWaalsContact O-CA 3.31Å; S939-G943 WeakPolarHBondContact O-CA 3.32Å; S939-G943 PolarHBondContact O-N 3.49Å
940	L	95.8	Very high	95.3	Very high	22 Å²	22	44.6 Å²	44.6	12%	0.115	23%	0.229	C	C	.	.	H	α-helix	trans	-67.2	-48.1	178.5	-68.8	174.4	0	0	0	112	V936 V937 K938 Q942 G943 T944 I945 E999 V1000	V936-L940 HydrophobicContact CG1-CD1 4.07Å; V936-L940 WeakPolarHBondContact O-CG 3.32Å; V936-L940 PolarHBondContact O-N 3.15Å; V937-L940 PolarHBondContact O-N 3.35Å; K938-L940 PolarHBondContact O-N 3.44Å; L940-Q942 PolarHBondContact O-N 3Å; L940-G943 PolarHBondContact O-N 3.43Å; L940-T944 PolarHBondContact O-N 3.31Å; L940-I945 HydrophobicContact CB-CD1 3.93Å; L940-I945 HydrophobicContact CB-CG1 4.44Å; L940-I945 VanDerWaalsContact O-CB 3.26Å; L940-I945 WeakPolarHBondContact O-CB 3.43Å; L940-I945 WeakPolarHBondContact O-CG1 3.33Å; L940-I945 PolarHBondContact O-N 2.89Å; L940-E999 HydrophobicContact CD1-CB 3.95Å; L940-V1000 HydrophobicContact CB-CG2 3.93Å; L940-V1000 HydrophobicContact CD1-CG2 3.83Å
941	L	95.4	Very high	95.3	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.3	-33.7	-177.6	-72.8	178.4	0	0	0	113.3	V937 K938 I945 L946 I1100 F1103 L1104 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 3.49Å; V937-L941 WeakPolarHBondContact O-CG 3.42Å; V937-L941 PolarHBondContact O-N 2.93Å; K938-L941 PolarHBondContact O-N 3.11Å; L941-I945 HydrophobicContact CD2-CD1 4.02Å; L941-I945 HydrophobicContact CD2-CG2 4.41Å; L941-L946 VanDerWaalsContact O-CB 3.29Å; L941-L946 WeakPolarHBondContact O-CB 3.33Å; L941-L946 PolarHBondContact O-N 3.17Å; L941-I1100 HydrophobicContact CD1-CG2 3.79Å; L941-F1103 HydrophobicContact CD1-CB 4.5Å; L941-L1104 HydrophobicContact CD1-CD2 4.19Å; L941-L1104 HydrophobicContact CD2-CD2 4.37Å; L941-I1164 HydrophobicContact CD2-CD1 3.8Å; L941-I1164 HydrophobicContact CD2-CG1 4.28Å
942	Q	95.3	Very high	95.3	Very high	85 Å²	85	43.4 Å²	43.4	40%	0.397	23%	0.227	S	C	.	.	H	α-helix	trans	-95	-15.3	179.8	-62.1	-173.8	-28.3	0	0	113.3	K938 L940 F1103	K938-Q942 HydrophobicContact CG-CG 4.41Å; K938-Q942 VanDerWaalsContact O-CB 3.31Å; K938-Q942 WeakPolarHBondContact O-CB 3.32Å; K938-Q942 WeakPolarHBondContact O-CG 3.45Å; K938-Q942 PolarHBondContact O-N 3.45Å; L940-Q942 PolarHBondContact O-N 3Å; Q942-F1103 HydrophobicContact CG-CB 4.43Å; Q942-F1103 WeakPolarHBondContact CG-O 3.34Å; Q942-F1103 PolarHBondContact NE2-O 2.86Å; Q942-F1103 VanDerWaalsContact NE2-O 3.13Å
943	G	95.2	Very high	95.1	Very high	35 Å²	35	41.2 Å²	41.2	36%	0.361	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-103.4	179.2	0	0	0	0	0	112.1	S939 L940 L946 Q947	S939-G943 VanDerWaalsContact O-CA 3.31Å; S939-G943 WeakPolarHBondContact O-CA 3.32Å; S939-G943 PolarHBondContact O-N 3.49Å; L940-G943 PolarHBondContact O-N 3.43Å; G943-L946 PolarHBondContact O-N 3.12Å; G943-Q947 PolarHBondContact O-N 2.71Å; G943-Q947 VanDerWaalsContact O-N 3.08Å
944	T	94.1	Very high	94.9	Very high	54 Å²	54	47.3 Å²	47.3	33%	0.331	25%	0.245	S	C	.	.	H	α-helix	trans	-63.7	-46.5	-171.4	50.1	0	0	0	0	112.1	L940 L946 Q947 Y948 N996	L940-T944 PolarHBondContact O-N 3.31Å; T944-L946 PolarHBondContact O-N 3.38Å; T944-Q947 PolarHBondContact O-N 3.21Å; T944-Y948 VanDerWaalsContact O-CD2 3.29Å; T944-Y948 WeakPolarHBondContact O-CD2 3.23Å; T944-Y948 PolarHBondContact O-N 3.47Å; T944-N996 PolarHBondContact OG1-ND2 3.32Å
945	I	96.3	Very high	94.9	Very high	9 Å²	9	49.5 Å²	49.5	5%	0.046	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-45.7	-178.2	-59.3	174.2	0	0	0	110	L940 L941 Q947 Y948 V949 N996 L997 V1000 W1109	L940-I945 HydrophobicContact CB-CD1 3.93Å; L940-I945 HydrophobicContact CB-CG1 4.44Å; L940-I945 VanDerWaalsContact O-CB 3.26Å; L940-I945 WeakPolarHBondContact O-CB 3.43Å; L940-I945 WeakPolarHBondContact O-CG1 3.33Å; L940-I945 PolarHBondContact O-N 2.89Å; L941-I945 HydrophobicContact CD2-CD1 4.02Å; L941-I945 HydrophobicContact CD2-CG2 4.41Å; I945-Q947 VanDerWaalsContact C-N 3.31Å; I945-Q947 PolarHBondContact O-N 3.36Å; I945-Y948 PolarHBondContact O-N 2.8Å; I945-V949 HydrophobicContact CG2-CG2 4.1Å; I945-V949 WeakPolarHBondContact O-CB 3.41Å; I945-V949 VanDerWaalsContact O-CG2 3.26Å; I945-V949 WeakPolarHBondContact O-CG2 3.29Å; I945-V949 PolarHBondContact O-N 3.42Å; I945-N996 HydrophobicContact CD1-CB 4Å; I945-N996 HydrophobicContact CG1-CB 3.68Å; I945-L997 HydrophobicContact CD1-CD2 4.21Å; I945-L997 HydrophobicContact CG2-CD2 4.28Å; I945-V1000 HydrophobicContact CD1-CG2 3.68Å; I945-W1109 HydrophobicContact CG2-CH2 4.08Å
946	L	95.5	Very high	94.7	Very high	22 Å²	22	44.2 Å²	44.2	12%	0.115	24%	0.236	C	C	.	.	H	α-helix	trans	-57.7	-43.9	177	-177.6	59.1	0	0	0	112.3	L941 G943 T944 V949 K950 D1106 I1108 W1109	L941-L946 VanDerWaalsContact O-CB 3.29Å; L941-L946 WeakPolarHBondContact O-CB 3.33Å; L941-L946 PolarHBondContact O-N 3.17Å; G943-L946 PolarHBondContact O-N 3.12Å; T944-L946 PolarHBondContact O-N 3.38Å; L946-V949 PolarHBondContact O-N 3.29Å; L946-K950 HydrophobicContact CD1-CD 4.42Å; L946-K950 HydrophobicContact CD1-CG 4.44Å; L946-K950 HydrophobicContact CG-CD 4.32Å; L946-K950 WeakPolarHBondContact O-CG 3.49Å; L946-K950 PolarHBondContact O-N 2.92Å; L946-D1106 HydrophobicContact CD1-CB 3.95Å; L946-D1106 HydrophobicContact CD2-CB 4.29Å; L946-I1108 HydrophobicContact CD1-CG2 3.59Å; L946-W1109 HydrophobicContact CB-CZ2 4.41Å; L946-W1109 HydrophobicContact CD1-CZ2 3.85Å
947	Q	94.9	Very high	94.6	Very high	120 Å²	120	44.1 Å²	44.1	56%	0.561	24%	0.236	S	C	*	.	H	α-helix	trans	-60.2	-46.6	178.6	-178.6	-178.6	-10.3	0	0	111.5	G943 T944 I945 K950 T951	G943-Q947 PolarHBondContact O-N 2.71Å; G943-Q947 VanDerWaalsContact O-N 3.08Å; T944-Q947 PolarHBondContact O-N 3.21Å; I945-Q947 VanDerWaalsContact C-N 3.31Å; I945-Q947 PolarHBondContact O-N 3.36Å; Q947-K950 PolarHBondContact O-N 2.87Å; Q947-T951 WeakPolarHBondContact O-CB 3.31Å; Q947-T951 PolarHBondContact O-N 3.41Å; Q947-T951 PolarHBondContact O-OG1 2.86Å
948	Y	94.3	Very high	94.2	Very high	39 Å²	39	49.9 Å²	49.9	15%	0.153	26%	0.261	C	S	.	.	H	α-helix	trans	-72.4	-32.7	178.4	-80.6	-99.6	0	0	0	112.3	T944 I945 T951 L952 Y986 E988 V992 C993	T944-Y948 VanDerWaalsContact O-CD2 3.29Å; T944-Y948 WeakPolarHBondContact O-CD2 3.23Å; T944-Y948 PolarHBondContact O-N 3.47Å; I945-Y948 PolarHBondContact O-N 2.8Å; Y948-T951 PolarHBondContact O-N 3.35Å; Y948-L952 VanDerWaalsContact O-CB 3.27Å; Y948-L952 WeakPolarHBondContact O-CB 3.36Å; Y948-L952 VanDerWaalsContact O-CG 3.26Å; Y948-L952 WeakPolarHBondContact O-CG 3.41Å; Y948-L952 PolarHBondContact O-N 3.16Å; Y948-Y986 AromaticContact CD1-CE1 3.96Å; Y948-Y986 HydrophobicContact CD1-CE1 3.96Å; Y948-Y986 AromaticContact CE1-CE1 3.93Å; Y948-Y986 HydrophobicContact CE1-CE1 3.93Å; Y948-Y986 WeakPolarHBondContact CE1-OH 3.35Å; Y948-E988 HydrophobicContact CE1-CB 4.08Å; Y948-E988 WeakPolarHBondContact CE1-OE2 3.41Å; Y948-E988 PolarHBondContact OH-OE2 3Å; Y948-V992 HydrophobicContact CD2-CG1 4.16Å; Y948-V992 HydrophobicContact CE1-CB 4.28Å; Y948-V992 HydrophobicContact CE1-CG1 4.18Å; Y948-V992 HydrophobicContact CE2-CG1 3.58Å; Y948-C993 WeakPolarHBondContact CD1-SG 3.27Å
949	V	95.2	Very high	93.9	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.024	27%	0.268	C	S	.	.	H	α-helix	trans	-61.9	-47.5	171.8	170.4	0	0	0	0	110.7	I945 L946 T951 L952 M953 I1108 W1109 F1127 L1130	I945-V949 HydrophobicContact CG2-CG2 4.1Å; I945-V949 WeakPolarHBondContact O-CB 3.41Å; I945-V949 VanDerWaalsContact O-CG2 3.26Å; I945-V949 WeakPolarHBondContact O-CG2 3.29Å; I945-V949 PolarHBondContact O-N 3.42Å; L946-V949 PolarHBondContact O-N 3.29Å; V949-T951 VanDerWaalsContact C-N 3.32Å; V949-T951 PolarHBondContact O-N 2.81Å; V949-L952 PolarHBondContact O-N 2.93Å; V949-M953 WeakPolarHBondContact O-CB 3.43Å; V949-M953 PolarHBondContact O-N 3.35Å; V949-I1108 HydrophobicContact CG1-CG1 4.4Å; V949-I1108 HydrophobicContact CG1-CG2 4.35Å; V949-W1109 HydrophobicContact CB-CH2 4.32Å; V949-W1109 HydrophobicContact CB-CZ3 4.39Å; V949-W1109 HydrophobicContact CG1-CE3 4.37Å; V949-W1109 HydrophobicContact CG1-CH2 4.5Å; V949-W1109 HydrophobicContact CG1-CZ3 4.15Å; V949-W1109 HydrophobicContact CG2-CH2 3.71Å; V949-W1109 HydrophobicContact CG2-CZ3 3.76Å; V949-F1127 HydrophobicContact CG1-CD2 4.22Å; V949-F1127 HydrophobicContact CG2-CD2 4.17Å; V949-F1127 HydrophobicContact CG2-CE2 3.95Å; V949-L1130 HydrophobicContact CB-CD2 4.34Å; V949-L1130 HydrophobicContact CG1-CD2 4.08Å; V949-L1130 HydrophobicContact CG2-CD2 4.25Å
950	K	93.8	Very high	93.7	Very high	85 Å²	85	46.7 Å²	46.7	37%	0.37	24%	0.24	S	C	.	.	H	α-helix	trans	-59.2	-44	175.6	-74.8	176.6	176.6	176.3	0	111.7	L946 Q947 E954 D1106 I1108	L946-K950 HydrophobicContact CD1-CD 4.42Å; L946-K950 HydrophobicContact CD1-CG 4.44Å; L946-K950 HydrophobicContact CG-CD 4.32Å; L946-K950 WeakPolarHBondContact O-CG 3.49Å; L946-K950 PolarHBondContact O-N 2.92Å; Q947-K950 PolarHBondContact O-N 2.87Å; K950-E954 PolarHBondContact O-N 3.49Å; K950-D1106 WeakPolarHBondContact CE-OD1 3.46Å; K950-D1106 VanDerWaalsContact CE-OD2 3.26Å; K950-D1106 WeakPolarHBondContact CE-OD2 3.3Å; K950-D1106 IonicContact NZ-OD1 2.81Å; K950-D1106 IonicContact NZ-OD2 3.25Å; K950-D1106 PolarHBondContact NZ-OD2 2.91Å; K950-I1108 HydrophobicContact CG-CB 4.15Å; K950-I1108 HydrophobicContact CG-CG1 3.93Å; K950-I1108 HydrophobicContact CG-CG2 3.98Å
951	T	94.8	Very high	93.5	Very high	58 Å²	58	52.7 Å²	52.7	36%	0.356	26%	0.261	S	S	.	.	H	α-helix	trans	-64	-52.3	179.5	-55.2	0	0	0	0	111.2	Q947 Y948 V949 M953 E954 V955	Q947-T951 WeakPolarHBondContact O-CB 3.31Å; Q947-T951 PolarHBondContact O-N 3.41Å; Q947-T951 PolarHBondContact O-OG1 2.86Å; Y948-T951 PolarHBondContact O-N 3.35Å; V949-T951 VanDerWaalsContact C-N 3.32Å; V949-T951 PolarHBondContact O-N 2.81Å; T951-M953 VanDerWaalsContact C-N 3.32Å; T951-M953 PolarHBondContact O-N 3.49Å; T951-E954 PolarHBondContact O-N 3.39Å; T951-V955 WeakPolarHBondContact O-CG2 3.38Å; T951-V955 PolarHBondContact O-N 3.12Å
952	L	93.5	Very high	93.4	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-70.2	-27.4	-177.5	-67.7	173.5	0	0	0	112.7	Y948 V949 E954 V955 M956 I983 Y986 L989 L1130 M1134	Y948-L952 VanDerWaalsContact O-CB 3.27Å; Y948-L952 WeakPolarHBondContact O-CB 3.36Å; Y948-L952 VanDerWaalsContact O-CG 3.26Å; Y948-L952 WeakPolarHBondContact O-CG 3.41Å; Y948-L952 PolarHBondContact O-N 3.16Å; V949-L952 PolarHBondContact O-N 2.93Å; L952-E954 VanDerWaalsContact C-N 3.3Å; L952-V955 CarbonylContact O-C 3.56Å; L952-V955 PolarHBondContact O-N 3.39Å; L952-M956 WeakPolarHBondContact O-CB 3.19Å; L952-M956 PolarHBondContact O-N 3.38Å; L952-I983 HydrophobicContact CB-CD1 4.34Å; L952-I983 HydrophobicContact CD2-CD1 4.02Å; L952-Y986 HydrophobicContact CD2-CD1 3.88Å; L952-Y986 HydrophobicContact CD2-CD2 3.87Å; L952-Y986 HydrophobicContact CD2-CE1 4.05Å; L952-Y986 HydrophobicContact CD2-CE2 4.04Å; L952-Y986 HydrophobicContact CD2-CG 3.79Å; L952-L989 HydrophobicContact CD1-CD1 3.92Å; L952-L1130 HydrophobicContact CB-CD1 3.69Å; L952-L1130 HydrophobicContact CB-CD2 4.07Å; L952-L1130 HydrophobicContact CD1-CD1 4.43Å; L952-M1134 HydrophobicContact CD1-CE 3.56Å
953	M	92.3	Very high	93.4	Very high	10 Å²	10	51 Å²	51	5%	0.049	26%	0.256	C	S	.	.	H	α-helix	trans	-68.6	-29.6	174.1	-162.4	65	70.3	0	0	112.3	V949 T951 M956 I1108 L1130	V949-M953 WeakPolarHBondContact O-CB 3.43Å; V949-M953 PolarHBondContact O-N 3.35Å; T951-M953 VanDerWaalsContact C-N 3.32Å; T951-M953 PolarHBondContact O-N 3.49Å; M953-M956 WeakPolarHBondContact O-CB 3.36Å; M953-I1108 HydrophobicContact CB-CD1 4.17Å; M953-I1108 HydrophobicContact CB-CG1 4.49Å; M953-I1108 HydrophobicContact CG-CD1 3.99Å; M953-L1130 HydrophobicContact CE-CB 3.76Å; M953-L1130 HydrophobicContact CE-CD2 4.25Å
954	E	91.3	Very high	93.2	Very high	130 Å²	130	57.1 Å²	57.1	61%	0.607	27%	0.268	S	S	*	.	H	α-helix	trans	-75.8	-32.5	170.7	-72.7	-57.3	147.6	0	0	112.8	K950 T951 L952 M956 K958	K950-E954 PolarHBondContact O-N 3.49Å; T951-E954 PolarHBondContact O-N 3.39Å; L952-E954 VanDerWaalsContact C-N 3.3Å; E954-M956 VanDerWaalsContact C-N 3.27Å; E954-K958 IonicContact OE1-NZ 3.25Å; E954-K958 IonicContact OE2-NZ 2.79Å; E954-K958 PolarHBondContact OE2-NZ 3.06Å
955	V	93.1	Very high	93	Very high	49 Å²	49	58.2 Å²	58.2	30%	0.297	27%	0.269	S	S	.	.	H	α-helix	trans	-71.1	-25.4	172.7	177.6	0	0	0	0	111.6	T951 L952 D982 I983	T951-V955 WeakPolarHBondContact O-CG2 3.38Å; T951-V955 PolarHBondContact O-N 3.12Å; L952-V955 CarbonylContact O-C 3.56Å; L952-V955 PolarHBondContact O-N 3.39Å; V955-D982 HydrophobicContact CG1-CB 3.48Å; V955-D982 VanDerWaalsContact CG1-CB 3.48Å; V955-I983 HydrophobicContact CB-CD1 4.2Å; V955-I983 HydrophobicContact CG1-CD1 3.86Å
956	M	93.4	Very high	92.6	Very high	4 Å²	4	64.9 Å²	64.9	2%	0.02	30%	0.3	C	S	.	.	S	Bend	trans	-63.6	139.3	-179.1	-159.3	65.8	-156.2	0	0	111.4	L952 M953 E954 K958 L980 I983 C1124 L1130 A1133 F1179	L952-M956 WeakPolarHBondContact O-CB 3.19Å; L952-M956 PolarHBondContact O-N 3.38Å; M953-M956 WeakPolarHBondContact O-CB 3.36Å; E954-M956 VanDerWaalsContact C-N 3.27Å; M956-K958 PolarHBondContact O-N 2.82Å; M956-L980 HydrophobicContact CE-CD2 3.31Å; M956-L980 HydrophobicContact SD-CD2 4.36Å; M956-I983 HydrophobicContact SD-CD1 4.22Å; M956-I983 HydrophobicContact SD-CG1 3.94Å; M956-C1124 HydrophobicContact CE-CB 4.41Å; M956-C1124 HydrophobicContact CG-CB 3.66Å; M956-L1130 HydrophobicContact SD-CD1 4.44Å; M956-A1133 HydrophobicContact CE-CB 3.61Å; M956-A1133 HydrophobicContact SD-CB 3.64Å; M956-F1179 HydrophobicContact CE-CE2 3.77Å; M956-F1179 HydrophobicContact CE-CZ 4.03Å
957	P	92.3	Very high	92.3	Very high	22 Å²	22	71.9 Å²	71.9	14%	0.143	33%	0.326	C	S	.	.			trans	-55.9	127.1	173.2	23.3	-36.8	0	0	0	110.5	I959 C960 Q979 L980 C1124	P957-I959 PolarHBondContact O-N 3.43Å; P957-I959 VanDerWaalsContact O-N 3.09Å; P957-C960 HydrophobicContact CG-CB 4.13Å; P957-Q979 WeakPolarHBondContact CD-O 3.26Å; P957-Q979 WeakPolarHBondContact CG-O 3.44Å; P957-L980 HydrophobicContact CG-CD2 4.19Å; P957-C1124 WeakPolarHBondContact O-CB 3.47Å
958	K	89.1	Confident	92.2	Very high	124 Å²	124	66.4 Å²	66.4	54%	0.539	30%	0.302	S	S	.	.	S	Bend	trans	-54.6	-36.1	-176.2	-63.4	-61.1	-179.4	-168.2	0	112.8	E954 M956 C1124	E954-K958 IonicContact OE1-NZ 3.25Å; E954-K958 IonicContact OE2-NZ 2.79Å; E954-K958 PolarHBondContact OE2-NZ 3.06Å; M956-K958 PolarHBondContact O-N 2.82Å; K958-C1124 PolarHBondContact O-N 3.2Å
959	I	90.3	Very high	92	Very high	106 Å²	106	64.5 Å²	64.5	54%	0.544	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-137.5	129.3	176.5	-55.9	177.2	0	0	0	108.4	P957 D1122	P957-I959 PolarHBondContact O-N 3.43Å; P957-I959 VanDerWaalsContact O-N 3.09Å; I959-D1122 CarbonylContact C-O 3.46Å; I959-D1122 WeakPolarHBondContact CA-O 3.32Å; I959-D1122 HydrophobicContact CG2-CB 3.52Å
960	C	92.9	Very high	91.9	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.007	30%	0.296	C	S	.	.			trans	-136.3	95	175.2	-171.8	0	0	0	0	110.5	P957 D1122 F1179	P957-C960 HydrophobicContact CG-CB 4.13Å; C960-D1122 PolarHBondContact N-O 2.95Å; C960-F1179 HydrophobicContact CB-CE1 3.98Å; C960-F1179 HydrophobicContact CB-CZ 4.08Å
961	R	91.4	Very high	91.8	Very high	148 Å²	148	62 Å²	62	56%	0.558	29%	0.292	S	S	*	.			trans	-72.6	146	179.4	-173.2	170.3	-173.1	-178.7	8.3	111.5	P963 F975 D1122	R961-P963 VanDerWaalsContact O-CD 3.28Å; R961-P963 WeakPolarHBondContact O-CD 3.49Å; R961-F975 VanDerWaalsContact O-CE1 3.28Å; R961-F975 WeakPolarHBondContact O-CE1 3.47Å; R961-D1122 WeakPolarHBondContact CA-OD1 3.25Å; R961-D1122 WeakPolarHBondContact CG-OD1 3.34Å
962	L	93.6	Very high	91.7	Very high	35 Å²	35	59.3 Å²	59.3	18%	0.183	28%	0.276	C	S	.	.			trans	-77.5	113.1	168.9	-61.7	-178.9	0	0	0	109.9	F976 L1177 F1179 H1182	L962-F976 HydrophobicContact CD2-CE1 4.28Å; L962-F976 HydrophobicContact CD2-CZ 3.87Å; L962-L1177 HydrophobicContact CD1-CD2 4.44Å; L962-F1179 HydrophobicContact CD2-CD1 3.98Å; L962-H1182 HydrophobicContact CD1-CB 4.23Å; L962-H1182 HydrophobicContact CD2-CB 3.91Å
963	P	93.5	Very high	91.7	Very high	16 Å²	16	59.2 Å²	59.2	10%	0.104	28%	0.275	C	S	.	.			trans	-65.8	151.4	-178.3	-16	29.5	0	0	0	111.4	R961 Y967 I972 F975 H1182	R961-P963 VanDerWaalsContact O-CD 3.28Å; R961-P963 WeakPolarHBondContact O-CD 3.49Å; P963-Y967 HydrophobicContact CB-CD2 4.04Å; P963-Y967 HydrophobicContact CB-CG 4.21Å; P963-I972 HydrophobicContact CB-CG1 4.03Å; P963-I972 HydrophobicContact CG-CG1 4.24Å; P963-F975 HydrophobicContact CG-CB 4.44Å; P963-F975 HydrophobicContact CG-CD1 3.53Å; P963-F975 HydrophobicContact CG-CE1 3.81Å; P963-F975 HydrophobicContact CG-CG 3.92Å; P963-F975 HydrophobicContact CG-CZ 4.42Å; P963-H1182 PolarHBondContact O-CE1 2.99Å; P963-H1182 PolarHBondContact O-NE2 3.19Å
964	R	91.4	Very high	91.8	Very high	162 Å²	162	64.1 Å²	64.1	61%	0.611	30%	0.298	S	S	*	.			trans	-71.3	165.3	-178.1	-56.2	-177.1	168.7	-176.4	-2.8	112.1	E966 Y967	R964-E966 WeakPolarHBondContact CB-OE2 3.26Å; R964-E966 PolarHBondContact O-N 3.48Å; R964-E966 VanDerWaalsContact O-N 3.15Å; R964-Y967 HydrophobicContact CB-CD2 4.3Å; R964-Y967 HydrophobicContact CB-CE2 4.48Å; R964-Y967 WeakPolarHBondContact O-CD2 3.27Å; R964-Y967 PolarHBondContact O-N 3.17Å
965	H	90.4	Very high	91.9	Very high	77 Å²	77	61 Å²	61	36%	0.356	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-61.6	-25.7	-176	-69.5	71	0	0	0	112.6	Y967 G968	H965-Y967 PolarHBondContact O-N 2.83Å; H965-G968 PolarHBondContact O-N 3.07Å; H965-G968 VanDerWaalsContact O-N 3.14Å
966	E	87.8	Confident	92	Very high	149 Å²	149	58.7 Å²	58.7	70%	0.696	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-67.1	-21.6	-178.5	-60	83.3	175.1	0	0	113.5	R964 G968	R964-E966 WeakPolarHBondContact CB-OE2 3.26Å; R964-E966 PolarHBondContact O-N 3.48Å; R964-E966 VanDerWaalsContact O-N 3.15Å; E966-G968 PolarHBondContact O-N 3.03Å
967	Y	89	Confident	91.9	Very high	169 Å²	169	59.3 Å²	59.3	66%	0.663	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-70.3	-16.6	175.2	-72.9	-93	0	0	0	112.7	P963 R964 H965	P963-Y967 HydrophobicContact CB-CD2 4.04Å; P963-Y967 HydrophobicContact CB-CG 4.21Å; R964-Y967 HydrophobicContact CB-CD2 4.3Å; R964-Y967 HydrophobicContact CB-CE2 4.48Å; R964-Y967 WeakPolarHBondContact O-CD2 3.27Å; R964-Y967 PolarHBondContact O-N 3.17Å; H965-Y967 PolarHBondContact O-N 2.83Å
968	G	92	Very high	91.9	Very high	5 Å²	5	64.9 Å²	64.9	5%	0.052	30%	0.295	C	S	.	.	H	α-helix	trans	72	151.2	-176.8	0	0	0	0	0	113.5	H965 E966 P970 G971 I972 D1190	H965-G968 PolarHBondContact O-N 3.07Å; H965-G968 VanDerWaalsContact O-N 3.14Å; E966-G968 PolarHBondContact O-N 3.03Å; G968-P970 VanDerWaalsContact C-CD 3.44Å; G968-G971 PolarHBondContact O-N 3.2Å; G968-I972 VanDerWaalsContact O-CG1 3.31Å; G968-I972 WeakPolarHBondContact O-CG1 3.43Å; G968-I972 PolarHBondContact O-N 2.9Å; G968-D1190 WeakPolarHBondContact CA-OD2 3.32Å
969	S	91.8	Very high	92	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-33.7	-178.3	55.3	0	0	0	0	115.1	I972 L973 L1183 D1190 L1201	S969-I972 PolarHBondContact O-N 3.47Å; S969-L973 PolarHBondContact O-N 3.04Å; S969-L1183 WeakPolarHBondContact O-CD1 3.39Å; S969-D1190 WeakPolarHBondContact CB-OD2 2.97Å; S969-D1190 PolarHBondContact N-OD2 2.97Å; S969-D1190 VanDerWaalsContact OG-CG 3.25Å; S969-D1190 PolarHBondContact OG-OD1 3.33Å; S969-D1190 PolarHBondContact OG-OD2 2.87Å; S969-L1201 WeakPolarHBondContact OG-CD2 3.31Å
970	P	92.8	Very high	92.2	Very high	8 Å²	8	56.9 Å²	56.9	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-65.7	-43.5	173.6	-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 3.34Å; P970-I972 PolarHBondContact O-N 3.27Å; P970-L973 PolarHBondContact O-N 3.16Å; P970-E974 PolarHBondContact O-N 2.81Å; P970-K1192 HydrophobicContact CG-CB 4.03Å; P970-K1192 HydrophobicContact CG-CD 3.82Å; P970-E1194 HydrophobicContact CB-CB 4.3Å; P970-E1194 HydrophobicContact CB-CG 4.47Å; P970-E1194 WeakPolarHBondContact CB-OE2 3.28Å; P970-E1194 HydrophobicContact CG-CB 4.26Å; P970-E1194 VanDerWaalsContact CG-CD 3.44Å; P970-E1194 HydrophobicContact CG-CG 4.07Å; P970-E1194 WeakPolarHBondContact CG-OE1 3.36Å; P970-I1196 HydrophobicContact CB-CD1 3.96Å; P970-I1196 HydrophobicContact CB-CG1 4.09Å; P970-L1201 HydrophobicContact CG-CD2 4Å
971	G	90.8	Very high	92.1	Very high	29 Å²	29	61.5 Å²	61.5	30%	0.299	28%	0.277	S	S	.	.	H	α-helix	trans	-68.2	-32.7	178.2	0	0	0	0	0	112.8	G968 F975	G968-G971 PolarHBondContact O-N 3.2Å; G971-F975 WeakPolarHBondContact O-CB 3.42Å; G971-F975 PolarHBondContact O-N 2.99Å
972	I	93.3	Very high	92.2	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.1	-41	173.5	-66.7	174.2	0	0	0	111.3	P963 G968 S969 P970 F975 F976 L1183 V1186	P963-I972 HydrophobicContact CB-CG1 4.03Å; P963-I972 HydrophobicContact CG-CG1 4.24Å; G968-I972 VanDerWaalsContact O-CG1 3.31Å; G968-I972 WeakPolarHBondContact O-CG1 3.43Å; G968-I972 PolarHBondContact O-N 2.9Å; S969-I972 PolarHBondContact O-N 3.47Å; P970-I972 VanDerWaalsContact C-N 3.34Å; P970-I972 PolarHBondContact O-N 3.27Å; I972-F975 PolarHBondContact O-N 3.4Å; I972-F976 HydrophobicContact CG2-CD2 3.73Å; I972-F976 HydrophobicContact CG2-CE2 3.27Å; I972-F976 HydrophobicContact CG2-CZ 3.98Å; I972-F976 VanDerWaalsContact O-CD2 3.32Å; I972-F976 WeakPolarHBondContact O-CD2 3.43Å; I972-F976 PolarHBondContact O-N 3.02Å; I972-L1183 HydrophobicContact CB-CD1 4.2Å; I972-L1183 HydrophobicContact CG2-CD1 3.97Å; I972-V1186 HydrophobicContact CD1-CB 3.88Å; I972-V1186 HydrophobicContact CD1-CG1 3.73Å; I972-V1186 HydrophobicContact CD1-CG2 3.65Å
973	L	93.7	Very high	92.1	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-43.3	174.7	176.2	57.5	0	0	0	111.2	S969 P970 F976 H977 F1136 L1183 I1196 V1199 L1201	S969-L973 PolarHBondContact O-N 3.04Å; P970-L973 PolarHBondContact O-N 3.16Å; L973-F976 PolarHBondContact O-N 2.79Å; L973-H977 PolarHBondContact O-CD2 3.47Å; L973-H977 PolarHBondContact O-N 3.15Å; L973-F1136 HydrophobicContact CD1-CE2 3.9Å; L973-F1136 HydrophobicContact CD1-CZ 3.96Å; L973-L1183 HydrophobicContact CB-CD1 4.04Å; L973-L1183 HydrophobicContact CB-CD2 4.22Å; L973-L1183 HydrophobicContact CD1-CD2 3.86Å; L973-I1196 HydrophobicContact CD2-CB 3.83Å; L973-I1196 HydrophobicContact CD2-CG1 4.15Å; L973-I1196 HydrophobicContact CG-CB 4.11Å; L973-I1196 HydrophobicContact CG-CG2 4.27Å; L973-V1199 HydrophobicContact CD2-CB 4.38Å; L973-V1199 HydrophobicContact CD2-CG1 4.08Å; L973-L1201 HydrophobicContact CB-CD1 4.23Å; L973-L1201 HydrophobicContact CD2-CB 4.16Å; L973-L1201 HydrophobicContact CD2-CD1 3.71Å; L973-L1201 HydrophobicContact CD2-CG 4.5Å
974	E	93.7	Very high	92	Very high	112 Å²	112	59.1 Å²	59.1	52%	0.523	28%	0.277	S	S	.	.	H	α-helix	trans	-62	-43.2	175.4	-170.1	172.7	-160.7	0	0	112	P970 H977 H978 I1196	P970-E974 PolarHBondContact O-N 2.81Å; E974-H977 PolarHBondContact O-N 3.27Å; E974-H978 PolarHBondContact O-N 3.37Å; E974-I1196 HydrophobicContact CB-CG2 3.73Å; E974-I1196 HydrophobicContact CG-CG2 4.27Å
975	F	94.3	Very high	92.1	Very high	65 Å²	65	57.5 Å²	57.5	29%	0.285	28%	0.276	S	S	.	.	H	α-helix	trans	-58.3	-49.4	175.9	174.4	-96.1	0	0	0	112	R961 P963 G971 I972 H977 H978 Q979	R961-F975 VanDerWaalsContact O-CE1 3.28Å; R961-F975 WeakPolarHBondContact O-CE1 3.47Å; P963-F975 HydrophobicContact CG-CB 4.44Å; P963-F975 HydrophobicContact CG-CD1 3.53Å; P963-F975 HydrophobicContact CG-CE1 3.81Å; P963-F975 HydrophobicContact CG-CG 3.92Å; P963-F975 HydrophobicContact CG-CZ 4.42Å; G971-F975 WeakPolarHBondContact O-CB 3.42Å; G971-F975 PolarHBondContact O-N 2.99Å; I972-F975 PolarHBondContact O-N 3.4Å; F975-H977 PolarHBondContact O-N 2.73Å; F975-H978 PolarHBondContact O-N 2.96Å; F975-Q979 HydrophobicContact CD1-CG 4.24Å; F975-Q979 HydrophobicContact CD2-CG 4.24Å; F975-Q979 HydrophobicContact CE1-CG 3.86Å; F975-Q979 HydrophobicContact CE2-CG 3.86Å; F975-Q979 HydrophobicContact CG-CG 4.42Å; F975-Q979 HydrophobicContact CZ-CG 3.67Å; F975-Q979 WeakPolarHBondContact O-CG 3.48Å; F975-Q979 PolarHBondContact O-N 2.77Å
976	F	94.9	Very high	92.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.8	-36.8	178.7	-67.6	-42.3	0	0	0	112.5	L962 I972 L973 H978 Q979 L980 F1136 F1179 L1183	L962-F976 HydrophobicContact CD2-CE1 4.28Å; L962-F976 HydrophobicContact CD2-CZ 3.87Å; I972-F976 HydrophobicContact CG2-CD2 3.73Å; I972-F976 HydrophobicContact CG2-CE2 3.27Å; I972-F976 HydrophobicContact CG2-CZ 3.98Å; I972-F976 VanDerWaalsContact O-CD2 3.32Å; I972-F976 WeakPolarHBondContact O-CD2 3.43Å; I972-F976 PolarHBondContact O-N 3.02Å; L973-F976 PolarHBondContact O-N 2.79Å; F976-H978 VanDerWaalsContact C-N 3.27Å; F976-H978 PolarHBondContact O-N 3.48Å; F976-Q979 PolarHBondContact O-N 2.66Å; F976-L980 HydrophobicContact CB-CD1 4.4Å; F976-L980 VanDerWaalsContact O-CB 3.25Å; F976-L980 WeakPolarHBondContact O-CB 3.43Å; F976-L980 VanDerWaalsContact O-CG 3.32Å; F976-L980 WeakPolarHBondContact O-CG 3.31Å; F976-L980 PolarHBondContact O-N 2.97Å; F976-F1136 HydrophobicContact CB-CD2 4.26Å; F976-F1136 HydrophobicContact CB-CE2 3.71Å; F976-F1136 HydrophobicContact CB-CZ 3.91Å; F976-F1179 HydrophobicContact CD1-CB 4.14Å; F976-F1179 HydrophobicContact CD1-CD1 4.08Å; F976-F1179 HydrophobicContact CD1-CG 4.24Å; F976-F1179 HydrophobicContact CD2-CB 4.26Å; F976-F1179 HydrophobicContact CE1-CB 4Å; F976-F1179 AromaticContact CE1-CD1 3.58Å; F976-F1179 HydrophobicContact CE1-CD1 3.58Å; F976-F1179 HydrophobicContact CE1-CE1 4.4Å; F976-F1179 HydrophobicContact CE1-CG 4.08Å; F976-F1179 HydrophobicContact CE2-CB 4.09Å; F976-F1179 VanDerWaalsContact CE2-O 3.27Å; F976-F1179 WeakPolarHBondContact CE2-O 3.23Å; F976-F1179 HydrophobicContact CG-CB 4.29Å; F976-F1179 HydrophobicContact CZ-CB 3.97Å; F976-F1179 HydrophobicContact CZ-CD1 4.09Å; F976-F1179 HydrophobicContact CZ-CG 4.47Å; F976-L1183 HydrophobicContact CE2-CB 4.35Å
977	H	91.4	Very high	92.2	Very high	18 Å²	18	54 Å²	54	8%	0.083	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-36.7	172.7	-93.3	-64.4	0	0	0	113.1	L973 E974 F975 K981 F1136 K1197 V1199	L973-H977 PolarHBondContact O-CD2 3.47Å; L973-H977 PolarHBondContact O-N 3.15Å; E974-H977 PolarHBondContact O-N 3.27Å; F975-H977 PolarHBondContact O-N 2.73Å; H977-K981 PolarHBondContact O-N 3.16Å; H977-F1136 AromaticContact CD2-CZ 3.82Å; H977-F1136 AromaticContact CE1-CE1 3.93Å; H977-F1136 AromaticContact CE1-CZ 3.9Å; H977-F1136 AromaticContact CG-CZ 3.86Å; H977-F1136 AromaticContact ND1-CE1 3.79Å; H977-F1136 AromaticContact ND1-CZ 3.93Å; H977-F1136 AromaticContact NE2-CZ 3.84Å; H977-K1197 HydrophobicContact CB-CD 3.84Å; H977-V1199 VanDerWaalsContact NE2-CG2 3.32Å; H977-V1199 WeakPolarHBondContact NE2-CG2 3.33Å
978	H	92.1	Very high	92.4	Very high	138 Å²	138	49.9 Å²	49.9	64%	0.639	26%	0.261	S	S	*	.	H	α-helix	trans	-71.9	-48	176.7	-174.2	73.7	0	0	0	111.5	E974 F975 F976 L980	E974-H978 PolarHBondContact O-N 3.37Å; F975-H978 PolarHBondContact O-N 2.96Å; F976-H978 VanDerWaalsContact C-N 3.27Å; F976-H978 PolarHBondContact O-N 3.48Å; H978-L980 VanDerWaalsContact C-N 3.33Å; H978-L980 PolarHBondContact O-N 3.21Å
979	Q	91.3	Very high	92.4	Very high	62 Å²	62	49.8 Å²	49.8	29%	0.29	26%	0.259	S	S	.	.	H	α-helix	trans	-69	-29.1	-176.5	-66.9	-71.3	27.8	0	0	113.7	P957 F975 F976	P957-Q979 WeakPolarHBondContact CD-O 3.26Å; P957-Q979 WeakPolarHBondContact CG-O 3.44Å; F975-Q979 HydrophobicContact CD1-CG 4.24Å; F975-Q979 HydrophobicContact CD2-CG 4.24Å; F975-Q979 HydrophobicContact CE1-CG 3.86Å; F975-Q979 HydrophobicContact CE2-CG 3.86Å; F975-Q979 HydrophobicContact CG-CG 4.42Å; F975-Q979 HydrophobicContact CZ-CG 3.67Å; F975-Q979 WeakPolarHBondContact O-CG 3.48Å; F975-Q979 PolarHBondContact O-N 2.77Å; F976-Q979 PolarHBondContact O-N 2.66Å
980	L	94	Very high	92.3	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	11.1	-176.2	-54.5	179.2	0	0	0	113	M956 P957 F976 H978 D982 I983 V984 A1133 F1136 F1179	M956-L980 HydrophobicContact CE-CD2 3.31Å; M956-L980 HydrophobicContact SD-CD2 4.36Å; P957-L980 HydrophobicContact CG-CD2 4.19Å; F976-L980 HydrophobicContact CB-CD1 4.4Å; F976-L980 VanDerWaalsContact O-CB 3.25Å; F976-L980 WeakPolarHBondContact O-CB 3.43Å; F976-L980 VanDerWaalsContact O-CG 3.32Å; F976-L980 WeakPolarHBondContact O-CG 3.31Å; F976-L980 PolarHBondContact O-N 2.97Å; H978-L980 VanDerWaalsContact C-N 3.33Å; H978-L980 PolarHBondContact O-N 3.21Å; L980-D982 VanDerWaalsContact C-N 3.3Å; L980-D982 PolarHBondContact O-N 3.05Å; L980-I983 PolarHBondContact O-N 3.01Å; L980-I983 VanDerWaalsContact O-N 3.08Å; L980-V984 WeakPolarHBondContact O-CG2 3.24Å; L980-V984 PolarHBondContact O-N 2.78Å; L980-A1133 HydrophobicContact CD2-CB 4.12Å; L980-F1136 HydrophobicContact CB-CD1 4.3Å; L980-F1136 HydrophobicContact CD1-CB 3.77Å; L980-F1136 HydrophobicContact CD1-CD1 3.73Å; L980-F1136 HydrophobicContact CD1-CD2 4.37Å; L980-F1136 HydrophobicContact CD1-CE1 4.42Å; L980-F1136 HydrophobicContact CD1-CG 3.69Å; L980-F1179 HydrophobicContact CD1-CD2 3.74Å; L980-F1179 HydrophobicContact CD1-CE2 4.15Å; L980-F1179 HydrophobicContact CD1-CG 4.39Å; L980-F1179 HydrophobicContact CD2-CD2 4.42Å; L980-F1179 HydrophobicContact CD2-CE2 3.98Å
981	K	92	Very high	92.2	Very high	98 Å²	98	58 Å²	58	43%	0.426	30%	0.3	S	S	.	.	H	α-helix	trans	-52.5	-47.3	-174.3	-173.7	-170.4	170.5	-161.1	0	112.4	H977 I983 V984 E985	H977-K981 PolarHBondContact O-N 3.16Å; K981-I983 VanDerWaalsContact C-N 3.25Å; K981-I983 PolarHBondContact O-N 3.19Å; K981-V984 PolarHBondContact O-N 2.9Å; K981-V984 VanDerWaalsContact O-N 3.11Å; K981-E985 WeakPolarHBondContact CE-OE1 3.44Å; K981-E985 WeakPolarHBondContact CE-OE2 3.25Å; K981-E985 HydrophobicContact CG-CG 4.44Å; K981-E985 IonicContact NZ-OE1 3.7Å; K981-E985 IonicContact NZ-OE2 2.69Å; K981-E985 PolarHBondContact O-N 3.37Å
982	D	91.7	Very high	92.2	Very high	100 Å²	100	58.2 Å²	58.2	54%	0.535	30%	0.296	S	S	.	.	H	α-helix	trans	-70.1	-23.6	-175.2	-58.4	-28.4	0	0	0	112.6	V955 L980 Y986	V955-D982 HydrophobicContact CG1-CB 3.48Å; V955-D982 VanDerWaalsContact CG1-CB 3.48Å; L980-D982 VanDerWaalsContact C-N 3.3Å; L980-D982 PolarHBondContact O-N 3.05Å; D982-Y986 PolarHBondContact O-N 2.65Å
983	I	92.8	Very high	92.2	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-78.4	-41.1	170.7	-56.7	-63	0	0	0	110.5	L952 V955 M956 L980 K981 E985 Y986 L989 L1130 A1133 V1137	L952-I983 HydrophobicContact CB-CD1 4.34Å; L952-I983 HydrophobicContact CD2-CD1 4.02Å; V955-I983 HydrophobicContact CB-CD1 4.2Å; V955-I983 HydrophobicContact CG1-CD1 3.86Å; M956-I983 HydrophobicContact SD-CD1 4.22Å; M956-I983 HydrophobicContact SD-CG1 3.94Å; L980-I983 PolarHBondContact O-N 3.01Å; L980-I983 VanDerWaalsContact O-N 3.08Å; K981-I983 VanDerWaalsContact C-N 3.25Å; K981-I983 PolarHBondContact O-N 3.19Å; I983-E985 VanDerWaalsContact C-N 3.33Å; I983-E985 PolarHBondContact O-N 2.96Å; I983-Y986 WeakPolarHBondContact O-CB 3.38Å; I983-Y986 PolarHBondContact O-N 3.36Å; I983-L989 HydrophobicContact CG2-CD2 4.31Å; I983-L989 WeakPolarHBondContact O-CD2 3.49Å; I983-L1130 HydrophobicContact CD1-CD1 4.38Å; I983-A1133 HydrophobicContact CB-CB 4.49Å; I983-A1133 HydrophobicContact CG1-CB 4.32Å; I983-A1133 HydrophobicContact CG2-CB 4Å; I983-V1137 HydrophobicContact CG2-CG2 4.11Å
984	V	91.4	Very high	92.4	Very high	48 Å²	48	58.7 Å²	58.7	29%	0.291	30%	0.299	S	S	.	.	H	α-helix	trans	-63.2	-39.3	178.1	175.1	0	0	0	0	111.6	L980 K981 Y986 F1136 V1137 I1140	L980-V984 WeakPolarHBondContact O-CG2 3.24Å; L980-V984 PolarHBondContact O-N 2.78Å; K981-V984 PolarHBondContact O-N 2.9Å; K981-V984 VanDerWaalsContact O-N 3.11Å; V984-Y986 VanDerWaalsContact C-N 3.35Å; V984-F1136 HydrophobicContact CG2-CD1 4.12Å; V984-F1136 HydrophobicContact CG2-CE1 4.19Å; V984-V1137 HydrophobicContact CB-CG2 4.35Å; V984-V1137 HydrophobicContact CG2-CG2 3.86Å; V984-I1140 HydrophobicContact CG1-CD1 4.25Å; V984-I1140 HydrophobicContact CG2-CD1 4.34Å
985	E	92.1	Very high	92.5	Very high	128 Å²	128	53.6 Å²	53.6	60%	0.598	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	0.4	-177.7	-67.6	178.1	-176.4	0	0	113.4	K981 I983 A987	K981-E985 WeakPolarHBondContact CE-OE1 3.44Å; K981-E985 WeakPolarHBondContact CE-OE2 3.25Å; K981-E985 HydrophobicContact CG-CG 4.44Å; K981-E985 IonicContact NZ-OE1 3.7Å; K981-E985 IonicContact NZ-OE2 2.69Å; K981-E985 PolarHBondContact O-N 3.37Å; I983-E985 VanDerWaalsContact C-N 3.33Å; I983-E985 PolarHBondContact O-N 2.96Å; E985-A987 PolarHBondContact O-N 3.1Å; E985-A987 VanDerWaalsContact O-N 3.1Å
986	Y	93.8	Very high	92.6	Very high	59 Å²	59	51.6 Å²	51.6	23%	0.231	27%	0.267	C	S	.	.			trans	-69.2	109	-178.4	-165.3	-97.7	0	0	0	111.8	Y948 L952 D982 I983 V984 E988 L989	Y948-Y986 AromaticContact CD1-CE1 3.96Å; Y948-Y986 HydrophobicContact CD1-CE1 3.96Å; Y948-Y986 AromaticContact CE1-CE1 3.93Å; Y948-Y986 HydrophobicContact CE1-CE1 3.93Å; Y948-Y986 WeakPolarHBondContact CE1-OH 3.35Å; L952-Y986 HydrophobicContact CD2-CD1 3.88Å; L952-Y986 HydrophobicContact CD2-CD2 3.87Å; L952-Y986 HydrophobicContact CD2-CE1 4.05Å; L952-Y986 HydrophobicContact CD2-CE2 4.04Å; L952-Y986 HydrophobicContact CD2-CG 3.79Å; D982-Y986 PolarHBondContact O-N 2.65Å; I983-Y986 WeakPolarHBondContact O-CB 3.38Å; I983-Y986 PolarHBondContact O-N 3.36Å; V984-Y986 VanDerWaalsContact C-N 3.35Å; Y986-E988 VanDerWaalsContact C-N 3.31Å; Y986-E988 HydrophobicContact CD1-CB 4.36Å; Y986-E988 HydrophobicContact CE1-CB 3.84Å; Y986-E988 PolarHBondContact O-N 2.99Å; Y986-L989 HydrophobicContact CD1-CB 4.06Å; Y986-L989 VanDerWaalsContact O-CB 3.27Å; Y986-L989 WeakPolarHBondContact O-CB 3.47Å; Y986-L989 PolarHBondContact O-N 2.82Å; Y986-L989 VanDerWaalsContact O-N 3.15Å
987	A	87.6	Confident	92.7	Very high	93 Å²	93	51.8 Å²	51.8	77%	0.769	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-37.9	-169.7	0	0	0	0	0	114.1	E985 L989	E985-A987 PolarHBondContact O-N 3.1Å; E985-A987 VanDerWaalsContact O-N 3.1Å; A987-L989 VanDerWaalsContact C-N 3.34Å
988	E	92.9	Very high	92.9	Very high	83 Å²	83	50.9 Å²	50.9	39%	0.388	26%	0.264	S	S	.	.	H	α-helix	trans	-92.6	9.3	-175.1	-65.6	178.8	175.9	0	0	113.7	Y948 Y986 K990 T991 V992 C993	Y948-E988 HydrophobicContact CE1-CB 4.08Å; Y948-E988 WeakPolarHBondContact CE1-OE2 3.41Å; Y948-E988 PolarHBondContact OH-OE2 3Å; Y986-E988 VanDerWaalsContact C-N 3.31Å; Y986-E988 HydrophobicContact CD1-CB 4.36Å; Y986-E988 HydrophobicContact CE1-CB 3.84Å; Y986-E988 PolarHBondContact O-N 2.99Å; E988-K990 VanDerWaalsContact C-N 3.34Å; E988-K990 PolarHBondContact O-N 3.4Å; E988-T991 WeakPolarHBondContact CA-OG1 3.18Å; E988-V992 HydrophobicContact CB-CB 4.31Å; E988-V992 HydrophobicContact CB-CG2 3.96Å; E988-V992 HydrophobicContact CG-CG2 4.32Å; E988-V992 WeakPolarHBondContact O-CB 3.5Å; E988-V992 PolarHBondContact O-N 2.99Å; E988-C993 PolarHBondContact O-N 2.95Å
989	L	91.8	Very high	93.2	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.016	24%	0.24	C	C	.	.	I	π-helix	trans	-64.1	-42	-177.5	-172.1	65.5	0	0	0	111.1	L952 I983 Y986 A987 C993 F994 M1134 V1137	L952-L989 HydrophobicContact CD1-CD1 3.92Å; I983-L989 HydrophobicContact CG2-CD2 4.31Å; I983-L989 WeakPolarHBondContact O-CD2 3.49Å; Y986-L989 HydrophobicContact CD1-CB 4.06Å; Y986-L989 VanDerWaalsContact O-CB 3.27Å; Y986-L989 WeakPolarHBondContact O-CB 3.47Å; Y986-L989 PolarHBondContact O-N 2.82Å; Y986-L989 VanDerWaalsContact O-N 3.15Å; A987-L989 VanDerWaalsContact C-N 3.34Å; L989-C993 HydrophobicContact CD1-CB 4.11Å; L989-C993 VanDerWaalsContact O-CB 3.24Å; L989-C993 WeakPolarHBondContact O-CB 3.45Å; L989-C993 PolarHBondContact O-N 3.05Å; L989-F994 HydrophobicContact CD1-CE1 4.17Å; L989-F994 HydrophobicContact CD2-CE1 4.4Å; L989-F994 HydrophobicContact CD2-CZ 4.08Å; L989-F994 HydrophobicContact CG-CE1 3.93Å; L989-F994 HydrophobicContact CG-CZ 3.99Å; L989-F994 WeakPolarHBondContact O-CD1 3.48Å; L989-F994 WeakPolarHBondContact O-CG 3.49Å; L989-F994 PolarHBondContact O-N 3.32Å; L989-M1134 HydrophobicContact CD1-CE 3.96Å; L989-M1134 HydrophobicContact CD1-CG 4.23Å; L989-V1137 HydrophobicContact CD2-CB 4.15Å; L989-V1137 HydrophobicContact CD2-CG1 3.96Å; L989-V1137 HydrophobicContact CD2-CG2 3.9Å
990	K	90.9	Very high	93.5	Very high	101 Å²	101	42.8 Å²	42.8	44%	0.439	23%	0.226	S	C	.	.	I	π-helix	trans	-82.6	-49.5	178.8	-64.5	177.4	-176.5	167.3	0	111.7	F871 E988 V992 F994 Q995 F1153	F871-K990 HydrophobicContact CZ-CB 4.3Å; E988-K990 VanDerWaalsContact C-N 3.34Å; E988-K990 PolarHBondContact O-N 3.4Å; K990-V992 VanDerWaalsContact C-N 3.35Å; K990-V992 PolarHBondContact O-N 3.01Å; K990-F994 HydrophobicContact CB-CD2 4.33Å; K990-F994 HydrophobicContact CG-CD2 3.86Å; K990-F994 HydrophobicContact CG-CE2 4.04Å; K990-Q995 PolarHBondContact O-N 3.44Å; K990-F1153 HydrophobicContact CB-CZ 4.4Å; K990-F1153 VanDerWaalsContact O-CZ 3.24Å; K990-F1153 WeakPolarHBondContact O-CZ 3.27Å
991	T	90.3	Very high	93.7	Very high	78 Å²	78	42.7 Å²	42.7	48%	0.479	23%	0.226	S	C	.	.	I	π-helix	trans	-68.6	-29.8	-173	50.5	0	0	0	0	113.9	F871 E988 Q995	F871-T991 HydrophobicContact CE1-CG2 4.27Å; F871-T991 HydrophobicContact CZ-CG2 3.94Å; E988-T991 WeakPolarHBondContact CA-OG1 3.18Å; T991-Q995 VanDerWaalsContact O-CB 3.3Å; T991-Q995 WeakPolarHBondContact O-CB 3.18Å
992	V	91.4	Very high	93.9	Very high	35 Å²	35	38 Å²	38	21%	0.212	21%	0.206	C	C	.	.	I	π-helix	trans	-116.3	-54.9	-177.9	-173.3	0	0	0	0	111.5	Y948 E988 K990 N996	Y948-V992 HydrophobicContact CD2-CG1 4.16Å; Y948-V992 HydrophobicContact CE1-CB 4.28Å; Y948-V992 HydrophobicContact CE1-CG1 4.18Å; Y948-V992 HydrophobicContact CE2-CG1 3.58Å; E988-V992 HydrophobicContact CB-CB 4.31Å; E988-V992 HydrophobicContact CB-CG2 3.96Å; E988-V992 HydrophobicContact CG-CG2 4.32Å; E988-V992 WeakPolarHBondContact O-CB 3.5Å; E988-V992 PolarHBondContact O-N 2.99Å; K990-V992 VanDerWaalsContact C-N 3.35Å; K990-V992 PolarHBondContact O-N 3.01Å; V992-N996 WeakPolarHBondContact CG1-ND2 3.35Å; V992-N996 WeakPolarHBondContact O-CB 2.88Å; V992-N996 PolarHBondContact O-N 3.33Å; V992-N996 PolarHBondContact O-ND2 2.71Å
993	C	93.1	Very high	94.2	Very high	8 Å²	8	33.3 Å²	33.3	5%	0.054	18%	0.181	C	C	.	.	I	π-helix	trans	-69	-53	-172.6	-52.1	0	0	0	0	112	Y948 E988 L989 Q995 L997	Y948-C993 WeakPolarHBondContact CD1-SG 3.27Å; E988-C993 PolarHBondContact O-N 2.95Å; L989-C993 HydrophobicContact CD1-CB 4.11Å; L989-C993 VanDerWaalsContact O-CB 3.24Å; L989-C993 WeakPolarHBondContact O-CB 3.45Å; L989-C993 PolarHBondContact O-N 3.05Å; C993-Q995 VanDerWaalsContact C-N 3.32Å; C993-Q995 PolarHBondContact O-N 3.07Å; C993-L997 WeakPolarHBondContact O-CB 3.37Å; C993-L997 WeakPolarHBondContact O-CG 3.2Å; C993-L997 PolarHBondContact O-N 3.46Å
994	F	96.6	Very high	94.4	Very high	1 Å²	1	33.4 Å²	33.4	0%	0.004	18%	0.181	C	C	.	.	I	π-helix	trans	-67.2	-35	179.5	-66.8	-5.1	0	0	0	112.1	L989 K990 L997 R998 M1134 Y1138 V1149 F1153 L1157	L989-F994 HydrophobicContact CD1-CE1 4.17Å; L989-F994 HydrophobicContact CD2-CE1 4.4Å; L989-F994 HydrophobicContact CD2-CZ 4.08Å; L989-F994 HydrophobicContact CG-CE1 3.93Å; L989-F994 HydrophobicContact CG-CZ 3.99Å; L989-F994 WeakPolarHBondContact O-CD1 3.48Å; L989-F994 WeakPolarHBondContact O-CG 3.49Å; L989-F994 PolarHBondContact O-N 3.32Å; K990-F994 HydrophobicContact CB-CD2 4.33Å; K990-F994 HydrophobicContact CG-CD2 3.86Å; K990-F994 HydrophobicContact CG-CE2 4.04Å; F994-L997 PolarHBondContact O-N 3.49Å; F994-R998 VanDerWaalsContact O-CB 3.31Å; F994-R998 WeakPolarHBondContact O-CB 3.35Å; F994-R998 PolarHBondContact O-N 3.46Å; F994-M1134 HydrophobicContact CE1-CB 4.01Å; F994-M1134 HydrophobicContact CE1-CG 4.11Å; F994-M1134 HydrophobicContact CE1-SD 4.16Å; F994-M1134 HydrophobicContact CZ-CB 4.36Å; F994-Y1138 HydrophobicContact CZ-CD1 4.23Å; F994-V1149 HydrophobicContact CD2-CG2 4.1Å; F994-V1149 HydrophobicContact CE2-CG2 4.23Å; F994-F1153 HydrophobicContact CB-CD1 4.21Å; F994-F1153 HydrophobicContact CB-CD2 4.15Å; F994-F1153 HydrophobicContact CB-CE1 3.93Å; F994-F1153 HydrophobicContact CB-CE2 3.84Å; F994-F1153 HydrophobicContact CB-CG 4.33Å; F994-F1153 HydrophobicContact CB-CZ 3.74Å; F994-F1153 HydrophobicContact CD2-CD2 4.4Å; F994-F1153 HydrophobicContact CD2-CE2 4.03Å; F994-F1153 HydrophobicContact CG-CE2 4.48Å; F994-L1157 HydrophobicContact CB-CD1 3.97Å; F994-L1157 HydrophobicContact CB-CD2 4.19Å; F994-L1157 HydrophobicContact CD1-CD1 3.97Å; F994-L1157 HydrophobicContact CD1-CD2 4.34Å; F994-L1157 HydrophobicContact CD2-CD2 4.09Å; F994-L1157 HydrophobicContact CG-CD1 4.09Å; F994-L1157 HydrophobicContact CG-CD2 3.97Å
995	Q	95.8	Very high	94.7	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.028	17%	0.167	C	C	.	.	H	α-helix	trans	-62.5	-51.7	176.3	-176.9	54.6	33.9	0	0	112	P853 K990 T991 C993 L997 R998 E999 F1153	P853-Q995 VanDerWaalsContact CA-NE2 3.28Å; P853-Q995 PolarHBondContact O-NE2 2.97Å; K990-Q995 PolarHBondContact O-N 3.44Å; T991-Q995 VanDerWaalsContact O-CB 3.3Å; T991-Q995 WeakPolarHBondContact O-CB 3.18Å; C993-Q995 VanDerWaalsContact C-N 3.32Å; C993-Q995 PolarHBondContact O-N 3.07Å; Q995-L997 VanDerWaalsContact C-N 3.33Å; Q995-L997 PolarHBondContact O-N 2.89Å; Q995-R998 WeakPolarHBondContact O-CB 3.36Å; Q995-R998 PolarHBondContact O-N 3.02Å; Q995-R998 VanDerWaalsContact O-N 3.16Å; Q995-E999 PolarHBondContact NE2-OE1 3.25Å; Q995-E999 PolarHBondContact O-N 3.27Å; Q995-F1153 HydrophobicContact CB-CE1 4.06Å
996	N	96.4	Very high	94.9	Very high	22 Å²	22	25.1 Å²	25.1	12%	0.118	14%	0.139	C	C	.	.	H	α-helix	trans	-63.7	-37.9	178.4	-68.1	-29.6	0	0	0	112.2	T944 I945 V992 E999 V1000	T944-N996 PolarHBondContact OG1-ND2 3.32Å; I945-N996 HydrophobicContact CD1-CB 4Å; I945-N996 HydrophobicContact CG1-CB 3.68Å; V992-N996 WeakPolarHBondContact CG1-ND2 3.35Å; V992-N996 WeakPolarHBondContact O-CB 2.88Å; V992-N996 PolarHBondContact O-N 3.33Å; V992-N996 PolarHBondContact O-ND2 2.71Å; N996-E999 PolarHBondContact O-N 2.85Å; N996-V1000 WeakPolarHBondContact O-CG2 3.43Å; N996-V1000 PolarHBondContact O-N 3.44Å; N996-V1000 VanDerWaalsContact O-N 3.12Å
997	L	96.8	Very high	95.1	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-66.7	-38.4	175.2	-74.6	167.9	0	0	0	111.7	I945 C993 F994 Q995 E999 V1000 G1001 W1131 M1134 L1157 A1160 I1164	I945-L997 HydrophobicContact CD1-CD2 4.21Å; I945-L997 HydrophobicContact CG2-CD2 4.28Å; C993-L997 WeakPolarHBondContact O-CB 3.37Å; C993-L997 WeakPolarHBondContact O-CG 3.2Å; C993-L997 PolarHBondContact O-N 3.46Å; F994-L997 PolarHBondContact O-N 3.49Å; Q995-L997 VanDerWaalsContact C-N 3.33Å; Q995-L997 PolarHBondContact O-N 2.89Å; L997-E999 VanDerWaalsContact C-N 3.34Å; L997-E999 PolarHBondContact O-N 2.88Å; L997-V1000 PolarHBondContact O-N 3.23Å; L997-G1001 PolarHBondContact O-N 3.04Å; L997-W1131 HydrophobicContact CD1-CZ3 3.93Å; L997-M1134 HydrophobicContact CD1-SD 4.43Å; L997-L1157 HydrophobicContact CB-CD1 3.66Å; L997-L1157 HydrophobicContact CD1-CD1 4.11Å; L997-A1160 HydrophobicContact CB-CB 4.19Å; L997-A1160 HydrophobicContact CD2-CB 4.06Å; L997-A1160 WeakPolarHBondContact O-CB 3.38Å; L997-I1164 HydrophobicContact CD2-CD1 3.96Å
998	R	97.2	Very high	95.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.8	-43.6	173.7	175.5	-114.7	-76.3	-84.8	-5	111.5	L852 P853 Y855 C856 T867 F994 Q995 V1000 G1001 N1002 C1152 F1153	L852-R998 WeakPolarHBondContact O-CD 3.31Å; P853-R998 PolarHBondContact O-NE 3.32Å; Y855-R998 VanDerWaalsContact C-NH1 3.33Å; Y855-R998 PolarHBondContact O-NH1 3.37Å; C856-R998 PolarHBondContact SG-NH1 2.69Å; T867-R998 PolarHBondContact OG1-NH2 3.4Å; F994-R998 VanDerWaalsContact O-CB 3.31Å; F994-R998 WeakPolarHBondContact O-CB 3.35Å; F994-R998 PolarHBondContact O-N 3.46Å; Q995-R998 WeakPolarHBondContact O-CB 3.36Å; Q995-R998 PolarHBondContact O-N 3.02Å; Q995-R998 VanDerWaalsContact O-N 3.16Å; R998-V1000 PolarHBondContact O-N 3.49Å; R998-G1001 PolarHBondContact O-N 3.14Å; R998-N1002 WeakPolarHBondContact CD-ND2 3.4Å; R998-N1002 WeakPolarHBondContact O-CB 3.15Å; R998-N1002 PolarHBondContact O-N 3.3Å; R998-C1152 VanDerWaalsContact CZ-O 3.22Å; R998-C1152 PolarHBondContact NH1-O 3.06Å; R998-C1152 PolarHBondContact NH2-O 2.83Å; R998-F1153 HydrophobicContact CB-CB 4.24Å; R998-F1153 HydrophobicContact CB-CD1 3.97Å; R998-F1153 HydrophobicContact CG-CB 4.24Å; R998-F1153 HydrophobicContact CG-CD1 4.36Å; R998-F1153 WeakPolarHBondContact CG-O 3.48Å
999	E	97.6	Very high	95.6	Very high	29 Å²	29	15 Å²	15	14%	0.136	8%	0.079	C	C	.	.	H	α-helix	trans	-59.4	-45.6	176.3	-73.1	171.4	-144.7	0	0	112.1	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 3.46Å; P853-E999 HydrophobicContact CB-CG 4.31Å; L940-E999 HydrophobicContact CD1-CB 3.95Å; Q995-E999 PolarHBondContact NE2-OE1 3.25Å; Q995-E999 PolarHBondContact O-N 3.27Å; N996-E999 PolarHBondContact O-N 2.85Å; L997-E999 VanDerWaalsContact C-N 3.34Å; L997-E999 PolarHBondContact O-N 2.88Å; E999-G1001 VanDerWaalsContact C-N 3.33Å; E999-G1001 PolarHBondContact O-N 2.51Å; E999-N1002 PolarHBondContact O-N 3.17Å; E999-A1003 PolarHBondContact O-N 3.24Å
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	-45.1	173.8	171	0	0	0	0	111.2	V937 L940 I945 N996 L997 R998 A1003 V1004 A1160 M1163	V937-V1000 HydrophobicContact CG1-CG1 4.06Å; V937-V1000 HydrophobicContact CG2-CG1 4.38Å; L940-V1000 HydrophobicContact CB-CG2 3.93Å; L940-V1000 HydrophobicContact CD1-CG2 3.83Å; I945-V1000 HydrophobicContact CD1-CG2 3.68Å; N996-V1000 WeakPolarHBondContact O-CG2 3.43Å; N996-V1000 PolarHBondContact O-N 3.44Å; N996-V1000 VanDerWaalsContact O-N 3.12Å; L997-V1000 PolarHBondContact O-N 3.23Å; R998-V1000 PolarHBondContact O-N 3.49Å; V1000-A1003 PolarHBondContact O-N 3.39Å; V1000-V1004 VanDerWaalsContact O-CG2 3.31Å; V1000-V1004 WeakPolarHBondContact O-CG2 3.44Å; V1000-V1004 PolarHBondContact O-N 2.87Å; V1000-V1004 VanDerWaalsContact O-N 3.11Å; V1000-A1160 HydrophobicContact CB-CB 4.05Å; V1000-A1160 HydrophobicContact CG1-CB 3.95Å; V1000-M1163 HydrophobicContact CG1-CE 3.78Å
1001	G	97.1	Very high	96.1	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-64.7	-43	179.9	0	0	0	0	0	113	L997 R998 E999 A1003 V1004 L1005 G1156	L997-G1001 PolarHBondContact O-N 3.04Å; R998-G1001 PolarHBondContact O-N 3.14Å; E999-G1001 VanDerWaalsContact C-N 3.33Å; E999-G1001 PolarHBondContact O-N 2.51Å; G1001-A1003 VanDerWaalsContact C-N 3.32Å; G1001-A1003 PolarHBondContact O-N 2.9Å; G1001-V1004 PolarHBondContact O-N 3.23Å; G1001-L1005 WeakPolarHBondContact O-CB 3.27Å; G1001-L1005 VanDerWaalsContact O-CG 3.29Å; G1001-L1005 WeakPolarHBondContact O-CG 3.44Å; G1001-L1005 PolarHBondContact O-N 2.61Å; G1001-G1156 VanDerWaalsContact CA-O 3.3Å; G1001-G1156 WeakPolarHBondContact CA-O 3.19Å
1002	N	98	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	-63.2	-37.3	176.3	-75	-12.1	0	0	0	111.7	F851 L852 Y855 R998 E999 L1005 F1006	F851-N1002 HydrophobicContact CE1-CB 4.38Å; L852-N1002 HydrophobicContact CD2-CB 3.79Å; L852-N1002 PolarHBondContact O-ND2 3.38Å; Y855-N1002 PolarHBondContact O-ND2 3.16Å; R998-N1002 WeakPolarHBondContact CD-ND2 3.4Å; R998-N1002 WeakPolarHBondContact O-CB 3.15Å; R998-N1002 PolarHBondContact O-N 3.3Å; E999-N1002 PolarHBondContact O-N 3.17Å; N1002-L1005 PolarHBondContact O-N 3.45Å; N1002-F1006 WeakPolarHBondContact O-CB 3.42Å; N1002-F1006 PolarHBondContact O-N 3.26Å
1003	A	97.7	Very high	96.5	Very high	1 Å²	1	10.1 Å²	10.1	1%	0.008	5%	0.052	C	C	.	.	H	α-helix	trans	-65.2	-42.8	176.1	0	0	0	0	0	112	L852 L933 V937 E999 V1000 G1001 F1006 C1007	L852-A1003 HydrophobicContact CD1-CB 4.48Å; L852-A1003 HydrophobicContact CD2-CB 3.76Å; L852-A1003 VanDerWaalsContact CD2-N 3.31Å; L933-A1003 HydrophobicContact CD2-CB 4.21Å; V937-A1003 HydrophobicContact CG2-CB 3.77Å; E999-A1003 PolarHBondContact O-N 3.24Å; V1000-A1003 PolarHBondContact O-N 3.39Å; G1001-A1003 VanDerWaalsContact C-N 3.32Å; G1001-A1003 PolarHBondContact O-N 2.9Å; A1003-F1006 PolarHBondContact O-N 3.22Å; A1003-C1007 PolarHBondContact O-N 3.07Å; A1003-C1007 VanDerWaalsContact O-N 3.14Å; A1003-C1007 PolarHBondContact O-SG 2.98Å
1004	V	96.3	Very high	96.6	Very high	2 Å²	2	10.1 Å²	10.1	1%	0.012	5%	0.051	C	C	.	.	H	α-helix	trans	-66.8	-44	177.2	174.6	0	0	0	0	110.9	V1000 G1001 F1006 C1007 L1008 F1093 L1097 I1100 M1163	V1000-V1004 VanDerWaalsContact O-CG2 3.31Å; V1000-V1004 WeakPolarHBondContact O-CG2 3.44Å; V1000-V1004 PolarHBondContact O-N 2.87Å; V1000-V1004 VanDerWaalsContact O-N 3.11Å; G1001-V1004 PolarHBondContact O-N 3.23Å; V1004-F1006 VanDerWaalsContact C-N 3.33Å; V1004-F1006 PolarHBondContact O-N 3.47Å; V1004-C1007 PolarHBondContact O-N 3.01Å; V1004-L1008 PolarHBondContact O-N 3.42Å; V1004-F1093 HydrophobicContact CG1-CE2 3.68Å; V1004-F1093 HydrophobicContact CG1-CZ 3.82Å; V1004-L1097 HydrophobicContact CG1-CD2 4.46Å; V1004-I1100 HydrophobicContact CG2-CD1 3.92Å; V1004-M1163 HydrophobicContact CG1-SD 4.33Å; V1004-M1163 HydrophobicContact CG2-CE 4.33Å; V1004-M1163 HydrophobicContact CG2-SD 3.6Å
1005	L	97.3	Very high	96.5	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-61.9	-39.8	175	-76.7	165.9	0	0	0	112.1	Y857 F864 G1001 N1002 C1007 L1008 L1009 W1159	Y857-L1005 HydrophobicContact CD1-CD1 3.54Å; Y857-L1005 HydrophobicContact CD1-CD2 3.82Å; Y857-L1005 HydrophobicContact CD1-CG 4.32Å; Y857-L1005 HydrophobicContact CE1-CD1 4.32Å; Y857-L1005 HydrophobicContact CE1-CD2 3.72Å; Y857-L1005 HydrophobicContact CG-CD1 3.71Å; F864-L1005 HydrophobicContact CE1-CD1 4.34Å; F864-L1005 HydrophobicContact CZ-CB 3.95Å; F864-L1005 HydrophobicContact CZ-CD1 4.34Å; G1001-L1005 WeakPolarHBondContact O-CB 3.27Å; G1001-L1005 VanDerWaalsContact O-CG 3.29Å; G1001-L1005 WeakPolarHBondContact O-CG 3.44Å; G1001-L1005 PolarHBondContact O-N 2.61Å; N1002-L1005 PolarHBondContact O-N 3.45Å; L1005-C1007 VanDerWaalsContact C-N 3.34Å; L1005-C1007 PolarHBondContact O-N 3.25Å; L1005-L1008 PolarHBondContact O-N 3.29Å; L1005-L1009 WeakPolarHBondContact O-CB 3.43Å; L1005-L1009 VanDerWaalsContact O-CG 3.24Å; L1005-L1009 WeakPolarHBondContact O-CG 3.23Å; L1005-L1009 PolarHBondContact O-N 3.28Å; L1005-W1159 HydrophobicContact CD1-CB 4.4Å; L1005-W1159 HydrophobicContact CD1-CG 4.06Å; L1005-W1159 HydrophobicContact CD2-CD2 3.66Å; L1005-W1159 HydrophobicContact CD2-CE3 4.14Å; L1005-W1159 HydrophobicContact CD2-CG 4.01Å; L1005-W1159 HydrophobicContact CD2-CH2 4.35Å; L1005-W1159 HydrophobicContact CD2-CZ2 3.92Å; L1005-W1159 HydrophobicContact CD2-CZ3 4.46Å; L1005-W1159 HydrophobicContact CG-CB 4.46Å; L1005-W1159 HydrophobicContact CG-CD2 4.09Å; L1005-W1159 HydrophobicContact CG-CG 4.03Å
1006	F	97.9	Very high	96.3	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.009	9%	0.093	C	C	.	.	H	α-helix	trans	-59	-47	175	-176.3	-85.2	0	0	0	111	L847 F851 F914 I917 V929 L933 N1002 A1003 V1004 L1008 L1009 I1010	L847-F1006 HydrophobicContact CD1-CD1 4.43Å; L847-F1006 HydrophobicContact CD1-CD2 4.32Å; L847-F1006 HydrophobicContact CD1-CE1 3.94Å; L847-F1006 HydrophobicContact CD1-CE2 3.84Å; L847-F1006 HydrophobicContact CD1-CZ 3.63Å; 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 4.21Å; L847-F1006 HydrophobicContact CG-CE2 4.29Å; F851-F1006 HydrophobicContact CE1-CB 4.25Å; F851-F1006 HydrophobicContact CE1-CD2 4.07Å; F851-F1006 HydrophobicContact CZ-CD2 4.47Å; F914-F1006 HydrophobicContact CD1-CD2 4.42Å; F914-F1006 HydrophobicContact CD1-CE2 4.16Å; 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 3.57Å; F914-F1006 HydrophobicContact CE1-CE2 3.57Å; F914-F1006 HydrophobicContact CE1-CG 4.17Å; F914-F1006 HydrophobicContact CE1-CZ 4.42Å; F914-F1006 HydrophobicContact CZ-CD2 4.09Å; F914-F1006 HydrophobicContact CZ-CE2 4.47Å; I917-F1006 HydrophobicContact CD1-CE2 4.39Å; I917-F1006 HydrophobicContact CG2-CZ 4.33Å; 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 3.49Å; L933-F1006 VanDerWaalsContact CD1-CD1 3.49Å; L933-F1006 HydrophobicContact CD1-CE1 4.18Å; L933-F1006 HydrophobicContact CD1-CG 4.11Å; N1002-F1006 WeakPolarHBondContact O-CB 3.42Å; N1002-F1006 PolarHBondContact O-N 3.26Å; A1003-F1006 PolarHBondContact O-N 3.22Å; V1004-F1006 VanDerWaalsContact C-N 3.33Å; V1004-F1006 PolarHBondContact O-N 3.47Å; F1006-L1008 VanDerWaalsContact C-N 3.33Å; F1006-L1008 PolarHBondContact O-N 2.97Å; F1006-L1009 PolarHBondContact O-N 3.42Å; F1006-I1010 HydrophobicContact CD1-CG2 4.31Å; F1006-I1010 HydrophobicContact CE1-CB 4.16Å; F1006-I1010 HydrophobicContact CE1-CG1 4.42Å; F1006-I1010 HydrophobicContact CE1-CG2 4.13Å; F1006-I1010 HydrophobicContact CZ-CB 4.47Å; F1006-I1010 WeakPolarHBondContact O-CB 3.33Å; F1006-I1010 VanDerWaalsContact O-CG2 3.27Å; F1006-I1010 WeakPolarHBondContact O-CG2 3.49Å; F1006-I1010 PolarHBondContact O-N 3.03Å
1007	C	96.3	Very high	96.2	Very high	4 Å²	4	18.6 Å²	18.6	3%	0.027	10%	0.098	C	C	.	.	H	α-helix	trans	-59.9	-42.4	178	-63.3	0	0	0	0	112.1	M930 A1003 V1004 L1005 I1010 E1011 I1096	M930-C1007 HydrophobicContact CE-CB 4.28Å; M930-C1007 WeakPolarHBondContact CE-O 3.43Å; A1003-C1007 PolarHBondContact O-N 3.07Å; A1003-C1007 VanDerWaalsContact O-N 3.14Å; A1003-C1007 PolarHBondContact O-SG 2.98Å; V1004-C1007 PolarHBondContact O-N 3.01Å; L1005-C1007 VanDerWaalsContact C-N 3.34Å; L1005-C1007 PolarHBondContact O-N 3.25Å; C1007-I1010 WeakPolarHBondContact O-CG2 3.35Å; C1007-E1011 WeakPolarHBondContact O-CB 3.29Å; C1007-E1011 PolarHBondContact O-N 3.43Å; C1007-I1096 HydrophobicContact CB-CG1 4.49Å; C1007-I1096 HydrophobicContact CB-CG2 4.48Å
1008	L	96	Very high	96.1	Very high	12 Å²	12	18.5 Å²	18.5	6%	0.063	10%	0.097	C	C	.	.	H	α-helix	trans	-63.2	-47.4	176.3	178.4	60.6	0	0	0	112.1	V1004 L1005 F1006 Q1012 F1093 W1159 Y1225	V1004-L1008 PolarHBondContact O-N 3.42Å; L1005-L1008 PolarHBondContact O-N 3.29Å; F1006-L1008 VanDerWaalsContact C-N 3.33Å; F1006-L1008 PolarHBondContact O-N 2.97Å; L1008-Q1012 WeakPolarHBondContact O-CG 3.46Å; L1008-Q1012 PolarHBondContact O-N 3.31Å; L1008-Q1012 VanDerWaalsContact O-N 3.16Å; L1008-F1093 HydrophobicContact CB-CD2 3.88Å; L1008-F1093 HydrophobicContact CB-CE2 3.68Å; L1008-F1093 HydrophobicContact CB-CZ 4.18Å; L1008-F1093 HydrophobicContact CD1-CD1 4.01Å; L1008-F1093 HydrophobicContact CD1-CD2 4.18Å; L1008-F1093 HydrophobicContact CD1-CE1 4.21Å; L1008-F1093 HydrophobicContact CD1-CE2 4.39Å; L1008-F1093 HydrophobicContact CD1-CG 3.99Å; L1008-F1093 HydrophobicContact CD1-CZ 4.41Å; L1008-F1093 HydrophobicContact CD2-CZ 4.37Å; L1008-F1093 HydrophobicContact CG-CE2 4.46Å; L1008-W1159 HydrophobicContact CD2-CH2 3.84Å; L1008-W1159 HydrophobicContact CD2-CZ3 4.2Å; L1008-Y1225 HydrophobicContact CD1-CE2 4.29Å
1009	L	96.4	Very high	95.9	Very high	8 Å²	8	21.5 Å²	21.5	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-77.2	-31.2	-172.7	-66.8	171.6	0	0	0	113	Y857 N862 F864 F914 L1005 F1006 S1013	Y857-L1009 HydrophobicContact CE2-CD1 3.96Å; N862-L1009 WeakPolarHBondContact OD1-CD2 3.41Å; F864-L1009 HydrophobicContact CE2-CD1 3.55Å; F864-L1009 HydrophobicContact CZ-CD1 4.01Å; F914-L1009 HydrophobicContact CD1-CB 4.21Å; F914-L1009 HydrophobicContact CD2-CB 4.38Å; F914-L1009 HydrophobicContact CE1-CB 3.94Å; F914-L1009 HydrophobicContact CE2-CB 4.16Å; F914-L1009 HydrophobicContact CE2-CD1 3.94Å; F914-L1009 HydrophobicContact CG-CB 4.44Å; F914-L1009 HydrophobicContact CZ-CB 3.94Å; F914-L1009 HydrophobicContact CZ-CD1 3.91Å; L1005-L1009 WeakPolarHBondContact O-CB 3.43Å; L1005-L1009 VanDerWaalsContact O-CG 3.24Å; L1005-L1009 WeakPolarHBondContact O-CG 3.23Å; L1005-L1009 PolarHBondContact O-N 3.28Å; F1006-L1009 PolarHBondContact O-N 3.42Å; L1009-S1013 PolarHBondContact O-N 3.39Å; L1009-S1013 VanDerWaalsContact O-N 3.08Å; L1009-S1013 PolarHBondContact O-OG 3.22Å
1010	I	96.8	Very high	95.6	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-71.6	-37	174.4	-162.5	65.4	0	0	0	111.2	F914 I917 C918 I926 M930 F1006 C1007 S1013 L1014	F914-I1010 HydrophobicContact CD1-CB 4.34Å; F914-I1010 HydrophobicContact CD1-CD1 4.11Å; I917-I1010 HydrophobicContact CB-CD1 4.15Å; I917-I1010 HydrophobicContact CG2-CD1 3.81Å; C918-I1010 HydrophobicContact CB-CD1 4.06Å; I926-I1010 HydrophobicContact CD1-CG1 4.37Å; I926-I1010 HydrophobicContact CG1-CG1 4.21Å; I926-I1010 HydrophobicContact CG2-CG1 4.33Å; I926-I1010 HydrophobicContact CG2-CG2 4.29Å; M930-I1010 HydrophobicContact CE-CG2 3.48Å; M930-I1010 VanDerWaalsContact CE-CG2 3.48Å; F1006-I1010 HydrophobicContact CD1-CG2 4.31Å; F1006-I1010 HydrophobicContact CE1-CB 4.16Å; F1006-I1010 HydrophobicContact CE1-CG1 4.42Å; F1006-I1010 HydrophobicContact CE1-CG2 4.13Å; F1006-I1010 HydrophobicContact CZ-CB 4.47Å; F1006-I1010 WeakPolarHBondContact O-CB 3.33Å; F1006-I1010 VanDerWaalsContact O-CG2 3.27Å; F1006-I1010 WeakPolarHBondContact O-CG2 3.49Å; F1006-I1010 PolarHBondContact O-N 3.03Å; C1007-I1010 WeakPolarHBondContact O-CG2 3.35Å; I1010-S1013 PolarHBondContact O-N 2.91Å; I1010-L1014 WeakPolarHBondContact O-CB 3.46Å; I1010-L1014 PolarHBondContact O-N 3.41Å
1011	E	95.7	Very high	95.4	Very high	19 Å²	19	26.3 Å²	26.3	9%	0.089	15%	0.147	C	C	.	.	H	α-helix	trans	-64.1	-41	173.5	179	176.8	178.7	0	0	112.1	M930 C1007 S1013 L1014 S1015 S1091 M1092 F1093	M930-E1011 HydrophobicContact CE-CB 4.41Å; C1007-E1011 WeakPolarHBondContact O-CB 3.29Å; C1007-E1011 PolarHBondContact O-N 3.43Å; E1011-S1013 VanDerWaalsContact C-N 3.3Å; E1011-S1013 PolarHBondContact O-N 3.18Å; E1011-L1014 PolarHBondContact O-N 3.42Å; E1011-S1015 PolarHBondContact O-N 3.14Å; E1011-S1015 PolarHBondContact O-OG 2.85Å; E1011-S1091 VanDerWaalsContact OE1-CA 3.25Å; E1011-S1091 WeakPolarHBondContact OE1-CA 3.28Å; E1011-S1091 WeakPolarHBondContact OE1-CB 3.49Å; E1011-M1092 HydrophobicContact CB-CE 3.92Å; E1011-M1092 HydrophobicContact CG-CE 3.75Å; E1011-M1092 PolarHBondContact OE1-N 3.16Å; E1011-M1092 PolarHBondContact OE2-N 3.41Å; E1011-F1093 WeakPolarHBondContact OE2-CB 3.09Å; E1011-F1093 PolarHBondContact OE2-N 3.36Å
1012	Q	94.6	Very high	95.2	Very high	78 Å²	78	28 Å²	28	36%	0.364	16%	0.156	S	C	.	.	H	α-helix	trans	-61	-42.2	173.8	-72.8	174.3	20	0	0	111.4	L1008 S1015 L1016	L1008-Q1012 WeakPolarHBondContact O-CG 3.46Å; L1008-Q1012 PolarHBondContact O-N 3.31Å; L1008-Q1012 VanDerWaalsContact O-N 3.16Å; Q1012-S1015 PolarHBondContact O-N 3.26Å; Q1012-L1016 WeakPolarHBondContact O-CG 3.49Å; Q1012-L1016 PolarHBondContact O-N 3.05Å; Q1012-L1016 VanDerWaalsContact O-N 3.07Å
1013	S	95.3	Very high	95	Very high	14 Å²	14	33.9 Å²	33.9	10%	0.098	19%	0.186	C	C	.	.	H	α-helix	trans	-66.7	-39.8	179.2	-57.5	0	0	0	0	111.5	F914 L1009 I1010 E1011 L1016 E1017	F914-S1013 VanDerWaalsContact CB-OG 3.25Å; F914-S1013 WeakPolarHBondContact CB-OG 3.25Å; L1009-S1013 PolarHBondContact O-N 3.39Å; L1009-S1013 VanDerWaalsContact O-N 3.08Å; L1009-S1013 PolarHBondContact O-OG 3.22Å; I1010-S1013 PolarHBondContact O-N 2.91Å; E1011-S1013 VanDerWaalsContact C-N 3.3Å; E1011-S1013 PolarHBondContact O-N 3.18Å; S1013-L1016 PolarHBondContact O-N 3.36Å; S1013-E1017 PolarHBondContact O-N 3.18Å
1014	L	94.4	Very high	94.7	Very high	8 Å²	8	40.6 Å²	40.6	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-62	-43.4	173.5	-176.8	59.8	0	0	0	111.9	C918 Y923 I926 I1010 E1011 L1016 E1017 E1018 L1086 M1092	C918-L1014 WeakPolarHBondContact SG-CA 3.43Å; C918-L1014 VanDerWaalsContact SG-CD1 3.59Å; Y923-L1014 HydrophobicContact CD1-CD1 4.26Å; Y923-L1014 HydrophobicContact CD1-CD2 4.07Å; Y923-L1014 HydrophobicContact CE1-CD1 3.8Å; Y923-L1014 HydrophobicContact CE1-CD2 3.92Å; Y923-L1014 HydrophobicContact CE1-CG 4.23Å; I926-L1014 HydrophobicContact CD1-CD1 4.16Å; I926-L1014 HydrophobicContact CD1-CD2 4.14Å; I1010-L1014 WeakPolarHBondContact O-CB 3.46Å; I1010-L1014 PolarHBondContact O-N 3.41Å; E1011-L1014 PolarHBondContact O-N 3.42Å; L1014-L1016 VanDerWaalsContact C-N 3.29Å; L1014-L1016 PolarHBondContact O-N 3.11Å; L1014-E1017 PolarHBondContact O-N 3.18Å; L1014-E1018 HydrophobicContact CD1-CG 4.28Å; L1014-E1018 HydrophobicContact CG-CG 4.45Å; L1014-E1018 WeakPolarHBondContact O-CB 3.27Å; L1014-E1018 VanDerWaalsContact O-CG 3.29Å; L1014-E1018 WeakPolarHBondContact O-CG 3.24Å; L1014-E1018 PolarHBondContact O-N 2.9Å; L1014-L1086 HydrophobicContact CD2-CD1 3.69Å; L1014-M1092 HydrophobicContact CD2-CE 3.89Å
1015	S	94.3	Very high	94.6	Very high	43 Å²	43	41.1 Å²	41.1	30%	0.301	22%	0.221	S	C	.	.	H	α-helix	trans	-60.8	-39	176.4	-58	0	0	0	0	112.3	E1011 Q1012 V1019	E1011-S1015 PolarHBondContact O-N 3.14Å; E1011-S1015 PolarHBondContact O-OG 2.85Å; Q1012-S1015 PolarHBondContact O-N 3.26Å; S1015-V1019 WeakPolarHBondContact O-CG1 3.47Å; S1015-V1019 PolarHBondContact O-N 3.34Å; S1015-V1019 VanDerWaalsContact O-N 3.09Å
1016	L	93.6	Very high	94.4	Very high	117 Å²	117	41.9 Å²	41.9	61%	0.613	23%	0.228	S	C	*	.	H	α-helix	trans	-68.7	-37.2	176.2	-70.2	174.1	0	0	0	112.4	Q1012 S1013 L1014 V1019 C1020	Q1012-L1016 WeakPolarHBondContact O-CG 3.49Å; Q1012-L1016 PolarHBondContact O-N 3.05Å; Q1012-L1016 VanDerWaalsContact O-N 3.07Å; S1013-L1016 PolarHBondContact O-N 3.36Å; L1014-L1016 VanDerWaalsContact C-N 3.29Å; L1014-L1016 PolarHBondContact O-N 3.11Å; L1016-V1019 VanDerWaalsContact O-CG1 3.31Å; L1016-V1019 WeakPolarHBondContact O-CG1 3.45Å; L1016-C1020 PolarHBondContact O-N 3.08Å; L1016-C1020 PolarHBondContact O-SG 3.28Å; L1016-C1020 VanDerWaalsContact O-SG 3.41Å
1017	E	93.3	Very high	94.2	Very high	48 Å²	48	44.3 Å²	44.3	22%	0.224	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-49.4	175.4	-172	170	154.7	0	0	111	C918 R919 S1013 L1014 V1019 C1020 D1021	C918-E1017 PolarHBondContact SG-OE2 2.89Å; R919-E1017 WeakPolarHBondContact CG-OE1 3.37Å; R919-E1017 VanDerWaalsContact CG-OE2 3.23Å; R919-E1017 WeakPolarHBondContact CG-OE2 3.3Å; R919-E1017 PolarHBondContact N-OE2 3.31Å; S1013-E1017 PolarHBondContact O-N 3.18Å; L1014-E1017 PolarHBondContact O-N 3.18Å; E1017-V1019 PolarHBondContact O-N 3.25Å; E1017-C1020 WeakPolarHBondContact O-CB 3.49Å; E1017-C1020 PolarHBondContact O-N 3.13Å; E1017-C1020 VanDerWaalsContact O-N 3.16Å; E1017-D1021 PolarHBondContact O-N 3.5Å
1018	E	93.8	Very high	94.2	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-41.5	-179.5	-71	177.9	145.8	0	0	113.2	Y923 L1014 C1020 D1021 L1022 R1085 L1086 C1087	Y923-E1018 VanDerWaalsContact CE1-OE1 3.23Å; Y923-E1018 WeakPolarHBondContact CE1-OE1 3.44Å; Y923-E1018 VanDerWaalsContact CZ-OE1 3.27Å; Y923-E1018 WeakPolarHBondContact OH-CG 3.3Å; Y923-E1018 PolarHBondContact OH-OE1 3.19Å; L1014-E1018 HydrophobicContact CD1-CG 4.28Å; L1014-E1018 HydrophobicContact CG-CG 4.45Å; L1014-E1018 WeakPolarHBondContact O-CB 3.27Å; L1014-E1018 VanDerWaalsContact O-CG 3.29Å; L1014-E1018 WeakPolarHBondContact O-CG 3.24Å; L1014-E1018 PolarHBondContact O-N 2.9Å; E1018-C1020 VanDerWaalsContact C-N 3.29Å; E1018-C1020 PolarHBondContact O-N 3Å; E1018-D1021 WeakPolarHBondContact O-CB 3.25Å; E1018-D1021 PolarHBondContact O-N 3.31Å; E1018-L1022 WeakPolarHBondContact O-CG 3.4Å; E1018-L1022 PolarHBondContact O-N 3.06Å; E1018-R1085 HydrophobicContact CB-CB 3.97Å; E1018-R1085 HydrophobicContact CB-CG 4.38Å; E1018-R1085 HydrophobicContact CG-CB 3.99Å; E1018-L1086 WeakPolarHBondContact OE1-CB 3.31Å; E1018-L1086 PolarHBondContact OE1-N 3.08Å; E1018-L1086 PolarHBondContact OE2-N 3.48Å; E1018-C1087 HydrophobicContact CB-CB 4.37Å; E1018-C1087 WeakPolarHBondContact OE2-CB 3.42Å; E1018-C1087 PolarHBondContact OE2-N 2.91Å
1019	V	94.2	Very high	94.1	Very high	64 Å²	64	49.8 Å²	49.8	39%	0.388	27%	0.267	S	S	.	.	H	α-helix	trans	-66.3	-35	178.1	70.6	0	0	0	0	111.3	S1015 L1016 E1017 L1022 L1023	S1015-V1019 WeakPolarHBondContact O-CG1 3.47Å; S1015-V1019 PolarHBondContact O-N 3.34Å; S1015-V1019 VanDerWaalsContact O-N 3.09Å; L1016-V1019 VanDerWaalsContact O-CG1 3.31Å; L1016-V1019 WeakPolarHBondContact O-CG1 3.45Å; E1017-V1019 PolarHBondContact O-N 3.25Å; V1019-L1022 PolarHBondContact O-N 3.41Å; V1019-L1023 VanDerWaalsContact O-CG 3.26Å; V1019-L1023 WeakPolarHBondContact O-CG 3.4Å; V1019-L1023 PolarHBondContact O-N 3.45Å
1020	C	92.1	Very high	93.9	Very high	65 Å²	65	51.4 Å²	51.4	44%	0.439	28%	0.276	S	S	.	.	H	α-helix	trans	-65.3	-40.9	173.4	-77.5	0	0	0	0	111.6	L1016 E1017 E1018 L1023 H1024	L1016-C1020 PolarHBondContact O-N 3.08Å; L1016-C1020 PolarHBondContact O-SG 3.28Å; L1016-C1020 VanDerWaalsContact O-SG 3.41Å; E1017-C1020 WeakPolarHBondContact O-CB 3.49Å; E1017-C1020 PolarHBondContact O-N 3.13Å; E1017-C1020 VanDerWaalsContact O-N 3.16Å; E1018-C1020 VanDerWaalsContact C-N 3.29Å; E1018-C1020 PolarHBondContact O-N 3Å; C1020-L1023 PolarHBondContact O-N 3.28Å; C1020-H1024 PolarHBondContact O-N 3.03Å; C1020-H1024 PolarHBondContact O-ND1 3.29Å
1021	D	92.3	Very high	93.8	Very high	65 Å²	65	56 Å²	56	35%	0.348	30%	0.3	S	S	.	.	H	α-helix	trans	-60.2	-47.7	174.5	-68.8	-18.4	0	0	0	111.2	E1017 E1018 L1023 H1024 A1025 R1085	E1017-D1021 PolarHBondContact O-N 3.5Å; E1018-D1021 WeakPolarHBondContact O-CB 3.25Å; E1018-D1021 PolarHBondContact O-N 3.31Å; D1021-L1023 VanDerWaalsContact C-N 3.31Å; D1021-L1023 PolarHBondContact O-N 3.31Å; D1021-H1024 PolarHBondContact O-N 3.26Å; D1021-H1024 VanDerWaalsContact O-N 3.11Å; D1021-A1025 WeakPolarHBondContact O-CB 3.41Å; D1021-A1025 PolarHBondContact O-N 3.47Å; D1021-R1085 IonicContact OD2-CZ 2.77Å; D1021-R1085 IonicContact OD2-NH2 3.77Å; D1021-R1085 PolarHBondContact OD2-NH2 3.27Å
1022	L	93.5	Very high	93.6	Very high	36 Å²	36	56.8 Å²	56.8	19%	0.188	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-37.8	179.1	-71.6	171.8	0	0	0	112.5	E1018 V1019 H1024 A1025 A1026 T1082 R1085	E1018-L1022 WeakPolarHBondContact O-CG 3.4Å; E1018-L1022 PolarHBondContact O-N 3.06Å; V1019-L1022 PolarHBondContact O-N 3.41Å; L1022-H1024 VanDerWaalsContact C-N 3.31Å; L1022-H1024 PolarHBondContact O-N 3.48Å; L1022-A1025 PolarHBondContact O-N 2.93Å; L1022-A1026 WeakPolarHBondContact O-CB 3.5Å; L1022-A1026 PolarHBondContact O-N 2.9Å; L1022-T1082 VanDerWaalsContact CD2-O 3.32Å; L1022-T1082 WeakPolarHBondContact CD2-O 3.26Å; L1022-R1085 HydrophobicContact CD1-CB 4.38Å; L1022-R1085 HydrophobicContact CD1-CG 4.13Å; L1022-R1085 HydrophobicContact CD2-CG 3.93Å; L1022-R1085 HydrophobicContact CG-CG 3.99Å
1023	L	93.8	Very high	93.5	Very high	122 Å²	122	58 Å²	58	64%	0.639	32%	0.319	S	S	*	.	H	α-helix	trans	-63.9	-35.9	175.8	-74.1	171.4	0	0	0	112.4	V1019 C1020 D1021	V1019-L1023 VanDerWaalsContact O-CG 3.26Å; V1019-L1023 WeakPolarHBondContact O-CG 3.4Å; V1019-L1023 PolarHBondContact O-N 3.45Å; C1020-L1023 PolarHBondContact O-N 3.28Å; D1021-L1023 VanDerWaalsContact C-N 3.31Å; D1021-L1023 PolarHBondContact O-N 3.31Å
1024	H	91.8	Very high	93.2	Very high	143 Å²	143	67.6 Å²	67.6	66%	0.662	35%	0.353	S	S	*	.	H	α-helix	trans	-76.9	-30.6	175.1	-70.2	89.9	0	0	0	112.5	C1020 D1021 L1022 P1027	C1020-H1024 PolarHBondContact O-N 3.03Å; C1020-H1024 PolarHBondContact O-ND1 3.29Å; D1021-H1024 PolarHBondContact O-N 3.26Å; D1021-H1024 VanDerWaalsContact O-N 3.11Å; L1022-H1024 VanDerWaalsContact C-N 3.31Å; L1022-H1024 PolarHBondContact O-N 3.48Å; H1024-P1027 WeakPolarHBondContact O-CD 3.42Å
1025	A	93.3	Very high	93	Very high	12 Å²	12	69 Å²	69	10%	0.099	36%	0.362	C	S	.	.	H	α-helix	trans	-74.1	-30.6	176.7	0	0	0	0	0	113	D1021 L1022 P1027 F1028 Q1029 T1082	D1021-A1025 WeakPolarHBondContact O-CB 3.41Å; D1021-A1025 PolarHBondContact O-N 3.47Å; L1022-A1025 PolarHBondContact O-N 2.93Å; A1025-P1027 VanDerWaalsContact C-CD 3.46Å; A1025-P1027 VanDerWaalsContact O-N 3.15Å; A1025-F1028 PolarHBondContact O-N 2.89Å; A1025-Q1029 HydrophobicContact CB-CG 4.46Å; A1025-Q1029 PolarHBondContact O-N 2.85Å; A1025-Q1029 VanDerWaalsContact O-N 3.17Å; A1025-T1082 HydrophobicContact CB-CG2 3.46Å; A1025-T1082 VanDerWaalsContact CB-CG2 3.46Å
1026	A	93.9	Very high	92.8	Very high	17 Å²	17	73.8 Å²	73.8	14%	0.14	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-45.9	-172.5	0	0	0	0	0	115.4	L1022 F1028 Q1029 N1030 I1031	L1022-A1026 WeakPolarHBondContact O-CB 3.5Å; L1022-A1026 PolarHBondContact O-N 2.9Å; A1026-F1028 VanDerWaalsContact C-N 3.28Å; A1026-F1028 PolarHBondContact O-N 3.29Å; A1026-Q1029 PolarHBondContact O-N 3.15Å; A1026-N1030 PolarHBondContact O-N 3.46Å; A1026-I1031 HydrophobicContact CB-CB 3.87Å; A1026-I1031 HydrophobicContact CB-CG2 4.21Å; A1026-I1031 PolarHBondContact O-N 3.23Å
1027	P	94	Very high	92.6	Very high	53 Å²	53	70.5 Å²	70.5	34%	0.344	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-31.8	178.4	-22.6	35	0	0	0	114.1	H1024 A1025	H1024-P1027 WeakPolarHBondContact O-CD 3.42Å; A1025-P1027 VanDerWaalsContact C-CD 3.46Å; A1025-P1027 VanDerWaalsContact O-N 3.15Å
1028	F	95.1	Very high	92.3	Very high	105 Å²	105	74.9 Å²	74.9	46%	0.461	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-18.1	-177.4	-54.5	-72.9	0	0	0	112.8	A1025 A1026 L1057 H1058 L1059	A1025-F1028 PolarHBondContact O-N 2.89Å; A1026-F1028 VanDerWaalsContact C-N 3.28Å; A1026-F1028 PolarHBondContact O-N 3.29Å; F1028-L1057 WeakPolarHBondContact CA-O 3.33Å; F1028-H1058 WeakPolarHBondContact O-CA 3.49Å; F1028-H1058 PolarHBondContact O-CD2 2.79Å; F1028-L1059 HydrophobicContact CB-CB 4.38Å; F1028-L1059 PolarHBondContact O-N 3.47Å
1029	Q	94	Very high	91.4	Very high	26 Å²	26	84.7 Å²	84.7	12%	0.121	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	12	178.2	-60.3	-171.5	-44.1	0	0	113.1	A1025 A1026 I1031 D1079	A1025-Q1029 HydrophobicContact CB-CG 4.46Å; A1025-Q1029 PolarHBondContact O-N 2.85Å; A1025-Q1029 VanDerWaalsContact O-N 3.17Å; A1026-Q1029 PolarHBondContact O-N 3.15Å; Q1029-I1031 VanDerWaalsContact C-N 3.29Å; Q1029-I1031 HydrophobicContact CB-CD1 4.3Å; Q1029-I1031 HydrophobicContact CB-CG1 4.35Å; Q1029-I1031 PolarHBondContact O-N 3.43Å; Q1029-D1079 WeakPolarHBondContact CG-OD1 3.19Å; Q1029-D1079 PolarHBondContact NE2-O 3.44Å; Q1029-D1079 PolarHBondContact NE2-OD1 3.5Å
1030	N	93.4	Very high	90.8	Very high	42 Å²	42	85.8 Å²	85.8	23%	0.225	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	30.7	179.9	-163.9	40.8	0	0	0	114.5	A1026 E1051	A1026-N1030 PolarHBondContact O-N 3.46Å; N1030-E1051 PolarHBondContact ND2-OE1 3.08Å
1031	I	93.5	Very high	90.6	Very high	98 Å²	98	86 Å²	86	50%	0.503	45%	0.447	S	S	.	.			trans	-95.8	114.9	175.8	-58.6	173	0	0	0	108.5	A1026 Q1029	A1026-I1031 HydrophobicContact CB-CB 3.87Å; A1026-I1031 HydrophobicContact CB-CG2 4.21Å; A1026-I1031 PolarHBondContact O-N 3.23Å; Q1029-I1031 VanDerWaalsContact C-N 3.29Å; Q1029-I1031 HydrophobicContact CB-CD1 4.3Å; Q1029-I1031 HydrophobicContact CB-CG1 4.35Å; Q1029-I1031 PolarHBondContact O-N 3.43Å
1032	L	91.4	Very high	90.3	Very high	36 Å²	36	92.5 Å²	92.5	19%	0.188	47%	0.466	C	S	.	.			trans	-115	139.2	-177.3	-65.4	175.5	0	0	0	111.7	M1047 L1050 E1051 Y1054	L1032-M1047 HydrophobicContact CB-CE 4Å; L1032-L1050 HydrophobicContact CD1-CB 4.19Å; L1032-L1050 HydrophobicContact CD1-CD2 4.27Å; L1032-L1050 HydrophobicContact CD1-CG 4Å; L1032-E1051 HydrophobicContact CD1-CB 4.21Å; L1032-Y1054 HydrophobicContact CD1-CD2 4.3Å; L1032-Y1054 HydrophobicContact CD2-CD2 3.5Å; L1032-Y1054 VanDerWaalsContact CD2-CD2 3.5Å; L1032-Y1054 HydrophobicContact CD2-CE2 3.98Å; L1032-Y1054 HydrophobicContact CD2-CG 4.2Å
1033	P	92.4	Very high	90	Very high	104 Å²	104	93.4 Å²	93.4	68%	0.675	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-69.1	156.8	175	30.8	-35.3	0	0	0	110.9	V1035	P1033-V1035 PolarHBondContact O-N 3.32Å; P1033-V1035 VanDerWaalsContact O-N 3.15Å
1034	R	89.6	Confident	89.6	Confident	214 Å²	214	93.2 Å²	93.2	81%	0.808	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-62.3	117.5	176.7	-171.1	174.2	-177.1	178	0.7	110.6	L1043	R1034-L1043 HydrophobicContact CG-CD1 4.27Å
1035	V	89.9	Confident	89.4	Confident	39 Å²	39	88.5 Å²	88.5	24%	0.236	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-81.2	144.4	-178.5	68.8	0	0	0	0	112.1	P1033 V1037 L1043 K1046 M1047 L1050	P1033-V1035 PolarHBondContact O-N 3.32Å; P1033-V1035 VanDerWaalsContact O-N 3.15Å; V1035-V1037 PolarHBondContact O-N 3.23Å; V1035-L1043 HydrophobicContact CG1-CD1 4.11Å; V1035-K1046 HydrophobicContact CG1-CB 4.11Å; V1035-K1046 HydrophobicContact CG1-CD 3.91Å; V1035-K1046 HydrophobicContact CG1-CG 3.87Å; V1035-K1046 HydrophobicContact CG2-CD 4.19Å; V1035-M1047 HydrophobicContact CB-SD 4.32Å; V1035-M1047 HydrophobicContact CG1-CG 4.32Å; V1035-M1047 HydrophobicContact CG1-SD 3.79Å; V1035-L1050 HydrophobicContact CB-CD2 4.39Å
1036	H	89.4	Confident	89.1	Confident	143 Å²	143	90.1 Å²	90.1	66%	0.662	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-65.1	130.9	172.7	179.9	66.3	0	0	0	111.2	K1046	H1036-K1046 WeakPolarHBondContact O-CE 3.47Å; H1036-K1046 PolarHBondContact O-NZ 2.86Å
1037	V	90.8	Very high	88.9	Confident	47 Å²	47	91.7 Å²	91.7	29%	0.285	47%	0.466	S	S	.	.			trans	-111.2	120.9	-176.6	-175	0	0	0	0	108.8	V1035 E1041 L1043	V1035-V1037 PolarHBondContact O-N 3.23Å; V1037-E1041 HydrophobicContact CG1-CB 3.64Å; V1037-E1041 WeakPolarHBondContact CG1-O 3.3Å; V1037-L1043 HydrophobicContact CG2-CB 3.97Å; V1037-L1043 HydrophobicContact CG2-CD1 3.53Å; V1037-L1043 HydrophobicContact CG2-CG 4.36Å
1038	K	86.9	Confident	88.7	Confident	141 Å²	141	96 Å²	96	61%	0.613	48%	0.48	S	S	*	.			trans	-81.8	162.2	176.2	-68.7	-175.1	177.6	-178.4	0	110.9	G1040 E1041	K1038-G1040 PolarHBondContact O-N 2.95Å; K1038-E1041 PolarHBondContact N-OE2 3.08Å; K1038-E1041 VanDerWaalsContact N-OE2 3.17Å; K1038-E1041 WeakPolarHBondContact O-CB 3.29Å; K1038-E1041 PolarHBondContact O-N 3.19Å
1039	E	73.8	Confident	88.4	Confident	207 Å²	207	98.5 Å²	98.5	97%	0.967	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	125.1	175.7	-164	177.3	-178.5	0	0	110.5
1040	G	82.5	Confident	88.2	Confident	86 Å²	86	99.1 Å²	99.1	89%	0.887	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.7	-6.9	-174	0	0	0	0	0	115.9	K1038	K1038-G1040 PolarHBondContact O-N 2.95Å
1041	E	88.2	Confident	88.2	Confident	70 Å²	70	101.1 Å²	101.1	33%	0.327	50%	0.498	S	S	.	.			trans	-99.2	148.4	174	-64.4	179.7	152.7	0	0	111.9	V1037 K1038 K1046	V1037-E1041 HydrophobicContact CG1-CB 3.64Å; V1037-E1041 WeakPolarHBondContact CG1-O 3.3Å; K1038-E1041 PolarHBondContact N-OE2 3.08Å; K1038-E1041 VanDerWaalsContact N-OE2 3.17Å; K1038-E1041 WeakPolarHBondContact O-CB 3.29Å; K1038-E1041 PolarHBondContact O-N 3.19Å; E1041-K1046 IonicContact OE1-NZ 3.7Å; E1041-K1046 WeakPolarHBondContact OE2-CD 3.42Å; E1041-K1046 WeakPolarHBondContact OE2-CE 3.26Å; E1041-K1046 IonicContact OE2-NZ 2.7Å; E1041-K1046 PolarHBondContact OE2-NZ 3.47Å
1042	R	85.9	Confident	88.1	Confident	201 Å²	201	100.7 Å²	100.7	76%	0.758	50%	0.503	S	S	*	.			trans	-101.9	135.9	169.9	-66.2	-174.5	-178.1	-177.2	0.9	110.1	D1044 A1045 K1046	R1042-D1044 VanDerWaalsContact C-N 3.32Å; R1042-D1044 PolarHBondContact O-N 3.23Å; R1042-A1045 HydrophobicContact CB-CB 4.2Å; R1042-A1045 PolarHBondContact O-N 3.39Å; R1042-K1046 PolarHBondContact O-N 2.84Å; R1042-K1046 VanDerWaalsContact O-N 3.11Å
1043	L	86.3	Confident	88.1	Confident	55 Å²	55	105.5 Å²	105.5	29%	0.288	52%	0.523	S	S	.	.	H	α-helix	trans	-53.8	-48.5	179.3	-177.3	63.7	0	0	0	111.3	R1034 V1035 V1037 A1045 K1046 M1047	R1034-L1043 HydrophobicContact CG-CD1 4.27Å; V1035-L1043 HydrophobicContact CG1-CD1 4.11Å; V1037-L1043 HydrophobicContact CG2-CB 3.97Å; V1037-L1043 HydrophobicContact CG2-CD1 3.53Å; V1037-L1043 HydrophobicContact CG2-CG 4.36Å; L1043-A1045 VanDerWaalsContact C-N 3.33Å; L1043-A1045 PolarHBondContact O-N 2.96Å; L1043-K1046 PolarHBondContact O-N 2.85Å; L1043-K1046 VanDerWaalsContact O-N 3.08Å; L1043-M1047 HydrophobicContact CD1-CG 4.01Å; L1043-M1047 HydrophobicContact CG-CG 4.18Å; L1043-M1047 WeakPolarHBondContact O-CB 3.49Å; L1043-M1047 WeakPolarHBondContact O-CG 3.37Å; L1043-M1047 PolarHBondContact O-N 3.44Å
1044	D	86.3	Confident	88.2	Confident	118 Å²	118	104.3 Å²	104.3	63%	0.631	51%	0.506	S	S	*	.	H	α-helix	trans	-61	-41.3	-178.5	-53.5	-34.7	0	0	0	112.5	R1042 K1046 K1048	R1042-D1044 VanDerWaalsContact C-N 3.32Å; R1042-D1044 PolarHBondContact O-N 3.23Å; D1044-K1046 VanDerWaalsContact C-N 3.27Å; D1044-K1046 PolarHBondContact O-N 3.39Å; D1044-K1048 WeakPolarHBondContact O-CB 3.34Å; D1044-K1048 WeakPolarHBondContact O-CG 3.47Å; D1044-K1048 PolarHBondContact O-N 3.26Å
1045	A	86.7	Confident	88.3	Confident	44 Å²	44	96.7 Å²	96.7	36%	0.364	49%	0.488	S	S	.	.	H	α-helix	trans	-70.1	-26	179.3	0	0	0	0	0	112.3	R1042 L1043 R1049	R1042-A1045 HydrophobicContact CB-CB 4.2Å; R1042-A1045 PolarHBondContact O-N 3.39Å; L1043-A1045 VanDerWaalsContact C-N 3.33Å; L1043-A1045 PolarHBondContact O-N 2.96Å; A1045-R1049 WeakPolarHBondContact O-CG 3.09Å; A1045-R1049 PolarHBondContact O-NE 3.11Å
1046	K	88.1	Confident	88.5	Confident	47 Å²	47	98.8 Å²	98.8	20%	0.204	50%	0.503	C	S	.	.	H	α-helix	trans	-86.3	-39.8	177.9	-161.1	170.3	-173	170.7	0	111.7	V1035 H1036 E1041 R1042 L1043 D1044 R1049 L1050	V1035-K1046 HydrophobicContact CG1-CB 4.11Å; V1035-K1046 HydrophobicContact CG1-CD 3.91Å; V1035-K1046 HydrophobicContact CG1-CG 3.87Å; V1035-K1046 HydrophobicContact CG2-CD 4.19Å; H1036-K1046 WeakPolarHBondContact O-CE 3.47Å; H1036-K1046 PolarHBondContact O-NZ 2.86Å; E1041-K1046 IonicContact OE1-NZ 3.7Å; E1041-K1046 WeakPolarHBondContact OE2-CD 3.42Å; E1041-K1046 WeakPolarHBondContact OE2-CE 3.26Å; E1041-K1046 IonicContact OE2-NZ 2.7Å; E1041-K1046 PolarHBondContact OE2-NZ 3.47Å; R1042-K1046 PolarHBondContact O-N 2.84Å; R1042-K1046 VanDerWaalsContact O-N 3.11Å; L1043-K1046 PolarHBondContact O-N 2.85Å; L1043-K1046 VanDerWaalsContact O-N 3.08Å; D1044-K1046 VanDerWaalsContact C-N 3.27Å; D1044-K1046 PolarHBondContact O-N 3.39Å; K1046-R1049 PolarHBondContact O-N 2.98Å; K1046-L1050 PolarHBondContact O-N 2.99Å
1047	M	88.8	Confident	88.6	Confident	50 Å²	50	95.6 Å²	95.6	25%	0.246	49%	0.49	C	S	.	.	H	α-helix	trans	-60.8	-46	173.7	-72.8	-62	-66.3	0	0	111.3	L1032 V1035 L1043 R1049 L1050 E1051	L1032-M1047 HydrophobicContact CB-CE 4Å; V1035-M1047 HydrophobicContact CB-SD 4.32Å; V1035-M1047 HydrophobicContact CG1-CG 4.32Å; V1035-M1047 HydrophobicContact CG1-SD 3.79Å; L1043-M1047 HydrophobicContact CD1-CG 4.01Å; L1043-M1047 HydrophobicContact CG-CG 4.18Å; L1043-M1047 WeakPolarHBondContact O-CB 3.49Å; L1043-M1047 WeakPolarHBondContact O-CG 3.37Å; L1043-M1047 PolarHBondContact O-N 3.44Å; M1047-R1049 VanDerWaalsContact C-N 3.31Å; M1047-R1049 PolarHBondContact O-N 3.08Å; M1047-L1050 PolarHBondContact O-N 3.31Å; M1047-L1050 VanDerWaalsContact O-N 3.1Å; M1047-E1051 WeakPolarHBondContact O-CB 3.21Å; M1047-E1051 PolarHBondContact O-N 3.37Å
1048	K	89.9	Confident	88.8	Confident	144 Å²	144	95.7 Å²	95.7	63%	0.626	49%	0.487	S	S	*	.	H	α-helix	trans	-61.6	-35.9	175.5	-74.3	-175.5	178	-173.6	0	113.7	D1044 S1052	D1044-K1048 WeakPolarHBondContact O-CB 3.34Å; D1044-K1048 WeakPolarHBondContact O-CG 3.47Å; D1044-K1048 PolarHBondContact O-N 3.26Å; K1048-S1052 WeakPolarHBondContact O-CB 3.44Å; K1048-S1052 PolarHBondContact O-N 3.13Å; K1048-S1052 PolarHBondContact O-OG 3.45Å
1049	R	88.7	Confident	89.1	Confident	157 Å²	157	92.9 Å²	92.9	59%	0.592	48%	0.479	S	S	*	.	H	α-helix	trans	-67.6	-38.4	174.4	-80.5	-174.8	-87.3	-175.5	-4.2	111.6	A1045 K1046 M1047 S1052 K1053	A1045-R1049 WeakPolarHBondContact O-CG 3.09Å; A1045-R1049 PolarHBondContact O-NE 3.11Å; K1046-R1049 PolarHBondContact O-N 2.98Å; M1047-R1049 VanDerWaalsContact C-N 3.31Å; M1047-R1049 PolarHBondContact O-N 3.08Å; R1049-S1052 PolarHBondContact O-N 3.04Å; R1049-K1053 PolarHBondContact O-N 3.49Å; R1049-K1053 VanDerWaalsContact O-N 3.14Å
1050	L	89.5	Confident	90.1	Very high	39 Å²	39	84 Å²	84	20%	0.204	44%	0.438	C	S	.	.	H	α-helix	trans	-72	-38.8	177.2	-164.7	63.7	0	0	0	112	L1032 V1035 K1046 M1047 S1052 K1053 Y1054	L1032-L1050 HydrophobicContact CD1-CB 4.19Å; L1032-L1050 HydrophobicContact CD1-CD2 4.27Å; L1032-L1050 HydrophobicContact CD1-CG 4Å; V1035-L1050 HydrophobicContact CB-CD2 4.39Å; K1046-L1050 PolarHBondContact O-N 2.99Å; M1047-L1050 PolarHBondContact O-N 3.31Å; M1047-L1050 VanDerWaalsContact O-N 3.1Å; L1050-S1052 VanDerWaalsContact C-N 3.34Å; L1050-K1053 HydrophobicContact CD1-CD 4.27Å; L1050-K1053 WeakPolarHBondContact O-CB 3.36Å; L1050-K1053 PolarHBondContact O-N 3.36Å; L1050-K1053 VanDerWaalsContact O-N 3.14Å; L1050-Y1054 HydrophobicContact CD1-CD2 4.18Å; L1050-Y1054 HydrophobicContact CD1-CE2 3.7Å; L1050-Y1054 HydrophobicContact CG-CD2 4.08Å; L1050-Y1054 HydrophobicContact CG-CE2 3.95Å; L1050-Y1054 WeakPolarHBondContact O-CD2 3.42Å; L1050-Y1054 PolarHBondContact O-N 3.45Å; L1050-Y1054 VanDerWaalsContact O-N 3.13Å
1051	E	92.7	Very high	90.7	Very high	84 Å²	84	82.5 Å²	82.5	39%	0.393	41%	0.413	S	S	.	.	H	α-helix	trans	-58.8	-45.5	170.8	-176.1	174.7	-160.2	0	0	110.9	N1030 L1032 M1047 K1053 Y1054 A1055	N1030-E1051 PolarHBondContact ND2-OE1 3.08Å; L1032-E1051 HydrophobicContact CD1-CB 4.21Å; M1047-E1051 WeakPolarHBondContact O-CB 3.21Å; M1047-E1051 PolarHBondContact O-N 3.37Å; E1051-K1053 VanDerWaalsContact C-N 3.25Å; E1051-K1053 PolarHBondContact O-N 3.32Å; E1051-Y1054 CarbonylContact O-C 3.54Å; E1051-Y1054 PolarHBondContact O-N 3.38Å; E1051-Y1054 VanDerWaalsContact O-N 3.13Å; E1051-A1055 PolarHBondContact O-N 3.43Å
1052	S	91.6	Very high	91	Very high	88 Å²	88	81.9 Å²	81.9	62%	0.615	41%	0.412	S	S	*	.	H	α-helix	trans	-60.7	-34.2	174.9	-57.3	0	0	0	0	112.7	K1048 R1049 L1050	K1048-S1052 WeakPolarHBondContact O-CB 3.44Å; K1048-S1052 PolarHBondContact O-N 3.13Å; K1048-S1052 PolarHBondContact O-OG 3.45Å; R1049-S1052 PolarHBondContact O-N 3.04Å; L1050-S1052 VanDerWaalsContact C-N 3.34Å
1053	K	92.6	Very high	91.4	Very high	138 Å²	138	74.3 Å²	74.3	60%	0.6	39%	0.386	S	S	*	.	H	α-helix	trans	-67.1	-38.3	176.4	-179.6	-175.5	175.8	-174.5	0	112	R1049 L1050 E1051 P1056	R1049-K1053 PolarHBondContact O-N 3.49Å; R1049-K1053 VanDerWaalsContact O-N 3.14Å; L1050-K1053 HydrophobicContact CD1-CD 4.27Å; L1050-K1053 WeakPolarHBondContact O-CB 3.36Å; L1050-K1053 PolarHBondContact O-N 3.36Å; L1050-K1053 VanDerWaalsContact O-N 3.14Å; E1051-K1053 VanDerWaalsContact C-N 3.25Å; E1051-K1053 PolarHBondContact O-N 3.32Å; K1053-P1056 WeakPolarHBondContact O-CD 3.35Å
1054	Y	93.6	Very high	91.8	Very high	79 Å²	79	75.5 Å²	75.5	31%	0.31	39%	0.39	S	S	.	.	H	α-helix	trans	-98.1	-2.8	-177.2	-68.3	-65.4	0	0	0	114.3	L1032 L1050 E1051 P1056 L1057	L1032-Y1054 HydrophobicContact CD1-CD2 4.3Å; L1032-Y1054 HydrophobicContact CD2-CD2 3.5Å; L1032-Y1054 VanDerWaalsContact CD2-CD2 3.5Å; L1032-Y1054 HydrophobicContact CD2-CE2 3.98Å; L1032-Y1054 HydrophobicContact CD2-CG 4.2Å; L1050-Y1054 HydrophobicContact CD1-CD2 4.18Å; L1050-Y1054 HydrophobicContact CD1-CE2 3.7Å; L1050-Y1054 HydrophobicContact CG-CD2 4.08Å; L1050-Y1054 HydrophobicContact CG-CE2 3.95Å; L1050-Y1054 WeakPolarHBondContact O-CD2 3.42Å; L1050-Y1054 PolarHBondContact O-N 3.45Å; L1050-Y1054 VanDerWaalsContact O-N 3.13Å; E1051-Y1054 CarbonylContact O-C 3.54Å; E1051-Y1054 PolarHBondContact O-N 3.38Å; E1051-Y1054 VanDerWaalsContact O-N 3.13Å; Y1054-P1056 VanDerWaalsContact O-N 3.11Å; Y1054-L1057 HydrophobicContact CD1-CD1 3.66Å; Y1054-L1057 HydrophobicContact CD1-CG 4.43Å; Y1054-L1057 HydrophobicContact CE1-CD1 4.29Å; Y1054-L1057 WeakPolarHBondContact O-CB 3.25Å; Y1054-L1057 PolarHBondContact O-N 2.81Å
1055	A	92.8	Very high	92.2	Very high	53 Å²	53	78.6 Å²	78.6	44%	0.438	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-47.8	-36.1	173.1	0	0	0	0	0	114.5	E1051 L1057 H1058	E1051-A1055 PolarHBondContact O-N 3.43Å; A1055-L1057 PolarHBondContact O-N 2.91Å; A1055-H1058 WeakPolarHBondContact O-CB 3.38Å; A1055-H1058 PolarHBondContact O-N 3.03Å
1056	P	93.1	Very high	92.5	Very high	84 Å²	84	82.7 Å²	82.7	55%	0.545	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-65.4	-20.6	175.3	-22.9	35.4	0	0	0	115	K1053 Y1054	K1053-P1056 WeakPolarHBondContact O-CD 3.35Å; Y1054-P1056 VanDerWaalsContact O-N 3.11Å
1057	L	92.4	Very high	92.8	Very high	75 Å²	75	81.6 Å²	81.6	39%	0.393	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-88.2	-13.4	178.2	-55.1	-173.4	0	0	0	112.7	F1028 Y1054 A1055 L1059	F1028-L1057 WeakPolarHBondContact CA-O 3.33Å; Y1054-L1057 HydrophobicContact CD1-CD1 3.66Å; Y1054-L1057 HydrophobicContact CD1-CG 4.43Å; Y1054-L1057 HydrophobicContact CE1-CD1 4.29Å; Y1054-L1057 WeakPolarHBondContact O-CB 3.25Å; Y1054-L1057 PolarHBondContact O-N 2.81Å; A1055-L1057 PolarHBondContact O-N 2.91Å; L1057-L1059 PolarHBondContact O-N 2.69Å
1058	H	95.3	Very high	93.1	Very high	49 Å²	49	82.2 Å²	82.2	23%	0.227	42%	0.417	C	S	.	.			trans	-68.9	105.7	-178	-167.5	176.9	0	0	0	110	F1028 A1055 P1061 L1062	F1028-H1058 WeakPolarHBondContact O-CA 3.49Å; F1028-H1058 PolarHBondContact O-CD2 2.79Å; A1055-H1058 WeakPolarHBondContact O-CB 3.38Å; A1055-H1058 PolarHBondContact O-N 3.03Å; H1058-P1061 HydrophobicContact CB-CG 4.48Å; H1058-P1061 WeakPolarHBondContact CD2-CD 3.48Å; H1058-P1061 VanDerWaalsContact CE1-CG 3.48Å; H1058-P1061 WeakPolarHBondContact CE1-CG 3.48Å; H1058-P1061 WeakPolarHBondContact ND1-CG 3.39Å; H1058-P1061 WeakPolarHBondContact NE2-CD 3.33Å; H1058-L1062 WeakPolarHBondContact O-CB 3.24Å; H1058-L1062 PolarHBondContact O-N 3.18Å
1059	L	92.9	Very high	93.4	Very high	83 Å²	83	80.1 Å²	80.1	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-68.5	-48.5	-161.8	-176.5	64	0	0	0	113	F1028 L1057 L1062 I1063	F1028-L1059 HydrophobicContact CB-CB 4.38Å; F1028-L1059 PolarHBondContact O-N 3.47Å; L1057-L1059 PolarHBondContact O-N 2.69Å; L1059-L1062 WeakPolarHBondContact O-CB 3.42Å; L1059-L1062 PolarHBondContact O-N 3Å; L1059-I1063 HydrophobicContact CD1-CD1 3.82Å; L1059-I1063 HydrophobicContact CD1-CG1 4.31Å; L1059-I1063 HydrophobicContact CG-CD1 3.95Å; L1059-I1063 WeakPolarHBondContact O-CG1 3.32Å; L1059-I1063 PolarHBondContact O-N 3.11Å
1060	V	94.8	Very high	93.6	Very high	19 Å²	19	78.8 Å²	78.8	12%	0.115	42%	0.418	C	S	.	.	H	α-helix	trans	-63.6	-51.2	-175.8	175.4	0	0	0	0	111.5	L1062 I1063 E1064 R1076 D1079	V1060-L1062 PolarHBondContact O-N 2.97Å; V1060-I1063 PolarHBondContact O-N 3.26Å; V1060-E1064 HydrophobicContact CG1-CG 4.22Å; V1060-E1064 WeakPolarHBondContact O-CB 3.32Å; V1060-E1064 WeakPolarHBondContact O-CG 3.35Å; V1060-E1064 PolarHBondContact O-N 3.28Å; V1060-R1076 HydrophobicContact CG1-CG 4.13Å; V1060-D1079 HydrophobicContact CG2-CB 3.73Å
1061	P	94.9	Very high	93.7	Very high	55 Å²	55	81.8 Å²	81.8	36%	0.357	43%	0.431	S	S	.	.	H	α-helix	trans	-62.5	-30.1	176.4	-26.7	38.5	0	0	0	113.8	H1058 R1065	H1058-P1061 HydrophobicContact CB-CG 4.48Å; H1058-P1061 WeakPolarHBondContact CD2-CD 3.48Å; H1058-P1061 VanDerWaalsContact CE1-CG 3.48Å; H1058-P1061 WeakPolarHBondContact CE1-CG 3.48Å; H1058-P1061 WeakPolarHBondContact ND1-CG 3.39Å; H1058-P1061 WeakPolarHBondContact NE2-CD 3.33Å; P1061-R1065 WeakPolarHBondContact O-CB 3.43Å; P1061-R1065 PolarHBondContact O-N 2.82Å; P1061-R1065 VanDerWaalsContact O-N 3.11Å
1062	L	94.4	Very high	93.8	Very high	58 Å²	58	79.1 Å²	79.1	30%	0.304	42%	0.419	S	S	.	.	H	α-helix	trans	-66.3	-45.3	175.4	-175.4	66.2	0	0	0	111.2	H1058 L1059 V1060 R1065 L1066	H1058-L1062 WeakPolarHBondContact O-CB 3.24Å; H1058-L1062 PolarHBondContact O-N 3.18Å; L1059-L1062 WeakPolarHBondContact O-CB 3.42Å; L1059-L1062 PolarHBondContact O-N 3Å; V1060-L1062 PolarHBondContact O-N 2.97Å; L1062-R1065 PolarHBondContact O-N 3.24Å; L1062-L1066 HydrophobicContact CD1-CD1 3.76Å; L1062-L1066 HydrophobicContact CG-CD1 4.38Å; L1062-L1066 PolarHBondContact O-N 3.03Å; L1062-L1066 VanDerWaalsContact O-N 3.08Å
1063	I	94.6	Very high	93.9	Very high	41 Å²	41	77.5 Å²	77.5	21%	0.21	41%	0.411	C	S	.	.	H	α-helix	trans	-70.9	-35.3	176.6	-65.8	174.9	0	0	0	111.1	L1059 V1060 R1065 L1066 G1067 Q1071 I1072 A1075	L1059-I1063 HydrophobicContact CD1-CD1 3.82Å; L1059-I1063 HydrophobicContact CD1-CG1 4.31Å; L1059-I1063 HydrophobicContact CG-CD1 3.95Å; L1059-I1063 WeakPolarHBondContact O-CG1 3.32Å; L1059-I1063 PolarHBondContact O-N 3.11Å; V1060-I1063 PolarHBondContact O-N 3.26Å; I1063-R1065 PolarHBondContact O-N 3.08Å; I1063-L1066 PolarHBondContact O-N 3.34Å; I1063-G1067 WeakPolarHBondContact O-CA 3.48Å; I1063-G1067 PolarHBondContact O-N 2.8Å; I1063-Q1071 HydrophobicContact CG2-CB 3.97Å; I1063-I1072 HydrophobicContact CG2-CG1 4.03Å; I1063-A1075 HydrophobicContact CB-CB 4.39Å; I1063-A1075 HydrophobicContact CD1-CB 3.64Å; I1063-A1075 HydrophobicContact CG2-CB 4.12Å
1064	E	94.3	Very high	94	Very high	80 Å²	80	76.7 Å²	76.7	37%	0.374	41%	0.412	S	S	.	.	H	α-helix	trans	-62.6	-31.2	173.4	-74.5	178.6	159.5	0	0	112.7	V1060 I1072 R1076	V1060-E1064 HydrophobicContact CG1-CG 4.22Å; V1060-E1064 WeakPolarHBondContact O-CB 3.32Å; V1060-E1064 WeakPolarHBondContact O-CG 3.35Å; V1060-E1064 PolarHBondContact O-N 3.28Å; E1064-I1072 HydrophobicContact CG-CG1 4.31Å; E1064-I1072 HydrophobicContact CG-CG2 3.9Å; E1064-R1076 IonicContact OE1-CZ 3.31Å; E1064-R1076 VanDerWaalsContact OE1-CZ 3.25Å; E1064-R1076 IonicContact OE1-NE 2.8Å; E1064-R1076 PolarHBondContact OE1-NE 3.45Å; E1064-R1076 IonicContact OE1-NH2 3.58Å; E1064-R1076 PolarHBondContact OE1-NH2 2.93Å
1065	R	94.4	Very high	93.9	Very high	184 Å²	184	73.7 Å²	73.7	69%	0.694	40%	0.403	S	S	*	.	H	α-helix	trans	-82.4	-35.7	178.9	-170.3	177.1	67.1	-174.6	-0.3	113.4	P1061 L1062 I1063	P1061-R1065 WeakPolarHBondContact O-CB 3.43Å; P1061-R1065 PolarHBondContact O-N 2.82Å; P1061-R1065 VanDerWaalsContact O-N 3.11Å; L1062-R1065 PolarHBondContact O-N 3.24Å; I1063-R1065 PolarHBondContact O-N 3.08Å
1066	L	93.5	Very high	93.9	Very high	129 Å²	129	77.8 Å²	77.8	68%	0.675	41%	0.408	S	S	*	.	H	α-helix	trans	-118.3	-16.4	-168.4	-57.8	178.6	0	0	0	114.3	L1062 I1063	L1062-L1066 HydrophobicContact CD1-CD1 3.76Å; L1062-L1066 HydrophobicContact CG-CD1 4.38Å; L1062-L1066 PolarHBondContact O-N 3.03Å; L1062-L1066 VanDerWaalsContact O-N 3.08Å; I1063-L1066 PolarHBondContact O-N 3.34Å
1067	G	94.3	Very high	93.9	Very high	24 Å²	24	79.8 Å²	79.8	25%	0.247	41%	0.409	C	S	.	.	S	Bend	trans	-95.3	167.4	-172.2	0	0	0	0	0	114	I1063	I1063-G1067 WeakPolarHBondContact O-CA 3.48Å; I1063-G1067 PolarHBondContact O-N 2.8Å
1068	T	94.9	Very high	93.9	Very high	64 Å²	64	77.7 Å²	77.7	39%	0.393	41%	0.406	S	S	.	.			trans	-77.6	160.8	174.2	59.3	0	0	0	0	111.7	Q1070 Q1071 I1072	T1068-Q1070 PolarHBondContact O-N 2.83Å; T1068-Q1071 PolarHBondContact O-N 3.03Å; T1068-Q1071 VanDerWaalsContact OG1-CG 3.29Å; T1068-Q1071 WeakPolarHBondContact OG1-CG 3.41Å; T1068-Q1071 PolarHBondContact OG1-N 3.4Å; T1068-Q1071 PolarHBondContact OG1-OE1 3.35Å; T1068-I1072 WeakPolarHBondContact O-CG1 3.5Å; T1068-I1072 PolarHBondContact O-N 3.02Å
1069	P	95.6	Very high	93.8	Very high	99 Å²	99	77 Å²	77	64%	0.643	41%	0.405	S	S	*	.	H	α-helix	trans	-54.4	-36.4	175.7	-27.5	36.1	0	0	0	113.9	I1072 A1073	P1069-I1072 PolarHBondContact O-N 3.02Å; P1069-A1073 PolarHBondContact O-N 3.33Å
1070	Q	93.3	Very high	93.8	Very high	129 Å²	129	76.1 Å²	76.1	60%	0.603	40%	0.4	S	S	*	.	H	α-helix	trans	-65.8	-45.3	176	-65.7	79.9	4.7	0	0	111.5	T1068 I1072 A1073 I1074	T1068-Q1070 PolarHBondContact O-N 2.83Å; Q1070-I1072 VanDerWaalsContact C-N 3.31Å; Q1070-I1072 PolarHBondContact O-N 3.14Å; Q1070-A1073 PolarHBondContact O-N 2.96Å; Q1070-I1074 WeakPolarHBondContact O-CD1 3.44Å; Q1070-I1074 VanDerWaalsContact O-CG1 3.27Å; Q1070-I1074 WeakPolarHBondContact O-CG1 3.46Å; Q1070-I1074 PolarHBondContact O-N 3.27Å
1071	Q	92.8	Very high	93.6	Very high	102 Å²	102	80.9 Å²	80.9	48%	0.477	42%	0.424	S	S	.	.	H	α-helix	trans	-64	-37.5	177.3	-73.1	166.8	-38.6	0	0	111.8	I1063 T1068 I1074 A1075	I1063-Q1071 HydrophobicContact CG2-CB 3.97Å; T1068-Q1071 PolarHBondContact O-N 3.03Å; T1068-Q1071 VanDerWaalsContact OG1-CG 3.29Å; T1068-Q1071 WeakPolarHBondContact OG1-CG 3.41Å; T1068-Q1071 PolarHBondContact OG1-N 3.4Å; T1068-Q1071 PolarHBondContact OG1-OE1 3.35Å; Q1071-I1074 PolarHBondContact O-N 2.91Å; Q1071-A1075 WeakPolarHBondContact O-CB 3.4Å; Q1071-A1075 PolarHBondContact O-N 2.88Å
1072	I	93.8	Very high	93.5	Very high	29 Å²	29	80.9 Å²	80.9	15%	0.149	42%	0.423	C	S	.	.	H	α-helix	trans	-63.7	-47.3	176.3	-65.8	167.4	0	0	0	110.8	I1063 E1064 T1068 P1069 Q1070 I1074 A1075 R1076	I1063-I1072 HydrophobicContact CG2-CG1 4.03Å; E1064-I1072 HydrophobicContact CG-CG1 4.31Å; E1064-I1072 HydrophobicContact CG-CG2 3.9Å; T1068-I1072 WeakPolarHBondContact O-CG1 3.5Å; T1068-I1072 PolarHBondContact O-N 3.02Å; P1069-I1072 PolarHBondContact O-N 3.02Å; Q1070-I1072 VanDerWaalsContact C-N 3.31Å; Q1070-I1072 PolarHBondContact O-N 3.14Å; I1072-I1074 PolarHBondContact O-N 2.85Å; I1072-A1075 PolarHBondContact O-N 3.25Å; I1072-R1076 WeakPolarHBondContact O-CG 3.34Å; I1072-R1076 PolarHBondContact O-N 2.9Å
1073	A	93.8	Very high	93.3	Very high	54 Å²	54	82.5 Å²	82.5	45%	0.446	43%	0.427	S	S	.	.	H	α-helix	trans	-59.3	-48.3	177.4	0	0	0	0	0	111.2	P1069 Q1070 A1075 R1076 E1077	P1069-A1073 PolarHBondContact O-N 3.33Å; Q1070-A1073 PolarHBondContact O-N 2.96Å; A1073-A1075 PolarHBondContact O-N 3.2Å; A1073-R1076 PolarHBondContact O-N 3.39Å; A1073-E1077 WeakPolarHBondContact O-CG 3.41Å; A1073-E1077 PolarHBondContact O-N 2.91Å
1074	I	93.8	Very high	93.2	Very high	121 Å²	121	86.7 Å²	86.7	62%	0.621	45%	0.446	S	S	*	.	H	α-helix	trans	-61.6	-42.6	178	-66.6	165.5	0	0	0	111.4	Q1070 Q1071 I1072 E1077 G1078	Q1070-I1074 WeakPolarHBondContact O-CD1 3.44Å; Q1070-I1074 VanDerWaalsContact O-CG1 3.27Å; Q1070-I1074 WeakPolarHBondContact O-CG1 3.46Å; Q1070-I1074 PolarHBondContact O-N 3.27Å; Q1071-I1074 PolarHBondContact O-N 2.91Å; I1072-I1074 PolarHBondContact O-N 2.85Å; I1074-E1077 PolarHBondContact O-N 3.19Å; I1074-G1078 PolarHBondContact O-N 3.43Å
1075	A	92.1	Very high	93.1	Very high	15 Å²	15	85.4 Å²	85.4	12%	0.124	44%	0.438	C	S	.	.	H	α-helix	trans	-66.1	-38.3	179.9	0	0	0	0	0	112.3	I1063 Q1071 I1072 A1073 D1079	I1063-A1075 HydrophobicContact CB-CB 4.39Å; I1063-A1075 HydrophobicContact CD1-CB 3.64Å; I1063-A1075 HydrophobicContact CG2-CB 4.12Å; Q1071-A1075 WeakPolarHBondContact O-CB 3.4Å; Q1071-A1075 PolarHBondContact O-N 2.88Å; I1072-A1075 PolarHBondContact O-N 3.25Å; A1073-A1075 PolarHBondContact O-N 3.2Å; A1075-D1079 VanDerWaalsContact O-CB 3.27Å; A1075-D1079 WeakPolarHBondContact O-CB 3.42Å; A1075-D1079 PolarHBondContact O-N 2.84Å
1076	R	93.1	Very high	92.9	Very high	140 Å²	140	78.8 Å²	78.8	53%	0.528	42%	0.416	S	S	.	.	H	α-helix	trans	-66.9	-43.5	176.2	-73.3	179.2	-177.1	164.9	0.2	112.1	V1060 E1064 I1072 A1073 D1079 L1080	V1060-R1076 HydrophobicContact CG1-CG 4.13Å; E1064-R1076 IonicContact OE1-CZ 3.31Å; E1064-R1076 VanDerWaalsContact OE1-CZ 3.25Å; E1064-R1076 IonicContact OE1-NE 2.8Å; E1064-R1076 PolarHBondContact OE1-NE 3.45Å; E1064-R1076 IonicContact OE1-NH2 3.58Å; E1064-R1076 PolarHBondContact OE1-NH2 2.93Å; I1072-R1076 WeakPolarHBondContact O-CG 3.34Å; I1072-R1076 PolarHBondContact O-N 2.9Å; A1073-R1076 PolarHBondContact O-N 3.39Å; R1076-D1079 PolarHBondContact O-N 3.09Å; R1076-L1080 WeakPolarHBondContact O-CB 3.25Å; R1076-L1080 PolarHBondContact O-N 2.94Å
1077	E	93.8	Very high	92.8	Very high	125 Å²	125	75 Å²	75	58%	0.584	40%	0.4	S	S	*	.	H	α-helix	trans	-61.8	-47	174.3	-70.3	-72.5	171.8	0	0	111.1	A1073 I1074 D1079 L1080 L1081	A1073-E1077 WeakPolarHBondContact O-CG 3.41Å; A1073-E1077 PolarHBondContact O-N 2.91Å; I1074-E1077 PolarHBondContact O-N 3.19Å; E1077-D1079 PolarHBondContact O-N 3.41Å; E1077-L1080 WeakPolarHBondContact O-CB 3.38Å; E1077-L1080 PolarHBondContact O-N 2.79Å; E1077-L1081 WeakPolarHBondContact O-CG 3.26Å; E1077-L1081 PolarHBondContact O-N 2.77Å
1078	G	92.6	Very high	92.5	Very high	32 Å²	32	78 Å²	78	33%	0.33	42%	0.416	S	S	.	.	H	α-helix	trans	-61.8	-42.3	177.6	0	0	0	0	0	113.1	I1074 L1080 L1081 T1082	I1074-G1078 PolarHBondContact O-N 3.43Å; G1078-L1080 VanDerWaalsContact C-N 3.34Å; G1078-L1081 PolarHBondContact O-N 3.23Å; G1078-T1082 WeakPolarHBondContact O-CB 3.4Å; G1078-T1082 PolarHBondContact O-N 3.38Å; G1078-T1082 PolarHBondContact O-OG1 3.44Å
1079	D	92.6	Very high	92.1	Very high	35 Å²	35	78.2 Å²	78.2	19%	0.187	43%	0.431	C	S	.	.	H	α-helix	trans	-62.6	-40.7	175.1	-179.7	71.4	0	0	0	112	Q1029 V1060 A1075 R1076 E1077 T1082 K1083	Q1029-D1079 WeakPolarHBondContact CG-OD1 3.19Å; Q1029-D1079 PolarHBondContact NE2-O 3.44Å; Q1029-D1079 PolarHBondContact NE2-OD1 3.5Å; V1060-D1079 HydrophobicContact CG2-CB 3.73Å; A1075-D1079 VanDerWaalsContact O-CB 3.27Å; A1075-D1079 WeakPolarHBondContact O-CB 3.42Å; A1075-D1079 PolarHBondContact O-N 2.84Å; R1076-D1079 PolarHBondContact O-N 3.09Å; E1077-D1079 PolarHBondContact O-N 3.41Å; D1079-T1082 PolarHBondContact O-N 2.79Å; D1079-K1083 WeakPolarHBondContact O-CG 3.45Å; D1079-K1083 PolarHBondContact O-N 3.16Å; D1079-K1083 IonicContact OD2-NZ 3.43Å; D1079-K1083 PolarHBondContact OD2-NZ 3.02Å
1080	L	93.1	Very high	91.8	Very high	63 Å²	63	79.4 Å²	79.4	33%	0.33	43%	0.431	S	S	.	.	H	α-helix	trans	-61.2	-50.5	177.3	-168.2	65.3	0	0	0	111.6	R1076 E1077 G1078 T1082 K1083 E1084	R1076-L1080 WeakPolarHBondContact O-CB 3.25Å; R1076-L1080 PolarHBondContact O-N 2.94Å; E1077-L1080 WeakPolarHBondContact O-CB 3.38Å; E1077-L1080 PolarHBondContact O-N 2.79Å; G1078-L1080 VanDerWaalsContact C-N 3.34Å; L1080-T1082 PolarHBondContact O-N 3.25Å; L1080-K1083 PolarHBondContact O-N 2.96Å; L1080-E1084 VanDerWaalsContact CD1-CD 3.5Å; L1080-E1084 HydrophobicContact CD1-CG 4.14Å; L1080-E1084 VanDerWaalsContact CD1-OE1 3.24Å; L1080-E1084 WeakPolarHBondContact CD1-OE1 3.33Å; L1080-E1084 WeakPolarHBondContact O-CB 3.4Å; L1080-E1084 PolarHBondContact O-N 3.11Å
1081	L	91	Very high	91.5	Very high	119 Å²	119	75.6 Å²	75.6	62%	0.623	42%	0.419	S	S	*	.	H	α-helix	trans	-63.8	-25.6	177.3	-66.7	173.9	0	0	0	113.5	E1077 G1078 R1085	E1077-L1081 WeakPolarHBondContact O-CG 3.26Å; E1077-L1081 PolarHBondContact O-N 2.77Å; G1078-L1081 PolarHBondContact O-N 3.23Å; L1081-R1085 PolarHBondContact O-NH1 3Å
1082	T	91.5	Very high	91.5	Very high	56 Å²	56	72.8 Å²	72.8	34%	0.344	41%	0.407	S	S	.	.	H	α-helix	trans	-80.4	-40.6	179.7	-55.8	0	0	0	0	111.6	L1022 A1025 G1078 D1079 L1080	L1022-T1082 VanDerWaalsContact CD2-O 3.32Å; L1022-T1082 WeakPolarHBondContact CD2-O 3.26Å; A1025-T1082 HydrophobicContact CB-CG2 3.46Å; A1025-T1082 VanDerWaalsContact CB-CG2 3.46Å; G1078-T1082 WeakPolarHBondContact O-CB 3.4Å; G1078-T1082 PolarHBondContact O-N 3.38Å; G1078-T1082 PolarHBondContact O-OG1 3.44Å; D1079-T1082 PolarHBondContact O-N 2.79Å; L1080-T1082 PolarHBondContact O-N 3.25Å
1083	K	89.8	Confident	91.4	Very high	91 Å²	91	71.4 Å²	71.4	40%	0.396	40%	0.4	S	S	.	.	H	α-helix	trans	-83.8	-28.1	-179.1	71.2	-165.7	174.9	-149.1	0	114.3	D1079 L1080 R1085	D1079-K1083 WeakPolarHBondContact O-CG 3.45Å; D1079-K1083 PolarHBondContact O-N 3.16Å; D1079-K1083 IonicContact OD2-NZ 3.43Å; D1079-K1083 PolarHBondContact OD2-NZ 3.02Å; L1080-K1083 PolarHBondContact O-N 2.96Å; K1083-R1085 PolarHBondContact O-N 3.35Å
1084	E	93.3	Very high	91.3	Very high	129 Å²	129	71 Å²	71	60%	0.603	39%	0.388	S	S	*	.			trans	-90.4	96.6	-179.7	-64.3	-173.2	168.4	0	0	110.5	L1080	L1080-E1084 VanDerWaalsContact CD1-CD 3.5Å; L1080-E1084 HydrophobicContact CD1-CG 4.14Å; L1080-E1084 VanDerWaalsContact CD1-OE1 3.24Å; L1080-E1084 WeakPolarHBondContact CD1-OE1 3.33Å; L1080-E1084 WeakPolarHBondContact O-CB 3.4Å; L1080-E1084 PolarHBondContact O-N 3.11Å
1085	R	91.5	Very high	91.2	Very high	54 Å²	54	69.1 Å²	69.1	20%	0.204	38%	0.382	C	S	.	.			trans	-122	159.6	178.6	-48.6	-60.1	-83.2	-170.8	-5.4	110.3	Y923 E1018 D1021 L1022 L1081 K1083 C1087 C1088	Y923-R1085 PolarHBondContact OH-NE 3.39Å; Y923-R1085 VanDerWaalsContact OH-NE 3.14Å; Y923-R1085 PolarHBondContact OH-NH2 3.48Å; E1018-R1085 HydrophobicContact CB-CB 3.97Å; E1018-R1085 HydrophobicContact CB-CG 4.38Å; E1018-R1085 HydrophobicContact CG-CB 3.99Å; D1021-R1085 IonicContact OD2-CZ 2.77Å; D1021-R1085 IonicContact OD2-NH2 3.77Å; D1021-R1085 PolarHBondContact OD2-NH2 3.27Å; L1022-R1085 HydrophobicContact CD1-CB 4.38Å; L1022-R1085 HydrophobicContact CD1-CG 4.13Å; L1022-R1085 HydrophobicContact CD2-CG 3.93Å; L1022-R1085 HydrophobicContact CG-CG 3.99Å; L1081-R1085 PolarHBondContact O-NH1 3Å; K1083-R1085 PolarHBondContact O-N 3.35Å; R1085-C1087 VanDerWaalsContact C-N 3.31Å; R1085-C1087 PolarHBondContact O-N 3.36Å; R1085-C1088 VanDerWaalsContact O-CB 3.32Å; R1085-C1088 WeakPolarHBondContact O-CB 3.37Å; R1085-C1088 PolarHBondContact O-N 2.7Å
1086	L	90.8	Very high	91.3	Very high	45 Å²	45	68.9 Å²	68.9	24%	0.236	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-62.5	-40.1	-177.5	-65.1	177.6	0	0	0	111.5	Y923 L1014 E1018 C1088 G1089 L1090 M1092	Y923-L1086 HydrophobicContact CD1-CD1 4.28Å; Y923-L1086 HydrophobicContact CE1-CD1 3.99Å; Y923-L1086 HydrophobicContact CE1-CG 4.18Å; L1014-L1086 HydrophobicContact CD2-CD1 3.69Å; E1018-L1086 WeakPolarHBondContact OE1-CB 3.31Å; E1018-L1086 PolarHBondContact OE1-N 3.08Å; E1018-L1086 PolarHBondContact OE2-N 3.48Å; L1086-C1088 PolarHBondContact O-N 2.9Å; L1086-G1089 PolarHBondContact O-N 2.89Å; L1086-G1089 VanDerWaalsContact O-N 3.14Å; L1086-L1090 HydrophobicContact CD2-CB 4.09Å; L1086-L1090 HydrophobicContact CD2-CD1 3.83Å; L1086-L1090 PolarHBondContact O-N 3.34Å; L1086-L1090 VanDerWaalsContact O-O 3.11Å; L1086-M1092 HydrophobicContact CD1-CE 4Å; L1086-M1092 HydrophobicContact CD1-SD 4.12Å
1087	C	91.5	Very high	91.3	Very high	50 Å²	50	62.3 Å²	62.3	34%	0.338	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-60.3	-12.2	179.2	73.9	0	0	0	0	114.8	E1018 R1085 G1089	E1018-C1087 HydrophobicContact CB-CB 4.37Å; E1018-C1087 WeakPolarHBondContact OE2-CB 3.42Å; E1018-C1087 PolarHBondContact OE2-N 2.91Å; R1085-C1087 VanDerWaalsContact C-N 3.31Å; R1085-C1087 PolarHBondContact O-N 3.36Å; C1087-G1089 VanDerWaalsContact C-N 3.3Å; C1087-G1089 PolarHBondContact O-N 3.07Å
1088	C	88.2	Confident	91.2	Very high	85 Å²	85	59 Å²	59	57%	0.574	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-73.7	-16.3	176.7	-61	0	0	0	0	113.9	R1085 L1086	R1085-C1088 VanDerWaalsContact O-CB 3.32Å; R1085-C1088 WeakPolarHBondContact O-CB 3.37Å; R1085-C1088 PolarHBondContact O-N 2.7Å; L1086-C1088 PolarHBondContact O-N 2.9Å
1089	G	86.1	Confident	91.3	Very high	70 Å²	70	61.8 Å²	61.8	72%	0.722	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	166.3	11.2	178.4	0	0	0	0	0	117	L1086 C1087	L1086-G1089 PolarHBondContact O-N 2.89Å; L1086-G1089 VanDerWaalsContact O-N 3.14Å; C1087-G1089 VanDerWaalsContact C-N 3.3Å; C1087-G1089 PolarHBondContact O-N 3.07Å
1090	L	88.9	Confident	91.4	Very high	123 Å²	123	60.2 Å²	60.2	64%	0.644	34%	0.335	S	S	*	.			trans	-117	148.6	179.7	-62.5	173.3	0	0	0	110.2	L1086	L1086-L1090 HydrophobicContact CD2-CB 4.09Å; L1086-L1090 HydrophobicContact CD2-CD1 3.83Å; L1086-L1090 PolarHBondContact O-N 3.34Å; L1086-L1090 VanDerWaalsContact O-O 3.11Å
1091	S	88.4	Confident	91.4	Very high	50 Å²	50	62.4 Å²	62.4	35%	0.35	34%	0.338	S	S	.	.			trans	-138.5	146.1	172.4	73.3	0	0	0	0	111	E1011	E1011-S1091 VanDerWaalsContact OE1-CA 3.25Å; E1011-S1091 WeakPolarHBondContact OE1-CA 3.28Å; E1011-S1091 WeakPolarHBondContact OE1-CB 3.49Å
1092	M	91.3	Very high	91.6	Very high	43 Å²	43	59.5 Å²	59.5	21%	0.212	33%	0.328	C	S	.	.	S	Bend	trans	-100.5	-35.5	-175.4	-63.4	-178	-74.7	0	0	112	M930 E1011 L1014 L1086 E1094 V1095 I1096	M930-M1092 HydrophobicContact CE-CE 3.82Å; M930-M1092 HydrophobicContact CE-SD 4.19Å; M930-M1092 HydrophobicContact SD-CB 4.48Å; M930-M1092 HydrophobicContact SD-CE 4.35Å; M930-M1092 HydrophobicContact SD-SD 3.93Å; E1011-M1092 HydrophobicContact CB-CE 3.92Å; E1011-M1092 HydrophobicContact CG-CE 3.75Å; E1011-M1092 PolarHBondContact OE1-N 3.16Å; E1011-M1092 PolarHBondContact OE2-N 3.41Å; L1014-M1092 HydrophobicContact CD2-CE 3.89Å; L1086-M1092 HydrophobicContact CD1-CE 4Å; L1086-M1092 HydrophobicContact CD1-SD 4.12Å; M1092-E1094 VanDerWaalsContact C-N 3.27Å; M1092-E1094 PolarHBondContact O-N 2.88Å; M1092-V1095 WeakPolarHBondContact O-CA 3.33Å; M1092-V1095 WeakPolarHBondContact O-CB 3.35Å; M1092-V1095 PolarHBondContact O-N 3.25Å; M1092-I1096 WeakPolarHBondContact O-CG1 3.34Å; M1092-I1096 PolarHBondContact O-N 3.31Å
1093	F	93.1	Very high	91.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-57.8	-36.7	-173	-167	-118	0	0	0	113.6	V1004 L1008 E1011 V1095 I1096 L1097 W1159 L1222 Y1225	V1004-F1093 HydrophobicContact CG1-CE2 3.68Å; V1004-F1093 HydrophobicContact CG1-CZ 3.82Å; L1008-F1093 HydrophobicContact CB-CD2 3.88Å; L1008-F1093 HydrophobicContact CB-CE2 3.68Å; L1008-F1093 HydrophobicContact CB-CZ 4.18Å; L1008-F1093 HydrophobicContact CD1-CD1 4.01Å; L1008-F1093 HydrophobicContact CD1-CD2 4.18Å; L1008-F1093 HydrophobicContact CD1-CE1 4.21Å; L1008-F1093 HydrophobicContact CD1-CE2 4.39Å; L1008-F1093 HydrophobicContact CD1-CG 3.99Å; L1008-F1093 HydrophobicContact CD1-CZ 4.41Å; L1008-F1093 HydrophobicContact CD2-CZ 4.37Å; L1008-F1093 HydrophobicContact CG-CE2 4.46Å; E1011-F1093 WeakPolarHBondContact OE2-CB 3.09Å; E1011-F1093 PolarHBondContact OE2-N 3.36Å; F1093-V1095 VanDerWaalsContact C-N 3.34Å; F1093-V1095 PolarHBondContact O-N 3.16Å; F1093-I1096 PolarHBondContact O-N 3.46Å; F1093-L1097 HydrophobicContact CD1-CD1 4Å; F1093-L1097 HydrophobicContact CD1-CG 4.42Å; F1093-L1097 HydrophobicContact CE1-CD1 3.7Å; F1093-L1097 HydrophobicContact CE1-CD2 4.48Å; F1093-L1097 HydrophobicContact CE1-CG 4.18Å; F1093-L1097 HydrophobicContact CZ-CD1 4.22Å; F1093-L1097 HydrophobicContact CZ-CD2 4.17Å; F1093-L1097 HydrophobicContact CZ-CG 4.27Å; F1093-L1097 WeakPolarHBondContact O-CG 3.2Å; F1093-L1097 PolarHBondContact O-N 3.21Å; F1093-W1159 HydrophobicContact CZ-CZ3 4.38Å; F1093-L1222 HydrophobicContact CE1-CD2 4.3Å; F1093-L1222 HydrophobicContact CZ-CD2 4.27Å; F1093-Y1225 HydrophobicContact CD1-CD1 4.12Å; F1093-Y1225 AromaticContact CD1-CD2 3.79Å; F1093-Y1225 HydrophobicContact CD1-CD2 3.79Å; F1093-Y1225 HydrophobicContact CD1-CE2 4.34Å; F1093-Y1225 AromaticContact CD1-CG 3.67Å; F1093-Y1225 HydrophobicContact CD1-CG 3.67Å; F1093-Y1225 HydrophobicContact CE1-CD2 4.06Å; F1093-Y1225 HydrophobicContact CE1-CG 4.3Å
1094	E	90.4	Very high	92	Very high	44 Å²	44	53.4 Å²	53.4	21%	0.206	30%	0.297	C	S	.	.	H	α-helix	trans	-59.2	-43.6	173.3	-179.9	178.7	162.6	0	0	112.1	M1092 L1097 T1098 Y1225 S1228	M1092-E1094 VanDerWaalsContact C-N 3.27Å; M1092-E1094 PolarHBondContact O-N 2.88Å; E1094-L1097 PolarHBondContact O-N 2.93Å; E1094-T1098 WeakPolarHBondContact O-CB 3.25Å; E1094-T1098 PolarHBondContact O-N 2.91Å; E1094-T1098 PolarHBondContact O-OG1 3.23Å; E1094-Y1225 WeakPolarHBondContact CB-O 3.34Å; E1094-Y1225 WeakPolarHBondContact CG-O 3.47Å; E1094-S1228 VanDerWaalsContact OE2-CB 3.31Å; E1094-S1228 WeakPolarHBondContact OE2-CB 3.29Å; E1094-S1228 PolarHBondContact OE2-OG 2.98Å
1095	V	92.3	Very high	92	Very high	82 Å²	82	52.6 Å²	52.6	50%	0.497	30%	0.297	S	S	.	.	H	α-helix	trans	-66	-41.2	179	-178.5	0	0	0	0	110.5	M1092 F1093 T1098 R1099	M1092-V1095 WeakPolarHBondContact O-CA 3.33Å; M1092-V1095 WeakPolarHBondContact O-CB 3.35Å; M1092-V1095 PolarHBondContact O-N 3.25Å; F1093-V1095 VanDerWaalsContact C-N 3.34Å; F1093-V1095 PolarHBondContact O-N 3.16Å; V1095-T1098 PolarHBondContact O-N 3.35Å; V1095-R1099 WeakPolarHBondContact O-CG 3.21Å; V1095-R1099 PolarHBondContact O-N 3Å
1096	I	93.6	Very high	92.2	Very high	11 Å²	11	52 Å²	52	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-58.1	-52.4	175.7	-61.5	-57.1	0	0	0	110.3	M930 L934 C1007 M1092 F1093 T1098 R1099 I1100	M930-I1096 HydrophobicContact CB-CD1 4.43Å; M930-I1096 HydrophobicContact SD-CD1 4.39Å; L934-I1096 HydrophobicContact CD1-CD1 3.8Å; L934-I1096 HydrophobicContact CD2-CD1 4.4Å; L934-I1096 HydrophobicContact CD2-CG2 3.99Å; L934-I1096 HydrophobicContact CG-CD1 4.14Å; C1007-I1096 HydrophobicContact CB-CG1 4.49Å; C1007-I1096 HydrophobicContact CB-CG2 4.48Å; M1092-I1096 WeakPolarHBondContact O-CG1 3.34Å; M1092-I1096 PolarHBondContact O-N 3.31Å; F1093-I1096 PolarHBondContact O-N 3.46Å; I1096-T1098 PolarHBondContact O-N 3.41Å; I1096-R1099 PolarHBondContact O-N 3.2Å; I1096-I1100 HydrophobicContact CG2-CD1 3.9Å; I1096-I1100 WeakPolarHBondContact O-CG1 3.49Å; I1096-I1100 PolarHBondContact O-N 2.88Å
1097	L	93.4	Very high	92.3	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-61	-43.2	179.1	-68.4	-180	0	0	0	112.3	V1004 F1093 E1094 R1099 I1100 R1101 M1163 L1167 L1222 L1226	V1004-L1097 HydrophobicContact CG1-CD2 4.46Å; F1093-L1097 HydrophobicContact CD1-CD1 4Å; F1093-L1097 HydrophobicContact CD1-CG 4.42Å; F1093-L1097 HydrophobicContact CE1-CD1 3.7Å; F1093-L1097 HydrophobicContact CE1-CD2 4.48Å; F1093-L1097 HydrophobicContact CE1-CG 4.18Å; F1093-L1097 HydrophobicContact CZ-CD1 4.22Å; F1093-L1097 HydrophobicContact CZ-CD2 4.17Å; F1093-L1097 HydrophobicContact CZ-CG 4.27Å; F1093-L1097 WeakPolarHBondContact O-CG 3.2Å; F1093-L1097 PolarHBondContact O-N 3.21Å; E1094-L1097 PolarHBondContact O-N 2.93Å; L1097-R1099 VanDerWaalsContact C-N 3.32Å; L1097-R1099 PolarHBondContact O-N 3.46Å; L1097-I1100 PolarHBondContact O-N 3.42Å; L1097-R1101 PolarHBondContact O-N 2.9Å; L1097-M1163 HydrophobicContact CD2-CG 4.03Å; L1097-M1163 HydrophobicContact CD2-SD 4.06Å; L1097-L1167 HydrophobicContact CB-CD2 4.21Å; L1097-L1222 HydrophobicContact CD1-CD2 3.96Å; L1097-L1222 HydrophobicContact CD2-CD2 3.9Å; L1097-L1226 HydrophobicContact CB-CD1 4.18Å
1098	T	92.2	Very high	92.3	Very high	54 Å²	54	53.9 Å²	53.9	33%	0.331	31%	0.309	S	S	.	.	H	α-helix	trans	-61.9	-40.2	179	-62.8	0	0	0	0	111.9	E1094 V1095 I1096 R1101	E1094-T1098 WeakPolarHBondContact O-CB 3.25Å; E1094-T1098 PolarHBondContact O-N 2.91Å; E1094-T1098 PolarHBondContact O-OG1 3.23Å; V1095-T1098 PolarHBondContact O-N 3.35Å; I1096-T1098 PolarHBondContact O-N 3.41Å; T1098-R1101 WeakPolarHBondContact O-CB 3.38Å; T1098-R1101 PolarHBondContact O-N 3.35Å
1099	R	93.9	Very high	92.6	Very high	92 Å²	92	49.9 Å²	49.9	35%	0.347	28%	0.283	S	S	.	.	H	α-helix	trans	-69.4	-41.7	175.1	-74.1	179.9	67.5	-175.5	-4.4	111.9	E931 V1095 I1096 L1097 R1101 S1102	E931-R1099 IonicContact OE1-CZ 3.36Å; E931-R1099 IonicContact OE1-NH1 3.69Å; E931-R1099 PolarHBondContact OE1-NH1 2.99Å; E931-R1099 IonicContact OE1-NH2 3.65Å; E931-R1099 IonicContact OE2-CZ 2.77Å; E931-R1099 IonicContact OE2-NH1 2.97Å; E931-R1099 PolarHBondContact OE2-NH1 3.11Å; E931-R1099 IonicContact OE2-NH2 3.7Å; E931-R1099 PolarHBondContact OE2-NH2 3.18Å; V1095-R1099 WeakPolarHBondContact O-CG 3.21Å; V1095-R1099 PolarHBondContact O-N 3Å; I1096-R1099 PolarHBondContact O-N 3.2Å; L1097-R1099 VanDerWaalsContact C-N 3.32Å; L1097-R1099 PolarHBondContact O-N 3.46Å; R1099-R1101 PolarHBondContact O-N 2.89Å; R1099-S1102 WeakPolarHBondContact O-CB 3.3Å; R1099-S1102 PolarHBondContact O-N 2.72Å; R1099-S1102 VanDerWaalsContact O-N 3.07Å; R1099-S1102 PolarHBondContact O-OG 3.15Å
1100	I	95.7	Very high	92.9	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-35.2	176.9	-66.9	168.9	0	0	0	111.3	L934 V937 L941 V1004 I1096 L1097 S1102 F1103 M1163 L1167	L934-I1100 HydrophobicContact CD2-CD1 4.12Å; L934-I1100 HydrophobicContact CD2-CG1 3.66Å; V937-I1100 HydrophobicContact CG1-CD1 4.13Å; V937-I1100 HydrophobicContact CG1-CG1 4.08Å; V937-I1100 HydrophobicContact CG1-CG2 4.2Å; L941-I1100 HydrophobicContact CD1-CG2 3.79Å; V1004-I1100 HydrophobicContact CG2-CD1 3.92Å; I1096-I1100 HydrophobicContact CG2-CD1 3.9Å; I1096-I1100 WeakPolarHBondContact O-CG1 3.49Å; I1096-I1100 PolarHBondContact O-N 2.88Å; L1097-I1100 PolarHBondContact O-N 3.42Å; I1100-S1102 PolarHBondContact O-N 3.09Å; I1100-F1103 HydrophobicContact CB-CD2 4.36Å; I1100-F1103 HydrophobicContact CG1-CD2 4.34Å; I1100-F1103 HydrophobicContact CG1-CE2 4.14Å; I1100-F1103 HydrophobicContact CG2-CD2 4.42Å; I1100-F1103 WeakPolarHBondContact O-CB 3.45Å; I1100-F1103 PolarHBondContact O-N 3.33Å; I1100-M1163 HydrophobicContact CD1-SD 3.9Å; I1100-M1163 HydrophobicContact CG2-CE 3.68Å; I1100-M1163 HydrophobicContact CG2-SD 3.99Å; I1100-L1167 HydrophobicContact CB-CD1 4.03Å; I1100-L1167 HydrophobicContact CG2-CD1 3.71Å
1101	R	93	Very high	93	Very high	109 Å²	109	46.5 Å²	46.5	41%	0.411	25%	0.246	S	C	.	.	H	α-helix	trans	-55.5	-37.6	175.6	-173.2	170.2	60.5	-171.2	-2.4	112.6	L1097 T1098 R1099 F1103 L1104 L1167	L1097-R1101 PolarHBondContact O-N 2.9Å; T1098-R1101 WeakPolarHBondContact O-CB 3.38Å; T1098-R1101 PolarHBondContact O-N 3.35Å; R1099-R1101 PolarHBondContact O-N 2.89Å; R1101-F1103 PolarHBondContact O-N 3.35Å; R1101-L1104 PolarHBondContact O-N 2.98Å; R1101-L1167 HydrophobicContact CB-CB 4.23Å; R1101-L1167 HydrophobicContact CB-CD1 4.33Å; R1101-L1167 HydrophobicContact CB-CD2 4.21Å; R1101-L1167 HydrophobicContact CB-CG 4.48Å; R1101-L1167 WeakPolarHBondContact CD-O 3.49Å; R1101-L1167 HydrophobicContact CG-CB 4.22Å
1102	S	93.7	Very high	93.2	Very high	58 Å²	58	48.1 Å²	48.1	41%	0.406	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-12.1	177	75.1	0	0	0	0	113.8	R1099 I1100 L1104	R1099-S1102 WeakPolarHBondContact O-CB 3.3Å; R1099-S1102 PolarHBondContact O-N 2.72Å; R1099-S1102 VanDerWaalsContact O-N 3.07Å; R1099-S1102 PolarHBondContact O-OG 3.15Å; I1100-S1102 PolarHBondContact O-N 3.09Å; S1102-L1104 VanDerWaalsContact C-N 3.3Å
1103	F	96.3	Very high	93.2	Very high	19 Å²	19	53.5 Å²	53.5	8%	0.083	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-12.1	176.8	-52.3	-22.6	0	0	0	112.3	L934 K938 L941 Q942 I1100 R1101	L934-F1103 HydrophobicContact CD2-CE2 4.31Å; K938-F1103 HydrophobicContact CB-CD1 4.3Å; K938-F1103 HydrophobicContact CB-CD2 3.71Å; K938-F1103 HydrophobicContact CB-CE1 4.28Å; K938-F1103 HydrophobicContact CB-CE2 3.67Å; K938-F1103 HydrophobicContact CB-CG 4.05Å; K938-F1103 HydrophobicContact CB-CZ 3.97Å; K938-F1103 HydrophobicContact CD-CD1 4.06Å; K938-F1103 HydrophobicContact CD-CE1 3.9Å; K938-F1103 HydrophobicContact CD-CZ 4.26Å; K938-F1103 HydrophobicContact CG-CD1 3.9Å; K938-F1103 HydrophobicContact CG-CD2 4.14Å; K938-F1103 HydrophobicContact CG-CE1 4.11Å; K938-F1103 HydrophobicContact CG-CE2 4.33Å; K938-F1103 HydrophobicContact CG-CG 3.94Å; K938-F1103 HydrophobicContact CG-CZ 4.32Å; L941-F1103 HydrophobicContact CD1-CB 4.5Å; Q942-F1103 HydrophobicContact CG-CB 4.43Å; Q942-F1103 WeakPolarHBondContact CG-O 3.34Å; Q942-F1103 PolarHBondContact NE2-O 2.86Å; Q942-F1103 VanDerWaalsContact NE2-O 3.13Å; I1100-F1103 HydrophobicContact CB-CD2 4.36Å; I1100-F1103 HydrophobicContact CG1-CD2 4.34Å; I1100-F1103 HydrophobicContact CG1-CE2 4.14Å; I1100-F1103 HydrophobicContact CG2-CD2 4.42Å; I1100-F1103 WeakPolarHBondContact O-CB 3.45Å; I1100-F1103 PolarHBondContact O-N 3.33Å; R1101-F1103 PolarHBondContact O-N 3.35Å
1104	L	95.1	Very high	93.1	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.291	C	S	.	.			trans	-103.4	36.5	-173.8	-57.7	172.7	0	0	0	113	L941 R1101 S1102 W1109 R1110 I1164 L1167 L1168	L941-L1104 HydrophobicContact CD1-CD2 4.19Å; L941-L1104 HydrophobicContact CD2-CD2 4.37Å; R1101-L1104 PolarHBondContact O-N 2.98Å; S1102-L1104 VanDerWaalsContact C-N 3.3Å; L1104-W1109 HydrophobicContact CB-CG 4.32Å; L1104-W1109 HydrophobicContact CD2-CD2 3.9Å; L1104-W1109 HydrophobicContact CD2-CE3 4.29Å; L1104-W1109 HydrophobicContact CD2-CG 4.4Å; L1104-W1109 HydrophobicContact CD2-CH2 4.15Å; L1104-W1109 HydrophobicContact CD2-CZ2 3.75Å; L1104-W1109 HydrophobicContact CD2-CZ3 4.39Å; L1104-R1110 PolarHBondContact O-NH1 2.76Å; L1104-I1164 HydrophobicContact CD1-CG2 4.09Å; L1104-I1164 HydrophobicContact CD2-CG2 4.47Å; L1104-L1167 HydrophobicContact CD1-CB 4.26Å; L1104-L1168 HydrophobicContact CB-CD2 4.14Å; L1104-L1168 HydrophobicContact CD1-CD2 4.34Å; L1104-L1168 HydrophobicContact CD1-CG 4.29Å
1105	D	92.6	Very high	93	Very high	113 Å²	113	57.7 Å²	57.7	60%	0.604	32%	0.318	S	S	*	.			trans	-79.9	-15.1	-176.9	-72.6	-18.7	0	0	0	114.1
1106	D	95.3	Very high	92.8	Very high	42 Å²	42	57.9 Å²	57.9	23%	0.225	32%	0.316	C	S	.	.	S	Bend	trans	-59.4	134.8	177.4	-167.4	-70.6	0	0	0	111.1	L946 K950 I1108 W1109	L946-D1106 HydrophobicContact CD1-CB 3.95Å; L946-D1106 HydrophobicContact CD2-CB 4.29Å; K950-D1106 WeakPolarHBondContact CE-OD1 3.46Å; K950-D1106 VanDerWaalsContact CE-OD2 3.26Å; K950-D1106 WeakPolarHBondContact CE-OD2 3.3Å; K950-D1106 IonicContact NZ-OD1 2.81Å; K950-D1106 IonicContact NZ-OD2 3.25Å; K950-D1106 PolarHBondContact NZ-OD2 2.91Å; D1106-I1108 HydrophobicContact CB-CG2 4.37Å; D1106-I1108 PolarHBondContact O-N 3.27Å; D1106-I1108 VanDerWaalsContact O-N 3.11Å; D1106-I1108 WeakPolarHBondContact OD1-CB 3.47Å; D1106-I1108 WeakPolarHBondContact OD1-CG2 3.36Å; D1106-I1108 PolarHBondContact OD1-N 2.76Å; D1106-W1109 PolarHBondContact O-N 2.78Å
1107	P	92.5	Very high	92.5	Very high	98 Å²	98	59.1 Å²	59.1	64%	0.636	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-60.8	-24.8	-175.5	23.9	-35.7	0	0	0	113.5	W1109 R1110 G1111	P1107-W1109 PolarHBondContact O-N 3.44Å; P1107-W1109 VanDerWaalsContact O-N 3.14Å; P1107-R1110 PolarHBondContact O-N 3.11Å; P1107-G1111 PolarHBondContact O-N 3.25Å
1108	I	93.4	Very high	92.3	Very high	35 Å²	35	62.3 Å²	62.3	18%	0.179	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-60.2	-27.4	-178.5	-162.8	63.3	0	0	0	113	L946 V949 K950 M953 D1106 R1110	L946-I1108 HydrophobicContact CD1-CG2 3.59Å; V949-I1108 HydrophobicContact CG1-CG1 4.4Å; V949-I1108 HydrophobicContact CG1-CG2 4.35Å; K950-I1108 HydrophobicContact CG-CB 4.15Å; K950-I1108 HydrophobicContact CG-CG1 3.93Å; K950-I1108 HydrophobicContact CG-CG2 3.98Å; M953-I1108 HydrophobicContact CB-CD1 4.17Å; M953-I1108 HydrophobicContact CB-CG1 4.49Å; M953-I1108 HydrophobicContact CG-CD1 3.99Å; D1106-I1108 HydrophobicContact CB-CG2 4.37Å; D1106-I1108 PolarHBondContact O-N 3.27Å; D1106-I1108 VanDerWaalsContact O-N 3.11Å; D1106-I1108 WeakPolarHBondContact OD1-CB 3.47Å; D1106-I1108 WeakPolarHBondContact OD1-CG2 3.36Å; D1106-I1108 PolarHBondContact OD1-N 2.76Å; I1108-R1110 PolarHBondContact O-N 3.17Å
1109	W	93.5	Very high	92.2	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.008	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-66.8	-37	-179.5	-63.7	115	0	0	0	112.5	I945 L946 V949 L1104 D1106 P1107 F1127 I1164 L1168 Q1170	I945-W1109 HydrophobicContact CG2-CH2 4.08Å; L946-W1109 HydrophobicContact CB-CZ2 4.41Å; L946-W1109 HydrophobicContact CD1-CZ2 3.85Å; V949-W1109 HydrophobicContact CB-CH2 4.32Å; V949-W1109 HydrophobicContact CB-CZ3 4.39Å; V949-W1109 HydrophobicContact CG1-CE3 4.37Å; V949-W1109 HydrophobicContact CG1-CH2 4.5Å; V949-W1109 HydrophobicContact CG1-CZ3 4.15Å; V949-W1109 HydrophobicContact CG2-CH2 3.71Å; V949-W1109 HydrophobicContact CG2-CZ3 3.76Å; L1104-W1109 HydrophobicContact CB-CG 4.32Å; L1104-W1109 HydrophobicContact CD2-CD2 3.9Å; L1104-W1109 HydrophobicContact CD2-CE3 4.29Å; L1104-W1109 HydrophobicContact CD2-CG 4.4Å; L1104-W1109 HydrophobicContact CD2-CH2 4.15Å; L1104-W1109 HydrophobicContact CD2-CZ2 3.75Å; L1104-W1109 HydrophobicContact CD2-CZ3 4.39Å; D1106-W1109 PolarHBondContact O-N 2.78Å; P1107-W1109 PolarHBondContact O-N 3.44Å; P1107-W1109 VanDerWaalsContact O-N 3.14Å; W1109-F1127 HydrophobicContact CE3-CB 4.05Å; W1109-F1127 AromaticContact CE3-CD2 3.73Å; W1109-F1127 HydrophobicContact CE3-CD2 3.73Å; W1109-F1127 HydrophobicContact CE3-CE2 4.41Å; W1109-F1127 AromaticContact CE3-CG 3.92Å; W1109-F1127 HydrophobicContact CE3-CG 3.92Å; W1109-F1127 AromaticContact CZ3-CD2 3.45Å; W1109-F1127 HydrophobicContact CZ3-CD2 3.45Å; W1109-F1127 VanDerWaalsContact CZ3-CD2 3.45Å; W1109-F1127 AromaticContact CZ3-CE2 3.7Å; W1109-F1127 HydrophobicContact CZ3-CE2 3.7Å; W1109-F1127 HydrophobicContact CZ3-CG 4.04Å; W1109-F1127 HydrophobicContact CZ3-CZ 4.45Å; W1109-F1127 PolarHBondContact O-N 2.99Å; W1109-I1164 HydrophobicContact CE3-CG2 3.95Å; W1109-I1164 HydrophobicContact CZ3-CD1 4.42Å; W1109-I1164 HydrophobicContact CZ3-CG2 3.91Å; W1109-L1168 HydrophobicContact CB-CD1 3.85Å; W1109-L1168 HydrophobicContact CB-CD2 3.8Å; W1109-L1168 HydrophobicContact CB-CG 4.5Å; W1109-L1168 HydrophobicContact CE3-CD1 4.4Å; W1109-Q1170 PolarHBondContact O-NE2 2.95Å
1110	R	92.7	Very high	92.1	Very high	99 Å²	99	58.7 Å²	58.7	37%	0.374	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-21.4	-176.3	-62.2	178.4	-173.3	76.1	-1.1	113.3	L1104 P1107 I1108 L1168	L1104-R1110 PolarHBondContact O-NH1 2.76Å; P1107-R1110 PolarHBondContact O-N 3.11Å; I1108-R1110 PolarHBondContact O-N 3.17Å; R1110-L1168 HydrophobicContact CG-CD2 4.11Å
1111	G	91.6	Very high	91.8	Very high	22 Å²	22	61.3 Å²	61.3	23%	0.227	35%	0.351	C	S	.	.			trans	72.2	-178.4	-175.6	0	0	0	0	0	113.5	P1107 V1125	P1107-G1111 PolarHBondContact O-N 3.25Å; G1111-V1125 VanDerWaalsContact CA-O 3.28Å; G1111-V1125 WeakPolarHBondContact CA-O 3.25Å
1112	P	92.4	Very high	91.7	Very high	84 Å²	84	58.4 Å²	58.4	55%	0.545	34%	0.344	S	S	.	.	S	Bend	trans	-69.1	174.5	175.9	30.8	-35.4	0	0	0	112	H1120 V1125	P1112-H1120 PolarHBondContact O-CE1 3.17Å; P1112-H1120 PolarHBondContact O-NE2 2.91Å; P1112-V1125 HydrophobicContact CG-CB 4.46Å; P1112-V1125 HydrophobicContact CG-CG2 4.23Å
1113	L	89.6	Confident	91.6	Very high	156 Å²	156	58 Å²	58	82%	0.817	34%	0.335	S	S	*	.			trans	-67.4	145.3	172	-69.6	172.3	0	0	0	111.3
1114	P	91.8	Very high	91.5	Very high	23 Å²	23	57.2 Å²	57.2	15%	0.149	33%	0.332	C	S	.	.			trans	-73	138.9	-177.3	30.2	-35.9	0	0	0	112.8	N1116 G1117 H1120	P1114-N1116 PolarHBondContact O-N 3.42Å; P1114-G1117 PolarHBondContact O-N 3.09Å; P1114-H1120 WeakPolarHBondContact CA-CE1 3.42Å
1115	S	88.9	Confident	91.4	Very high	110 Å²	110	59 Å²	59	77%	0.769	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-32.6	-178.1	-52	0	0	0	0	113.5	G1117	S1115-G1117 VanDerWaalsContact C-N 3.31Å
1116	N	88.6	Confident	91.5	Very high	85 Å²	85	54.1 Å²	54.1	46%	0.455	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	1.8	179	62.8	18.7	0	0	0	113.7	P1114 V1118 M1119	P1114-N1116 PolarHBondContact O-N 3.42Å; N1116-V1118 PolarHBondContact O-N 3.4Å; N1116-V1118 VanDerWaalsContact O-N 3.15Å; N1116-V1118 WeakPolarHBondContact OD1-CA 3.33Å; N1116-V1118 PolarHBondContact OD1-N 2.98Å; N1116-M1119 PolarHBondContact ND2-O 3.38Å; N1116-M1119 PolarHBondContact OD1-N 3.26Å; N1116-M1119 PolarHBondContact OD1-O 2.96Å; N1116-M1119 VanDerWaalsContact OD1-O 3.05Å
1117	G	86.6	Confident	91.5	Very high	37 Å²	37	52.2 Å²	52.2	38%	0.381	31%	0.306	S	S	.	.	S	Bend	trans	68.5	4.1	-175.9	0	0	0	0	0	114.8	P1114 S1115 R1240	P1114-G1117 PolarHBondContact O-N 3.09Å; S1115-G1117 VanDerWaalsContact C-N 3.31Å; G1117-R1240 PolarHBondContact O-NH1 2.99Å; G1117-R1240 PolarHBondContact O-NH2 3.17Å
1118	V	88.4	Confident	91.7	Very high	70 Å²	70	47.5 Å²	47.5	42%	0.424	28%	0.276	S	S	.	.	S	Bend	trans	-113.5	-72.4	-176.5	-174.1	0	0	0	0	111.2	N1116 R1240 F1242	N1116-V1118 PolarHBondContact O-N 3.4Å; N1116-V1118 VanDerWaalsContact O-N 3.15Å; N1116-V1118 WeakPolarHBondContact OD1-CA 3.33Å; N1116-V1118 PolarHBondContact OD1-N 2.98Å; V1118-R1240 VanDerWaalsContact CA-NH2 3.29Å; V1118-R1240 PolarHBondContact O-NH2 2.9Å; V1118-F1242 HydrophobicContact CB-CZ 4.39Å; V1118-F1242 HydrophobicContact CG1-CZ 4.14Å; V1118-F1242 HydrophobicContact CG2-CE1 3.83Å; V1118-F1242 HydrophobicContact CG2-CZ 3.82Å
1119	M	90.8	Very high	91.8	Very high	62 Å²	62	46 Å²	46	31%	0.305	27%	0.268	S	S	.	.			trans	-159.2	153.7	-178	60.3	-179.4	-87.6	0	0	110.6	N1116 V1121 R1173 L1177	N1116-M1119 PolarHBondContact ND2-O 3.38Å; N1116-M1119 PolarHBondContact OD1-N 3.26Å; N1116-M1119 PolarHBondContact OD1-O 2.96Å; N1116-M1119 VanDerWaalsContact OD1-O 3.05Å; M1119-V1121 HydrophobicContact CG-CG2 4.31Å; M1119-R1173 HydrophobicContact CE-CB 4.39Å; M1119-R1173 HydrophobicContact CE-CG 3.73Å; M1119-R1173 HydrophobicContact SD-CG 4.45Å; M1119-L1177 HydrophobicContact CE-CD1 3.99Å
1120	H	91.1	Very high	91.9	Very high	8 Å²	8	45.9 Å²	45.9	4%	0.037	27%	0.267	C	S	.	.			trans	-67	138.7	170.2	-63.9	-68.3	0	0	0	110	P1112 P1114 E1123 E1126	P1112-H1120 PolarHBondContact O-CE1 3.17Å; P1112-H1120 PolarHBondContact O-NE2 2.91Å; P1114-H1120 WeakPolarHBondContact CA-CE1 3.42Å; H1120-E1123 HydrophobicContact CB-CB 4.38Å; H1120-E1126 IonicContact CD2-OE1 3.5Å
1121	V	89.7	Confident	92.2	Very high	55 Å²	55	41.1 Å²	41.1	33%	0.333	25%	0.25	S	C	.	.	S	Bend	trans	-123.1	-55.3	-176.5	-178.3	0	0	0	0	110.6	M1119 E1123 R1129 L1177	M1119-V1121 HydrophobicContact CG-CG2 4.31Å; V1121-E1123 PolarHBondContact N-OE2 3.39Å; V1121-R1129 PolarHBondContact O-NH2 3.47Å; V1121-L1177 HydrophobicContact CG1-CD2 4.29Å
1122	D	90.2	Very high	92.4	Very high	48 Å²	48	40.1 Å²	40.1	26%	0.257	24%	0.239	S	C	.	.	S	Bend	trans	-104.2	-18.8	-179.5	-65.9	-35.2	0	0	0	111.8	I959 C960 R961	I959-D1122 CarbonylContact C-O 3.46Å; I959-D1122 WeakPolarHBondContact CA-O 3.32Å; I959-D1122 HydrophobicContact CG2-CB 3.52Å; C960-D1122 PolarHBondContact N-O 2.95Å; R961-D1122 WeakPolarHBondContact CA-OD1 3.25Å; R961-D1122 WeakPolarHBondContact CG-OD1 3.34Å
1123	E	92.3	Very high	92.5	Very high	49 Å²	49	36.1 Å²	36.1	23%	0.229	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-69	133.6	-179.9	-57	85.9	169.1	0	0	111.8	H1120 V1121 V1125	H1120-E1123 HydrophobicContact CB-CB 4.38Å; V1121-E1123 PolarHBondContact N-OE2 3.39Å; E1123-V1125 HydrophobicContact CB-CG1 4.39Å; E1123-V1125 HydrophobicContact CB-CG2 4.15Å; E1123-V1125 PolarHBondContact O-N 3.49Å
1124	C	93.6	Very high	92.9	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.02	18%	0.175	C	C	.	.			trans	-101.2	64.9	177.2	-60.5	0	0	0	0	111.1	M956 P957 K958 R1129	M956-C1124 HydrophobicContact CE-CB 4.41Å; M956-C1124 HydrophobicContact CG-CB 3.66Å; P957-C1124 WeakPolarHBondContact O-CB 3.47Å; K958-C1124 PolarHBondContact O-N 3.2Å; C1124-R1129 HydrophobicContact CB-CB 4.19Å
1125	V	92.9	Very high	93.1	Very high	38 Å²	38	27.8 Å²	27.8	23%	0.23	17%	0.168	C	C	.	.			trans	-118.9	-2.3	-174.4	-61.4	0	0	0	0	114.1	G1111 P1112 E1123	G1111-V1125 VanDerWaalsContact CA-O 3.28Å; G1111-V1125 WeakPolarHBondContact CA-O 3.25Å; P1112-V1125 HydrophobicContact CG-CB 4.46Å; P1112-V1125 HydrophobicContact CG-CG2 4.23Å; E1123-V1125 HydrophobicContact CB-CG1 4.39Å; E1123-V1125 HydrophobicContact CB-CG2 4.15Å; E1123-V1125 PolarHBondContact O-N 3.49Å
1126	E	94.6	Very high	93.5	Very high	11 Å²	11	22.5 Å²	22.5	5%	0.051	13%	0.131	C	C	.	.	S	Bend	trans	-107.7	149.1	178.2	-58.3	-170	121.5	0	0	110.3	H1120 H1128 R1129 R1173	H1120-E1126 IonicContact CD2-OE1 3.5Å; E1126-H1128 VanDerWaalsContact C-N 3.3Å; E1126-H1128 PolarHBondContact O-N 3.37Å; E1126-H1128 IonicContact OE2-CD2 3.38Å; E1126-H1128 PolarHBondContact OE2-CD2 3.39Å; E1126-H1128 IonicContact OE2-CE1 3.86Å; E1126-H1128 IonicContact OE2-NE2 2.7Å; E1126-H1128 PolarHBondContact OE2-NE2 3.18Å; E1126-R1129 WeakPolarHBondContact O-CB 3.24Å; E1126-R1129 PolarHBondContact O-N 3.01Å; E1126-R1173 IonicContact OE1-CZ 3.37Å; E1126-R1173 IonicContact OE1-NE 3.25Å; E1126-R1173 PolarHBondContact OE1-NE 2.97Å; E1126-R1173 IonicContact OE1-NH2 2.72Å; E1126-R1173 PolarHBondContact OE1-NH2 3.33Å; E1126-R1173 IonicContact OE2-CZ 3.72Å; E1126-R1173 IonicContact OE2-NE 2.91Å; E1126-R1173 PolarHBondContact OE2-NE 3.48Å; E1126-R1173 IonicContact OE2-NH2 3.66Å
1127	F	96.9	Very high	93.8	Very high	1 Å²	1	19.2 Å²	19.2	0%	0.004	11%	0.114	C	C	.	.	H	α-helix	trans	-53.8	-41.6	-178.6	176	-100.4	0	0	0	113.9	V949 W1109 R1129 L1130 W1131 I1164 I1165 L1168	V949-F1127 HydrophobicContact CG1-CD2 4.22Å; V949-F1127 HydrophobicContact CG2-CD2 4.17Å; V949-F1127 HydrophobicContact CG2-CE2 3.95Å; W1109-F1127 HydrophobicContact CE3-CB 4.05Å; W1109-F1127 AromaticContact CE3-CD2 3.73Å; W1109-F1127 HydrophobicContact CE3-CD2 3.73Å; W1109-F1127 HydrophobicContact CE3-CE2 4.41Å; W1109-F1127 AromaticContact CE3-CG 3.92Å; W1109-F1127 HydrophobicContact CE3-CG 3.92Å; W1109-F1127 AromaticContact CZ3-CD2 3.45Å; W1109-F1127 HydrophobicContact CZ3-CD2 3.45Å; W1109-F1127 VanDerWaalsContact CZ3-CD2 3.45Å; W1109-F1127 AromaticContact CZ3-CE2 3.7Å; W1109-F1127 HydrophobicContact CZ3-CE2 3.7Å; W1109-F1127 HydrophobicContact CZ3-CG 4.04Å; W1109-F1127 HydrophobicContact CZ3-CZ 4.45Å; W1109-F1127 PolarHBondContact O-N 2.99Å; F1127-R1129 PolarHBondContact O-N 2.87Å; F1127-R1129 VanDerWaalsContact O-N 3.11Å; F1127-L1130 WeakPolarHBondContact O-CA 3.28Å; F1127-L1130 WeakPolarHBondContact O-CB 3.39Å; F1127-L1130 PolarHBondContact O-N 3.39Å; F1127-W1131 HydrophobicContact CE1-CB 4.26Å; F1127-W1131 PolarHBondContact O-N 3.49Å; F1127-I1164 HydrophobicContact CD1-CB 4.1Å; F1127-I1164 HydrophobicContact CD1-CG2 3.41Å; F1127-I1164 VanDerWaalsContact CD1-CG2 3.41Å; F1127-I1164 HydrophobicContact CD2-CG2 4.45Å; F1127-I1164 HydrophobicContact CE1-CB 3.67Å; F1127-I1164 HydrophobicContact CE1-CD1 4.26Å; F1127-I1164 HydrophobicContact CE1-CG2 3.45Å; F1127-I1164 VanDerWaalsContact CE1-CG2 3.45Å; F1127-I1164 HydrophobicContact CE2-CG2 4.48Å; F1127-I1164 HydrophobicContact CG-CG2 3.94Å; F1127-I1164 HydrophobicContact CZ-CB 4.23Å; F1127-I1164 HydrophobicContact CZ-CD1 3.93Å; F1127-I1164 HydrophobicContact CZ-CG2 4.01Å; F1127-I1165 HydrophobicContact CD1-CG1 3.96Å; F1127-I1165 HydrophobicContact CE1-CG1 4.03Å; F1127-L1168 HydrophobicContact CB-CD1 4Å
1128	H	96.5	Very high	94.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.5	-25.5	179.8	77.2	90.4	0	0	0	113.8	E1126 W1131 S1132 I1165 Q1170 F1174	E1126-H1128 VanDerWaalsContact C-N 3.3Å; E1126-H1128 PolarHBondContact O-N 3.37Å; E1126-H1128 IonicContact OE2-CD2 3.38Å; E1126-H1128 PolarHBondContact OE2-CD2 3.39Å; E1126-H1128 IonicContact OE2-CE1 3.86Å; E1126-H1128 IonicContact OE2-NE2 2.7Å; E1126-H1128 PolarHBondContact OE2-NE2 3.18Å; H1128-W1131 PolarHBondContact O-N 2.76Å; H1128-S1132 PolarHBondContact O-N 3.34Å; H1128-S1132 PolarHBondContact O-OG 3.19Å; H1128-I1165 HydrophobicContact CB-CD1 4.12Å; H1128-I1165 HydrophobicContact CB-CG1 4Å; H1128-I1165 HydrophobicContact CB-CG2 4.44Å; H1128-Q1170 HydrophobicContact CB-CB 4.06Å; H1128-Q1170 PolarHBondContact CD2-OE1 2.98Å; H1128-F1174 HydrophobicContact CB-CB 3.92Å; H1128-F1174 HydrophobicContact CB-CD2 4.06Å; H1128-F1174 HydrophobicContact CB-CG 4.37Å; H1128-F1174 WeakPolarHBondContact ND1-CA 3.32Å
1129	R	95.7	Very high	94.6	Very high	2 Å²	2	14.5 Å²	14.5	1%	0.008	8%	0.077	C	C	.	.	H	α-helix	trans	-71.2	-40.2	173.7	-71.8	-62	-149.4	165	-0.8	112.3	V1121 C1124 E1126 F1127 W1131 S1132 A1133 L1177	V1121-R1129 PolarHBondContact O-NH2 3.47Å; C1124-R1129 HydrophobicContact CB-CB 4.19Å; E1126-R1129 WeakPolarHBondContact O-CB 3.24Å; E1126-R1129 PolarHBondContact O-N 3.01Å; F1127-R1129 PolarHBondContact O-N 2.87Å; F1127-R1129 VanDerWaalsContact O-N 3.11Å; R1129-W1131 VanDerWaalsContact C-N 3.33Å; R1129-S1132 WeakPolarHBondContact O-CB 3.43Å; R1129-S1132 PolarHBondContact O-N 3.35Å; R1129-A1133 PolarHBondContact O-N 2.85Å; R1129-A1133 VanDerWaalsContact O-N 3.15Å; R1129-L1177 PolarHBondContact NH1-O 3.27Å
1130	L	95.8	Very high	94.8	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-64.6	-40.7	171.3	175.7	61.4	0	0	0	110.6	V949 L952 M953 M956 I983 F1127 S1132 A1133 M1134	V949-L1130 HydrophobicContact CB-CD2 4.34Å; V949-L1130 HydrophobicContact CG1-CD2 4.08Å; V949-L1130 HydrophobicContact CG2-CD2 4.25Å; L952-L1130 HydrophobicContact CB-CD1 3.69Å; L952-L1130 HydrophobicContact CB-CD2 4.07Å; L952-L1130 HydrophobicContact CD1-CD1 4.43Å; M953-L1130 HydrophobicContact CE-CB 3.76Å; M953-L1130 HydrophobicContact CE-CD2 4.25Å; M956-L1130 HydrophobicContact SD-CD1 4.44Å; I983-L1130 HydrophobicContact CD1-CD1 4.38Å; F1127-L1130 WeakPolarHBondContact O-CA 3.28Å; F1127-L1130 WeakPolarHBondContact O-CB 3.39Å; F1127-L1130 PolarHBondContact O-N 3.39Å; L1130-S1132 PolarHBondContact O-N 3.28Å; L1130-A1133 WeakPolarHBondContact O-CA 3.44Å; L1130-A1133 VanDerWaalsContact O-CB 3.26Å; L1130-A1133 WeakPolarHBondContact O-CB 3.32Å; L1130-A1133 PolarHBondContact O-N 3.24Å; L1130-A1133 VanDerWaalsContact O-N 3.08Å; L1130-M1134 HydrophobicContact CD1-CE 4.15Å; L1130-M1134 HydrophobicContact CD2-CE 4.11Å; L1130-M1134 HydrophobicContact CG-CE 3.96Å; L1130-M1134 WeakPolarHBondContact O-CG 3.36Å; L1130-M1134 PolarHBondContact O-N 3Å
1131	W	97.4	Very high	94.8	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.7	-39.4	174.2	-172.7	-110.5	0	0	0	112.5	L997 F1127 H1128 R1129 A1133 M1134 Q1135 Y1138 L1157 I1165 F1174	L997-W1131 HydrophobicContact CD1-CZ3 3.93Å; F1127-W1131 HydrophobicContact CE1-CB 4.26Å; F1127-W1131 PolarHBondContact O-N 3.49Å; H1128-W1131 PolarHBondContact O-N 2.76Å; R1129-W1131 VanDerWaalsContact C-N 3.33Å; W1131-A1133 PolarHBondContact O-N 3.47Å; W1131-M1134 HydrophobicContact CE3-CB 4.18Å; W1131-M1134 HydrophobicContact CE3-SD 3.83Å; W1131-M1134 HydrophobicContact CZ3-CB 4.5Å; W1131-M1134 HydrophobicContact CZ3-SD 4.09Å; W1131-M1134 CarbonylContact O-C 3.46Å; W1131-M1134 PolarHBondContact O-N 2.66Å; W1131-Q1135 WeakPolarHBondContact O-CB 3.48Å; W1131-Q1135 PolarHBondContact O-N 3.27Å; W1131-Y1138 HydrophobicContact CH2-CE1 4.21Å; W1131-Y1138 HydrophobicContact CZ2-CE1 4.05Å; W1131-L1157 HydrophobicContact CH2-CD1 4.02Å; W1131-L1157 HydrophobicContact CH2-CG 4.09Å; W1131-L1157 WeakPolarHBondContact CH2-O 3.28Å; W1131-L1157 HydrophobicContact CZ3-CD1 4.32Å; W1131-I1165 HydrophobicContact CB-CD1 3.91Å; W1131-I1165 HydrophobicContact CG-CD1 3.69Å; W1131-F1174 AromaticContact CD1-CE2 3.68Å; W1131-F1174 AromaticContact CD1-CZ 3.78Å
1132	S	96.5	Very high	95	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-59.3	-34.5	171.4	-70.5	0	0	0	0	112.9	H1128 R1129 L1130 F1136 F1174 D1178	H1128-S1132 PolarHBondContact O-N 3.34Å; H1128-S1132 PolarHBondContact O-OG 3.19Å; R1129-S1132 WeakPolarHBondContact O-CB 3.43Å; R1129-S1132 PolarHBondContact O-N 3.35Å; L1130-S1132 PolarHBondContact O-N 3.28Å; S1132-F1136 PolarHBondContact O-N 3.3Å; S1132-F1174 WeakPolarHBondContact OG-CD2 3.36Å; S1132-F1174 VanDerWaalsContact OG-CE2 3.29Å; S1132-F1174 WeakPolarHBondContact OG-CE2 3.47Å; S1132-D1178 VanDerWaalsContact CA-OD1 3.3Å; S1132-D1178 WeakPolarHBondContact CA-OD1 3.32Å; S1132-D1178 WeakPolarHBondContact CB-OD1 3.29Å; S1132-D1178 WeakPolarHBondContact OG-CA 3.43Å; S1132-D1178 PolarHBondContact OG-OD1 3.17Å
1133	A	95.6	Very high	94.8	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-69	-46.1	174	0	0	0	0	0	111.5	M956 L980 I983 R1129 L1130 W1131 Q1135 F1136 V1137	M956-A1133 HydrophobicContact CE-CB 3.61Å; M956-A1133 HydrophobicContact SD-CB 3.64Å; L980-A1133 HydrophobicContact CD2-CB 4.12Å; I983-A1133 HydrophobicContact CB-CB 4.49Å; I983-A1133 HydrophobicContact CG1-CB 4.32Å; I983-A1133 HydrophobicContact CG2-CB 4Å; R1129-A1133 PolarHBondContact O-N 2.85Å; R1129-A1133 VanDerWaalsContact O-N 3.15Å; L1130-A1133 WeakPolarHBondContact O-CA 3.44Å; L1130-A1133 VanDerWaalsContact O-CB 3.26Å; L1130-A1133 WeakPolarHBondContact O-CB 3.32Å; L1130-A1133 PolarHBondContact O-N 3.24Å; L1130-A1133 VanDerWaalsContact O-N 3.08Å; W1131-A1133 PolarHBondContact O-N 3.47Å; A1133-Q1135 VanDerWaalsContact C-N 3.27Å; A1133-Q1135 PolarHBondContact O-N 3.31Å; A1133-F1136 WeakPolarHBondContact O-CB 3.25Å; A1133-F1136 PolarHBondContact O-N 2.91Å; A1133-V1137 WeakPolarHBondContact O-CG2 3.48Å; A1133-V1137 PolarHBondContact O-N 3.45Å; A1133-V1137 VanDerWaalsContact O-N 3.09Å
1134	M	96.3	Very high	94.5	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.02	11%	0.11	C	C	.	.	H	α-helix	trans	-60.2	-39.4	174.1	-67.5	-178.9	176.9	0	0	111.6	L952 L989 F994 L997 L1130 W1131 V1137 Y1138	L952-M1134 HydrophobicContact CD1-CE 3.56Å; L989-M1134 HydrophobicContact CD1-CE 3.96Å; L989-M1134 HydrophobicContact CD1-CG 4.23Å; F994-M1134 HydrophobicContact CE1-CB 4.01Å; F994-M1134 HydrophobicContact CE1-CG 4.11Å; F994-M1134 HydrophobicContact CE1-SD 4.16Å; F994-M1134 HydrophobicContact CZ-CB 4.36Å; L997-M1134 HydrophobicContact CD1-SD 4.43Å; L1130-M1134 HydrophobicContact CD1-CE 4.15Å; L1130-M1134 HydrophobicContact CD2-CE 4.11Å; L1130-M1134 HydrophobicContact CG-CE 3.96Å; L1130-M1134 WeakPolarHBondContact O-CG 3.36Å; L1130-M1134 PolarHBondContact O-N 3Å; W1131-M1134 HydrophobicContact CE3-CB 4.18Å; W1131-M1134 HydrophobicContact CE3-SD 3.83Å; W1131-M1134 HydrophobicContact CZ3-CB 4.5Å; W1131-M1134 HydrophobicContact CZ3-SD 4.09Å; W1131-M1134 CarbonylContact O-C 3.46Å; W1131-M1134 PolarHBondContact O-N 2.66Å; M1134-V1137 WeakPolarHBondContact O-CB 3.49Å; M1134-V1137 PolarHBondContact O-N 3.33Å; M1134-V1137 VanDerWaalsContact O-N 3.13Å; M1134-Y1138 WeakPolarHBondContact O-CD1 3.41Å; M1134-Y1138 PolarHBondContact O-N 3.34Å
1135	Q	96.8	Very high	94.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.4	-43.2	174	175.9	156.1	-94.8	0	0	112.5	W1131 A1133 V1137 Y1138 C1139 D1178 C1180 N1215	W1131-Q1135 WeakPolarHBondContact O-CB 3.48Å; W1131-Q1135 PolarHBondContact O-N 3.27Å; A1133-Q1135 VanDerWaalsContact C-N 3.27Å; A1133-Q1135 PolarHBondContact O-N 3.31Å; Q1135-V1137 VanDerWaalsContact C-N 3.28Å; Q1135-V1137 PolarHBondContact O-N 3Å; Q1135-Y1138 HydrophobicContact CB-CE1 3.93Å; Q1135-Y1138 HydrophobicContact CB-CE2 4Å; Q1135-Y1138 VanDerWaalsContact CB-CZ 3.5Å; Q1135-Y1138 VanDerWaalsContact CB-OH 3.3Å; Q1135-Y1138 WeakPolarHBondContact CB-OH 3.46Å; Q1135-Y1138 HydrophobicContact CG-CE2 3.69Å; Q1135-Y1138 WeakPolarHBondContact CG-OH 3.46Å; Q1135-Y1138 PolarHBondContact O-N 2.7Å; Q1135-Y1138 PolarHBondContact OE1-OH 3.38Å; Q1135-C1139 VanDerWaalsContact O-CB 3.25Å; Q1135-C1139 WeakPolarHBondContact O-CB 3.38Å; Q1135-C1139 PolarHBondContact O-N 3.48Å; Q1135-C1139 PolarHBondContact O-SG 3.25Å; Q1135-D1178 PolarHBondContact NE2-OD1 3.49Å; Q1135-D1178 PolarHBondContact NE2-OD2 2.93Å; Q1135-C1180 HydrophobicContact CG-CB 4.22Å; Q1135-N1215 PolarHBondContact OE1-ND2 3.3Å
1136	F	96.4	Very high	94	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-56.2	-45.6	172	-174.9	-98.8	0	0	0	111.4	L973 F976 H977 L980 V984 S1132 A1133 C1139 I1140 C1180 M1204	L973-F1136 HydrophobicContact CD1-CE2 3.9Å; L973-F1136 HydrophobicContact CD1-CZ 3.96Å; F976-F1136 HydrophobicContact CB-CD2 4.26Å; F976-F1136 HydrophobicContact CB-CE2 3.71Å; F976-F1136 HydrophobicContact CB-CZ 3.91Å; H977-F1136 AromaticContact CD2-CZ 3.82Å; H977-F1136 AromaticContact CE1-CE1 3.93Å; H977-F1136 AromaticContact CE1-CZ 3.9Å; H977-F1136 AromaticContact CG-CZ 3.86Å; H977-F1136 AromaticContact ND1-CE1 3.79Å; H977-F1136 AromaticContact ND1-CZ 3.93Å; H977-F1136 AromaticContact NE2-CZ 3.84Å; L980-F1136 HydrophobicContact CB-CD1 4.3Å; L980-F1136 HydrophobicContact CD1-CB 3.77Å; L980-F1136 HydrophobicContact CD1-CD1 3.73Å; L980-F1136 HydrophobicContact CD1-CD2 4.37Å; L980-F1136 HydrophobicContact CD1-CE1 4.42Å; L980-F1136 HydrophobicContact CD1-CG 3.69Å; V984-F1136 HydrophobicContact CG2-CD1 4.12Å; V984-F1136 HydrophobicContact CG2-CE1 4.19Å; S1132-F1136 PolarHBondContact O-N 3.3Å; A1133-F1136 WeakPolarHBondContact O-CB 3.25Å; A1133-F1136 PolarHBondContact O-N 2.91Å; F1136-C1139 PolarHBondContact O-N 2.91Å; F1136-I1140 HydrophobicContact CD1-CD1 4.4Å; F1136-I1140 HydrophobicContact CE1-CD1 4.18Å; F1136-I1140 WeakPolarHBondContact O-CG1 3.38Å; F1136-I1140 PolarHBondContact O-N 2.99Å; F1136-C1180 WeakPolarHBondContact CA-SG 3.48Å; F1136-M1204 HydrophobicContact CD2-CE 3.72Å; F1136-M1204 HydrophobicContact CE2-CE 3.76Å; F1136-M1204 HydrophobicContact CG-CE 4.42Å; F1136-M1204 HydrophobicContact CZ-CE 4.49Å
1137	V	95.5	Very high	93.8	Very high	15 Å²	15	33.7 Å²	33.7	9%	0.091	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-49.4	178.4	-179	0	0	0	0	112.4	I983 V984 L989 A1133 M1134 Q1135 C1139 I1140	I983-V1137 HydrophobicContact CG2-CG2 4.11Å; V984-V1137 HydrophobicContact CB-CG2 4.35Å; V984-V1137 HydrophobicContact CG2-CG2 3.86Å; L989-V1137 HydrophobicContact CD2-CB 4.15Å; L989-V1137 HydrophobicContact CD2-CG1 3.96Å; L989-V1137 HydrophobicContact CD2-CG2 3.9Å; A1133-V1137 WeakPolarHBondContact O-CG2 3.48Å; A1133-V1137 PolarHBondContact O-N 3.45Å; A1133-V1137 VanDerWaalsContact O-N 3.09Å; M1134-V1137 WeakPolarHBondContact O-CB 3.49Å; M1134-V1137 PolarHBondContact O-N 3.33Å; M1134-V1137 VanDerWaalsContact O-N 3.13Å; Q1135-V1137 VanDerWaalsContact C-N 3.28Å; Q1135-V1137 PolarHBondContact O-N 3Å; V1137-C1139 VanDerWaalsContact C-N 3.32Å; V1137-C1139 PolarHBondContact O-N 3.31Å; V1137-I1140 WeakPolarHBondContact O-CB 3.47Å; V1137-I1140 PolarHBondContact O-N 3.13Å
1138	Y	95.3	Very high	93.7	Very high	9 Å²	9	35.2 Å²	35.2	4%	0.035	19%	0.191	C	C	.	.	H	α-helix	trans	-79.3	-15.4	-174.2	69	-126.4	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 4.21Å; W1131-Y1138 HydrophobicContact CZ2-CE1 4.05Å; M1134-Y1138 WeakPolarHBondContact O-CD1 3.41Å; M1134-Y1138 PolarHBondContact O-N 3.34Å; Q1135-Y1138 HydrophobicContact CB-CE1 3.93Å; Q1135-Y1138 HydrophobicContact CB-CE2 4Å; Q1135-Y1138 VanDerWaalsContact CB-CZ 3.5Å; Q1135-Y1138 VanDerWaalsContact CB-OH 3.3Å; Q1135-Y1138 WeakPolarHBondContact CB-OH 3.46Å; Q1135-Y1138 HydrophobicContact CG-CE2 3.69Å; Q1135-Y1138 WeakPolarHBondContact CG-OH 3.46Å; Q1135-Y1138 PolarHBondContact O-N 2.7Å; Q1135-Y1138 PolarHBondContact OE1-OH 3.38Å; Y1138-V1149 HydrophobicContact CD2-CG1 4.44Å; Y1138-V1149 HydrophobicContact CG-CG1 4.27Å; Y1138-H1158 AromaticContact CE1-CE1 3.89Å; Y1138-H1158 AromaticContact CE2-CE1 3.77Å; Y1138-H1158 AromaticContact CZ-CE1 3.62Å; Y1138-H1158 AromaticContact CZ-ND1 3.79Å; Y1138-R1207 PolarHBondContact O-NH2 3.22Å; Y1138-F1211 HydrophobicContact CD2-CD1 4.32Å; Y1138-F1211 AromaticContact CD2-CD2 3.98Å; Y1138-F1211 HydrophobicContact CD2-CD2 3.98Å; Y1138-F1211 HydrophobicContact CD2-CE1 4.29Å; Y1138-F1211 AromaticContact CD2-CE2 3.92Å; Y1138-F1211 HydrophobicContact CD2-CE2 3.92Å; Y1138-F1211 HydrophobicContact CD2-CG 4.18Å; Y1138-F1211 HydrophobicContact CD2-CZ 4.08Å; Y1138-F1211 HydrophobicContact CE2-CB 4.07Å; Y1138-F1211 AromaticContact CE2-CD1 3.89Å; Y1138-F1211 HydrophobicContact CE2-CD1 3.89Å; Y1138-F1211 AromaticContact CE2-CD2 3.87Å; Y1138-F1211 HydrophobicContact CE2-CD2 3.87Å; Y1138-F1211 HydrophobicContact CE2-CE1 4.29Å; Y1138-F1211 HydrophobicContact CE2-CE2 4.25Å; Y1138-F1211 AromaticContact CE2-CG 3.66Å; Y1138-F1211 HydrophobicContact CE2-CG 3.66Å; Y1138-F1211 HydrophobicContact CE2-CZ 4.45Å
1139	C	96.1	Very high	93.6	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-76.4	-24.5	170.5	-76.9	0	0	0	0	112.8	Q1135 F1136 V1137 P1141 M1204 R1207 I1208 F1211	Q1135-C1139 VanDerWaalsContact O-CB 3.25Å; Q1135-C1139 WeakPolarHBondContact O-CB 3.38Å; Q1135-C1139 PolarHBondContact O-N 3.48Å; Q1135-C1139 PolarHBondContact O-SG 3.25Å; F1136-C1139 PolarHBondContact O-N 2.91Å; V1137-C1139 VanDerWaalsContact C-N 3.32Å; V1137-C1139 PolarHBondContact O-N 3.31Å; C1139-P1141 WeakPolarHBondContact O-CD 3.36Å; C1139-M1204 HydrophobicContact CB-CE 3.63Å; C1139-M1204 HydrophobicContact CB-SD 3.7Å; C1139-R1207 VanDerWaalsContact O-CD 3.32Å; C1139-R1207 WeakPolarHBondContact O-CD 3.31Å; C1139-R1207 PolarHBondContact O-NE 2.72Å; C1139-I1208 HydrophobicContact CB-CG1 3.79Å; C1139-F1211 VanDerWaalsContact SG-CD2 3.59Å
1140	I	94.8	Very high	93.4	Very high	32 Å²	32	38.9 Å²	38.9	16%	0.164	21%	0.21	C	C	.	.	S	Bend	trans	-55.5	123.8	177.9	-69.1	165	0	0	0	109.5	V984 F1136 V1137 V1142 V1199 M1204	V984-I1140 HydrophobicContact CG1-CD1 4.25Å; V984-I1140 HydrophobicContact CG2-CD1 4.34Å; F1136-I1140 HydrophobicContact CD1-CD1 4.4Å; F1136-I1140 HydrophobicContact CE1-CD1 4.18Å; F1136-I1140 WeakPolarHBondContact O-CG1 3.38Å; F1136-I1140 PolarHBondContact O-N 2.99Å; V1137-I1140 WeakPolarHBondContact O-CB 3.47Å; V1137-I1140 PolarHBondContact O-N 3.13Å; I1140-V1142 PolarHBondContact O-N 2.92Å; I1140-V1199 HydrophobicContact CG1-CG2 4.46Å; I1140-V1199 HydrophobicContact CG2-CG2 3.85Å; I1140-M1204 HydrophobicContact CG1-CE 4.25Å; I1140-M1204 HydrophobicContact CG1-SD 4.43Å
1141	P	92.8	Very high	93.2	Very high	24 Å²	24	44.1 Å²	44.1	16%	0.156	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-64.2	131.8	174.4	-19	32.2	0	0	0	111.1	C1139 P1200 K1203 M1204	C1139-P1141 WeakPolarHBondContact O-CD 3.36Å; P1141-P1200 HydrophobicContact CG-CG 4.32Å; P1141-K1203 HydrophobicContact CB-CB 4.42Å; P1141-K1203 HydrophobicContact CG-CB 3.85Å; P1141-M1204 HydrophobicContact CG-CB 4.43Å
1142	V	92.3	Very high	93	Very high	56 Å²	56	44.1 Å²	44.1	34%	0.339	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-94.8	170.3	173.3	-62.6	0	0	0	0	111.1	I1140 E1146 T1148	I1140-V1142 PolarHBondContact O-N 2.92Å; V1142-E1146 HydrophobicContact CB-CB 3.97Å; V1142-E1146 HydrophobicContact CG2-CB 3.99Å; V1142-T1148 HydrophobicContact CG2-CG2 3.92Å
1143	G	87.7	Confident	93	Very high	36 Å²	36	44.3 Å²	44.3	37%	0.371	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-60.5	155.2	176.6	0	0	0	0	0	112.7	H1145 E1146	G1143-H1145 PolarHBondContact O-N 3.18Å; G1143-E1146 PolarHBondContact N-OE2 2.88Å; G1143-E1146 PolarHBondContact O-N 2.91Å
1144	T	84.3	Confident	93	Very high	135 Å²	135	44.5 Å²	44.5	83%	0.828	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-22.8	-175.6	-45.4	0	0	0	0	114.3
1145	H	89.1	Confident	93.1	Very high	191 Å²	191	45.4 Å²	45.4	88%	0.884	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.8	7.6	-179.6	-57.2	97.1	0	0	0	113.2	G1143	G1143-H1145 PolarHBondContact O-N 3.18Å
1146	E	88.7	Confident	93	Very high	123 Å²	123	45.4 Å²	45.4	58%	0.575	24%	0.242	S	C	*	.	S	Bend	trans	-96.1	145.1	174.4	-65.4	-176.8	114.9	0	0	109.7	V1142 G1143	V1142-E1146 HydrophobicContact CB-CB 3.97Å; V1142-E1146 HydrophobicContact CG2-CB 3.99Å; G1143-E1146 PolarHBondContact N-OE2 2.88Å; G1143-E1146 PolarHBondContact O-N 2.91Å
1147	F	90.6	Very high	93.1	Very high	80 Å²	80	45.4 Å²	45.4	35%	0.351	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-75.9	142.8	176.2	58.4	-97.5	0	0	0	110.8	V868 P870 F871 Q1151 C1152	V868-F1147 HydrophobicContact CG1-CB 3.96Å; V868-F1147 HydrophobicContact CG1-CG 4.1Å; V868-F1147 HydrophobicContact CG2-CD1 4.34Å; V868-F1147 HydrophobicContact CG2-CD2 4.07Å; V868-F1147 HydrophobicContact CG2-CE1 4.38Å; V868-F1147 HydrophobicContact CG2-CE2 4.1Å; V868-F1147 HydrophobicContact CG2-CG 4.19Å; V868-F1147 HydrophobicContact CG2-CZ 4.26Å; P870-F1147 HydrophobicContact CG-CE1 4.31Å; F871-F1147 HydrophobicContact CE2-CE2 4.23Å; F871-F1147 HydrophobicContact CE2-CZ 4.12Å; F1147-Q1151 HydrophobicContact CB-CG 4.49Å; F1147-C1152 HydrophobicContact CD2-CB 3.87Å; F1147-C1152 HydrophobicContact CE2-CB 4.1Å
1148	T	93.5	Very high	93.1	Very high	32 Å²	32	44.7 Å²	44.7	20%	0.196	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-86.4	170.6	179	60.7	0	0	0	0	112	V1142 E1150 Q1151 C1152	V1142-T1148 HydrophobicContact CG2-CG2 3.92Å; T1148-E1150 VanDerWaalsContact C-N 3.29Å; T1148-E1150 VanDerWaalsContact CB-OE1 3.25Å; T1148-E1150 WeakPolarHBondContact CB-OE1 3.34Å; T1148-E1150 WeakPolarHBondContact CB-OE2 3.35Å; T1148-E1150 PolarHBondContact O-N 2.97Å; T1148-E1150 WeakPolarHBondContact OG1-CG 3.37Å; T1148-E1150 PolarHBondContact OG1-OE1 2.92Å; T1148-E1150 PolarHBondContact OG1-OE2 3.36Å; T1148-Q1151 PolarHBondContact O-N 3.4Å; T1148-Q1151 PolarHBondContact OG1-N 3.43Å; T1148-C1152 WeakPolarHBondContact O-CB 3.32Å; T1148-C1152 PolarHBondContact O-N 2.82Å
1149	V	94.2	Very high	93.3	Very high	16 Å²	16	45 Å²	45	10%	0.097	24%	0.239	C	C	.	.	H	α-helix	trans	-62	-40.2	176.4	72.1	0	0	0	0	111	F994 Y1138 Q1151 C1152 F1153 L1157 F1211	F994-V1149 HydrophobicContact CD2-CG2 4.1Å; F994-V1149 HydrophobicContact CE2-CG2 4.23Å; Y1138-V1149 HydrophobicContact CD2-CG1 4.44Å; Y1138-V1149 HydrophobicContact CG-CG1 4.27Å; V1149-Q1151 VanDerWaalsContact C-N 3.34Å; V1149-Q1151 PolarHBondContact O-N 3.17Å; V1149-C1152 PolarHBondContact O-N 3.31Å; V1149-F1153 HydrophobicContact CG2-CD2 3.72Å; V1149-F1153 HydrophobicContact CG2-CE2 4.38Å; V1149-F1153 PolarHBondContact O-N 2.79Å; V1149-L1157 HydrophobicContact CG2-CD2 3.48Å; V1149-L1157 VanDerWaalsContact CG2-CD2 3.48Å; V1149-F1211 HydrophobicContact CG1-CE1 4.18Å; V1149-F1211 HydrophobicContact CG1-CZ 3.68Å
1150	E	91.3	Very high	93.3	Very high	63 Å²	63	45 Å²	45	29%	0.294	24%	0.239	S	C	.	.	H	α-helix	trans	-71.9	-30.3	-177.7	59	-84.2	-168.3	0	0	111.7	T1148 G1154 R1207	T1148-E1150 VanDerWaalsContact C-N 3.29Å; T1148-E1150 VanDerWaalsContact CB-OE1 3.25Å; T1148-E1150 WeakPolarHBondContact CB-OE1 3.34Å; T1148-E1150 WeakPolarHBondContact CB-OE2 3.35Å; T1148-E1150 PolarHBondContact O-N 2.97Å; T1148-E1150 WeakPolarHBondContact OG1-CG 3.37Å; T1148-E1150 PolarHBondContact OG1-OE1 2.92Å; T1148-E1150 PolarHBondContact OG1-OE2 3.36Å; E1150-G1154 WeakPolarHBondContact O-CA 3.48Å; E1150-G1154 PolarHBondContact O-N 3.49Å; E1150-R1207 IonicContact OE1-CZ 2.97Å; E1150-R1207 IonicContact OE1-NH1 3.58Å; E1150-R1207 PolarHBondContact OE1-NH1 2.88Å; E1150-R1207 IonicContact OE1-NH2 2.74Å; E1150-R1207 PolarHBondContact OE1-NH2 3.19Å; E1150-R1207 IonicContact OE2-CZ 2.97Å; E1150-R1207 IonicContact OE2-NH1 3.6Å; E1150-R1207 IonicContact OE2-NH2 2.8Å; E1150-R1207 PolarHBondContact OE2-NH2 3.01Å
1151	Q	91.6	Very high	93.4	Very high	111 Å²	111	43.5 Å²	43.5	52%	0.519	23%	0.231	S	C	.	.	H	α-helix	trans	-72	-35.5	171.4	-171.8	179.4	2.4	0	0	111.8	V868 F1147 T1148 V1149	V868-Q1151 HydrophobicContact CG1-CG 4.02Å; F1147-Q1151 HydrophobicContact CB-CG 4.49Å; T1148-Q1151 PolarHBondContact O-N 3.4Å; T1148-Q1151 PolarHBondContact OG1-N 3.43Å; V1149-Q1151 VanDerWaalsContact C-N 3.34Å; V1149-Q1151 PolarHBondContact O-N 3.17Å
1152	C	94.5	Very high	93.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-80.8	-49.2	-178.2	-174.7	0	0	0	0	112.3	C856 T867 V868 F871 R998 F1147 T1148 V1149	C856-C1152 VanDerWaalsContact SG-C 3.59Å; C856-C1152 PolarHBondContact SG-O 3Å; T867-C1152 WeakPolarHBondContact CB-O 3.31Å; T867-C1152 PolarHBondContact OG1-O 2.91Å; V868-C1152 HydrophobicContact CG2-CB 4.09Å; F871-C1152 VanDerWaalsContact CD2-SG 3.53Å; R998-C1152 VanDerWaalsContact CZ-O 3.22Å; R998-C1152 PolarHBondContact NH1-O 3.06Å; R998-C1152 PolarHBondContact NH2-O 2.83Å; F1147-C1152 HydrophobicContact CD2-CB 3.87Å; F1147-C1152 HydrophobicContact CE2-CB 4.1Å; T1148-C1152 WeakPolarHBondContact O-CB 3.32Å; T1148-C1152 PolarHBondContact O-N 2.82Å; V1149-C1152 PolarHBondContact O-N 3.31Å
1153	F	95.8	Very high	93.9	Very high	3 Å²	3	39.7 Å²	39.7	1%	0.013	21%	0.208	C	C	.	.	H	α-helix	trans	-111.2	-15.2	-171.3	-56.5	-80.4	0	0	0	114.6	F871 K990 F994 Q995 R998 V1149 L1157	F871-F1153 AromaticContact CD1-CE1 3.98Å; F871-F1153 HydrophobicContact CD1-CE1 3.98Å; F871-F1153 AromaticContact CD1-CZ 3.97Å; F871-F1153 HydrophobicContact CD1-CZ 3.97Å; F871-F1153 AromaticContact CE1-CE1 3.84Å; F871-F1153 HydrophobicContact CE1-CE1 3.84Å; F871-F1153 AromaticContact CE1-CZ 3.45Å; F871-F1153 HydrophobicContact CE1-CZ 3.45Å; F871-F1153 VanDerWaalsContact CE1-CZ 3.45Å; F871-F1153 AromaticContact CZ-CZ 3.92Å; F871-F1153 HydrophobicContact CZ-CZ 3.92Å; K990-F1153 HydrophobicContact CB-CZ 4.4Å; K990-F1153 VanDerWaalsContact O-CZ 3.24Å; K990-F1153 WeakPolarHBondContact O-CZ 3.27Å; F994-F1153 HydrophobicContact CB-CD1 4.21Å; F994-F1153 HydrophobicContact CB-CD2 4.15Å; F994-F1153 HydrophobicContact CB-CE1 3.93Å; F994-F1153 HydrophobicContact CB-CE2 3.84Å; F994-F1153 HydrophobicContact CB-CG 4.33Å; F994-F1153 HydrophobicContact CB-CZ 3.74Å; F994-F1153 HydrophobicContact CD2-CD2 4.4Å; F994-F1153 HydrophobicContact CD2-CE2 4.03Å; F994-F1153 HydrophobicContact CG-CE2 4.48Å; Q995-F1153 HydrophobicContact CB-CE1 4.06Å; R998-F1153 HydrophobicContact CB-CB 4.24Å; R998-F1153 HydrophobicContact CB-CD1 3.97Å; R998-F1153 HydrophobicContact CG-CB 4.24Å; R998-F1153 HydrophobicContact CG-CD1 4.36Å; R998-F1153 WeakPolarHBondContact CG-O 3.48Å; V1149-F1153 HydrophobicContact CG2-CD2 3.72Å; V1149-F1153 HydrophobicContact CG2-CE2 4.38Å; V1149-F1153 PolarHBondContact O-N 2.79Å; F1153-L1157 HydrophobicContact CB-CB 3.98Å; F1153-L1157 HydrophobicContact CB-CD2 4.29Å; F1153-L1157 HydrophobicContact CD2-CD2 4.48Å
1154	G	96.6	Very high	94.3	Very high	4 Å²	4	38 Å²	38	4%	0.041	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	58.3	-159.7	-173.6	0	0	0	0	0	113.2	E1150 G1156	E1150-G1154 WeakPolarHBondContact O-CA 3.48Å; E1150-G1154 PolarHBondContact O-N 3.49Å; G1154-G1156 VanDerWaalsContact C-N 3.28Å; G1154-G1156 PolarHBondContact O-N 2.78Å
1155	D	96.8	Very high	94.9	Very high	24 Å²	24	31.6 Å²	31.6	13%	0.128	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-19.6	-175.3	-62.1	-16.8	0	0	0	112.6	Y857 G859 L1157 H1158 W1159	Y857-D1155 HydrophobicContact CD1-CB 3.99Å; Y857-D1155 PolarHBondContact O-N 2.65Å; G859-D1155 PolarHBondContact N-OD2 2.96Å; D1155-L1157 VanDerWaalsContact C-N 3.27Å; D1155-L1157 PolarHBondContact O-N 3.43Å; D1155-H1158 PolarHBondContact O-N 3.49Å; D1155-W1159 VanDerWaalsContact O-CD1 3.31Å; D1155-W1159 PolarHBondContact O-N 3.29Å
1156	G	96	Very high	95.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-54.5	-40.4	-178.8	0	0	0	0	0	113	G1001 G1154 H1158 W1159 A1160	G1001-G1156 VanDerWaalsContact CA-O 3.3Å; G1001-G1156 WeakPolarHBondContact CA-O 3.19Å; G1154-G1156 VanDerWaalsContact C-N 3.28Å; G1154-G1156 PolarHBondContact O-N 2.78Å; G1156-H1158 VanDerWaalsContact C-N 3.29Å; G1156-H1158 PolarHBondContact O-N 3.02Å; G1156-W1159 PolarHBondContact O-N 2.94Å; G1156-A1160 PolarHBondContact O-N 3.16Å; G1156-A1160 VanDerWaalsContact O-N 3.08Å
1157	L	97.7	Very high	95.5	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-54.2	-46.4	174.4	172.7	60.1	0	0	0	112.1	F994 L997 W1131 V1149 F1153 D1155 A1160 G1161	F994-L1157 HydrophobicContact CB-CD1 3.97Å; F994-L1157 HydrophobicContact CB-CD2 4.19Å; F994-L1157 HydrophobicContact CD1-CD1 3.97Å; F994-L1157 HydrophobicContact CD1-CD2 4.34Å; F994-L1157 HydrophobicContact CD2-CD2 4.09Å; F994-L1157 HydrophobicContact CG-CD1 4.09Å; F994-L1157 HydrophobicContact CG-CD2 3.97Å; L997-L1157 HydrophobicContact CB-CD1 3.66Å; L997-L1157 HydrophobicContact CD1-CD1 4.11Å; W1131-L1157 HydrophobicContact CH2-CD1 4.02Å; W1131-L1157 HydrophobicContact CH2-CG 4.09Å; W1131-L1157 WeakPolarHBondContact CH2-O 3.28Å; W1131-L1157 HydrophobicContact CZ3-CD1 4.32Å; 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 4.29Å; F1153-L1157 HydrophobicContact CD2-CD2 4.48Å; D1155-L1157 VanDerWaalsContact C-N 3.27Å; D1155-L1157 PolarHBondContact O-N 3.43Å; L1157-A1160 PolarHBondContact O-N 3.5Å; L1157-G1161 PolarHBondContact O-N 3.49Å; L1157-G1161 VanDerWaalsContact O-N 3.15Å
1158	H	96.8	Very high	95.6	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-73.8	-35.2	-177.8	-55.1	-69.7	0	0	0	111.6	Y1138 D1155 G1156 A1160 G1161 C1162 F1211 L1214 I1218	Y1138-H1158 AromaticContact CE1-CE1 3.89Å; Y1138-H1158 AromaticContact CE2-CE1 3.77Å; Y1138-H1158 AromaticContact CZ-CE1 3.62Å; Y1138-H1158 AromaticContact CZ-ND1 3.79Å; D1155-H1158 PolarHBondContact O-N 3.49Å; G1156-H1158 VanDerWaalsContact C-N 3.29Å; G1156-H1158 PolarHBondContact O-N 3.02Å; H1158-A1160 VanDerWaalsContact C-N 3.35Å; H1158-A1160 PolarHBondContact O-N 2.82Å; H1158-G1161 PolarHBondContact O-N 3.49Å; H1158-C1162 WeakPolarHBondContact O-CB 3.22Å; H1158-C1162 PolarHBondContact O-N 2.95Å; H1158-C1162 PolarHBondContact O-SG 2.98Å; H1158-C1162 VanDerWaalsContact O-SG 3.35Å; H1158-F1211 AromaticContact CE1-CD1 3.47Å; H1158-F1211 VanDerWaalsContact CE1-CD1 3.47Å; H1158-F1211 WeakPolarHBondContact CE1-CD1 3.46Å; H1158-F1211 AromaticContact CE1-CE1 3.46Å; H1158-F1211 VanDerWaalsContact CE1-CE1 3.46Å; H1158-F1211 WeakPolarHBondContact CE1-CE1 3.37Å; H1158-F1211 AromaticContact NE2-CD1 3.64Å; H1158-F1211 AromaticContact NE2-CE1 3.28Å; H1158-F1211 VanDerWaalsContact NE2-CE1 3.28Å; H1158-F1211 WeakPolarHBondContact NE2-CE1 3.49Å; H1158-L1214 HydrophobicContact CB-CD2 4.11Å; H1158-I1218 HydrophobicContact CB-CD1 3.86Å
1159	W	97.8	Very high	95.6	Very high	15 Å²	15	14.3 Å²	14.3	6%	0.057	8%	0.077	C	C	.	.	H	α-helix	trans	-58.6	-44.3	172.8	-86.2	84.8	0	0	0	112.1	L1005 L1008 F1093 D1155 G1156 M1163 I1218 I1221 L1222	L1005-W1159 HydrophobicContact CD1-CB 4.4Å; L1005-W1159 HydrophobicContact CD1-CG 4.06Å; L1005-W1159 HydrophobicContact CD2-CD2 3.66Å; L1005-W1159 HydrophobicContact CD2-CE3 4.14Å; L1005-W1159 HydrophobicContact CD2-CG 4.01Å; L1005-W1159 HydrophobicContact CD2-CH2 4.35Å; L1005-W1159 HydrophobicContact CD2-CZ2 3.92Å; L1005-W1159 HydrophobicContact CD2-CZ3 4.46Å; L1005-W1159 HydrophobicContact CG-CB 4.46Å; L1005-W1159 HydrophobicContact CG-CD2 4.09Å; L1005-W1159 HydrophobicContact CG-CG 4.03Å; L1008-W1159 HydrophobicContact CD2-CH2 3.84Å; L1008-W1159 HydrophobicContact CD2-CZ3 4.2Å; F1093-W1159 HydrophobicContact CZ-CZ3 4.38Å; D1155-W1159 VanDerWaalsContact O-CD1 3.31Å; D1155-W1159 PolarHBondContact O-N 3.29Å; G1156-W1159 PolarHBondContact O-N 2.94Å; W1159-M1163 WeakPolarHBondContact O-CB 3.29Å; W1159-M1163 PolarHBondContact O-N 2.79Å; W1159-I1218 HydrophobicContact CD2-CD1 4.42Å; W1159-I1218 HydrophobicContact CD2-CG1 4.22Å; W1159-I1218 HydrophobicContact CD2-CG2 3.9Å; W1159-I1218 HydrophobicContact CE3-CG2 4.03Å; 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 4.23Å; W1159-I1218 HydrophobicContact CZ3-CG2 4.48Å; W1159-I1221 HydrophobicContact CH2-CB 4.42Å; W1159-I1221 HydrophobicContact CH2-CD1 4.32Å; W1159-I1221 HydrophobicContact CH2-CG2 3.93Å; W1159-I1221 HydrophobicContact CZ2-CD1 4.37Å; W1159-L1222 HydrophobicContact CE3-CD2 4.37Å; W1159-L1222 HydrophobicContact CZ3-CD2 4.09Å; W1159-L1222 HydrophobicContact CZ3-CG 4.43Å
1160	A	97.3	Very high	95.7	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-67	-48.6	176.3	0	0	0	0	0	112.9	L997 V1000 G1156 L1157 H1158 C1162 M1163 I1164	L997-A1160 HydrophobicContact CB-CB 4.19Å; L997-A1160 HydrophobicContact CD2-CB 4.06Å; L997-A1160 WeakPolarHBondContact O-CB 3.38Å; V1000-A1160 HydrophobicContact CB-CB 4.05Å; V1000-A1160 HydrophobicContact CG1-CB 3.95Å; G1156-A1160 PolarHBondContact O-N 3.16Å; G1156-A1160 VanDerWaalsContact O-N 3.08Å; L1157-A1160 PolarHBondContact O-N 3.5Å; H1158-A1160 VanDerWaalsContact C-N 3.35Å; H1158-A1160 PolarHBondContact O-N 2.82Å; A1160-C1162 PolarHBondContact O-N 3.33Å; A1160-M1163 PolarHBondContact O-N 3.44Å; A1160-I1164 WeakPolarHBondContact O-CG1 3.13Å; A1160-I1164 PolarHBondContact O-N 3.1Å
1161	G	95.9	Very high	95.8	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-59.3	-49	179.7	0	0	0	0	0	112.4	L1157 H1158 I1164 I1165	L1157-G1161 PolarHBondContact O-N 3.49Å; L1157-G1161 VanDerWaalsContact O-N 3.15Å; H1158-G1161 PolarHBondContact O-N 3.49Å; G1161-I1164 PolarHBondContact O-N 3.43Å; G1161-I1165 WeakPolarHBondContact O-CG1 3.23Å; G1161-I1165 PolarHBondContact O-N 3.11Å; G1161-I1165 VanDerWaalsContact O-N 3.16Å
1162	C	97.3	Very high	95.8	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-65.3	-38	176.9	-70.6	0	0	0	0	112.4	H1158 A1160 I1165 V1166 I1218 I1219 L1222	H1158-C1162 WeakPolarHBondContact O-CB 3.22Å; H1158-C1162 PolarHBondContact O-N 2.95Å; H1158-C1162 PolarHBondContact O-SG 2.98Å; H1158-C1162 VanDerWaalsContact O-SG 3.35Å; A1160-C1162 PolarHBondContact O-N 3.33Å; C1162-I1165 PolarHBondContact O-N 3.31Å; C1162-V1166 WeakPolarHBondContact O-CG2 3.4Å; C1162-V1166 PolarHBondContact O-N 3.47Å; C1162-I1218 HydrophobicContact CB-CB 4.32Å; C1162-I1218 HydrophobicContact CB-CG2 3.61Å; C1162-I1219 HydrophobicContact CB-CG1 3.95Å; C1162-L1222 HydrophobicContact CB-CD1 4.33Å
1163	M	97.7	Very high	95.8	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-58.7	-50.4	174.7	180	-165.5	68.4	0	0	111.5	V1000 V1004 L1097 I1100 W1159 A1160 I1165 V1166 L1167 L1222	V1000-M1163 HydrophobicContact CG1-CE 3.78Å; V1004-M1163 HydrophobicContact CG1-SD 4.33Å; V1004-M1163 HydrophobicContact CG2-CE 4.33Å; V1004-M1163 HydrophobicContact CG2-SD 3.6Å; L1097-M1163 HydrophobicContact CD2-CG 4.03Å; L1097-M1163 HydrophobicContact CD2-SD 4.06Å; I1100-M1163 HydrophobicContact CD1-SD 3.9Å; I1100-M1163 HydrophobicContact CG2-CE 3.68Å; I1100-M1163 HydrophobicContact CG2-SD 3.99Å; W1159-M1163 WeakPolarHBondContact O-CB 3.29Å; W1159-M1163 PolarHBondContact O-N 2.79Å; A1160-M1163 PolarHBondContact O-N 3.44Å; M1163-I1165 VanDerWaalsContact C-N 3.28Å; M1163-I1165 PolarHBondContact O-N 3.04Å; M1163-V1166 PolarHBondContact O-N 2.83Å; M1163-L1167 HydrophobicContact CG-CD1 3.69Å; M1163-L1167 HydrophobicContact CG-CG 4.1Å; 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 3.22Å; M1163-L1167 HydrophobicContact SD-CD1 4.21Å; M1163-L1222 HydrophobicContact CB-CD1 4.09Å
1164	I	97.1	Very high	95.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-58.9	-43.9	178.9	-63.5	166.2	0	0	0	110.1	L941 L997 L1104 W1109 F1127 A1160 G1161 V1166 L1167 L1168	L941-I1164 HydrophobicContact CD2-CD1 3.8Å; L941-I1164 HydrophobicContact CD2-CG1 4.28Å; L997-I1164 HydrophobicContact CD2-CD1 3.96Å; 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 4.42Å; W1109-I1164 HydrophobicContact CZ3-CG2 3.91Å; F1127-I1164 HydrophobicContact CD1-CB 4.1Å; F1127-I1164 HydrophobicContact CD1-CG2 3.41Å; F1127-I1164 VanDerWaalsContact CD1-CG2 3.41Å; F1127-I1164 HydrophobicContact CD2-CG2 4.45Å; F1127-I1164 HydrophobicContact CE1-CB 3.67Å; F1127-I1164 HydrophobicContact CE1-CD1 4.26Å; F1127-I1164 HydrophobicContact CE1-CG2 3.45Å; F1127-I1164 VanDerWaalsContact CE1-CG2 3.45Å; F1127-I1164 HydrophobicContact CE2-CG2 4.48Å; F1127-I1164 HydrophobicContact CG-CG2 3.94Å; F1127-I1164 HydrophobicContact CZ-CB 4.23Å; F1127-I1164 HydrophobicContact CZ-CD1 3.93Å; F1127-I1164 HydrophobicContact CZ-CG2 4.01Å; A1160-I1164 WeakPolarHBondContact O-CG1 3.13Å; A1160-I1164 PolarHBondContact O-N 3.1Å; G1161-I1164 PolarHBondContact O-N 3.43Å; I1164-V1166 PolarHBondContact O-N 3.33Å; I1164-L1167 PolarHBondContact O-N 3.23Å; I1164-L1168 HydrophobicContact CG2-CD1 3.71Å; I1164-L1168 HydrophobicContact CG2-CG 4.41Å; I1164-L1168 WeakPolarHBondContact O-CB 3.27Å; I1164-L1168 WeakPolarHBondContact O-CD1 3.27Å; I1164-L1168 WeakPolarHBondContact O-CG 3.39Å; I1164-L1168 PolarHBondContact O-N 3Å; I1164-L1168 VanDerWaalsContact O-N 3.08Å
1165	I	96.6	Very high	95.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.3	-44.8	177.9	-69.7	172	0	0	0	112	F1127 H1128 W1131 G1161 C1162 M1163 G1169 Q1170 Q1171 F1174	F1127-I1165 HydrophobicContact CD1-CG1 3.96Å; F1127-I1165 HydrophobicContact CE1-CG1 4.03Å; H1128-I1165 HydrophobicContact CB-CD1 4.12Å; H1128-I1165 HydrophobicContact CB-CG1 4Å; H1128-I1165 HydrophobicContact CB-CG2 4.44Å; W1131-I1165 HydrophobicContact CB-CD1 3.91Å; W1131-I1165 HydrophobicContact CG-CD1 3.69Å; G1161-I1165 WeakPolarHBondContact O-CG1 3.23Å; G1161-I1165 PolarHBondContact O-N 3.11Å; G1161-I1165 VanDerWaalsContact O-N 3.16Å; C1162-I1165 PolarHBondContact O-N 3.31Å; M1163-I1165 VanDerWaalsContact C-N 3.28Å; M1163-I1165 PolarHBondContact O-N 3.04Å; I1165-G1169 PolarHBondContact O-N 3.4Å; I1165-Q1170 HydrophobicContact CG2-CB 4.05Å; I1165-Q1170 PolarHBondContact O-N 3.47Å; I1165-Q1171 VanDerWaalsContact CG2-CA 3.42Å; I1165-Q1171 HydrophobicContact CG2-CB 3.85Å; I1165-F1174 HydrophobicContact CD1-CD2 4.17Å; I1165-F1174 HydrophobicContact CD1-CE2 4.39Å; I1165-F1174 HydrophobicContact CD1-CG 4.22Å; I1165-F1174 HydrophobicContact CG2-CB 4.25Å
1166	V	96.1	Very high	95.6	Very high	6 Å²	6	22.4 Å²	22.4	4%	0.036	12%	0.117	C	C	.	.	H	α-helix	trans	-67.9	-46.3	-179.9	169	0	0	0	0	111.3	C1162 M1163 I1164 L1168 G1169 Q1171 I1219 L1222 D1223 L1226	C1162-V1166 WeakPolarHBondContact O-CG2 3.4Å; C1162-V1166 PolarHBondContact O-N 3.47Å; M1163-V1166 PolarHBondContact O-N 2.83Å; I1164-V1166 PolarHBondContact O-N 3.33Å; V1166-L1168 PolarHBondContact O-N 3.42Å; V1166-G1169 PolarHBondContact O-N 2.91Å; V1166-Q1171 HydrophobicContact CG2-CB 4.21Å; V1166-Q1171 HydrophobicContact CG2-CG 4.41Å; 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 4.48Å; V1166-L1222 HydrophobicContact CG1-CB 4.11Å; V1166-L1222 HydrophobicContact CG2-CB 4.29Å; V1166-L1222 HydrophobicContact CG2-CD1 4.22Å; V1166-D1223 WeakPolarHBondContact CG1-OD1 3.48Å; V1166-L1226 HydrophobicContact CG1-CD2 4.18Å
1167	L	93.9	Very high	95.6	Very high	10 Å²	10	22.9 Å²	22.9	5%	0.052	12%	0.119	C	C	.	.	H	α-helix	trans	-65.2	-27	-179.3	-64.9	-179	0	0	0	112.8	L1097 I1100 R1101 L1104 M1163 I1164 L1226	L1097-L1167 HydrophobicContact CB-CD2 4.21Å; I1100-L1167 HydrophobicContact CB-CD1 4.03Å; I1100-L1167 HydrophobicContact CG2-CD1 3.71Å; R1101-L1167 HydrophobicContact CB-CB 4.23Å; R1101-L1167 HydrophobicContact CB-CD1 4.33Å; R1101-L1167 HydrophobicContact CB-CD2 4.21Å; R1101-L1167 HydrophobicContact CB-CG 4.48Å; R1101-L1167 WeakPolarHBondContact CD-O 3.49Å; R1101-L1167 HydrophobicContact CG-CB 4.22Å; L1104-L1167 HydrophobicContact CD1-CB 4.26Å; M1163-L1167 HydrophobicContact CG-CD1 3.69Å; M1163-L1167 HydrophobicContact CG-CG 4.1Å; 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 3.22Å; M1163-L1167 HydrophobicContact SD-CD1 4.21Å; I1164-L1167 PolarHBondContact O-N 3.23Å; L1167-L1226 HydrophobicContact CD2-CD1 4.2Å; L1167-L1226 HydrophobicContact CD2-CD2 4.27Å
1168	L	94.3	Very high	95.6	Very high	20 Å²	20	23 Å²	23	11%	0.105	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-5.1	172.6	-65.4	172.4	0	0	0	113.8	L1104 W1109 R1110 F1127 I1164 V1166 Q1170	L1104-L1168 HydrophobicContact CB-CD2 4.14Å; L1104-L1168 HydrophobicContact CD1-CD2 4.34Å; L1104-L1168 HydrophobicContact CD1-CG 4.29Å; W1109-L1168 HydrophobicContact CB-CD1 3.85Å; W1109-L1168 HydrophobicContact CB-CD2 3.8Å; W1109-L1168 HydrophobicContact CB-CG 4.5Å; W1109-L1168 HydrophobicContact CE3-CD1 4.4Å; R1110-L1168 HydrophobicContact CG-CD2 4.11Å; F1127-L1168 HydrophobicContact CB-CD1 4Å; I1164-L1168 HydrophobicContact CG2-CD1 3.71Å; I1164-L1168 HydrophobicContact CG2-CG 4.41Å; I1164-L1168 WeakPolarHBondContact O-CB 3.27Å; I1164-L1168 WeakPolarHBondContact O-CD1 3.27Å; I1164-L1168 WeakPolarHBondContact O-CG 3.39Å; I1164-L1168 PolarHBondContact O-N 3Å; I1164-L1168 VanDerWaalsContact O-N 3.08Å; V1166-L1168 PolarHBondContact O-N 3.42Å; L1168-Q1170 VanDerWaalsContact C-N 3.32Å; L1168-Q1170 HydrophobicContact CB-CG 3.88Å; L1168-Q1170 PolarHBondContact O-N 3.36Å
1169	G	93.3	Very high	95.6	Very high	27 Å²	27	23 Å²	23	28%	0.278	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.8	30.6	-176.4	0	0	0	0	0	113.7	I1165 V1166 Q1171 R1173	I1165-G1169 PolarHBondContact O-N 3.4Å; V1166-G1169 PolarHBondContact O-N 2.91Å; G1169-Q1171 VanDerWaalsContact CA-OE1 3.28Å; G1169-R1173 PolarHBondContact O-NH1 3.23Å
1170	Q	94.8	Very high	95.5	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	12%	0.117	C	C	.	.			trans	-99.6	-10.1	-174.9	-70.8	177.9	7.3	0	0	113.8	W1109 H1128 I1165 L1168 R1172 R1173 F1174	W1109-Q1170 PolarHBondContact O-NE2 2.95Å; H1128-Q1170 HydrophobicContact CB-CB 4.06Å; H1128-Q1170 PolarHBondContact CD2-OE1 2.98Å; I1165-Q1170 HydrophobicContact CG2-CB 4.05Å; I1165-Q1170 PolarHBondContact O-N 3.47Å; L1168-Q1170 VanDerWaalsContact C-N 3.32Å; L1168-Q1170 HydrophobicContact CB-CG 3.88Å; L1168-Q1170 PolarHBondContact O-N 3.36Å; Q1170-R1172 VanDerWaalsContact C-N 3.31Å; Q1170-R1172 PolarHBondContact O-N 3.32Å; Q1170-R1173 PolarHBondContact O-N 3.03Å; Q1170-F1174 PolarHBondContact O-N 3.29Å
1171	Q	93.6	Very high	95.5	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	-171.4	68.4	-81.2	35.3	0	0	114.3	I1165 V1166 G1169 A1175 I1219 D1223	I1165-Q1171 VanDerWaalsContact CG2-CA 3.42Å; I1165-Q1171 HydrophobicContact CG2-CB 3.85Å; V1166-Q1171 HydrophobicContact CG2-CB 4.21Å; V1166-Q1171 HydrophobicContact CG2-CG 4.41Å; G1169-Q1171 VanDerWaalsContact CA-OE1 3.28Å; Q1171-A1175 PolarHBondContact O-N 3.48Å; Q1171-I1219 HydrophobicContact CB-CD1 4.41Å; Q1171-I1219 HydrophobicContact CB-CG2 3.92Å; Q1171-I1219 HydrophobicContact CG-CG2 4Å; Q1171-D1223 PolarHBondContact NE2-OD1 2.84Å; Q1171-D1223 PolarHBondContact NE2-OD2 3.27Å
1172	R	93.3	Very high	95.4	Very high	176 Å²	176	23.6 Å²	23.6	66%	0.664	12%	0.123	S	C	*	.	H	α-helix	trans	-68.7	-39.3	176.6	-68.8	-177.6	-70.8	-83.4	3.4	112.1	Q1170 V1176	Q1170-R1172 VanDerWaalsContact C-N 3.31Å; Q1170-R1172 PolarHBondContact O-N 3.32Å; R1172-V1176 WeakPolarHBondContact O-CG2 3.25Å; R1172-V1176 PolarHBondContact O-N 3.03Å
1173	R	94.1	Very high	95.4	Very high	58 Å²	58	23.6 Å²	23.6	22%	0.219	12%	0.123	C	C	.	.	H	α-helix	trans	-70.5	-42.3	177.6	-66.5	-165.3	-68.1	-72.7	11.5	110.5	M1119 E1126 G1169 Q1170 A1175 V1176 L1177	M1119-R1173 HydrophobicContact CE-CB 4.39Å; M1119-R1173 HydrophobicContact CE-CG 3.73Å; M1119-R1173 HydrophobicContact SD-CG 4.45Å; E1126-R1173 IonicContact OE1-CZ 3.37Å; E1126-R1173 IonicContact OE1-NE 3.25Å; E1126-R1173 PolarHBondContact OE1-NE 2.97Å; E1126-R1173 IonicContact OE1-NH2 2.72Å; E1126-R1173 PolarHBondContact OE1-NH2 3.33Å; E1126-R1173 IonicContact OE2-CZ 3.72Å; E1126-R1173 IonicContact OE2-NE 2.91Å; E1126-R1173 PolarHBondContact OE2-NE 3.48Å; E1126-R1173 IonicContact OE2-NH2 3.66Å; G1169-R1173 PolarHBondContact O-NH1 3.23Å; Q1170-R1173 PolarHBondContact O-N 3.03Å; R1173-A1175 PolarHBondContact O-N 3.29Å; R1173-V1176 PolarHBondContact O-N 3.46Å; R1173-L1177 HydrophobicContact CB-CD1 4.48Å; R1173-L1177 VanDerWaalsContact O-CB 3.27Å; R1173-L1177 WeakPolarHBondContact O-CB 3.32Å; R1173-L1177 WeakPolarHBondContact O-CG 3.27Å; R1173-L1177 PolarHBondContact O-N 3.02Å
1174	F	96.6	Very high	95.3	Very high	1 Å²	1	24.1 Å²	24.1	0%	0.004	13%	0.125	C	C	.	.	H	α-helix	trans	-53.7	-53.1	173.3	176	-109	0	0	0	112.1	H1128 W1131 S1132 I1165 Q1170 V1176 L1177 D1178 Y1181	H1128-F1174 HydrophobicContact CB-CB 3.92Å; H1128-F1174 HydrophobicContact CB-CD2 4.06Å; H1128-F1174 HydrophobicContact CB-CG 4.37Å; H1128-F1174 WeakPolarHBondContact ND1-CA 3.32Å; W1131-F1174 AromaticContact CD1-CE2 3.68Å; W1131-F1174 AromaticContact CD1-CZ 3.78Å; S1132-F1174 WeakPolarHBondContact OG-CD2 3.36Å; S1132-F1174 VanDerWaalsContact OG-CE2 3.29Å; S1132-F1174 WeakPolarHBondContact OG-CE2 3.47Å; I1165-F1174 HydrophobicContact CD1-CD2 4.17Å; I1165-F1174 HydrophobicContact CD1-CE2 4.39Å; I1165-F1174 HydrophobicContact CD1-CG 4.22Å; I1165-F1174 HydrophobicContact CG2-CB 4.25Å; Q1170-F1174 PolarHBondContact O-N 3.29Å; F1174-V1176 PolarHBondContact O-N 3.31Å; F1174-V1176 VanDerWaalsContact O-N 3.09Å; F1174-L1177 PolarHBondContact O-N 2.97Å; F1174-L1177 VanDerWaalsContact O-N 3.14Å; F1174-D1178 HydrophobicContact CD2-CB 4.21Å; F1174-D1178 HydrophobicContact CE2-CB 3.98Å; F1174-D1178 VanDerWaalsContact CE2-OD1 3.23Å; F1174-D1178 WeakPolarHBondContact CE2-OD1 3.17Å; F1174-D1178 HydrophobicContact CZ-CB 4.32Å; F1174-D1178 VanDerWaalsContact O-CB 3.22Å; F1174-D1178 WeakPolarHBondContact O-CB 3.49Å; F1174-D1178 PolarHBondContact O-N 3.27Å; F1174-Y1181 HydrophobicContact CE1-CE2 4.09Å
1175	A	94	Very high	95.2	Very high	48 Å²	48	29.5 Å²	29.5	40%	0.397	15%	0.149	S	C	.	.	H	α-helix	trans	-58.6	-28.9	-179.1	0	0	0	0	0	113.7	Q1171 R1173	Q1171-A1175 PolarHBondContact O-N 3.48Å; R1173-A1175 PolarHBondContact O-N 3.29Å
1176	V	93.9	Very high	95.1	Very high	92 Å²	92	29.5 Å²	29.5	56%	0.558	15%	0.149	S	C	*	.	H	α-helix	trans	-84.3	-40.7	177.7	175.3	0	0	0	0	112	R1172 R1173 F1174	R1172-V1176 WeakPolarHBondContact O-CG2 3.25Å; R1172-V1176 PolarHBondContact O-N 3.03Å; R1173-V1176 PolarHBondContact O-N 3.46Å; F1174-V1176 PolarHBondContact O-N 3.31Å; F1174-V1176 VanDerWaalsContact O-N 3.09Å
1177	L	96.1	Very high	95	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.052	15%	0.149	C	C	.	.	H	α-helix	trans	-104.1	-5.1	-164.7	-64.4	178	0	0	0	114.6	L962 M1119 V1121 R1129 R1173 F1174 F1179	L962-L1177 HydrophobicContact CD1-CD2 4.44Å; M1119-L1177 HydrophobicContact CE-CD1 3.99Å; V1121-L1177 HydrophobicContact CG1-CD2 4.29Å; R1129-L1177 PolarHBondContact NH1-O 3.27Å; R1173-L1177 HydrophobicContact CB-CD1 4.48Å; R1173-L1177 VanDerWaalsContact O-CB 3.27Å; R1173-L1177 WeakPolarHBondContact O-CB 3.32Å; R1173-L1177 WeakPolarHBondContact O-CG 3.27Å; R1173-L1177 PolarHBondContact O-N 3.02Å; F1174-L1177 PolarHBondContact O-N 2.97Å; F1174-L1177 VanDerWaalsContact O-N 3.14Å; L1177-F1179 PolarHBondContact O-N 3.5Å
1178	D	97.6	Very high	95	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.177	C	C	.	.			trans	-61.4	133.1	-179	179.4	79.9	0	0	0	113.2	S1132 Q1135 F1174 C1180 Y1181 H1182	S1132-D1178 VanDerWaalsContact CA-OD1 3.3Å; S1132-D1178 WeakPolarHBondContact CA-OD1 3.32Å; S1132-D1178 WeakPolarHBondContact CB-OD1 3.29Å; S1132-D1178 WeakPolarHBondContact OG-CA 3.43Å; S1132-D1178 PolarHBondContact OG-OD1 3.17Å; Q1135-D1178 PolarHBondContact NE2-OD1 3.49Å; Q1135-D1178 PolarHBondContact NE2-OD2 2.93Å; F1174-D1178 HydrophobicContact CD2-CB 4.21Å; F1174-D1178 HydrophobicContact CE2-CB 3.98Å; F1174-D1178 VanDerWaalsContact CE2-OD1 3.23Å; F1174-D1178 WeakPolarHBondContact CE2-OD1 3.17Å; F1174-D1178 HydrophobicContact CZ-CB 4.32Å; F1174-D1178 VanDerWaalsContact O-CB 3.22Å; F1174-D1178 WeakPolarHBondContact O-CB 3.49Å; F1174-D1178 PolarHBondContact O-N 3.27Å; D1178-C1180 PolarHBondContact O-N 2.92Å; D1178-C1180 WeakPolarHBondContact OD2-CA 3.43Å; D1178-C1180 VanDerWaalsContact OD2-CB 3.27Å; D1178-C1180 WeakPolarHBondContact OD2-CB 3.49Å; D1178-C1180 PolarHBondContact OD2-N 3.02Å; D1178-Y1181 HydrophobicContact CB-CD1 4.43Å; D1178-Y1181 HydrophobicContact CB-CD2 3.99Å; D1178-Y1181 HydrophobicContact CB-CG 3.91Å; D1178-Y1181 PolarHBondContact O-N 3.16Å; D1178-Y1181 VanDerWaalsContact OD2-CD1 3.25Å; D1178-Y1181 WeakPolarHBondContact OD2-CD1 3.44Å; D1178-Y1181 PolarHBondContact OD2-N 3.06Å; D1178-H1182 WeakPolarHBondContact O-CB 3.4Å; D1178-H1182 PolarHBondContact O-N 3.13Å; D1178-H1182 VanDerWaalsContact O-N 3.08Å
1179	F	96.1	Very high	94.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-43.2	-175.8	-53	-51.9	0	0	0	112.1	M956 C960 L962 F976 L980 L1177 H1182 L1183	M956-F1179 HydrophobicContact CE-CE2 3.77Å; M956-F1179 HydrophobicContact CE-CZ 4.03Å; C960-F1179 HydrophobicContact CB-CE1 3.98Å; C960-F1179 HydrophobicContact CB-CZ 4.08Å; L962-F1179 HydrophobicContact CD2-CD1 3.98Å; F976-F1179 HydrophobicContact CD1-CB 4.14Å; F976-F1179 HydrophobicContact CD1-CD1 4.08Å; F976-F1179 HydrophobicContact CD1-CG 4.24Å; F976-F1179 HydrophobicContact CD2-CB 4.26Å; F976-F1179 HydrophobicContact CE1-CB 4Å; F976-F1179 AromaticContact CE1-CD1 3.58Å; F976-F1179 HydrophobicContact CE1-CD1 3.58Å; F976-F1179 HydrophobicContact CE1-CE1 4.4Å; F976-F1179 HydrophobicContact CE1-CG 4.08Å; F976-F1179 HydrophobicContact CE2-CB 4.09Å; F976-F1179 VanDerWaalsContact CE2-O 3.27Å; F976-F1179 WeakPolarHBondContact CE2-O 3.23Å; F976-F1179 HydrophobicContact CG-CB 4.29Å; F976-F1179 HydrophobicContact CZ-CB 3.97Å; F976-F1179 HydrophobicContact CZ-CD1 4.09Å; F976-F1179 HydrophobicContact CZ-CG 4.47Å; L980-F1179 HydrophobicContact CD1-CD2 3.74Å; L980-F1179 HydrophobicContact CD1-CE2 4.15Å; L980-F1179 HydrophobicContact CD1-CG 4.39Å; L980-F1179 HydrophobicContact CD2-CD2 4.42Å; L980-F1179 HydrophobicContact CD2-CE2 3.98Å; L1177-F1179 PolarHBondContact O-N 3.5Å; F1179-H1182 PolarHBondContact O-N 3Å; F1179-L1183 PolarHBondContact O-N 3.18Å
1180	C	95.9	Very high	94.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.9	-42.2	-179.6	-75.5	0	0	0	0	111.7	Q1135 F1136 D1178 H1182 L1183 L1184 I1208	Q1135-C1180 HydrophobicContact CG-CB 4.22Å; F1136-C1180 WeakPolarHBondContact CA-SG 3.48Å; D1178-C1180 PolarHBondContact O-N 2.92Å; D1178-C1180 WeakPolarHBondContact OD2-CA 3.43Å; D1178-C1180 VanDerWaalsContact OD2-CB 3.27Å; D1178-C1180 WeakPolarHBondContact OD2-CB 3.49Å; D1178-C1180 PolarHBondContact OD2-N 3.02Å; C1180-H1182 VanDerWaalsContact C-N 3.25Å; C1180-H1182 PolarHBondContact O-N 3.13Å; C1180-L1183 PolarHBondContact O-N 2.87Å; C1180-L1184 WeakPolarHBondContact O-CB 3.34Å; C1180-L1184 PolarHBondContact O-N 2.91Å; C1180-I1208 HydrophobicContact CB-CB 4.37Å; C1180-I1208 HydrophobicContact CB-CD1 3.69Å; C1180-I1208 HydrophobicContact CB-CG1 3.74Å; C1180-I1208 HydrophobicContact CB-CG2 3.72Å
1181	Y	96.9	Very high	94.7	Very high	12 Å²	12	45.3 Å²	45.3	5%	0.047	23%	0.229	C	C	.	.	H	α-helix	trans	-63.7	-36.3	178.1	-68.7	7.7	0	0	0	110.9	F1174 D1178 K1185 I1208 Q1212 N1215	F1174-Y1181 HydrophobicContact CE1-CE2 4.09Å; D1178-Y1181 HydrophobicContact CB-CD1 4.43Å; D1178-Y1181 HydrophobicContact CB-CD2 3.99Å; D1178-Y1181 HydrophobicContact CB-CG 3.91Å; D1178-Y1181 PolarHBondContact O-N 3.16Å; D1178-Y1181 VanDerWaalsContact OD2-CD1 3.25Å; D1178-Y1181 WeakPolarHBondContact OD2-CD1 3.44Å; D1178-Y1181 PolarHBondContact OD2-N 3.06Å; Y1181-K1185 WeakPolarHBondContact O-CB 3.2Å; Y1181-K1185 PolarHBondContact O-N 2.81Å; Y1181-I1208 HydrophobicContact CD1-CG2 4.28Å; 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 4.17Å; Y1181-N1215 PolarHBondContact OH-ND2 2.96Å; Y1181-N1215 VanDerWaalsContact OH-ND2 3.16Å
1182	H	95.4	Very high	94.6	Very high	16 Å²	16	49 Å²	49	7%	0.074	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-47.9	172.1	-173.3	64	0	0	0	112.3	L962 P963 D1178 F1179 C1180 L1184 K1185 V1186	L962-H1182 HydrophobicContact CD1-CB 4.23Å; L962-H1182 HydrophobicContact CD2-CB 3.91Å; P963-H1182 PolarHBondContact O-CE1 2.99Å; P963-H1182 PolarHBondContact O-NE2 3.19Å; D1178-H1182 WeakPolarHBondContact O-CB 3.4Å; D1178-H1182 PolarHBondContact O-N 3.13Å; D1178-H1182 VanDerWaalsContact O-N 3.08Å; F1179-H1182 PolarHBondContact O-N 3Å; C1180-H1182 VanDerWaalsContact C-N 3.25Å; C1180-H1182 PolarHBondContact O-N 3.13Å; H1182-L1184 VanDerWaalsContact C-N 3.34Å; H1182-L1184 PolarHBondContact O-N 3.27Å; H1182-K1185 WeakPolarHBondContact O-CB 3.42Å; H1182-K1185 PolarHBondContact O-N 3.14Å; H1182-K1185 VanDerWaalsContact O-N 3.12Å; H1182-V1186 WeakPolarHBondContact O-CG2 3.36Å; H1182-V1186 PolarHBondContact O-N 3.14Å
1183	L	95.6	Very high	94.6	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-57	-46.3	176.4	177.8	62.4	0	0	0	112	S969 I972 L973 F976 F1179 C1180 K1185 V1186 Q1187 L1201 M1204 V1205 I1208	S969-L1183 WeakPolarHBondContact O-CD1 3.39Å; I972-L1183 HydrophobicContact CB-CD1 4.2Å; I972-L1183 HydrophobicContact CG2-CD1 3.97Å; L973-L1183 HydrophobicContact CB-CD1 4.04Å; L973-L1183 HydrophobicContact CB-CD2 4.22Å; L973-L1183 HydrophobicContact CD1-CD2 3.86Å; F976-L1183 HydrophobicContact CE2-CB 4.35Å; F1179-L1183 PolarHBondContact O-N 3.18Å; C1180-L1183 PolarHBondContact O-N 2.87Å; L1183-K1185 VanDerWaalsContact C-N 3.33Å; L1183-K1185 PolarHBondContact O-N 3.05Å; L1183-V1186 PolarHBondContact O-N 2.96Å; L1183-Q1187 WeakPolarHBondContact O-CB 3.3Å; L1183-Q1187 PolarHBondContact O-N 3.2Å; L1183-L1201 HydrophobicContact CD1-CD1 3.99Å; L1183-L1201 HydrophobicContact CD2-CD1 4.31Å; L1183-L1201 HydrophobicContact CG-CD1 4.36Å; L1183-M1204 HydrophobicContact CD2-CG 4.22Å; L1183-V1205 HydrophobicContact CD2-CG1 4.5Å; L1183-V1205 HydrophobicContact CG-CG1 4.19Å; L1183-I1208 HydrophobicContact CD2-CD1 4.07Å
1184	L	96.1	Very high	94.5	Very high	11 Å²	11	46.8 Å²	46.8	6%	0.058	25%	0.247	C	C	.	.	H	α-helix	trans	-59.7	-43	175.6	173.1	64.5	0	0	0	111.6	C1180 H1182 Q1187 K1188 V1205 I1208 R1209	C1180-L1184 WeakPolarHBondContact O-CB 3.34Å; C1180-L1184 PolarHBondContact O-N 2.91Å; H1182-L1184 VanDerWaalsContact C-N 3.34Å; H1182-L1184 PolarHBondContact O-N 3.27Å; L1184-Q1187 PolarHBondContact O-N 2.96Å; L1184-K1188 HydrophobicContact CD1-CD 3.94Å; L1184-K1188 HydrophobicContact CD1-CG 3.99Å; L1184-K1188 HydrophobicContact CG-CD 4.21Å; L1184-K1188 WeakPolarHBondContact O-CB 3.23Å; L1184-K1188 VanDerWaalsContact O-CG 3.3Å; L1184-K1188 WeakPolarHBondContact O-CG 3.49Å; L1184-K1188 PolarHBondContact O-N 3.18Å; L1184-V1205 HydrophobicContact CD1-CB 3.86Å; L1184-I1208 HydrophobicContact CB-CG2 3.97Å; L1184-I1208 HydrophobicContact CD2-CG2 4.08Å; L1184-R1209 HydrophobicContact CD1-CB 4.46Å; L1184-R1209 HydrophobicContact CD2-CB 4.06Å
1185	K	94.4	Very high	94.3	Very high	113 Å²	113	52.7 Å²	52.7	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-45.6	179.3	-172.7	-174.6	-61.2	168.5	0	111.5	Y1181 H1182 L1183 H1189	Y1181-K1185 WeakPolarHBondContact O-CB 3.2Å; Y1181-K1185 PolarHBondContact O-N 2.81Å; H1182-K1185 WeakPolarHBondContact O-CB 3.42Å; H1182-K1185 PolarHBondContact O-N 3.14Å; H1182-K1185 VanDerWaalsContact O-N 3.12Å; L1183-K1185 VanDerWaalsContact C-N 3.33Å; L1183-K1185 PolarHBondContact O-N 3.05Å; K1185-H1189 PolarHBondContact O-N 2.81Å
1186	V	94.6	Very high	94.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-71.6	-40.2	179.1	-175.7	0	0	0	0	111.6	I972 H1182 L1183 K1188 H1189 D1190	I972-V1186 HydrophobicContact CD1-CB 3.88Å; I972-V1186 HydrophobicContact CD1-CG1 3.73Å; I972-V1186 HydrophobicContact CD1-CG2 3.65Å; H1182-V1186 WeakPolarHBondContact O-CG2 3.36Å; H1182-V1186 PolarHBondContact O-N 3.14Å; L1183-V1186 PolarHBondContact O-N 2.96Å; V1186-K1188 VanDerWaalsContact C-N 3.34Å; V1186-K1188 PolarHBondContact O-N 3.15Å; V1186-H1189 WeakPolarHBondContact O-CA 3.43Å; V1186-H1189 WeakPolarHBondContact O-CB 3.27Å; V1186-H1189 PolarHBondContact O-N 3.05Å; V1186-D1190 PolarHBondContact O-N 2.82Å
1187	Q	94.9	Very high	93.9	Very high	9 Å²	9	53.6 Å²	53.6	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-64.1	-38.2	177.4	-165	-75.1	-27.7	0	0	112.1	L1183 L1184 H1189 D1190 G1191 K1192 L1201 V1205	L1183-Q1187 WeakPolarHBondContact O-CB 3.3Å; L1183-Q1187 PolarHBondContact O-N 3.2Å; L1184-Q1187 PolarHBondContact O-N 2.96Å; Q1187-H1189 PolarHBondContact O-N 3.05Å; Q1187-D1190 WeakPolarHBondContact CA-OD1 3.49Å; Q1187-G1191 WeakPolarHBondContact O-CA 3.38Å; Q1187-G1191 PolarHBondContact O-N 2.98Å; Q1187-K1192 PolarHBondContact NE2-O 2.95Å; Q1187-L1201 HydrophobicContact CG-CD1 4.39Å; Q1187-L1201 HydrophobicContact CG-CD2 4.23Å; Q1187-L1201 HydrophobicContact CG-CG 4.09Å; Q1187-V1205 HydrophobicContact CB-CG1 3.83Å; Q1187-V1205 HydrophobicContact CG-CB 4.5Å; Q1187-V1205 HydrophobicContact CG-CG1 3.91Å; Q1187-V1205 HydrophobicContact CG-CG2 4.02Å
1188	K	93.2	Very high	93.5	Very high	147 Å²	147	60.3 Å²	60.3	64%	0.639	30%	0.302	S	S	*	.	H	α-helix	trans	-66.1	-26	173.6	-73.4	-175.7	83.6	178.5	0	112.8	L1184 V1186	L1184-K1188 HydrophobicContact CD1-CD 3.94Å; L1184-K1188 HydrophobicContact CD1-CG 3.99Å; L1184-K1188 HydrophobicContact CG-CD 4.21Å; L1184-K1188 WeakPolarHBondContact O-CB 3.23Å; L1184-K1188 VanDerWaalsContact O-CG 3.3Å; L1184-K1188 WeakPolarHBondContact O-CG 3.49Å; L1184-K1188 PolarHBondContact O-N 3.18Å; V1186-K1188 VanDerWaalsContact C-N 3.34Å; V1186-K1188 PolarHBondContact O-N 3.15Å
1189	H	92.7	Very high	93.2	Very high	138 Å²	138	60.5 Å²	60.5	64%	0.639	30%	0.303	S	S	*	.	H	α-helix	trans	-79.9	-45.6	177.4	171.6	-90.6	0	0	0	112.1	K1185 V1186 Q1187	K1185-H1189 PolarHBondContact O-N 2.81Å; V1186-H1189 WeakPolarHBondContact O-CA 3.43Å; V1186-H1189 WeakPolarHBondContact O-CB 3.27Å; V1186-H1189 PolarHBondContact O-N 3.05Å; Q1187-H1189 PolarHBondContact O-N 3.05Å
1190	D	92.3	Very high	93.1	Very high	46 Å²	46	62.1 Å²	62.1	25%	0.246	31%	0.313	C	S	.	.	H	α-helix	trans	-95.1	-17.4	-175.2	72.4	8	0	0	0	115.2	G968 S969 V1186 Q1187 K1192	G968-D1190 WeakPolarHBondContact CA-OD2 3.32Å; S969-D1190 WeakPolarHBondContact CB-OD2 2.97Å; S969-D1190 PolarHBondContact N-OD2 2.97Å; S969-D1190 VanDerWaalsContact OG-CG 3.25Å; S969-D1190 PolarHBondContact OG-OD1 3.33Å; S969-D1190 PolarHBondContact OG-OD2 2.87Å; V1186-D1190 PolarHBondContact O-N 2.82Å; Q1187-D1190 WeakPolarHBondContact CA-OD1 3.49Å; D1190-K1192 HydrophobicContact CB-CG 4.38Å; D1190-K1192 PolarHBondContact O-N 3.28Å; D1190-K1192 PolarHBondContact OD1-N 2.85Å; D1190-K1192 VanDerWaalsContact OD1-N 3.11Å
1191	G	91.1	Very high	92.9	Very high	57 Å²	57	62.1 Å²	62.1	59%	0.588	31%	0.313	S	S	*	.			trans	68.3	12.4	176.4	0	0	0	0	0	115.6	Q1187	Q1187-G1191 WeakPolarHBondContact O-CA 3.38Å; Q1187-G1191 PolarHBondContact O-N 2.98Å
1192	K	91.4	Very high	92.7	Very high	93 Å²	93	65.6 Å²	65.6	40%	0.404	33%	0.329	S	S	.	.			trans	-73.5	151.1	-175.5	-65.9	-176.1	175.6	-173.1	0	112.8	P970 Q1187 D1190	P970-K1192 HydrophobicContact CG-CB 4.03Å; P970-K1192 HydrophobicContact CG-CD 3.82Å; Q1187-K1192 PolarHBondContact NE2-O 2.95Å; D1190-K1192 HydrophobicContact CB-CG 4.38Å; D1190-K1192 PolarHBondContact O-N 3.28Å; D1190-K1192 PolarHBondContact OD1-N 2.85Å; D1190-K1192 VanDerWaalsContact OD1-N 3.11Å
1193	D	92.9	Very high	92.5	Very high	99 Å²	99	70.8 Å²	70.8	53%	0.529	35%	0.351	S	S	.	.			trans	-142.4	103.8	175.7	-173.8	21.7	0	0	0	110.4	K1202	D1193-K1202 HydrophobicContact CB-CB 4.23Å; D1193-K1202 WeakPolarHBondContact OD1-CB 3.35Å; D1193-K1202 PolarHBondContact OD1-N 3.05Å; D1193-K1202 WeakPolarHBondContact OD2-CB 3.35Å
1194	E	92.1	Very high	92.5	Very high	88 Å²	88	70.8 Å²	70.8	41%	0.411	35%	0.351	S	S	.	.			trans	-132.4	160.2	-179	-67	176.4	-152.3	0	0	109.4	P970 I1196 L1201	P970-E1194 HydrophobicContact CB-CB 4.3Å; P970-E1194 HydrophobicContact CB-CG 4.47Å; P970-E1194 WeakPolarHBondContact CB-OE2 3.28Å; P970-E1194 HydrophobicContact CG-CB 4.26Å; P970-E1194 VanDerWaalsContact CG-CD 3.44Å; P970-E1194 HydrophobicContact CG-CG 4.07Å; P970-E1194 WeakPolarHBondContact CG-OE1 3.36Å; E1194-I1196 HydrophobicContact CB-CD1 4.09Å; E1194-I1196 HydrophobicContact CB-CG1 4.41Å; E1194-L1201 WeakPolarHBondContact O-CB 3.5Å; E1194-L1201 PolarHBondContact O-N 3.01Å
1195	I	93.5	Very high	92.4	Very high	126 Å²	126	70.4 Å²	70.4	65%	0.646	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	108.2	174.2	-57.3	176.9	0	0	0	108.2	V1199 P1200	I1195-V1199 WeakPolarHBondContact CA-O 3.49Å; I1195-P1200 HydrophobicContact CG1-CB 4.47Å
1196	I	90.9	Very high	92.4	Very high	22 Å²	22	69.9 Å²	69.9	11%	0.113	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120	-177.3	-54.6	-57.8	0	0	0	108.6	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 3.83Å; L973-I1196 HydrophobicContact CD2-CG1 4.15Å; L973-I1196 HydrophobicContact CG-CB 4.11Å; L973-I1196 HydrophobicContact CG-CG2 4.27Å; E974-I1196 HydrophobicContact CB-CG2 3.73Å; E974-I1196 HydrophobicContact CG-CG2 4.27Å; E1194-I1196 HydrophobicContact CB-CD1 4.09Å; E1194-I1196 HydrophobicContact CB-CG1 4.41Å; I1196-N1198 VanDerWaalsContact C-N 3.29Å; I1196-N1198 PolarHBondContact O-N 3.28Å; I1196-V1199 PolarHBondContact N-O 3.45Å; I1196-V1199 WeakPolarHBondContact O-CA 3.4Å; I1196-V1199 VanDerWaalsContact O-CB 3.29Å; I1196-V1199 WeakPolarHBondContact O-CB 3.48Å; I1196-V1199 PolarHBondContact O-N 2.6Å
1197	K	87.2	Confident	92.4	Very high	137 Å²	137	72.1 Å²	72.1	60%	0.596	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	49.1	-174.9	-75.8	-175.1	175	-74.9	0	113.4	H977 V1199	H977-K1197 HydrophobicContact CB-CD 3.84Å; K1197-V1199 PolarHBondContact O-N 3.19Å
1198	N	88.1	Confident	92.5	Very high	150 Å²	150	71.7 Å²	71.7	80%	0.802	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	11	-176.1	-62.4	-8.7	0	0	0	115.4	I1196 P1200	I1196-N1198 VanDerWaalsContact C-N 3.29Å; I1196-N1198 PolarHBondContact O-N 3.28Å; N1198-P1200 WeakPolarHBondContact O-CD 3.44Å
1199	V	92.5	Very high	92.6	Very high	5 Å²	5	69.9 Å²	69.9	3%	0.03	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	110.6	175.3	178	0	0	0	0	109.8	L973 H977 I1140 I1195 I1196 K1197 L1201 M1204	L973-V1199 HydrophobicContact CD2-CB 4.38Å; L973-V1199 HydrophobicContact CD2-CG1 4.08Å; H977-V1199 VanDerWaalsContact NE2-CG2 3.32Å; H977-V1199 WeakPolarHBondContact NE2-CG2 3.33Å; I1140-V1199 HydrophobicContact CG1-CG2 4.46Å; I1140-V1199 HydrophobicContact CG2-CG2 3.85Å; I1195-V1199 WeakPolarHBondContact CA-O 3.49Å; I1196-V1199 PolarHBondContact N-O 3.45Å; I1196-V1199 WeakPolarHBondContact O-CA 3.4Å; I1196-V1199 VanDerWaalsContact O-CB 3.29Å; I1196-V1199 WeakPolarHBondContact O-CB 3.48Å; I1196-V1199 PolarHBondContact O-N 2.6Å; K1197-V1199 PolarHBondContact O-N 3.19Å; V1199-L1201 PolarHBondContact O-N 3.09Å; V1199-M1204 HydrophobicContact CG1-CB 3.78Å; V1199-M1204 HydrophobicContact CG1-CG 4.09Å; V1199-M1204 HydrophobicContact CG1-SD 4.39Å
1200	P	93	Very high	92.7	Very high	34 Å²	34	70.6 Å²	70.6	22%	0.221	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	112.2	172.2	22.9	-27.6	0	0	0	109.8	P1141 I1195 N1198 K1202 K1203 M1204	P1141-P1200 HydrophobicContact CG-CG 4.32Å; I1195-P1200 HydrophobicContact CG1-CB 4.47Å; N1198-P1200 WeakPolarHBondContact O-CD 3.44Å; P1200-K1202 VanDerWaalsContact C-N 3.3Å; P1200-K1202 PolarHBondContact O-N 2.86Å; P1200-K1203 HydrophobicContact CB-CB 4.38Å; P1200-K1203 HydrophobicContact CG-CB 4.02Å; P1200-K1203 HydrophobicContact CG-CD 4.03Å; P1200-K1203 HydrophobicContact CG-CG 4.33Å; P1200-K1203 PolarHBondContact O-N 3.49Å; P1200-K1203 VanDerWaalsContact O-N 3.16Å; P1200-M1204 PolarHBondContact O-N 2.65Å
1201	L	92.7	Very high	92.9	Very high	0 Å²	0	69 Å²	69	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-56.3	-42.1	-172.5	176.6	61.1	0	0	0	112.1	S969 P970 L973 L1183 Q1187 E1194 V1199 M1204 V1205	S969-L1201 WeakPolarHBondContact OG-CD2 3.31Å; P970-L1201 HydrophobicContact CG-CD2 4Å; L973-L1201 HydrophobicContact CB-CD1 4.23Å; L973-L1201 HydrophobicContact CD2-CB 4.16Å; L973-L1201 HydrophobicContact CD2-CD1 3.71Å; L973-L1201 HydrophobicContact CD2-CG 4.5Å; L1183-L1201 HydrophobicContact CD1-CD1 3.99Å; L1183-L1201 HydrophobicContact CD2-CD1 4.31Å; L1183-L1201 HydrophobicContact CG-CD1 4.36Å; Q1187-L1201 HydrophobicContact CG-CD1 4.39Å; Q1187-L1201 HydrophobicContact CG-CD2 4.23Å; Q1187-L1201 HydrophobicContact CG-CG 4.09Å; E1194-L1201 WeakPolarHBondContact O-CB 3.5Å; E1194-L1201 PolarHBondContact O-N 3.01Å; V1199-L1201 PolarHBondContact O-N 3.09Å; L1201-M1204 WeakPolarHBondContact O-CB 3.49Å; L1201-M1204 PolarHBondContact O-N 3.02Å; L1201-V1205 HydrophobicContact CD1-CG1 4.11Å; L1201-V1205 WeakPolarHBondContact O-CG2 3.32Å; L1201-V1205 PolarHBondContact O-N 3.01Å
1202	K	91.7	Very high	93.1	Very high	85 Å²	85	67.6 Å²	67.6	37%	0.37	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-46.6	177.6	-175.2	64.8	174.7	-177.5	0	113.5	D1193 P1200 M1204 V1205 E1206	D1193-K1202 HydrophobicContact CB-CB 4.23Å; D1193-K1202 WeakPolarHBondContact OD1-CB 3.35Å; D1193-K1202 PolarHBondContact OD1-N 3.05Å; D1193-K1202 WeakPolarHBondContact OD2-CB 3.35Å; P1200-K1202 VanDerWaalsContact C-N 3.3Å; P1200-K1202 PolarHBondContact O-N 2.86Å; K1202-M1204 VanDerWaalsContact C-N 3.34Å; K1202-M1204 PolarHBondContact O-N 3.38Å; K1202-V1205 VanDerWaalsContact O-CG2 3.23Å; K1202-V1205 WeakPolarHBondContact O-CG2 3.48Å; K1202-V1205 PolarHBondContact O-N 3.12Å; K1202-E1206 VanDerWaalsContact CE-OE1 3.28Å; K1202-E1206 WeakPolarHBondContact CE-OE1 3.29Å; K1202-E1206 VanDerWaalsContact O-CG 3.29Å; K1202-E1206 WeakPolarHBondContact O-CG 3.28Å; K1202-E1206 PolarHBondContact O-N 3.39Å
1203	K	92.3	Very high	93.3	Very high	126 Å²	126	67 Å²	67	55%	0.548	32%	0.315	S	S	.	.	H	α-helix	trans	-67.5	-35.4	177.4	-73.2	-172.6	173.7	-177.8	0	112	P1141 P1200 E1206 R1207	P1141-K1203 HydrophobicContact CB-CB 4.42Å; P1141-K1203 HydrophobicContact CG-CB 3.85Å; P1200-K1203 HydrophobicContact CB-CB 4.38Å; P1200-K1203 HydrophobicContact CG-CB 4.02Å; P1200-K1203 HydrophobicContact CG-CD 4.03Å; P1200-K1203 HydrophobicContact CG-CG 4.33Å; P1200-K1203 PolarHBondContact O-N 3.49Å; P1200-K1203 VanDerWaalsContact O-N 3.16Å; K1203-E1206 PolarHBondContact O-N 3.08Å; K1203-R1207 WeakPolarHBondContact O-CG 3.45Å; K1203-R1207 PolarHBondContact O-N 3.48Å
1204	M	94.8	Very high	93.4	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-58.9	-53.1	174.9	177.4	60.3	171.1	0	0	110.7	F1136 C1139 I1140 P1141 L1183 V1199 P1200 L1201 K1202 E1206 R1207 I1208	F1136-M1204 HydrophobicContact CD2-CE 3.72Å; F1136-M1204 HydrophobicContact CE2-CE 3.76Å; F1136-M1204 HydrophobicContact CG-CE 4.42Å; F1136-M1204 HydrophobicContact CZ-CE 4.49Å; C1139-M1204 HydrophobicContact CB-CE 3.63Å; C1139-M1204 HydrophobicContact CB-SD 3.7Å; I1140-M1204 HydrophobicContact CG1-CE 4.25Å; I1140-M1204 HydrophobicContact CG1-SD 4.43Å; P1141-M1204 HydrophobicContact CG-CB 4.43Å; L1183-M1204 HydrophobicContact CD2-CG 4.22Å; V1199-M1204 HydrophobicContact CG1-CB 3.78Å; V1199-M1204 HydrophobicContact CG1-CG 4.09Å; V1199-M1204 HydrophobicContact CG1-SD 4.39Å; P1200-M1204 PolarHBondContact O-N 2.65Å; L1201-M1204 WeakPolarHBondContact O-CB 3.49Å; L1201-M1204 PolarHBondContact O-N 3.02Å; K1202-M1204 VanDerWaalsContact C-N 3.34Å; K1202-M1204 PolarHBondContact O-N 3.38Å; M1204-E1206 VanDerWaalsContact C-N 3.33Å; M1204-E1206 PolarHBondContact O-N 2.89Å; M1204-R1207 PolarHBondContact O-N 3.14Å; M1204-I1208 HydrophobicContact CE-CD1 4.04Å; M1204-I1208 HydrophobicContact CE-CG1 4.39Å; M1204-I1208 HydrophobicContact CG-CD1 3.98Å; M1204-I1208 VanDerWaalsContact O-CG1 3.27Å; M1204-I1208 WeakPolarHBondContact O-CG1 3.11Å; M1204-I1208 PolarHBondContact O-N 2.72Å; M1204-I1208 HydrophobicContact SD-CD1 4.32Å; M1204-I1208 HydrophobicContact SD-CG1 4.45Å
1205	V	94.2	Very high	93.5	Very high	4 Å²	4	59.4 Å²	59.4	2%	0.024	28%	0.277	C	S	.	.	H	α-helix	trans	-69.4	-28.9	-178.5	-60.6	0	0	0	0	113.6	L1183 L1184 Q1187 L1201 K1202 I1208 R1209	L1183-V1205 HydrophobicContact CD2-CG1 4.5Å; L1183-V1205 HydrophobicContact CG-CG1 4.19Å; L1184-V1205 HydrophobicContact CD1-CB 3.86Å; Q1187-V1205 HydrophobicContact CB-CG1 3.83Å; Q1187-V1205 HydrophobicContact CG-CB 4.5Å; Q1187-V1205 HydrophobicContact CG-CG1 3.91Å; Q1187-V1205 HydrophobicContact CG-CG2 4.02Å; L1201-V1205 HydrophobicContact CD1-CG1 4.11Å; L1201-V1205 WeakPolarHBondContact O-CG2 3.32Å; L1201-V1205 PolarHBondContact O-N 3.01Å; K1202-V1205 VanDerWaalsContact O-CG2 3.23Å; K1202-V1205 WeakPolarHBondContact O-CG2 3.48Å; K1202-V1205 PolarHBondContact O-N 3.12Å; V1205-I1208 HydrophobicContact CG1-CD1 4.42Å; V1205-I1208 PolarHBondContact O-N 2.9Å; V1205-R1209 PolarHBondContact O-N 3.37Å
1206	E	94	Very high	93.6	Very high	102 Å²	102	56.6 Å²	56.6	48%	0.477	26%	0.263	S	S	.	.	H	α-helix	trans	-63.8	-46.2	170.6	-76.5	172.4	-178.7	0	0	111.7	K1202 K1203 M1204 R1209 K1210	K1202-E1206 VanDerWaalsContact CE-OE1 3.28Å; K1202-E1206 WeakPolarHBondContact CE-OE1 3.29Å; K1202-E1206 VanDerWaalsContact O-CG 3.29Å; K1202-E1206 WeakPolarHBondContact O-CG 3.28Å; K1202-E1206 PolarHBondContact O-N 3.39Å; K1203-E1206 PolarHBondContact O-N 3.08Å; M1204-E1206 VanDerWaalsContact C-N 3.33Å; M1204-E1206 PolarHBondContact O-N 2.89Å; E1206-R1209 PolarHBondContact O-N 3.38Å; E1206-K1210 WeakPolarHBondContact O-CG 3.23Å; E1206-K1210 PolarHBondContact O-N 2.97Å
1207	R	95.5	Very high	93.8	Very high	46 Å²	46	60.7 Å²	60.7	17%	0.174	28%	0.282	C	S	.	.	H	α-helix	trans	-62.2	-44.3	173.7	-74.1	-178.3	63.8	73.4	2.8	111.6	Y1138 C1139 E1150 K1203 M1204 R1209 K1210 F1211	Y1138-R1207 PolarHBondContact O-NH2 3.22Å; C1139-R1207 VanDerWaalsContact O-CD 3.32Å; C1139-R1207 WeakPolarHBondContact O-CD 3.31Å; C1139-R1207 PolarHBondContact O-NE 2.72Å; E1150-R1207 IonicContact OE1-CZ 2.97Å; E1150-R1207 IonicContact OE1-NH1 3.58Å; E1150-R1207 PolarHBondContact OE1-NH1 2.88Å; E1150-R1207 IonicContact OE1-NH2 2.74Å; E1150-R1207 PolarHBondContact OE1-NH2 3.19Å; E1150-R1207 IonicContact OE2-CZ 2.97Å; E1150-R1207 IonicContact OE2-NH1 3.6Å; E1150-R1207 IonicContact OE2-NH2 2.8Å; E1150-R1207 PolarHBondContact OE2-NH2 3.01Å; K1203-R1207 WeakPolarHBondContact O-CG 3.45Å; K1203-R1207 PolarHBondContact O-N 3.48Å; M1204-R1207 PolarHBondContact O-N 3.14Å; R1207-R1209 VanDerWaalsContact C-N 3.27Å; R1207-R1209 PolarHBondContact O-N 3.03Å; R1207-K1210 WeakPolarHBondContact O-CB 3.35Å; R1207-K1210 PolarHBondContact O-N 3.03Å; R1207-F1211 VanDerWaalsContact O-CD2 3.24Å; R1207-F1211 WeakPolarHBondContact O-CD2 3.32Å; R1207-F1211 PolarHBondContact O-N 2.77Å; R1207-F1211 VanDerWaalsContact O-N 3.11Å
1208	I	96.6	Very high	94.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-54.6	-46.1	175.1	-67.9	167.9	0	0	0	110.6	C1139 C1180 Y1181 L1183 L1184 M1204 V1205 K1210 F1211 Q1212	C1139-I1208 HydrophobicContact CB-CG1 3.79Å; C1180-I1208 HydrophobicContact CB-CB 4.37Å; C1180-I1208 HydrophobicContact CB-CD1 3.69Å; C1180-I1208 HydrophobicContact CB-CG1 3.74Å; C1180-I1208 HydrophobicContact CB-CG2 3.72Å; Y1181-I1208 HydrophobicContact CD1-CG2 4.28Å; L1183-I1208 HydrophobicContact CD2-CD1 4.07Å; L1184-I1208 HydrophobicContact CB-CG2 3.97Å; L1184-I1208 HydrophobicContact CD2-CG2 4.08Å; M1204-I1208 HydrophobicContact CE-CD1 4.04Å; M1204-I1208 HydrophobicContact CE-CG1 4.39Å; M1204-I1208 HydrophobicContact CG-CD1 3.98Å; M1204-I1208 VanDerWaalsContact O-CG1 3.27Å; M1204-I1208 WeakPolarHBondContact O-CG1 3.11Å; M1204-I1208 PolarHBondContact O-N 2.72Å; M1204-I1208 HydrophobicContact SD-CD1 4.32Å; M1204-I1208 HydrophobicContact SD-CG1 4.45Å; V1205-I1208 HydrophobicContact CG1-CD1 4.42Å; V1205-I1208 PolarHBondContact O-N 2.9Å; I1208-K1210 VanDerWaalsContact C-N 3.26Å; I1208-K1210 PolarHBondContact O-N 3.48Å; I1208-F1211 PolarHBondContact O-N 2.97Å; I1208-Q1212 WeakPolarHBondContact O-CB 3.39Å; I1208-Q1212 PolarHBondContact O-N 3.42Å
1209	R	95.9	Very high	94.6	Very high	110 Å²	110	48 Å²	48	42%	0.415	22%	0.22	S	C	.	.	H	α-helix	trans	-62.2	-33.9	179.5	-179.1	56.5	-178	171	6.8	112.3	L1184 V1205 E1206 R1207 I1213	L1184-R1209 HydrophobicContact CD1-CB 4.46Å; L1184-R1209 HydrophobicContact CD2-CB 4.06Å; V1205-R1209 PolarHBondContact O-N 3.37Å; E1206-R1209 PolarHBondContact O-N 3.38Å; R1207-R1209 VanDerWaalsContact C-N 3.27Å; R1207-R1209 PolarHBondContact O-N 3.03Å; R1209-I1213 HydrophobicContact CG-CD1 4.35Å; R1209-I1213 WeakPolarHBondContact O-CD1 3.39Å; R1209-I1213 VanDerWaalsContact O-CG1 3.32Å; R1209-I1213 WeakPolarHBondContact O-CG1 3.47Å; R1209-I1213 PolarHBondContact O-N 3.45Å
1210	K	94.5	Very high	94.6	Very high	152 Å²	152	52.1 Å²	52.1	66%	0.661	25%	0.246	S	C	*	.	H	α-helix	trans	-66.7	-49.7	176.2	-65	-64.4	-176.6	176.4	0	111.7	E1206 R1207 I1208 Q1212 I1213 L1214	E1206-K1210 WeakPolarHBondContact O-CG 3.23Å; E1206-K1210 PolarHBondContact O-N 2.97Å; R1207-K1210 WeakPolarHBondContact O-CB 3.35Å; R1207-K1210 PolarHBondContact O-N 3.03Å; I1208-K1210 VanDerWaalsContact C-N 3.26Å; I1208-K1210 PolarHBondContact O-N 3.48Å; K1210-Q1212 VanDerWaalsContact C-N 3.3Å; K1210-Q1212 PolarHBondContact O-N 3Å; K1210-I1213 PolarHBondContact O-N 3.25Å; K1210-L1214 PolarHBondContact O-N 2.68Å; K1210-L1214 VanDerWaalsContact O-N 3.1Å
1211	F	95.6	Very high	94.7	Very high	12 Å²	12	52.8 Å²	52.8	5%	0.053	25%	0.247	C	C	.	.	H	α-helix	trans	-67.3	-31.2	177.1	-68.2	-68.4	0	0	0	112.7	Y1138 C1139 V1149 H1158 R1207 I1208 I1213 L1214 N1215	Y1138-F1211 HydrophobicContact CD2-CD1 4.32Å; Y1138-F1211 AromaticContact CD2-CD2 3.98Å; Y1138-F1211 HydrophobicContact CD2-CD2 3.98Å; Y1138-F1211 HydrophobicContact CD2-CE1 4.29Å; Y1138-F1211 AromaticContact CD2-CE2 3.92Å; Y1138-F1211 HydrophobicContact CD2-CE2 3.92Å; Y1138-F1211 HydrophobicContact CD2-CG 4.18Å; Y1138-F1211 HydrophobicContact CD2-CZ 4.08Å; Y1138-F1211 HydrophobicContact CE2-CB 4.07Å; Y1138-F1211 AromaticContact CE2-CD1 3.89Å; Y1138-F1211 HydrophobicContact CE2-CD1 3.89Å; Y1138-F1211 AromaticContact CE2-CD2 3.87Å; Y1138-F1211 HydrophobicContact CE2-CD2 3.87Å; Y1138-F1211 HydrophobicContact CE2-CE1 4.29Å; Y1138-F1211 HydrophobicContact CE2-CE2 4.25Å; Y1138-F1211 AromaticContact CE2-CG 3.66Å; Y1138-F1211 HydrophobicContact CE2-CG 3.66Å; Y1138-F1211 HydrophobicContact CE2-CZ 4.45Å; C1139-F1211 VanDerWaalsContact SG-CD2 3.59Å; V1149-F1211 HydrophobicContact CG1-CE1 4.18Å; V1149-F1211 HydrophobicContact CG1-CZ 3.68Å; H1158-F1211 AromaticContact CE1-CD1 3.47Å; H1158-F1211 VanDerWaalsContact CE1-CD1 3.47Å; H1158-F1211 WeakPolarHBondContact CE1-CD1 3.46Å; H1158-F1211 AromaticContact CE1-CE1 3.46Å; H1158-F1211 VanDerWaalsContact CE1-CE1 3.46Å; H1158-F1211 WeakPolarHBondContact CE1-CE1 3.37Å; H1158-F1211 AromaticContact NE2-CD1 3.64Å; H1158-F1211 AromaticContact NE2-CE1 3.28Å; H1158-F1211 VanDerWaalsContact NE2-CE1 3.28Å; H1158-F1211 WeakPolarHBondContact NE2-CE1 3.49Å; R1207-F1211 VanDerWaalsContact O-CD2 3.24Å; R1207-F1211 WeakPolarHBondContact O-CD2 3.32Å; R1207-F1211 PolarHBondContact O-N 2.77Å; R1207-F1211 VanDerWaalsContact O-N 3.11Å; I1208-F1211 PolarHBondContact O-N 2.97Å; F1211-I1213 PolarHBondContact O-N 2.74Å; F1211-L1214 HydrophobicContact CD1-CD2 4.37Å; F1211-L1214 PolarHBondContact O-N 2.8Å; F1211-N1215 WeakPolarHBondContact O-CB 3.38Å; F1211-N1215 PolarHBondContact O-N 3.34Å; F1211-N1215 PolarHBondContact O-ND2 3.08Å; F1211-N1215 PolarHBondContact O-OD1 3.01Å
1212	Q	95.8	Very high	94.7	Very high	29 Å²	29	52.9 Å²	52.9	14%	0.136	25%	0.247	C	C	.	.	H	α-helix	trans	-59.1	-47.2	171.8	-179.6	174.9	55.7	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 4.17Å; I1208-Q1212 WeakPolarHBondContact O-CB 3.39Å; I1208-Q1212 PolarHBondContact O-N 3.42Å; K1210-Q1212 VanDerWaalsContact C-N 3.3Å; K1210-Q1212 PolarHBondContact O-N 3Å; Q1212-L1214 VanDerWaalsContact C-N 3.35Å; Q1212-L1214 PolarHBondContact O-N 2.8Å; Q1212-N1215 PolarHBondContact O-N 3.34Å; Q1212-D1216 WeakPolarHBondContact O-CB 2.9Å; Q1212-D1216 PolarHBondContact O-N 3.15Å
1213	I	95.1	Very high	94.7	Very high	80 Å²	80	50.3 Å²	50.3	41%	0.41	24%	0.238	S	C	.	.	H	α-helix	trans	-61.4	-45.5	177.4	-66.9	164	0	0	0	110.5	R1209 K1210 F1211 D1216 E1217	R1209-I1213 HydrophobicContact CG-CD1 4.35Å; R1209-I1213 WeakPolarHBondContact O-CD1 3.39Å; R1209-I1213 VanDerWaalsContact O-CG1 3.32Å; R1209-I1213 WeakPolarHBondContact O-CG1 3.47Å; R1209-I1213 PolarHBondContact O-N 3.45Å; K1210-I1213 PolarHBondContact O-N 3.25Å; F1211-I1213 PolarHBondContact O-N 2.74Å; I1213-D1216 PolarHBondContact O-N 3.38Å; I1213-E1217 WeakPolarHBondContact O-CB 3.49Å; I1213-E1217 PolarHBondContact O-N 3.15Å
1214	L	94.9	Very high	94.6	Very high	28 Å²	28	51.6 Å²	51.6	15%	0.147	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-46.6	178.9	-179.3	62.9	0	0	0	112	H1158 K1210 F1211 Q1212 E1217 I1218	H1158-L1214 HydrophobicContact CB-CD2 4.11Å; K1210-L1214 PolarHBondContact O-N 2.68Å; K1210-L1214 VanDerWaalsContact O-N 3.1Å; F1211-L1214 HydrophobicContact CD1-CD2 4.37Å; F1211-L1214 PolarHBondContact O-N 2.8Å; Q1212-L1214 VanDerWaalsContact C-N 3.35Å; Q1212-L1214 PolarHBondContact O-N 2.8Å; L1214-E1217 PolarHBondContact O-N 3.23Å; L1214-I1218 HydrophobicContact CD1-CD1 3.91Å; L1214-I1218 HydrophobicContact CD1-CG1 4.35Å; L1214-I1218 HydrophobicContact CG-CD1 3.85Å; L1214-I1218 VanDerWaalsContact O-CG1 3.25Å; L1214-I1218 WeakPolarHBondContact O-CG1 3.3Å; L1214-I1218 PolarHBondContact O-N 3.46Å
1215	N	95.4	Very high	94.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-44.9	178.4	-68.5	-18.9	0	0	0	111.3	Q1135 Y1181 F1211 Q1212 E1217 I1218 I1219	Q1135-N1215 PolarHBondContact OE1-ND2 3.3Å; Y1181-N1215 PolarHBondContact OH-ND2 2.96Å; Y1181-N1215 VanDerWaalsContact OH-ND2 3.16Å; F1211-N1215 WeakPolarHBondContact O-CB 3.38Å; F1211-N1215 PolarHBondContact O-N 3.34Å; F1211-N1215 PolarHBondContact O-ND2 3.08Å; F1211-N1215 PolarHBondContact O-OD1 3.01Å; Q1212-N1215 PolarHBondContact O-N 3.34Å; N1215-E1217 VanDerWaalsContact C-N 3.3Å; N1215-E1217 PolarHBondContact O-N 3.1Å; N1215-I1218 PolarHBondContact O-N 3.49Å; N1215-I1219 HydrophobicContact CB-CD1 4.46Å; N1215-I1219 VanDerWaalsContact O-CB 3.28Å; N1215-I1219 WeakPolarHBondContact O-CB 3.42Å; N1215-I1219 WeakPolarHBondContact O-CG1 3.42Å; N1215-I1219 PolarHBondContact O-N 2.97Å
1216	D	94.8	Very high	93.8	Very high	67 Å²	67	56.6 Å²	56.6	36%	0.358	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-39.9	179.8	-69.7	-16.9	0	0	0	110.8	Q1212 I1213 T1220	Q1212-D1216 WeakPolarHBondContact O-CB 2.9Å; Q1212-D1216 PolarHBondContact O-N 3.15Å; I1213-D1216 PolarHBondContact O-N 3.38Å; D1216-T1220 VanDerWaalsContact O-CB 3.23Å; D1216-T1220 WeakPolarHBondContact O-CB 3.34Å; D1216-T1220 PolarHBondContact O-N 3.05Å; D1216-T1220 PolarHBondContact O-OG1 3.29Å
1217	E	95.3	Very high	92.6	Very high	107 Å²	107	58.2 Å²	58.2	50%	0.5	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-53.5	173.7	-179.5	177.9	178.5	0	0	111.5	I1213 L1214 N1215 T1220 I1221	I1213-E1217 WeakPolarHBondContact O-CB 3.49Å; I1213-E1217 PolarHBondContact O-N 3.15Å; L1214-E1217 PolarHBondContact O-N 3.23Å; N1215-E1217 VanDerWaalsContact C-N 3.3Å; N1215-E1217 PolarHBondContact O-N 3.1Å; E1217-T1220 PolarHBondContact O-N 3.44Å; E1217-I1221 HydrophobicContact CG-CD1 3.97Å; E1217-I1221 WeakPolarHBondContact O-CG1 3.39Å; E1217-I1221 PolarHBondContact O-N 2.94Å
1218	I	96.4	Very high	90.6	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-49.2	-178.9	-66.1	169.3	0	0	0	111.1	H1158 W1159 C1162 L1214 N1215 T1220 I1221 L1222	H1158-I1218 HydrophobicContact CB-CD1 3.86Å; W1159-I1218 HydrophobicContact CD2-CD1 4.42Å; W1159-I1218 HydrophobicContact CD2-CG1 4.22Å; W1159-I1218 HydrophobicContact CD2-CG2 3.9Å; W1159-I1218 HydrophobicContact CE3-CG2 4.03Å; 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 4.23Å; W1159-I1218 HydrophobicContact CZ3-CG2 4.48Å; C1162-I1218 HydrophobicContact CB-CB 4.32Å; C1162-I1218 HydrophobicContact CB-CG2 3.61Å; L1214-I1218 HydrophobicContact CD1-CD1 3.91Å; L1214-I1218 HydrophobicContact CD1-CG1 4.35Å; L1214-I1218 HydrophobicContact CG-CD1 3.85Å; L1214-I1218 VanDerWaalsContact O-CG1 3.25Å; L1214-I1218 WeakPolarHBondContact O-CG1 3.3Å; L1214-I1218 PolarHBondContact O-N 3.46Å; N1215-I1218 PolarHBondContact O-N 3.49Å; I1218-T1220 VanDerWaalsContact C-N 3.28Å; I1218-T1220 PolarHBondContact O-N 2.95Å; I1218-I1221 PolarHBondContact O-N 3.3Å; I1218-L1222 HydrophobicContact CG2-CD1 3.72Å; I1218-L1222 HydrophobicContact CG2-CG 4.29Å; I1218-L1222 VanDerWaalsContact O-CG 3.29Å; I1218-L1222 WeakPolarHBondContact O-CG 3.49Å; I1218-L1222 PolarHBondContact O-N 3.34Å
1219	I	94.9	Very high	88.1	Confident	18 Å²	18	62.2 Å²	62.2	9%	0.092	31%	0.314	C	S	.	.	H	α-helix	trans	-58.7	-43	179.3	-71.3	168.1	0	0	0	110.1	C1162 V1166 Q1171 N1215 L1222 D1223	C1162-I1219 HydrophobicContact CB-CG1 3.95Å; 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 4.41Å; Q1171-I1219 HydrophobicContact CB-CG2 3.92Å; Q1171-I1219 HydrophobicContact CG-CG2 4Å; N1215-I1219 HydrophobicContact CB-CD1 4.46Å; N1215-I1219 VanDerWaalsContact O-CB 3.28Å; N1215-I1219 WeakPolarHBondContact O-CB 3.42Å; N1215-I1219 WeakPolarHBondContact O-CG1 3.42Å; N1215-I1219 PolarHBondContact O-N 2.97Å; I1219-L1222 PolarHBondContact O-N 3.14Å; I1219-D1223 WeakPolarHBondContact O-CB 3.47Å; I1219-D1223 PolarHBondContact O-N 2.82Å
1220	T	94.2	Very high	85.6	Confident	93 Å²	93	62.3 Å²	62.3	57%	0.571	32%	0.323	S	S	*	.	H	α-helix	trans	-64.1	-41.5	178.2	-59.3	0	0	0	0	111.8	D1216 E1217 I1218 K1224	D1216-T1220 VanDerWaalsContact O-CB 3.23Å; D1216-T1220 WeakPolarHBondContact O-CB 3.34Å; D1216-T1220 PolarHBondContact O-N 3.05Å; D1216-T1220 PolarHBondContact O-OG1 3.29Å; E1217-T1220 PolarHBondContact O-N 3.44Å; I1218-T1220 VanDerWaalsContact C-N 3.28Å; I1218-T1220 PolarHBondContact O-N 2.95Å; T1220-K1224 VanDerWaalsContact O-CB 3.3Å; T1220-K1224 WeakPolarHBondContact O-CB 3.37Å; T1220-K1224 PolarHBondContact O-N 3.05Å
1221	I	93.9	Very high	83	Confident	47 Å²	47	57.5 Å²	57.5	24%	0.241	32%	0.317	C	S	.	.	H	α-helix	trans	-63.8	-47.8	176.9	-67.9	165.5	0	0	0	110.5	W1159 E1217 I1218 K1224 Y1225	W1159-I1221 HydrophobicContact CH2-CB 4.42Å; W1159-I1221 HydrophobicContact CH2-CD1 4.32Å; W1159-I1221 HydrophobicContact CH2-CG2 3.93Å; W1159-I1221 HydrophobicContact CZ2-CD1 4.37Å; E1217-I1221 HydrophobicContact CG-CD1 3.97Å; E1217-I1221 WeakPolarHBondContact O-CG1 3.39Å; E1217-I1221 PolarHBondContact O-N 2.94Å; I1218-I1221 PolarHBondContact O-N 3.3Å; I1221-K1224 WeakPolarHBondContact O-CB 3.37Å; I1221-K1224 PolarHBondContact O-N 2.83Å; I1221-Y1225 HydrophobicContact CG2-CD2 3.91Å; I1221-Y1225 HydrophobicContact CG2-CE2 3.92Å; I1221-Y1225 WeakPolarHBondContact O-CD2 3.49Å; I1221-Y1225 PolarHBondContact O-N 3.4Å; I1221-Y1225 VanDerWaalsContact O-N 3.13Å
1222	L	93.9	Very high	80.2	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-62.2	-46.6	179.3	-67.3	167.7	0	0	0	111.8	F1093 L1097 W1159 C1162 M1163 V1166 I1218 I1219 K1224 Y1225 L1226	F1093-L1222 HydrophobicContact CE1-CD2 4.3Å; F1093-L1222 HydrophobicContact CZ-CD2 4.27Å; L1097-L1222 HydrophobicContact CD1-CD2 3.96Å; L1097-L1222 HydrophobicContact CD2-CD2 3.9Å; W1159-L1222 HydrophobicContact CE3-CD2 4.37Å; W1159-L1222 HydrophobicContact CZ3-CD2 4.09Å; W1159-L1222 HydrophobicContact CZ3-CG 4.43Å; C1162-L1222 HydrophobicContact CB-CD1 4.33Å; M1163-L1222 HydrophobicContact CB-CD1 4.09Å; V1166-L1222 HydrophobicContact CB-CB 4.44Å; V1166-L1222 HydrophobicContact CB-CD1 4.48Å; V1166-L1222 HydrophobicContact CG1-CB 4.11Å; V1166-L1222 HydrophobicContact CG2-CB 4.29Å; V1166-L1222 HydrophobicContact CG2-CD1 4.22Å; I1218-L1222 HydrophobicContact CG2-CD1 3.72Å; I1218-L1222 HydrophobicContact CG2-CG 4.29Å; I1218-L1222 VanDerWaalsContact O-CG 3.29Å; I1218-L1222 WeakPolarHBondContact O-CG 3.49Å; I1218-L1222 PolarHBondContact O-N 3.34Å; I1219-L1222 PolarHBondContact O-N 3.14Å; L1222-K1224 PolarHBondContact O-N 3.11Å; L1222-Y1225 PolarHBondContact O-N 3.08Å; L1222-L1226 WeakPolarHBondContact O-CB 3.41Å; L1222-L1226 PolarHBondContact O-N 3.35Å
1223	D	90.9	Very high	77.6	Confident	31 Å²	31	69.4 Å²	69.4	17%	0.166	39%	0.392	C	S	.	.	H	α-helix	trans	-62.8	-31.1	175.7	-88.3	-23.6	0	0	0	111.9	V1166 Q1171 I1219 K1227	V1166-D1223 WeakPolarHBondContact CG1-OD1 3.48Å; Q1171-D1223 PolarHBondContact NE2-OD1 2.84Å; Q1171-D1223 PolarHBondContact NE2-OD2 3.27Å; I1219-D1223 WeakPolarHBondContact O-CB 3.47Å; I1219-D1223 PolarHBondContact O-N 2.82Å; D1223-K1227 WeakPolarHBondContact O-CD 3.48Å; D1223-K1227 WeakPolarHBondContact O-CG 3.07Å
1224	K	89.9	Confident	74.8	Confident	154 Å²	154	69.8 Å²	69.8	67%	0.67	40%	0.398	S	S	*	.	H	α-helix	trans	-66.9	-45.9	176.7	-176.5	-171.6	175.9	-170	0	111.4	T1220 I1221 L1222	T1220-K1224 VanDerWaalsContact O-CB 3.3Å; T1220-K1224 WeakPolarHBondContact O-CB 3.37Å; T1220-K1224 PolarHBondContact O-N 3.05Å; I1221-K1224 WeakPolarHBondContact O-CB 3.37Å; I1221-K1224 PolarHBondContact O-N 2.83Å; L1222-K1224 PolarHBondContact O-N 3.11Å
1225	Y	88.5	Confident	72.3	Confident	67 Å²	67	74 Å²	74	26%	0.263	43%	0.427	S	S	.	.	H	α-helix	trans	-76.5	-20.7	179.4	-78.7	-76.2	0	0	0	113.6	L1008 F1093 E1094 I1221 L1222 K1227 S1228	L1008-Y1225 HydrophobicContact CD1-CE2 4.29Å; F1093-Y1225 HydrophobicContact CD1-CD1 4.12Å; F1093-Y1225 AromaticContact CD1-CD2 3.79Å; F1093-Y1225 HydrophobicContact CD1-CD2 3.79Å; F1093-Y1225 HydrophobicContact CD1-CE2 4.34Å; F1093-Y1225 AromaticContact CD1-CG 3.67Å; F1093-Y1225 HydrophobicContact CD1-CG 3.67Å; F1093-Y1225 HydrophobicContact CE1-CD2 4.06Å; F1093-Y1225 HydrophobicContact CE1-CG 4.3Å; E1094-Y1225 WeakPolarHBondContact CB-O 3.34Å; E1094-Y1225 WeakPolarHBondContact CG-O 3.47Å; I1221-Y1225 HydrophobicContact CG2-CD2 3.91Å; I1221-Y1225 HydrophobicContact CG2-CE2 3.92Å; I1221-Y1225 WeakPolarHBondContact O-CD2 3.49Å; I1221-Y1225 PolarHBondContact O-N 3.4Å; I1221-Y1225 VanDerWaalsContact O-N 3.13Å; L1222-Y1225 PolarHBondContact O-N 3.08Å; Y1225-K1227 VanDerWaalsContact C-N 3.3Å; Y1225-S1228 PolarHBondContact O-OG 3.11Å
1226	L	84.4	Confident	69.9	Low	41 Å²	41	80.8 Å²	80.8	22%	0.215	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-8.7	177.8	-157.4	66.8	0	0	0	113.3	L1097 V1166 L1167 L1222	L1097-L1226 HydrophobicContact CB-CD1 4.18Å; V1166-L1226 HydrophobicContact CG1-CD2 4.18Å; L1167-L1226 HydrophobicContact CD2-CD1 4.2Å; L1167-L1226 HydrophobicContact CD2-CD2 4.27Å; L1222-L1226 WeakPolarHBondContact O-CB 3.41Å; L1222-L1226 PolarHBondContact O-N 3.35Å
1227	K	67.5	Low	68.1	Low	137 Å²	137	85.4 Å²	85.4	60%	0.596	49%	0.488	S	S	*	.	S	Bend	trans	-106	-2.8	-175	-72.1	176.9	-171	-179.2	0	114.8	D1223 Y1225 G1229	D1223-K1227 WeakPolarHBondContact O-CD 3.48Å; D1223-K1227 WeakPolarHBondContact O-CG 3.07Å; Y1225-K1227 VanDerWaalsContact C-N 3.3Å; K1227-G1229 PolarHBondContact O-N 3.27Å
1228	S	53.8	Low	67	Low	74 Å²	74	89 Å²	89	52%	0.517	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-5.4	-173.8	21.5	0	0	0	0	115.2	E1094 Y1225	E1094-S1228 VanDerWaalsContact OE2-CB 3.31Å; E1094-S1228 WeakPolarHBondContact OE2-CB 3.29Å; E1094-S1228 PolarHBondContact OE2-OG 2.98Å; Y1225-S1228 PolarHBondContact O-OG 3.11Å
1229	G	45.2	Very low	66.1	Low	55 Å²	55	94.3 Å²	94.3	57%	0.567	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-7.9	178.3	0	0	0	0	0	117.4	K1227 G1231	K1227-G1229 PolarHBondContact O-N 3.27Å; G1229-G1231 VanDerWaalsContact C-N 3.31Å; G1229-G1231 PolarHBondContact O-N 2.79Å
1230	D	42.2	Very low	65.4	Low	112 Å²	112	99.8 Å²	99.8	60%	0.599	56%	0.556	S	S	*	*			trans	-81.8	76.6	176.3	-80.4	-33.3	0	0	0	110.6
1231	G	39.8	Very low	65	Low	52 Å²	52	100.6 Å²	100.6	54%	0.536	56%	0.564	S	S	.	*			trans	-62.3	156.3	164.8	0	0	0	0	0	111.3	G1229 G1233	G1229-G1231 VanDerWaalsContact C-N 3.31Å; G1229-G1231 PolarHBondContact O-N 2.79Å; G1231-G1233 PolarHBondContact O-N 3.49Å
1232	E	36.8	Very low	64.6	Low	220 Å²	220	104.3 Å²	104.3	100%	1.028	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	28.2	-174.1	-63.3	-176.8	144.4	0	0	116.8
1233	G	41.3	Very low	63.9	Low	71 Å²	71	112.6 Å²	112.6	73%	0.732	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.7	5.5	-176.4	0	0	0	0	0	116.6	G1231	G1231-G1233 PolarHBondContact O-N 3.49Å
1234	T	37.5	Very low	63.6	Low	88 Å²	88	115.6 Å²	115.6	54%	0.54	64%	0.638	S	S	.	*	S	Bend	trans	-78	131	171.4	27.4	0	0	0	0	110.8	V1236	T1234-V1236 PolarHBondContact O-N 3.29Å
1235	P	42.4	Very low	63	Low	116 Å²	116	114.8 Å²	114.8	75%	0.753	65%	0.649	S	S	*	*			trans	-61.6	136.6	174.1	26.6	-31.4	0	0	0	108.5	E1237	P1235-E1237 PolarHBondContact O-N 3.36Å
1236	V	44.1	Very low	62.5	Low	143 Å²	143	117.1 Å²	117.1	87%	0.867	67%	0.665	S	S	*	*			trans	-33.9	111.8	177.6	-176.8	0	0	0	0	110.4	T1234 H1238	T1234-V1236 PolarHBondContact O-N 3.29Å; V1236-H1238 PolarHBondContact O-N 3.21Å
1237	E	58.1	Low	62	Low	164 Å²	164	121.7 Å²	121.7	77%	0.766	69%	0.685	S	S	*	*			trans	-50.5	133.6	179.8	-87.8	-154.3	142.5	0	0	110.2	P1235 V1239	P1235-E1237 PolarHBondContact O-N 3.36Å; E1237-V1239 PolarHBondContact O-N 3.36Å
1238	H	70.4	Confident	62	Low	183 Å²	183	123.5 Å²	123.5	85%	0.847	70%	0.695	S	S	*	*			trans	-67.2	103.3	-175	-174	72.5	0	0	0	111.3	V1236	V1236-H1238 PolarHBondContact O-N 3.21Å
1239	V	78.4	Confident	62.8	Low	113 Å²	113	124.3 Å²	124.3	69%	0.685	70%	0.701	S	S	*	*			trans	-79.6	131.8	172.2	-177	0	0	0	0	109.5	E1237 C1241	E1237-V1239 PolarHBondContact O-N 3.36Å; V1239-C1241 PolarHBondContact O-N 3.27Å; V1239-C1241 VanDerWaalsContact O-N 3.08Å
1240	R	81.1	Confident	63.7	Low	133 Å²	133	127.1 Å²	127.1	50%	0.502	70%	0.702	S	S	.	*			trans	-60.7	112.8	176.3	-173.4	179.5	67.1	-169.4	-9.8	110.8	G1117 V1118	G1117-R1240 PolarHBondContact O-NH1 2.99Å; G1117-R1240 PolarHBondContact O-NH2 3.17Å; V1118-R1240 VanDerWaalsContact CA-NH2 3.29Å; V1118-R1240 PolarHBondContact O-NH2 2.9Å
1241	C	84.9	Confident	64.3	Low	109 Å²	109	125.1 Å²	125.1	74%	0.736	70%	0.701	S	S	*	*			trans	-81.6	150.8	174.9	-58.6	0	0	0	0	111.8	V1239	V1239-C1241 PolarHBondContact O-N 3.27Å; V1239-C1241 VanDerWaalsContact O-N 3.08Å
1242	F	84.7	Confident	65	Low	126 Å²	126	128.1 Å²	128.1	55%	0.553	71%	0.714	S	S	*	*			trans	-106.5	141.5	170.6	-57.9	-74.1	0	0	0	109.5	V1118	V1118-F1242 HydrophobicContact CB-CZ 4.39Å; V1118-F1242 HydrophobicContact CG1-CZ 4.14Å; V1118-F1242 HydrophobicContact CG2-CE1 3.83Å; V1118-F1242 HydrophobicContact CG2-CZ 3.82Å
1243	Q	80.6	Confident	65.3	Low	175 Å²	175	125.2 Å²	125.2	82%	0.818	72%	0.718	S	S	*	*			trans	-69.7	134.2	175.9	-66.2	-64.1	-19.9	0	0	109.7
1244	P	83.1	Confident	66.5	Low	94 Å²	94	128 Å²	128	61%	0.61	72%	0.718	S	S	*	*			trans	-62	157.3	167.4	29.2	-33.8	0	0	0	109.5	I1246	P1244-I1246 PolarHBondContact O-N 3.48Å
1245	P	77.6	Confident	68.1	Low	138 Å²	138	130.1 Å²	130.1	90%	0.896	73%	0.727	S	S	*	*			trans	-55.7	112.3	175.2	22.6	-32	0	0	0	109.6
1246	I	77.9	Confident	69.5	Low	116 Å²	116	130.8 Å²	130.8	60%	0.595	73%	0.725	S	S	*	*			trans	-82.8	128.3	-177.8	-163.2	155.2	0	0	0	109.8	P1244 Q1248 L1250 A1251	P1244-I1246 PolarHBondContact O-N 3.48Å; I1246-Q1248 PolarHBondContact O-N 2.7Å; I1246-L1250 HydrophobicContact CG1-CB 4.43Å; I1246-A1251 HydrophobicContact CG2-CB 4.34Å
1247	H	74.1	Confident	71	Confident	137 Å²	137	130.1 Å²	130.1	63%	0.634	72%	0.717	S	S	*	*			trans	-66.9	132.7	176.5	-167.2	-94.3	0	0	0	109.3	S1249 L1250	H1247-S1249 VanDerWaalsContact ND1-CB 3.34Å; H1247-S1249 WeakPolarHBondContact ND1-CB 3.34Å; H1247-S1249 PolarHBondContact O-N 3.17Å; H1247-L1250 PolarHBondContact O-N 2.94Å
1248	Q	68.5	Low	71.8	Confident	174 Å²	174	128 Å²	128	81%	0.813	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-54.2	-23.4	-174.1	-74.8	151.5	-23.8	0	0	113.8	I1246 L1250	I1246-Q1248 PolarHBondContact O-N 2.7Å; Q1248-L1250 PolarHBondContact O-N 3.01Å
1249	S	69.9	Low	71.9	Confident	92 Å²	92	124.3 Å²	124.3	64%	0.643	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-63.6	-18.7	175.8	-175.5	0	0	0	0	115.5	H1247	H1247-S1249 VanDerWaalsContact ND1-CB 3.34Å; H1247-S1249 WeakPolarHBondContact ND1-CB 3.34Å; H1247-S1249 PolarHBondContact O-N 3.17Å
1250	L	63.6	Low	71.4	Confident	114 Å²	114	125.1 Å²	125.1	60%	0.597	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-113.9	-5.3	-175.4	-67.9	151.8	0	0	0	112.7	I1246 H1247 Q1248 S1253	I1246-L1250 HydrophobicContact CG1-CB 4.43Å; H1247-L1250 PolarHBondContact O-N 2.94Å; Q1248-L1250 PolarHBondContact O-N 3.01Å; L1250-S1253 PolarHBondContact O-OG 3.27Å
1251	A	56	Low	70.7	Confident	70 Å²	70	124.5 Å²	124.5	58%	0.579	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-5.9	-174.3	0	0	0	0	0	113.9	I1246	I1246-A1251 HydrophobicContact CG2-CB 4.34Å
1252	S	53.3	Low	69.5	Low	114 Å²	114	125.8 Å²	125.8	80%	0.797	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	19.1	-179.8	53.5	0	0	0	0	113.7
1253	S	44.8	Very low	68.1	Low	160 Å²	160	125.8 Å²	125.8	100%	1.119	74%	0.736	S	S	*	*			trans	-113.3	0	172.5	55.2	0	0	0	0	111.5	L1250	L1250-S1253 PolarHBondContact O-OG 3.27Å

Retrieved 1,253 of 1,253 residues in 1512.2 ms (Link to these results)

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