A0A077YZ72_TRITR Loading...

Bromodomain and PHD and DDT and WAC Acf1 DNA bd d omain containing protein

AlphaFold DB , UniProt , Accession A0A077YZ72, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,376 aa.

						>A0A077YZ72_TRITR|A0A077YZ72
MPLFMNEKLVVSPPPADLKPDEYVFYCSQTGEIYRGFESYFNRILLLKSCVWQCTATGRQGLTYQEALERELASSATLKNFPETLIRPVLFIVGLTSRSTLSAVTSDVYSFVSDHYFIGEDVEYTGARGRRYVYPPYLFIYFSKSGVVKSIEWSPEKEKYFEEFPFNEVIARQGQTTSEEWLGSLRYGIKPYDECKEGSVEERILPGREIVYVDAPLVMWLLFVGHLPLIILCNCLQESTVESYNIGGTEWKDLFNGPLPVFPANPLKSNATDDDDSSECTIIGEKTEEIEIEEEYEDNDDSEVYIIDREKERNRQLASSLIQEARELNVKLGDDLEKRIKRGSKVTDAECNMVRAMIRRAKNERKESDRLRRRQDRELLLEWRKSRDDLLCDDHKPFPIFPTVSLPDGISSERFGDCMSLLEFIHSYADMLNVTDFFPDNFSLTQLYMALFDKRPTGAFANLLCMLLERIFVLQTEEDGDEEDEERMEEAAVALENSEIVNKFYSSHVDFATKMSELTRDIHGELSCLSARYLPLDGYTLTEVLRVYFIVSGYFTGSKNARFRYLSRGGFKCFDDQAFQFVLSHHDFVDRLKTESVYEFSPSDRLDVLTVLRDQLLTFTAFRVRLDRNLERVRNLRVQMRHMCVLDSRFEKEATTARFRLSAKEKSNSNNATVEPEPSYDKRMLEATRKLQRLIAKPMQDPSCSLQATVSTVKDSARSLLNNVLFEKLEVAEIDFVRKLQRQYLQDCCQAMVEELFELMGKCGILGGRDRAFRHYWLCRSVGALLVEDYDPVIGSCFEATSLEKVSKGQDNIDGEMEMRRSLLVCSGRKDTCPVHGADNRRPRWTFINNVELFDLLMKRLNPRGMREMDLIEILDFFRSQIERMLQVANPVLSNVPTLDSNELDSSEDTVEHQLKSRFEEMSNRLQDSRMTYFVEESGAEEKTSEREPAETSANGDQMEIVKDGAWYAGALLKLADSIDPKYIENPVVGEIILHEGTDGEEITQEVYRMEKWKMSLSDARTYSSVLLHLATLENCIIWQKSLSQMRCRVCRRKGNTTTFAFCSECERPFHLTCLKPALEKVPGPSWTCKQCSKVVADLPDAQANNVKAIPGEANKNAAEDHQSAEMDHSPESYPNCSICFLEVTYRKHLIACSSCTASFHTKCASVKKSEVNVSLWKCAQCAATPAEERSKEDVKVSRSGRVLKRPKSISFGGFTSQNGSTANTEEGFHSSGNDSDGTVITRRRSNGMEQATENSVTERCNLLLSLLHSHADSWPFLTPVSKKIAPDYYKIIRSPMDLSTVAKKFDSGAYERFGEMVNDIEQIFNNCYLYNESTAEVYGCGERLQQFFCEQLTSLHLSTTDLLKPSKRRRTTLRS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	74.4	Confident	76.8	Confident	87 Å²	87	82.5 Å²	82.5	43%	0.429	42%	0.417	S	S	.	.				0	129.8	0	-161.7	179.4	85.9	0	0	106.5	K8 L9 T55 E71	M1-K8 HydrophobicContact CE-CB 3.95Å; M1-L9 HydrophobicContact CE-CB 3.99Å; M1-L9 WeakPolarHBondContact CE-O 3.24Å; M1-T55 PolarHBondContact N-OG1 2.97Å; M1-T55 WeakPolarHBondContact O-CG2 3.48Å; M1-E71 VanDerWaalsContact C-OE2 3.23Å; M1-E71 WeakPolarHBondContact CA-OE2 3.26Å; M1-E71 PolarHBondContact N-OE2 3.05Å
2	P	82.1	Confident	76.9	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	41%	0.413	C	S	.	.			trans	-55	143.9	-172.1	-31	38.4	0	0	0	113.8	W52 Y64 A67 L68 E71	P2-W52 HydrophobicContact CB-CE3 3.7Å; P2-W52 HydrophobicContact CB-CZ3 4.31Å; P2-Y64 HydrophobicContact CB-CD2 4.03Å; P2-Y64 HydrophobicContact CB-CE2 4.19Å; P2-Y64 HydrophobicContact CG-CD2 4.12Å; P2-Y64 HydrophobicContact CG-CE2 4.09Å; P2-A67 HydrophobicContact CB-CB 3.59Å; P2-A67 HydrophobicContact CG-CB 3.6Å; P2-L68 HydrophobicContact CG-CB 4.05Å; P2-L68 HydrophobicContact CG-CD1 4.41Å; P2-E71 VanDerWaalsContact CA-OE1 3.23Å; P2-E71 WeakPolarHBondContact CA-OE1 3.24Å; P2-E71 WeakPolarHBondContact CD-OE2 3.48Å
3	L	81.5	Confident	77.1	Confident	28 Å²	28	82.2 Å²	82.2	15%	0.147	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	138.3	175	-59.7	172.4	0	0	0	110.6	E7 K8 W52 Q53 T55	L3-E7 CarbonylContact C-O 3.53Å; L3-E7 VanDerWaalsContact CA-O 3.32Å; L3-E7 WeakPolarHBondContact CA-O 3.35Å; L3-K8 HydrophobicContact CD2-CG 3.88Å; L3-W52 CarbonylContact O-C 3.56Å; L3-W52 WeakPolarHBondContact O-CA 3.23Å; L3-Q53 HydrophobicContact CB-CB 4.34Å; L3-Q53 PolarHBondContact N-O 3.01Å; L3-Q53 PolarHBondContact O-N 2.92Å; L3-T55 HydrophobicContact CD1-CG2 3.84Å; L3-T55 HydrophobicContact CD2-CG2 3.94Å; L3-T55 HydrophobicContact CG-CG2 3.47Å; L3-T55 VanDerWaalsContact CG-CG2 3.47Å
4	F	79.4	Confident	77.4	Confident	61 Å²	61	81.9 Å²	81.9	27%	0.268	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	118.9	166.6	173.2	-112.4	0	0	0	107.6	N6 E7 L46 V51 W52	F4-N6 VanDerWaalsContact C-N 3.27Å; F4-N6 PolarHBondContact O-N 2.63Å; F4-E7 PolarHBondContact N-O 2.83Å; F4-E7 PolarHBondContact O-N 3.24Å; F4-L46 HydrophobicContact CD2-CD1 4.14Å; F4-L46 HydrophobicContact CE1-CD1 4.33Å; F4-L46 HydrophobicContact CE2-CD1 3.68Å; F4-L46 HydrophobicContact CZ-CD1 3.77Å; F4-V51 HydrophobicContact CD2-CB 4.27Å; F4-V51 HydrophobicContact CD2-CG2 3.62Å; F4-V51 HydrophobicContact CE2-CB 4.03Å; F4-V51 HydrophobicContact CE2-CG2 3.46Å; F4-V51 VanDerWaalsContact CE2-CG2 3.46Å; F4-W52 HydrophobicContact CB-CD2 4.3Å; F4-W52 HydrophobicContact CB-CE3 3.84Å; F4-W52 HydrophobicContact CB-CH2 3.88Å; F4-W52 HydrophobicContact CB-CZ2 4.34Å; F4-W52 HydrophobicContact CB-CZ3 3.61Å
5	M	68.5	Low	77.6	Confident	146 Å²	146	79 Å²	79	72%	0.719	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	44.9	-174.1	-59	-166	-179.7	0	0	113.6	E7	M5-E7 PolarHBondContact O-N 2.97Å; M5-E7 VanDerWaalsContact O-N 3.14Å
6	N	64.2	Low	77.6	Confident	109 Å²	109	81.3 Å²	81.3	58%	0.583	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	5.6	-174.3	-69	-18.4	0	0	0	116.5	F4 Q53	F4-N6 VanDerWaalsContact C-N 3.27Å; F4-N6 PolarHBondContact O-N 2.63Å; N6-Q53 PolarHBondContact OD1-OE1 3.42Å
7	E	72.1	Confident	78.2	Confident	142 Å²	142	82.8 Å²	82.8	66%	0.664	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	147.3	174.4	-63.3	-169.2	163.8	0	0	111.5	L3 F4 M5	L3-E7 CarbonylContact C-O 3.53Å; L3-E7 VanDerWaalsContact CA-O 3.32Å; L3-E7 WeakPolarHBondContact CA-O 3.35Å; F4-E7 PolarHBondContact N-O 2.83Å; F4-E7 PolarHBondContact O-N 3.24Å; M5-E7 PolarHBondContact O-N 2.97Å; M5-E7 VanDerWaalsContact O-N 3.14Å
8	K	76.4	Confident	78.3	Confident	139 Å²	139	81.2 Å²	81.2	60%	0.604	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	141.1	173.1	-71.4	-179.5	-177.5	176	0	109.3	M1 L3 V10	M1-K8 HydrophobicContact CE-CB 3.95Å; L3-K8 HydrophobicContact CD2-CG 3.88Å; K8-V10 PolarHBondContact O-N 2.85Å; K8-V10 VanDerWaalsContact O-N 3.11Å
9	L	81.3	Confident	78.5	Confident	15 Å²	15	84.1 Å²	84.1	8%	0.079	46%	0.464	C	S	.	.			trans	-54.7	120	173.3	175.1	63.3	0	0	0	110.8	M1 V11 T30 L47 W52 Y64	M1-L9 HydrophobicContact CE-CB 3.99Å; M1-L9 WeakPolarHBondContact CE-O 3.24Å; L9-V11 HydrophobicContact CD2-CG2 4.45Å; L9-V11 HydrophobicContact CG-CG2 4.45Å; L9-V11 PolarHBondContact O-N 3.07Å; L9-T30 HydrophobicContact CD2-CG2 3.41Å; L9-T30 VanDerWaalsContact CD2-CG2 3.41Å; L9-L47 HydrophobicContact CD2-CD2 4.17Å; L9-W52 HydrophobicContact CB-CH2 3.75Å; L9-W52 HydrophobicContact CB-CZ3 3.87Å; L9-W52 HydrophobicContact CD1-CH2 3.77Å; L9-W52 HydrophobicContact CD2-CH2 4.06Å; L9-W52 HydrophobicContact CG-CH2 4.03Å; L9-Y64 HydrophobicContact CB-CE2 4.4Å; L9-Y64 HydrophobicContact CD2-CD2 4.34Å; L9-Y64 HydrophobicContact CD2-CE2 3.68Å
10	V	81.7	Confident	78.6	Confident	115 Å²	115	87 Å²	87	70%	0.697	49%	0.487	S	S	*	.			trans	-82.3	110.9	170	-176.9	0	0	0	0	108.4	K8 R43	K8-V10 PolarHBondContact O-N 2.85Å; K8-V10 VanDerWaalsContact O-N 3.11Å; V10-R43 PolarHBondContact O-NH2 3.19Å
11	V	82.8	Confident	78.9	Confident	66 Å²	66	88.9 Å²	88.9	40%	0.4	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-80.9	123.7	175.5	180	0	0	0	0	108.5	L9 E32	L9-V11 HydrophobicContact CD2-CG2 4.45Å; L9-V11 HydrophobicContact CG-CG2 4.45Å; L9-V11 PolarHBondContact O-N 3.07Å; V11-E32 HydrophobicContact CB-CG 4.45Å; V11-E32 HydrophobicContact CG1-CG 3.49Å; V11-E32 VanDerWaalsContact CG1-CG 3.49Å
12	S	78.1	Confident	79.4	Confident	53 Å²	53	87.5 Å²	87.5	37%	0.371	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-71.5	132.1	178.4	-40.1	0	0	0	0	109.3	E32	S12-E32 VanDerWaalsContact CB-OE1 3.23Å; S12-E32 WeakPolarHBondContact CB-OE1 3.45Å; S12-E32 PolarHBondContact N-OE1 2.89Å; S12-E32 PolarHBondContact OG-OE1 3.09Å
13	P	80.1	Confident	79.6	Confident	108 Å²	108	98.1 Å²	98.1	70%	0.701	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-62.5	151.6	173	26.4	-32.7	0	0	0	110.4
14	P	80.5	Confident	80.1	Confident	78 Å²	78	99.2 Å²	99.2	51%	0.506	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-54.2	143.3	172	-22	31.7	0	0	0	110.8	A16 I33	P14-A16 PolarHBondContact O-N 3.49Å; P14-I33 HydrophobicContact CB-CD1 4.33Å; P14-I33 HydrophobicContact CG-CD1 4.48Å
15	P	80.8	Confident	80.5	Confident	38 Å²	38	100 Å²	100	25%	0.247	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-49.6	125.4	171.7	-26	32.3	0	0	0	110.9	D17 L18	P15-D17 PolarHBondContact O-N 3.02Å; P15-L18 HydrophobicContact CB-CD1 3.9Å; P15-L18 HydrophobicContact CG-CD1 3.83Å; P15-L18 WeakPolarHBondContact O-CB 3.32Å; P15-L18 PolarHBondContact O-N 2.92Å; P15-L18 VanDerWaalsContact O-N 3.15Å
16	A	78.4	Confident	81.5	Confident	116 Å²	116	99.3 Å²	99.3	96%	0.959	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-17.5	-172.8	0	0	0	0	0	113.9	P14	P14-A16 PolarHBondContact O-N 3.49Å
17	D	86.8	Confident	82.6	Confident	107 Å²	107	94.2 Å²	94.2	57%	0.572	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	20.1	-177.8	66.6	-28.9	0	0	0	113.1	P15 K19 R35	P15-D17 PolarHBondContact O-N 3.02Å; D17-K19 PolarHBondContact O-N 2.91Å; D17-R35 PolarHBondContact O-NH2 3.45Å; D17-R35 IonicContact OD1-CZ 3.49Å; D17-R35 IonicContact OD1-NH2 3.2Å; D17-R35 PolarHBondContact OD1-NH2 3.47Å; D17-R35 IonicContact OD2-CZ 2.67Å; D17-R35 IonicContact OD2-NH2 3.26Å; D17-R35 PolarHBondContact OD2-NH2 3Å
18	L	81.1	Confident	83.1	Confident	53 Å²	53	91.9 Å²	91.9	28%	0.277	50%	0.504	S	S	.	.			trans	-65.5	123.5	177.7	-144.4	81.9	0	0	0	110.9	P15 V24 I33 R35	P15-L18 HydrophobicContact CB-CD1 3.9Å; P15-L18 HydrophobicContact CG-CD1 3.83Å; P15-L18 WeakPolarHBondContact O-CB 3.32Å; P15-L18 PolarHBondContact O-N 2.92Å; P15-L18 VanDerWaalsContact O-N 3.15Å; L18-V24 HydrophobicContact CD1-CG1 3.79Å; L18-V24 HydrophobicContact CD2-CG1 4.2Å; L18-V24 HydrophobicContact CG-CG1 4.24Å; L18-I33 HydrophobicContact CD1-CG2 4.26Å; L18-I33 HydrophobicContact CD2-CD1 4.21Å; L18-I33 HydrophobicContact CD2-CG2 4Å; L18-R35 HydrophobicContact CD1-CG 4.48Å
19	K	82.1	Confident	83.3	Confident	136 Å²	136	88 Å²	88	59%	0.591	49%	0.488	S	S	*	.			trans	-82.8	148.1	175.1	-57.4	179.2	-178.7	174	0	110.9	D17 D21 E22	D17-K19 PolarHBondContact O-N 2.91Å; K19-D21 VanDerWaalsContact CB-OD1 3.31Å; K19-D21 WeakPolarHBondContact CB-OD1 3.11Å; K19-D21 PolarHBondContact O-N 3.25Å; K19-D21 VanDerWaalsContact O-N 3.09Å; K19-E22 HydrophobicContact CB-CB 4.13Å; K19-E22 PolarHBondContact N-OE2 3.18Å; K19-E22 WeakPolarHBondContact O-CB 3.44Å; K19-E22 PolarHBondContact O-N 2.89Å; K19-E22 VanDerWaalsContact O-N 3.07Å
20	P	80.5	Confident	83.5	Confident	142 Å²	142	88.1 Å²	88.1	92%	0.922	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.7	179.6	-23.3	33	0	0	0	114.6
21	D	83.9	Confident	83.6	Confident	128 Å²	128	84.4 Å²	84.4	68%	0.684	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	5	-177.9	58.6	-39.5	0	0	0	113.6	K19	K19-D21 VanDerWaalsContact CB-OD1 3.31Å; K19-D21 WeakPolarHBondContact CB-OD1 3.11Å; K19-D21 PolarHBondContact O-N 3.25Å; K19-D21 VanDerWaalsContact O-N 3.09Å
22	E	85.7	Confident	83.9	Confident	57 Å²	57	81.4 Å²	81.4	27%	0.266	46%	0.456	S	S	.	.			trans	-79.4	127.9	-178.8	-170.8	168.5	177.9	0	0	112	K19 V24 R35	K19-E22 HydrophobicContact CB-CB 4.13Å; K19-E22 PolarHBondContact N-OE2 3.18Å; K19-E22 WeakPolarHBondContact O-CB 3.44Å; K19-E22 PolarHBondContact O-N 2.89Å; K19-E22 VanDerWaalsContact O-N 3.07Å; E22-V24 HydrophobicContact CG-CG1 4.39Å; E22-R35 VanDerWaalsContact CD-NH1 3.28Å; E22-R35 WeakPolarHBondContact OE1-CD 3.15Å; E22-R35 IonicContact OE1-CZ 3.8Å; E22-R35 IonicContact OE1-NE 2.61Å; E22-R35 PolarHBondContact OE1-NE 3.28Å; E22-R35 IonicContact OE1-NH1 3.51Å; E22-R35 PolarHBondContact OE1-NH1 2.97Å; E22-R35 IonicContact OE2-CZ 2.97Å; E22-R35 IonicContact OE2-NH1 3.64Å; E22-R35 PolarHBondContact OE2-NH1 3.25Å; E22-R35 VanDerWaalsContact OE2-NH1 3.12Å; E22-R35 IonicContact OE2-NH2 3.36Å; E22-R35 PolarHBondContact OE2-NH2 3.39Å
23	Y	86.4	Confident	84.4	Confident	224 Å²	224	80.9 Å²	80.9	88%	0.878	45%	0.449	S	S	*	.			trans	-72.6	128.6	172.9	-72.5	-85.4	0	0	0	110.5
24	V	90.3	Very high	84.8	Confident	50 Å²	50	77 Å²	77	30%	0.303	42%	0.42	S	S	.	.			trans	-136.8	158.2	-175.4	-64.6	0	0	0	0	110.9	L18 E22 I33	L18-V24 HydrophobicContact CD1-CG1 3.79Å; L18-V24 HydrophobicContact CD2-CG1 4.2Å; L18-V24 HydrophobicContact CG-CG1 4.24Å; E22-V24 HydrophobicContact CG-CG1 4.39Å; V24-I33 HydrophobicContact CB-CG2 3.52Å; V24-I33 HydrophobicContact CG1-CG2 3.75Å; V24-I33 HydrophobicContact CG2-CG2 3.57Å
25	F	89.3	Confident	85.1	Confident	77 Å²	77	78 Å²	78	34%	0.338	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	116.6	169.3	-60.5	-86.5	0	0	0	109.5	Y34 F37 Y40	F25-Y34 PolarHBondContact N-O 3.49Å; F25-Y34 PolarHBondContact O-N 3.19Å; F25-F37 HydrophobicContact CD1-CD2 4.06Å; F25-F37 HydrophobicContact CE1-CB 4.19Å; F25-F37 AromaticContact CE1-CD2 3.56Å; F25-F37 HydrophobicContact CE1-CD2 3.56Å; F25-F37 HydrophobicContact CE1-CE2 4.47Å; F25-F37 HydrophobicContact CE1-CG 4.34Å; F25-F37 HydrophobicContact CE2-CB 3.84Å; F25-F37 HydrophobicContact CZ-CB 3.65Å; F25-F37 AromaticContact CZ-CD2 3.92Å; F25-F37 HydrophobicContact CZ-CD2 3.92Å; F25-F37 HydrophobicContact CZ-CG 4.25Å; F25-Y40 HydrophobicContact CB-CD1 3.95Å; F25-Y40 HydrophobicContact CB-CD2 3.7Å; F25-Y40 HydrophobicContact CB-CE2 4.38Å; F25-Y40 HydrophobicContact CB-CG 3.44Å; F25-Y40 VanDerWaalsContact CB-CG 3.44Å; F25-Y40 AromaticContact CD1-CD1 3.9Å; F25-Y40 HydrophobicContact CD1-CD1 3.9Å; F25-Y40 HydrophobicContact CD1-CE1 4.31Å; F25-Y40 HydrophobicContact CD1-CG 4.28Å; F25-Y40 HydrophobicContact CG-CD1 4.15Å; F25-Y40 HydrophobicContact CG-CG 4.07Å
26	Y	89.5	Confident	85.1	Confident	133 Å²	133	77.8 Å²	77.8	52%	0.522	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	124.3	-177.8	172.2	-110.9	0	0	0	111	S28 I33 Y40	Y26-S28 PolarHBondContact O-N 3.02Å; Y26-I33 HydrophobicContact CD2-CG1 4.17Å; Y26-Y40 WeakPolarHBondContact O-CE2 3.33Å
27	C	86.9	Confident	85.5	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.007	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	99.9	173.7	-173.1	0	0	0	0	110.1	Q29 T30 G31 E32 Y34 Y40 L47	C27-Q29 PolarHBondContact O-N 2.99Å; C27-Q29 VanDerWaalsContact O-N 3.13Å; C27-T30 PolarHBondContact O-N 3.15Å; C27-T30 PolarHBondContact SG-OG1 2.74Å; C27-G31 WeakPolarHBondContact O-CA 3.28Å; C27-G31 PolarHBondContact O-N 2.9Å; C27-E32 HydrophobicContact CB-CB 4.41Å; C27-E32 PolarHBondContact N-O 3.47Å; C27-Y34 HydrophobicContact CB-CE2 4.2Å; C27-Y40 HydrophobicContact CB-CE2 4.41Å; C27-L47 WeakPolarHBondContact SG-CD1 3.21Å
28	S	83.4	Confident	85.3	Confident	94 Å²	94	79.9 Å²	79.9	66%	0.657	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-22.6	-176.8	60.8	0	0	0	0	114.7	Y26	Y26-S28 PolarHBondContact O-N 3.02Å
29	Q	79.3	Confident	85.4	Confident	57 Å²	57	80.6 Å²	80.6	27%	0.266	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-31.8	-178.5	-67.7	-178.5	-47	0	0	113.1	C27 L47 Y64	C27-Q29 PolarHBondContact O-N 2.99Å; C27-Q29 VanDerWaalsContact O-N 3.13Å; Q29-L47 HydrophobicContact CB-CD1 4.18Å; Q29-Y64 HydrophobicContact CB-CD1 4.36Å; Q29-Y64 HydrophobicContact CB-CE1 4.38Å
30	T	84.9	Confident	85.7	Confident	17 Å²	17	77 Å²	77	10%	0.104	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-13.4	-176.4	63.5	0	0	0	0	113.3	L9 C27 E32 L47 Y64	L9-T30 HydrophobicContact CD2-CG2 3.41Å; L9-T30 VanDerWaalsContact CD2-CG2 3.41Å; C27-T30 PolarHBondContact O-N 3.15Å; C27-T30 PolarHBondContact SG-OG1 2.74Å; T30-E32 VanDerWaalsContact C-N 3.29Å; T30-E32 WeakPolarHBondContact CB-OE2 3.21Å; T30-E32 WeakPolarHBondContact OG1-CG 3.43Å; T30-E32 PolarHBondContact OG1-OE2 2.85Å; T30-L47 HydrophobicContact CG2-CD1 3.53Å; T30-L47 HydrophobicContact CG2-CD2 3.56Å; T30-L47 HydrophobicContact CG2-CG 4.16Å; T30-Y64 HydrophobicContact CG2-CE1 4.49Å
31	G	85.6	Confident	86	Confident	38 Å²	38	74.9 Å²	74.9	39%	0.392	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	6.4	-174.8	0	0	0	0	0	114.2	C27	C27-G31 WeakPolarHBondContact O-CA 3.28Å; C27-G31 PolarHBondContact O-N 2.9Å
32	E	89.1	Confident	86.1	Confident	2 Å²	2	73 Å²	73	1%	0.009	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	150.8	-175.8	-66.5	174.8	98.7	0	0	113.3	V11 S12 C27 T30 Y34 R43	V11-E32 HydrophobicContact CB-CG 4.45Å; V11-E32 HydrophobicContact CG1-CG 3.49Å; V11-E32 VanDerWaalsContact CG1-CG 3.49Å; S12-E32 VanDerWaalsContact CB-OE1 3.23Å; S12-E32 WeakPolarHBondContact CB-OE1 3.45Å; S12-E32 PolarHBondContact N-OE1 2.89Å; S12-E32 PolarHBondContact OG-OE1 3.09Å; C27-E32 HydrophobicContact CB-CB 4.41Å; C27-E32 PolarHBondContact N-O 3.47Å; T30-E32 VanDerWaalsContact C-N 3.29Å; T30-E32 WeakPolarHBondContact CB-OE2 3.21Å; T30-E32 WeakPolarHBondContact OG1-CG 3.43Å; T30-E32 PolarHBondContact OG1-OE2 2.85Å; E32-Y34 HydrophobicContact CB-CD2 4.47Å; E32-Y34 HydrophobicContact CB-CE2 3.63Å; E32-Y34 PolarHBondContact OE1-OH 3.44Å; E32-Y34 PolarHBondContact OE2-OH 3.14Å; E32-Y34 VanDerWaalsContact OE2-OH 3.12Å; E32-R43 VanDerWaalsContact CD-NH2 3.29Å; E32-R43 IonicContact OE1-CZ 3.86Å; E32-R43 IonicContact OE1-NE 3.06Å; E32-R43 PolarHBondContact OE1-NE 2.93Å; E32-R43 IonicContact OE1-NH2 3.63Å; E32-R43 PolarHBondContact OE1-NH2 2.89Å; E32-R43 IonicContact OE2-CZ 3.15Å; E32-R43 VanDerWaalsContact OE2-CZ 3.27Å; E32-R43 IonicContact OE2-NE 3.31Å; E32-R43 PolarHBondContact OE2-NE 3.18Å; E32-R43 IonicContact OE2-NH2 3.47Å; E32-R43 PolarHBondContact OE2-NH2 3.4Å
33	I	87.8	Confident	86.3	Confident	42 Å²	42	72.1 Å²	72.1	22%	0.215	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.2	180	-60.2	176.8	0	0	0	109	P14 L18 V24 Y26	P14-I33 HydrophobicContact CB-CD1 4.33Å; P14-I33 HydrophobicContact CG-CD1 4.48Å; L18-I33 HydrophobicContact CD1-CG2 4.26Å; L18-I33 HydrophobicContact CD2-CD1 4.21Å; L18-I33 HydrophobicContact CD2-CG2 4Å; V24-I33 HydrophobicContact CB-CG2 3.52Å; V24-I33 HydrophobicContact CG1-CG2 3.75Å; V24-I33 HydrophobicContact CG2-CG2 3.57Å; Y26-I33 HydrophobicContact CD2-CG1 4.17Å
34	Y	89	Confident	86.4	Confident	28 Å²	28	62.9 Å²	62.9	11%	0.11	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	136.3	179.4	-58.8	-84.4	0	0	0	110.9	F25 C27 E32 S39 Y40 R43	F25-Y34 PolarHBondContact N-O 3.49Å; F25-Y34 PolarHBondContact O-N 3.19Å; C27-Y34 HydrophobicContact CB-CE2 4.2Å; E32-Y34 HydrophobicContact CB-CD2 4.47Å; E32-Y34 HydrophobicContact CB-CE2 3.63Å; E32-Y34 PolarHBondContact OE1-OH 3.44Å; E32-Y34 PolarHBondContact OE2-OH 3.14Å; E32-Y34 VanDerWaalsContact OE2-OH 3.12Å; Y34-S39 VanDerWaalsContact CD1-CB 3.49Å; Y34-Y40 HydrophobicContact CD2-CD2 4.07Å; Y34-Y40 HydrophobicContact CD2-CG 4.5Å; Y34-R43 HydrophobicContact CE2-CB 3.95Å; Y34-R43 HydrophobicContact CE2-CG 4.14Å; Y34-R43 WeakPolarHBondContact OH-CB 3.44Å; Y34-R43 WeakPolarHBondContact OH-CG 3.47Å; Y34-R43 PolarHBondContact OH-NE 2.94Å
35	R	86.2	Confident	86.1	Confident	99 Å²	99	65.3 Å²	65.3	37%	0.374	33%	0.333	S	S	.	.	S	Bend	trans	-78.7	-35.9	170.8	-66.1	-175.1	-170.7	-136.1	3.3	112.4	D17 L18 E22	D17-R35 PolarHBondContact O-NH2 3.45Å; D17-R35 IonicContact OD1-CZ 3.49Å; D17-R35 IonicContact OD1-NH2 3.2Å; D17-R35 PolarHBondContact OD1-NH2 3.47Å; D17-R35 IonicContact OD2-CZ 2.67Å; D17-R35 IonicContact OD2-NH2 3.26Å; D17-R35 PolarHBondContact OD2-NH2 3Å; L18-R35 HydrophobicContact CD1-CG 4.48Å; E22-R35 VanDerWaalsContact CD-NH1 3.28Å; E22-R35 WeakPolarHBondContact OE1-CD 3.15Å; E22-R35 IonicContact OE1-CZ 3.8Å; E22-R35 IonicContact OE1-NE 2.61Å; E22-R35 PolarHBondContact OE1-NE 3.28Å; E22-R35 IonicContact OE1-NH1 3.51Å; E22-R35 PolarHBondContact OE1-NH1 2.97Å; E22-R35 IonicContact OE2-CZ 2.97Å; E22-R35 IonicContact OE2-NH1 3.64Å; E22-R35 PolarHBondContact OE2-NH1 3.25Å; E22-R35 VanDerWaalsContact OE2-NH1 3.12Å; E22-R35 IonicContact OE2-NH2 3.36Å; E22-R35 PolarHBondContact OE2-NH2 3.39Å
36	G	80.6	Confident	86	Confident	33 Å²	33	63.6 Å²	63.6	34%	0.34	33%	0.327	S	S	.	.	S	Bend	trans	-94.3	133.8	-178.6	0	0	0	0	0	112.4	E38 S39 Y40	G36-E38 PolarHBondContact O-N 3.43Å; G36-S39 PolarHBondContact O-N 3.19Å; G36-Y40 PolarHBondContact O-N 3.21Å
37	F	86.1	Confident	85.9	Confident	122 Å²	122	57.3 Å²	57.3	54%	0.535	30%	0.302	S	S	.	.	H	α-helix	trans	-57.8	-37.1	174.5	178.1	-107.1	0	0	0	111.7	F25 Y40 F41	F25-F37 HydrophobicContact CD1-CD2 4.06Å; F25-F37 HydrophobicContact CE1-CB 4.19Å; F25-F37 AromaticContact CE1-CD2 3.56Å; F25-F37 HydrophobicContact CE1-CD2 3.56Å; F25-F37 HydrophobicContact CE1-CE2 4.47Å; F25-F37 HydrophobicContact CE1-CG 4.34Å; F25-F37 HydrophobicContact CE2-CB 3.84Å; F25-F37 HydrophobicContact CZ-CB 3.65Å; F25-F37 AromaticContact CZ-CD2 3.92Å; F25-F37 HydrophobicContact CZ-CD2 3.92Å; F25-F37 HydrophobicContact CZ-CG 4.25Å; F37-Y40 HydrophobicContact CD2-CD1 4.23Å; F37-Y40 HydrophobicContact CE2-CD1 4.35Å; F37-Y40 PolarHBondContact O-N 2.89Å; F37-F41 HydrophobicContact CD1-CB 4.5Å; F37-F41 HydrophobicContact CE1-CB 4.22Å; F37-F41 HydrophobicContact CE1-CD2 4.24Å; F37-F41 HydrophobicContact CE1-CG 4.35Å; F37-F41 HydrophobicContact CZ-CB 4.35Å; F37-F41 AromaticContact CZ-CD2 3.95Å; F37-F41 HydrophobicContact CZ-CD2 3.95Å; F37-F41 HydrophobicContact CZ-CG 4.43Å; F37-F41 WeakPolarHBondContact O-CB 3.47Å; F37-F41 PolarHBondContact O-N 3.05Å
38	E	82.5	Confident	85.9	Confident	144 Å²	144	64.1 Å²	64.1	67%	0.673	33%	0.332	S	S	*	.	H	α-helix	trans	-64.3	-44.1	-178.2	-166.8	175.3	179.9	0	0	112.4	G36 F41 N42	G36-E38 PolarHBondContact O-N 3.43Å; E38-F41 PolarHBondContact O-N 3.23Å; E38-N42 WeakPolarHBondContact O-CB 3.37Å; E38-N42 VanDerWaalsContact O-CG 3.24Å; E38-N42 PolarHBondContact O-N 3.36Å; E38-N42 PolarHBondContact O-ND2 3.4Å
39	S	83.3	Confident	85.9	Confident	68 Å²	68	61.3 Å²	61.3	48%	0.476	31%	0.312	S	S	.	.	H	α-helix	trans	-65.8	-42.2	176.3	-48.8	0	0	0	0	112	Y34 G36 R43	Y34-S39 VanDerWaalsContact CD1-CB 3.49Å; G36-S39 PolarHBondContact O-N 3.19Å; S39-R43 PolarHBondContact O-N 3.33Å
40	Y	89.4	Confident	86.3	Confident	61 Å²	61	60.9 Å²	60.9	24%	0.239	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-46.8	172.9	167.6	-106.4	0	0	0	111.7	F25 Y26 C27 Y34 G36 F37 R43 I44	F25-Y40 HydrophobicContact CB-CD1 3.95Å; F25-Y40 HydrophobicContact CB-CD2 3.7Å; F25-Y40 HydrophobicContact CB-CE2 4.38Å; F25-Y40 HydrophobicContact CB-CG 3.44Å; F25-Y40 VanDerWaalsContact CB-CG 3.44Å; F25-Y40 AromaticContact CD1-CD1 3.9Å; F25-Y40 HydrophobicContact CD1-CD1 3.9Å; F25-Y40 HydrophobicContact CD1-CE1 4.31Å; F25-Y40 HydrophobicContact CD1-CG 4.28Å; F25-Y40 HydrophobicContact CG-CD1 4.15Å; F25-Y40 HydrophobicContact CG-CG 4.07Å; Y26-Y40 WeakPolarHBondContact O-CE2 3.33Å; C27-Y40 HydrophobicContact CB-CE2 4.41Å; Y34-Y40 HydrophobicContact CD2-CD2 4.07Å; Y34-Y40 HydrophobicContact CD2-CG 4.5Å; G36-Y40 PolarHBondContact O-N 3.21Å; F37-Y40 HydrophobicContact CD2-CD1 4.23Å; F37-Y40 HydrophobicContact CE2-CD1 4.35Å; F37-Y40 PolarHBondContact O-N 2.89Å; Y40-R43 PolarHBondContact O-N 3.06Å; Y40-I44 HydrophobicContact CD1-CG1 4.46Å; Y40-I44 HydrophobicContact CD2-CG1 4.07Å; Y40-I44 HydrophobicContact CE1-CG1 4.07Å; Y40-I44 HydrophobicContact CE2-CD1 3.88Å; Y40-I44 HydrophobicContact CE2-CG1 3.65Å; Y40-I44 HydrophobicContact CG-CG1 4.46Å; Y40-I44 WeakPolarHBondContact O-CG1 3.46Å; Y40-I44 PolarHBondContact O-N 3.42Å
41	F	87.2	Confident	86.3	Confident	97 Å²	97	63.4 Å²	63.4	43%	0.425	33%	0.33	S	S	.	.	H	α-helix	trans	-62.6	-45.2	-179.4	-176.1	-98.9	0	0	0	111	F37 E38 R43 I44 L45	F37-F41 HydrophobicContact CD1-CB 4.5Å; F37-F41 HydrophobicContact CE1-CB 4.22Å; F37-F41 HydrophobicContact CE1-CD2 4.24Å; F37-F41 HydrophobicContact CE1-CG 4.35Å; F37-F41 HydrophobicContact CZ-CB 4.35Å; F37-F41 AromaticContact CZ-CD2 3.95Å; F37-F41 HydrophobicContact CZ-CD2 3.95Å; F37-F41 HydrophobicContact CZ-CG 4.43Å; F37-F41 WeakPolarHBondContact O-CB 3.47Å; F37-F41 PolarHBondContact O-N 3.05Å; E38-F41 PolarHBondContact O-N 3.23Å; F41-R43 VanDerWaalsContact C-N 3.32Å; F41-R43 PolarHBondContact O-N 3.33Å; F41-I44 PolarHBondContact O-N 3.5Å; F41-L45 HydrophobicContact CE1-CD1 3.99Å; F41-L45 HydrophobicContact CZ-CD1 4Å; F41-L45 WeakPolarHBondContact O-CB 3.47Å; F41-L45 PolarHBondContact O-N 2.85Å
42	N	84.9	Confident	86.4	Confident	90 Å²	90	61.7 Å²	61.7	48%	0.481	31%	0.312	S	S	.	.	H	α-helix	trans	-60.8	-39.8	175.2	-73.8	-22.4	0	0	0	112	E38 L45 L46	E38-N42 WeakPolarHBondContact O-CB 3.37Å; E38-N42 VanDerWaalsContact O-CG 3.24Å; E38-N42 PolarHBondContact O-N 3.36Å; E38-N42 PolarHBondContact O-ND2 3.4Å; N42-L45 PolarHBondContact O-N 3.46Å; N42-L46 PolarHBondContact O-N 3.46Å
43	R	90.3	Very high	86.1	Confident	38 Å²	38	63.2 Å²	63.2	14%	0.143	32%	0.319	C	S	.	.	H	α-helix	trans	-66.1	-45.6	174.6	-176.9	65.8	93.2	-171	12.3	111.9	V10 E32 Y34 S39 Y40 F41 L45 L46 L47	V10-R43 PolarHBondContact O-NH2 3.19Å; E32-R43 VanDerWaalsContact CD-NH2 3.29Å; E32-R43 IonicContact OE1-CZ 3.86Å; E32-R43 IonicContact OE1-NE 3.06Å; E32-R43 PolarHBondContact OE1-NE 2.93Å; E32-R43 IonicContact OE1-NH2 3.63Å; E32-R43 PolarHBondContact OE1-NH2 2.89Å; E32-R43 IonicContact OE2-CZ 3.15Å; E32-R43 VanDerWaalsContact OE2-CZ 3.27Å; E32-R43 IonicContact OE2-NE 3.31Å; E32-R43 PolarHBondContact OE2-NE 3.18Å; E32-R43 IonicContact OE2-NH2 3.47Å; E32-R43 PolarHBondContact OE2-NH2 3.4Å; Y34-R43 HydrophobicContact CE2-CB 3.95Å; Y34-R43 HydrophobicContact CE2-CG 4.14Å; Y34-R43 WeakPolarHBondContact OH-CB 3.44Å; Y34-R43 WeakPolarHBondContact OH-CG 3.47Å; Y34-R43 PolarHBondContact OH-NE 2.94Å; S39-R43 PolarHBondContact O-N 3.33Å; Y40-R43 PolarHBondContact O-N 3.06Å; F41-R43 VanDerWaalsContact C-N 3.32Å; F41-R43 PolarHBondContact O-N 3.33Å; R43-L45 VanDerWaalsContact C-N 3.27Å; R43-L45 PolarHBondContact O-N 3.43Å; R43-L46 PolarHBondContact O-N 3.35Å; R43-L47 HydrophobicContact CG-CD1 3.96Å; R43-L47 HydrophobicContact CG-CG 4.38Å; R43-L47 VanDerWaalsContact O-CG 3.29Å; R43-L47 WeakPolarHBondContact O-CG 3.22Å; R43-L47 PolarHBondContact O-N 3.14Å
44	I	88.3	Confident	85.7	Confident	30 Å²	30	61.2 Å²	61.2	15%	0.154	31%	0.309	C	S	.	.	H	α-helix	trans	-61.1	-38.8	176.2	-67.2	-66.4	0	0	0	111	Y40 F41 L47 K48	Y40-I44 HydrophobicContact CD1-CG1 4.46Å; Y40-I44 HydrophobicContact CD2-CG1 4.07Å; Y40-I44 HydrophobicContact CE1-CG1 4.07Å; Y40-I44 HydrophobicContact CE2-CD1 3.88Å; Y40-I44 HydrophobicContact CE2-CG1 3.65Å; Y40-I44 HydrophobicContact CG-CG1 4.46Å; Y40-I44 WeakPolarHBondContact O-CG1 3.46Å; Y40-I44 PolarHBondContact O-N 3.42Å; F41-I44 PolarHBondContact O-N 3.5Å; I44-L47 PolarHBondContact O-N 3.19Å; I44-K48 HydrophobicContact CG2-CD 4.03Å; I44-K48 HydrophobicContact CG2-CG 4.43Å; I44-K48 WeakPolarHBondContact O-CB 3.29Å; I44-K48 WeakPolarHBondContact O-CG 3.35Å; I44-K48 PolarHBondContact O-N 2.94Å
45	L	84.1	Confident	84.9	Confident	101 Å²	101	62.3 Å²	62.3	53%	0.529	32%	0.318	S	S	.	.	H	α-helix	trans	-62.9	-44.4	176.5	-151.3	89.4	0	0	0	111.3	F41 N42 R43 K48 S49	F41-L45 HydrophobicContact CE1-CD1 3.99Å; F41-L45 HydrophobicContact CZ-CD1 4Å; F41-L45 WeakPolarHBondContact O-CB 3.47Å; F41-L45 PolarHBondContact O-N 2.85Å; N42-L45 PolarHBondContact O-N 3.46Å; R43-L45 VanDerWaalsContact C-N 3.27Å; R43-L45 PolarHBondContact O-N 3.43Å; L45-K48 CarbonylContact O-C 3.22Å; L45-K48 PolarHBondContact O-N 2.94Å; L45-S49 WeakPolarHBondContact O-CB 3.45Å; L45-S49 PolarHBondContact O-N 2.93Å
46	L	87	Confident	83.7	Confident	40 Å²	40	58.5 Å²	58.5	21%	0.209	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-48.3	175.3	177.9	67.2	0	0	0	111.6	F4 N42 R43 K48 S49 V51 W52	F4-L46 HydrophobicContact CD2-CD1 4.14Å; F4-L46 HydrophobicContact CE1-CD1 4.33Å; F4-L46 HydrophobicContact CE2-CD1 3.68Å; F4-L46 HydrophobicContact CZ-CD1 3.77Å; N42-L46 PolarHBondContact O-N 3.46Å; R43-L46 PolarHBondContact O-N 3.35Å; L46-K48 VanDerWaalsContact C-N 3.27Å; L46-K48 PolarHBondContact O-N 3.37Å; L46-S49 PolarHBondContact O-N 3.37Å; L46-S49 VanDerWaalsContact O-N 3.13Å; L46-S49 PolarHBondContact O-OG 2.86Å; L46-V51 HydrophobicContact CD1-CG2 4.46Å; L46-W52 HydrophobicContact CD2-CZ2 4.42Å; L46-W52 HydrophobicContact CG-CZ2 4.13Å; L46-W52 PolarHBondContact O-NE1 3.16Å
47	L	88.4	Confident	82.9	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-32.7	-179.7	-64.1	167.8	0	0	0	112.4	L9 C27 Q29 T30 R43 I44 W52 Y64	L9-L47 HydrophobicContact CD2-CD2 4.17Å; C27-L47 WeakPolarHBondContact SG-CD1 3.21Å; Q29-L47 HydrophobicContact CB-CD1 4.18Å; T30-L47 HydrophobicContact CG2-CD1 3.53Å; T30-L47 HydrophobicContact CG2-CD2 3.56Å; T30-L47 HydrophobicContact CG2-CG 4.16Å; R43-L47 HydrophobicContact CG-CD1 3.96Å; R43-L47 HydrophobicContact CG-CG 4.38Å; R43-L47 VanDerWaalsContact O-CG 3.29Å; R43-L47 WeakPolarHBondContact O-CG 3.22Å; R43-L47 PolarHBondContact O-N 3.14Å; I44-L47 PolarHBondContact O-N 3.19Å; L47-W52 HydrophobicContact CD2-CH2 4.28Å; L47-W52 HydrophobicContact CD2-CZ2 3.76Å; L47-Y64 HydrophobicContact CD2-CD1 3.85Å; L47-Y64 HydrophobicContact CD2-CD2 3.74Å; L47-Y64 HydrophobicContact CD2-CE1 4.43Å; L47-Y64 HydrophobicContact CD2-CE2 4.34Å; L47-Y64 HydrophobicContact CD2-CG 3.46Å; L47-Y64 VanDerWaalsContact CD2-CG 3.46Å; L47-Y64 WeakPolarHBondContact O-CB 3.42Å; L47-Y64 PolarHBondContact O-N 3.04Å
48	K	86.3	Confident	82	Confident	144 Å²	144	53.5 Å²	53.5	63%	0.626	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-4.9	175.6	-70.5	-172.3	175.2	-171.4	0	114.4	I44 L45 L46 T63	I44-K48 HydrophobicContact CG2-CD 4.03Å; I44-K48 HydrophobicContact CG2-CG 4.43Å; I44-K48 WeakPolarHBondContact O-CB 3.29Å; I44-K48 WeakPolarHBondContact O-CG 3.35Å; I44-K48 PolarHBondContact O-N 2.94Å; L45-K48 CarbonylContact O-C 3.22Å; L45-K48 PolarHBondContact O-N 2.94Å; L46-K48 VanDerWaalsContact C-N 3.27Å; L46-K48 PolarHBondContact O-N 3.37Å; K48-T63 WeakPolarHBondContact O-CG2 3.29Å
49	S	83.9	Confident	81.4	Confident	36 Å²	36	53.4 Å²	53.4	25%	0.252	28%	0.279	S	S	.	.	S	Bend	trans	-80.8	142.1	176.2	67.3	0	0	0	0	110.7	L45 L46 V51 W52	L45-S49 WeakPolarHBondContact O-CB 3.45Å; L45-S49 PolarHBondContact O-N 2.93Å; L46-S49 PolarHBondContact O-N 3.37Å; L46-S49 VanDerWaalsContact O-N 3.13Å; L46-S49 PolarHBondContact O-OG 2.86Å; S49-V51 PolarHBondContact O-N 3.44Å; S49-V51 WeakPolarHBondContact OG-CG2 3.3Å; S49-W52 VanDerWaalsContact O-CD1 3.29Å
50	C	87.6	Confident	81.3	Confident	47 Å²	47	56.1 Å²	56.1	32%	0.318	29%	0.285	S	S	.	.	S	Bend	trans	-81.5	52.2	-176.3	-61.2	0	0	0	0	111.8	G61 L62	C50-G61 WeakPolarHBondContact CB-O 3.45Å; C50-G61 CarbonylContact O-C 3.49Å; C50-G61 VanDerWaalsContact O-CA 3.28Å; C50-G61 WeakPolarHBondContact O-CA 3.34Å; C50-L62 CarbonylContact C-O 3.53Å; C50-L62 VanDerWaalsContact C-O 3.28Å; C50-L62 VanDerWaalsContact CA-O 3.3Å; C50-L62 WeakPolarHBondContact CA-O 3.35Å
51	V	84.1	Confident	80.9	Confident	71 Å²	71	55.3 Å²	55.3	43%	0.43	30%	0.295	S	S	.	.			trans	-120.5	4.5	-172	-62.4	0	0	0	0	112.7	F4 L46 S49 L62	F4-V51 HydrophobicContact CD2-CB 4.27Å; F4-V51 HydrophobicContact CD2-CG2 3.62Å; F4-V51 HydrophobicContact CE2-CB 4.03Å; F4-V51 HydrophobicContact CE2-CG2 3.46Å; F4-V51 VanDerWaalsContact CE2-CG2 3.46Å; L46-V51 HydrophobicContact CD1-CG2 4.46Å; S49-V51 PolarHBondContact O-N 3.44Å; S49-V51 WeakPolarHBondContact OG-CG2 3.3Å; V51-L62 PolarHBondContact N-O 3.09Å; V51-L62 VanDerWaalsContact N-O 3.11Å
52	W	87.9	Confident	80.8	Confident	1 Å²	1	51.1 Å²	51.1	0%	0.004	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	151.6	-179	-60.8	81.4	0	0	0	111.3	P2 L3 F4 L9 L46 L47 S49 G61 L62 Y64 A67	P2-W52 HydrophobicContact CB-CE3 3.7Å; P2-W52 HydrophobicContact CB-CZ3 4.31Å; L3-W52 CarbonylContact O-C 3.56Å; L3-W52 WeakPolarHBondContact O-CA 3.23Å; F4-W52 HydrophobicContact CB-CD2 4.3Å; F4-W52 HydrophobicContact CB-CE3 3.84Å; F4-W52 HydrophobicContact CB-CH2 3.88Å; F4-W52 HydrophobicContact CB-CZ2 4.34Å; F4-W52 HydrophobicContact CB-CZ3 3.61Å; L9-W52 HydrophobicContact CB-CH2 3.75Å; L9-W52 HydrophobicContact CB-CZ3 3.87Å; L9-W52 HydrophobicContact CD1-CH2 3.77Å; L9-W52 HydrophobicContact CD2-CH2 4.06Å; L9-W52 HydrophobicContact CG-CH2 4.03Å; L46-W52 HydrophobicContact CD2-CZ2 4.42Å; L46-W52 HydrophobicContact CG-CZ2 4.13Å; L46-W52 PolarHBondContact O-NE1 3.16Å; L47-W52 HydrophobicContact CD2-CH2 4.28Å; L47-W52 HydrophobicContact CD2-CZ2 3.76Å; S49-W52 VanDerWaalsContact O-CD1 3.29Å; W52-G61 PolarHBondContact O-N 3.48Å; W52-L62 WeakPolarHBondContact CA-O 3.25Å; W52-L62 WeakPolarHBondContact CB-O 3.29Å; W52-L62 PolarHBondContact N-O 3.33Å; W52-L62 PolarHBondContact O-N 3.33Å; W52-Y64 AromaticContact CD2-CD2 3.88Å; W52-Y64 HydrophobicContact CD2-CD2 3.88Å; W52-Y64 HydrophobicContact CD2-CG 4.46Å; W52-Y64 AromaticContact CE2-CD2 3.95Å; W52-Y64 AromaticContact CE3-CD2 3.64Å; W52-Y64 HydrophobicContact CE3-CD2 3.64Å; W52-Y64 HydrophobicContact CE3-CE2 4.39Å; W52-Y64 AromaticContact CH2-CD2 3.56Å; W52-Y64 HydrophobicContact CH2-CD2 3.56Å; W52-Y64 HydrophobicContact CH2-CE2 4.08Å; W52-Y64 AromaticContact CZ2-CD2 3.8Å; W52-Y64 HydrophobicContact CZ2-CD2 3.8Å; W52-Y64 HydrophobicContact CZ2-CG 4.4Å; W52-Y64 AromaticContact CZ3-CD2 3.48Å; W52-Y64 HydrophobicContact CZ3-CD2 3.48Å; W52-Y64 VanDerWaalsContact CZ3-CD2 3.48Å; W52-Y64 AromaticContact CZ3-CE2 3.92Å; W52-Y64 HydrophobicContact CZ3-CE2 3.92Å; W52-A67 HydrophobicContact CB-CB 4.15Å
53	Q	82.6	Confident	81.1	Confident	34 Å²	34	48 Å²	48	16%	0.159	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131	174.3	-179.3	175.1	-30.9	0	0	109.6	L3 N6 T55 G58 R59 Q60	L3-Q53 HydrophobicContact CB-CB 4.34Å; L3-Q53 PolarHBondContact N-O 3.01Å; L3-Q53 PolarHBondContact O-N 2.92Å; N6-Q53 PolarHBondContact OD1-OE1 3.42Å; Q53-T55 PolarHBondContact O-N 3.18Å; Q53-G58 WeakPolarHBondContact CG-O 3.31Å; Q53-R59 WeakPolarHBondContact CA-O 3.38Å; Q53-Q60 HydrophobicContact CB-CG 4.04Å; Q53-Q60 HydrophobicContact CG-CG 3.81Å
54	C	79.5	Confident	81.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.256	C	S	.	.			trans	-68.1	124.7	171.2	174.1	0	0	0	0	109.8	A56 T57 G58 R59 L62 A67 R70 E71	C54-A56 VanDerWaalsContact C-N 3.33Å; C54-A56 PolarHBondContact O-N 3.37Å; C54-A56 PolarHBondContact SG-N 3.41Å; C54-A56 VanDerWaalsContact SG-N 3.44Å; C54-T57 WeakPolarHBondContact CB-OG1 3.24Å; C54-T57 PolarHBondContact SG-N 2.8Å; C54-T57 PolarHBondContact SG-OG1 3.46Å; C54-T57 VanDerWaalsContact SG-OG1 3.37Å; C54-G58 VanDerWaalsContact O-CA 3.27Å; C54-G58 WeakPolarHBondContact O-CA 3.38Å; C54-G58 PolarHBondContact O-N 2.98Å; C54-R59 PolarHBondContact N-O 3.19Å; C54-L62 HydrophobicContact CB-CD1 3.85Å; C54-A67 HydrophobicContact CB-CB 4.47Å; C54-R70 HydrophobicContact CB-CB 4.23Å; C54-E71 WeakPolarHBondContact SG-CG 3.35Å
55	T	72.8	Confident	81.1	Confident	51 Å²	51	48.6 Å²	48.6	31%	0.313	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-31.9	176.7	46.2	0	0	0	0	113.3	M1 L3 Q53 E71 M219	M1-T55 PolarHBondContact N-OG1 2.97Å; M1-T55 WeakPolarHBondContact O-CG2 3.48Å; L3-T55 HydrophobicContact CD1-CG2 3.84Å; L3-T55 HydrophobicContact CD2-CG2 3.94Å; L3-T55 HydrophobicContact CG-CG2 3.47Å; L3-T55 VanDerWaalsContact CG-CG2 3.47Å; Q53-T55 PolarHBondContact O-N 3.18Å; T55-E71 WeakPolarHBondContact CB-OE1 3.49Å; T55-E71 PolarHBondContact N-OE1 3.13Å; T55-E71 PolarHBondContact OG1-OE1 3.47Å; T55-E71 PolarHBondContact OG1-OE2 3.12Å; T55-M219 VanDerWaalsContact O-CE 3.31Å; T55-M219 WeakPolarHBondContact O-CE 3.25Å
56	A	60.7	Low	81.3	Confident	20 Å²	20	47.5 Å²	47.5	17%	0.165	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-42.5	-179.7	0	0	0	0	0	111.9	C54 E71 P216 M219	C54-A56 VanDerWaalsContact C-N 3.33Å; C54-A56 PolarHBondContact O-N 3.37Å; C54-A56 PolarHBondContact SG-N 3.41Å; C54-A56 VanDerWaalsContact SG-N 3.44Å; A56-E71 HydrophobicContact CB-CB 4.44Å; A56-E71 HydrophobicContact CB-CG 4.17Å; A56-P216 WeakPolarHBondContact O-CA 3.17Å; A56-M219 WeakPolarHBondContact O-CB 3.23Å
57	T	63.3	Low	81.3	Confident	27 Å²	27	45.6 Å²	45.6	17%	0.166	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-13.6	-171.7	75.9	0	0	0	0	114.4	C54 R59 R70 S74 P216	C54-T57 WeakPolarHBondContact CB-OG1 3.24Å; C54-T57 PolarHBondContact SG-N 2.8Å; C54-T57 PolarHBondContact SG-OG1 3.46Å; C54-T57 VanDerWaalsContact SG-OG1 3.37Å; T57-R59 PolarHBondContact O-N 3.39Å; T57-R59 VanDerWaalsContact O-N 3.16Å; T57-R59 WeakPolarHBondContact OG1-CB 3.46Å; T57-R59 PolarHBondContact OG1-N 3.2Å; T57-R70 HydrophobicContact CG2-CB 4.42Å; T57-S74 VanDerWaalsContact CG2-OG 3.25Å; T57-S74 WeakPolarHBondContact CG2-OG 3.49Å; T57-P216 HydrophobicContact CG2-CB 4.08Å; T57-P216 HydrophobicContact CG2-CG 3.48Å; T57-P216 VanDerWaalsContact CG2-CG 3.48Å
58	G	67.9	Low	81.2	Confident	23 Å²	23	47.9 Å²	47.9	24%	0.237	26%	0.258	C	S	.	.			trans	72.7	-3.6	-174.4	0	0	0	0	0	114.5	Q53 C54 Q60	Q53-G58 WeakPolarHBondContact CG-O 3.31Å; C54-G58 VanDerWaalsContact O-CA 3.27Å; C54-G58 WeakPolarHBondContact O-CA 3.38Å; C54-G58 PolarHBondContact O-N 2.98Å; G58-Q60 PolarHBondContact O-N 3.48Å
59	R	69.1	Low	81.2	Confident	142 Å²	142	46 Å²	46	54%	0.536	25%	0.251	S	S	.	.			trans	-65.8	121.1	-178	-172.8	171	177.6	162.8	-2	110.6	Q53 C54 T57 L62 R70	Q53-R59 WeakPolarHBondContact CA-O 3.38Å; C54-R59 PolarHBondContact N-O 3.19Å; T57-R59 PolarHBondContact O-N 3.39Å; T57-R59 VanDerWaalsContact O-N 3.16Å; T57-R59 WeakPolarHBondContact OG1-CB 3.46Å; T57-R59 PolarHBondContact OG1-N 3.2Å; R59-L62 HydrophobicContact CB-CD1 4.25Å; R59-L62 HydrophobicContact CG-CD1 4.34Å; R59-L62 HydrophobicContact CG-CD2 4.25Å; R59-L62 HydrophobicContact CG-CG 4.45Å; R59-L62 WeakPolarHBondContact O-CD1 3.3Å; R59-R70 VanDerWaalsContact CZ-NH2 3.31Å
60	Q	82.2	Confident	81	Confident	125 Å²	125	48.1 Å²	48.1	58%	0.584	25%	0.254	S	S	*	.			trans	-90.2	174.4	176	-63.1	-177	-4.9	0	0	111.4	Q53 G58	Q53-Q60 HydrophobicContact CB-CG 4.04Å; Q53-Q60 HydrophobicContact CG-CG 3.81Å; G58-Q60 PolarHBondContact O-N 3.48Å
61	G	81.1	Confident	80.6	Confident	44 Å²	44	46.8 Å²	46.8	45%	0.454	24%	0.243	S	C	.	.	S	Bend	trans	78.8	19.9	175.8	0	0	0	0	0	113.9	C50 W52	C50-G61 WeakPolarHBondContact CB-O 3.45Å; C50-G61 CarbonylContact O-C 3.49Å; C50-G61 VanDerWaalsContact O-CA 3.28Å; C50-G61 WeakPolarHBondContact O-CA 3.34Å; W52-G61 PolarHBondContact O-N 3.48Å
62	L	85.6	Confident	80.3	Confident	8 Å²	8	48.9 Å²	48.9	4%	0.042	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-99.1	155.3	-176.3	-54.4	-177.8	0	0	0	110.6	C50 V51 W52 C54 R59 E66 A67	C50-L62 CarbonylContact C-O 3.53Å; C50-L62 VanDerWaalsContact C-O 3.28Å; C50-L62 VanDerWaalsContact CA-O 3.3Å; C50-L62 WeakPolarHBondContact CA-O 3.35Å; V51-L62 PolarHBondContact N-O 3.09Å; V51-L62 VanDerWaalsContact N-O 3.11Å; W52-L62 WeakPolarHBondContact CA-O 3.25Å; W52-L62 WeakPolarHBondContact CB-O 3.29Å; W52-L62 PolarHBondContact N-O 3.33Å; W52-L62 PolarHBondContact O-N 3.33Å; C54-L62 HydrophobicContact CB-CD1 3.85Å; R59-L62 HydrophobicContact CB-CD1 4.25Å; R59-L62 HydrophobicContact CG-CD1 4.34Å; R59-L62 HydrophobicContact CG-CD2 4.25Å; R59-L62 HydrophobicContact CG-CG 4.45Å; R59-L62 WeakPolarHBondContact O-CD1 3.3Å; L62-E66 HydrophobicContact CB-CB 4.13Å; L62-E66 HydrophobicContact CD2-CB 4.48Å; L62-A67 HydrophobicContact CB-CB 4.02Å; L62-A67 HydrophobicContact CD1-CB 4.03Å
63	T	90.5	Very high	79.5	Confident	24 Å²	24	51.6 Å²	51.6	15%	0.147	27%	0.274	C	S	.	.			trans	-73.2	163.1	159.2	62.6	0	0	0	0	110.1	K48 Q65 E66 A67	K48-T63 WeakPolarHBondContact O-CG2 3.29Å; T63-Q65 PolarHBondContact O-N 2.86Å; T63-E66 WeakPolarHBondContact CG2-OE2 3.48Å; T63-E66 PolarHBondContact N-OE2 3.42Å; T63-E66 PolarHBondContact O-N 3.45Å; T63-E66 VanDerWaalsContact OG1-CD 3.26Å; T63-E66 VanDerWaalsContact OG1-CG 3.23Å; T63-E66 WeakPolarHBondContact OG1-CG 3.43Å; T63-E66 PolarHBondContact OG1-N 2.94Å; T63-E66 PolarHBondContact OG1-OE2 2.94Å; T63-A67 WeakPolarHBondContact O-CB 3.43Å; T63-A67 PolarHBondContact O-N 3.16Å
64	Y	90.7	Very high	78.6	Confident	14 Å²	14	50.4 Å²	50.4	6%	0.055	27%	0.27	C	S	.	.	H	α-helix	trans	-55.5	-39.9	177.6	-178.7	-98	0	0	0	111.6	P2 L9 Q29 T30 L47 W52 L68	P2-Y64 HydrophobicContact CB-CD2 4.03Å; P2-Y64 HydrophobicContact CB-CE2 4.19Å; P2-Y64 HydrophobicContact CG-CD2 4.12Å; P2-Y64 HydrophobicContact CG-CE2 4.09Å; L9-Y64 HydrophobicContact CB-CE2 4.4Å; L9-Y64 HydrophobicContact CD2-CD2 4.34Å; L9-Y64 HydrophobicContact CD2-CE2 3.68Å; Q29-Y64 HydrophobicContact CB-CD1 4.36Å; Q29-Y64 HydrophobicContact CB-CE1 4.38Å; T30-Y64 HydrophobicContact CG2-CE1 4.49Å; L47-Y64 HydrophobicContact CD2-CD1 3.85Å; L47-Y64 HydrophobicContact CD2-CD2 3.74Å; L47-Y64 HydrophobicContact CD2-CE1 4.43Å; L47-Y64 HydrophobicContact CD2-CE2 4.34Å; L47-Y64 HydrophobicContact CD2-CG 3.46Å; L47-Y64 VanDerWaalsContact CD2-CG 3.46Å; L47-Y64 WeakPolarHBondContact O-CB 3.42Å; L47-Y64 PolarHBondContact O-N 3.04Å; W52-Y64 AromaticContact CD2-CD2 3.88Å; W52-Y64 HydrophobicContact CD2-CD2 3.88Å; W52-Y64 HydrophobicContact CD2-CG 4.46Å; W52-Y64 AromaticContact CE2-CD2 3.95Å; W52-Y64 AromaticContact CE3-CD2 3.64Å; W52-Y64 HydrophobicContact CE3-CD2 3.64Å; W52-Y64 HydrophobicContact CE3-CE2 4.39Å; W52-Y64 AromaticContact CH2-CD2 3.56Å; W52-Y64 HydrophobicContact CH2-CD2 3.56Å; W52-Y64 HydrophobicContact CH2-CE2 4.08Å; W52-Y64 AromaticContact CZ2-CD2 3.8Å; W52-Y64 HydrophobicContact CZ2-CD2 3.8Å; W52-Y64 HydrophobicContact CZ2-CG 4.4Å; W52-Y64 AromaticContact CZ3-CD2 3.48Å; W52-Y64 HydrophobicContact CZ3-CD2 3.48Å; W52-Y64 VanDerWaalsContact CZ3-CD2 3.48Å; W52-Y64 AromaticContact CZ3-CE2 3.92Å; W52-Y64 HydrophobicContact CZ3-CE2 3.92Å; Y64-L68 WeakPolarHBondContact O-CB 3.46Å; Y64-L68 PolarHBondContact O-N 3.12Å
65	Q	88.7	Confident	78	Confident	67 Å²	67	53.4 Å²	53.4	31%	0.313	29%	0.29	S	S	.	.	H	α-helix	trans	-67.1	-49.3	179.6	-172.1	66.1	28.9	0	0	111.9	T63 A67 L68 E69	T63-Q65 PolarHBondContact O-N 2.86Å; Q65-A67 VanDerWaalsContact C-N 3.29Å; Q65-A67 PolarHBondContact O-N 3.38Å; Q65-L68 PolarHBondContact O-N 3.29Å; Q65-L68 VanDerWaalsContact O-N 3.16Å; Q65-E69 WeakPolarHBondContact CG-OE1 3.48Å; Q65-E69 PolarHBondContact NE2-OE1 3.23Å; Q65-E69 WeakPolarHBondContact O-CB 3.31Å; Q65-E69 WeakPolarHBondContact O-CG 3.17Å; Q65-E69 PolarHBondContact O-N 3.14Å
66	E	88.1	Confident	77.7	Confident	78 Å²	78	53.7 Å²	53.7	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-37.2	178.5	-71.5	165	152.3	0	0	112	L62 T63 R70	L62-E66 HydrophobicContact CB-CB 4.13Å; L62-E66 HydrophobicContact CD2-CB 4.48Å; T63-E66 WeakPolarHBondContact CG2-OE2 3.48Å; T63-E66 PolarHBondContact N-OE2 3.42Å; T63-E66 PolarHBondContact O-N 3.45Å; T63-E66 VanDerWaalsContact OG1-CD 3.26Å; T63-E66 VanDerWaalsContact OG1-CG 3.23Å; T63-E66 WeakPolarHBondContact OG1-CG 3.43Å; T63-E66 PolarHBondContact OG1-N 2.94Å; T63-E66 PolarHBondContact OG1-OE2 2.94Å; E66-R70 WeakPolarHBondContact O-CB 3.48Å; E66-R70 WeakPolarHBondContact O-CG 3.33Å; E66-R70 PolarHBondContact O-N 2.86Å; E66-R70 VanDerWaalsContact O-N 3.08Å
67	A	86.9	Confident	77.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.2	-43.8	174.5	0	0	0	0	0	111	P2 W52 C54 L62 T63 Q65 R70 E71	P2-A67 HydrophobicContact CB-CB 3.59Å; P2-A67 HydrophobicContact CG-CB 3.6Å; W52-A67 HydrophobicContact CB-CB 4.15Å; C54-A67 HydrophobicContact CB-CB 4.47Å; L62-A67 HydrophobicContact CB-CB 4.02Å; L62-A67 HydrophobicContact CD1-CB 4.03Å; T63-A67 WeakPolarHBondContact O-CB 3.43Å; T63-A67 PolarHBondContact O-N 3.16Å; Q65-A67 VanDerWaalsContact C-N 3.29Å; Q65-A67 PolarHBondContact O-N 3.38Å; A67-R70 PolarHBondContact O-N 2.87Å; A67-E71 VanDerWaalsContact O-CG 3.29Å; A67-E71 WeakPolarHBondContact O-CG 3.48Å; A67-E71 PolarHBondContact O-N 3.37Å
68	L	86.4	Confident	77.6	Confident	50 Å²	50	54.8 Å²	54.8	26%	0.262	30%	0.302	S	S	.	.	H	α-helix	trans	-65.9	-42.4	178.5	-171	71.4	0	0	0	112.3	P2 Y64 Q65 R70 E71 L72	P2-L68 HydrophobicContact CG-CB 4.05Å; P2-L68 HydrophobicContact CG-CD1 4.41Å; Y64-L68 WeakPolarHBondContact O-CB 3.46Å; Y64-L68 PolarHBondContact O-N 3.12Å; Q65-L68 PolarHBondContact O-N 3.29Å; Q65-L68 VanDerWaalsContact O-N 3.16Å; L68-R70 VanDerWaalsContact C-N 3.33Å; L68-R70 PolarHBondContact O-N 3.14Å; L68-E71 PolarHBondContact O-N 2.97Å; L68-L72 HydrophobicContact CG-CD1 4.43Å; L68-L72 WeakPolarHBondContact O-CG 3.41Å; L68-L72 PolarHBondContact O-N 3.01Å
69	E	85.1	Confident	77.4	Confident	103 Å²	103	62.1 Å²	62.1	48%	0.481	33%	0.328	S	S	.	.	H	α-helix	trans	-61.7	-41.8	176.3	-76	168	-173.3	0	0	111.3	Q65 L72 A73	Q65-E69 WeakPolarHBondContact CG-OE1 3.48Å; Q65-E69 PolarHBondContact NE2-OE1 3.23Å; Q65-E69 WeakPolarHBondContact O-CB 3.31Å; Q65-E69 WeakPolarHBondContact O-CG 3.17Å; Q65-E69 PolarHBondContact O-N 3.14Å; E69-L72 PolarHBondContact O-N 3.07Å; E69-A73 WeakPolarHBondContact O-CB 3.28Å; E69-A73 PolarHBondContact O-N 3.44Å
70	R	81.1	Confident	77.1	Confident	81 Å²	81	62 Å²	62	31%	0.306	34%	0.338	S	S	.	.	H	α-helix	trans	-63.4	-41.6	173	-80.9	-166.9	165.2	93.8	11.1	112.8	C54 T57 R59 E66 A67 L68 L72 A73 S74	C54-R70 HydrophobicContact CB-CB 4.23Å; T57-R70 HydrophobicContact CG2-CB 4.42Å; R59-R70 VanDerWaalsContact CZ-NH2 3.31Å; E66-R70 WeakPolarHBondContact O-CB 3.48Å; E66-R70 WeakPolarHBondContact O-CG 3.33Å; E66-R70 PolarHBondContact O-N 2.86Å; E66-R70 VanDerWaalsContact O-N 3.08Å; A67-R70 PolarHBondContact O-N 2.87Å; L68-R70 VanDerWaalsContact C-N 3.33Å; L68-R70 PolarHBondContact O-N 3.14Å; R70-L72 VanDerWaalsContact C-N 3.34Å; R70-L72 PolarHBondContact O-N 3.27Å; R70-A73 PolarHBondContact O-N 3.27Å; R70-S74 WeakPolarHBondContact O-CB 3.34Å; R70-S74 PolarHBondContact O-N 3.05Å; R70-S74 PolarHBondContact O-OG 2.95Å; R70-S74 VanDerWaalsContact O-OG 3.13Å
71	E	79	Confident	76.2	Confident	19 Å²	19	57.2 Å²	57.2	9%	0.089	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-42.1	176.7	-72.1	175.3	-179.9	0	0	112.3	M1 P2 C54 T55 A56 A67 L68 S75	M1-E71 VanDerWaalsContact C-OE2 3.23Å; M1-E71 WeakPolarHBondContact CA-OE2 3.26Å; M1-E71 PolarHBondContact N-OE2 3.05Å; P2-E71 VanDerWaalsContact CA-OE1 3.23Å; P2-E71 WeakPolarHBondContact CA-OE1 3.24Å; P2-E71 WeakPolarHBondContact CD-OE2 3.48Å; C54-E71 WeakPolarHBondContact SG-CG 3.35Å; T55-E71 WeakPolarHBondContact CB-OE1 3.49Å; T55-E71 PolarHBondContact N-OE1 3.13Å; T55-E71 PolarHBondContact OG1-OE1 3.47Å; T55-E71 PolarHBondContact OG1-OE2 3.12Å; A56-E71 HydrophobicContact CB-CB 4.44Å; A56-E71 HydrophobicContact CB-CG 4.17Å; A67-E71 VanDerWaalsContact O-CG 3.29Å; A67-E71 WeakPolarHBondContact O-CG 3.48Å; A67-E71 PolarHBondContact O-N 3.37Å; L68-E71 PolarHBondContact O-N 2.97Å; E71-S75 WeakPolarHBondContact O-CB 3.49Å; E71-S75 PolarHBondContact O-N 2.59Å
72	L	77.7	Confident	75.6	Confident	116 Å²	116	57.7 Å²	57.7	61%	0.607	31%	0.31	S	S	*	.	H	α-helix	trans	-66.5	-44.1	177.2	-73	168.7	0	0	0	111.9	L68 E69 R70 S75 A76	L68-L72 HydrophobicContact CG-CD1 4.43Å; L68-L72 WeakPolarHBondContact O-CG 3.41Å; L68-L72 PolarHBondContact O-N 3.01Å; E69-L72 PolarHBondContact O-N 3.07Å; R70-L72 VanDerWaalsContact C-N 3.34Å; R70-L72 PolarHBondContact O-N 3.27Å; L72-S75 PolarHBondContact O-N 2.91Å; L72-A76 PolarHBondContact O-N 3.13Å; L72-A76 VanDerWaalsContact O-N 3.08Å
73	A	71.2	Confident	75	Confident	58 Å²	58	65.5 Å²	65.5	48%	0.479	35%	0.346	S	S	.	.	H	α-helix	trans	-61	-49.1	176.7	0	0	0	0	0	111.2	E69 R70 S75 A76 T77	E69-A73 WeakPolarHBondContact O-CB 3.28Å; E69-A73 PolarHBondContact O-N 3.44Å; R70-A73 PolarHBondContact O-N 3.27Å; A73-S75 VanDerWaalsContact C-N 3.34Å; A73-S75 PolarHBondContact O-N 3.43Å; A73-A76 WeakPolarHBondContact O-CB 3.41Å; A73-A76 PolarHBondContact O-N 2.88Å; A73-A76 VanDerWaalsContact O-N 3.13Å; A73-T77 PolarHBondContact O-N 3.4Å; A73-T77 VanDerWaalsContact O-N 3.16Å; A73-T77 PolarHBondContact O-OG1 2.89Å
74	S	63.8	Low	74.2	Confident	9 Å²	9	67.1 Å²	67.1	6%	0.063	36%	0.356	C	S	.	.	H	α-helix	trans	-60.4	-42.2	176.1	-65.1	0	0	0	0	112	T57 R70 A76 T77 L78 P216	T57-S74 VanDerWaalsContact CG2-OG 3.25Å; T57-S74 WeakPolarHBondContact CG2-OG 3.49Å; R70-S74 WeakPolarHBondContact O-CB 3.34Å; R70-S74 PolarHBondContact O-N 3.05Å; R70-S74 PolarHBondContact O-OG 2.95Å; R70-S74 VanDerWaalsContact O-OG 3.13Å; S74-A76 PolarHBondContact O-N 3.47Å; S74-T77 PolarHBondContact O-N 3.3Å; S74-L78 WeakPolarHBondContact O-CB 3.22Å; S74-L78 VanDerWaalsContact O-CD1 3.25Å; S74-L78 WeakPolarHBondContact O-CD1 3.31Å; S74-L78 WeakPolarHBondContact O-CG 2.97Å; S74-L78 PolarHBondContact O-N 3.45Å; S74-P216 WeakPolarHBondContact OG-CB 3.29Å
75	S	65.6	Low	73.5	Confident	62 Å²	62	66.5 Å²	66.5	43%	0.434	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-29.6	176.8	-176.5	0	0	0	0	113.5	E71 L72 A73 K79	E71-S75 WeakPolarHBondContact O-CB 3.49Å; E71-S75 PolarHBondContact O-N 2.59Å; L72-S75 PolarHBondContact O-N 2.91Å; A73-S75 VanDerWaalsContact C-N 3.34Å; A73-S75 PolarHBondContact O-N 3.43Å; S75-K79 PolarHBondContact O-N 2.9Å
76	A	66.7	Low	73.1	Confident	57 Å²	57	64.1 Å²	64.1	47%	0.471	34%	0.343	S	S	.	.	H	α-helix	trans	-73.6	-43.7	176	0	0	0	0	0	111.4	L72 A73 S74 L78 K79	L72-A76 PolarHBondContact O-N 3.13Å; L72-A76 VanDerWaalsContact O-N 3.08Å; A73-A76 WeakPolarHBondContact O-CB 3.41Å; A73-A76 PolarHBondContact O-N 2.88Å; A73-A76 VanDerWaalsContact O-N 3.13Å; S74-A76 PolarHBondContact O-N 3.47Å; A76-L78 VanDerWaalsContact C-N 3.3Å; A76-L78 PolarHBondContact O-N 3.14Å; A76-K79 PolarHBondContact O-N 3.41Å
77	T	60.2	Low	72.8	Confident	57 Å²	57	65.3 Å²	65.3	35%	0.35	34%	0.344	S	S	.	.	H	α-helix	trans	-59.9	-42.4	175.6	-47.8	0	0	0	0	111.4	A73 S74 K79 N80	A73-T77 PolarHBondContact O-N 3.4Å; A73-T77 VanDerWaalsContact O-N 3.16Å; A73-T77 PolarHBondContact O-OG1 2.89Å; S74-T77 PolarHBondContact O-N 3.3Å; T77-K79 VanDerWaalsContact C-N 3.33Å; T77-K79 PolarHBondContact O-N 2.97Å; T77-N80 PolarHBondContact O-N 2.93Å; T77-N80 VanDerWaalsContact O-N 3.15Å
78	L	61.4	Low	72.7	Confident	13 Å²	13	65.4 Å²	65.4	7%	0.068	35%	0.345	C	S	.	.	H	α-helix	trans	-63.1	-33.5	-179.1	-75.9	162.2	0	0	0	114.4	S74 A76 N80 F81 L217 W220	S74-L78 WeakPolarHBondContact O-CB 3.22Å; S74-L78 VanDerWaalsContact O-CD1 3.25Å; S74-L78 WeakPolarHBondContact O-CD1 3.31Å; S74-L78 WeakPolarHBondContact O-CG 2.97Å; S74-L78 PolarHBondContact O-N 3.45Å; A76-L78 VanDerWaalsContact C-N 3.3Å; A76-L78 PolarHBondContact O-N 3.14Å; L78-N80 PolarHBondContact O-N 2.96Å; L78-F81 PolarHBondContact O-N 3.21Å; L78-L217 HydrophobicContact CD2-CB 4.49Å; L78-L217 HydrophobicContact CD2-CD1 3.66Å; L78-L217 HydrophobicContact CD2-CG 4.2Å; L78-W220 HydrophobicContact CB-CD2 4.4Å; L78-W220 HydrophobicContact CD1-CB 3.46Å; L78-W220 VanDerWaalsContact CD1-CB 3.46Å; L78-W220 VanDerWaalsContact CD1-CD1 3.49Å; L78-W220 HydrophobicContact CD1-CD2 4.11Å; L78-W220 HydrophobicContact CD1-CG 3.39Å; L78-W220 HydrophobicContact CD2-CB 3.38Å; L78-W220 HydrophobicContact CD2-CD2 3.52Å; L78-W220 HydrophobicContact CD2-CE3 3.58Å; L78-W220 HydrophobicContact CD2-CG 3.47Å; L78-W220 VanDerWaalsContact CD2-CG 3.47Å; L78-W220 HydrophobicContact CD2-CZ3 4.44Å; L78-W220 HydrophobicContact CG-CB 4.06Å; L78-W220 HydrophobicContact CG-CD2 4.23Å; L78-W220 HydrophobicContact CG-CG 3.97Å
79	K	64.2	Low	72.6	Confident	178 Å²	178	63 Å²	63	77%	0.774	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.5	176.9	-90.9	-177.2	174.7	178.7	0	113.5	S75 A76 T77	S75-K79 PolarHBondContact O-N 2.9Å; A76-K79 PolarHBondContact O-N 3.41Å; T77-K79 VanDerWaalsContact C-N 3.33Å; T77-K79 PolarHBondContact O-N 2.97Å
80	N	62	Low	72.5	Confident	140 Å²	140	58.1 Å²	58.1	75%	0.749	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	9.2	-177.2	-65.1	-23.5	0	0	0	112.9	T77 L78	T77-N80 PolarHBondContact O-N 2.93Å; T77-N80 VanDerWaalsContact O-N 3.15Å; L78-N80 PolarHBondContact O-N 2.96Å
81	F	64.9	Low	72.7	Confident	23 Å²	23	55.9 Å²	55.9	10%	0.101	30%	0.302	C	S	.	.			trans	-69.3	132.9	-178.8	-170.7	-106	0	0	0	111.7	L78 E83 L85 I86 V89 V211 L217 L221	L78-F81 PolarHBondContact O-N 3.21Å; F81-E83 PolarHBondContact O-N 3.32Å; F81-L85 HydrophobicContact CE1-CB 3.82Å; F81-L85 HydrophobicContact CE2-CB 4.49Å; F81-L85 HydrophobicContact CZ-CB 3.58Å; F81-L85 HydrophobicContact CZ-CD1 4.45Å; F81-I86 HydrophobicContact CD1-CD1 4.49Å; F81-I86 HydrophobicContact CD1-CG1 3.67Å; F81-I86 HydrophobicContact CE1-CG1 3.74Å; F81-V89 HydrophobicContact CZ-CG2 4.15Å; F81-V211 HydrophobicContact CE2-CG1 3.8Å; F81-L217 HydrophobicContact CB-CD1 4.02Å; F81-L217 HydrophobicContact CD2-CD1 3.25Å; F81-L217 HydrophobicContact CD2-CD2 3.61Å; F81-L217 HydrophobicContact CD2-CG 4.01Å; F81-L217 HydrophobicContact CE1-CD2 4.33Å; F81-L217 HydrophobicContact CE2-CD1 3.83Å; F81-L217 HydrophobicContact CE2-CD2 3.18Å; F81-L217 HydrophobicContact CE2-CG 4.09Å; F81-L217 HydrophobicContact CG-CD1 3.69Å; F81-L217 HydrophobicContact CG-CD2 4.35Å; F81-L217 HydrophobicContact CG-CG 4.5Å; F81-L217 HydrophobicContact CZ-CD2 3.6Å; F81-L221 HydrophobicContact CE1-CD1 4.44Å
82	P	68.4	Low	73.1	Confident	54 Å²	54	55 Å²	55	35%	0.351	30%	0.298	S	S	.	.			trans	-63.2	123.4	-178.6	-21.4	32.5	0	0	0	112.5	T84 L85	P82-T84 PolarHBondContact O-N 3.22Å; P82-T84 VanDerWaalsContact O-N 3.12Å; P82-L85 HydrophobicContact CB-CD1 4.23Å; P82-L85 HydrophobicContact CB-CG 4.26Å; P82-L85 HydrophobicContact CG-CD1 4.08Å; P82-L85 PolarHBondContact O-N 3.05Å
83	E	72.2	Confident	73.3	Confident	172 Å²	172	49.4 Å²	49.4	80%	0.804	27%	0.269	S	S	*	.	H	α-helix	trans	-56.2	-31.5	178.7	-78.1	-171.9	162.3	0	0	113	F81 L85 I86	F81-E83 PolarHBondContact O-N 3.32Å; E83-L85 PolarHBondContact O-N 3.49Å; E83-I86 HydrophobicContact CB-CD1 4.48Å; E83-I86 HydrophobicContact CG-CD1 4.35Å; E83-I86 PolarHBondContact O-N 2.94Å
84	T	73.5	Confident	73.7	Confident	58 Å²	58	48.9 Å²	48.9	36%	0.356	27%	0.268	S	S	.	.	H	α-helix	trans	-65.3	-24	179.3	49.1	0	0	0	0	113.3	P82 P88 G119	P82-T84 PolarHBondContact O-N 3.22Å; P82-T84 VanDerWaalsContact O-N 3.12Å; T84-P88 VanDerWaalsContact O-CD 3.26Å; T84-P88 WeakPolarHBondContact O-CD 3.36Å; T84-G119 VanDerWaalsContact CG2-O 3.27Å; T84-G119 WeakPolarHBondContact CG2-O 3.41Å
85	L	77.6	Confident	74.6	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-93.8	-13.9	179.8	-65.6	179.5	0	0	0	113.6	F81 P82 E83 R87 P88 V89 F117 E120 V211	F81-L85 HydrophobicContact CE1-CB 3.82Å; F81-L85 HydrophobicContact CE2-CB 4.49Å; F81-L85 HydrophobicContact CZ-CB 3.58Å; F81-L85 HydrophobicContact CZ-CD1 4.45Å; P82-L85 HydrophobicContact CB-CD1 4.23Å; P82-L85 HydrophobicContact CB-CG 4.26Å; P82-L85 HydrophobicContact CG-CD1 4.08Å; P82-L85 PolarHBondContact O-N 3.05Å; E83-L85 PolarHBondContact O-N 3.49Å; L85-R87 PolarHBondContact O-N 2.64Å; L85-P88 WeakPolarHBondContact O-CD 3.4Å; L85-V89 VanDerWaalsContact O-CB 3.29Å; L85-V89 WeakPolarHBondContact O-CB 3.49Å; L85-V89 WeakPolarHBondContact O-CG2 3.15Å; L85-V89 PolarHBondContact O-N 2.93Å; L85-F117 HydrophobicContact CD2-CB 4.26Å; L85-F117 HydrophobicContact CD2-CD2 3.6Å; L85-F117 HydrophobicContact CD2-CE2 4.42Å; L85-F117 HydrophobicContact CD2-CG 4.27Å; L85-E120 HydrophobicContact CD2-CG 4.23Å; L85-V211 HydrophobicContact CD1-CB 4.22Å; L85-V211 HydrophobicContact CD1-CG1 3.58Å; L85-V211 HydrophobicContact CD1-CG2 3.76Å
86	I	78.3	Confident	75	Confident	18 Å²	18	47.8 Å²	47.8	9%	0.092	26%	0.257	C	S	.	.	H	α-helix	trans	-59.1	-50.7	-177.4	-64	174.7	0	0	0	111	F81 E83 L90 L221 Y244	F81-I86 HydrophobicContact CD1-CD1 4.49Å; F81-I86 HydrophobicContact CD1-CG1 3.67Å; F81-I86 HydrophobicContact CE1-CG1 3.74Å; E83-I86 HydrophobicContact CB-CD1 4.48Å; E83-I86 HydrophobicContact CG-CD1 4.35Å; E83-I86 PolarHBondContact O-N 2.94Å; I86-L90 HydrophobicContact CG2-CD1 3.68Å; I86-L90 HydrophobicContact CG2-CG 4.31Å; I86-L90 WeakPolarHBondContact O-CB 3.4Å; I86-L90 WeakPolarHBondContact O-CG 2.79Å; I86-L90 PolarHBondContact O-N 2.82Å; I86-L221 HydrophobicContact CG1-CD2 4.46Å; I86-L221 HydrophobicContact CG2-CD2 3.95Å; I86-Y244 HydrophobicContact CB-CE1 4.39Å; I86-Y244 HydrophobicContact CD1-CE1 4.39Å; I86-Y244 HydrophobicContact CG2-CD1 3.67Å; I86-Y244 HydrophobicContact CG2-CE1 3.38Å; I86-Y244 HydrophobicContact CG2-CE2 4.34Å; I86-Y244 HydrophobicContact CG2-CG 4.27Å
87	R	83.8	Confident	75.1	Confident	103 Å²	103	48 Å²	48	39%	0.389	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-50	-179.9	-87.6	177.1	147.4	174.6	-9.6	113.2	L85 V89 L90 F91 Y244 I246 L254	L85-R87 PolarHBondContact O-N 2.64Å; R87-V89 PolarHBondContact O-N 2.9Å; R87-L90 PolarHBondContact O-N 3.04Å; R87-F91 WeakPolarHBondContact O-CB 2.94Å; R87-F91 PolarHBondContact O-N 3.09Å; R87-Y244 PolarHBondContact NE-O 3Å; R87-Y244 PolarHBondContact NH2-O 3Å; R87-Y244 VanDerWaalsContact NH2-O 3.08Å; R87-I246 HydrophobicContact CB-CD1 4.46Å; R87-I246 HydrophobicContact CG-CD1 4.14Å; R87-L254 HydrophobicContact CB-CD2 3.93Å
88	P	84.9	Confident	75.4	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.013	25%	0.246	C	C	.	.	H	α-helix	trans	-55	-47.3	173.6	-26.7	32.3	0	0	0	114.1	T84 L85 F91 I92 F117 L254	T84-P88 VanDerWaalsContact O-CD 3.26Å; T84-P88 WeakPolarHBondContact O-CD 3.36Å; L85-P88 WeakPolarHBondContact O-CD 3.4Å; P88-F91 PolarHBondContact O-N 3.34Å; P88-I92 WeakPolarHBondContact O-CD1 3.16Å; P88-I92 VanDerWaalsContact O-CG1 3.22Å; P88-I92 WeakPolarHBondContact O-CG1 3.27Å; P88-I92 PolarHBondContact O-N 3.1Å; P88-F117 HydrophobicContact CB-CB 4.29Å; P88-F117 HydrophobicContact CB-CD1 3.35Å; P88-F117 HydrophobicContact CB-CD2 4.11Å; P88-F117 HydrophobicContact CB-CE1 3.59Å; P88-F117 HydrophobicContact CB-CE2 4.32Å; P88-F117 HydrophobicContact CB-CG 3.62Å; P88-F117 HydrophobicContact CB-CZ 4.08Å; P88-F117 HydrophobicContact CG-CB 3.83Å; P88-F117 HydrophobicContact CG-CD1 3.76Å; P88-F117 HydrophobicContact CG-CD2 4.47Å; P88-F117 HydrophobicContact CG-CE1 4.48Å; P88-F117 HydrophobicContact CG-CG 3.74Å; P88-L254 HydrophobicContact CG-CB 4.44Å; P88-L254 HydrophobicContact CG-CD2 4.19Å
89	V	83.7	Confident	75.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-48.4	179.8	169.5	0	0	0	0	111	F81 L85 R87 F91 I92 V93 V108 V112 L221	F81-V89 HydrophobicContact CZ-CG2 4.15Å; L85-V89 VanDerWaalsContact O-CB 3.29Å; L85-V89 WeakPolarHBondContact O-CB 3.49Å; L85-V89 WeakPolarHBondContact O-CG2 3.15Å; L85-V89 PolarHBondContact O-N 2.93Å; R87-V89 PolarHBondContact O-N 2.9Å; V89-F91 VanDerWaalsContact C-N 3.31Å; V89-F91 PolarHBondContact O-N 3.3Å; V89-I92 PolarHBondContact O-N 3.31Å; V89-V93 HydrophobicContact CG1-CG2 4.34Å; V89-V93 VanDerWaalsContact O-CG2 3.24Å; V89-V93 WeakPolarHBondContact O-CG2 3.44Å; V89-V93 PolarHBondContact O-N 3.11Å; V89-V108 HydrophobicContact CG1-CG1 3.83Å; V89-V112 HydrophobicContact CG2-CG2 3.99Å; V89-L221 HydrophobicContact CB-CD1 4.2Å; V89-L221 HydrophobicContact CG1-CD1 3.49Å; V89-L221 VanDerWaalsContact CG1-CD1 3.49Å
90	L	83.1	Confident	75.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.5	-41.4	176.6	-70.4	172	0	0	0	111.4	I86 R87 I92 V93 G94 L221 L236 T240 Y244 I246	I86-L90 HydrophobicContact CG2-CD1 3.68Å; I86-L90 HydrophobicContact CG2-CG 4.31Å; I86-L90 WeakPolarHBondContact O-CB 3.4Å; I86-L90 WeakPolarHBondContact O-CG 2.79Å; I86-L90 PolarHBondContact O-N 2.82Å; R87-L90 PolarHBondContact O-N 3.04Å; L90-I92 PolarHBondContact O-N 2.76Å; L90-V93 PolarHBondContact O-N 2.62Å; L90-G94 PolarHBondContact O-N 2.89Å; L90-G94 VanDerWaalsContact O-N 3.14Å; L90-L221 HydrophobicContact CD2-CB 3.95Å; L90-L236 HydrophobicContact CB-CD2 4.33Å; L90-L236 HydrophobicContact CD2-CD2 3.5Å; L90-L236 VanDerWaalsContact CD2-CD2 3.5Å; L90-L236 HydrophobicContact CG-CD2 4.49Å; L90-L236 VanDerWaalsContact O-CD1 3.27Å; L90-L236 WeakPolarHBondContact O-CD1 3.42Å; L90-T240 HydrophobicContact CD1-CG2 4.01Å; L90-T240 HydrophobicContact CD2-CG2 3.78Å; L90-Y244 HydrophobicContact CD1-CD1 4.28Å; L90-Y244 HydrophobicContact CD1-CD2 3.46Å; L90-Y244 VanDerWaalsContact CD1-CD2 3.46Å; L90-Y244 HydrophobicContact CD1-CE2 4.04Å; L90-Y244 HydrophobicContact CD1-CG 3.59Å; L90-I246 HydrophobicContact CB-CD1 3.7Å; L90-I246 HydrophobicContact CB-CG1 4.08Å; L90-I246 HydrophobicContact CD1-CD1 4.19Å; L90-I246 HydrophobicContact CD1-CG1 4.42Å
91	F	85.6	Confident	75.5	Confident	33 Å²	33	38.9 Å²	38.9	15%	0.145	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-45.9	176.7	-164.4	-82.3	0	0	0	111.5	R87 P88 V89 G94 L95 I246 T249 W251 L254 L259	R87-F91 WeakPolarHBondContact O-CB 2.94Å; R87-F91 PolarHBondContact O-N 3.09Å; P88-F91 PolarHBondContact O-N 3.34Å; V89-F91 VanDerWaalsContact C-N 3.31Å; V89-F91 PolarHBondContact O-N 3.3Å; F91-G94 PolarHBondContact O-N 3.02Å; F91-L95 HydrophobicContact CD1-CD1 4.02Å; F91-L95 HydrophobicContact CD1-CG 4.36Å; F91-L95 HydrophobicContact CE1-CD1 4.03Å; F91-L95 HydrophobicContact CE1-CD2 4.33Å; F91-L95 HydrophobicContact CE1-CG 4.36Å; F91-L95 WeakPolarHBondContact O-CG 3.26Å; F91-L95 PolarHBondContact O-N 2.57Å; F91-I246 HydrophobicContact CD2-CG2 4.04Å; F91-T249 VanDerWaalsContact CE2-O 3.26Å; F91-T249 WeakPolarHBondContact CE2-O 3.26Å; F91-W251 HydrophobicContact CD1-CD2 4.45Å; F91-W251 AromaticContact CD1-CE3 3.38Å; F91-W251 HydrophobicContact CD1-CE3 3.38Å; F91-W251 AromaticContact CD1-CZ3 3.76Å; F91-W251 HydrophobicContact CD1-CZ3 3.76Å; F91-W251 HydrophobicContact CE1-CB 4.03Å; F91-W251 HydrophobicContact CE1-CD2 4.26Å; F91-W251 AromaticContact CE1-CE3 3.57Å; F91-W251 HydrophobicContact CE1-CE3 3.57Å; F91-W251 HydrophobicContact CE1-CG 4.49Å; F91-W251 HydrophobicContact CE1-CZ3 4.35Å; F91-W251 HydrophobicContact CG-CE3 4.24Å; F91-W251 HydrophobicContact CZ-CB 4.2Å; F91-L254 HydrophobicContact CB-CD1 3.55Å; F91-L254 HydrophobicContact CD1-CD1 4.34Å; F91-L254 HydrophobicContact CD2-CD1 3.72Å; F91-L254 HydrophobicContact CG-CD1 3.61Å; F91-L259 HydrophobicContact CE1-CD1 3.89Å
92	I	85.7	Confident	75.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.1	-42.6	178	-66	161.5	0	0	0	111.5	P88 V89 L90 G94 L95 T96 V108 F111 V112 F117 W251 P260 F262	P88-I92 WeakPolarHBondContact O-CD1 3.16Å; P88-I92 VanDerWaalsContact O-CG1 3.22Å; P88-I92 WeakPolarHBondContact O-CG1 3.27Å; P88-I92 PolarHBondContact O-N 3.1Å; V89-I92 PolarHBondContact O-N 3.31Å; L90-I92 PolarHBondContact O-N 2.76Å; I92-G94 PolarHBondContact O-N 2.98Å; I92-L95 WeakPolarHBondContact O-CA 3.24Å; I92-L95 WeakPolarHBondContact O-CB 3.25Å; I92-L95 PolarHBondContact O-N 3.48Å; I92-T96 PolarHBondContact O-N 3.29Å; I92-V108 HydrophobicContact CG2-CB 4.35Å; I92-V108 HydrophobicContact CG2-CG1 4.45Å; I92-V108 HydrophobicContact CG2-CG2 3.89Å; I92-F111 HydrophobicContact CD1-CD1 3.52Å; I92-F111 HydrophobicContact CD1-CE1 4.04Å; I92-F111 HydrophobicContact CG1-CD1 4.25Å; I92-V112 HydrophobicContact CD1-CG2 3.74Å; I92-F117 HydrophobicContact CD1-CE1 3.98Å; I92-F117 HydrophobicContact CD1-CZ 3.61Å; I92-W251 HydrophobicContact CD1-CH2 4.07Å; I92-W251 HydrophobicContact CD1-CZ3 4.4Å; I92-W251 HydrophobicContact CG1-CH2 3.79Å; I92-W251 HydrophobicContact CG1-CZ3 3.83Å; I92-P260 HydrophobicContact CG1-CG 4.43Å; I92-F262 HydrophobicContact CG2-CE2 3.56Å; I92-F262 HydrophobicContact CG2-CZ 3.52Å
93	V	82.1	Confident	75.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-56.3	-38.7	175.4	171.9	0	0	0	0	111	V89 L90 L95 T96 V104 V108 V218 L222 C235 L236	V89-V93 HydrophobicContact CG1-CG2 4.34Å; V89-V93 VanDerWaalsContact O-CG2 3.24Å; V89-V93 WeakPolarHBondContact O-CG2 3.44Å; V89-V93 PolarHBondContact O-N 3.11Å; L90-V93 PolarHBondContact O-N 2.62Å; V93-L95 PolarHBondContact O-N 3.43Å; V93-T96 PolarHBondContact O-N 3.47Å; V93-T96 PolarHBondContact O-OG1 2.86Å; V93-V104 HydrophobicContact CG1-CG1 4Å; V93-V104 HydrophobicContact CG2-CG1 4.26Å; V93-V108 HydrophobicContact CB-CG2 4.42Å; V93-V108 HydrophobicContact CG2-CG1 4.46Å; V93-V108 HydrophobicContact CG2-CG2 3.53Å; V93-V218 HydrophobicContact CG2-CG1 4.12Å; V93-L222 HydrophobicContact CG1-CD1 4.34Å; V93-L222 HydrophobicContact CG1-CD2 3.67Å; V93-L222 HydrophobicContact CG1-CG 4.36Å; V93-C235 HydrophobicContact CG1-CB 4.17Å; V93-L236 HydrophobicContact CG1-CG 4.38Å
94	G	80.1	Confident	75.2	Confident	46 Å²	46	30.5 Å²	30.5	47%	0.474	18%	0.182	S	C	.	.	H	α-helix	trans	-66.5	-20.2	174	0	0	0	0	0	114.9	L90 F91 I92	L90-G94 PolarHBondContact O-N 2.89Å; L90-G94 VanDerWaalsContact O-N 3.14Å; F91-G94 PolarHBondContact O-N 3.02Å; I92-G94 PolarHBondContact O-N 2.98Å
95	L	83.2	Confident	75	Confident	46 Å²	46	28.3 Å²	28.3	24%	0.241	17%	0.169	C	C	.	.	H	α-helix	trans	-86.7	-20.1	174.3	-58.3	173.1	0	0	0	112.4	F91 I92 V93 S97 L259 P260 F262	F91-L95 HydrophobicContact CD1-CD1 4.02Å; F91-L95 HydrophobicContact CD1-CG 4.36Å; F91-L95 HydrophobicContact CE1-CD1 4.03Å; F91-L95 HydrophobicContact CE1-CD2 4.33Å; F91-L95 HydrophobicContact CE1-CG 4.36Å; F91-L95 WeakPolarHBondContact O-CG 3.26Å; F91-L95 PolarHBondContact O-N 2.57Å; I92-L95 WeakPolarHBondContact O-CA 3.24Å; I92-L95 WeakPolarHBondContact O-CB 3.25Å; I92-L95 PolarHBondContact O-N 3.48Å; V93-L95 PolarHBondContact O-N 3.43Å; L95-S97 PolarHBondContact O-N 2.79Å; L95-L259 HydrophobicContact CD1-CD1 3.63Å; L95-L259 HydrophobicContact CD1-CG 3.95Å; L95-L259 HydrophobicContact CD2-CD1 4.25Å; L95-L259 HydrophobicContact CD2-CD2 4.18Å; L95-L259 HydrophobicContact CD2-CG 4.41Å; L95-P260 HydrophobicContact CD1-CG 3.76Å; L95-F262 HydrophobicContact CB-CD2 4.1Å; L95-F262 HydrophobicContact CB-CE2 4.13Å
96	T	73.8	Confident	74.7	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.018	18%	0.184	C	C	.	.			trans	-72.2	128.5	177.5	69.7	0	0	0	0	110.8	I92 V93 V104 D107 V108 C235 F262	I92-T96 PolarHBondContact O-N 3.29Å; V93-T96 PolarHBondContact O-N 3.47Å; V93-T96 PolarHBondContact O-OG1 2.86Å; T96-V104 HydrophobicContact CG2-CG1 4.29Å; T96-V104 WeakPolarHBondContact OG1-CG1 3.32Å; T96-D107 HydrophobicContact CG2-CB 3.77Å; T96-V108 HydrophobicContact CG2-CG2 4.11Å; T96-C235 PolarHBondContact O-SG 2.89Å; T96-C235 VanDerWaalsContact O-SG 3.42Å; T96-F262 HydrophobicContact CG2-CD2 3.77Å; T96-F262 HydrophobicContact CG2-CE2 4.03Å; T96-F262 HydrophobicContact CG2-CG 4.14Å
97	S	67.9	Low	74.8	Confident	61 Å²	61	30.3 Å²	30.3	43%	0.427	18%	0.183	S	C	.	.			trans	-104.9	35	176.4	-64.7	0	0	0	0	112.1	L95 N265	L95-S97 PolarHBondContact O-N 2.79Å; S97-N265 PolarHBondContact O-ND2 3.31Å
98	R	67.6	Low	74.5	Confident	43 Å²	43	25.4 Å²	25.4	16%	0.162	17%	0.165	C	C	.	.			trans	-92.2	148.5	-174.9	-54.7	-61.8	-167.1	177	12.5	112.2	A103 V104 D107 P263 N265	R98-A103 HydrophobicContact CB-CB 3.76Å; R98-A103 HydrophobicContact CG-CB 3.7Å; R98-V104 HydrophobicContact CB-CG2 3.79Å; R98-D107 WeakPolarHBondContact CG-OD2 3.2Å; R98-D107 IonicContact CZ-OD1 2.76Å; R98-D107 IonicContact CZ-OD2 3.31Å; R98-D107 IonicContact NE-OD1 3.21Å; R98-D107 PolarHBondContact NE-OD1 3.25Å; R98-D107 IonicContact NE-OD2 2.87Å; R98-D107 PolarHBondContact NE-OD2 3.13Å; R98-D107 IonicContact NH2-OD1 3.45Å; R98-D107 PolarHBondContact NH2-OD1 3.17Å; R98-D107 IonicContact NH2-OD2 2.83Å; R98-P263 WeakPolarHBondContact CD-O 3.27Å; R98-P263 PolarHBondContact NE-O 2.81Å; R98-P263 PolarHBondContact NH1-O 3.05Å; R98-N265 WeakPolarHBondContact CA-OD1 3.42Å
99	S	62.4	Low	73.9	Confident	56 Å²	56	28.4 Å²	28.4	39%	0.392	18%	0.176	S	C	.	.	S	Bend	trans	-93.5	-11.4	179.9	55.3	0	0	0	0	112.9	I231 N265	S99-I231 WeakPolarHBondContact O-CD1 3.25Å; S99-I231 WeakPolarHBondContact O-CG2 3.42Å; S99-N265 WeakPolarHBondContact CA-OD1 3.4Å; S99-N265 VanDerWaalsContact CB-CG 3.4Å; S99-N265 WeakPolarHBondContact CB-ND2 3.47Å; S99-N265 VanDerWaalsContact CB-OD1 3.24Å; S99-N265 WeakPolarHBondContact CB-OD1 3.48Å; S99-N265 VanDerWaalsContact N-CG 3.27Å; S99-N265 PolarHBondContact N-ND2 3.41Å; S99-N265 PolarHBondContact N-OD1 3.47Å; S99-N265 PolarHBondContact OG-ND2 3.45Å; S99-N265 PolarHBondContact OG-OD1 3.45Å
100	T	61.5	Low	73.4	Confident	70 Å²	70	31.1 Å²	31.1	43%	0.429	20%	0.195	S	C	.	.	S	Bend	trans	-121.5	137.3	178.5	69.5	0	0	0	0	109.2	S102 A103 V104	T100-S102 PolarHBondContact O-N 2.69Å; T100-A103 PolarHBondContact O-N 3.29Å; T100-A103 VanDerWaalsContact O-N 3.13Å; T100-A103 WeakPolarHBondContact OG1-CB 3.38Å; T100-A103 PolarHBondContact OG1-N 3.11Å; T100-V104 PolarHBondContact O-N 2.85Å; T100-V104 VanDerWaalsContact O-N 3.08Å
101	L	64.4	Low	73.3	Confident	28 Å²	28	32.3 Å²	32.3	15%	0.147	20%	0.201	C	C	.	.	H	α-helix	trans	-55.5	-37.1	174.6	173.9	77	0	0	0	111.9	A103 V104 T105 A215 V218 M219 L222	L101-A103 VanDerWaalsContact C-N 3.34Å; L101-A103 PolarHBondContact O-N 3.38Å; L101-V104 PolarHBondContact O-N 3.3Å; L101-T105 WeakPolarHBondContact O-CB 3.12Å; L101-T105 PolarHBondContact O-N 3.24Å; L101-T105 PolarHBondContact O-OG1 2.75Å; L101-A215 HydrophobicContact CD2-CB 4.5Å; L101-V218 HydrophobicContact CD1-CG1 4.14Å; L101-M219 HydrophobicContact CD1-CG 3.73Å; L101-M219 HydrophobicContact CD1-SD 4.44Å; L101-M219 HydrophobicContact CD2-CE 4.12Å; L101-M219 HydrophobicContact CD2-CG 3.12Å; L101-M219 HydrophobicContact CD2-SD 3.49Å; L101-M219 WeakPolarHBondContact CD2-SD 3.42Å; L101-M219 HydrophobicContact CG-CG 3.98Å; L101-L222 HydrophobicContact CD1-CD1 4.11Å
102	S	62.9	Low	72.8	Confident	39 Å²	39	30.8 Å²	30.8	27%	0.273	19%	0.194	S	C	.	.	H	α-helix	trans	-56.1	-49.2	176.5	165.7	0	0	0	0	111.4	T100 T105 S106 F1215	T100-S102 PolarHBondContact O-N 2.69Å; S102-T105 WeakPolarHBondContact O-CB 3.44Å; S102-T105 PolarHBondContact O-N 3.38Å; S102-S106 WeakPolarHBondContact O-CB 3.34Å; S102-S106 PolarHBondContact O-N 2.94Å; S102-F1215 WeakPolarHBondContact OG-CE1 3.44Å; S102-F1215 WeakPolarHBondContact OG-CZ 3.45Å
103	A	65.5	Low	72	Confident	25 Å²	25	32.4 Å²	32.4	21%	0.207	21%	0.205	C	C	.	.	H	α-helix	trans	-67.4	-40	179.1	0	0	0	0	0	111.8	R98 T100 L101 T105 S106 D107	R98-A103 HydrophobicContact CB-CB 3.76Å; R98-A103 HydrophobicContact CG-CB 3.7Å; T100-A103 PolarHBondContact O-N 3.29Å; T100-A103 VanDerWaalsContact O-N 3.13Å; T100-A103 WeakPolarHBondContact OG1-CB 3.38Å; T100-A103 PolarHBondContact OG1-N 3.11Å; L101-A103 VanDerWaalsContact C-N 3.34Å; L101-A103 PolarHBondContact O-N 3.38Å; A103-T105 VanDerWaalsContact C-N 3.3Å; A103-T105 PolarHBondContact O-N 3.02Å; A103-S106 PolarHBondContact O-N 3.48Å; A103-D107 WeakPolarHBondContact O-CB 3.2Å; A103-D107 VanDerWaalsContact O-CG 3.26Å; A103-D107 PolarHBondContact O-N 3.08Å
104	V	72.2	Confident	71.2	Confident	8 Å²	8	38.3 Å²	38.3	5%	0.048	24%	0.237	C	C	.	.	H	α-helix	trans	-57	-46.4	171.5	176.7	0	0	0	0	110.4	V93 T96 R98 T100 L101 D107 V108 V218	V93-V104 HydrophobicContact CG1-CG1 4Å; V93-V104 HydrophobicContact CG2-CG1 4.26Å; T96-V104 HydrophobicContact CG2-CG1 4.29Å; T96-V104 WeakPolarHBondContact OG1-CG1 3.32Å; R98-V104 HydrophobicContact CB-CG2 3.79Å; T100-V104 PolarHBondContact O-N 2.85Å; T100-V104 VanDerWaalsContact O-N 3.08Å; L101-V104 PolarHBondContact O-N 3.3Å; V104-D107 PolarHBondContact O-N 3.03Å; V104-V108 HydrophobicContact CG1-CG2 4.18Å; V104-V108 WeakPolarHBondContact O-CB 3.38Å; V104-V108 WeakPolarHBondContact O-CG2 3.2Å; V104-V108 PolarHBondContact O-N 2.92Å; V104-V218 HydrophobicContact CG1-CG1 3.98Å
105	T	69.6	Low	70.9	Confident	13 Å²	13	38.7 Å²	38.7	8%	0.08	23%	0.226	C	C	.	.	H	α-helix	trans	-64.5	-43.7	-179.6	-52.6	0	0	0	0	111	L101 S102 A103 V108 Y109 D214 A215 V218	L101-T105 WeakPolarHBondContact O-CB 3.12Å; L101-T105 PolarHBondContact O-N 3.24Å; L101-T105 PolarHBondContact O-OG1 2.75Å; S102-T105 WeakPolarHBondContact O-CB 3.44Å; S102-T105 PolarHBondContact O-N 3.38Å; A103-T105 VanDerWaalsContact C-N 3.3Å; A103-T105 PolarHBondContact O-N 3.02Å; T105-V108 PolarHBondContact O-N 3.16Å; T105-Y109 WeakPolarHBondContact O-CB 3.4Å; T105-Y109 PolarHBondContact O-N 2.89Å; T105-D214 VanDerWaalsContact CG2-C 3.47Å; T105-A215 HydrophobicContact CG2-CB 3.9Å; T105-A215 WeakPolarHBondContact OG1-CA 3.41Å; T105-V218 HydrophobicContact CG2-CG2 4.07Å
106	S	70.7	Confident	70.4	Confident	47 Å²	47	38.3 Å²	38.3	33%	0.329	22%	0.222	S	C	.	.	H	α-helix	trans	-63.5	-43.8	179	-166.1	0	0	0	0	111.6	S102 A103 S110	S102-S106 WeakPolarHBondContact O-CB 3.34Å; S102-S106 PolarHBondContact O-N 2.94Å; A103-S106 PolarHBondContact O-N 3.48Å; S106-S110 VanDerWaalsContact O-CB 3.3Å; S106-S110 WeakPolarHBondContact O-CB 3.26Å; S106-S110 PolarHBondContact O-N 3.16Å; S106-S110 PolarHBondContact O-OG 3.41Å
107	D	79.7	Confident	70.6	Confident	14 Å²	14	38.2 Å²	38.2	8%	0.075	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-47.1	176	-77.4	-11.6	0	0	0	111.3	T96 R98 A103 V104 S110 F111 F262	T96-D107 HydrophobicContact CG2-CB 3.77Å; R98-D107 WeakPolarHBondContact CG-OD2 3.2Å; R98-D107 IonicContact CZ-OD1 2.76Å; R98-D107 IonicContact CZ-OD2 3.31Å; R98-D107 IonicContact NE-OD1 3.21Å; R98-D107 PolarHBondContact NE-OD1 3.25Å; R98-D107 IonicContact NE-OD2 2.87Å; R98-D107 PolarHBondContact NE-OD2 3.13Å; R98-D107 IonicContact NH2-OD1 3.45Å; R98-D107 PolarHBondContact NH2-OD1 3.17Å; R98-D107 IonicContact NH2-OD2 2.83Å; A103-D107 WeakPolarHBondContact O-CB 3.2Å; A103-D107 VanDerWaalsContact O-CG 3.26Å; A103-D107 PolarHBondContact O-N 3.08Å; V104-D107 PolarHBondContact O-N 3.03Å; D107-S110 PolarHBondContact O-OG 2.92Å; D107-F111 WeakPolarHBondContact O-CB 3.49Å; D107-F111 PolarHBondContact O-N 3.47Å; D107-F111 VanDerWaalsContact O-N 3.14Å; D107-F262 HydrophobicContact CB-CD1 3.42Å; D107-F262 VanDerWaalsContact CB-CD1 3.42Å; D107-F262 HydrophobicContact CB-CE1 3.59Å; D107-F262 HydrophobicContact CB-CG 4.01Å; D107-F262 HydrophobicContact CB-CZ 4.3Å; D107-F262 VanDerWaalsContact CG-CD1 3.45Å; D107-F262 VanDerWaalsContact O-CE1 3.28Å; D107-F262 WeakPolarHBondContact O-CE1 3.22Å
108	V	78.1	Confident	70.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.3	-44.6	179.7	177	0	0	0	0	110.6	V89 I92 V93 T96 V104 T105 F111 V112 V213 V218	V89-V108 HydrophobicContact CG1-CG1 3.83Å; I92-V108 HydrophobicContact CG2-CB 4.35Å; I92-V108 HydrophobicContact CG2-CG1 4.45Å; I92-V108 HydrophobicContact CG2-CG2 3.89Å; V93-V108 HydrophobicContact CB-CG2 4.42Å; V93-V108 HydrophobicContact CG2-CG1 4.46Å; V93-V108 HydrophobicContact CG2-CG2 3.53Å; T96-V108 HydrophobicContact CG2-CG2 4.11Å; V104-V108 HydrophobicContact CG1-CG2 4.18Å; V104-V108 WeakPolarHBondContact O-CB 3.38Å; V104-V108 WeakPolarHBondContact O-CG2 3.2Å; V104-V108 PolarHBondContact O-N 2.92Å; T105-V108 PolarHBondContact O-N 3.16Å; V108-F111 PolarHBondContact O-N 3.26Å; V108-V112 HydrophobicContact CG1-CG2 4.05Å; V108-V112 WeakPolarHBondContact O-CB 3.26Å; V108-V112 WeakPolarHBondContact O-CG2 3.41Å; V108-V112 PolarHBondContact O-N 3.27Å; V108-V213 HydrophobicContact CG1-CG1 3.83Å; V108-V218 HydrophobicContact CG1-CG2 4.43Å
109	Y	72.6	Confident	71.2	Confident	64 Å²	64	37.3 Å²	37.3	25%	0.251	22%	0.222	S	C	.	.	H	α-helix	trans	-62.1	-50	178.6	175.9	-93.2	0	0	0	110.8	T105 F111 V112 S113 I210 V213	T105-Y109 WeakPolarHBondContact O-CB 3.4Å; T105-Y109 PolarHBondContact O-N 2.89Å; Y109-F111 VanDerWaalsContact C-N 3.29Å; Y109-F111 PolarHBondContact O-N 2.99Å; Y109-V112 PolarHBondContact O-N 2.96Å; Y109-S113 VanDerWaalsContact O-CB 3.24Å; Y109-S113 WeakPolarHBondContact O-CB 3.21Å; Y109-S113 PolarHBondContact O-N 2.73Å; Y109-S113 PolarHBondContact O-OG 2.95Å; Y109-S113 VanDerWaalsContact O-OG 3.1Å; Y109-I210 HydrophobicContact CE2-CG2 4.08Å; Y109-V213 HydrophobicContact CD2-CB 4.03Å; Y109-V213 WeakPolarHBondContact CD2-O 3.29Å
110	S	72.8	Confident	71.6	Confident	58 Å²	58	35.1 Å²	35.1	41%	0.406	21%	0.206	S	C	.	.	H	α-helix	trans	-62.8	-37.6	-178.1	76.6	0	0	0	0	112	S106 D107 S113	S106-S110 VanDerWaalsContact O-CB 3.3Å; S106-S110 WeakPolarHBondContact O-CB 3.26Å; S106-S110 PolarHBondContact O-N 3.16Å; S106-S110 PolarHBondContact O-OG 3.41Å; D107-S110 PolarHBondContact O-OG 2.92Å; S110-S113 PolarHBondContact O-OG 3.18Å; S110-S113 VanDerWaalsContact O-OG 3.13Å
111	F	80.2	Confident	71.7	Confident	25 Å²	25	35.4 Å²	35.4	11%	0.11	21%	0.205	C	C	.	.	H	α-helix	trans	-73.1	-47.5	176.2	-169.6	-91.5	0	0	0	111.5	I92 D107 V108 Y109 H115 F117 W251 F255 P260 F262	I92-F111 HydrophobicContact CD1-CD1 3.52Å; I92-F111 HydrophobicContact CD1-CE1 4.04Å; I92-F111 HydrophobicContact CG1-CD1 4.25Å; D107-F111 WeakPolarHBondContact O-CB 3.49Å; D107-F111 PolarHBondContact O-N 3.47Å; D107-F111 VanDerWaalsContact O-N 3.14Å; V108-F111 PolarHBondContact O-N 3.26Å; Y109-F111 VanDerWaalsContact C-N 3.29Å; Y109-F111 PolarHBondContact O-N 2.99Å; F111-H115 AromaticContact CD2-CE1 3.74Å; F111-H115 AromaticContact CD2-ND1 3.73Å; F111-H115 HydrophobicContact CE1-CB 4.22Å; F111-H115 AromaticContact CE1-ND1 3.96Å; F111-H115 AromaticContact CE2-CE1 3.5Å; F111-H115 AromaticContact CE2-ND1 3.65Å; F111-H115 AromaticContact CE2-NE2 3.97Å; F111-H115 AromaticContact CG-ND1 3.95Å; F111-H115 AromaticContact CZ-CE1 3.97Å; F111-H115 AromaticContact CZ-CG 3.91Å; F111-H115 AromaticContact CZ-ND1 3.78Å; F111-H115 PolarHBondContact O-N 2.8Å; F111-H115 PolarHBondContact O-ND1 3.16Å; F111-F117 HydrophobicContact CD1-CZ 4.08Å; F111-F117 HydrophobicContact CE1-CE1 4.18Å; F111-F117 AromaticContact CE1-CZ 3.94Å; F111-F117 HydrophobicContact CE1-CZ 3.94Å; F111-W251 HydrophobicContact CD1-CH2 4.49Å; F111-W251 AromaticContact CE1-CH2 3.63Å; F111-W251 HydrophobicContact CE1-CH2 3.63Å; F111-W251 AromaticContact CE1-CZ2 3.72Å; F111-W251 HydrophobicContact CE1-CZ2 3.72Å; F111-W251 HydrophobicContact CZ-CH2 4.12Å; F111-W251 AromaticContact CZ-CZ2 3.73Å; F111-W251 HydrophobicContact CZ-CZ2 3.73Å; F111-F255 HydrophobicContact CZ-CD1 4.34Å; F111-F255 HydrophobicContact CZ-CE1 4.17Å; F111-P260 HydrophobicContact CD1-CG 4.25Å; F111-P260 HydrophobicContact CD2-CB 3.53Å; F111-P260 HydrophobicContact CD2-CG 4.06Å; F111-P260 HydrophobicContact CE1-CG 4.07Å; F111-P260 HydrophobicContact CE2-CB 3.53Å; F111-P260 HydrophobicContact CE2-CG 3.87Å; F111-P260 HydrophobicContact CG-CB 4.06Å; F111-P260 HydrophobicContact CG-CG 4.23Å; F111-P260 HydrophobicContact CZ-CB 4.07Å; F111-P260 HydrophobicContact CZ-CG 3.86Å; F111-F262 HydrophobicContact CB-CE1 4.25Å; F111-F262 HydrophobicContact CB-CZ 3.99Å; F111-F262 HydrophobicContact CG-CZ 4.4Å
112	V	76.8	Confident	71.3	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-64.3	-47.4	-177.3	172.3	0	0	0	0	109.2	V89 I92 V108 Y109 D114 H115 F117 R208 V213	V89-V112 HydrophobicContact CG2-CG2 3.99Å; I92-V112 HydrophobicContact CD1-CG2 3.74Å; V108-V112 HydrophobicContact CG1-CG2 4.05Å; V108-V112 WeakPolarHBondContact O-CB 3.26Å; V108-V112 WeakPolarHBondContact O-CG2 3.41Å; V108-V112 PolarHBondContact O-N 3.27Å; Y109-V112 PolarHBondContact O-N 2.96Å; V112-D114 PolarHBondContact O-N 3.24Å; V112-H115 PolarHBondContact O-N 3.03Å; V112-H115 VanDerWaalsContact O-N 3.1Å; V112-F117 HydrophobicContact CB-CE2 4.32Å; V112-F117 HydrophobicContact CG1-CE2 4.09Å; V112-F117 HydrophobicContact CG2-CE2 4.03Å; V112-F117 HydrophobicContact CG2-CZ 4.11Å; V112-R208 VanDerWaalsContact CG1-NH1 3.25Å; V112-R208 PolarHBondContact O-NH1 3.24Å; V112-V213 HydrophobicContact CB-CG2 4.29Å; V112-V213 HydrophobicContact CG1-CG2 3.83Å
113	S	68.1	Low	70.7	Confident	34 Å²	34	38.7 Å²	38.7	24%	0.238	22%	0.216	C	C	.	.	H	α-helix	trans	-51.5	-35.6	-176.4	63.3	0	0	0	0	114	Y109 S110	Y109-S113 VanDerWaalsContact O-CB 3.24Å; Y109-S113 WeakPolarHBondContact O-CB 3.21Å; Y109-S113 PolarHBondContact O-N 2.73Å; Y109-S113 PolarHBondContact O-OG 2.95Å; Y109-S113 VanDerWaalsContact O-OG 3.1Å; S110-S113 PolarHBondContact O-OG 3.18Å; S110-S113 VanDerWaalsContact O-OG 3.13Å
114	D	65.8	Low	69.7	Low	123 Å²	123	40.7 Å²	40.7	66%	0.658	22%	0.218	S	C	*	.	H	α-helix	trans	-96.1	-8.3	-172	-66.2	4.8	0	0	0	113.4	V112	V112-D114 PolarHBondContact O-N 3.24Å
115	H	73	Confident	68.3	Low	54 Å²	54	44.8 Å²	44.8	25%	0.25	24%	0.244	C	C	.	.			trans	-127.8	139.8	-172.6	-60.5	91	0	0	0	112.4	F111 V112 R208 F255	F111-H115 AromaticContact CD2-CE1 3.74Å; F111-H115 AromaticContact CD2-ND1 3.73Å; F111-H115 HydrophobicContact CE1-CB 4.22Å; F111-H115 AromaticContact CE1-ND1 3.96Å; F111-H115 AromaticContact CE2-CE1 3.5Å; F111-H115 AromaticContact CE2-ND1 3.65Å; F111-H115 AromaticContact CE2-NE2 3.97Å; F111-H115 AromaticContact CG-ND1 3.95Å; F111-H115 AromaticContact CZ-CE1 3.97Å; F111-H115 AromaticContact CZ-CG 3.91Å; F111-H115 AromaticContact CZ-ND1 3.78Å; F111-H115 PolarHBondContact O-N 2.8Å; F111-H115 PolarHBondContact O-ND1 3.16Å; V112-H115 PolarHBondContact O-N 3.03Å; V112-H115 VanDerWaalsContact O-N 3.1Å; H115-R208 PolarHBondContact O-NH2 2.94Å; H115-F255 HydrophobicContact CB-CD2 4.48Å; H115-F255 HydrophobicContact CB-CE2 3.76Å; H115-F255 HydrophobicContact CB-CZ 4.02Å; H115-F255 AromaticContact CD2-CZ 3.39Å; H115-F255 WeakPolarHBondContact CD2-CZ 3.39Å; H115-F255 AromaticContact CG-CZ 3.96Å
116	Y	73.4	Confident	67.1	Low	39 Å²	39	45.7 Å²	45.7	15%	0.153	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-99.9	136.3	173.1	-61.9	-82.5	0	0	0	111.6	E120 V122 F142 I189 L205 P206 R208 F255	Y116-E120 WeakPolarHBondContact CA-OE2 3.29Å; Y116-V122 HydrophobicContact CD1-CG1 3.29Å; Y116-V122 HydrophobicContact CE1-CB 4.39Å; Y116-V122 HydrophobicContact CE1-CG1 3.33Å; Y116-V122 HydrophobicContact CG-CG1 4.3Å; Y116-F142 HydrophobicContact CD2-CE1 4.07Å; Y116-F142 AromaticContact CD2-CZ 3.77Å; Y116-F142 HydrophobicContact CD2-CZ 3.77Å; Y116-F142 HydrophobicContact CE2-CZ 4.47Å; Y116-F142 HydrophobicContact CG-CZ 4.28Å; Y116-I189 HydrophobicContact CD1-CD1 4.16Å; Y116-I189 HydrophobicContact CG-CD1 3.87Å; Y116-L205 HydrophobicContact CD2-CD1 4.46Å; Y116-L205 HydrophobicContact CE2-CD1 4.01Å; Y116-P206 PolarHBondContact OH-O 2.91Å; Y116-R208 HydrophobicContact CD1-CG 4.48Å; Y116-R208 HydrophobicContact CE1-CB 4.29Å; Y116-R208 HydrophobicContact CE1-CG 3.77Å; Y116-F255 VanDerWaalsContact O-CD2 3.29Å; Y116-F255 WeakPolarHBondContact O-CD2 3.36Å; Y116-F255 VanDerWaalsContact O-CE2 3.3Å; Y116-F255 WeakPolarHBondContact O-CE2 3.35Å
117	F	77.6	Confident	65.7	Low	1 Å²	1	48.3 Å²	48.3	0%	0.004	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-98.4	155	-175.2	-64.4	-84.2	0	0	0	112.9	L85 P88 I92 F111 V112 G119 E120 W251 F255	L85-F117 HydrophobicContact CD2-CB 4.26Å; L85-F117 HydrophobicContact CD2-CD2 3.6Å; L85-F117 HydrophobicContact CD2-CE2 4.42Å; L85-F117 HydrophobicContact CD2-CG 4.27Å; P88-F117 HydrophobicContact CB-CB 4.29Å; P88-F117 HydrophobicContact CB-CD1 3.35Å; P88-F117 HydrophobicContact CB-CD2 4.11Å; P88-F117 HydrophobicContact CB-CE1 3.59Å; P88-F117 HydrophobicContact CB-CE2 4.32Å; P88-F117 HydrophobicContact CB-CG 3.62Å; P88-F117 HydrophobicContact CB-CZ 4.08Å; P88-F117 HydrophobicContact CG-CB 3.83Å; P88-F117 HydrophobicContact CG-CD1 3.76Å; P88-F117 HydrophobicContact CG-CD2 4.47Å; P88-F117 HydrophobicContact CG-CE1 4.48Å; P88-F117 HydrophobicContact CG-CG 3.74Å; I92-F117 HydrophobicContact CD1-CE1 3.98Å; I92-F117 HydrophobicContact CD1-CZ 3.61Å; F111-F117 HydrophobicContact CD1-CZ 4.08Å; F111-F117 HydrophobicContact CE1-CE1 4.18Å; F111-F117 AromaticContact CE1-CZ 3.94Å; F111-F117 HydrophobicContact CE1-CZ 3.94Å; V112-F117 HydrophobicContact CB-CE2 4.32Å; V112-F117 HydrophobicContact CG1-CE2 4.09Å; V112-F117 HydrophobicContact CG2-CE2 4.03Å; V112-F117 HydrophobicContact CG2-CZ 4.11Å; F117-G119 PolarHBondContact O-N 3.33Å; F117-E120 PolarHBondContact N-OE2 3.02Å; F117-E120 WeakPolarHBondContact O-CB 3.3Å; F117-E120 PolarHBondContact O-N 3.31Å; F117-W251 AromaticContact CE1-CH2 3.88Å; F117-W251 HydrophobicContact CE1-CH2 3.88Å; F117-W251 HydrophobicContact CE1-CZ3 4.42Å; F117-F255 HydrophobicContact CD1-CB 3.94Å; F117-F255 HydrophobicContact CD1-CD2 4.06Å; F117-F255 HydrophobicContact CD1-CG 4.33Å; F117-F255 HydrophobicContact CE1-CB 4.1Å; F117-F255 HydrophobicContact CE1-CD2 4.19Å; F117-F255 HydrophobicContact CE1-CG 4.29Å
118	I	74.2	Confident	63.8	Low	49 Å²	49	58 Å²	58	25%	0.251	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	125.4	178.9	-63.2	172.8	0	0	0	108.9	P191 K252 L254	I118-P191 HydrophobicContact CD1-CG 4.08Å; I118-K252 WeakPolarHBondContact CD1-O 2.91Å; I118-L254 PolarHBondContact N-O 2.79Å
119	G	74.1	Confident	61.7	Low	35 Å²	35	62 Å²	62	36%	0.361	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	-1.5	-176.8	0	0	0	0	0	115.9	T84 F117 D121 I189	T84-G119 VanDerWaalsContact CG2-O 3.27Å; T84-G119 WeakPolarHBondContact CG2-O 3.41Å; F117-G119 PolarHBondContact O-N 3.33Å; G119-D121 PolarHBondContact O-N 3.3Å; G119-I189 PolarHBondContact N-O 2.86Å
120	E	71.5	Confident	59.9	Low	11 Å²	11	67.6 Å²	67.6	5%	0.051	38%	0.377	C	S	.	.			trans	-63.5	130.1	171.8	-173.9	179.2	159.5	0	0	111.2	L85 Y116 F117 V122 Y187 I189 R208	L85-E120 HydrophobicContact CD2-CG 4.23Å; Y116-E120 WeakPolarHBondContact CA-OE2 3.29Å; F117-E120 PolarHBondContact N-OE2 3.02Å; F117-E120 WeakPolarHBondContact O-CB 3.3Å; F117-E120 PolarHBondContact O-N 3.31Å; E120-V122 HydrophobicContact CG-CG1 4.42Å; E120-V122 PolarHBondContact O-N 3.31Å; E120-Y187 VanDerWaalsContact O-O 3.09Å; E120-I189 HydrophobicContact CB-CD1 4.45Å; E120-R208 IonicContact OE1-CZ 2.79Å; E120-R208 IonicContact OE1-NE 2.66Å; E120-R208 PolarHBondContact OE1-NE 3.04Å; E120-R208 IonicContact OE1-NH2 3.13Å; E120-R208 PolarHBondContact OE1-NH2 3.43Å; E120-R208 IonicContact OE2-CZ 3.61Å; E120-R208 IonicContact OE2-NE 3.4Å; E120-R208 IonicContact OE2-NH2 3.34Å; E120-R208 PolarHBondContact OE2-NH2 2.72Å
121	D	62.9	Low	57.9	Low	76 Å²	76	71.8 Å²	71.8	41%	0.406	38%	0.384	S	S	.	.			trans	-74.3	113.6	171.5	-78.7	-26.4	0	0	0	108.2	G119 R186	G119-D121 PolarHBondContact O-N 3.3Å; D121-R186 HydrophobicContact CB-CG 4.44Å; D121-R186 WeakPolarHBondContact OD2-CD 3.47Å; D121-R186 IonicContact OD2-CZ 3.88Å; D121-R186 IonicContact OD2-NE 3.91Å; D121-R186 IonicContact OD2-NH1 3.9Å; D121-R186 PolarHBondContact OD2-NH1 3.42Å
122	V	56.6	Low	55.9	Low	12 Å²	12	79.3 Å²	79.3	7%	0.073	41%	0.413	C	S	.	.	B	Isolated β-bridge	trans	-104.1	164.8	172	-67.7	0	0	0	0	111.2	Y116 E120 I140 Y187 I189	Y116-V122 HydrophobicContact CD1-CG1 3.29Å; Y116-V122 HydrophobicContact CE1-CB 4.39Å; Y116-V122 HydrophobicContact CE1-CG1 3.33Å; Y116-V122 HydrophobicContact CG-CG1 4.3Å; E120-V122 HydrophobicContact CG-CG1 4.42Å; E120-V122 PolarHBondContact O-N 3.31Å; V122-I140 HydrophobicContact CG2-CD1 3.72Å; V122-Y187 HydrophobicContact CG2-CD2 4.05Å; V122-Y187 HydrophobicContact CG2-CG 4.21Å; V122-Y187 PolarHBondContact N-O 3.33Å; V122-Y187 WeakPolarHBondContact O-CD2 3.39Å; V122-Y187 PolarHBondContact O-N 3.36Å; V122-I189 HydrophobicContact CG1-CD1 4.08Å
123	E	49.3	Very low	53.9	Low	123 Å²	123	84.9 Å²	84.9	58%	0.575	45%	0.446	S	S	*	.			trans	-113.9	140.2	166.3	-85	-172.7	-163.8	0	0	109.6	S184	E123-S184 WeakPolarHBondContact OE1-CB 3.49Å; E123-S184 PolarHBondContact OE1-OG 3.06Å
124	Y	44.4	Very low	52.4	Low	67 Å²	67	92 Å²	92	26%	0.263	47%	0.469	S	S	.	.			trans	-115.4	119.6	-178.9	172.2	-98.2	0	0	0	109.5	Y187 L205	Y124-Y187 VanDerWaalsContact CB-CZ 3.43Å; Y124-Y187 WeakPolarHBondContact CB-OH 3.4Å; Y124-L205 HydrophobicContact CD2-CD2 3.81Å; Y124-L205 HydrophobicContact CE2-CD2 4.43Å
125	T	44.1	Very low	51.3	Low	95 Å²	95	90.3 Å²	90.3	58%	0.583	47%	0.465	S	S	*	.			trans	-103.4	117.4	168.5	50.2	0	0	0	0	109.5	P206	T125-P206 WeakPolarHBondContact OG1-CG 3.46Å
126	G	42.7	Very low	50	Low	32 Å²	32	91.2 Å²	91.2	33%	0.33	48%	0.476	S	S	.	.			trans	-69.7	140.1	-176.9	0	0	0	0	0	113.4	R128 G129	G126-R128 PolarHBondContact O-N 3.12Å; G126-G129 PolarHBondContact O-N 3.31Å
127	A	41.1	Very low	48.9	Very low	102 Å²	102	94.3 Å²	94.3	84%	0.843	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	9.1	-173.2	0	0	0	0	0	117.8
128	R	40.2	Very low	47.8	Very low	218 Å²	218	95.1 Å²	95.1	82%	0.823	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149	35.4	-179	-69	-169.4	-178.7	167.4	2	114	G126 R130	G126-R128 PolarHBondContact O-N 3.12Å; R128-R130 PolarHBondContact O-N 3.02Å
129	G	33.9	Very low	47.2	Very low	82 Å²	82	95 Å²	95	85%	0.845	49%	0.49	S	S	*	.			trans	50.8	17.8	171.7	0	0	0	0	0	116.1	G126	G126-G129 PolarHBondContact O-N 3.31Å
130	R	34.4	Very low	46.7	Very low	183 Å²	183	93.4 Å²	93.4	69%	0.691	47%	0.473	S	S	*	.			trans	-95.1	106.7	179.9	-82.1	-172.7	-177.3	-175.8	-0	106.6	R128 Y132	R128-R130 PolarHBondContact O-N 3.02Å; R130-Y132 HydrophobicContact CB-CE2 4.31Å; R130-Y132 WeakPolarHBondContact O-CD2 3.47Å; R130-Y132 PolarHBondContact O-N 3.46Å
131	R	32.7	Very low	46.5	Very low	146 Å²	146	93.2 Å²	93.2	55%	0.551	47%	0.472	S	S	*	.			trans	-59.2	119.5	169.5	-76.9	179.8	170.6	139.3	-8.8	109.3	E179	R131-E179 IonicContact CZ-OE2 2.64Å; R131-E179 VanDerWaalsContact NH1-CG 3.32Å; R131-E179 IonicContact NH1-OE1 2.92Å; R131-E179 PolarHBondContact NH1-OE1 2.97Å; R131-E179 IonicContact NH1-OE2 3.69Å; R131-E179 PolarHBondContact NH1-OE2 2.79Å; R131-E179 IonicContact NH2-OE2 2.9Å
132	Y	36.3	Very low	46.4	Very low	183 Å²	183	90.4 Å²	90.4	72%	0.718	46%	0.456	S	S	*	.			trans	-101.8	134.2	163.8	-67.6	-84.3	0	0	0	107.9	R130	R130-Y132 HydrophobicContact CB-CE2 4.31Å; R130-Y132 WeakPolarHBondContact O-CD2 3.47Å; R130-Y132 PolarHBondContact O-N 3.46Å
133	V	35	Very low	46.6	Very low	117 Å²	117	90.5 Å²	90.5	71%	0.709	46%	0.457	S	S	*	.			trans	-118	90.2	-179.7	179.5	0	0	0	0	107.6
134	Y	36.5	Very low	47	Very low	184 Å²	184	91.5 Å²	91.5	72%	0.722	46%	0.46	S	S	*	.			trans	-153.5	156.5	171.8	-77.7	-69.5	0	0	0	111.4
135	P	43.6	Very low	47.3	Very low	88 Å²	88	92.6 Å²	92.6	57%	0.571	48%	0.478	S	S	*	.			trans	-70.2	167.6	-154.3	-13.3	28.9	0	0	0	115.7
136	P	46.1	Very low	47.8	Very low	72 Å²	72	89.6 Å²	89.6	47%	0.468	47%	0.466	S	S	.	.	S	Bend	trans	-83.6	154.1	-157.7	35.6	-34.1	0	0	0	113.1	L185	P136-L185 HydrophobicContact CB-CD2 4.35Å
137	Y	50.4	Low	48.5	Very low	104 Å²	104	91 Å²	91	41%	0.408	47%	0.467	S	S	.	.			trans	91.5	89.7	-179.8	-55.1	-72.7	0	0	0	116.3
138	L	54.2	Low	49.4	Very low	19 Å²	19	86.5 Å²	86.5	10%	0.099	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.5	170.3	-175.1	88.5	0	0	0	106.9	I151 W153 Y187 G188	L138-I151 HydrophobicContact CD1-CG2 3.75Å; L138-I151 HydrophobicContact CD2-CG2 3.11Å; L138-I151 HydrophobicContact CG-CG2 3.29Å; L138-W153 HydrophobicContact CD1-CB 4.31Å; L138-W153 HydrophobicContact CD1-CD2 3.15Å; L138-W153 HydrophobicContact CD1-CE3 3.55Å; L138-W153 HydrophobicContact CD1-CG 3.51Å; L138-W153 HydrophobicContact CD1-CH2 3.99Å; L138-W153 HydrophobicContact CD1-CZ2 3.65Å; L138-W153 HydrophobicContact CD1-CZ3 3.95Å; L138-Y187 HydrophobicContact CB-CD1 3.62Å; L138-Y187 HydrophobicContact CB-CE1 3.79Å; L138-Y187 HydrophobicContact CD2-CD1 3.79Å; L138-Y187 HydrophobicContact CD2-CE1 3.46Å; L138-Y187 VanDerWaalsContact CD2-CE1 3.46Å; L138-Y187 HydrophobicContact CG-CD1 4.17Å; L138-Y187 HydrophobicContact CG-CE1 4.22Å; L138-Y187 WeakPolarHBondContact O-CA 3.27Å; L138-G188 PolarHBondContact O-N 3.23Å
139	F	61.9	Low	50.4	Low	47 Å²	47	78.7 Å²	78.7	21%	0.206	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	130.3	179.4	-73.4	-64.3	0	0	0	110.1	Y141 I151 E152 S154 G188 K190	F139-Y141 HydrophobicContact CB-CD2 4.38Å; F139-Y141 HydrophobicContact CB-CE2 3.62Å; F139-I151 CarbonylContact O-C 3.56Å; F139-I151 VanDerWaalsContact O-CA 3.28Å; F139-I151 WeakPolarHBondContact O-CA 3.31Å; F139-E152 PolarHBondContact N-O 3.02Å; F139-E152 PolarHBondContact O-N 3.14Å; F139-S154 VanDerWaalsContact CE2-CB 3.42Å; F139-G188 WeakPolarHBondContact CA-O 3.13Å; F139-K190 HydrophobicContact CB-CD 4.33Å; F139-K190 HydrophobicContact CD1-CD 3.5Å; F139-K190 VanDerWaalsContact CD1-CD 3.5Å; F139-K190 HydrophobicContact CD1-CG 3.8Å; F139-K190 HydrophobicContact CD2-CD 4.34Å; F139-K190 HydrophobicContact CE1-CD 3.82Å; F139-K190 HydrophobicContact CE1-CG 4.25Å; F139-K190 HydrophobicContact CG-CD 3.82Å; F139-K190 HydrophobicContact CG-CG 4.44Å; F139-K190 HydrophobicContact CZ-CD 4.36Å; F139-K190 VanDerWaalsContact CZ-NZ 3.3Å
140	I	62.4	Low	51.8	Low	1 Å²	1	75.1 Å²	75.1	1%	0.005	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	121.5	174.8	-56.3	176	0	0	0	108.3	V122 F142 V148 Y187 G188 K190 L205	V122-I140 HydrophobicContact CG2-CD1 3.72Å; I140-F142 HydrophobicContact CB-CE2 4.14Å; I140-F142 HydrophobicContact CG2-CD2 3.9Å; I140-F142 HydrophobicContact CG2-CE2 3.43Å; I140-F142 VanDerWaalsContact CG2-CE2 3.43Å; I140-F142 HydrophobicContact CG2-CZ 4.14Å; I140-V148 HydrophobicContact CG2-CB 4.22Å; I140-V148 HydrophobicContact CG2-CG1 3.57Å; I140-V148 HydrophobicContact CG2-CG2 3.61Å; I140-Y187 HydrophobicContact CD1-CD1 4.25Å; I140-Y187 HydrophobicContact CD1-CG 3.94Å; I140-Y187 HydrophobicContact CG1-CD1 4.41Å; I140-Y187 HydrophobicContact CG1-CG 4.44Å; I140-G188 PolarHBondContact N-O 3.15Å; I140-K190 PolarHBondContact O-N 3.11Å; I140-L205 HydrophobicContact CD1-CD1 4.49Å; I140-L205 HydrophobicContact CD1-CD2 4.22Å; I140-L205 HydrophobicContact CG2-CD1 4.48Å
141	Y	66.9	Low	53.1	Low	6 Å²	6	68.7 Å²	68.7	2%	0.024	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	118.8	-175.9	-67.6	-88	0	0	0	110.8	F139 K149 S150 E152 K190 P191 E194 C195	F139-Y141 HydrophobicContact CB-CD2 4.38Å; F139-Y141 HydrophobicContact CB-CE2 3.62Å; Y141-K149 PolarHBondContact O-N 3.25Å; Y141-S150 PolarHBondContact N-O 2.85Å; Y141-S150 PolarHBondContact O-N 3.14Å; Y141-E152 HydrophobicContact CD2-CB 4.23Å; Y141-E152 HydrophobicContact CE2-CB 3.37Å; Y141-E152 HydrophobicContact CE2-CG 4.45Å; Y141-E152 VanDerWaalsContact CZ-OE2 3.3Å; Y141-E152 PolarHBondContact OH-OE2 2.68Å; Y141-K190 WeakPolarHBondContact CA-O 3.2Å; Y141-K190 HydrophobicContact CD1-CB 3.9Å; Y141-K190 HydrophobicContact CE1-CB 3.78Å; Y141-K190 HydrophobicContact CE1-CD 4.14Å; Y141-P191 WeakPolarHBondContact CD1-O 3.38Å; Y141-E194 HydrophobicContact CE1-CB 4.13Å; Y141-C195 HydrophobicContact CD1-CB 3.89Å; Y141-C195 HydrophobicContact CE1-CB 4.06Å; Y141-C195 HydrophobicContact CG-CB 4.12Å
142	F	61.3	Low	54.4	Low	17 Å²	17	63.9 Å²	63.9	8%	0.075	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	140.2	-178.7	-75.6	-103.7	0	0	0	112.5	Y116 I140 G146 V147 V148 I189 K190 Y192 L205 N256	Y116-F142 HydrophobicContact CD2-CE1 4.07Å; Y116-F142 AromaticContact CD2-CZ 3.77Å; Y116-F142 HydrophobicContact CD2-CZ 3.77Å; Y116-F142 HydrophobicContact CE2-CZ 4.47Å; Y116-F142 HydrophobicContact CG-CZ 4.28Å; I140-F142 HydrophobicContact CB-CE2 4.14Å; I140-F142 HydrophobicContact CG2-CD2 3.9Å; I140-F142 HydrophobicContact CG2-CE2 3.43Å; I140-F142 VanDerWaalsContact CG2-CE2 3.43Å; I140-F142 HydrophobicContact CG2-CZ 4.14Å; F142-G146 VanDerWaalsContact CD1-O 3.27Å; F142-G146 WeakPolarHBondContact CD1-O 3.44Å; F142-V147 CarbonylContact C-O 3.57Å; F142-V147 WeakPolarHBondContact CA-O 3.48Å; F142-V148 HydrophobicContact CD1-CG2 3.92Å; F142-V148 HydrophobicContact CD2-CG2 4.34Å; F142-V148 HydrophobicContact CE1-CG2 3.43Å; F142-V148 VanDerWaalsContact CE1-CG2 3.43Å; F142-V148 HydrophobicContact CE2-CG2 3.91Å; F142-V148 HydrophobicContact CG-CG2 4.38Å; F142-V148 HydrophobicContact CZ-CG2 3.46Å; F142-V148 VanDerWaalsContact CZ-CG2 3.46Å; F142-I189 HydrophobicContact CD2-CG2 3.66Å; F142-I189 HydrophobicContact CE2-CB 4.46Å; F142-I189 HydrophobicContact CE2-CD1 3.77Å; F142-I189 HydrophobicContact CE2-CG1 3.92Å; F142-I189 HydrophobicContact CE2-CG2 3.87Å; F142-I189 HydrophobicContact CZ-CD1 4.27Å; F142-K190 PolarHBondContact N-O 3.34Å; F142-Y192 VanDerWaalsContact O-CB 3.22Å; F142-Y192 WeakPolarHBondContact O-CB 3.5Å; F142-Y192 PolarHBondContact O-N 3.17Å; F142-Y192 VanDerWaalsContact O-N 3.1Å; F142-L205 HydrophobicContact CE1-CD1 4.23Å; F142-L205 HydrophobicContact CE2-CD1 4.34Å; F142-L205 HydrophobicContact CZ-CD1 3.51Å; F142-N256 PolarHBondContact O-ND2 3.27Å; F142-N256 VanDerWaalsContact O-ND2 3.09Å
143	S	62.3	Low	55.4	Low	14 Å²	14	62.9 Å²	62.9	10%	0.098	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-65	165.6	166.8	65.9	0	0	0	0	111.3	S145 G146 V147	S143-S145 PolarHBondContact O-N 3.45Å; S143-S145 PolarHBondContact OG-N 3.44Å; S143-S145 PolarHBondContact OG-OG 2.96Å; S143-G146 PolarHBondContact O-N 2.96Å; S143-V147 PolarHBondContact N-O 3.49Å; S143-V147 WeakPolarHBondContact OG-CB 3.25Å; S143-V147 PolarHBondContact OG-N 2.95Å; S143-V147 VanDerWaalsContact OG-N 3.11Å; S143-V147 PolarHBondContact OG-O 2.92Å
144	K	56.5	Low	56.1	Low	144 Å²	144	59.1 Å²	59.1	63%	0.626	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-13.3	169	-63	-174.7	178.8	-176.8	0	114.7	N256 G257	K144-N256 WeakPolarHBondContact CA-O 3.24Å; K144-G257 WeakPolarHBondContact O-CA 3.46Å
145	S	51.7	Low	56.7	Low	91 Å²	91	55.6 Å²	55.6	64%	0.636	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	11	178.5	66.4	0	0	0	0	113	S143 V147	S143-S145 PolarHBondContact O-N 3.45Å; S143-S145 PolarHBondContact OG-N 3.44Å; S143-S145 PolarHBondContact OG-OG 2.96Å; S145-V147 VanDerWaalsContact C-N 3.29Å; S145-V147 PolarHBondContact O-N 2.76Å; S145-V147 WeakPolarHBondContact OG-CG2 3.5Å
146	G	54.5	Low	56.9	Low	32 Å²	32	59.1 Å²	59.1	33%	0.33	31%	0.309	S	S	.	.	S	Bend	trans	72.8	17	-178.7	0	0	0	0	0	114.5	F142 S143	F142-G146 VanDerWaalsContact CD1-O 3.27Å; F142-G146 WeakPolarHBondContact CD1-O 3.44Å; S143-G146 PolarHBondContact O-N 2.96Å
147	V	57.2	Low	56.8	Low	61 Å²	61	62.7 Å²	62.7	37%	0.37	32%	0.317	S	S	.	.			trans	-97.8	130.1	178.5	-178.9	0	0	0	0	109.6	F142 S143 S145 K149	F142-V147 CarbonylContact C-O 3.57Å; F142-V147 WeakPolarHBondContact CA-O 3.48Å; S143-V147 PolarHBondContact N-O 3.49Å; S143-V147 WeakPolarHBondContact OG-CB 3.25Å; S143-V147 PolarHBondContact OG-N 2.95Å; S143-V147 VanDerWaalsContact OG-N 3.11Å; S143-V147 PolarHBondContact OG-O 2.92Å; S145-V147 VanDerWaalsContact C-N 3.29Å; S145-V147 PolarHBondContact O-N 2.76Å; S145-V147 WeakPolarHBondContact OG-CG2 3.5Å; V147-K149 PolarHBondContact O-N 2.76Å; V147-K149 VanDerWaalsContact O-N 3.16Å
148	V	59	Low	56.1	Low	7 Å²	7	66.8 Å²	66.8	4%	0.042	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	118	172.4	177.9	0	0	0	0	109.8	I140 F142 I151 L205	I140-V148 HydrophobicContact CG2-CB 4.22Å; I140-V148 HydrophobicContact CG2-CG1 3.57Å; I140-V148 HydrophobicContact CG2-CG2 3.61Å; F142-V148 HydrophobicContact CD1-CG2 3.92Å; F142-V148 HydrophobicContact CD2-CG2 4.34Å; F142-V148 HydrophobicContact CE1-CG2 3.43Å; F142-V148 VanDerWaalsContact CE1-CG2 3.43Å; F142-V148 HydrophobicContact CE2-CG2 3.91Å; F142-V148 HydrophobicContact CG-CG2 4.38Å; F142-V148 HydrophobicContact CZ-CG2 3.46Å; F142-V148 VanDerWaalsContact CZ-CG2 3.46Å; V148-I151 HydrophobicContact CG1-CD1 4.47Å; V148-I151 HydrophobicContact CG1-CG1 4.1Å; V148-L205 HydrophobicContact CG2-CD1 3.45Å; V148-L205 VanDerWaalsContact CG2-CD1 3.45Å; V148-L205 HydrophobicContact CG2-CG 3.77Å
149	K	61.4	Low	55.6	Low	54 Å²	54	74.8 Å²	74.8	24%	0.235	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-31.8	-179	-75.7	-73	178.4	-164.1	0	113.5	Y141 V147 Y192 E202	Y141-K149 PolarHBondContact O-N 3.25Å; V147-K149 PolarHBondContact O-N 2.76Å; V147-K149 VanDerWaalsContact O-N 3.16Å; K149-Y192 HydrophobicContact CB-CD2 3.23Å; K149-Y192 HydrophobicContact CB-CE2 3.41Å; K149-Y192 VanDerWaalsContact CB-CE2 3.41Å; K149-Y192 HydrophobicContact CB-CG 3.87Å; K149-Y192 HydrophobicContact CG-CD2 4.06Å; K149-Y192 HydrophobicContact CG-CE2 4.3Å; K149-Y192 HydrophobicContact CG-CG 4.23Å; K149-E202 IonicContact NZ-OE1 3.14Å; K149-E202 PolarHBondContact NZ-OE1 2.82Å
150	S	63.7	Low	54.5	Low	8 Å²	8	81.6 Å²	81.6	6%	0.056	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	155.1	-176.1	159	0	0	0	0	110.7	Y141 C195	Y141-S150 PolarHBondContact N-O 2.85Å; Y141-S150 PolarHBondContact O-N 3.14Å; S150-C195 PolarHBondContact OG-SG 3.2Å
151	I	61.5	Low	53.1	Low	48 Å²	48	89.1 Å²	89.1	25%	0.246	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	115.1	173.9	-61.6	-179.2	0	0	0	106.7	L138 F139 V148	L138-I151 HydrophobicContact CD1-CG2 3.75Å; L138-I151 HydrophobicContact CD2-CG2 3.11Å; L138-I151 HydrophobicContact CG-CG2 3.29Å; F139-I151 CarbonylContact O-C 3.56Å; F139-I151 VanDerWaalsContact O-CA 3.28Å; F139-I151 WeakPolarHBondContact O-CA 3.31Å; V148-I151 HydrophobicContact CG1-CD1 4.47Å; V148-I151 HydrophobicContact CG1-CG1 4.1Å
152	E	59.8	Low	51.5	Low	45 Å²	45	97.5 Å²	97.5	21%	0.21	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137	-174.4	-150.3	177.9	-146.9	0	0	110.7	F139 Y141 K196 E197	F139-E152 PolarHBondContact N-O 3.02Å; F139-E152 PolarHBondContact O-N 3.14Å; Y141-E152 HydrophobicContact CD2-CB 4.23Å; Y141-E152 HydrophobicContact CE2-CB 3.37Å; Y141-E152 HydrophobicContact CE2-CG 4.45Å; Y141-E152 VanDerWaalsContact CZ-OE2 3.3Å; Y141-E152 PolarHBondContact OH-OE2 2.68Å; E152-K196 PolarHBondContact OE1-N 2.9Å; E152-E197 PolarHBondContact OE1-N 3.42Å
153	W	58.1	Low	50.4	Low	161 Å²	161	105.1 Å²	105.1	61%	0.61	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	127.8	175.6	-67	88	0	0	0	109.4	L138 P155	L138-W153 HydrophobicContact CD1-CB 4.31Å; L138-W153 HydrophobicContact CD1-CD2 3.15Å; L138-W153 HydrophobicContact CD1-CE3 3.55Å; L138-W153 HydrophobicContact CD1-CG 3.51Å; L138-W153 HydrophobicContact CD1-CH2 3.99Å; L138-W153 HydrophobicContact CD1-CZ2 3.65Å; L138-W153 HydrophobicContact CD1-CZ3 3.95Å; W153-P155 WeakPolarHBondContact O-CD 3.41Å
154	S	50.2	Low	49	Very low	39 Å²	39	113.3 Å²	113.3	27%	0.273	54%	0.542	S	S	.	.			trans	-97.2	120.2	174.9	-172.5	0	0	0	0	111.5	F139 E156	F139-S154 VanDerWaalsContact CE2-CB 3.42Å; S154-E156 VanDerWaalsContact C-N 3.27Å; S154-E156 PolarHBondContact O-N 3.47Å; S154-E156 PolarHBondContact OG-N 2.96Å
155	P	48.4	Very low	48.1	Very low	110 Å²	110	111.6 Å²	111.6	71%	0.714	55%	0.546	S	S	*	.			trans	-77.2	-5.9	171.5	-12.2	28.5	0	0	0	114	W153 K157	W153-P155 WeakPolarHBondContact O-CD 3.41Å; P155-K157 PolarHBondContact O-N 3.11Å
156	E	47.9	Very low	47.2	Very low	162 Å²	162	115.4 Å²	115.4	76%	0.757	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	18.8	-149.7	-73	-177.7	153.8	0	0	117.7	S154	S154-E156 VanDerWaalsContact C-N 3.27Å; S154-E156 PolarHBondContact O-N 3.47Å; S154-E156 PolarHBondContact OG-N 2.96Å
157	K	44.1	Very low	46.5	Very low	146 Å²	146	120.7 Å²	120.7	64%	0.635	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.3	26.1	173.7	-91.5	-161.9	179.3	-176.6	0	116.7	P155 K159 Y160	P155-K157 PolarHBondContact O-N 3.11Å; K157-K159 PolarHBondContact O-N 3.39Å; K157-Y160 PolarHBondContact O-N 3.05Å
158	E	36.1	Very low	45.7	Very low	190 Å²	190	125.7 Å²	125.7	89%	0.888	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	-9.1	174.6	-132.3	173.9	-166	0	0	115.3
159	K	41.9	Very low	44.6	Very low	188 Å²	188	131.1 Å²	131.1	82%	0.817	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-5	-178.7	-91.2	-177.2	175.4	178	0	117.1	K157	K157-K159 PolarHBondContact O-N 3.39Å
160	Y	39.1	Very low	43.5	Very low	189 Å²	189	135.2 Å²	135.2	74%	0.741	65%	0.647	S	S	*	*	S	Bend	trans	-102	-2.3	-172.7	-102.6	-88.1	0	0	0	115.9	K157	K157-Y160 PolarHBondContact O-N 3.05Å
161	F	33.9	Very low	42.4	Very low	160 Å²	160	139 Å²	139	70%	0.702	68%	0.679	S	S	*	*			trans	-121.8	35.8	-172.7	-79.9	-82	0	0	0	114.6	E163	F161-E163 PolarHBondContact O-N 3.16Å
162	E	33.7	Very low	41.2	Very low	181 Å²	181	147.2 Å²	147.2	85%	0.846	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	5.2	179.5	-80.5	-172.3	163.1	0	0	115.9
163	E	37.7	Very low	40.1	Very low	178 Å²	178	154 Å²	154	83%	0.832	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-4	-176.6	-76.1	-167.5	160.4	0	0	117.6	F161	F161-E163 PolarHBondContact O-N 3.16Å
164	F	32.9	Very low	38.9	Very low	185 Å²	185	149.7 Å²	149.7	81%	0.811	74%	0.744	S	S	*	*			trans	-142.7	109.5	174.6	-85.6	-86.4	0	0	0	113.1	F166	F164-F166 PolarHBondContact O-N 3.2Å
165	P	37.7	Very low	38.1	Very low	109 Å²	109	157 Å²	157	71%	0.708	77%	0.773	S	S	*	*			trans	-72.8	112.7	179.7	-5	19.7	0	0	0	111.3	N167	P165-N167 PolarHBondContact O-N 2.86Å
166	F	32.1	Very low	37.5	Very low	171 Å²	171	158.4 Å²	158.4	75%	0.75	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-6.4	-175.6	-149.8	-101.3	0	0	0	115.3	F164	F164-F166 PolarHBondContact O-N 3.2Å
167	N	40.1	Very low	36.9	Very low	143 Å²	143	157.1 Å²	157.1	77%	0.765	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-9.1	-168.3	-75.7	-26	0	0	0	116.1	P165	P165-N167 PolarHBondContact O-N 2.86Å
168	E	39.8	Very low	36.2	Very low	165 Å²	165	155.1 Å²	155.1	77%	0.771	79%	0.788	S	S	*	*	S	Bend	trans	-90.8	-17	-178.9	-85.8	-168.7	147.3	0	0	115.2
169	V	37.6	Very low	35.8	Very low	121 Å²	121	152.6 Å²	152.6	73%	0.733	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-80.5	-23	-174.7	-179.7	0	0	0	0	112.7	A171	V169-A171 PolarHBondContact O-N 3.24Å
170	I	37.6	Very low	35.2	Very low	140 Å²	140	152.4 Å²	152.4	72%	0.718	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-82.3	-10.4	-172.5	-62	177.8	0	0	0	113
171	A	39.9	Very low	34.9	Very low	88 Å²	88	154.3 Å²	154.3	73%	0.727	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-103.9	-0.8	-170.8	0	0	0	0	0	116.5	V169	V169-A171 PolarHBondContact O-N 3.24Å
172	R	37.8	Very low	34.7	Very low	221 Å²	221	154.9 Å²	154.9	83%	0.834	79%	0.794	S	S	*	*	S	Bend	trans	-123.8	-1.3	-165.8	-88	-172.5	177.7	170.9	3.6	119.8
173	Q	35.1	Very low	34.7	Very low	187 Å²	187	149 Å²	149	87%	0.874	78%	0.782	S	S	*	*			trans	-133.8	84.6	179.8	-68.5	-172.6	-4.6	0	0	112.5
174	G	32.6	Very low	34.6	Very low	70 Å²	70	143.9 Å²	143.9	72%	0.722	77%	0.766	S	S	*	*			trans	-85.2	139.4	154.7	0	0	0	0	0	109.3
175	Q	34.1	Very low	35	Very low	192 Å²	192	137.4 Å²	137.4	90%	0.897	74%	0.739	S	S	*	*			trans	86	77.4	-178.9	-55.5	-179.3	-21.5	0	0	116.1
176	T	36.3	Very low	35.3	Very low	140 Å²	140	138.9 Å²	138.9	86%	0.859	73%	0.731	S	S	*	*			trans	-171.6	148.5	133.5	28.5	0	0	0	0	109.4
177	T	34.8	Very low	36.6	Very low	136 Å²	136	131.2 Å²	131.2	83%	0.834	70%	0.697	S	S	*	*			trans	-67.7	127.6	-169.6	46.6	0	0	0	0	114.1
178	S	29.5	Very low	37.4	Very low	103 Å²	103	125.2 Å²	125.2	72%	0.72	67%	0.668	S	S	*	*	S	Bend	trans	10.8	131.9	144.3	110.9	0	0	0	0	116.9
179	E	28	Very low	38.5	Very low	137 Å²	137	117.7 Å²	117.7	64%	0.64	63%	0.634	S	S	*	*			cis	-166.3	103.9	22.7	-85.8	169.2	166.5	0	0	107.9	R131	R131-E179 IonicContact CZ-OE2 2.64Å; R131-E179 VanDerWaalsContact NH1-CG 3.32Å; R131-E179 IonicContact NH1-OE1 2.92Å; R131-E179 PolarHBondContact NH1-OE1 2.97Å; R131-E179 IonicContact NH1-OE2 3.69Å; R131-E179 PolarHBondContact NH1-OE2 2.79Å; R131-E179 IonicContact NH2-OE2 2.9Å
180	E	29.8	Very low	39.8	Very low	185 Å²	185	114.6 Å²	114.6	86%	0.864	61%	0.61	S	S	*	*			trans	-140.9	93.9	174.1	-84.6	-179.2	168.1	0	0	110
181	W	32	Very low	41	Very low	229 Å²	229	109 Å²	109	87%	0.867	58%	0.583	S	S	*	*			trans	-149.6	89.3	153.5	-86.5	92.7	0	0	0	106.2	G183	W181-G183 PolarHBondContact O-N 3.33Å
182	L	28.8	Very low	42.2	Very low	172 Å²	172	108.8 Å²	108.8	90%	0.901	56%	0.564	S	S	*	*			trans	-92.2	75	165.4	-81.1	155.6	0	0	0	106.7
183	G	34.8	Very low	43.6	Very low	57 Å²	57	104 Å²	104	59%	0.588	56%	0.555	S	S	*	*			trans	-95.7	111.6	171.5	0	0	0	0	0	108.9	W181 L185	W181-G183 PolarHBondContact O-N 3.33Å; G183-L185 PolarHBondContact O-N 2.85Å
184	S	35.6	Very low	45.2	Very low	71 Å²	71	100.1 Å²	100.1	50%	0.497	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-66.7	125.4	172.1	59.5	0	0	0	0	110.6	E123	E123-S184 WeakPolarHBondContact OE1-CB 3.49Å; E123-S184 PolarHBondContact OE1-OG 3.06Å
185	L	40.5	Very low	46.7	Very low	49 Å²	49	98.2 Å²	98.2	26%	0.257	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-81.2	120	170	-78.3	160.6	0	0	0	106.8	P136 G183 Y187	P136-L185 HydrophobicContact CB-CD2 4.35Å; G183-L185 PolarHBondContact O-N 2.85Å; L185-Y187 HydrophobicContact CB-CE1 4.19Å; L185-Y187 HydrophobicContact CB-CE2 3.79Å; L185-Y187 VanDerWaalsContact CB-CZ 3.45Å; L185-Y187 WeakPolarHBondContact CB-OH 3.12Å; L185-Y187 VanDerWaalsContact CD1-OH 3.31Å; L185-Y187 WeakPolarHBondContact CD1-OH 3.44Å; L185-Y187 VanDerWaalsContact O-CD2 3.24Å; L185-Y187 WeakPolarHBondContact O-CD2 3.24Å; L185-Y187 WeakPolarHBondContact O-CE2 3.22Å
186	R	43.6	Very low	47.9	Very low	140 Å²	140	97.4 Å²	97.4	53%	0.528	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-80.9	125.2	170.1	-69.6	-178.9	-172.2	-143.1	9	109.4	D121	D121-R186 HydrophobicContact CB-CG 4.44Å; D121-R186 WeakPolarHBondContact OD2-CD 3.47Å; D121-R186 IonicContact OD2-CZ 3.88Å; D121-R186 IonicContact OD2-NE 3.91Å; D121-R186 IonicContact OD2-NH1 3.9Å; D121-R186 PolarHBondContact OD2-NH1 3.42Å
187	Y	60.5	Low	48.9	Very low	10 Å²	10	98.5 Å²	98.5	4%	0.039	50%	0.501	C	S	.	.	B	Isolated β-bridge	trans	-107.1	142.5	175.8	-51.3	-88.9	0	0	0	109.7	E120 V122 Y124 L138 I140 L185	E120-Y187 VanDerWaalsContact O-O 3.09Å; V122-Y187 HydrophobicContact CG2-CD2 4.05Å; V122-Y187 HydrophobicContact CG2-CG 4.21Å; V122-Y187 PolarHBondContact N-O 3.33Å; V122-Y187 WeakPolarHBondContact O-CD2 3.39Å; V122-Y187 PolarHBondContact O-N 3.36Å; Y124-Y187 VanDerWaalsContact CB-CZ 3.43Å; Y124-Y187 WeakPolarHBondContact CB-OH 3.4Å; L138-Y187 HydrophobicContact CB-CD1 3.62Å; L138-Y187 HydrophobicContact CB-CE1 3.79Å; L138-Y187 HydrophobicContact CD2-CD1 3.79Å; L138-Y187 HydrophobicContact CD2-CE1 3.46Å; L138-Y187 VanDerWaalsContact CD2-CE1 3.46Å; L138-Y187 HydrophobicContact CG-CD1 4.17Å; L138-Y187 HydrophobicContact CG-CE1 4.22Å; L138-Y187 WeakPolarHBondContact O-CA 3.27Å; I140-Y187 HydrophobicContact CD1-CD1 4.25Å; I140-Y187 HydrophobicContact CD1-CG 3.94Å; I140-Y187 HydrophobicContact CG1-CD1 4.41Å; I140-Y187 HydrophobicContact CG1-CG 4.44Å; L185-Y187 HydrophobicContact CB-CE1 4.19Å; L185-Y187 HydrophobicContact CB-CE2 3.79Å; L185-Y187 VanDerWaalsContact CB-CZ 3.45Å; L185-Y187 WeakPolarHBondContact CB-OH 3.12Å; L185-Y187 VanDerWaalsContact CD1-OH 3.31Å; L185-Y187 WeakPolarHBondContact CD1-OH 3.44Å; L185-Y187 VanDerWaalsContact O-CD2 3.24Å; L185-Y187 WeakPolarHBondContact O-CD2 3.24Å; L185-Y187 WeakPolarHBondContact O-CE2 3.22Å
188	G	56	Low	49.4	Very low	16 Å²	16	95.9 Å²	95.9	17%	0.165	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	136.3	169.9	0	0	0	0	0	110.9	L138 F139 I140	L138-G188 PolarHBondContact O-N 3.23Å; F139-G188 WeakPolarHBondContact CA-O 3.13Å; I140-G188 PolarHBondContact N-O 3.15Å
189	I	62.6	Low	50.1	Low	8 Å²	8	95.1 Å²	95.1	4%	0.041	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	132.3	177.5	-64.9	-178.1	0	0	0	110.8	Y116 G119 E120 V122 F142	Y116-I189 HydrophobicContact CD1-CD1 4.16Å; Y116-I189 HydrophobicContact CG-CD1 3.87Å; G119-I189 PolarHBondContact N-O 2.86Å; E120-I189 HydrophobicContact CB-CD1 4.45Å; V122-I189 HydrophobicContact CG1-CD1 4.08Å; F142-I189 HydrophobicContact CD2-CG2 3.66Å; F142-I189 HydrophobicContact CE2-CB 4.46Å; F142-I189 HydrophobicContact CE2-CD1 3.77Å; F142-I189 HydrophobicContact CE2-CG1 3.92Å; F142-I189 HydrophobicContact CE2-CG2 3.87Å; F142-I189 HydrophobicContact CZ-CD1 4.27Å
190	K	66.4	Low	50.9	Low	56 Å²	56	93.6 Å²	93.6	24%	0.243	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154	178.3	-78.1	-172.7	167.9	177	0	113	F139 I140 Y141 F142	F139-K190 HydrophobicContact CB-CD 4.33Å; F139-K190 HydrophobicContact CD1-CD 3.5Å; F139-K190 VanDerWaalsContact CD1-CD 3.5Å; F139-K190 HydrophobicContact CD1-CG 3.8Å; F139-K190 HydrophobicContact CD2-CD 4.34Å; F139-K190 HydrophobicContact CE1-CD 3.82Å; F139-K190 HydrophobicContact CE1-CG 4.25Å; F139-K190 HydrophobicContact CG-CD 3.82Å; F139-K190 HydrophobicContact CG-CG 4.44Å; F139-K190 HydrophobicContact CZ-CD 4.36Å; F139-K190 VanDerWaalsContact CZ-NZ 3.3Å; I140-K190 PolarHBondContact O-N 3.11Å; Y141-K190 WeakPolarHBondContact CA-O 3.2Å; Y141-K190 HydrophobicContact CD1-CB 3.9Å; Y141-K190 HydrophobicContact CE1-CB 3.78Å; Y141-K190 HydrophobicContact CE1-CD 4.14Å; F142-K190 PolarHBondContact N-O 3.34Å
191	P	62.2	Low	51.8	Low	21 Å²	21	90.1 Å²	90.1	14%	0.136	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	135.5	171.3	-18	30.7	0	0	0	111.8	I118 Y141 D193 E194 N256	I118-P191 HydrophobicContact CD1-CG 4.08Å; Y141-P191 WeakPolarHBondContact CD1-O 3.38Å; P191-D193 PolarHBondContact O-N 2.88Å; P191-D193 VanDerWaalsContact O-N 3.07Å; P191-E194 PolarHBondContact O-N 3.3Å; P191-N256 WeakPolarHBondContact CA-ND2 3.28Å; P191-N256 HydrophobicContact CB-CB 4.37Å
192	Y	64.4	Low	52.4	Low	84 Å²	84	85.1 Å²	85.1	33%	0.329	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-55.9	-27.1	178.6	-178.8	-106.7	0	0	0	114.4	F142 K149 E194 C195	F142-Y192 VanDerWaalsContact O-CB 3.22Å; F142-Y192 WeakPolarHBondContact O-CB 3.5Å; F142-Y192 PolarHBondContact O-N 3.17Å; F142-Y192 VanDerWaalsContact O-N 3.1Å; K149-Y192 HydrophobicContact CB-CD2 3.23Å; K149-Y192 HydrophobicContact CB-CE2 3.41Å; K149-Y192 VanDerWaalsContact CB-CE2 3.41Å; K149-Y192 HydrophobicContact CB-CG 3.87Å; K149-Y192 HydrophobicContact CG-CD2 4.06Å; K149-Y192 HydrophobicContact CG-CE2 4.3Å; K149-Y192 HydrophobicContact CG-CG 4.23Å; Y192-E194 PolarHBondContact O-N 3.38Å; Y192-E194 VanDerWaalsContact O-N 3.12Å; Y192-C195 HydrophobicContact CD2-CB 4.29Å; Y192-C195 HydrophobicContact CE2-CB 4.4Å; Y192-C195 VanDerWaalsContact O-CB 3.25Å; Y192-C195 WeakPolarHBondContact O-CB 3.33Å; Y192-C195 PolarHBondContact O-N 2.56Å
193	D	68	Low	53.2	Low	121 Å²	121	82.7 Å²	82.7	65%	0.647	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-64.6	-14	178.3	-56.1	-15.2	0	0	0	112.8	P191	P191-D193 PolarHBondContact O-N 2.88Å; P191-D193 VanDerWaalsContact O-N 3.07Å
194	E	68.8	Low	53.7	Low	106 Å²	106	88 Å²	88	50%	0.495	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-92.1	-5.1	174.4	-64.7	-171.2	-179.2	0	0	114.7	Y141 P191 Y192 K196	Y141-E194 HydrophobicContact CE1-CB 4.13Å; P191-E194 PolarHBondContact O-N 3.3Å; Y192-E194 PolarHBondContact O-N 3.38Å; Y192-E194 VanDerWaalsContact O-N 3.12Å; E194-K196 PolarHBondContact O-N 3.14Å
195	C	64.4	Low	54.1	Low	30 Å²	30	85.9 Å²	85.9	20%	0.203	44%	0.44	C	S	.	.			trans	-67.2	121.9	-178	-170.9	0	0	0	0	110.5	Y141 S150 Y192	Y141-C195 HydrophobicContact CD1-CB 3.89Å; Y141-C195 HydrophobicContact CE1-CB 4.06Å; Y141-C195 HydrophobicContact CG-CB 4.12Å; S150-C195 PolarHBondContact OG-SG 3.2Å; Y192-C195 HydrophobicContact CD2-CB 4.29Å; Y192-C195 HydrophobicContact CE2-CB 4.4Å; Y192-C195 VanDerWaalsContact O-CB 3.25Å; Y192-C195 WeakPolarHBondContact O-CB 3.33Å; Y192-C195 PolarHBondContact O-N 2.56Å
196	K	59.7	Low	54.4	Low	175 Å²	175	85.8 Å²	85.8	76%	0.761	44%	0.442	S	S	*	.			trans	-87.7	-28.2	-172	-75.6	-175.7	179.5	173.5	0	114.3	E152 E194	E152-K196 PolarHBondContact OE1-N 2.9Å; E194-K196 PolarHBondContact O-N 3.14Å
197	E	57.2	Low	54.4	Low	163 Å²	163	82.7 Å²	82.7	76%	0.762	45%	0.454	S	S	*	.	S	Bend	trans	-142.9	145	179.9	-68	-175	162.2	0	0	113.5	E152	E152-E197 PolarHBondContact OE1-N 3.42Å
198	G	44.8	Very low	54	Low	80 Å²	80	84 Å²	84	83%	0.825	46%	0.459	S	S	*	.			trans	-87.3	127.9	-166	0	0	0	0	0	116.2
199	S	44.9	Very low	53.7	Low	88 Å²	88	91.8 Å²	91.8	62%	0.615	49%	0.491	S	S	*	.			trans	-148.9	111.4	142	60.9	0	0	0	0	108.6	E201	S199-E201 PolarHBondContact O-N 3.48Å
200	V	44.2	Very low	53	Low	105 Å²	105	96.5 Å²	96.5	64%	0.636	52%	0.515	S	S	*	.			trans	-80.1	101.3	179.4	-178.6	0	0	0	0	108.3
201	E	47.5	Very low	52.2	Low	112 Å²	112	95.1 Å²	95.1	52%	0.523	51%	0.512	S	S	.	.			trans	-123.8	105.5	161.3	-78.9	-167.3	175.5	0	0	108.4	S199 R203	S199-E201 PolarHBondContact O-N 3.48Å; E201-R203 HydrophobicContact CB-CG 4.42Å; E201-R203 PolarHBondContact O-N 3.38Å; E201-R203 IonicContact OE2-CZ 2.85Å; E201-R203 IonicContact OE2-NE 2.74Å; E201-R203 PolarHBondContact OE2-NE 3.41Å; E201-R203 IonicContact OE2-NH2 3.62Å; E201-R203 PolarHBondContact OE2-NH2 3.26Å
202	E	44.6	Very low	51.7	Low	123 Å²	123	101.8 Å²	101.8	58%	0.575	54%	0.535	S	S	*	.			trans	-64.1	118.3	168.1	-81.3	177	169.7	0	0	108.7	K149	K149-E202 IonicContact NZ-OE1 3.14Å; K149-E202 PolarHBondContact NZ-OE1 2.82Å
203	R	47.2	Very low	51.2	Low	121 Å²	121	98 Å²	98	46%	0.457	52%	0.52	S	S	.	.			trans	-129.9	128.5	177.4	-68.4	-175.3	178.6	-168.3	2.5	109.1	E201 L205	E201-R203 HydrophobicContact CB-CG 4.42Å; E201-R203 PolarHBondContact O-N 3.38Å; E201-R203 IonicContact OE2-CZ 2.85Å; E201-R203 IonicContact OE2-NE 2.74Å; E201-R203 PolarHBondContact OE2-NE 3.41Å; E201-R203 IonicContact OE2-NH2 3.62Å; E201-R203 PolarHBondContact OE2-NH2 3.26Å; R203-L205 PolarHBondContact O-N 2.9Å
204	I	44	Very low	50.5	Low	170 Å²	170	94.8 Å²	94.8	87%	0.872	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-74.9	120.8	176.4	-58.8	171.6	0	0	0	107.4
205	L	44.4	Very low	49.7	Very low	25 Å²	25	91.1 Å²	91.1	13%	0.131	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-70.8	145.3	167.6	-73.7	170.8	0	0	0	109.1	Y116 Y124 I140 F142 V148 R203	Y116-L205 HydrophobicContact CD2-CD1 4.46Å; Y116-L205 HydrophobicContact CE2-CD1 4.01Å; Y124-L205 HydrophobicContact CD2-CD2 3.81Å; Y124-L205 HydrophobicContact CE2-CD2 4.43Å; I140-L205 HydrophobicContact CD1-CD1 4.49Å; I140-L205 HydrophobicContact CD1-CD2 4.22Å; I140-L205 HydrophobicContact CG2-CD1 4.48Å; F142-L205 HydrophobicContact CE1-CD1 4.23Å; F142-L205 HydrophobicContact CE2-CD1 4.34Å; F142-L205 HydrophobicContact CZ-CD1 3.51Å; V148-L205 HydrophobicContact CG2-CD1 3.45Å; V148-L205 VanDerWaalsContact CG2-CD1 3.45Å; V148-L205 HydrophobicContact CG2-CG 3.77Å; R203-L205 PolarHBondContact O-N 2.9Å
206	P	46.1	Very low	49.3	Very low	47 Å²	47	90.4 Å²	90.4	31%	0.305	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-52.2	149.8	167.6	-14.5	25.2	0	0	0	110.3	Y116 T125	Y116-P206 PolarHBondContact OH-O 2.91Å; T125-P206 WeakPolarHBondContact OG1-CG 3.46Å
207	G	45.1	Very low	49.4	Very low	75 Å²	75	82.1 Å²	82.1	77%	0.773	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-53.1	140.6	171	0	0	0	0	0	110.4	E209	G207-E209 PolarHBondContact O-N 3.1Å
208	R	52.6	Low	49.6	Very low	37 Å²	37	74.4 Å²	74.4	14%	0.14	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-59.1	126	-177.6	-158	172.6	-176.5	-153.3	21.3	109.1	V112 H115 Y116 E120 I210	V112-R208 VanDerWaalsContact CG1-NH1 3.25Å; V112-R208 PolarHBondContact O-NH1 3.24Å; H115-R208 PolarHBondContact O-NH2 2.94Å; Y116-R208 HydrophobicContact CD1-CG 4.48Å; Y116-R208 HydrophobicContact CE1-CB 4.29Å; Y116-R208 HydrophobicContact CE1-CG 3.77Å; E120-R208 IonicContact OE1-CZ 2.79Å; E120-R208 IonicContact OE1-NE 2.66Å; E120-R208 PolarHBondContact OE1-NE 3.04Å; E120-R208 IonicContact OE1-NH2 3.13Å; E120-R208 PolarHBondContact OE1-NH2 3.43Å; E120-R208 IonicContact OE2-CZ 3.61Å; E120-R208 IonicContact OE2-NE 3.4Å; E120-R208 IonicContact OE2-NH2 3.34Å; E120-R208 PolarHBondContact OE2-NH2 2.72Å; R208-I210 PolarHBondContact O-N 3.05Å
209	E	48.5	Very low	50.2	Low	181 Å²	181	71.1 Å²	71.1	85%	0.846	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-65.1	122.7	164.1	-116.4	178.2	-175.6	0	0	107	G207 V211	G207-E209 PolarHBondContact O-N 3.1Å; E209-V211 PolarHBondContact O-N 3.3Å; E209-V211 VanDerWaalsContact O-N 3.11Å
210	I	47.2	Very low	51	Low	106 Å²	106	71.7 Å²	71.7	54%	0.544	37%	0.367	S	S	.	.			trans	-55.5	114.9	-159.8	-62.1	166.9	0	0	0	110.7	Y109 R208 Y212	Y109-I210 HydrophobicContact CE2-CG2 4.08Å; R208-I210 PolarHBondContact O-N 3.05Å; I210-Y212 PolarHBondContact O-N 2.82Å
211	V	50.2	Low	51.8	Low	28 Å²	28	66.9 Å²	66.9	17%	0.17	34%	0.337	C	S	.	.			trans	-68.3	118.4	162	-178.5	0	0	0	0	106.3	F81 L85 E209 V213	F81-V211 HydrophobicContact CE2-CG1 3.8Å; L85-V211 HydrophobicContact CD1-CB 4.22Å; L85-V211 HydrophobicContact CD1-CG1 3.58Å; L85-V211 HydrophobicContact CD1-CG2 3.76Å; E209-V211 PolarHBondContact O-N 3.3Å; E209-V211 VanDerWaalsContact O-N 3.11Å; V211-V213 HydrophobicContact CG1-CG2 4.13Å; V211-V213 PolarHBondContact O-N 3.45Å
212	Y	51.3	Low	52.4	Low	160 Å²	160	62.4 Å²	62.4	63%	0.627	32%	0.317	S	S	*	.			trans	-63.5	80.2	176.4	-69.9	-88.2	0	0	0	110.7	I210 D214	I210-Y212 PolarHBondContact O-N 2.82Å; Y212-D214 VanDerWaalsContact C-N 3.34Å; Y212-D214 PolarHBondContact O-N 2.73Å
213	V	53.8	Low	52.8	Low	4 Å²	4	59.7 Å²	59.7	2%	0.024	30%	0.303	C	S	.	.			trans	-90.6	78.9	163.8	-174.2	0	0	0	0	107.1	V108 Y109 V112 V211 L217 V218	V108-V213 HydrophobicContact CG1-CG1 3.83Å; Y109-V213 HydrophobicContact CD2-CB 4.03Å; Y109-V213 WeakPolarHBondContact CD2-O 3.29Å; V112-V213 HydrophobicContact CB-CG2 4.29Å; V112-V213 HydrophobicContact CG1-CG2 3.83Å; V211-V213 HydrophobicContact CG1-CG2 4.13Å; V211-V213 PolarHBondContact O-N 3.45Å; V213-L217 HydrophobicContact CB-CD2 4.31Å; V213-L217 HydrophobicContact CG1-CD2 4.19Å; V213-L217 HydrophobicContact CG2-CD2 4.2Å; V213-V218 HydrophobicContact CG1-CG2 3.86Å
214	D	54.8	Low	53	Low	54 Å²	54	58.1 Å²	58.1	29%	0.289	31%	0.307	S	S	.	.			trans	-95.9	166.8	175.9	65.8	8.4	0	0	0	110.7	T105 Y212 P216 L217 V218	T105-D214 VanDerWaalsContact CG2-C 3.47Å; Y212-D214 VanDerWaalsContact C-N 3.34Å; Y212-D214 PolarHBondContact O-N 2.73Å; D214-P216 HydrophobicContact CB-CG 4.38Å; D214-P216 WeakPolarHBondContact OD1-CB 3.49Å; D214-P216 VanDerWaalsContact OD1-CD 3.27Å; D214-P216 WeakPolarHBondContact OD1-CD 3.33Å; D214-L217 WeakPolarHBondContact O-CA 3.28Å; D214-L217 WeakPolarHBondContact O-CB 3.48Å; D214-L217 PolarHBondContact O-N 3.26Å; D214-L217 VanDerWaalsContact OD1-CB 3.3Å; D214-L217 WeakPolarHBondContact OD1-CB 3.31Å; D214-L217 PolarHBondContact OD1-N 3.2Å; D214-V218 PolarHBondContact O-N 3.35Å; D214-V218 VanDerWaalsContact O-N 3.07Å
215	A	52.4	Low	52.8	Low	30 Å²	30	51 Å²	51	25%	0.248	28%	0.275	C	S	.	.	H	α-helix	trans	-54.9	-35.8	176.3	0	0	0	0	0	112.9	L101 T105 M219	L101-A215 HydrophobicContact CD2-CB 4.5Å; T105-A215 HydrophobicContact CG2-CB 3.9Å; T105-A215 WeakPolarHBondContact OG1-CA 3.41Å; A215-M219 VanDerWaalsContact O-CB 3.25Å; A215-M219 WeakPolarHBondContact O-CB 3.15Å; A215-M219 VanDerWaalsContact O-CG 3.25Å; A215-M219 WeakPolarHBondContact O-CG 3.45Å; A215-M219 PolarHBondContact O-N 3.35Å
216	P	55.5	Low	52.4	Low	14 Å²	14	58.1 Å²	58.1	9%	0.091	31%	0.307	C	S	.	.	H	α-helix	trans	-57.3	-41.8	168.8	-20.9	26	0	0	0	114.7	A56 T57 S74 D214 W220	A56-P216 WeakPolarHBondContact O-CA 3.17Å; T57-P216 HydrophobicContact CG2-CB 4.08Å; T57-P216 HydrophobicContact CG2-CG 3.48Å; T57-P216 VanDerWaalsContact CG2-CG 3.48Å; S74-P216 WeakPolarHBondContact OG-CB 3.29Å; D214-P216 HydrophobicContact CB-CG 4.38Å; D214-P216 WeakPolarHBondContact OD1-CB 3.49Å; D214-P216 VanDerWaalsContact OD1-CD 3.27Å; D214-P216 WeakPolarHBondContact OD1-CD 3.33Å; P216-W220 WeakPolarHBondContact O-CB 3.25Å; P216-W220 PolarHBondContact O-N 3.17Å
217	L	60.6	Low	51.8	Low	2 Å²	2	62.2 Å²	62.2	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-64.4	-50.8	178.3	-165.7	99.3	0	0	0	111.8	L78 F81 V213 D214 M219 W220 L221	L78-L217 HydrophobicContact CD2-CB 4.49Å; L78-L217 HydrophobicContact CD2-CD1 3.66Å; L78-L217 HydrophobicContact CD2-CG 4.2Å; F81-L217 HydrophobicContact CB-CD1 4.02Å; F81-L217 HydrophobicContact CD2-CD1 3.25Å; F81-L217 HydrophobicContact CD2-CD2 3.61Å; F81-L217 HydrophobicContact CD2-CG 4.01Å; F81-L217 HydrophobicContact CE1-CD2 4.33Å; F81-L217 HydrophobicContact CE2-CD1 3.83Å; F81-L217 HydrophobicContact CE2-CD2 3.18Å; F81-L217 HydrophobicContact CE2-CG 4.09Å; F81-L217 HydrophobicContact CG-CD1 3.69Å; F81-L217 HydrophobicContact CG-CD2 4.35Å; F81-L217 HydrophobicContact CG-CG 4.5Å; F81-L217 HydrophobicContact CZ-CD2 3.6Å; V213-L217 HydrophobicContact CB-CD2 4.31Å; V213-L217 HydrophobicContact CG1-CD2 4.19Å; V213-L217 HydrophobicContact CG2-CD2 4.2Å; D214-L217 WeakPolarHBondContact O-CA 3.28Å; D214-L217 WeakPolarHBondContact O-CB 3.48Å; D214-L217 PolarHBondContact O-N 3.26Å; D214-L217 VanDerWaalsContact OD1-CB 3.3Å; D214-L217 WeakPolarHBondContact OD1-CB 3.31Å; D214-L217 PolarHBondContact OD1-N 3.2Å; L217-M219 VanDerWaalsContact C-N 3.34Å; L217-M219 PolarHBondContact O-N 2.87Å; L217-W220 PolarHBondContact O-N 2.67Å; L217-L221 HydrophobicContact CD2-CD1 4.09Å; L217-L221 HydrophobicContact CG-CD1 4.34Å; L217-L221 WeakPolarHBondContact O-CB 3.28Å; L217-L221 WeakPolarHBondContact O-CG 3.42Å; L217-L221 PolarHBondContact O-N 2.92Å
218	V	62	Low	51.4	Low	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-43.5	178	178.4	0	0	0	0	110.1	V93 L101 V104 T105 V108 V213 D214 W220 L221 L222	V93-V218 HydrophobicContact CG2-CG1 4.12Å; L101-V218 HydrophobicContact CD1-CG1 4.14Å; V104-V218 HydrophobicContact CG1-CG1 3.98Å; T105-V218 HydrophobicContact CG2-CG2 4.07Å; V108-V218 HydrophobicContact CG1-CG2 4.43Å; V213-V218 HydrophobicContact CG1-CG2 3.86Å; D214-V218 PolarHBondContact O-N 3.35Å; D214-V218 VanDerWaalsContact O-N 3.07Å; V218-W220 PolarHBondContact O-N 3.1Å; V218-L221 PolarHBondContact O-N 2.89Å; V218-L222 HydrophobicContact CG1-CD1 3.96Å; V218-L222 HydrophobicContact CG1-CG 4.4Å; V218-L222 WeakPolarHBondContact O-CB 3.44Å; V218-L222 WeakPolarHBondContact O-CG 3.29Å; V218-L222 PolarHBondContact O-N 3.25Å
219	M	58.4	Low	50.5	Low	12 Å²	12	65.8 Å²	65.8	6%	0.059	34%	0.335	C	S	.	.	H	α-helix	trans	-54.9	-52.2	171.6	-84.4	-105.8	-95.2	0	0	111.8	T55 A56 L101 A215 L217 L221 L222 F223 L229	T55-M219 VanDerWaalsContact O-CE 3.31Å; T55-M219 WeakPolarHBondContact O-CE 3.25Å; A56-M219 WeakPolarHBondContact O-CB 3.23Å; L101-M219 HydrophobicContact CD1-CG 3.73Å; L101-M219 HydrophobicContact CD1-SD 4.44Å; L101-M219 HydrophobicContact CD2-CE 4.12Å; L101-M219 HydrophobicContact CD2-CG 3.12Å; L101-M219 HydrophobicContact CD2-SD 3.49Å; L101-M219 WeakPolarHBondContact CD2-SD 3.42Å; L101-M219 HydrophobicContact CG-CG 3.98Å; A215-M219 VanDerWaalsContact O-CB 3.25Å; A215-M219 WeakPolarHBondContact O-CB 3.15Å; A215-M219 VanDerWaalsContact O-CG 3.25Å; A215-M219 WeakPolarHBondContact O-CG 3.45Å; A215-M219 PolarHBondContact O-N 3.35Å; L217-M219 VanDerWaalsContact C-N 3.34Å; L217-M219 PolarHBondContact O-N 2.87Å; M219-L221 VanDerWaalsContact C-N 3.34Å; M219-L221 PolarHBondContact O-N 3.47Å; M219-L222 CarbonylContact O-C 3.59Å; M219-L222 WeakPolarHBondContact O-CA 3.43Å; M219-L222 WeakPolarHBondContact O-CB 3.32Å; M219-L222 PolarHBondContact O-N 3.36Å; M219-F223 HydrophobicContact CB-CD2 4.3Å; M219-F223 VanDerWaalsContact O-CB 3.25Å; M219-F223 WeakPolarHBondContact O-CB 3.37Å; M219-F223 VanDerWaalsContact O-CD2 3.26Å; M219-F223 WeakPolarHBondContact O-CD2 3.46Å; M219-F223 PolarHBondContact O-N 2.92Å; M219-F223 HydrophobicContact SD-CD2 3.78Å; M219-F223 HydrophobicContact SD-CE2 3.3Å; M219-F223 WeakPolarHBondContact SD-CE2 3.47Å; M219-F223 HydrophobicContact SD-CZ 4.29Å; M219-L229 HydrophobicContact SD-CD1 4.46Å
220	W	60.1	Low	49.9	Very low	100 Å²	100	63.4 Å²	63.4	38%	0.379	33%	0.327	S	S	.	.	H	α-helix	trans	-60.8	-45.8	-177.5	-178	82.6	0	0	0	111.8	L78 P216 L217 V218 L222 F223 V224	L78-W220 HydrophobicContact CB-CD2 4.4Å; L78-W220 HydrophobicContact CD1-CB 3.46Å; L78-W220 VanDerWaalsContact CD1-CB 3.46Å; L78-W220 VanDerWaalsContact CD1-CD1 3.49Å; L78-W220 HydrophobicContact CD1-CD2 4.11Å; L78-W220 HydrophobicContact CD1-CG 3.39Å; L78-W220 HydrophobicContact CD2-CB 3.38Å; L78-W220 HydrophobicContact CD2-CD2 3.52Å; L78-W220 HydrophobicContact CD2-CE3 3.58Å; L78-W220 HydrophobicContact CD2-CG 3.47Å; L78-W220 VanDerWaalsContact CD2-CG 3.47Å; L78-W220 HydrophobicContact CD2-CZ3 4.44Å; L78-W220 HydrophobicContact CG-CB 4.06Å; L78-W220 HydrophobicContact CG-CD2 4.23Å; L78-W220 HydrophobicContact CG-CG 3.97Å; P216-W220 WeakPolarHBondContact O-CB 3.25Å; P216-W220 PolarHBondContact O-N 3.17Å; L217-W220 PolarHBondContact O-N 2.67Å; V218-W220 PolarHBondContact O-N 3.1Å; W220-L222 PolarHBondContact O-N 2.88Å; W220-F223 PolarHBondContact O-N 3.32Å; W220-V224 HydrophobicContact CD2-CG2 4.06Å; W220-V224 HydrophobicContact CE3-CG2 4.4Å; W220-V224 HydrophobicContact CZ2-CG2 4.23Å; W220-V224 WeakPolarHBondContact O-CG2 3.25Å; W220-V224 PolarHBondContact O-N 3.01Å
221	L	62	Low	49.4	Very low	4 Å²	4	62.3 Å²	62.3	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-58.7	-31.2	175.5	-74.1	174	0	0	0	112.3	F81 I86 V89 L90 L217 V218 M219	F81-L221 HydrophobicContact CE1-CD1 4.44Å; I86-L221 HydrophobicContact CG1-CD2 4.46Å; I86-L221 HydrophobicContact CG2-CD2 3.95Å; V89-L221 HydrophobicContact CB-CD1 4.2Å; V89-L221 HydrophobicContact CG1-CD1 3.49Å; V89-L221 VanDerWaalsContact CG1-CD1 3.49Å; L90-L221 HydrophobicContact CD2-CB 3.95Å; L217-L221 HydrophobicContact CD2-CD1 4.09Å; L217-L221 HydrophobicContact CG-CD1 4.34Å; L217-L221 WeakPolarHBondContact O-CB 3.28Å; L217-L221 WeakPolarHBondContact O-CG 3.42Å; L217-L221 PolarHBondContact O-N 2.92Å; V218-L221 PolarHBondContact O-N 2.89Å; M219-L221 VanDerWaalsContact C-N 3.34Å; M219-L221 PolarHBondContact O-N 3.47Å
222	L	59.6	Low	48.7	Very low	17 Å²	17	67.5 Å²	67.5	9%	0.089	35%	0.347	C	S	.	.	H	α-helix	trans	-80.9	-28.3	174.6	-69.6	-179.9	0	0	0	114.5	V93 L101 V218 M219 W220 C235 L236	V93-L222 HydrophobicContact CG1-CD1 4.34Å; V93-L222 HydrophobicContact CG1-CD2 3.67Å; V93-L222 HydrophobicContact CG1-CG 4.36Å; L101-L222 HydrophobicContact CD1-CD1 4.11Å; V218-L222 HydrophobicContact CG1-CD1 3.96Å; V218-L222 HydrophobicContact CG1-CG 4.4Å; V218-L222 WeakPolarHBondContact O-CB 3.44Å; V218-L222 WeakPolarHBondContact O-CG 3.29Å; V218-L222 PolarHBondContact O-N 3.25Å; M219-L222 CarbonylContact O-C 3.59Å; M219-L222 WeakPolarHBondContact O-CA 3.43Å; M219-L222 WeakPolarHBondContact O-CB 3.32Å; M219-L222 PolarHBondContact O-N 3.36Å; W220-L222 PolarHBondContact O-N 2.88Å; L222-C235 WeakPolarHBondContact CD2-O 3.38Å; L222-L236 HydrophobicContact CD2-CD2 3.82Å; L222-L236 HydrophobicContact CD2-CG 4.28Å
223	F	52.7	Low	48.1	Very low	66 Å²	66	65.1 Å²	65.1	29%	0.289	35%	0.353	S	S	.	.	H	α-helix	trans	-106.8	3.5	-166.6	-90	-82.5	0	0	0	116.4	M219 W220 G225 L227 L229	M219-F223 HydrophobicContact CB-CD2 4.3Å; M219-F223 VanDerWaalsContact O-CB 3.25Å; M219-F223 WeakPolarHBondContact O-CB 3.37Å; M219-F223 VanDerWaalsContact O-CD2 3.26Å; M219-F223 WeakPolarHBondContact O-CD2 3.46Å; M219-F223 PolarHBondContact O-N 2.92Å; M219-F223 HydrophobicContact SD-CD2 3.78Å; M219-F223 HydrophobicContact SD-CE2 3.3Å; M219-F223 WeakPolarHBondContact SD-CE2 3.47Å; M219-F223 HydrophobicContact SD-CZ 4.29Å; W220-F223 PolarHBondContact O-N 3.32Å; F223-G225 CarbonylContact O-C 3.56Å; F223-G225 PolarHBondContact O-N 2.74Å; F223-L227 VanDerWaalsContact CE1-O 3.26Å; F223-L227 WeakPolarHBondContact CE1-O 3.17Å; F223-L229 HydrophobicContact CD2-CD1 4.2Å; F223-L229 HydrophobicContact CE1-CB 4.39Å; F223-L229 HydrophobicContact CE1-CG 4.04Å; F223-L229 HydrophobicContact CE2-CB 4.29Å; F223-L229 HydrophobicContact CE2-CD1 3.1Å; F223-L229 HydrophobicContact CE2-CG 3.48Å; F223-L229 VanDerWaalsContact CE2-CG 3.48Å; F223-L229 HydrophobicContact CZ-CB 3.62Å; F223-L229 HydrophobicContact CZ-CD1 3.34Å; F223-L229 HydrophobicContact CZ-CG 3.21Å
224	V	52.5	Low	47.9	Very low	89 Å²	89	71.8 Å²	71.8	54%	0.539	39%	0.388	S	S	.	.	S	Bend	trans	-58.4	-6.7	177.6	-172.6	0	0	0	0	113.4	W220	W220-V224 HydrophobicContact CD2-CG2 4.06Å; W220-V224 HydrophobicContact CE3-CG2 4.4Å; W220-V224 HydrophobicContact CZ2-CG2 4.23Å; W220-V224 WeakPolarHBondContact O-CG2 3.25Å; W220-V224 PolarHBondContact O-N 3.01Å
225	G	39.7	Very low	48	Very low	19 Å²	19	71.1 Å²	71.1	20%	0.196	39%	0.388	C	S	.	.	S	Bend	trans	-109.9	109.2	162.6	0	0	0	0	0	114	F223 L227 Q237	F223-G225 CarbonylContact O-C 3.56Å; F223-G225 PolarHBondContact O-N 2.74Å; G225-L227 PolarHBondContact O-N 3.28Å; G225-Q237 VanDerWaalsContact CA-OE1 3.25Å; G225-Q237 PolarHBondContact O-NE2 3.39Å; G225-Q237 PolarHBondContact O-OE1 3.36Å; G225-Q237 VanDerWaalsContact O-OE1 3.14Å
226	H	34.8	Very low	48.5	Very low	175 Å²	175	71 Å²	71	81%	0.81	38%	0.383	S	S	*	.			trans	-38.5	99.5	176.5	-64.3	-65.8	0	0	0	116.8
227	L	33.5	Very low	48.9	Very low	133 Å²	133	73.3 Å²	73.3	70%	0.696	39%	0.392	S	S	*	.	S	Bend	trans	-172.4	154.5	155.2	-97.5	134.7	0	0	0	110.3	F223 G225	F223-L227 VanDerWaalsContact CE1-O 3.26Å; F223-L227 WeakPolarHBondContact CE1-O 3.17Å; G225-L227 PolarHBondContact O-N 3.28Å
228	P	36.4	Very low	49.2	Very low	103 Å²	103	80.9 Å²	80.9	67%	0.669	43%	0.428	S	S	*	.			trans	-71.9	135	-176.2	5.9	7.9	0	0	0	111.3	I230	P228-I230 PolarHBondContact O-N 3.24Å
229	L	34	Very low	49.4	Very low	84 Å²	84	83.8 Å²	83.8	44%	0.44	45%	0.448	S	S	.	.			trans	-60.9	104.3	171.7	-93.9	174.2	0	0	0	110.1	M219 F223 I231	M219-L229 HydrophobicContact SD-CD1 4.46Å; F223-L229 HydrophobicContact CD2-CD1 4.2Å; F223-L229 HydrophobicContact CE1-CB 4.39Å; F223-L229 HydrophobicContact CE1-CG 4.04Å; F223-L229 HydrophobicContact CE2-CB 4.29Å; F223-L229 HydrophobicContact CE2-CD1 3.1Å; F223-L229 HydrophobicContact CE2-CG 3.48Å; F223-L229 VanDerWaalsContact CE2-CG 3.48Å; F223-L229 HydrophobicContact CZ-CB 3.62Å; F223-L229 HydrophobicContact CZ-CD1 3.34Å; F223-L229 HydrophobicContact CZ-CG 3.21Å; L229-I231 HydrophobicContact CB-CG1 4.3Å; L229-I231 HydrophobicContact CD1-CG1 4.31Å; L229-I231 HydrophobicContact CD2-CG1 4.11Å
230	I	36.2	Very low	49.7	Very low	132 Å²	132	83.4 Å²	83.4	68%	0.677	45%	0.446	S	S	*	.			trans	-82.6	108.4	140.3	-59.7	172.2	0	0	0	104.1	P228 L232	P228-I230 PolarHBondContact O-N 3.24Å; I230-L232 HydrophobicContact CG2-CB 4.24Å; I230-L232 HydrophobicContact CG2-CD1 3.47Å; I230-L232 VanDerWaalsContact CG2-CD1 3.47Å; I230-L232 HydrophobicContact CG2-CG 3.74Å; I230-L232 PolarHBondContact O-N 3.27Å
231	I	36.6	Very low	50.3	Low	82 Å²	82	80.8 Å²	80.8	42%	0.421	44%	0.441	S	S	.	.			trans	-71.3	82.1	169.8	-54.8	170.6	0	0	0	106.8	S99 L229	S99-I231 WeakPolarHBondContact O-CD1 3.25Å; S99-I231 WeakPolarHBondContact O-CG2 3.42Å; L229-I231 HydrophobicContact CB-CG1 4.3Å; L229-I231 HydrophobicContact CD1-CG1 4.31Å; L229-I231 HydrophobicContact CD2-CG1 4.11Å
232	L	35.1	Very low	50.9	Low	138 Å²	138	87.9 Å²	87.9	72%	0.723	47%	0.474	S	S	*	.			trans	-105.5	129.3	160.6	-88.9	158.3	0	0	0	105.8	I230 N234	I230-L232 HydrophobicContact CG2-CB 4.24Å; I230-L232 HydrophobicContact CG2-CD1 3.47Å; I230-L232 VanDerWaalsContact CG2-CD1 3.47Å; I230-L232 HydrophobicContact CG2-CG 3.74Å; I230-L232 PolarHBondContact O-N 3.27Å; L232-N234 PolarHBondContact O-N 2.93Å; L232-N234 VanDerWaalsContact O-N 3.12Å
233	C	39.7	Very low	51.5	Low	109 Å²	109	91 Å²	91	74%	0.736	50%	0.498	S	S	*	.	S	Bend	trans	-27.7	108.9	173.7	-159.8	0	0	0	0	113.5
234	N	50.3	Low	52.6	Low	144 Å²	144	91.3 Å²	91.3	77%	0.77	50%	0.497	S	S	*	.			trans	150.9	73.7	166.6	-81.9	-15.5	0	0	0	107.8	L232 L236	L232-N234 PolarHBondContact O-N 2.93Å; L232-N234 VanDerWaalsContact O-N 3.12Å; N234-L236 PolarHBondContact O-N 3.37Å
235	C	55.8	Low	54	Low	41 Å²	41	91.3 Å²	91.3	28%	0.277	49%	0.494	S	S	.	.			trans	-64.8	-3.8	-155.9	-52.5	0	0	0	0	116.6	V93 T96 L222	V93-C235 HydrophobicContact CG1-CB 4.17Å; T96-C235 PolarHBondContact O-SG 2.89Å; T96-C235 VanDerWaalsContact O-SG 3.42Å; L222-C235 WeakPolarHBondContact CD2-O 3.38Å
236	L	63.1	Low	55.9	Low	28 Å²	28	91.1 Å²	91.1	15%	0.147	49%	0.489	C	S	.	.	S	Bend	trans	-125.4	135.6	178.3	-74.5	151.4	0	0	0	110.7	L90 V93 L222 N234 T240 V241	L90-L236 HydrophobicContact CB-CD2 4.33Å; L90-L236 HydrophobicContact CD2-CD2 3.5Å; L90-L236 VanDerWaalsContact CD2-CD2 3.5Å; L90-L236 HydrophobicContact CG-CD2 4.49Å; L90-L236 VanDerWaalsContact O-CD1 3.27Å; L90-L236 WeakPolarHBondContact O-CD1 3.42Å; V93-L236 HydrophobicContact CG1-CG 4.38Å; L222-L236 HydrophobicContact CD2-CD2 3.82Å; L222-L236 HydrophobicContact CD2-CG 4.28Å; N234-L236 PolarHBondContact O-N 3.37Å; L236-T240 HydrophobicContact CD2-CG2 4.19Å; L236-V241 HydrophobicContact CB-CG2 3.69Å; L236-V241 HydrophobicContact CD1-CG2 4.48Å
237	Q	64.3	Low	57.8	Low	61 Å²	61	86.2 Å²	86.2	29%	0.285	49%	0.485	S	S	.	.			trans	-65.6	140.5	171	-70.2	-171.2	-18.8	0	0	110.9	G225 S239 T240 V241	G225-Q237 VanDerWaalsContact CA-OE1 3.25Å; G225-Q237 PolarHBondContact O-NE2 3.39Å; G225-Q237 PolarHBondContact O-OE1 3.36Å; G225-Q237 VanDerWaalsContact O-OE1 3.14Å; Q237-S239 PolarHBondContact O-N 2.65Å; Q237-S239 VanDerWaalsContact O-N 3.17Å; Q237-T240 WeakPolarHBondContact O-CA 3.48Å; Q237-T240 WeakPolarHBondContact O-CB 3.3Å; Q237-T240 PolarHBondContact O-N 3.18Å; Q237-V241 PolarHBondContact O-N 3.29Å
238	E	65.9	Low	59.9	Low	162 Å²	162	82.4 Å²	82.4	76%	0.757	48%	0.478	S	S	*	.	H	α-helix	trans	-50.8	-40.5	175.8	-86.1	179.5	159.8	0	0	112	T240 V241 E242	E238-T240 VanDerWaalsContact C-N 3.28Å; E238-T240 PolarHBondContact O-N 3.24Å; E238-V241 PolarHBondContact O-N 2.84Å; E238-E242 WeakPolarHBondContact O-CB 3.48Å; E238-E242 WeakPolarHBondContact O-CG 3.17Å; E238-E242 PolarHBondContact O-N 3.23Å
239	S	66.9	Low	62.1	Low	60 Å²	60	78.3 Å²	78.3	42%	0.42	45%	0.451	S	S	.	.	H	α-helix	trans	-60.8	-34.6	176.4	53.9	0	0	0	0	113.5	Q237 S243	Q237-S239 PolarHBondContact O-N 2.65Å; Q237-S239 VanDerWaalsContact O-N 3.17Å; S239-S243 VanDerWaalsContact O-CB 3.26Å; S239-S243 WeakPolarHBondContact O-CB 3.45Å; S239-S243 PolarHBondContact O-N 3.42Å; S239-S243 PolarHBondContact O-OG 3.05Å
240	T	65.2	Low	64.4	Low	4 Å²	4	79.4 Å²	79.4	3%	0.025	45%	0.454	C	S	.	.	H	α-helix	trans	-76	-40.4	177.2	-54.1	0	0	0	0	110.4	L90 L236 Q237 E238 E242 S243 Y244	L90-T240 HydrophobicContact CD1-CG2 4.01Å; L90-T240 HydrophobicContact CD2-CG2 3.78Å; L236-T240 HydrophobicContact CD2-CG2 4.19Å; Q237-T240 WeakPolarHBondContact O-CA 3.48Å; Q237-T240 WeakPolarHBondContact O-CB 3.3Å; Q237-T240 PolarHBondContact O-N 3.18Å; E238-T240 VanDerWaalsContact C-N 3.28Å; E238-T240 PolarHBondContact O-N 3.24Å; T240-E242 VanDerWaalsContact C-N 3.31Å; T240-E242 PolarHBondContact O-N 3.08Å; T240-S243 WeakPolarHBondContact CA-OG 3.38Å; T240-S243 PolarHBondContact O-N 3.35Å; T240-S243 PolarHBondContact O-OG 2.94Å; T240-Y244 HydrophobicContact CG2-CD2 3.96Å; T240-Y244 HydrophobicContact CG2-CE2 4.29Å; T240-Y244 WeakPolarHBondContact O-CD2 3.34Å; T240-Y244 PolarHBondContact O-N 3.19Å; T240-Y244 VanDerWaalsContact O-N 3.14Å
241	V	71.1	Confident	66.8	Low	45 Å²	45	74.3 Å²	74.3	27%	0.273	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-42.3	175.1	177	0	0	0	0	110.8	L236 Q237 E238 N245 I246	L236-V241 HydrophobicContact CB-CG2 3.69Å; L236-V241 HydrophobicContact CD1-CG2 4.48Å; Q237-V241 PolarHBondContact O-N 3.29Å; E238-V241 PolarHBondContact O-N 2.84Å; V241-N245 CarbonylContact O-C 3.59Å; V241-N245 VanDerWaalsContact O-CA 3.25Å; V241-N245 WeakPolarHBondContact O-CA 3.46Å; V241-N245 PolarHBondContact O-N 3.03Å; V241-I246 HydrophobicContact CG1-CB 4.27Å; V241-I246 PolarHBondContact O-N 2.86Å
242	E	74.7	Confident	68.9	Low	153 Å²	153	76.5 Å²	76.5	72%	0.715	43%	0.433	S	S	*	.	H	α-helix	trans	-69.1	-50.1	176.4	-73.8	-179.6	172.8	0	0	112.5	E238 T240 Y244 N245	E238-E242 WeakPolarHBondContact O-CB 3.48Å; E238-E242 WeakPolarHBondContact O-CG 3.17Å; E238-E242 PolarHBondContact O-N 3.23Å; T240-E242 VanDerWaalsContact C-N 3.31Å; T240-E242 PolarHBondContact O-N 3.08Å; E242-Y244 VanDerWaalsContact C-N 3.28Å; E242-Y244 PolarHBondContact O-N 3.13Å; E242-N245 PolarHBondContact O-N 3.47Å; E242-N245 VanDerWaalsContact O-N 3.11Å
243	S	72.8	Confident	71.1	Confident	84 Å²	84	74.1 Å²	74.1	59%	0.587	42%	0.421	S	S	*	.	H	α-helix	trans	-63.8	-31.7	-175.3	48.8	0	0	0	0	113.4	S239 T240	S239-S243 VanDerWaalsContact O-CB 3.26Å; S239-S243 WeakPolarHBondContact O-CB 3.45Å; S239-S243 PolarHBondContact O-N 3.42Å; S239-S243 PolarHBondContact O-OG 3.05Å; T240-S243 WeakPolarHBondContact CA-OG 3.38Å; T240-S243 PolarHBondContact O-N 3.35Å; T240-S243 PolarHBondContact O-OG 2.94Å
244	Y	75.4	Confident	73.2	Confident	72 Å²	72	69.6 Å²	69.6	28%	0.282	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	2.7	174.9	-65.7	-80.2	0	0	0	114.1	I86 R87 L90 T240 E242 I246	I86-Y244 HydrophobicContact CB-CE1 4.39Å; I86-Y244 HydrophobicContact CD1-CE1 4.39Å; I86-Y244 HydrophobicContact CG2-CD1 3.67Å; I86-Y244 HydrophobicContact CG2-CE1 3.38Å; I86-Y244 HydrophobicContact CG2-CE2 4.34Å; I86-Y244 HydrophobicContact CG2-CG 4.27Å; R87-Y244 PolarHBondContact NE-O 3Å; R87-Y244 PolarHBondContact NH2-O 3Å; R87-Y244 VanDerWaalsContact NH2-O 3.08Å; L90-Y244 HydrophobicContact CD1-CD1 4.28Å; L90-Y244 HydrophobicContact CD1-CD2 3.46Å; L90-Y244 VanDerWaalsContact CD1-CD2 3.46Å; L90-Y244 HydrophobicContact CD1-CE2 4.04Å; L90-Y244 HydrophobicContact CD1-CG 3.59Å; T240-Y244 HydrophobicContact CG2-CD2 3.96Å; T240-Y244 HydrophobicContact CG2-CE2 4.29Å; T240-Y244 WeakPolarHBondContact O-CD2 3.34Å; T240-Y244 PolarHBondContact O-N 3.19Å; T240-Y244 VanDerWaalsContact O-N 3.14Å; E242-Y244 VanDerWaalsContact C-N 3.28Å; E242-Y244 PolarHBondContact O-N 3.13Å; Y244-I246 VanDerWaalsContact C-N 3.26Å; Y244-I246 PolarHBondContact O-N 3.26Å
245	N	82.6	Confident	74.6	Confident	89 Å²	89	63.3 Å²	63.3	48%	0.476	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	45.1	-176.9	-175.3	38	0	0	0	112.9	V241 E242 G247 G248 T249	V241-N245 CarbonylContact O-C 3.59Å; V241-N245 VanDerWaalsContact O-CA 3.25Å; V241-N245 WeakPolarHBondContact O-CA 3.46Å; V241-N245 PolarHBondContact O-N 3.03Å; E242-N245 PolarHBondContact O-N 3.47Å; E242-N245 VanDerWaalsContact O-N 3.11Å; N245-G247 VanDerWaalsContact C-N 3.34Å; N245-G248 PolarHBondContact O-N 3.14Å; N245-T249 PolarHBondContact O-N 2.94Å; N245-T249 PolarHBondContact O-OG1 3.39Å
246	I	80.1	Confident	75.2	Confident	15 Å²	15	62.9 Å²	62.9	8%	0.077	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-65.8	-39	-179.3	-58.3	-61.6	0	0	0	110.5	R87 L90 F91 V241 Y244 G248 T249	R87-I246 HydrophobicContact CB-CD1 4.46Å; R87-I246 HydrophobicContact CG-CD1 4.14Å; L90-I246 HydrophobicContact CB-CD1 3.7Å; L90-I246 HydrophobicContact CB-CG1 4.08Å; L90-I246 HydrophobicContact CD1-CD1 4.19Å; L90-I246 HydrophobicContact CD1-CG1 4.42Å; F91-I246 HydrophobicContact CD2-CG2 4.04Å; V241-I246 HydrophobicContact CG1-CB 4.27Å; V241-I246 PolarHBondContact O-N 2.86Å; Y244-I246 VanDerWaalsContact C-N 3.26Å; Y244-I246 PolarHBondContact O-N 3.26Å; I246-G248 PolarHBondContact O-N 3.25Å; I246-T249 PolarHBondContact O-N 3.41Å; I246-T249 VanDerWaalsContact O-N 3.13Å
247	G	74	Confident	75.5	Confident	71 Å²	71	62.3 Å²	62.3	73%	0.732	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-64.4	-18.6	179.7	0	0	0	0	0	115.2	N245	N245-G247 VanDerWaalsContact C-N 3.34Å
248	G	78.7	Confident	75.8	Confident	53 Å²	53	64.2 Å²	64.2	55%	0.546	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-105.6	3.5	176	0	0	0	0	0	114.7	N245 I246	N245-G248 PolarHBondContact O-N 3.14Å; I246-G248 PolarHBondContact O-N 3.25Å
249	T	81.2	Confident	76.5	Confident	18 Å²	18	60.6 Å²	60.6	11%	0.11	35%	0.354	C	S	.	.			trans	-95.5	130.5	-179.2	-55.4	0	0	0	0	109.2	F91 N245 I246 D253 L254	F91-T249 VanDerWaalsContact CE2-O 3.26Å; F91-T249 WeakPolarHBondContact CE2-O 3.26Å; N245-T249 PolarHBondContact O-N 2.94Å; N245-T249 PolarHBondContact O-OG1 3.39Å; I246-T249 PolarHBondContact O-N 3.41Å; I246-T249 VanDerWaalsContact O-N 3.13Å; T249-D253 HydrophobicContact CG2-CB 4.36Å; T249-L254 HydrophobicContact CG2-CD1 3.64Å; T249-L254 HydrophobicContact CG2-CD2 3.78Å; T249-L254 HydrophobicContact CG2-CG 3.58Å
250	E	82.9	Confident	77.2	Confident	107 Å²	107	58.3 Å²	58.3	50%	0.5	34%	0.338	S	S	.	.			trans	-91.4	149.9	170.9	-67.4	-170.3	-163.1	0	0	110.6	K252 D253	E250-K252 HydrophobicContact CB-CD 4.39Å; E250-K252 HydrophobicContact CB-CG 4.02Å; E250-K252 PolarHBondContact O-N 2.94Å; E250-K252 VanDerWaalsContact O-N 3.16Å; E250-K252 IonicContact OE1-NZ 3.68Å; E250-K252 VanDerWaalsContact OE2-CD 3.31Å; E250-K252 WeakPolarHBondContact OE2-CD 3.19Å; E250-K252 WeakPolarHBondContact OE2-CE 3.06Å; E250-K252 IonicContact OE2-NZ 3.85Å; E250-K252 PolarHBondContact OE2-NZ 3.47Å; E250-D253 WeakPolarHBondContact CB-OD2 3.15Å; E250-D253 PolarHBondContact N-OD2 3.22Å; E250-D253 VanDerWaalsContact O-CB 3.29Å; E250-D253 WeakPolarHBondContact O-CB 3.48Å; E250-D253 PolarHBondContact O-N 3.23Å
251	W	87.1	Confident	77.7	Confident	25 Å²	25	64.6 Å²	64.6	10%	0.095	38%	0.376	C	S	.	.	H	α-helix	trans	-55.5	-37.2	-179.4	-179.3	-118.1	0	0	0	113.2	F91 I92 F111 F117 D253 L254 F255 G257 P258 L259 P260	F91-W251 HydrophobicContact CD1-CD2 4.45Å; F91-W251 AromaticContact CD1-CE3 3.38Å; F91-W251 HydrophobicContact CD1-CE3 3.38Å; F91-W251 AromaticContact CD1-CZ3 3.76Å; F91-W251 HydrophobicContact CD1-CZ3 3.76Å; F91-W251 HydrophobicContact CE1-CB 4.03Å; F91-W251 HydrophobicContact CE1-CD2 4.26Å; F91-W251 AromaticContact CE1-CE3 3.57Å; F91-W251 HydrophobicContact CE1-CE3 3.57Å; F91-W251 HydrophobicContact CE1-CG 4.49Å; F91-W251 HydrophobicContact CE1-CZ3 4.35Å; F91-W251 HydrophobicContact CG-CE3 4.24Å; F91-W251 HydrophobicContact CZ-CB 4.2Å; I92-W251 HydrophobicContact CD1-CH2 4.07Å; I92-W251 HydrophobicContact CD1-CZ3 4.4Å; I92-W251 HydrophobicContact CG1-CH2 3.79Å; I92-W251 HydrophobicContact CG1-CZ3 3.83Å; F111-W251 HydrophobicContact CD1-CH2 4.49Å; F111-W251 AromaticContact CE1-CH2 3.63Å; F111-W251 HydrophobicContact CE1-CH2 3.63Å; F111-W251 AromaticContact CE1-CZ2 3.72Å; F111-W251 HydrophobicContact CE1-CZ2 3.72Å; F111-W251 HydrophobicContact CZ-CH2 4.12Å; F111-W251 AromaticContact CZ-CZ2 3.73Å; F111-W251 HydrophobicContact CZ-CZ2 3.73Å; F117-W251 AromaticContact CE1-CH2 3.88Å; F117-W251 HydrophobicContact CE1-CH2 3.88Å; F117-W251 HydrophobicContact CE1-CZ3 4.42Å; W251-D253 PolarHBondContact O-N 2.85Å; W251-D253 VanDerWaalsContact O-N 3.16Å; W251-L254 HydrophobicContact CE3-CB 4.44Å; W251-L254 HydrophobicContact CE3-CD1 4.47Å; W251-L254 PolarHBondContact O-N 3.49Å; W251-F255 HydrophobicContact CD2-CB 4.25Å; W251-F255 AromaticContact CE2-CD1 3.74Å; W251-F255 HydrophobicContact CH2-CB 3.99Å; W251-F255 HydrophobicContact CH2-CD1 4.46Å; W251-F255 HydrophobicContact CH2-CG 4.41Å; W251-F255 HydrophobicContact CZ2-CB 3.56Å; W251-F255 AromaticContact CZ2-CD1 3.44Å; W251-F255 HydrophobicContact CZ2-CD1 3.44Å; W251-F255 VanDerWaalsContact CZ2-CD1 3.44Å; W251-F255 HydrophobicContact CZ2-CE1 4.43Å; W251-F255 AromaticContact CZ2-CG 3.75Å; W251-F255 HydrophobicContact CZ2-CG 3.75Å; W251-F255 HydrophobicContact CZ3-CB 4.45Å; W251-F255 AromaticContact NE1-CD1 3.7Å; W251-F255 PolarHBondContact O-N 2.94Å; W251-G257 PolarHBondContact NE1-O 3.06Å; W251-G257 VanDerWaalsContact NE1-O 3.16Å; W251-P258 PolarHBondContact NE1-O 3.28Å; W251-L259 HydrophobicContact CB-CD1 3.66Å; W251-L259 HydrophobicContact CD2-CD1 3.73Å; W251-L259 HydrophobicContact CE3-CD1 4.25Å; W251-L259 HydrophobicContact CG-CD1 3.45Å; W251-L259 VanDerWaalsContact CG-CD1 3.45Å; W251-P260 HydrophobicContact CH2-CG 4.04Å; W251-P260 HydrophobicContact CZ2-CG 4.04Å
252	K	79.4	Confident	77.9	Confident	128 Å²	128	63.6 Å²	63.6	56%	0.557	37%	0.368	S	S	*	.	H	α-helix	trans	-60.2	-23.1	177.1	74.9	-170.7	-171.8	-158.5	0	113.5	I118 E250 L254	I118-K252 WeakPolarHBondContact CD1-O 2.91Å; E250-K252 HydrophobicContact CB-CD 4.39Å; E250-K252 HydrophobicContact CB-CG 4.02Å; E250-K252 PolarHBondContact O-N 2.94Å; E250-K252 VanDerWaalsContact O-N 3.16Å; E250-K252 IonicContact OE1-NZ 3.68Å; E250-K252 VanDerWaalsContact OE2-CD 3.31Å; E250-K252 WeakPolarHBondContact OE2-CD 3.19Å; E250-K252 WeakPolarHBondContact OE2-CE 3.06Å; E250-K252 IonicContact OE2-NZ 3.85Å; E250-K252 PolarHBondContact OE2-NZ 3.47Å; K252-L254 VanDerWaalsContact C-N 3.33Å
253	D	81.8	Confident	77.2	Confident	87 Å²	87	60.2 Å²	60.2	47%	0.465	36%	0.359	S	S	.	.	H	α-helix	trans	-81.8	-17.7	178.8	-52.7	-34.2	0	0	0	111.5	T249 E250 W251	T249-D253 HydrophobicContact CG2-CB 4.36Å; E250-D253 WeakPolarHBondContact CB-OD2 3.15Å; E250-D253 PolarHBondContact N-OD2 3.22Å; E250-D253 VanDerWaalsContact O-CB 3.29Å; E250-D253 WeakPolarHBondContact O-CB 3.48Å; E250-D253 PolarHBondContact O-N 3.23Å; W251-D253 PolarHBondContact O-N 2.85Å; W251-D253 VanDerWaalsContact O-N 3.16Å
254	L	83.5	Confident	76.4	Confident	14 Å²	14	59.1 Å²	59.1	7%	0.073	36%	0.355	C	S	.	.	H	α-helix	trans	-106.2	-38.4	-177.4	-60.6	174.1	0	0	0	112.2	R87 P88 F91 I118 T249 W251 K252	R87-L254 HydrophobicContact CB-CD2 3.93Å; P88-L254 HydrophobicContact CG-CB 4.44Å; P88-L254 HydrophobicContact CG-CD2 4.19Å; F91-L254 HydrophobicContact CB-CD1 3.55Å; F91-L254 HydrophobicContact CD1-CD1 4.34Å; F91-L254 HydrophobicContact CD2-CD1 3.72Å; F91-L254 HydrophobicContact CG-CD1 3.61Å; I118-L254 PolarHBondContact N-O 2.79Å; T249-L254 HydrophobicContact CG2-CD1 3.64Å; T249-L254 HydrophobicContact CG2-CD2 3.78Å; T249-L254 HydrophobicContact CG2-CG 3.58Å; W251-L254 HydrophobicContact CE3-CB 4.44Å; W251-L254 HydrophobicContact CE3-CD1 4.47Å; W251-L254 PolarHBondContact O-N 3.49Å; K252-L254 VanDerWaalsContact C-N 3.33Å
255	F	79.9	Confident	75	Confident	13 Å²	13	58.2 Å²	58.2	6%	0.057	36%	0.355	C	S	.	.			trans	-147.5	133.7	-173.2	-174.5	-111.5	0	0	0	111.7	F111 H115 Y116 F117 W251 G257	F111-F255 HydrophobicContact CZ-CD1 4.34Å; F111-F255 HydrophobicContact CZ-CE1 4.17Å; H115-F255 HydrophobicContact CB-CD2 4.48Å; H115-F255 HydrophobicContact CB-CE2 3.76Å; H115-F255 HydrophobicContact CB-CZ 4.02Å; H115-F255 AromaticContact CD2-CZ 3.39Å; H115-F255 WeakPolarHBondContact CD2-CZ 3.39Å; H115-F255 AromaticContact CG-CZ 3.96Å; Y116-F255 VanDerWaalsContact O-CD2 3.29Å; Y116-F255 WeakPolarHBondContact O-CD2 3.36Å; Y116-F255 VanDerWaalsContact O-CE2 3.3Å; Y116-F255 WeakPolarHBondContact O-CE2 3.35Å; F117-F255 HydrophobicContact CD1-CB 3.94Å; F117-F255 HydrophobicContact CD1-CD2 4.06Å; F117-F255 HydrophobicContact CD1-CG 4.33Å; F117-F255 HydrophobicContact CE1-CB 4.1Å; F117-F255 HydrophobicContact CE1-CD2 4.19Å; F117-F255 HydrophobicContact CE1-CG 4.29Å; W251-F255 HydrophobicContact CD2-CB 4.25Å; W251-F255 AromaticContact CE2-CD1 3.74Å; W251-F255 HydrophobicContact CH2-CB 3.99Å; W251-F255 HydrophobicContact CH2-CD1 4.46Å; W251-F255 HydrophobicContact CH2-CG 4.41Å; W251-F255 HydrophobicContact CZ2-CB 3.56Å; W251-F255 AromaticContact CZ2-CD1 3.44Å; W251-F255 HydrophobicContact CZ2-CD1 3.44Å; W251-F255 VanDerWaalsContact CZ2-CD1 3.44Å; W251-F255 HydrophobicContact CZ2-CE1 4.43Å; W251-F255 AromaticContact CZ2-CG 3.75Å; W251-F255 HydrophobicContact CZ2-CG 3.75Å; W251-F255 HydrophobicContact CZ3-CB 4.45Å; W251-F255 AromaticContact NE1-CD1 3.7Å; W251-F255 PolarHBondContact O-N 2.94Å; F255-G257 VanDerWaalsContact CE1-CA 3.45Å; F255-G257 PolarHBondContact O-N 3.38Å
256	N	68.1	Low	72.9	Confident	31 Å²	31	59 Å²	59	17%	0.166	37%	0.365	C	S	.	.	S	Bend	trans	-93.7	60.8	179.3	-167.1	30.2	0	0	0	112	F142 K144 P191	F142-N256 PolarHBondContact O-ND2 3.27Å; F142-N256 VanDerWaalsContact O-ND2 3.09Å; K144-N256 WeakPolarHBondContact CA-O 3.24Å; P191-N256 WeakPolarHBondContact CA-ND2 3.28Å; P191-N256 HydrophobicContact CB-CB 4.37Å
257	G	69.1	Low	70.8	Confident	17 Å²	17	65.4 Å²	65.4	18%	0.175	40%	0.398	C	S	.	.	S	Bend	trans	-160.9	-176.8	177.1	0	0	0	0	0	112.3	K144 W251 F255	K144-G257 WeakPolarHBondContact O-CA 3.46Å; W251-G257 PolarHBondContact NE1-O 3.06Å; W251-G257 VanDerWaalsContact NE1-O 3.16Å; F255-G257 VanDerWaalsContact CE1-CA 3.45Å; F255-G257 PolarHBondContact O-N 3.38Å
258	P	72.2	Confident	68.6	Low	100 Å²	100	72 Å²	72	65%	0.649	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-62.2	153.5	-179.5	26.7	-33.3	0	0	0	111.7	W251	W251-P258 PolarHBondContact NE1-O 3.28Å
259	L	79.6	Confident	66.3	Low	86 Å²	86	75 Å²	75	45%	0.45	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-67.5	129.5	174.1	-169	75.9	0	0	0	109.2	F91 L95 W251	F91-L259 HydrophobicContact CE1-CD1 3.89Å; L95-L259 HydrophobicContact CD1-CD1 3.63Å; L95-L259 HydrophobicContact CD1-CG 3.95Å; L95-L259 HydrophobicContact CD2-CD1 4.25Å; L95-L259 HydrophobicContact CD2-CD2 4.18Å; L95-L259 HydrophobicContact CD2-CG 4.41Å; W251-L259 HydrophobicContact CB-CD1 3.66Å; W251-L259 HydrophobicContact CD2-CD1 3.73Å; W251-L259 HydrophobicContact CE3-CD1 4.25Å; W251-L259 HydrophobicContact CG-CD1 3.45Å; W251-L259 VanDerWaalsContact CG-CD1 3.45Å
260	P	80.8	Confident	63.7	Low	13 Å²	13	81.9 Å²	81.9	8%	0.084	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-63.6	141.6	176.5	18.1	-25.5	0	0	0	111.7	I92 L95 F111 W251 F262	I92-P260 HydrophobicContact CG1-CG 4.43Å; L95-P260 HydrophobicContact CD1-CG 3.76Å; F111-P260 HydrophobicContact CD1-CG 4.25Å; F111-P260 HydrophobicContact CD2-CB 3.53Å; F111-P260 HydrophobicContact CD2-CG 4.06Å; F111-P260 HydrophobicContact CE1-CG 4.07Å; F111-P260 HydrophobicContact CE2-CB 3.53Å; F111-P260 HydrophobicContact CE2-CG 3.87Å; F111-P260 HydrophobicContact CG-CB 4.06Å; F111-P260 HydrophobicContact CG-CG 4.23Å; F111-P260 HydrophobicContact CZ-CB 4.07Å; F111-P260 HydrophobicContact CZ-CG 3.86Å; W251-P260 HydrophobicContact CH2-CG 4.04Å; W251-P260 HydrophobicContact CZ2-CG 4.04Å; P260-F262 HydrophobicContact CB-CE1 4.35Å; P260-F262 HydrophobicContact CB-CE2 3.72Å; P260-F262 HydrophobicContact CB-CZ 3.62Å; P260-F262 HydrophobicContact CG-CE2 3.99Å; P260-F262 HydrophobicContact CG-CZ 4.12Å
261	V	76.2	Confident	61.3	Low	135 Å²	135	80 Å²	80	82%	0.818	46%	0.459	S	S	*	.			trans	-115.6	116.7	176.7	-178	0	0	0	0	108.2
262	F	76.6	Confident	58.6	Low	24 Å²	24	82.8 Å²	82.8	11%	0.105	48%	0.479	C	S	.	.			trans	-108	132.5	177.9	-56.2	-70.6	0	0	0	110.3	I92 L95 T96 D107 F111 P260	I92-F262 HydrophobicContact CG2-CE2 3.56Å; I92-F262 HydrophobicContact CG2-CZ 3.52Å; L95-F262 HydrophobicContact CB-CD2 4.1Å; L95-F262 HydrophobicContact CB-CE2 4.13Å; T96-F262 HydrophobicContact CG2-CD2 3.77Å; T96-F262 HydrophobicContact CG2-CE2 4.03Å; T96-F262 HydrophobicContact CG2-CG 4.14Å; D107-F262 HydrophobicContact CB-CD1 3.42Å; D107-F262 VanDerWaalsContact CB-CD1 3.42Å; D107-F262 HydrophobicContact CB-CE1 3.59Å; D107-F262 HydrophobicContact CB-CG 4.01Å; D107-F262 HydrophobicContact CB-CZ 4.3Å; D107-F262 VanDerWaalsContact CG-CD1 3.45Å; D107-F262 VanDerWaalsContact O-CE1 3.28Å; D107-F262 WeakPolarHBondContact O-CE1 3.22Å; F111-F262 HydrophobicContact CB-CE1 4.25Å; F111-F262 HydrophobicContact CB-CZ 3.99Å; F111-F262 HydrophobicContact CG-CZ 4.4Å; P260-F262 HydrophobicContact CB-CE1 4.35Å; P260-F262 HydrophobicContact CB-CE2 3.72Å; P260-F262 HydrophobicContact CB-CZ 3.62Å; P260-F262 HydrophobicContact CG-CE2 3.99Å; P260-F262 HydrophobicContact CG-CZ 4.12Å
263	P	59.1	Low	56.4	Low	83 Å²	83	80 Å²	80	54%	0.539	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-62.9	148.6	179.4	1.7	-2.5	0	0	0	113.2	R98	R98-P263 WeakPolarHBondContact CD-O 3.27Å; R98-P263 PolarHBondContact NE-O 2.81Å; R98-P263 PolarHBondContact NH1-O 3.05Å
264	A	56.2	Low	54.2	Low	60 Å²	60	80.1 Å²	80.1	50%	0.496	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-80.9	157.8	172.8	0	0	0	0	0	112.1
265	N	47	Very low	51.8	Low	54 Å²	54	84.9 Å²	84.9	29%	0.289	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-46.3	133.4	-172.2	-70.1	-53.8	0	0	0	117.2	S97 R98 S99	S97-N265 PolarHBondContact O-ND2 3.31Å; R98-N265 WeakPolarHBondContact CA-OD1 3.42Å; S99-N265 WeakPolarHBondContact CA-OD1 3.4Å; S99-N265 VanDerWaalsContact CB-CG 3.4Å; S99-N265 WeakPolarHBondContact CB-ND2 3.47Å; S99-N265 VanDerWaalsContact CB-OD1 3.24Å; S99-N265 WeakPolarHBondContact CB-OD1 3.48Å; S99-N265 VanDerWaalsContact N-CG 3.27Å; S99-N265 PolarHBondContact N-ND2 3.41Å; S99-N265 PolarHBondContact N-OD1 3.47Å; S99-N265 PolarHBondContact OG-ND2 3.45Å; S99-N265 PolarHBondContact OG-OD1 3.45Å
266	P	38.3	Very low	49.4	Very low	104 Å²	104	90.3 Å²	90.3	68%	0.675	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-79.5	133	155.8	4.5	12.8	0	0	0	110.9
267	L	34.5	Very low	47.7	Very low	150 Å²	150	91.2 Å²	91.2	79%	0.785	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-74.7	140.6	171.2	-75.4	162.5	0	0	0	110.9
268	K	29.4	Very low	45.8	Very low	209 Å²	209	95.3 Å²	95.3	91%	0.909	56%	0.561	S	S	*	*			trans	-45.1	134.4	-171.7	-65.7	171.1	174.1	176.1	0	117.4
269	S	29.3	Very low	43.7	Very low	117 Å²	117	97.4 Å²	97.4	82%	0.818	56%	0.562	S	S	*	*				-171.6	162.7	127.7	64.7	0	0	0	0	111.1
270	N	27.8	Very low	41	Very low	163 Å²	163	98.5 Å²	98.5	87%	0.872	58%	0.575	S	S	*	*			trans	-78.1	120.1	-159.8	-56.8	-53.9	0	0	0	115
271	A	31.4	Very low	38.4	Very low	68 Å²	68	101.6 Å²	101.6	56%	0.562	59%	0.594	S	S	*	*			trans	-169.3	123.6	153.2	0	0	0	0	0	109.5
272	T	31.4	Very low	36	Very low	83 Å²	83	102.4 Å²	102.4	51%	0.509	59%	0.592	S	S	.	*			trans	-94.8	94.2	170.2	51.5	0	0	0	0	108.7
273	D	32.5	Very low	33.6	Very low	69 Å²	69	105.6 Å²	105.6	37%	0.369	61%	0.609	S	S	.	*			trans	-93.8	118.3	154.3	-75.7	-44.6	0	0	0	107.2	R637 T1216	D273-R637 IonicContact OD1-CZ 3.2Å; D273-R637 IonicContact OD1-NH1 2.76Å; D273-R637 PolarHBondContact OD1-NH1 2.97Å; D273-R637 IonicContact OD1-NH2 3.44Å; D273-R637 PolarHBondContact OD1-NH2 3.07Å; D273-T1216 VanDerWaalsContact O-CG2 3.27Å; D273-T1216 WeakPolarHBondContact O-CG2 3.46Å
274	D	35.6	Very low	32.1	Very low	90 Å²	90	104.6 Å²	104.6	48%	0.481	61%	0.614	S	S	.	*			trans	-118.5	100.9	156.7	-79.8	-49.3	0	0	0	105.6	T1216	D274-T1216 WeakPolarHBondContact OD1-CA 3.37Å; D274-T1216 VanDerWaalsContact OD1-CB 3.28Å; D274-T1216 WeakPolarHBondContact OD1-CB 3.37Å; D274-T1216 WeakPolarHBondContact OD1-CG2 3.36Å
275	D	32.7	Very low	30.8	Very low	113 Å²	113	110.2 Å²	110.2	60%	0.604	63%	0.63	S	S	*	*			trans	-94.9	121.2	162.6	-125	-17.3	0	0	0	107.8	S277	D275-S277 PolarHBondContact O-N 2.72Å
276	D	30.7	Very low	30	Very low	127 Å²	127	116.8 Å²	116.8	68%	0.679	66%	0.656	S	S	*	*			trans	-78.6	89.3	162.9	-88.4	-38.9	0	0	0	107.4	S278	D276-S278 VanDerWaalsContact C-N 3.32Å; D276-S278 PolarHBondContact O-N 2.75Å
277	S	30.5	Very low	29.5	Very low	50 Å²	50	118.2 Å²	118.2	35%	0.35	66%	0.663	S	S	.	*			trans	-91.5	71.5	162.5	58.6	0	0	0	0	109.6	D275 E279 E873	D275-S277 PolarHBondContact O-N 2.72Å; S277-E279 VanDerWaalsContact C-N 3.33Å; S277-E279 PolarHBondContact O-N 2.9Å; S277-E873 WeakPolarHBondContact CB-OE1 3.36Å
278	S	31.1	Very low	29.4	Very low	104 Å²	104	119.4 Å²	119.4	73%	0.727	67%	0.665	S	S	*	*			trans	-69.3	95.4	158.6	60.4	0	0	0	0	108.8	D276 C280	D276-S278 VanDerWaalsContact C-N 3.32Å; D276-S278 PolarHBondContact O-N 2.75Å; S278-C280 PolarHBondContact O-N 3.4Å
279	E	26.3	Very low	29.3	Very low	144 Å²	144	118.4 Å²	118.4	67%	0.673	66%	0.663	S	S	*	*			trans	12.6	69.3	147.6	-151.7	174.2	-152.2	0	0	116	S277 T281	S277-E279 VanDerWaalsContact C-N 3.33Å; S277-E279 PolarHBondContact O-N 2.9Å; E279-T281 VanDerWaalsContact C-N 3.33Å; E279-T281 PolarHBondContact O-N 3.49Å
280	C	24.8	Very low	29.4	Very low	108 Å²	108	120 Å²	120	73%	0.73	66%	0.661	S	S	*	*			trans	-88.1	81.9	161.6	-163.2	0	0	0	0	107.8	S278 I282	S278-C280 PolarHBondContact O-N 3.4Å; C280-I282 VanDerWaalsContact C-N 3.28Å; C280-I282 PolarHBondContact O-N 2.94Å
281	T	25.6	Very low	29.5	Very low	78 Å²	78	120.6 Å²	120.6	48%	0.479	66%	0.658	S	S	.	*			trans	-68	95.7	163.6	-32.1	0	0	0	0	106.8	E279 I283	E279-T281 VanDerWaalsContact C-N 3.33Å; E279-T281 PolarHBondContact O-N 3.49Å; T281-I283 HydrophobicContact CG2-CD1 4.22Å; T281-I283 HydrophobicContact CG2-CG1 3.74Å; T281-I283 PolarHBondContact O-N 3.1Å
282	I	26.2	Very low	29.5	Very low	152 Å²	152	124.4 Å²	124.4	78%	0.779	67%	0.668	S	S	*	*			trans	-67	80.5	162.6	-58.6	179.8	0	0	0	106.5	C280 G284	C280-I282 VanDerWaalsContact C-N 3.28Å; C280-I282 PolarHBondContact O-N 2.94Å; I282-G284 PolarHBondContact O-N 3.13Å
283	I	26.4	Very low	29.7	Very low	91 Å²	91	128.5 Å²	128.5	47%	0.467	68%	0.681	S	S	.	*			trans	-78	102.5	157.3	-60.8	178.6	0	0	0	104.3	T281 E285	T281-I283 HydrophobicContact CG2-CD1 4.22Å; T281-I283 HydrophobicContact CG2-CG1 3.74Å; T281-I283 PolarHBondContact O-N 3.1Å; I283-E285 PolarHBondContact O-N 2.78Å
284	G	27.4	Very low	29.6	Very low	62 Å²	62	132.4 Å²	132.4	64%	0.639	70%	0.697	S	S	*	*			trans	-55.1	101.3	166.9	0	0	0	0	0	109.4	I282 K286	I282-G284 PolarHBondContact O-N 3.13Å; G284-K286 PolarHBondContact O-N 2.9Å
285	E	28.1	Very low	29.7	Very low	178 Å²	178	137 Å²	137	83%	0.832	72%	0.716	S	S	*	*			trans	-68	101.2	166.2	-76.8	-172.3	150	0	0	107.5	I283 T287	I283-E285 PolarHBondContact O-N 2.78Å; E285-T287 PolarHBondContact O-N 3.12Å; E285-T287 VanDerWaalsContact O-N 3.11Å
286	K	30.2	Very low	29.8	Very low	192 Å²	192	141 Å²	141	84%	0.835	72%	0.724	S	S	*	*			trans	-59.9	107.5	155.1	-76.9	-178.9	174.8	-179.3	0	107	G284 E288	G284-K286 PolarHBondContact O-N 2.9Å; K286-E288 PolarHBondContact O-N 3.36Å; K286-E288 VanDerWaalsContact O-N 3.11Å
287	T	27.1	Very low	30.3	Very low	134 Å²	134	144.3 Å²	144.3	82%	0.822	74%	0.735	S	S	*	*			trans	-61.3	102.7	161	38.4	0	0	0	0	108.6	E285	E285-T287 PolarHBondContact O-N 3.12Å; E285-T287 VanDerWaalsContact O-N 3.11Å
288	E	32.5	Very low	30.5	Very low	176 Å²	176	149 Å²	149	82%	0.822	76%	0.756	S	S	*	*			trans	-87.1	115.3	158.3	-78.5	-176.8	170.7	0	0	107.7	K286 I290	K286-E288 PolarHBondContact O-N 3.36Å; K286-E288 VanDerWaalsContact O-N 3.11Å; E288-I290 PolarHBondContact O-N 3.42Å
289	E	28.8	Very low	30.9	Very low	188 Å²	188	151.4 Å²	151.4	88%	0.879	76%	0.761	S	S	*	*			trans	-59.5	126.1	169.1	-67.4	169	153.5	0	0	109.2
290	I	30.2	Very low	31.6	Very low	151 Å²	151	151 Å²	151	77%	0.774	76%	0.764	S	S	*	*			trans	-114.2	104.4	166.4	-62.7	177.1	0	0	0	106.7	E288	E288-I290 PolarHBondContact O-N 3.42Å
291	E	30.9	Very low	32.1	Very low	174 Å²	174	152.6 Å²	152.6	81%	0.813	77%	0.765	S	S	*	*			trans	-61.1	127.2	167.3	-68.5	173.2	151.3	0	0	109.5
292	I	31.4	Very low	33	Very low	148 Å²	148	154.4 Å²	154.4	76%	0.759	78%	0.781	S	S	*	*			trans	-105.9	100	167.4	-60.7	174.9	0	0	0	105.8
293	E	34.7	Very low	33.4	Very low	169 Å²	169	155.2 Å²	155.2	79%	0.79	78%	0.781	S	S	*	*			trans	-78.2	116.6	167.4	-75.2	179.7	152.7	0	0	109.3
294	E	30.9	Very low	33.9	Very low	151 Å²	151	157.1 Å²	157.1	71%	0.706	80%	0.797	S	S	*	*			trans	-95.4	113.3	164.1	-69.9	-176	168.4	0	0	108.5	Y296	E294-Y296 HydrophobicContact CB-CE2 4.5Å
295	E	37.2	Very low	34.6	Very low	187 Å²	187	165 Å²	165	87%	0.874	81%	0.809	S	S	*	*			trans	-110.6	118.3	166.3	-79	-172.6	161.4	0	0	110.2
296	Y	34.1	Very low	35.6	Very low	197 Å²	197	160.3 Å²	160.3	77%	0.773	79%	0.788	S	S	*	*			trans	-102.2	127.9	167	-72.8	-95.1	0	0	0	108.5	E294	E294-Y296 HydrophobicContact CB-CE2 4.5Å
297	E	41.3	Very low	36.5	Very low	196 Å²	196	157.2 Å²	157.2	92%	0.916	78%	0.78	S	S	*	*			trans	-136.2	112.2	158.9	-77.2	-166.1	160.6	0	0	110.9
298	D	36.2	Very low	37.8	Very low	148 Å²	148	156.9 Å²	156.9	79%	0.791	77%	0.773	S	S	*	*			trans	-81.9	141.2	162.6	-83.8	-39	0	0	0	110.2
299	N	39	Very low	38.8	Very low	156 Å²	156	158.7 Å²	158.7	83%	0.834	77%	0.772	S	S	*	*				161	114.4	121.1	-83.6	-50.6	0	0	0	114.3
300	D	40.1	Very low	40.1	Very low	135 Å²	135	154.5 Å²	154.5	72%	0.722	75%	0.753	S	S	*	*				47.3	116.6	121.7	-133.4	19.2	0	0	0	123.2
301	D	36.5	Very low	41.4	Very low	141 Å²	141	153 Å²	153	75%	0.754	74%	0.741	S	S	*	*			trans	48.7	110.3	135.7	-71.9	-3.1	0	0	0	122.7
302	S	43.7	Very low	43	Very low	116 Å²	116	148.7 Å²	148.7	81%	0.811	72%	0.72	S	S	*	*				-167.9	111.7	119.6	35.4	0	0	0	0	111.9
303	E	34.6	Very low	44.5	Very low	170 Å²	170	150.7 Å²	150.7	79%	0.794	72%	0.718	S	S	*	*			trans	-65.2	165	169.8	-114.1	171.9	160	0	0	111.8	I306	E303-I306 HydrophobicContact CG-CD1 3.87Å
304	V	37	Very low	45.9	Very low	131 Å²	131	146.6 Å²	146.6	79%	0.794	70%	0.702	S	S	*	*	S	Bend	trans	93.7	49.2	177.5	-159.3	0	0	0	0	115.7
305	Y	42.6	Very low	47.6	Very low	227 Å²	227	146.9 Å²	146.9	89%	0.89	70%	0.697	S	S	*	*	S	Bend	trans	-156.1	24.9	145.6	-108.3	-79.3	0	0	0	111.9
306	I	49.1	Very low	49.2	Very low	79 Å²	79	143.6 Å²	143.6	41%	0.405	68%	0.681	S	S	.	*	H	α-helix	trans	-92.4	-24.9	-153.9	-62.5	-176.6	0	0	0	114.7	E303 D308 E310	E303-I306 HydrophobicContact CG-CD1 3.87Å; I306-D308 PolarHBondContact O-N 2.74Å; I306-E310 VanDerWaalsContact O-CB 3.24Å; I306-E310 WeakPolarHBondContact O-CB 3.45Å; I306-E310 PolarHBondContact O-N 3.2Å; I306-E310 VanDerWaalsContact O-N 3.16Å
307	I	49	Very low	50.9	Low	127 Å²	127	137 Å²	137	65%	0.651	66%	0.659	S	S	*	*	H	α-helix	trans	-75.5	-29.6	-164.9	-57.4	173.9	0	0	0	114.8
308	D	52.9	Low	52.2	Low	127 Å²	127	128.2 Å²	128.2	68%	0.679	62%	0.62	S	S	*	*	H	α-helix	trans	-89.2	-30.4	178.1	-86.3	-21.8	0	0	0	113.4	I306 E310	I306-D308 PolarHBondContact O-N 2.74Å; D308-E310 VanDerWaalsContact C-N 3.3Å
309	R	54.6	Low	54	Low	214 Å²	214	124.9 Å²	124.9	81%	0.808	61%	0.608	S	S	*	*	H	α-helix	trans	-66.9	-33.9	171.5	-108.8	-174.1	-179.7	-170.6	0.9	111.7	E312 R313	R309-E312 PolarHBondContact O-N 2.85Å; R309-R313 VanDerWaalsContact O-CB 3.31Å; R309-R313 WeakPolarHBondContact O-CB 3.25Å; R309-R313 PolarHBondContact O-N 3.44Å
310	E	56.3	Low	56	Low	100 Å²	100	120.7 Å²	120.7	47%	0.467	59%	0.592	S	S	.	*	H	α-helix	trans	-71.4	-35.6	-177	-163.1	161.4	-142.4	0	0	113	I306 D308 E312 R313 N314	I306-E310 VanDerWaalsContact O-CB 3.24Å; I306-E310 WeakPolarHBondContact O-CB 3.45Å; I306-E310 PolarHBondContact O-N 3.2Å; I306-E310 VanDerWaalsContact O-N 3.16Å; D308-E310 VanDerWaalsContact C-N 3.3Å; E310-E312 VanDerWaalsContact C-N 3.34Å; E310-E312 PolarHBondContact O-N 3.14Å; E310-R313 PolarHBondContact O-N 3.27Å; E310-N314 VanDerWaalsContact O-CB 3.29Å; E310-N314 WeakPolarHBondContact O-CB 3.36Å; E310-N314 PolarHBondContact O-N 3.49Å; E310-N314 PolarHBondContact O-ND2 3.07Å
311	K	56.4	Low	57.8	Low	120 Å²	120	114.9 Å²	114.9	52%	0.522	56%	0.56	S	S	.	*	H	α-helix	trans	-65.8	-35.5	172.2	-72.7	177.4	-173.1	160.4	0	113	R315	K311-R315 PolarHBondContact O-N 3.33Å
312	E	64.4	Low	59.7	Low	83 Å²	83	109 Å²	109	39%	0.388	53%	0.529	S	S	.	.	H	α-helix	trans	-74.4	-42.5	175.9	-172.2	55.6	-150.4	0	0	111	R309 E310 N314 R315 Q316	R309-E312 PolarHBondContact O-N 2.85Å; E310-E312 VanDerWaalsContact C-N 3.34Å; E310-E312 PolarHBondContact O-N 3.14Å; E312-N314 VanDerWaalsContact C-N 3.31Å; E312-N314 PolarHBondContact O-N 3.5Å; E312-R315 PolarHBondContact O-N 2.87Å; E312-R315 VanDerWaalsContact O-N 3.16Å; E312-R315 IonicContact OE2-CZ 2.63Å; E312-R315 IonicContact OE2-NE 2.92Å; E312-R315 IonicContact OE2-NH2 3.74Å; E312-Q316 WeakPolarHBondContact O-CG 3.1Å; E312-Q316 PolarHBondContact O-N 3.08Å; E312-Q316 PolarHBondContact OE1-NE2 3.21Å
313	R	64.1	Low	61.5	Low	190 Å²	190	108 Å²	108	72%	0.717	51%	0.511	S	S	*	.	H	α-helix	trans	-59.1	-41.2	173.6	-156.4	178.6	-157.3	165.3	4.1	111.8	R309 E310 Q316 L317	R309-R313 VanDerWaalsContact O-CB 3.31Å; R309-R313 WeakPolarHBondContact O-CB 3.25Å; R309-R313 PolarHBondContact O-N 3.44Å; E310-R313 PolarHBondContact O-N 3.27Å; R313-Q316 PolarHBondContact O-N 3.22Å; R313-L317 WeakPolarHBondContact O-CB 3.39Å; R313-L317 PolarHBondContact O-N 2.8Å
314	N	63.2	Low	63.9	Low	84 Å²	84	102.1 Å²	102.1	45%	0.449	48%	0.484	S	S	.	.	H	α-helix	trans	-68	-35.1	176.5	-75.5	-17.2	0	0	0	112.9	E310 E312 A318	E310-N314 VanDerWaalsContact O-CB 3.29Å; E310-N314 WeakPolarHBondContact O-CB 3.36Å; E310-N314 PolarHBondContact O-N 3.49Å; E310-N314 PolarHBondContact O-ND2 3.07Å; E312-N314 VanDerWaalsContact C-N 3.31Å; E312-N314 PolarHBondContact O-N 3.5Å; N314-A318 WeakPolarHBondContact O-CB 3.19Å; N314-A318 PolarHBondContact O-N 3.27Å
315	R	67.1	Low	66.1	Low	157 Å²	157	95.9 Å²	95.9	59%	0.592	45%	0.446	S	S	*	.	H	α-helix	trans	-67.5	-44	172.8	-87.4	-172.9	-88.9	-173.6	-2.6	112.1	K311 E312 A318 S319	K311-R315 PolarHBondContact O-N 3.33Å; E312-R315 PolarHBondContact O-N 2.87Å; E312-R315 VanDerWaalsContact O-N 3.16Å; E312-R315 IonicContact OE2-CZ 2.63Å; E312-R315 IonicContact OE2-NE 2.92Å; E312-R315 IonicContact OE2-NH2 3.74Å; R315-A318 PolarHBondContact O-N 3.1Å; R315-S319 PolarHBondContact O-N 3.11Å; R315-S319 VanDerWaalsContact O-N 3.09Å
316	Q	71.3	Confident	68.1	Low	117 Å²	117	91.1 Å²	91.1	55%	0.547	43%	0.426	S	S	.	.	H	α-helix	trans	-64.6	-43	176.9	-69.7	174.8	3.1	0	0	111.7	E312 R313 S319 S320	E312-Q316 WeakPolarHBondContact O-CG 3.1Å; E312-Q316 PolarHBondContact O-N 3.08Å; E312-Q316 PolarHBondContact OE1-NE2 3.21Å; R313-Q316 PolarHBondContact O-N 3.22Å; Q316-S319 PolarHBondContact O-N 3.24Å; Q316-S320 WeakPolarHBondContact O-CB 3.41Å; Q316-S320 PolarHBondContact O-N 3.27Å
317	L	69.2	Low	69.8	Low	58 Å²	58	93.4 Å²	93.4	30%	0.304	44%	0.435	S	S	.	.	H	α-helix	trans	-61.1	-45.2	176.1	-179.4	67.7	0	0	0	112	R313 S319 S320 L321	R313-L317 WeakPolarHBondContact O-CB 3.39Å; R313-L317 PolarHBondContact O-N 2.8Å; L317-S319 VanDerWaalsContact C-N 3.35Å; L317-S319 PolarHBondContact O-N 2.82Å; L317-S320 PolarHBondContact O-N 3.29Å; L317-L321 HydrophobicContact CG-CD1 4.37Å; L317-L321 WeakPolarHBondContact O-CG 3.2Å; L317-L321 PolarHBondContact O-N 3.26Å
318	A	68.6	Low	71.4	Confident	12 Å²	12	89.1 Å²	89.1	10%	0.099	41%	0.413	C	S	.	.	H	α-helix	trans	-65.8	-36.9	178.3	0	0	0	0	0	112.5	N314 R315 I322 I340	N314-A318 WeakPolarHBondContact O-CB 3.19Å; N314-A318 PolarHBondContact O-N 3.27Å; R315-A318 PolarHBondContact O-N 3.1Å; A318-I322 WeakPolarHBondContact O-CG1 3.4Å; A318-I322 PolarHBondContact O-N 3.13Å; A318-I340 HydrophobicContact CB-CG2 3.82Å
319	S	73.7	Confident	72.8	Confident	78 Å²	78	90.2 Å²	90.2	55%	0.545	42%	0.419	S	S	.	.	H	α-helix	trans	-66.6	-41.4	174.2	-170.2	0	0	0	0	112.2	R315 Q316 L317 I322 Q323	R315-S319 PolarHBondContact O-N 3.11Å; R315-S319 VanDerWaalsContact O-N 3.09Å; Q316-S319 PolarHBondContact O-N 3.24Å; L317-S319 VanDerWaalsContact C-N 3.35Å; L317-S319 PolarHBondContact O-N 2.82Å; S319-I322 PolarHBondContact O-N 3.35Å; S319-Q323 PolarHBondContact O-N 3.1Å; S319-Q323 VanDerWaalsContact O-N 3.14Å
320	S	80.6	Confident	74.1	Confident	69 Å²	69	81 Å²	81	48%	0.483	39%	0.387	S	S	.	.	H	α-helix	trans	-63.1	-43.3	176.2	171.4	0	0	0	0	111.8	Q316 L317 I322 Q323 E324	Q316-S320 WeakPolarHBondContact O-CB 3.41Å; Q316-S320 PolarHBondContact O-N 3.27Å; L317-S320 PolarHBondContact O-N 3.29Å; S320-I322 VanDerWaalsContact C-N 3.34Å; S320-I322 PolarHBondContact O-N 2.85Å; S320-Q323 PolarHBondContact O-N 2.97Å; S320-E324 WeakPolarHBondContact O-CB 3.36Å; S320-E324 PolarHBondContact O-N 2.9Å
321	L	79	Confident	75.3	Confident	12 Å²	12	85.4 Å²	85.4	6%	0.063	41%	0.405	C	S	.	.	H	α-helix	trans	-63.3	-36.2	177.1	-72.1	172.3	0	0	0	112.8	L317 A325 C351 V354 R355 I358	L317-L321 HydrophobicContact CG-CD1 4.37Å; L317-L321 WeakPolarHBondContact O-CG 3.2Å; L317-L321 PolarHBondContact O-N 3.26Å; L321-A325 VanDerWaalsContact O-CB 3.25Å; L321-A325 WeakPolarHBondContact O-CB 3.37Å; L321-A325 PolarHBondContact O-N 3.49Å; L321-C351 HydrophobicContact CD1-CB 4.37Å; L321-V354 HydrophobicContact CB-CG1 3.99Å; L321-R355 HydrophobicContact CD1-CG 4.18Å; L321-R355 HydrophobicContact CD2-CG 3.54Å; L321-I358 HydrophobicContact CD2-CD1 3.88Å; L321-I358 WeakPolarHBondContact O-CD1 3.47Å
322	I	76.4	Confident	76.1	Confident	18 Å²	18	80.7 Å²	80.7	9%	0.092	39%	0.385	C	S	.	.	H	α-helix	trans	-66.3	-43.8	174.5	-71.4	169.8	0	0	0	111	A318 S319 S320 A325 R326 L332 I340	A318-I322 WeakPolarHBondContact O-CG1 3.4Å; A318-I322 PolarHBondContact O-N 3.13Å; S319-I322 PolarHBondContact O-N 3.35Å; S320-I322 VanDerWaalsContact C-N 3.34Å; S320-I322 PolarHBondContact O-N 2.85Å; I322-A325 PolarHBondContact O-N 3.06Å; I322-R326 WeakPolarHBondContact O-CG 3.3Å; I322-R326 PolarHBondContact O-N 3.17Å; I322-L332 HydrophobicContact CG1-CD1 4.1Å; I322-I340 HydrophobicContact CD1-CB 3.73Å; I322-I340 HydrophobicContact CD1-CD1 4.16Å; I322-I340 HydrophobicContact CD1-CG2 3.21Å; I322-I340 HydrophobicContact CG1-CD1 4.21Å; I322-I340 HydrophobicContact CG1-CG2 4.17Å
323	Q	82.3	Confident	76.7	Confident	95 Å²	95	79 Å²	79	44%	0.444	39%	0.39	S	S	.	.	H	α-helix	trans	-63.2	-46	-179	-178.5	58.7	26.6	0	0	110.8	S319 S320 A325 R326 E327	S319-Q323 PolarHBondContact O-N 3.1Å; S319-Q323 VanDerWaalsContact O-N 3.14Å; S320-Q323 PolarHBondContact O-N 2.97Å; Q323-A325 PolarHBondContact O-N 3.02Å; Q323-R326 WeakPolarHBondContact O-CB 3.43Å; Q323-R326 PolarHBondContact O-N 3.26Å; Q323-R326 VanDerWaalsContact O-N 3.14Å; Q323-E327 PolarHBondContact NE2-OE1 2.75Å; Q323-E327 WeakPolarHBondContact O-CG 3.24Å; Q323-E327 PolarHBondContact O-N 3.08Å
324	E	84.3	Confident	77.1	Confident	46 Å²	46	75.4 Å²	75.4	22%	0.215	39%	0.385	C	S	.	.	H	α-helix	trans	-65	-38.1	177.1	-171	176.6	-168.2	0	0	112.2	S320 R326 E327 L328 I358 K362	S320-E324 WeakPolarHBondContact O-CB 3.36Å; S320-E324 PolarHBondContact O-N 2.9Å; E324-R326 VanDerWaalsContact C-N 3.32Å; E324-R326 PolarHBondContact O-N 3.16Å; E324-E327 PolarHBondContact O-N 3.46Å; E324-L328 HydrophobicContact CG-CD1 4.18Å; E324-L328 WeakPolarHBondContact O-CG 3.37Å; E324-L328 PolarHBondContact O-N 3.39Å; E324-L328 VanDerWaalsContact O-N 3.14Å; E324-I358 HydrophobicContact CB-CD1 3.97Å; E324-I358 VanDerWaalsContact CD-CG2 3.44Å; E324-I358 HydrophobicContact CG-CD1 4.01Å; E324-I358 HydrophobicContact CG-CG1 4.37Å; E324-I358 HydrophobicContact CG-CG2 3.8Å; E324-I358 WeakPolarHBondContact OE1-CG2 3.37Å; E324-K362 WeakPolarHBondContact OE1-CE 3.12Å; E324-K362 IonicContact OE1-NZ 2.89Å; E324-K362 PolarHBondContact OE1-NZ 3.12Å
325	A	83.5	Confident	77.6	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-61.7	-38.5	172.3	0	0	0	0	0	112.1	L321 I322 Q323 L328 N329 V330 L332 I358	L321-A325 VanDerWaalsContact O-CB 3.25Å; L321-A325 WeakPolarHBondContact O-CB 3.37Å; L321-A325 PolarHBondContact O-N 3.49Å; I322-A325 PolarHBondContact O-N 3.06Å; Q323-A325 PolarHBondContact O-N 3.02Å; A325-L328 PolarHBondContact O-N 2.77Å; A325-N329 PolarHBondContact O-N 3.18Å; A325-V330 HydrophobicContact CB-CB 4.03Å; A325-V330 HydrophobicContact CB-CG1 4.43Å; A325-V330 WeakPolarHBondContact O-CB 3.48Å; A325-V330 PolarHBondContact O-N 3.32Å; A325-L332 HydrophobicContact CB-CD1 3.97Å; A325-L332 HydrophobicContact CB-CD2 4.43Å; A325-L332 HydrophobicContact CB-CG 4.19Å; A325-I358 HydrophobicContact CB-CD1 4.33Å; A325-I358 HydrophobicContact CB-CG1 4.31Å
326	R	83.3	Confident	77.7	Confident	128 Å²	128	70.4 Å²	70.4	48%	0.483	37%	0.37	S	S	.	.	H	α-helix	trans	-68.4	-42.9	176.3	-74.5	175	177.6	176.6	0.3	112.6	I322 Q323 E324 L328 N329 E337	I322-R326 WeakPolarHBondContact O-CG 3.3Å; I322-R326 PolarHBondContact O-N 3.17Å; Q323-R326 WeakPolarHBondContact O-CB 3.43Å; Q323-R326 PolarHBondContact O-N 3.26Å; Q323-R326 VanDerWaalsContact O-N 3.14Å; E324-R326 VanDerWaalsContact C-N 3.32Å; E324-R326 PolarHBondContact O-N 3.16Å; R326-L328 PolarHBondContact O-N 3.16Å; R326-N329 PolarHBondContact O-N 3.23Å; R326-N329 VanDerWaalsContact O-N 3.12Å; R326-E337 IonicContact CZ-OE1 3.62Å; R326-E337 IonicContact NH2-OE1 2.73Å; R326-E337 PolarHBondContact NH2-OE1 2.78Å
327	E	85.2	Confident	77.7	Confident	126 Å²	126	66.9 Å²	66.9	59%	0.589	35%	0.353	S	S	*	.	H	α-helix	trans	-62.1	-29	177.3	-73.8	169.8	-167.2	0	0	112.7	Q323 E324	Q323-E327 PolarHBondContact NE2-OE1 2.75Å; Q323-E327 WeakPolarHBondContact O-CG 3.24Å; Q323-E327 PolarHBondContact O-N 3.08Å; E324-E327 PolarHBondContact O-N 3.46Å
328	L	82.3	Confident	77.8	Confident	37 Å²	37	69.1 Å²	69.1	19%	0.194	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	8.2	177.7	-64.8	169.6	0	0	0	113.7	E324 A325 R326 V330 I358 A361 K362	E324-L328 HydrophobicContact CG-CD1 4.18Å; E324-L328 WeakPolarHBondContact O-CG 3.37Å; E324-L328 PolarHBondContact O-N 3.39Å; E324-L328 VanDerWaalsContact O-N 3.14Å; A325-L328 PolarHBondContact O-N 2.77Å; R326-L328 PolarHBondContact O-N 3.16Å; L328-V330 HydrophobicContact CB-CG2 3.87Å; L328-V330 PolarHBondContact O-N 3.41Å; L328-I358 HydrophobicContact CD1-CB 4.35Å; L328-I358 HydrophobicContact CD1-CG1 4.47Å; L328-I358 HydrophobicContact CD1-CG2 3.75Å; L328-A361 HydrophobicContact CB-CB 4.13Å; L328-A361 HydrophobicContact CD1-CB 4.43Å; L328-K362 HydrophobicContact CD1-CD 4.37Å; L328-K362 HydrophobicContact CD1-CG 3.72Å; L328-K362 HydrophobicContact CD2-CG 4.18Å
329	N	82.3	Confident	77.9	Confident	150 Å²	150	71.8 Å²	71.8	80%	0.802	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	31.6	-175.7	-70.9	-42.4	0	0	0	114.5	A325 R326 K331	A325-N329 PolarHBondContact O-N 3.18Å; R326-N329 PolarHBondContact O-N 3.23Å; R326-N329 VanDerWaalsContact O-N 3.12Å; N329-K331 PolarHBondContact O-N 3.22Å
330	V	82.3	Confident	77.6	Confident	22 Å²	22	69.3 Å²	69.3	13%	0.133	35%	0.348	C	S	.	.			trans	-78.9	114	176.9	177.4	0	0	0	0	109.7	A325 L328 L332 M357 A361	A325-V330 HydrophobicContact CB-CB 4.03Å; A325-V330 HydrophobicContact CB-CG1 4.43Å; A325-V330 WeakPolarHBondContact O-CB 3.48Å; A325-V330 PolarHBondContact O-N 3.32Å; L328-V330 HydrophobicContact CB-CG2 3.87Å; L328-V330 PolarHBondContact O-N 3.41Å; V330-L332 PolarHBondContact O-N 3.08Å; V330-M357 HydrophobicContact CG1-CB 3.67Å; V330-M357 HydrophobicContact CG1-CE 3.97Å; V330-M357 HydrophobicContact CG1-SD 4.38Å; V330-A361 HydrophobicContact CG2-CB 3.6Å
331	K	81	Confident	76.9	Confident	192 Å²	192	72.3 Å²	72.3	84%	0.835	35%	0.353	S	S	*	.			trans	-72.9	106.7	177.8	-67.3	-176.1	-179	178.1	0	111	N329	N329-K331 PolarHBondContact O-N 3.22Å
332	L	74.9	Confident	76.4	Confident	21 Å²	21	80.7 Å²	80.7	11%	0.11	38%	0.383	C	S	.	.			trans	-80.3	135.3	167.9	-60.9	172.7	0	0	0	108.7	I322 A325 V330 D334 L336 V354	I322-L332 HydrophobicContact CG1-CD1 4.1Å; A325-L332 HydrophobicContact CB-CD1 3.97Å; A325-L332 HydrophobicContact CB-CD2 4.43Å; A325-L332 HydrophobicContact CB-CG 4.19Å; V330-L332 PolarHBondContact O-N 3.08Å; L332-D334 PolarHBondContact O-N 3.44Å; L332-L336 HydrophobicContact CD2-CD2 4.41Å; L332-V354 HydrophobicContact CD2-CB 4.35Å; L332-V354 HydrophobicContact CD2-CG1 3.93Å; L332-V354 HydrophobicContact CD2-CG2 3.63Å
333	G	76.2	Confident	75.6	Confident	48 Å²	48	82.7 Å²	82.7	50%	0.495	41%	0.409	S	S	.	.			trans	-58.6	139.3	176.6	0	0	0	0	0	111.4	D335 L336 E337	G333-D335 PolarHBondContact O-N 3Å; G333-L336 WeakPolarHBondContact O-CB 3.26Å; G333-L336 PolarHBondContact O-N 3.47Å; G333-E337 PolarHBondContact O-N 3.29Å
334	D	73.4	Confident	74.7	Confident	114 Å²	114	80.8 Å²	80.8	61%	0.61	41%	0.406	S	S	*	.	H	α-helix	trans	-50.3	-35	-175.1	-71	-3.3	0	0	0	113.6	L332 K338	L332-D334 PolarHBondContact O-N 3.44Å; D334-K338 VanDerWaalsContact O-CB 3.26Å; D334-K338 WeakPolarHBondContact O-CB 3.32Å; D334-K338 WeakPolarHBondContact O-CD 3.44Å; D334-K338 WeakPolarHBondContact O-CG 3.22Å; D334-K338 PolarHBondContact O-N 3.07Å
335	D	72.9	Confident	73.5	Confident	109 Å²	109	87.9 Å²	87.9	58%	0.583	44%	0.436	S	S	*	.	H	α-helix	trans	-70.6	-40.5	179.6	-164.5	49.6	0	0	0	112.2	G333 K338 R339	G333-D335 PolarHBondContact O-N 3Å; D335-K338 PolarHBondContact O-N 3.17Å; D335-R339 WeakPolarHBondContact O-CB 3.38Å; D335-R339 VanDerWaalsContact O-CG 3.24Å; D335-R339 WeakPolarHBondContact O-CG 3.47Å; D335-R339 PolarHBondContact O-N 3.42Å
336	L	69.9	Low	72.7	Confident	26 Å²	26	89.6 Å²	89.6	14%	0.136	45%	0.447	C	S	.	.	H	α-helix	trans	-69.4	-43.5	177.1	-174.5	63.7	0	0	0	110.9	L332 G333 K338 R339 I340 E350 V354	L332-L336 HydrophobicContact CD2-CD2 4.41Å; G333-L336 WeakPolarHBondContact O-CB 3.26Å; G333-L336 PolarHBondContact O-N 3.47Å; L336-K338 VanDerWaalsContact C-N 3.34Å; L336-K338 PolarHBondContact O-N 2.93Å; L336-R339 PolarHBondContact O-N 3.42Å; L336-I340 HydrophobicContact CD1-CD1 4.14Å; L336-I340 HydrophobicContact CD1-CG1 4.34Å; L336-I340 HydrophobicContact CG-CD1 3.87Å; L336-I340 HydrophobicContact CG-CG1 4.47Å; L336-I340 VanDerWaalsContact O-CG1 3.23Å; L336-I340 WeakPolarHBondContact O-CG1 3.3Å; L336-I340 PolarHBondContact O-N 3.05Å; L336-E350 HydrophobicContact CD1-CB 4Å; L336-E350 HydrophobicContact CD1-CG 4.04Å; L336-V354 HydrophobicContact CD2-CG2 3.73Å
337	E	70.1	Confident	72.2	Confident	43 Å²	43	86.9 Å²	86.9	20%	0.201	44%	0.444	C	S	.	.	H	α-helix	trans	-64	-40	176.7	-157.3	-169.2	172.9	0	0	111.2	R326 G333 K341	R326-E337 IonicContact CZ-OE1 3.62Å; R326-E337 IonicContact NH2-OE1 2.73Å; R326-E337 PolarHBondContact NH2-OE1 2.78Å; G333-E337 PolarHBondContact O-N 3.29Å; E337-K341 HydrophobicContact CG-CD 4.39Å; E337-K341 VanDerWaalsContact O-CB 3.28Å; E337-K341 WeakPolarHBondContact O-CB 3.39Å; E337-K341 WeakPolarHBondContact O-CG 3.43Å; E337-K341 PolarHBondContact O-N 3.4Å; E337-K341 WeakPolarHBondContact OE1-CE 3.25Å; E337-K341 IonicContact OE1-NZ 3.09Å; E337-K341 PolarHBondContact OE1-NZ 3.5Å; E337-K341 IonicContact OE2-NZ 2.7Å
338	K	72	Confident	71.5	Confident	106 Å²	106	86.6 Å²	86.6	46%	0.461	45%	0.447	S	S	.	.	H	α-helix	trans	-65	-40.5	173.9	-76.5	167.8	-170.2	165.8	0	112.2	D334 D335 L336 R342	D334-K338 VanDerWaalsContact O-CB 3.26Å; D334-K338 WeakPolarHBondContact O-CB 3.32Å; D334-K338 WeakPolarHBondContact O-CD 3.44Å; D334-K338 WeakPolarHBondContact O-CG 3.22Å; D334-K338 PolarHBondContact O-N 3.07Å; D335-K338 PolarHBondContact O-N 3.17Å; L336-K338 VanDerWaalsContact C-N 3.34Å; L336-K338 PolarHBondContact O-N 2.93Å; K338-R342 WeakPolarHBondContact O-CB 3.39Å; K338-R342 WeakPolarHBondContact O-CD 3.46Å; K338-R342 WeakPolarHBondContact O-CG 3.22Å; K338-R342 PolarHBondContact O-N 3Å
339	R	69.9	Low	71.2	Confident	68 Å²	68	88.2 Å²	88.2	26%	0.257	47%	0.465	S	S	.	.	H	α-helix	trans	-68	-43.2	179.2	-79.1	175.6	60.3	-157.6	-13.9	112.5	D335 L336 R342 G343 S344 K345 E350	D335-R339 WeakPolarHBondContact O-CB 3.38Å; D335-R339 VanDerWaalsContact O-CG 3.24Å; D335-R339 WeakPolarHBondContact O-CG 3.47Å; D335-R339 PolarHBondContact O-N 3.42Å; L336-R339 PolarHBondContact O-N 3.42Å; R339-R342 PolarHBondContact O-N 2.95Å; R339-G343 PolarHBondContact O-N 2.89Å; R339-S344 PolarHBondContact O-N 2.94Å; R339-K345 PolarHBondContact NH2-O 3.43Å; R339-K345 VanDerWaalsContact NH2-O 3.07Å; R339-E350 IonicContact CZ-OE1 3.25Å; R339-E350 IonicContact CZ-OE2 3.2Å; R339-E350 IonicContact NH1-OE1 2.95Å; R339-E350 PolarHBondContact NH1-OE1 3.44Å; R339-E350 VanDerWaalsContact NH2-CD 3.28Å; R339-E350 IonicContact NH2-OE1 3.32Å; R339-E350 PolarHBondContact NH2-OE1 3.5Å; R339-E350 IonicContact NH2-OE2 2.76Å; R339-E350 PolarHBondContact NH2-OE2 3.13Å
340	I	67.2	Low	71	Confident	26 Å²	26	82.8 Å²	82.8	13%	0.133	44%	0.435	C	S	.	.	H	α-helix	trans	-66	-43.2	176.2	-59	163.5	0	0	0	110.1	A318 I322 L336 R342 G343 V346	A318-I340 HydrophobicContact CB-CG2 3.82Å; I322-I340 HydrophobicContact CD1-CB 3.73Å; I322-I340 HydrophobicContact CD1-CD1 4.16Å; I322-I340 HydrophobicContact CD1-CG2 3.21Å; I322-I340 HydrophobicContact CG1-CD1 4.21Å; I322-I340 HydrophobicContact CG1-CG2 4.17Å; L336-I340 HydrophobicContact CD1-CD1 4.14Å; L336-I340 HydrophobicContact CD1-CG1 4.34Å; L336-I340 HydrophobicContact CG-CD1 3.87Å; L336-I340 HydrophobicContact CG-CG1 4.47Å; L336-I340 VanDerWaalsContact O-CG1 3.23Å; L336-I340 WeakPolarHBondContact O-CG1 3.3Å; L336-I340 PolarHBondContact O-N 3.05Å; I340-R342 VanDerWaalsContact C-N 3.25Å; I340-R342 PolarHBondContact O-N 3.33Å; I340-G343 PolarHBondContact O-N 3.39Å; I340-V346 HydrophobicContact CB-CG2 4.44Å; I340-V346 HydrophobicContact CG1-CG2 3.71Å
341	K	67.3	Low	70.6	Confident	132 Å²	132	82.4 Å²	82.4	57%	0.574	43%	0.433	S	S	*	.	H	α-helix	trans	-60.4	-30.3	173.9	-77.9	173.5	-176.9	164.6	0	113.6	E337 G343	E337-K341 HydrophobicContact CG-CD 4.39Å; E337-K341 VanDerWaalsContact O-CB 3.28Å; E337-K341 WeakPolarHBondContact O-CB 3.39Å; E337-K341 WeakPolarHBondContact O-CG 3.43Å; E337-K341 PolarHBondContact O-N 3.4Å; E337-K341 WeakPolarHBondContact OE1-CE 3.25Å; E337-K341 IonicContact OE1-NZ 3.09Å; E337-K341 PolarHBondContact OE1-NZ 3.5Å; E337-K341 IonicContact OE2-NZ 2.7Å; K341-G343 VanDerWaalsContact C-N 3.34Å
342	R	68	Low	70.6	Confident	187 Å²	187	77.3 Å²	77.3	71%	0.706	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	2.9	180	-73.2	171.8	-174.9	178.4	1.5	113.9	K338 R339 I340 S344	K338-R342 WeakPolarHBondContact O-CB 3.39Å; K338-R342 WeakPolarHBondContact O-CD 3.46Å; K338-R342 WeakPolarHBondContact O-CG 3.22Å; K338-R342 PolarHBondContact O-N 3Å; R339-R342 PolarHBondContact O-N 2.95Å; I340-R342 VanDerWaalsContact C-N 3.25Å; I340-R342 PolarHBondContact O-N 3.33Å; R342-S344 PolarHBondContact O-N 2.98Å; R342-S344 VanDerWaalsContact O-N 3.15Å
343	G	58.9	Low	71	Confident	61 Å²	61	82.1 Å²	82.1	63%	0.629	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	22.5	-177.3	0	0	0	0	0	113.6	R339 I340 K341	R339-G343 PolarHBondContact O-N 2.89Å; I340-G343 PolarHBondContact O-N 3.39Å; K341-G343 VanDerWaalsContact C-N 3.34Å
344	S	62.9	Low	71.3	Confident	54 Å²	54	80 Å²	80	38%	0.378	42%	0.416	S	S	.	.			trans	-73.8	155.7	177.3	-62.8	0	0	0	0	110.3	R339 R342 V346	R339-S344 PolarHBondContact O-N 2.94Å; R342-S344 PolarHBondContact O-N 2.98Å; R342-S344 VanDerWaalsContact O-N 3.15Å; S344-V346 PolarHBondContact O-N 2.95Å
345	K	60.6	Low	71.8	Confident	196 Å²	196	79.4 Å²	79.4	85%	0.852	41%	0.405	S	S	*	.			trans	-52.5	108.7	176.3	-76.2	-175.1	177	-177.4	0	109.7	R339	R339-K345 PolarHBondContact NH2-O 3.43Å; R339-K345 VanDerWaalsContact NH2-O 3.07Å
346	V	66	Low	72.5	Confident	36 Å²	36	77 Å²	77	22%	0.218	40%	0.401	C	S	.	.			trans	-86.4	122	165.3	-172.8	0	0	0	0	105	I340 S344 E350 C351	I340-V346 HydrophobicContact CB-CG2 4.44Å; I340-V346 HydrophobicContact CG1-CG2 3.71Å; S344-V346 PolarHBondContact O-N 2.95Å; V346-E350 HydrophobicContact CG1-CB 3.7Å; V346-C351 VanDerWaalsContact CG1-SG 3.52Å
347	T	72	Confident	73.2	Confident	70 Å²	70	79 Å²	79	43%	0.429	41%	0.41	S	S	.	.			trans	-70.9	151.2	176.9	59.2	0	0	0	0	109.5	A349 E350 C351	T347-A349 PolarHBondContact O-N 3.12Å; T347-A349 VanDerWaalsContact O-N 3.14Å; T347-E350 PolarHBondContact N-OE2 3.19Å; T347-E350 WeakPolarHBondContact O-CB 3.5Å; T347-E350 PolarHBondContact O-N 3.35Å; T347-E350 VanDerWaalsContact OG1-CD 3.28Å; T347-E350 VanDerWaalsContact OG1-CG 3.24Å; T347-E350 WeakPolarHBondContact OG1-CG 3.42Å; T347-E350 PolarHBondContact OG1-N 3.16Å; T347-E350 PolarHBondContact OG1-OE2 3.4Å; T347-C351 PolarHBondContact O-N 2.93Å; T347-C351 VanDerWaalsContact O-N 3.09Å
348	D	71.5	Confident	74.1	Confident	121 Å²	121	77.3 Å²	77.3	65%	0.647	40%	0.402	S	S	*	.	H	α-helix	trans	-56.8	-30.9	173.6	-67.3	-36.5	0	0	0	111.7	E350 C351 N352	D348-E350 PolarHBondContact O-N 3.21Å; D348-C351 PolarHBondContact O-N 3.39Å; D348-N352 WeakPolarHBondContact O-CB 3.25Å; D348-N352 PolarHBondContact O-N 2.82Å; D348-N352 PolarHBondContact O-ND2 2.86Å; D348-N352 VanDerWaalsContact O-ND2 3.14Å
349	A	76.9	Confident	74.9	Confident	71 Å²	71	81 Å²	81	59%	0.587	41%	0.413	S	S	*	.	H	α-helix	trans	-59.9	-42.5	172.8	0	0	0	0	0	112.6	T347 N352 M353	T347-A349 PolarHBondContact O-N 3.12Å; T347-A349 VanDerWaalsContact O-N 3.14Å; A349-N352 PolarHBondContact O-N 3.2Å; A349-M353 WeakPolarHBondContact O-CB 3.33Å; A349-M353 PolarHBondContact O-N 2.94Å
350	E	76.5	Confident	75.7	Confident	36 Å²	36	85.7 Å²	85.7	17%	0.168	43%	0.431	C	S	.	.	H	α-helix	trans	-70.4	-43.1	177.4	-74	163.1	149.7	0	0	112	L336 R339 V346 T347 D348 N352 M353 V354	L336-E350 HydrophobicContact CD1-CB 4Å; L336-E350 HydrophobicContact CD1-CG 4.04Å; R339-E350 IonicContact CZ-OE1 3.25Å; R339-E350 IonicContact CZ-OE2 3.2Å; R339-E350 IonicContact NH1-OE1 2.95Å; R339-E350 PolarHBondContact NH1-OE1 3.44Å; R339-E350 VanDerWaalsContact NH2-CD 3.28Å; R339-E350 IonicContact NH2-OE1 3.32Å; R339-E350 PolarHBondContact NH2-OE1 3.5Å; R339-E350 IonicContact NH2-OE2 2.76Å; R339-E350 PolarHBondContact NH2-OE2 3.13Å; V346-E350 HydrophobicContact CG1-CB 3.7Å; T347-E350 PolarHBondContact N-OE2 3.19Å; T347-E350 WeakPolarHBondContact O-CB 3.5Å; T347-E350 PolarHBondContact O-N 3.35Å; T347-E350 VanDerWaalsContact OG1-CD 3.28Å; T347-E350 VanDerWaalsContact OG1-CG 3.24Å; T347-E350 WeakPolarHBondContact OG1-CG 3.42Å; T347-E350 PolarHBondContact OG1-N 3.16Å; T347-E350 PolarHBondContact OG1-OE2 3.4Å; D348-E350 PolarHBondContact O-N 3.21Å; E350-N352 VanDerWaalsContact C-N 3.3Å; E350-N352 PolarHBondContact O-N 2.97Å; E350-M353 WeakPolarHBondContact O-CB 3.31Å; E350-M353 PolarHBondContact O-N 2.81Å; E350-V354 WeakPolarHBondContact O-CG2 3.26Å; E350-V354 PolarHBondContact O-N 3.23Å
351	C	75.4	Confident	76.7	Confident	14 Å²	14	85.2 Å²	85.2	10%	0.095	43%	0.431	C	S	.	.	H	α-helix	trans	-59.5	-42.4	173	-77.5	0	0	0	0	111.5	L321 V346 T347 D348 M353 V354 R355	L321-C351 HydrophobicContact CD1-CB 4.37Å; V346-C351 VanDerWaalsContact CG1-SG 3.52Å; T347-C351 PolarHBondContact O-N 2.93Å; T347-C351 VanDerWaalsContact O-N 3.09Å; D348-C351 PolarHBondContact O-N 3.39Å; C351-M353 VanDerWaalsContact C-N 3.34Å; C351-V354 PolarHBondContact O-N 3.43Å; C351-R355 WeakPolarHBondContact O-CB 3.3Å; C351-R355 VanDerWaalsContact O-CG 3.3Å; C351-R355 WeakPolarHBondContact O-CG 3.47Å; C351-R355 PolarHBondContact O-N 3.45Å
352	N	80.5	Confident	77.7	Confident	85 Å²	85	83.4 Å²	83.4	46%	0.455	42%	0.423	S	S	.	.	H	α-helix	trans	-66.9	-34.7	176.7	-71.6	-22.6	0	0	0	112.1	D348 A349 E350 R355 A356	D348-N352 WeakPolarHBondContact O-CB 3.25Å; D348-N352 PolarHBondContact O-N 2.82Å; D348-N352 PolarHBondContact O-ND2 2.86Å; D348-N352 VanDerWaalsContact O-ND2 3.14Å; A349-N352 PolarHBondContact O-N 3.2Å; E350-N352 VanDerWaalsContact C-N 3.3Å; E350-N352 PolarHBondContact O-N 2.97Å; N352-R355 PolarHBondContact OD1-NH1 2.7Å; N352-A356 VanDerWaalsContact O-CB 3.29Å; N352-A356 WeakPolarHBondContact O-CB 3.49Å; N352-A356 PolarHBondContact O-N 3.31Å
353	M	82.6	Confident	78.6	Confident	121 Å²	121	78.6 Å²	78.6	60%	0.596	41%	0.411	S	S	*	.	H	α-helix	trans	-63.7	-47.4	172.6	-176.1	-178.1	-100	0	0	111.4	A349 E350 C351 R355 A356 M357	A349-M353 WeakPolarHBondContact O-CB 3.33Å; A349-M353 PolarHBondContact O-N 2.94Å; E350-M353 WeakPolarHBondContact O-CB 3.31Å; E350-M353 PolarHBondContact O-N 2.81Å; C351-M353 VanDerWaalsContact C-N 3.34Å; M353-R355 PolarHBondContact O-N 2.79Å; M353-A356 WeakPolarHBondContact O-CB 3.25Å; M353-A356 PolarHBondContact O-N 3.08Å; M353-M357 WeakPolarHBondContact O-CG 3.27Å; M353-M357 PolarHBondContact O-N 2.82Å
354	V	82.8	Confident	79.8	Confident	4 Å²	4	81.1 Å²	81.1	2%	0.024	41%	0.407	C	S	.	.	H	α-helix	trans	-62.7	-44.1	177.3	177.1	0	0	0	0	111.4	L321 L332 L336 E350 C351 A356 M357 I358	L321-V354 HydrophobicContact CB-CG1 3.99Å; L332-V354 HydrophobicContact CD2-CB 4.35Å; L332-V354 HydrophobicContact CD2-CG1 3.93Å; L332-V354 HydrophobicContact CD2-CG2 3.63Å; L336-V354 HydrophobicContact CD2-CG2 3.73Å; E350-V354 WeakPolarHBondContact O-CG2 3.26Å; E350-V354 PolarHBondContact O-N 3.23Å; C351-V354 PolarHBondContact O-N 3.43Å; V354-A356 VanDerWaalsContact C-N 3.3Å; V354-A356 PolarHBondContact O-N 3.47Å; V354-M357 PolarHBondContact O-N 3.32Å; V354-I358 HydrophobicContact CG1-CD1 3.89Å; V354-I358 WeakPolarHBondContact O-CG1 3.4Å; V354-I358 PolarHBondContact O-N 3.22Å
355	R	84.8	Confident	80.9	Confident	102 Å²	102	86.1 Å²	86.1	39%	0.385	42%	0.417	S	S	.	.	H	α-helix	trans	-58.4	-41.4	173.4	-73.8	174	-173.4	155.3	-6.7	112	L321 C351 N352 M353 I358 R359	L321-R355 HydrophobicContact CD1-CG 4.18Å; L321-R355 HydrophobicContact CD2-CG 3.54Å; C351-R355 WeakPolarHBondContact O-CB 3.3Å; C351-R355 VanDerWaalsContact O-CG 3.3Å; C351-R355 WeakPolarHBondContact O-CG 3.47Å; C351-R355 PolarHBondContact O-N 3.45Å; N352-R355 PolarHBondContact OD1-NH1 2.7Å; M353-R355 PolarHBondContact O-N 2.79Å; R355-I358 PolarHBondContact O-N 2.71Å; R355-R359 VanDerWaalsContact O-CB 3.29Å; R355-R359 WeakPolarHBondContact O-CB 3.48Å; R355-R359 PolarHBondContact O-N 2.92Å
356	A	86.1	Confident	82	Confident	59 Å²	59	83.1 Å²	83.1	49%	0.488	40%	0.404	S	S	.	.	H	α-helix	trans	-65.2	-39.2	177	0	0	0	0	0	111.9	N352 M353 V354 R359 R360	N352-A356 VanDerWaalsContact O-CB 3.29Å; N352-A356 WeakPolarHBondContact O-CB 3.49Å; N352-A356 PolarHBondContact O-N 3.31Å; M353-A356 WeakPolarHBondContact O-CB 3.25Å; M353-A356 PolarHBondContact O-N 3.08Å; V354-A356 VanDerWaalsContact C-N 3.3Å; V354-A356 PolarHBondContact O-N 3.47Å; A356-R359 PolarHBondContact O-N 3.28Å; A356-R360 WeakPolarHBondContact O-CB 3.3Å; A356-R360 PolarHBondContact O-N 2.86Å
357	M	86.3	Confident	82.8	Confident	68 Å²	68	87.9 Å²	87.9	34%	0.335	42%	0.424	S	S	.	.	H	α-helix	trans	-66.1	-44.3	175.4	-65.8	177.5	84.8	0	0	112.1	V330 M353 V354 R360 A361	V330-M357 HydrophobicContact CG1-CB 3.67Å; V330-M357 HydrophobicContact CG1-CE 3.97Å; V330-M357 HydrophobicContact CG1-SD 4.38Å; M353-M357 WeakPolarHBondContact O-CG 3.27Å; M353-M357 PolarHBondContact O-N 2.82Å; V354-M357 PolarHBondContact O-N 3.32Å; M357-R360 PolarHBondContact O-N 3.47Å; M357-A361 PolarHBondContact O-N 2.85Å
358	I	88.5	Confident	83.3	Confident	7 Å²	7	88 Å²	88	4%	0.036	43%	0.428	C	S	.	.	H	α-helix	trans	-59.7	-45.5	173.4	-74.1	166.5	0	0	0	110.9	L321 E324 A325 L328 V354 R355 R360 A361 K362	L321-I358 HydrophobicContact CD2-CD1 3.88Å; L321-I358 WeakPolarHBondContact O-CD1 3.47Å; E324-I358 HydrophobicContact CB-CD1 3.97Å; E324-I358 VanDerWaalsContact CD-CG2 3.44Å; E324-I358 HydrophobicContact CG-CD1 4.01Å; E324-I358 HydrophobicContact CG-CG1 4.37Å; E324-I358 HydrophobicContact CG-CG2 3.8Å; E324-I358 WeakPolarHBondContact OE1-CG2 3.37Å; A325-I358 HydrophobicContact CB-CD1 4.33Å; A325-I358 HydrophobicContact CB-CG1 4.31Å; L328-I358 HydrophobicContact CD1-CB 4.35Å; L328-I358 HydrophobicContact CD1-CG1 4.47Å; L328-I358 HydrophobicContact CD1-CG2 3.75Å; V354-I358 HydrophobicContact CG1-CD1 3.89Å; V354-I358 WeakPolarHBondContact O-CG1 3.4Å; V354-I358 PolarHBondContact O-N 3.22Å; R355-I358 PolarHBondContact O-N 2.71Å; I358-R360 VanDerWaalsContact C-N 3.31Å; I358-R360 PolarHBondContact O-N 3.31Å; I358-A361 PolarHBondContact O-N 3.11Å; I358-K362 HydrophobicContact CG2-CD 4.28Å; I358-K362 WeakPolarHBondContact O-CB 3.44Å; I358-K362 PolarHBondContact O-N 2.91Å
359	R	87.5	Confident	83.8	Confident	182 Å²	182	85.8 Å²	85.8	69%	0.687	42%	0.416	S	S	*	.	H	α-helix	trans	-61.9	-39.8	177.6	-171.4	176.1	-177.4	171.1	1	111.5	R355 A356 N363	R355-R359 VanDerWaalsContact O-CB 3.29Å; R355-R359 WeakPolarHBondContact O-CB 3.48Å; R355-R359 PolarHBondContact O-N 2.92Å; A356-R359 PolarHBondContact O-N 3.28Å; R359-N363 WeakPolarHBondContact O-CB 3.36Å; R359-N363 VanDerWaalsContact O-CG 3.23Å; R359-N363 PolarHBondContact O-N 2.87Å
360	R	87.5	Confident	84.1	Confident	168 Å²	168	91.2 Å²	91.2	63%	0.634	42%	0.421	S	S	*	.	H	α-helix	trans	-62.6	-50.1	174.1	-177.4	179.4	-79	160.2	-6.1	111.3	A356 M357 I358 K362 N363 E364	A356-R360 WeakPolarHBondContact O-CB 3.3Å; A356-R360 PolarHBondContact O-N 2.86Å; M357-R360 PolarHBondContact O-N 3.47Å; I358-R360 VanDerWaalsContact C-N 3.31Å; I358-R360 PolarHBondContact O-N 3.31Å; R360-K362 PolarHBondContact O-N 3.08Å; R360-N363 PolarHBondContact O-N 2.76Å; R360-N363 VanDerWaalsContact O-N 3.13Å; R360-E364 HydrophobicContact CG-CG 4.48Å; R360-E364 VanDerWaalsContact CG-OE1 3.3Å; R360-E364 WeakPolarHBondContact CG-OE1 3.44Å; R360-E364 WeakPolarHBondContact O-CG 3.38Å; R360-E364 PolarHBondContact O-N 3.21Å
361	A	87.5	Confident	84.3	Confident	15 Å²	15	93.8 Å²	93.8	12%	0.124	44%	0.436	C	S	.	.	H	α-helix	trans	-62.9	-38	178.8	0	0	0	0	0	113.3	L328 V330 M357 I358 R365	L328-A361 HydrophobicContact CB-CB 4.13Å; L328-A361 HydrophobicContact CD1-CB 4.43Å; V330-A361 HydrophobicContact CG2-CB 3.6Å; M357-A361 PolarHBondContact O-N 2.85Å; I358-A361 PolarHBondContact O-N 3.11Å; A361-R365 PolarHBondContact O-N 3.33Å
362	K	88.5	Confident	84.6	Confident	94 Å²	94	101 Å²	101	41%	0.409	46%	0.461	S	S	.	.	H	α-helix	trans	-63.9	-40.6	172.4	-78.9	-177.9	166.3	178.6	0	112.3	E324 L328 I358 R360 K366	E324-K362 WeakPolarHBondContact OE1-CE 3.12Å; E324-K362 IonicContact OE1-NZ 2.89Å; E324-K362 PolarHBondContact OE1-NZ 3.12Å; L328-K362 HydrophobicContact CD1-CD 4.37Å; L328-K362 HydrophobicContact CD1-CG 3.72Å; L328-K362 HydrophobicContact CD2-CG 4.18Å; I358-K362 HydrophobicContact CG2-CD 4.28Å; I358-K362 WeakPolarHBondContact O-CB 3.44Å; I358-K362 PolarHBondContact O-N 2.91Å; R360-K362 PolarHBondContact O-N 3.08Å; K362-K366 WeakPolarHBondContact O-CB 3.16Å; K362-K366 WeakPolarHBondContact O-CG 3.47Å; K362-K366 PolarHBondContact O-N 3.11Å; K362-K366 VanDerWaalsContact O-N 3.11Å
363	N	86.5	Confident	84.7	Confident	86 Å²	86	105.6 Å²	105.6	46%	0.46	47%	0.472	S	S	.	.	H	α-helix	trans	-67.1	-44.4	176.7	-75.2	-7.4	0	0	0	111.5	R359 R360 R365 K366 E367	R359-N363 WeakPolarHBondContact O-CB 3.36Å; R359-N363 VanDerWaalsContact O-CG 3.23Å; R359-N363 PolarHBondContact O-N 2.87Å; R360-N363 PolarHBondContact O-N 2.76Å; R360-N363 VanDerWaalsContact O-N 3.13Å; N363-R365 PolarHBondContact O-N 2.97Å; N363-K366 PolarHBondContact O-N 3.36Å; N363-E367 WeakPolarHBondContact O-CB 3.46Å; N363-E367 PolarHBondContact O-N 3.01Å
364	E	85.8	Confident	84.5	Confident	114 Å²	114	107.5 Å²	107.5	53%	0.533	47%	0.473	S	S	.	.	H	α-helix	trans	-60.2	-43.3	176.9	-73.5	168.4	-175.1	0	0	112.2	R360 E367 S368	R360-E364 HydrophobicContact CG-CG 4.48Å; R360-E364 VanDerWaalsContact CG-OE1 3.3Å; R360-E364 WeakPolarHBondContact CG-OE1 3.44Å; R360-E364 WeakPolarHBondContact O-CG 3.38Å; R360-E364 PolarHBondContact O-N 3.21Å; E364-E367 PolarHBondContact O-N 3.06Å; E364-S368 PolarHBondContact O-N 3.01Å
365	R	85.5	Confident	84.3	Confident	159 Å²	159	112.1 Å²	112.1	60%	0.6	49%	0.494	S	S	*	.	H	α-helix	trans	-64.8	-44	175.5	-172	173.7	-179.4	171.2	0.5	112.3	A361 N363 E367 S368 D369	A361-R365 PolarHBondContact O-N 3.33Å; N363-R365 PolarHBondContact O-N 2.97Å; R365-E367 VanDerWaalsContact C-N 3.28Å; R365-E367 PolarHBondContact O-N 2.97Å; R365-S368 PolarHBondContact O-N 2.9Å; R365-D369 PolarHBondContact O-N 3.07Å
366	K	83.9	Confident	84	Confident	133 Å²	133	111.1 Å²	111.1	58%	0.578	50%	0.496	S	S	*	.	H	α-helix	trans	-61.3	-37.3	174.2	-78.4	-177.6	177.9	-175	0	111.9	K362 N363 R370	K362-K366 WeakPolarHBondContact O-CB 3.16Å; K362-K366 WeakPolarHBondContact O-CG 3.47Å; K362-K366 PolarHBondContact O-N 3.11Å; K362-K366 VanDerWaalsContact O-N 3.11Å; N363-K366 PolarHBondContact O-N 3.36Å; K366-R370 WeakPolarHBondContact O-CB 3.41Å; K366-R370 WeakPolarHBondContact O-CG 3.46Å; K366-R370 PolarHBondContact O-N 3.06Å
367	E	82.4	Confident	83.6	Confident	136 Å²	136	116.9 Å²	116.9	64%	0.636	51%	0.505	S	S	*	.	H	α-helix	trans	-69.7	-41.5	177.3	-169.2	164	-165.1	0	0	111.8	N363 E364 R365 R370 L371	N363-E367 WeakPolarHBondContact O-CB 3.46Å; N363-E367 PolarHBondContact O-N 3.01Å; E364-E367 PolarHBondContact O-N 3.06Å; R365-E367 VanDerWaalsContact C-N 3.28Å; R365-E367 PolarHBondContact O-N 2.97Å; E367-R370 PolarHBondContact O-N 2.77Å; E367-L371 WeakPolarHBondContact O-CB 3.23Å; E367-L371 PolarHBondContact O-N 3.07Å
368	S	82.5	Confident	83	Confident	74 Å²	74	118.3 Å²	118.3	52%	0.517	51%	0.511	S	S	.	.	H	α-helix	trans	-62.7	-43	173.4	-173.8	0	0	0	0	113	E364 R365 L371 R372	E364-S368 PolarHBondContact O-N 3.01Å; R365-S368 PolarHBondContact O-N 2.9Å; S368-L371 PolarHBondContact O-N 3.42Å; S368-R372 PolarHBondContact O-N 2.92Å
369	D	82.3	Confident	82.4	Confident	74 Å²	74	123.7 Å²	123.7	40%	0.396	54%	0.539	S	S	.	.	H	α-helix	trans	-66.9	-37.2	176.4	-73.3	-22.2	0	0	0	111.4	R365 R373	R365-D369 PolarHBondContact O-N 3.07Å; D369-R373 WeakPolarHBondContact O-CB 3.46Å; D369-R373 WeakPolarHBondContact O-CG 3.46Å; D369-R373 PolarHBondContact O-N 3.24Å
370	R	82.9	Confident	81.9	Confident	184 Å²	184	119.7 Å²	119.7	69%	0.694	53%	0.531	S	S	*	.	H	α-helix	trans	-64	-41.2	172.5	-77.9	172.3	177.9	-173.5	-2.1	111.8	K366 E367 R374	K366-R370 WeakPolarHBondContact O-CB 3.41Å; K366-R370 WeakPolarHBondContact O-CG 3.46Å; K366-R370 PolarHBondContact O-N 3.06Å; E367-R370 PolarHBondContact O-N 2.77Å; R370-R374 WeakPolarHBondContact O-CB 3.49Å; R370-R374 PolarHBondContact O-N 3.19Å
371	L	81.4	Confident	81.3	Confident	90 Å²	90	116.4 Å²	116.4	47%	0.471	53%	0.525	S	S	.	.	H	α-helix	trans	-65.8	-44.3	177.1	-173.7	65.2	0	0	0	111.6	E367 S368 R374 Q375	E367-L371 WeakPolarHBondContact O-CB 3.23Å; E367-L371 PolarHBondContact O-N 3.07Å; S368-L371 PolarHBondContact O-N 3.42Å; L371-R374 WeakPolarHBondContact O-CB 3.47Å; L371-R374 PolarHBondContact O-N 3.07Å; L371-Q375 WeakPolarHBondContact O-CG 3.35Å; L371-Q375 PolarHBondContact O-N 3.21Å
372	R	81.5	Confident	80.7	Confident	167 Å²	167	119.7 Å²	119.7	63%	0.63	54%	0.538	S	S	*	.	H	α-helix	trans	-60.5	-46.7	174.8	-178.1	-176.8	-91.7	-171.9	-7.5	111.6	S368 R374 Q375 D376	S368-R372 PolarHBondContact O-N 2.92Å; R372-R374 VanDerWaalsContact C-N 3.26Å; R372-R374 PolarHBondContact O-N 2.94Å; R372-Q375 PolarHBondContact O-N 2.97Å; R372-D376 PolarHBondContact O-N 3.43Å
373	R	81.2	Confident	80.1	Confident	181 Å²	181	119.3 Å²	119.3	68%	0.683	53%	0.534	S	S	*	.	H	α-helix	trans	-61.5	-33.4	175.5	-72.7	175.5	-174.9	165.9	2	112.8	D369 R377	D369-R373 WeakPolarHBondContact O-CB 3.46Å; D369-R373 WeakPolarHBondContact O-CG 3.46Å; D369-R373 PolarHBondContact O-N 3.24Å; R373-R377 VanDerWaalsContact O-CB 3.25Å; R373-R377 WeakPolarHBondContact O-CB 3.45Å; R373-R377 PolarHBondContact O-N 3.44Å
374	R	79.3	Confident	79.8	Confident	161 Å²	161	120.9 Å²	120.9	61%	0.608	53%	0.534	S	S	*	.	H	α-helix	trans	-67.5	-47.3	173.7	-176.2	-177.5	-74.4	172.6	-5.2	110.9	R370 L371 R372 R377 E378	R370-R374 WeakPolarHBondContact O-CB 3.49Å; R370-R374 PolarHBondContact O-N 3.19Å; L371-R374 WeakPolarHBondContact O-CB 3.47Å; L371-R374 PolarHBondContact O-N 3.07Å; R372-R374 VanDerWaalsContact C-N 3.26Å; R372-R374 PolarHBondContact O-N 2.94Å; R374-R377 WeakPolarHBondContact O-CB 3.34Å; R374-R377 PolarHBondContact O-N 3.4Å; R374-E378 VanDerWaalsContact CG-OE1 3.31Å; R374-E378 WeakPolarHBondContact CG-OE1 3.09Å; R374-E378 WeakPolarHBondContact O-CG 3.49Å; R374-E378 PolarHBondContact O-N 3.36Å
375	Q	78.8	Confident	79.4	Confident	101 Å²	101	120.2 Å²	120.2	47%	0.472	53%	0.529	S	S	.	.	H	α-helix	trans	-61.6	-44.8	176	-72.5	176.9	-16.9	0	0	112.6	L371 R372 R377 E378 L379	L371-Q375 WeakPolarHBondContact O-CG 3.35Å; L371-Q375 PolarHBondContact O-N 3.21Å; R372-Q375 PolarHBondContact O-N 2.97Å; Q375-R377 VanDerWaalsContact C-N 3.3Å; Q375-R377 PolarHBondContact O-N 2.9Å; Q375-E378 PolarHBondContact O-N 2.85Å; Q375-L379 WeakPolarHBondContact O-CB 3.39Å; Q375-L379 WeakPolarHBondContact O-CG 3.44Å; Q375-L379 PolarHBondContact O-N 3.4Å
376	D	77.9	Confident	79.3	Confident	80 Å²	80	116 Å²	116	43%	0.428	53%	0.525	S	S	.	.	H	α-helix	trans	-62.2	-38.8	176.2	-68.5	-20.8	0	0	0	111	R372 L380	R372-D376 PolarHBondContact O-N 3.43Å; D376-L380 WeakPolarHBondContact O-CB 3.25Å; D376-L380 VanDerWaalsContact O-CG 3.28Å; D376-L380 WeakPolarHBondContact O-CG 3.41Å; D376-L380 PolarHBondContact O-N 2.81Å
377	R	77.2	Confident	79.3	Confident	180 Å²	180	113.6 Å²	113.6	68%	0.679	51%	0.512	S	S	*	.	H	α-helix	trans	-66.2	-43.4	174.5	179.4	-178.6	-80.8	-121.6	0.2	111.7	R373 R374 Q375 L380 L381	R373-R377 VanDerWaalsContact O-CB 3.25Å; R373-R377 WeakPolarHBondContact O-CB 3.45Å; R373-R377 PolarHBondContact O-N 3.44Å; R374-R377 WeakPolarHBondContact O-CB 3.34Å; R374-R377 PolarHBondContact O-N 3.4Å; Q375-R377 VanDerWaalsContact C-N 3.3Å; Q375-R377 PolarHBondContact O-N 2.9Å; R377-L380 PolarHBondContact O-N 3.15Å; R377-L381 HydrophobicContact CG-CD1 4.05Å; R377-L381 HydrophobicContact CG-CG 4.49Å; R377-L381 WeakPolarHBondContact O-CB 3.28Å; R377-L381 VanDerWaalsContact O-CG 3.28Å; R377-L381 WeakPolarHBondContact O-CG 3.32Å; R377-L381 PolarHBondContact O-N 2.83Å
378	E	74.4	Confident	79.6	Confident	99 Å²	99	109.8 Å²	109.8	46%	0.463	50%	0.496	S	S	.	.	H	α-helix	trans	-62.4	-44.2	176.4	-76	165.8	-169.6	0	0	111.5	R374 Q375 L380 L381 E382	R374-E378 VanDerWaalsContact CG-OE1 3.31Å; R374-E378 WeakPolarHBondContact CG-OE1 3.09Å; R374-E378 WeakPolarHBondContact O-CG 3.49Å; R374-E378 PolarHBondContact O-N 3.36Å; Q375-E378 PolarHBondContact O-N 2.85Å; E378-L380 PolarHBondContact O-N 2.88Å; E378-L381 PolarHBondContact O-N 2.93Å; E378-E382 WeakPolarHBondContact O-CB 3.42Å; E378-E382 PolarHBondContact O-N 2.82Å
379	L	76.7	Confident	79.9	Confident	120 Å²	120	106.3 Å²	106.3	63%	0.628	47%	0.471	S	S	*	.	H	α-helix	trans	-62.7	-40	175	-75.1	168.3	0	0	0	112.5	Q375 W383	Q375-L379 WeakPolarHBondContact O-CB 3.39Å; Q375-L379 WeakPolarHBondContact O-CG 3.44Å; Q375-L379 PolarHBondContact O-N 3.4Å; L379-W383 VanDerWaalsContact O-CB 3.31Å; L379-W383 WeakPolarHBondContact O-CB 3.5Å; L379-W383 PolarHBondContact O-N 3.07Å
380	L	75.4	Confident	80.2	Confident	98 Å²	98	103.6 Å²	103.6	51%	0.513	46%	0.457	S	S	.	.	H	α-helix	trans	-68.3	-38.8	176.1	-77	169.8	0	0	0	112.4	D376 R377 E378 R384	D376-L380 WeakPolarHBondContact O-CB 3.25Å; D376-L380 VanDerWaalsContact O-CG 3.28Å; D376-L380 WeakPolarHBondContact O-CG 3.41Å; D376-L380 PolarHBondContact O-N 2.81Å; R377-L380 PolarHBondContact O-N 3.15Å; E378-L380 PolarHBondContact O-N 2.88Å; L380-R384 WeakPolarHBondContact O-CB 3.39Å; L380-R384 VanDerWaalsContact O-CG 3.25Å; L380-R384 WeakPolarHBondContact O-CG 3.17Å; L380-R384 PolarHBondContact O-N 3.01Å; L380-R384 VanDerWaalsContact O-N 3.08Å
381	L	75.3	Confident	80.4	Confident	98 Å²	98	100.7 Å²	100.7	51%	0.513	45%	0.454	S	S	.	.	H	α-helix	trans	-65.4	-45	174.4	-73	168.2	0	0	0	110.7	R377 E378 W383 R384 K385	R377-L381 HydrophobicContact CG-CD1 4.05Å; R377-L381 HydrophobicContact CG-CG 4.49Å; R377-L381 WeakPolarHBondContact O-CB 3.28Å; R377-L381 VanDerWaalsContact O-CG 3.28Å; R377-L381 WeakPolarHBondContact O-CG 3.32Å; R377-L381 PolarHBondContact O-N 2.83Å; E378-L381 PolarHBondContact O-N 2.93Å; L381-W383 VanDerWaalsContact C-N 3.33Å; L381-W383 PolarHBondContact O-N 3.42Å; L381-R384 PolarHBondContact O-N 3.37Å; L381-K385 PolarHBondContact O-N 2.81Å
382	E	75.1	Confident	80.7	Confident	85 Å²	85	96.4 Å²	96.4	40%	0.397	43%	0.432	S	S	.	.	H	α-helix	trans	-62.4	-38.6	176.6	-175.8	56.4	-141.3	0	0	112.5	E378 K385 R387	E378-E382 WeakPolarHBondContact O-CB 3.42Å; E378-E382 PolarHBondContact O-N 2.82Å; E382-K385 IonicContact OE1-NZ 2.57Å; E382-K385 WeakPolarHBondContact OE2-CD 3.46Å; E382-K385 WeakPolarHBondContact OE2-CE 3.22Å; E382-K385 IonicContact OE2-NZ 2.62Å; E382-K385 PolarHBondContact OE2-NZ 3.5Å; E382-R387 PolarHBondContact O-NH2 3.17Å; E382-R387 IonicContact OE1-NH2 3.14Å; E382-R387 PolarHBondContact OE1-NH2 2.94Å; E382-R387 VanDerWaalsContact OE1-NH2 3.1Å
383	W	77.2	Confident	81	Confident	85 Å²	85	89.3 Å²	89.3	32%	0.322	41%	0.407	S	S	.	.	H	α-helix	trans	-69.2	-33.3	176.2	-175.4	68.2	0	0	0	112.7	L379 L381 D393 D394 K805 R864	L379-W383 VanDerWaalsContact O-CB 3.31Å; L379-W383 WeakPolarHBondContact O-CB 3.5Å; L379-W383 PolarHBondContact O-N 3.07Å; L381-W383 VanDerWaalsContact C-N 3.33Å; L381-W383 PolarHBondContact O-N 3.42Å; W383-D393 PolarHBondContact NE1-OD1 3.47Å; W383-D394 HydrophobicContact CZ2-CB 4.32Å; W383-D394 WeakPolarHBondContact CZ2-OD2 3.27Å; W383-K805 HydrophobicContact CZ2-CD 4.34Å; W383-R864 VanDerWaalsContact CE2-NH1 3.32Å; W383-R864 VanDerWaalsContact NE1-NH1 3.12Å; W383-R864 VanDerWaalsContact O-CZ 3.24Å; W383-R864 PolarHBondContact O-NE 3.29Å; W383-R864 PolarHBondContact O-NH2 3.38Å; W383-R864 VanDerWaalsContact O-NH2 3.07Å
384	R	79.8	Confident	81.4	Confident	119 Å²	119	82.4 Å²	82.4	45%	0.449	38%	0.383	S	S	.	.	H	α-helix	trans	-74.6	-17.2	179.4	-78.2	173.8	-174.6	-99	0.4	114.9	L380 L381	L380-R384 WeakPolarHBondContact O-CB 3.39Å; L380-R384 VanDerWaalsContact O-CG 3.25Å; L380-R384 WeakPolarHBondContact O-CG 3.17Å; L380-R384 PolarHBondContact O-N 3.01Å; L380-R384 VanDerWaalsContact O-N 3.08Å; L381-R384 PolarHBondContact O-N 3.37Å
385	K	76.7	Confident	81.9	Confident	100 Å²	100	75 Å²	75	44%	0.435	36%	0.355	S	S	.	.	S	Bend	trans	-54.9	142.2	178.6	-70.7	-179.2	175.9	175.4	0	111.9	L381 E382	L381-K385 PolarHBondContact O-N 2.81Å; E382-K385 IonicContact OE1-NZ 2.57Å; E382-K385 WeakPolarHBondContact OE2-CD 3.46Å; E382-K385 WeakPolarHBondContact OE2-CE 3.22Å; E382-K385 IonicContact OE2-NZ 2.62Å; E382-K385 PolarHBondContact OE2-NZ 3.5Å
386	S	83.7	Confident	82.5	Confident	72 Å²	72	75 Å²	75	50%	0.503	35%	0.354	S	S	.	.			trans	-59	140.7	168.5	-174.1	0	0	0	0	110.8	R864	S386-R864 WeakPolarHBondContact CA-O 3.46Å
387	R	84.5	Confident	83.1	Confident	82 Å²	82	72 Å²	72	31%	0.309	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-143.2	163	-175.9	-65.6	176.6	-174.3	-109.7	-9.6	109.5	E382 D389 R864 G865 M866	E382-R387 PolarHBondContact O-NH2 3.17Å; E382-R387 IonicContact OE1-NH2 3.14Å; E382-R387 PolarHBondContact OE1-NH2 2.94Å; E382-R387 VanDerWaalsContact OE1-NH2 3.1Å; R387-D389 PolarHBondContact O-N 2.99Å; R387-R864 PolarHBondContact N-O 2.65Å; R387-G865 WeakPolarHBondContact O-CA 3.41Å; R387-M866 WeakPolarHBondContact O-CG 3.38Å; R387-M866 PolarHBondContact O-N 3.22Å
388	D	87	Confident	83.7	Confident	56 Å²	56	64.3 Å²	64.3	30%	0.299	31%	0.31	S	S	.	.			trans	-55.2	134.3	165.1	-176.5	-80	0	0	0	109.4	L390 L391 M866	D388-L390 PolarHBondContact O-N 3.49Å; D388-L390 VanDerWaalsContact O-N 3.12Å; D388-L390 WeakPolarHBondContact OD1-CB 3.34Å; D388-L390 PolarHBondContact OD1-N 3.16Å; D388-L391 HydrophobicContact CB-CB 4.49Å; D388-L391 HydrophobicContact CB-CD1 3.9Å; D388-L391 HydrophobicContact CB-CG 4.01Å; D388-L391 WeakPolarHBondContact O-CA 3.4Å; D388-L391 WeakPolarHBondContact O-CB 3.49Å; D388-L391 PolarHBondContact O-N 2.99Å; D388-M866 HydrophobicContact CB-CE 3.9Å
389	D	90.2	Very high	84.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-54.5	-38.3	-172.7	-44.6	-4.3	0	0	0	111.7	R387 L391 C392 H395 R771 G865 M866 R867	R387-D389 PolarHBondContact O-N 2.99Å; D389-L391 PolarHBondContact O-N 3.32Å; D389-C392 WeakPolarHBondContact O-CB 3.38Å; D389-C392 PolarHBondContact O-N 3.1Å; D389-H395 PolarHBondContact O-CE1 3.03Å; D389-H395 PolarHBondContact O-NE2 3.17Å; D389-R771 HydrophobicContact CB-CB 3.51Å; D389-R771 WeakPolarHBondContact OD2-CA 2.93Å; D389-R771 PolarHBondContact OD2-N 2.87Å; D389-G865 VanDerWaalsContact OD1-CA 3.23Å; D389-G865 WeakPolarHBondContact OD1-CA 3.49Å; D389-M866 PolarHBondContact OD1-N 3.41Å; D389-R867 PolarHBondContact OD1-N 3.08Å; D389-R867 IonicContact OD1-NE 3.94Å; D389-R867 VanDerWaalsContact OD2-CB 3.29Å; D389-R867 WeakPolarHBondContact OD2-CB 3.28Å; D389-R867 IonicContact OD2-CZ 3.34Å; D389-R867 IonicContact OD2-NE 3.96Å; D389-R867 PolarHBondContact OD2-NE 2.86Å; D389-R867 IonicContact OD2-NH2 2.89Å
390	L	88.3	Confident	84.9	Confident	18 Å²	18	62.6 Å²	62.6	9%	0.094	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-75.1	-6.9	-178.7	-66.2	177.5	0	0	0	113.6	D388 R771 F773 T801 V835	D388-L390 PolarHBondContact O-N 3.49Å; D388-L390 VanDerWaalsContact O-N 3.12Å; D388-L390 WeakPolarHBondContact OD1-CB 3.34Å; D388-L390 PolarHBondContact OD1-N 3.16Å; L390-R771 WeakPolarHBondContact CD2-O 3.49Å; L390-F773 HydrophobicContact CD1-CE2 4.17Å; L390-T801 WeakPolarHBondContact O-CB 3.36Å; L390-T801 WeakPolarHBondContact O-CG2 3.29Å; L390-T801 PolarHBondContact O-OG1 3.15Å; L390-V835 HydrophobicContact CD1-CG1 4.36Å; L390-V835 HydrophobicContact CD2-CG2 4.32Å
391	L	87.4	Confident	85.7	Confident	122 Å²	122	58.4 Å²	58.4	64%	0.639	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-95.7	-5.7	174	-60.8	179.2	0	0	0	112.9	D388 D389	D388-L391 HydrophobicContact CB-CB 4.49Å; D388-L391 HydrophobicContact CB-CD1 3.9Å; D388-L391 HydrophobicContact CB-CG 4.01Å; D388-L391 WeakPolarHBondContact O-CA 3.4Å; D388-L391 WeakPolarHBondContact O-CB 3.49Å; D388-L391 PolarHBondContact O-N 2.99Å; D389-L391 PolarHBondContact O-N 3.32Å
392	C	87.9	Confident	86.5	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.273	C	S	.	.			trans	-70.3	146.3	173.4	-59.8	0	0	0	0	111	D389 H395 T801 N862	D389-C392 WeakPolarHBondContact O-CB 3.38Å; D389-C392 PolarHBondContact O-N 3.1Å; C392-H395 PolarHBondContact O-CD2 3.09Å; C392-H395 PolarHBondContact O-NE2 3.28Å; C392-H395 VanDerWaalsContact O-NE2 3.1Å; C392-T801 WeakPolarHBondContact O-CG2 3.39Å; C392-N862 VanDerWaalsContact CB-ND2 3.34Å; C392-N862 WeakPolarHBondContact CB-ND2 3.05Å
393	D	87.1	Confident	87.4	Confident	19 Å²	19	55.8 Å²	55.8	10%	0.102	28%	0.277	C	S	.	.	S	Bend	trans	-109.4	-4.2	-173.9	55.9	-11.6	0	0	0	113.7	W383 K805 V806 R864	W383-D393 PolarHBondContact NE1-OD1 3.47Å; D393-K805 HydrophobicContact CB-CB 4.34Å; D393-K805 HydrophobicContact CB-CG 4.45Å; D393-K805 CarbonylContact O-C 3.57Å; D393-K805 VanDerWaalsContact O-C 3.22Å; D393-K805 WeakPolarHBondContact O-CA 3.15Å; D393-K805 WeakPolarHBondContact O-CB 3.46Å; D393-K805 PolarHBondContact O-N 3.14Å; D393-K805 WeakPolarHBondContact OD2-CD 3.37Å; D393-K805 VanDerWaalsContact OD2-CE 3.23Å; D393-K805 WeakPolarHBondContact OD2-CE 3.41Å; D393-K805 WeakPolarHBondContact OD2-CG 3.23Å; D393-K805 IonicContact OD2-NZ 3.43Å; D393-K805 PolarHBondContact OD2-NZ 3.09Å; D393-V806 PolarHBondContact O-N 2.72Å; D393-R864 IonicContact OD1-CZ 3.03Å; D393-R864 IonicContact OD1-NH1 4Å; D393-R864 PolarHBondContact OD1-NH1 2.88Å; D393-R864 IonicContact OD1-NH2 3.79Å
394	D	89.4	Confident	88.2	Confident	36 Å²	36	52.2 Å²	52.2	19%	0.193	26%	0.264	C	S	.	.			trans	-118.2	28.9	-170.6	60.6	-20.1	0	0	0	113	W383 K805 N862 R864	W383-D394 HydrophobicContact CZ2-CB 4.32Å; W383-D394 WeakPolarHBondContact CZ2-OD2 3.27Å; D394-K805 HydrophobicContact CB-CB 4.34Å; D394-N862 PolarHBondContact OD1-ND2 2.78Å; D394-R864 IonicContact OD1-CZ 3.84Å; D394-R864 IonicContact OD1-NH1 3.72Å; D394-R864 PolarHBondContact OD1-NH1 2.87Å; D394-R864 IonicContact OD2-CZ 2.79Å; D394-R864 IonicContact OD2-NH1 2.72Å; D394-R864 PolarHBondContact OD2-NH1 3.38Å
395	H	90.8	Very high	88.8	Confident	5 Å²	5	48.5 Å²	48.5	2%	0.023	26%	0.257	C	S	.	.			trans	-57.7	144.7	179.7	-71.6	-60.6	0	0	0	113.5	D389 C392 R771 L823 V825	D389-H395 PolarHBondContact O-CE1 3.03Å; D389-H395 PolarHBondContact O-NE2 3.17Å; C392-H395 PolarHBondContact O-CD2 3.09Å; C392-H395 PolarHBondContact O-NE2 3.28Å; C392-H395 VanDerWaalsContact O-NE2 3.1Å; H395-R771 PolarHBondContact ND1-NE 3.44Å; H395-R771 PolarHBondContact ND1-NH1 3.03Å; H395-L823 HydrophobicContact CB-CD2 4.16Å; H395-L823 WeakPolarHBondContact O-CD2 3.46Å; H395-V825 HydrophobicContact CB-CG1 4.23Å; H395-V825 WeakPolarHBondContact CD2-CG1 3.28Å
396	K	91.4	Very high	89.6	Confident	100 Å²	100	45.6 Å²	45.6	44%	0.435	25%	0.246	S	C	.	.			trans	-110	148.9	170.9	-59.7	173	-169.4	162.2	0	110.2	R771 K859	K396-R771 PolarHBondContact O-NH1 3.03Å; K396-R771 VanDerWaalsContact O-NH1 3.13Å; K396-K859 WeakPolarHBondContact CD-O 3.49Å; K396-K859 PolarHBondContact NZ-O 3.13Å; K396-K859 VanDerWaalsContact NZ-O 3.11Å
397	P	89.7	Confident	89.9	Confident	19 Å²	19	42.4 Å²	42.4	12%	0.123	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-59.9	136.3	175.6	-26.4	33.4	0	0	0	112.9	S822 L823 R860	P397-S822 WeakPolarHBondContact CA-O 3.49Å; P397-S822 WeakPolarHBondContact CB-OG 3.34Å; P397-L823 HydrophobicContact CG-CD2 3.94Å; P397-R860 WeakPolarHBondContact O-CD 3.38Å; P397-R860 WeakPolarHBondContact O-CG 3.45Å; P397-R860 PolarHBondContact O-NE 3.43Å
398	F	89.2	Confident	90	Very high	17 Å²	17	45.8 Å²	45.8	8%	0.075	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-74	148.5	170.3	-86	-86.6	0	0	0	111.2	D770 R771 S822 L824 L857 L861 E868	F398-D770 HydrophobicContact CZ-CB 4.05Å; F398-R771 HydrophobicContact CE2-CG 3.98Å; F398-S822 PolarHBondContact N-O 3.31Å; F398-L824 HydrophobicContact CB-CD1 4.14Å; F398-L824 HydrophobicContact CD2-CB 4.3Å; F398-L824 HydrophobicContact CD2-CD1 3.74Å; F398-L824 HydrophobicContact CD2-CG 4.28Å; F398-L824 HydrophobicContact CE2-CD1 4.38Å; F398-L824 HydrophobicContact CG-CD1 4.06Å; F398-L857 HydrophobicContact CD1-CD1 4.11Å; F398-L857 HydrophobicContact CE1-CD1 3.69Å; F398-L861 HydrophobicContact CE1-CD2 3.86Å; F398-L861 HydrophobicContact CZ-CD2 3.82Å; F398-E868 VanDerWaalsContact CZ-OE1 3.29Å; F398-E868 WeakPolarHBondContact CZ-OE1 3.5Å
399	P	88.7	Confident	89.9	Confident	19 Å²	19	45.6 Å²	45.6	12%	0.123	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-64	154	165.8	29.7	-35.9	0	0	0	111.4	F401 L856	P399-F401 HydrophobicContact CB-CE1 4.25Å; P399-F401 HydrophobicContact CG-CD1 4.25Å; P399-F401 HydrophobicContact CG-CE1 3.44Å; P399-F401 VanDerWaalsContact CG-CE1 3.44Å; P399-F401 HydrophobicContact CG-CZ 3.61Å; P399-L856 HydrophobicContact CB-CD2 3.62Å; P399-L856 HydrophobicContact CB-CG 3.95Å; P399-L856 HydrophobicContact CG-CD2 4.34Å; P399-L856 HydrophobicContact CG-CG 4.14Å
400	I	87.7	Confident	89.9	Confident	165 Å²	165	46 Å²	46	85%	0.846	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-82.2	117.1	170.5	-59.4	173.1	0	0	0	107.5
401	F	92.1	Very high	90.1	Very high	10 Å²	10	47.8 Å²	47.8	4%	0.044	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-87.2	141.9	176.2	-60	-50.4	0	0	0	110.9	P399 T403 V787 T846 I848 L857	P399-F401 HydrophobicContact CB-CE1 4.25Å; P399-F401 HydrophobicContact CG-CD1 4.25Å; P399-F401 HydrophobicContact CG-CE1 3.44Å; P399-F401 VanDerWaalsContact CG-CE1 3.44Å; P399-F401 HydrophobicContact CG-CZ 3.61Å; F401-T403 PolarHBondContact O-N 3.45Å; F401-V787 HydrophobicContact CD2-CG2 4.36Å; F401-V787 HydrophobicContact CE2-CG2 4.41Å; F401-T846 HydrophobicContact CB-CG2 4.32Å; F401-I848 HydrophobicContact CD1-CD1 4.14Å; F401-I848 HydrophobicContact CD1-CG1 3.72Å; F401-I848 HydrophobicContact CE1-CD1 3.46Å; F401-I848 VanDerWaalsContact CE1-CD1 3.46Å; F401-I848 HydrophobicContact CE1-CG1 3.58Å; F401-I848 HydrophobicContact CE2-CD1 4.45Å; F401-I848 HydrophobicContact CG-CG1 4.37Å; F401-I848 HydrophobicContact CZ-CD1 3.66Å; F401-I848 HydrophobicContact CZ-CG1 4.14Å; F401-L857 HydrophobicContact CZ-CB 4.29Å; F401-L857 HydrophobicContact CZ-CD1 4.16Å
402	P	93	Very high	90.3	Very high	50 Å²	50	44.5 Å²	44.5	33%	0.325	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-53.7	138	169.7	-25.6	34.1	0	0	0	111.8	T846 F847 L853	P402-T846 CarbonylContact O-C 3.58Å; P402-T846 WeakPolarHBondContact O-CA 3.48Å; P402-T846 VanDerWaalsContact O-CB 3.26Å; P402-T846 WeakPolarHBondContact O-CB 3.2Å; P402-F847 HydrophobicContact CB-CD1 4.29Å; P402-F847 HydrophobicContact CB-CE1 3.7Å; P402-F847 HydrophobicContact CB-CE2 4.2Å; P402-F847 HydrophobicContact CB-CZ 3.65Å; P402-F847 WeakPolarHBondContact CD-O 3.09Å; P402-F847 HydrophobicContact CG-CZ 4.42Å; P402-F847 WeakPolarHBondContact O-CD1 3.25Å; P402-F847 PolarHBondContact O-N 2.67Å; P402-F847 VanDerWaalsContact O-N 3.08Å; P402-L853 HydrophobicContact CG-CD1 4.47Å
403	T	93.8	Very high	90.4	Very high	77 Å²	77	50.7 Å²	50.7	47%	0.472	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-78.8	140.5	173.7	-57.5	0	0	0	0	109.8	F401 S405 P843	F401-T403 PolarHBondContact O-N 3.45Å; T403-S405 PolarHBondContact O-N 3.26Å; T403-P843 HydrophobicContact CG2-CB 3.59Å; T403-P843 HydrophobicContact CG2-CG 4.22Å; T403-P843 WeakPolarHBondContact OG1-CG 3.14Å
404	V	94	Very high	90.7	Very high	10 Å²	10	51.6 Å²	51.6	6%	0.061	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-66.1	124.4	172.8	177.7	0	0	0	0	109.3	L406 F415 W845 F847 L893	V404-L406 HydrophobicContact CG1-CD2 3.68Å; V404-L406 HydrophobicContact CG1-CG 4.25Å; V404-F415 HydrophobicContact CG1-CD2 4.3Å; V404-F415 HydrophobicContact CG1-CE1 4.16Å; V404-F415 HydrophobicContact CG1-CE2 3.85Å; V404-F415 HydrophobicContact CG1-CZ 3.78Å; V404-F415 HydrophobicContact CG2-CE1 4.17Å; V404-F415 HydrophobicContact CG2-CZ 4.29Å; V404-W845 HydrophobicContact CB-CB 4.03Å; V404-W845 HydrophobicContact CG2-CB 3.78Å; V404-W845 PolarHBondContact N-O 2.89Å; V404-F847 HydrophobicContact CG2-CD1 3.67Å; V404-F847 HydrophobicContact CG2-CE1 4.37Å; V404-L893 HydrophobicContact CG1-CD2 4.32Å
405	S	92.8	Very high	90.9	Very high	42 Å²	42	49.9 Å²	49.9	29%	0.294	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-83.6	122.8	172.1	-61	0	0	0	0	109.3	T403 L893 S894	T403-S405 PolarHBondContact O-N 3.26Å; S405-L893 PolarHBondContact N-O 2.55Å; S405-S894 WeakPolarHBondContact CB-O 3.48Å; S405-S894 PolarHBondContact OG-O 2.83Å
406	L	92	Very high	91	Very high	38 Å²	38	50.8 Å²	50.8	20%	0.199	30%	0.295	C	S	.	.			trans	-111	143.7	-178.1	-60.9	175	0	0	0	110.6	V404 F415 V896	V404-L406 HydrophobicContact CG1-CD2 3.68Å; V404-L406 HydrophobicContact CG1-CG 4.25Å; L406-F415 HydrophobicContact CD1-CB 4.25Å; L406-F415 HydrophobicContact CD2-CB 3.97Å; L406-F415 HydrophobicContact CD2-CD2 3.32Å; L406-F415 HydrophobicContact CD2-CE2 3.99Å; L406-F415 HydrophobicContact CD2-CG 3.79Å; L406-V896 WeakPolarHBondContact O-CG2 3.27Å
407	P	90	Very high	91.1	Very high	5 Å²	5	48.3 Å²	48.3	3%	0.032	29%	0.286	C	S	.	.			trans	-64.7	146	171	27.5	-32.9	0	0	0	111.4	G409 I410 Y448 F452 V896 L899	P407-G409 PolarHBondContact O-N 3.43Å; P407-I410 HydrophobicContact CG-CB 4.39Å; P407-I410 HydrophobicContact CG-CG1 4.15Å; P407-I410 PolarHBondContact O-N 3.27Å; P407-I410 VanDerWaalsContact O-N 3.14Å; P407-Y448 HydrophobicContact CG-CD1 4.06Å; P407-Y448 HydrophobicContact CG-CD2 4.4Å; P407-Y448 HydrophobicContact CG-CE1 4.26Å; P407-Y448 HydrophobicContact CG-CG 4.14Å; P407-F452 HydrophobicContact CB-CE2 3.68Å; P407-F452 HydrophobicContact CB-CZ 3.81Å; P407-F452 HydrophobicContact CG-CE2 3.74Å; P407-F452 HydrophobicContact CG-CZ 4.12Å; P407-V896 HydrophobicContact CB-CG1 3.68Å; P407-V896 HydrophobicContact CG-CG1 4.47Å; P407-L899 HydrophobicContact CB-CD1 4.08Å
408	D	86.8	Confident	91.3	Very high	153 Å²	153	47.4 Å²	47.4	82%	0.818	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	125	176.7	-71.9	-26.1	0	0	0	110.4	F452	D408-F452 WeakPolarHBondContact O-CE1 3.34Å; D408-F452 WeakPolarHBondContact O-CZ 3.42Å
409	G	85.4	Confident	91.5	Very high	52 Å²	52	47.2 Å²	47.2	54%	0.536	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	106.8	-13.8	-176.9	0	0	0	0	0	114.7	P407	P407-G409 PolarHBondContact O-N 3.43Å
410	I	90.6	Very high	91.6	Very high	9 Å²	9	49.1 Å²	49.1	5%	0.046	29%	0.293	C	S	.	.			trans	-106.8	110.4	169.3	-57.8	-59.3	0	0	0	109.1	P407 R414 L451 F452 P602	P407-I410 HydrophobicContact CG-CB 4.39Å; P407-I410 HydrophobicContact CG-CG1 4.15Å; P407-I410 PolarHBondContact O-N 3.27Å; P407-I410 VanDerWaalsContact O-N 3.14Å; I410-R414 HydrophobicContact CG2-CB 4.26Å; I410-L451 HydrophobicContact CD1-CD1 3.71Å; I410-L451 HydrophobicContact CG1-CD1 4.14Å; I410-F452 HydrophobicContact CG1-CE2 4.46Å; I410-F452 HydrophobicContact CG1-CZ 4.36Å; I410-P602 HydrophobicContact CD1-CB 3.58Å; I410-P602 HydrophobicContact CG1-CB 4.35Å
411	S	92.1	Very high	92	Very high	56 Å²	56	41.3 Å²	41.3	39%	0.392	25%	0.253	S	S	.	.			trans	-73.1	160.1	177.2	80.1	0	0	0	0	111.3	E413 R414 F415	S411-E413 PolarHBondContact O-N 2.7Å; S411-E413 VanDerWaalsContact O-N 3.14Å; S411-E413 PolarHBondContact OG-N 3.37Å; S411-R414 PolarHBondContact O-N 2.81Å; S411-F415 PolarHBondContact O-N 3.28Å
412	S	91.4	Very high	92.1	Very high	53 Å²	53	40.9 Å²	40.9	37%	0.371	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.5	174.5	59.9	0	0	0	0	113	R414 W845	S412-R414 VanDerWaalsContact C-N 3.35Å; S412-W845 PolarHBondContact O-NE1 3.48Å
413	E	90.5	Very high	92	Very high	129 Å²	129	39.7 Å²	39.7	60%	0.603	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-28.7	176.3	-49.1	-172.9	154.7	0	0	112.8	S411 R844	S411-E413 PolarHBondContact O-N 2.7Å; S411-E413 VanDerWaalsContact O-N 3.14Å; S411-E413 PolarHBondContact OG-N 3.37Å; E413-R844 VanDerWaalsContact CA-NH1 3.31Å
414	R	93.3	Very high	91.9	Very high	38 Å²	38	36.5 Å²	36.5	14%	0.143	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-12.4	-177.8	-56.6	-52.6	-57	-101.7	0.6	113.7	I410 S411 S412 G416 D417 C418 S603 L606 D607	I410-R414 HydrophobicContact CG2-CB 4.26Å; S411-R414 PolarHBondContact O-N 2.81Å; S412-R414 VanDerWaalsContact C-N 3.35Å; R414-G416 VanDerWaalsContact C-N 3.27Å; R414-G416 PolarHBondContact O-N 3.16Å; R414-D417 IonicContact CZ-OD2 3.6Å; R414-D417 IonicContact NE-OD2 3.62Å; R414-D417 PolarHBondContact NE-OD2 3.07Å; R414-D417 IonicContact NH2-OD2 2.62Å; R414-D417 PolarHBondContact NH2-OD2 2.86Å; R414-D417 WeakPolarHBondContact O-CB 2.94Å; R414-D417 PolarHBondContact O-N 3.13Å; R414-D417 VanDerWaalsContact O-N 3.11Å; R414-C418 PolarHBondContact O-N 2.69Å; R414-S603 PolarHBondContact NH1-OG 3.39Å; R414-L606 HydrophobicContact CB-CD2 3.97Å; R414-D607 IonicContact CZ-OD1 2.61Å; R414-D607 IonicContact CZ-OD2 3.85Å; R414-D607 IonicContact NH1-OD1 2.74Å; R414-D607 PolarHBondContact NH1-OD1 2.98Å; R414-D607 IonicContact NH1-OD2 3.07Å; R414-D607 PolarHBondContact NH1-OD2 3.25Å; R414-D607 IonicContact NH2-OD1 3.1Å; R414-D607 PolarHBondContact NH2-OD1 3.01Å; R414-D607 IonicContact NH2-OD2 2.79Å
415	F	93.9	Very high	92	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-33.2	-179.4	176.6	-107.9	0	0	0	113.2	V404 L406 S411 D417 C418 M419 Y448 L786 W845 L893	V404-F415 HydrophobicContact CG1-CD2 4.3Å; V404-F415 HydrophobicContact CG1-CE1 4.16Å; V404-F415 HydrophobicContact CG1-CE2 3.85Å; V404-F415 HydrophobicContact CG1-CZ 3.78Å; V404-F415 HydrophobicContact CG2-CE1 4.17Å; V404-F415 HydrophobicContact CG2-CZ 4.29Å; L406-F415 HydrophobicContact CD1-CB 4.25Å; L406-F415 HydrophobicContact CD2-CB 3.97Å; L406-F415 HydrophobicContact CD2-CD2 3.32Å; L406-F415 HydrophobicContact CD2-CE2 3.99Å; L406-F415 HydrophobicContact CD2-CG 3.79Å; S411-F415 PolarHBondContact O-N 3.28Å; F415-D417 VanDerWaalsContact C-N 3.31Å; F415-D417 PolarHBondContact O-N 3.34Å; F415-C418 WeakPolarHBondContact O-CB 2.8Å; F415-C418 PolarHBondContact O-N 3.47Å; F415-M419 HydrophobicContact CD1-CG 4.28Å; F415-M419 HydrophobicContact CD2-CE 4.32Å; F415-M419 HydrophobicContact CE1-CG 3.8Å; F415-M419 HydrophobicContact CE1-SD 4.32Å; F415-M419 HydrophobicContact CE2-CE 3.58Å; F415-M419 HydrophobicContact CE2-CG 4.16Å; F415-M419 HydrophobicContact CE2-SD 4.07Å; F415-M419 HydrophobicContact CZ-CE 3.86Å; F415-M419 HydrophobicContact CZ-CG 3.73Å; F415-M419 HydrophobicContact CZ-SD 3.68Å; F415-M419 PolarHBondContact O-N 3.09Å; F415-M419 VanDerWaalsContact O-N 3.08Å; F415-Y448 WeakPolarHBondContact CE2-OH 3.04Å; F415-L786 HydrophobicContact CE1-CD1 3.95Å; F415-L786 HydrophobicContact CZ-CD1 4.24Å; F415-W845 HydrophobicContact CD1-CB 4.18Å; F415-W845 AromaticContact CD1-CD1 3.78Å; F415-W845 AromaticContact CD1-CD2 3.5Å; F415-W845 HydrophobicContact CD1-CD2 3.5Å; F415-W845 AromaticContact CD1-CE2 3.71Å; F415-W845 AromaticContact CD1-CE3 3.97Å; F415-W845 HydrophobicContact CD1-CE3 3.97Å; F415-W845 AromaticContact CD1-CG 3.58Å; F415-W845 HydrophobicContact CD1-CG 3.58Å; F415-W845 HydrophobicContact CD1-CZ2 4.34Å; F415-W845 AromaticContact CD1-NE1 3.87Å; F415-W845 HydrophobicContact CE1-CB 4.42Å; F415-W845 AromaticContact CE1-CD2 3.99Å; F415-W845 HydrophobicContact CE1-CD2 3.99Å; F415-W845 HydrophobicContact CE1-CE3 4.01Å; F415-W845 HydrophobicContact CE1-CG 4.17Å; F415-W845 HydrophobicContact CG-CG 4.48Å; F415-L893 HydrophobicContact CE2-CD2 4.38Å; F415-L893 HydrophobicContact CZ-CD2 3.87Å
416	G	91.7	Very high	91.9	Very high	24 Å²	24	37.1 Å²	37.1	25%	0.247	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-38.4	174.1	0	0	0	0	0	112.9	R414 C418 M419 S420	R414-G416 VanDerWaalsContact C-N 3.27Å; R414-G416 PolarHBondContact O-N 3.16Å; G416-C418 VanDerWaalsContact C-N 3.35Å; G416-C418 PolarHBondContact O-N 2.67Å; G416-M419 PolarHBondContact O-N 3.36Å; G416-S420 WeakPolarHBondContact O-CB 3.24Å; G416-S420 PolarHBondContact O-N 3.25Å
417	D	93.7	Very high	91.8	Very high	48 Å²	48	35.7 Å²	35.7	26%	0.257	21%	0.212	S	C	.	.	H	α-helix	trans	-64.2	-40.8	175.6	-59	-33.6	0	0	0	111.1	R414 F415 M419 S420 L421 L606	R414-D417 IonicContact CZ-OD2 3.6Å; R414-D417 IonicContact NE-OD2 3.62Å; R414-D417 PolarHBondContact NE-OD2 3.07Å; R414-D417 IonicContact NH2-OD2 2.62Å; R414-D417 PolarHBondContact NH2-OD2 2.86Å; R414-D417 WeakPolarHBondContact O-CB 2.94Å; R414-D417 PolarHBondContact O-N 3.13Å; R414-D417 VanDerWaalsContact O-N 3.11Å; F415-D417 VanDerWaalsContact C-N 3.31Å; F415-D417 PolarHBondContact O-N 3.34Å; D417-M419 PolarHBondContact O-N 3.26Å; D417-S420 PolarHBondContact O-N 3.19Å; D417-L421 WeakPolarHBondContact O-CB 3.18Å; D417-L421 PolarHBondContact O-N 2.92Å; D417-L606 HydrophobicContact CB-CD1 4.27Å; D417-L606 HydrophobicContact CB-CD2 3.95Å; D417-L606 HydrophobicContact CB-CG 4.15Å
418	C	95	Very high	91.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.1	-45.2	175	-65.2	0	0	0	0	111.7	R414 F415 G416 L421 L422 L447	R414-C418 PolarHBondContact O-N 2.69Å; F415-C418 WeakPolarHBondContact O-CB 2.8Å; F415-C418 PolarHBondContact O-N 3.47Å; G416-C418 VanDerWaalsContact C-N 3.35Å; G416-C418 PolarHBondContact O-N 2.67Å; C418-L421 PolarHBondContact O-N 2.79Å; C418-L422 WeakPolarHBondContact O-CB 3.37Å; C418-L422 PolarHBondContact O-N 3.11Å; C418-L447 HydrophobicContact CB-CD2 3.83Å; C418-L447 VanDerWaalsContact O-CD2 3.23Å; C418-L447 WeakPolarHBondContact O-CD2 3.32Å
419	M	92.9	Very high	92.2	Very high	13 Å²	13	30.4 Å²	30.4	6%	0.064	19%	0.188	C	C	.	.	H	α-helix	trans	-66.7	-42.1	178.1	-65.9	-59	95	0	0	112	F415 G416 D417 L421 L422 E423 L444 V782 L786	F415-M419 HydrophobicContact CD1-CG 4.28Å; F415-M419 HydrophobicContact CD2-CE 4.32Å; F415-M419 HydrophobicContact CE1-CG 3.8Å; F415-M419 HydrophobicContact CE1-SD 4.32Å; F415-M419 HydrophobicContact CE2-CE 3.58Å; F415-M419 HydrophobicContact CE2-CG 4.16Å; F415-M419 HydrophobicContact CE2-SD 4.07Å; F415-M419 HydrophobicContact CZ-CE 3.86Å; F415-M419 HydrophobicContact CZ-CG 3.73Å; F415-M419 HydrophobicContact CZ-SD 3.68Å; F415-M419 PolarHBondContact O-N 3.09Å; F415-M419 VanDerWaalsContact O-N 3.08Å; G416-M419 PolarHBondContact O-N 3.36Å; D417-M419 PolarHBondContact O-N 3.26Å; M419-L421 PolarHBondContact O-N 2.88Å; M419-L422 HydrophobicContact CE-CD2 4.28Å; M419-L422 PolarHBondContact O-N 3.02Å; M419-E423 PolarHBondContact O-N 2.86Å; M419-L444 HydrophobicContact CE-CD1 3.37Å; M419-L444 HydrophobicContact CE-CD2 3.93Å; M419-L444 HydrophobicContact CE-CG 4.23Å; M419-V782 HydrophobicContact SD-CG1 4.23Å; M419-L786 HydrophobicContact CG-CD1 3.69Å; M419-L786 HydrophobicContact SD-CD1 3.82Å
420	S	91.7	Very high	92.4	Very high	59 Å²	59	32.6 Å²	32.6	41%	0.413	19%	0.187	S	C	.	.	H	α-helix	trans	-59.5	-45.2	175.6	176.1	0	0	0	0	111.7	G416 D417 F424 R613	G416-S420 WeakPolarHBondContact O-CB 3.24Å; G416-S420 PolarHBondContact O-N 3.25Å; D417-S420 PolarHBondContact O-N 3.19Å; S420-F424 WeakPolarHBondContact O-CB 3.29Å; S420-F424 PolarHBondContact O-N 3.44Å; S420-R613 PolarHBondContact OG-NH1 3.38Å
421	L	94.9	Very high	92.5	Very high	1 Å²	1	33 Å²	33	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-65.4	-41.9	176.5	-176.8	63.1	0	0	0	112.4	D417 C418 M419 F424 I425 L447 L606 L609 R613	D417-L421 WeakPolarHBondContact O-CB 3.18Å; D417-L421 PolarHBondContact O-N 2.92Å; C418-L421 PolarHBondContact O-N 2.79Å; M419-L421 PolarHBondContact O-N 2.88Å; L421-F424 WeakPolarHBondContact O-CB 3.44Å; L421-F424 PolarHBondContact O-N 2.93Å; L421-I425 HydrophobicContact CD1-CD1 4.28Å; L421-I425 HydrophobicContact CG-CD1 4.14Å; L421-I425 WeakPolarHBondContact O-CG1 3.5Å; L421-I425 PolarHBondContact O-N 2.82Å; L421-L447 HydrophobicContact CD2-CD1 3.82Å; L421-L606 HydrophobicContact CD2-CD1 4.42Å; L421-L609 HydrophobicContact CD2-CB 3.66Å; L421-L609 HydrophobicContact CD2-CD1 3.98Å; L421-L609 HydrophobicContact CD2-CG 4.4Å; L421-R613 HydrophobicContact CD1-CB 4Å; L421-R613 HydrophobicContact CD1-CG 4.33Å
422	L	94.1	Very high	92.6	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-62.9	-48.6	177.7	-178.6	63.7	0	0	0	111.9	C418 M419 F424 I425 H426 F442 L444 L447 V782	C418-L422 WeakPolarHBondContact O-CB 3.37Å; C418-L422 PolarHBondContact O-N 3.11Å; M419-L422 HydrophobicContact CE-CD2 4.28Å; M419-L422 PolarHBondContact O-N 3.02Å; L422-F424 VanDerWaalsContact C-N 3.31Å; L422-F424 PolarHBondContact O-N 2.86Å; L422-I425 PolarHBondContact O-N 3.23Å; L422-H426 PolarHBondContact O-N 2.96Å; L422-H426 VanDerWaalsContact O-N 3.08Å; L422-F442 HydrophobicContact CD1-CD1 3.69Å; L422-F442 HydrophobicContact CD1-CE1 3.83Å; L422-L444 HydrophobicContact CD2-CB 4Å; L422-L444 HydrophobicContact CD2-CD1 4.48Å; L422-L447 HydrophobicContact CB-CD2 4.31Å; L422-V782 HydrophobicContact CD2-CG1 3.85Å
423	E	91	Very high	92.6	Very high	25 Å²	25	32 Å²	32	12%	0.117	18%	0.176	C	C	.	.	H	α-helix	trans	-64.6	-34.6	176.5	-73.7	-67.5	141.9	0	0	111.6	M419 S427 R780 S781	M419-E423 PolarHBondContact O-N 2.86Å; E423-S427 WeakPolarHBondContact O-CB 3.48Å; E423-S427 PolarHBondContact O-N 3.36Å; E423-S427 PolarHBondContact O-OG 3.1Å; E423-R780 PolarHBondContact OE1-N 3.26Å; E423-S781 WeakPolarHBondContact OE1-CB 3.43Å; E423-S781 PolarHBondContact OE1-N 3.3Å; E423-S781 PolarHBondContact OE1-OG 2.79Å
424	F	93.2	Very high	92.8	Very high	11 Å²	11	26.4 Å²	26.4	5%	0.048	15%	0.15	C	C	.	.	H	α-helix	trans	-61.1	-52	172.6	171.8	-93.6	0	0	0	111.5	S420 L421 L422 H426 S427 Y428 L432 L467 R613 L616 L617 F622	S420-F424 WeakPolarHBondContact O-CB 3.29Å; S420-F424 PolarHBondContact O-N 3.44Å; L421-F424 WeakPolarHBondContact O-CB 3.44Å; L421-F424 PolarHBondContact O-N 2.93Å; L422-F424 VanDerWaalsContact C-N 3.31Å; L422-F424 PolarHBondContact O-N 2.86Å; F424-H426 VanDerWaalsContact C-N 3.27Å; F424-H426 PolarHBondContact O-N 2.86Å; F424-S427 PolarHBondContact O-N 3.48Å; F424-S427 VanDerWaalsContact O-N 3.11Å; F424-Y428 AromaticContact CD2-CD2 3.41Å; F424-Y428 HydrophobicContact CD2-CD2 3.41Å; F424-Y428 VanDerWaalsContact CD2-CD2 3.41Å; F424-Y428 AromaticContact CD2-CE2 3.58Å; F424-Y428 HydrophobicContact CD2-CE2 3.58Å; F424-Y428 AromaticContact CE2-CD2 3.48Å; F424-Y428 HydrophobicContact CE2-CD2 3.48Å; F424-Y428 VanDerWaalsContact CE2-CD2 3.48Å; F424-Y428 AromaticContact CE2-CE2 3.74Å; F424-Y428 HydrophobicContact CE2-CE2 3.74Å; F424-Y428 HydrophobicContact CE2-CG 4.27Å; F424-Y428 HydrophobicContact CG-CD2 4.06Å; F424-Y428 HydrophobicContact CZ-CD2 4.19Å; F424-Y428 VanDerWaalsContact O-CD2 3.3Å; F424-Y428 WeakPolarHBondContact O-CD2 2.88Å; F424-Y428 PolarHBondContact O-N 3.33Å; F424-L432 HydrophobicContact CD1-CD1 4.27Å; F424-L432 HydrophobicContact CE1-CD1 3.78Å; F424-L432 HydrophobicContact CE1-CD2 4.44Å; F424-L467 HydrophobicContact CE1-CD2 4.32Å; F424-R613 HydrophobicContact CB-CG 4.15Å; F424-R613 HydrophobicContact CD1-CB 4.4Å; F424-R613 HydrophobicContact CD1-CG 3.66Å; F424-R613 HydrophobicContact CD2-CG 3.73Å; F424-R613 HydrophobicContact CE1-CB 4.38Å; F424-R613 HydrophobicContact CE1-CG 3.9Å; F424-R613 HydrophobicContact CE2-CG 3.98Å; F424-R613 HydrophobicContact CG-CG 3.57Å; F424-R613 HydrophobicContact CZ-CG 4.06Å; F424-L616 HydrophobicContact CE1-CD1 4.08Å; F424-L616 HydrophobicContact CZ-CB 3.96Å; F424-L616 HydrophobicContact CZ-CD1 3.89Å; F424-L617 HydrophobicContact CD2-CD2 4.18Å; F424-L617 HydrophobicContact CD2-CG 4.46Å; F424-L617 HydrophobicContact CE2-CD2 3.76Å; F424-L617 HydrophobicContact CE2-CG 4Å; F424-F622 HydrophobicContact CE2-CD1 4.02Å; F424-F622 AromaticContact CE2-CE1 3.94Å; F424-F622 HydrophobicContact CE2-CE1 3.94Å; F424-F622 HydrophobicContact CZ-CD1 4.16Å; F424-F622 AromaticContact CZ-CE1 3.64Å; F424-F622 HydrophobicContact CZ-CE1 3.64Å; F424-F622 HydrophobicContact CZ-CZ 4.37Å
425	I	94.7	Very high	92.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.8	-42	-179.1	-69.5	168.1	0	0	0	110.5	L421 L422 A429 L432 V434 F442 L463 M466	L421-I425 HydrophobicContact CD1-CD1 4.28Å; L421-I425 HydrophobicContact CG-CD1 4.14Å; L421-I425 WeakPolarHBondContact O-CG1 3.5Å; L421-I425 PolarHBondContact O-N 2.82Å; L422-I425 PolarHBondContact O-N 3.23Å; I425-A429 VanDerWaalsContact O-CA 3.29Å; I425-A429 WeakPolarHBondContact O-CA 3.33Å; I425-A429 WeakPolarHBondContact O-CB 3.36Å; I425-A429 PolarHBondContact O-N 3.33Å; I425-L432 HydrophobicContact CG1-CD1 4.41Å; I425-V434 HydrophobicContact CG2-CG1 4.29Å; I425-V434 HydrophobicContact CG2-CG2 3.76Å; I425-F442 HydrophobicContact CB-CD1 4.13Å; I425-F442 HydrophobicContact CD1-CD1 3.71Å; I425-F442 HydrophobicContact CD1-CE1 3.4Å; I425-F442 HydrophobicContact CD1-CG 4.46Å; I425-F442 HydrophobicContact CD1-CZ 3.92Å; I425-F442 HydrophobicContact CG2-CB 4.02Å; I425-F442 HydrophobicContact CG2-CD1 3.76Å; I425-F442 HydrophobicContact CG2-CG 4.05Å; I425-L463 HydrophobicContact CD1-CD2 3.8Å; I425-M466 HydrophobicContact CD1-CE 4.38Å; I425-M466 HydrophobicContact CG1-CE 4.41Å
426	H	91.1	Very high	92.7	Very high	65 Å²	65	34.2 Å²	34.2	30%	0.301	20%	0.198	S	C	.	.	H	α-helix	trans	-70	-35.7	176.4	-71.8	177	0	0	0	113.7	L422 F424 Y428 F442 S781	L422-H426 PolarHBondContact O-N 2.96Å; L422-H426 VanDerWaalsContact O-N 3.08Å; F424-H426 VanDerWaalsContact C-N 3.27Å; F424-H426 PolarHBondContact O-N 2.86Å; H426-Y428 VanDerWaalsContact C-N 3.31Å; H426-Y428 PolarHBondContact O-N 2.86Å; H426-F442 PolarHBondContact NE2-O 3.03Å; H426-S781 WeakPolarHBondContact ND1-CB 3.39Å; H426-S781 PolarHBondContact ND1-OG 3.12Å
427	S	89.3	Confident	92.8	Very high	8 Å²	8	35 Å²	35	6%	0.056	20%	0.195	C	C	.	.	H	α-helix	trans	-71.6	-27.1	-179.3	-64.3	0	0	0	0	113.2	E423 F424 K762	E423-S427 WeakPolarHBondContact O-CB 3.48Å; E423-S427 PolarHBondContact O-N 3.36Å; E423-S427 PolarHBondContact O-OG 3.1Å; F424-S427 PolarHBondContact O-N 3.48Å; F424-S427 VanDerWaalsContact O-N 3.11Å; S427-K762 WeakPolarHBondContact OG-CA 3.27Å
428	Y	92.8	Very high	92.8	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.035	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	22.5	-177.9	-60.8	-79.7	0	0	0	113.1	F424 H426 D430 M431 L432 L617 F622 R625	F424-Y428 AromaticContact CD2-CD2 3.41Å; F424-Y428 HydrophobicContact CD2-CD2 3.41Å; F424-Y428 VanDerWaalsContact CD2-CD2 3.41Å; F424-Y428 AromaticContact CD2-CE2 3.58Å; F424-Y428 HydrophobicContact CD2-CE2 3.58Å; F424-Y428 AromaticContact CE2-CD2 3.48Å; F424-Y428 HydrophobicContact CE2-CD2 3.48Å; F424-Y428 VanDerWaalsContact CE2-CD2 3.48Å; F424-Y428 AromaticContact CE2-CE2 3.74Å; F424-Y428 HydrophobicContact CE2-CE2 3.74Å; F424-Y428 HydrophobicContact CE2-CG 4.27Å; F424-Y428 HydrophobicContact CG-CD2 4.06Å; F424-Y428 HydrophobicContact CZ-CD2 4.19Å; F424-Y428 VanDerWaalsContact O-CD2 3.3Å; F424-Y428 WeakPolarHBondContact O-CD2 2.88Å; F424-Y428 PolarHBondContact O-N 3.33Å; H426-Y428 VanDerWaalsContact C-N 3.31Å; H426-Y428 PolarHBondContact O-N 2.86Å; Y428-D430 PolarHBondContact O-N 2.72Å; Y428-D430 VanDerWaalsContact O-N 3.12Å; Y428-M431 HydrophobicContact CD1-SD 3.93Å; Y428-M431 WeakPolarHBondContact O-CA 3.41Å; Y428-M431 PolarHBondContact O-N 3.15Å; Y428-L432 WeakPolarHBondContact O-CG 3.09Å; Y428-L432 PolarHBondContact O-N 2.7Å; Y428-L617 HydrophobicContact CE2-CD2 4.36Å; Y428-F622 AromaticContact CD1-CD1 3.46Å; Y428-F622 HydrophobicContact CD1-CD1 3.46Å; Y428-F622 VanDerWaalsContact CD1-CD1 3.46Å; Y428-F622 AromaticContact CD1-CE1 3.66Å; Y428-F622 HydrophobicContact CD1-CE1 3.66Å; Y428-F622 HydrophobicContact CD2-CD1 4.19Å; Y428-F622 HydrophobicContact CD2-CE1 4.19Å; Y428-F622 AromaticContact CE1-CD1 3.66Å; Y428-F622 HydrophobicContact CE1-CD1 3.66Å; Y428-F622 HydrophobicContact CE1-CE1 4.31Å; Y428-F622 HydrophobicContact CE2-CD1 4.38Å; Y428-F622 AromaticContact CG-CD1 3.76Å; Y428-F622 HydrophobicContact CG-CD1 3.76Å; Y428-F622 AromaticContact CG-CE1 3.58Å; Y428-F622 HydrophobicContact CG-CE1 3.58Å; Y428-R625 HydrophobicContact CD1-CG 4.27Å; Y428-R625 HydrophobicContact CE1-CB 4.16Å; Y428-R625 HydrophobicContact CE1-CG 3.8Å
429	A	92.3	Very high	92.7	Very high	38 Å²	38	38 Å²	38	31%	0.314	22%	0.215	S	C	.	.	H	α-helix	trans	-55.1	-35.4	-175.2	0	0	0	0	0	113.2	I425 M431 N433 V434	I425-A429 VanDerWaalsContact O-CA 3.29Å; I425-A429 WeakPolarHBondContact O-CA 3.33Å; I425-A429 WeakPolarHBondContact O-CB 3.36Å; I425-A429 PolarHBondContact O-N 3.33Å; A429-M431 VanDerWaalsContact C-N 3.33Å; A429-N433 PolarHBondContact O-N 2.71Å; A429-V434 HydrophobicContact CB-CB 4.42Å; A429-V434 HydrophobicContact CB-CG2 3.95Å; A429-V434 PolarHBondContact O-N 3.26Å
430	D	90.4	Very high	92.4	Very high	97 Å²	97	44.8 Å²	44.8	52%	0.519	25%	0.252	S	S	.	.	H	α-helix	trans	-72.5	-22.2	176.9	68.1	-49.2	0	0	0	113.9	Y428 R625	Y428-D430 PolarHBondContact O-N 2.72Å; Y428-D430 VanDerWaalsContact O-N 3.12Å; D430-R625 IonicContact OD1-CZ 3.32Å; D430-R625 IonicContact OD1-NH1 3.67Å; D430-R625 PolarHBondContact OD1-NH1 2.9Å; D430-R625 IonicContact OD1-NH2 3.74Å; D430-R625 IonicContact OD2-CZ 3.12Å; D430-R625 VanDerWaalsContact OD2-CZ 3.29Å; D430-R625 IonicContact OD2-NH1 3.05Å; D430-R625 PolarHBondContact OD2-NH1 3.4Å; D430-R625 IonicContact OD2-NH2 3.44Å; D430-R625 PolarHBondContact OD2-NH2 3.29Å
431	M	93.2	Very high	92	Very high	18 Å²	18	47.2 Å²	47.2	9%	0.089	26%	0.261	C	S	.	.	H	α-helix	trans	-96.6	-14.2	178.3	-67.2	-179	54.2	0	0	113.2	Y428 A429 R470 A621 F622 R625	Y428-M431 HydrophobicContact CD1-SD 3.93Å; Y428-M431 WeakPolarHBondContact O-CA 3.41Å; Y428-M431 PolarHBondContact O-N 3.15Å; A429-M431 VanDerWaalsContact C-N 3.33Å; M431-R470 WeakPolarHBondContact O-CD 3.5Å; M431-R470 PolarHBondContact O-NE 2.91Å; M431-A621 HydrophobicContact CE-CB 3.83Å; M431-F622 HydrophobicContact CB-CZ 4.27Å; M431-F622 HydrophobicContact CE-CD1 4.1Å; M431-F622 HydrophobicContact CE-CD2 3.75Å; M431-F622 HydrophobicContact CE-CE1 4.17Å; M431-F622 HydrophobicContact CE-CE2 3.8Å; M431-F622 HydrophobicContact CE-CG 3.9Å; M431-F622 HydrophobicContact CE-CZ 4.01Å; M431-R625 HydrophobicContact SD-CB 4.19Å; M431-R625 HydrophobicContact SD-CG 4.19Å
432	L	94.7	Very high	91.9	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-105.1	-6.7	-179.4	-65.6	172.8	0	0	0	113.1	F424 I425 Y428 V434 M466 L467 R470 L616 F622	F424-L432 HydrophobicContact CD1-CD1 4.27Å; F424-L432 HydrophobicContact CE1-CD1 3.78Å; F424-L432 HydrophobicContact CE1-CD2 4.44Å; I425-L432 HydrophobicContact CG1-CD1 4.41Å; Y428-L432 WeakPolarHBondContact O-CG 3.09Å; Y428-L432 PolarHBondContact O-N 2.7Å; L432-V434 VanDerWaalsContact C-N 3.28Å; L432-V434 HydrophobicContact CB-CG2 3.92Å; L432-V434 PolarHBondContact O-N 3.06Å; L432-M466 HydrophobicContact CB-CG 4.41Å; L432-M466 HydrophobicContact CB-SD 4.21Å; L432-M466 VanDerWaalsContact O-CG 3.32Å; L432-M466 WeakPolarHBondContact O-CG 3.44Å; L432-L467 HydrophobicContact CD2-CD2 4.3Å; L432-R470 HydrophobicContact CD2-CB 4.36Å; L432-R470 HydrophobicContact CD2-CG 4.23Å; L432-L616 HydrophobicContact CD2-CD1 3.87Å; L432-F622 HydrophobicContact CD2-CZ 4.01Å
433	N	90.6	Very high	91.8	Very high	84 Å²	84	49.5 Å²	49.5	45%	0.449	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	44.8	-174.7	-59.4	-24.5	0	0	0	112.8	A429 T435 D436	A429-N433 PolarHBondContact O-N 2.71Å; N433-T435 PolarHBondContact O-N 3.15Å; N433-D436 HydrophobicContact CB-CB 4.49Å; N433-D436 WeakPolarHBondContact CB-OD2 3.4Å; N433-D436 WeakPolarHBondContact O-CB 3.29Å; N433-D436 PolarHBondContact O-N 3.15Å
434	V	94	Very high	91.9	Very high	10 Å²	10	48.3 Å²	48.3	6%	0.061	27%	0.27	C	S	.	.	H	α-helix	trans	-53.7	-34.9	-172	176.6	0	0	0	0	112.7	I425 A429 L432 D436 F437 F438 F442 M466	I425-V434 HydrophobicContact CG2-CG1 4.29Å; I425-V434 HydrophobicContact CG2-CG2 3.76Å; A429-V434 HydrophobicContact CB-CB 4.42Å; A429-V434 HydrophobicContact CB-CG2 3.95Å; A429-V434 PolarHBondContact O-N 3.26Å; L432-V434 VanDerWaalsContact C-N 3.28Å; L432-V434 HydrophobicContact CB-CG2 3.92Å; L432-V434 PolarHBondContact O-N 3.06Å; V434-D436 PolarHBondContact O-N 2.75Å; V434-F437 PolarHBondContact O-N 3.39Å; V434-F438 HydrophobicContact CG1-CB 4.26Å; V434-F438 HydrophobicContact CG1-CD2 4.32Å; V434-F438 PolarHBondContact O-N 3.46Å; V434-F442 HydrophobicContact CG1-CB 3.94Å; V434-M466 HydrophobicContact CB-SD 4.36Å; V434-M466 HydrophobicContact CG2-SD 3.92Å
435	T	92.9	Very high	91.8	Very high	84 Å²	84	49.7 Å²	49.7	52%	0.515	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-23	-179.6	50.5	0	0	0	0	114.2	N433 F437	N433-T435 PolarHBondContact O-N 3.15Å; T435-F437 VanDerWaalsContact C-N 3.3Å
436	D	92.9	Very high	91.7	Very high	118 Å²	118	52.6 Å²	52.6	63%	0.631	29%	0.293	S	S	*	.	H	α-helix	trans	-74.8	-26.9	179.2	-62.2	-8.4	0	0	0	110.9	N433 V434	N433-D436 HydrophobicContact CB-CB 4.49Å; N433-D436 WeakPolarHBondContact CB-OD2 3.4Å; N433-D436 WeakPolarHBondContact O-CB 3.29Å; N433-D436 PolarHBondContact O-N 3.15Å; V434-D436 PolarHBondContact O-N 2.75Å
437	F	93.3	Very high	91.9	Very high	41 Å²	41	49.5 Å²	49.5	18%	0.18	28%	0.279	C	S	.	.	H	α-helix	trans	-103	-32.6	179.6	-63.6	-88.3	0	0	0	113.1	V434 T435 N462 C465 M466 E469	V434-F437 PolarHBondContact O-N 3.39Å; T435-F437 VanDerWaalsContact C-N 3.3Å; F437-N462 HydrophobicContact CB-CB 4.4Å; F437-N462 HydrophobicContact CD1-CB 4.38Å; F437-N462 WeakPolarHBondContact CD1-O 3.38Å; F437-C465 HydrophobicContact CE1-CB 3.83Å; F437-M466 HydrophobicContact CB-SD 4.49Å; F437-M466 HydrophobicContact CD1-CB 4.01Å; F437-M466 HydrophobicContact CD2-CB 3.61Å; F437-M466 HydrophobicContact CD2-CG 3.56Å; F437-M466 HydrophobicContact CD2-SD 4.09Å; F437-M466 HydrophobicContact CE1-CB 4.09Å; F437-M466 HydrophobicContact CE2-CB 3.7Å; F437-M466 HydrophobicContact CE2-CG 3.74Å; F437-M466 HydrophobicContact CG-CB 3.77Å; F437-M466 HydrophobicContact CG-CG 4.15Å; F437-M466 HydrophobicContact CG-SD 4.48Å; F437-M466 HydrophobicContact CZ-CB 3.94Å; F437-M466 HydrophobicContact CZ-CG 4.45Å; F437-E469 WeakPolarHBondContact CZ-OE2 3.19Å
438	F	94.4	Very high	92.1	Very high	10 Å²	10	49.1 Å²	49.1	4%	0.044	28%	0.276	C	S	.	.			trans	-132.6	82.4	-177.6	-58.9	-83.8	0	0	0	109.9	V434 D440 N441 F442 A459 N462 L463	V434-F438 HydrophobicContact CG1-CB 4.26Å; V434-F438 HydrophobicContact CG1-CD2 4.32Å; V434-F438 PolarHBondContact O-N 3.46Å; F438-D440 PolarHBondContact O-N 2.68Å; F438-N441 PolarHBondContact O-N 2.62Å; F438-N441 VanDerWaalsContact O-N 3.08Å; F438-F442 AromaticContact CD1-CD2 3.93Å; F438-F442 HydrophobicContact CD1-CD2 3.93Å; F438-F442 HydrophobicContact CD2-CD2 4.01Å; F438-F442 AromaticContact CE1-CD2 3.94Å; F438-F442 HydrophobicContact CE1-CD2 3.94Å; F438-F442 HydrophobicContact CE1-CE2 4.14Å; F438-F442 HydrophobicContact CE2-CD2 4.05Å; F438-F442 HydrophobicContact CE2-CE2 4.41Å; F438-F442 AromaticContact CG-CD2 3.97Å; F438-F442 HydrophobicContact CG-CD2 3.97Å; F438-F442 HydrophobicContact CZ-CD2 4.02Å; F438-F442 HydrophobicContact CZ-CE2 4.08Å; F438-A459 HydrophobicContact CE1-CB 4.29Å; F438-N462 HydrophobicContact CE1-CB 4.29Å; F438-N462 HydrophobicContact CE2-CB 4.14Å; F438-N462 HydrophobicContact CZ-CB 3.68Å; F438-L463 HydrophobicContact CE2-CD2 3.73Å; F438-L463 HydrophobicContact CE2-CG 4.14Å; F438-L463 HydrophobicContact CZ-CD2 3.85Å; F438-L463 HydrophobicContact CZ-CG 3.75Å
439	P	91.7	Very high	92	Very high	100 Å²	100	50.6 Å²	50.6	65%	0.649	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-33	-178.1	-26.9	35.7	0	0	0	113.9	N441	P439-N441 PolarHBondContact O-N 3.25Å
440	D	86.5	Confident	92.1	Very high	157 Å²	157	48.8 Å²	48.8	84%	0.84	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	18.5	179.9	-64.1	-43.3	0	0	0	113.7	F438	F438-D440 PolarHBondContact O-N 2.68Å
441	N	84.5	Confident	92.3	Very high	110 Å²	110	44.1 Å²	44.1	59%	0.588	24%	0.244	S	C	*	.			trans	63.5	154.9	-167.4	-54.1	-72.5	0	0	0	113.8	F438 P439	F438-N441 PolarHBondContact O-N 2.62Å; F438-N441 VanDerWaalsContact O-N 3.08Å; P439-N441 PolarHBondContact O-N 3.25Å
442	F	93.1	Very high	92.3	Very high	7 Å²	7	45.5 Å²	45.5	3%	0.031	25%	0.249	C	C	.	.			trans	-78.5	142.3	175.1	-167	-109.3	0	0	0	110.2	L422 I425 H426 V434 F438 Q446 L447 L463	L422-F442 HydrophobicContact CD1-CD1 3.69Å; L422-F442 HydrophobicContact CD1-CE1 3.83Å; I425-F442 HydrophobicContact CB-CD1 4.13Å; I425-F442 HydrophobicContact CD1-CD1 3.71Å; I425-F442 HydrophobicContact CD1-CE1 3.4Å; I425-F442 HydrophobicContact CD1-CG 4.46Å; I425-F442 HydrophobicContact CD1-CZ 3.92Å; I425-F442 HydrophobicContact CG2-CB 4.02Å; I425-F442 HydrophobicContact CG2-CD1 3.76Å; I425-F442 HydrophobicContact CG2-CG 4.05Å; H426-F442 PolarHBondContact NE2-O 3.03Å; V434-F442 HydrophobicContact CG1-CB 3.94Å; F438-F442 AromaticContact CD1-CD2 3.93Å; F438-F442 HydrophobicContact CD1-CD2 3.93Å; F438-F442 HydrophobicContact CD2-CD2 4.01Å; F438-F442 AromaticContact CE1-CD2 3.94Å; F438-F442 HydrophobicContact CE1-CD2 3.94Å; F438-F442 HydrophobicContact CE1-CE2 4.14Å; F438-F442 HydrophobicContact CE2-CD2 4.05Å; F438-F442 HydrophobicContact CE2-CE2 4.41Å; F438-F442 AromaticContact CG-CD2 3.97Å; F438-F442 HydrophobicContact CG-CD2 3.97Å; F438-F442 HydrophobicContact CZ-CD2 4.02Å; F438-F442 HydrophobicContact CZ-CE2 4.08Å; F442-Q446 HydrophobicContact CD2-CB 3.89Å; F442-Q446 HydrophobicContact CE2-CB 3.86Å; F442-L447 HydrophobicContact CE1-CB 3.94Å; F442-L447 HydrophobicContact CZ-CB 3.61Å; F442-L447 HydrophobicContact CZ-CD1 4.05Å; F442-L447 HydrophobicContact CZ-CG 4.37Å; F442-L463 HydrophobicContact CD2-CD2 4.11Å; F442-L463 HydrophobicContact CE2-CD1 3.8Å; F442-L463 HydrophobicContact CE2-CD2 3.51Å; F442-L463 HydrophobicContact CE2-CG 3.85Å; F442-L463 HydrophobicContact CZ-CD1 3.69Å; F442-L463 HydrophobicContact CZ-CD2 3.73Å; F442-L463 HydrophobicContact CZ-CG 4.16Å
443	S	92	Very high	92.2	Very high	42 Å²	42	45.3 Å²	45.3	29%	0.294	25%	0.248	S	C	.	.			trans	-142.6	168.3	-178.3	68.2	0	0	0	0	111.2	T445 Q446 L447	S443-T445 PolarHBondContact O-N 3.36Å; S443-Q446 WeakPolarHBondContact O-CB 3.48Å; S443-Q446 PolarHBondContact O-N 3.13Å; S443-Q446 PolarHBondContact OG-N 3.11Å; S443-L447 PolarHBondContact O-N 3.17Å
444	L	92.6	Very high	92.2	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-58.6	-35.7	174.4	-178.5	54.1	0	0	0	112.2	M419 L422 L447 Y448 V782 V892 L893	M419-L444 HydrophobicContact CE-CD1 3.37Å; M419-L444 HydrophobicContact CE-CD2 3.93Å; M419-L444 HydrophobicContact CE-CG 4.23Å; L422-L444 HydrophobicContact CD2-CB 4Å; L422-L444 HydrophobicContact CD2-CD1 4.48Å; L444-L447 HydrophobicContact CD1-CD2 4.36Å; L444-L447 PolarHBondContact O-N 3.44Å; L444-Y448 HydrophobicContact CD1-CD1 4.05Å; L444-Y448 HydrophobicContact CD1-CD2 4.39Å; L444-Y448 HydrophobicContact CD1-CE1 3.63Å; L444-Y448 HydrophobicContact CD1-CE2 4.02Å; L444-Y448 HydrophobicContact CD1-CG 4.42Å; L444-Y448 HydrophobicContact CD2-CE2 4.07Å; L444-Y448 HydrophobicContact CG-CD2 4.18Å; L444-Y448 HydrophobicContact CG-CE1 4.33Å; L444-Y448 HydrophobicContact CG-CE2 3.79Å; L444-Y448 PolarHBondContact O-N 3.06Å; L444-V782 HydrophobicContact CB-CG1 4.19Å; L444-V782 HydrophobicContact CD2-CG1 3.92Å; L444-V892 HydrophobicContact CB-CG1 4.2Å; L444-V892 HydrophobicContact CD2-CB 4.47Å; L444-V892 HydrophobicContact CD2-CG1 3.77Å; L444-V892 HydrophobicContact CG-CG1 3.83Å; L444-L893 HydrophobicContact CD2-CD2 3.9Å
445	T	91.1	Very high	92.2	Very high	40 Å²	40	47.2 Å²	47.2	25%	0.245	25%	0.25	C	S	.	.	H	α-helix	trans	-62.3	-44.6	173.7	-56.2	0	0	0	0	111.3	S443 L447 Y448 M449 V892 P897	S443-T445 PolarHBondContact O-N 3.36Å; T445-L447 VanDerWaalsContact C-N 3.32Å; T445-L447 PolarHBondContact O-N 3.01Å; T445-Y448 PolarHBondContact O-N 3.2Å; T445-M449 HydrophobicContact CG2-CG 4.47Å; T445-M449 HydrophobicContact CG2-SD 4.23Å; T445-M449 WeakPolarHBondContact O-CB 3.43Å; T445-M449 VanDerWaalsContact O-CG 3.29Å; T445-M449 WeakPolarHBondContact O-CG 3.42Å; T445-M449 PolarHBondContact O-N 3.15Å; T445-V892 WeakPolarHBondContact OG1-CG2 3.24Å; T445-P897 HydrophobicContact CG2-CB 3.98Å; T445-P897 HydrophobicContact CG2-CG 3.89Å
446	Q	92.7	Very high	92.2	Very high	60 Å²	60	43.4 Å²	43.4	28%	0.28	23%	0.227	S	C	.	.	H	α-helix	trans	-64.5	-37.1	176.9	-69.4	-64.5	-32.7	0	0	111.9	F442 S443 M449 A450	F442-Q446 HydrophobicContact CD2-CB 3.89Å; F442-Q446 HydrophobicContact CE2-CB 3.86Å; S443-Q446 WeakPolarHBondContact O-CB 3.48Å; S443-Q446 PolarHBondContact O-N 3.13Å; S443-Q446 PolarHBondContact OG-N 3.11Å; Q446-M449 PolarHBondContact O-N 2.72Å; Q446-A450 WeakPolarHBondContact O-CB 3.45Å; Q446-A450 PolarHBondContact O-N 2.84Å
447	L	94.7	Very high	92.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-47.2	173	179.3	56.9	0	0	0	111.5	C418 L421 L422 F442 S443 L444 T445 A450 L451 L463	C418-L447 HydrophobicContact CB-CD2 3.83Å; C418-L447 VanDerWaalsContact O-CD2 3.23Å; C418-L447 WeakPolarHBondContact O-CD2 3.32Å; L421-L447 HydrophobicContact CD2-CD1 3.82Å; L422-L447 HydrophobicContact CB-CD2 4.31Å; F442-L447 HydrophobicContact CE1-CB 3.94Å; F442-L447 HydrophobicContact CZ-CB 3.61Å; F442-L447 HydrophobicContact CZ-CD1 4.05Å; F442-L447 HydrophobicContact CZ-CG 4.37Å; S443-L447 PolarHBondContact O-N 3.17Å; L444-L447 HydrophobicContact CD1-CD2 4.36Å; L444-L447 PolarHBondContact O-N 3.44Å; T445-L447 VanDerWaalsContact C-N 3.32Å; T445-L447 PolarHBondContact O-N 3.01Å; L447-A450 WeakPolarHBondContact O-CB 3.44Å; L447-A450 PolarHBondContact O-N 3.13Å; L447-L451 WeakPolarHBondContact O-CG 3.37Å; L447-L451 PolarHBondContact O-N 2.91Å; L447-L451 VanDerWaalsContact O-N 3.13Å; L447-L463 HydrophobicContact CD1-CD1 4.25Å
448	Y	93.4	Very high	92.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-48.4	174.6	-70.3	-21.8	0	0	0	111	P407 F415 L444 T445 A450 L451 F452 V892 P897	P407-Y448 HydrophobicContact CG-CD1 4.06Å; P407-Y448 HydrophobicContact CG-CD2 4.4Å; P407-Y448 HydrophobicContact CG-CE1 4.26Å; P407-Y448 HydrophobicContact CG-CG 4.14Å; F415-Y448 WeakPolarHBondContact CE2-OH 3.04Å; L444-Y448 HydrophobicContact CD1-CD1 4.05Å; L444-Y448 HydrophobicContact CD1-CD2 4.39Å; L444-Y448 HydrophobicContact CD1-CE1 3.63Å; L444-Y448 HydrophobicContact CD1-CE2 4.02Å; L444-Y448 HydrophobicContact CD1-CG 4.42Å; L444-Y448 HydrophobicContact CD2-CE2 4.07Å; L444-Y448 HydrophobicContact CG-CD2 4.18Å; L444-Y448 HydrophobicContact CG-CE1 4.33Å; L444-Y448 HydrophobicContact CG-CE2 3.79Å; L444-Y448 PolarHBondContact O-N 3.06Å; T445-Y448 PolarHBondContact O-N 3.2Å; Y448-A450 VanDerWaalsContact C-N 3.29Å; Y448-A450 PolarHBondContact O-N 3.28Å; Y448-L451 PolarHBondContact O-N 3.26Å; Y448-F452 WeakPolarHBondContact O-CD2 3.37Å; Y448-F452 PolarHBondContact O-N 2.92Å; Y448-V892 HydrophobicContact CD2-CG1 4.13Å; Y448-V892 HydrophobicContact CE2-CG1 3.9Å; Y448-P897 HydrophobicContact CD2-CG 4.23Å
449	M	91.7	Very high	92.1	Very high	40 Å²	40	39.2 Å²	39.2	20%	0.197	21%	0.211	C	C	.	.	H	α-helix	trans	-53.2	-46.9	174.5	-71	177.7	76.4	0	0	111.4	T445 Q446 L451 F452 D453 A459 L899 L904	T445-M449 HydrophobicContact CG2-CG 4.47Å; T445-M449 HydrophobicContact CG2-SD 4.23Å; T445-M449 WeakPolarHBondContact O-CB 3.43Å; T445-M449 VanDerWaalsContact O-CG 3.29Å; T445-M449 WeakPolarHBondContact O-CG 3.42Å; T445-M449 PolarHBondContact O-N 3.15Å; Q446-M449 PolarHBondContact O-N 2.72Å; M449-L451 PolarHBondContact O-N 3.38Å; M449-F452 CarbonylContact O-C 3.44Å; M449-F452 PolarHBondContact O-N 3.35Å; M449-D453 VanDerWaalsContact O-CB 3.25Å; M449-D453 WeakPolarHBondContact O-CB 3.42Å; M449-D453 PolarHBondContact O-N 2.8Å; M449-A459 HydrophobicContact CB-CB 4.4Å; M449-L899 HydrophobicContact CG-CD2 3.91Å; M449-L904 HydrophobicContact CB-CD2 4.33Å; M449-L904 HydrophobicContact CE-CD2 4.19Å; M449-L904 HydrophobicContact CG-CD2 4.5Å
450	A	94	Very high	92.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-59	-30.6	177.5	0	0	0	0	0	113.9	Q446 L447 Y448 F452 A459 F460 L463 R605	Q446-A450 WeakPolarHBondContact O-CB 3.45Å; Q446-A450 PolarHBondContact O-N 2.84Å; L447-A450 WeakPolarHBondContact O-CB 3.44Å; L447-A450 PolarHBondContact O-N 3.13Å; Y448-A450 VanDerWaalsContact C-N 3.29Å; Y448-A450 PolarHBondContact O-N 3.28Å; A450-F452 VanDerWaalsContact C-N 3.25Å; A450-F452 PolarHBondContact O-N 2.97Å; A450-A459 HydrophobicContact CB-CB 3.91Å; A450-F460 HydrophobicContact CB-CB 4.38Å; A450-F460 WeakPolarHBondContact O-CB 3.36Å; A450-F460 WeakPolarHBondContact O-CD2 3.27Å; A450-F460 VanDerWaalsContact O-CG 3.31Å; A450-F460 WeakPolarHBondContact O-CG 3.27Å; A450-L463 HydrophobicContact CB-CD1 3.51Å; A450-L463 HydrophobicContact CB-CG 4.37Å; A450-R605 PolarHBondContact O-NH1 3.28Å
451	L	94.5	Very high	92.8	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-74.7	-15.2	177.4	-62.5	175	0	0	0	113.2	I410 L447 Y448 M449 P602 R605 L606 L609	I410-L451 HydrophobicContact CD1-CD1 3.71Å; I410-L451 HydrophobicContact CG1-CD1 4.14Å; L447-L451 WeakPolarHBondContact O-CG 3.37Å; L447-L451 PolarHBondContact O-N 2.91Å; L447-L451 VanDerWaalsContact O-N 3.13Å; Y448-L451 PolarHBondContact O-N 3.26Å; M449-L451 PolarHBondContact O-N 3.38Å; L451-P602 HydrophobicContact CB-CB 4.26Å; L451-R605 HydrophobicContact CD2-CB 4.28Å; L451-R605 WeakPolarHBondContact O-CD 3.3Å; L451-R605 PolarHBondContact O-NH1 3.29Å; L451-L606 HydrophobicContact CD2-CB 3.93Å; L451-L606 HydrophobicContact CD2-CD1 4.41Å; L451-L609 HydrophobicContact CD2-CD1 4.17Å
452	F	93	Very high	93.3	Very high	46 Å²	46	24.3 Å²	24.3	20%	0.202	13%	0.126	C	C	.	.	H	α-helix	trans	-119.3	-20.8	-179.1	-64.1	-85.5	0	0	0	114.5	P407 D408 I410 Y448 M449 A450 K454 P602 L899 L904	P407-F452 HydrophobicContact CB-CE2 3.68Å; P407-F452 HydrophobicContact CB-CZ 3.81Å; P407-F452 HydrophobicContact CG-CE2 3.74Å; P407-F452 HydrophobicContact CG-CZ 4.12Å; D408-F452 WeakPolarHBondContact O-CE1 3.34Å; D408-F452 WeakPolarHBondContact O-CZ 3.42Å; I410-F452 HydrophobicContact CG1-CE2 4.46Å; I410-F452 HydrophobicContact CG1-CZ 4.36Å; Y448-F452 WeakPolarHBondContact O-CD2 3.37Å; Y448-F452 PolarHBondContact O-N 2.92Å; M449-F452 CarbonylContact O-C 3.44Å; M449-F452 PolarHBondContact O-N 3.35Å; A450-F452 VanDerWaalsContact C-N 3.25Å; A450-F452 PolarHBondContact O-N 2.97Å; F452-K454 PolarHBondContact O-N 3.22Å; F452-P602 HydrophobicContact CD1-CG 3.84Å; F452-P602 HydrophobicContact CE1-CB 4.17Å; F452-P602 HydrophobicContact CE1-CG 3.41Å; F452-P602 VanDerWaalsContact CE1-CG 3.41Å; F452-P602 HydrophobicContact CZ-CB 4.11Å; F452-P602 HydrophobicContact CZ-CG 3.85Å; F452-L899 HydrophobicContact CB-CD1 4.38Å; F452-L899 HydrophobicContact CD2-CD1 3.37Å; F452-L899 HydrophobicContact CE2-CD1 3.74Å; F452-L899 HydrophobicContact CG-CD1 3.86Å; F452-L899 HydrophobicContact CZ-CD1 4.45Å; F452-L904 HydrophobicContact CB-CD1 4.11Å
453	D	91.6	Very high	93.4	Very high	1 Å²	1	24 Å²	24	1%	0.005	12%	0.124	C	C	.	.			trans	-65.1	118.2	-176.3	-161.3	-19.4	0	0	0	110.7	M449 R455 G458 A459 R605 L904	M449-D453 VanDerWaalsContact O-CB 3.25Å; M449-D453 WeakPolarHBondContact O-CB 3.42Å; M449-D453 PolarHBondContact O-N 2.8Å; D453-R455 VanDerWaalsContact OD1-CB 3.31Å; D453-R455 WeakPolarHBondContact OD1-CB 3.34Å; D453-R455 IonicContact OD1-CZ 2.92Å; D453-R455 PolarHBondContact OD1-N 3.2Å; D453-R455 VanDerWaalsContact OD1-N 3.08Å; D453-R455 IonicContact OD1-NE 3.01Å; D453-R455 PolarHBondContact OD1-NE 2.75Å; D453-R455 IonicContact OD1-NH2 2.56Å; D453-R455 IonicContact OD2-CZ 2.61Å; D453-R455 IonicContact OD2-NE 3.83Å; D453-R455 IonicContact OD2-NH2 3.8Å; D453-R455 PolarHBondContact OD2-NH2 2.88Å; D453-G458 WeakPolarHBondContact OD2-CA 3.44Å; D453-A459 PolarHBondContact OD2-N 3.11Å; D453-R605 PolarHBondContact O-NH1 2.87Å; D453-R605 PolarHBondContact O-NH2 2.83Å; D453-L904 HydrophobicContact CB-CD2 3.78Å
454	K	92	Very high	93.6	Very high	74 Å²	74	22 Å²	22	32%	0.322	11%	0.11	S	C	.	.			trans	-91.2	-9.4	-179.2	-64.8	-167.8	170.6	-156.3	0	112.9	F452 Y598 E599 L904	F452-K454 PolarHBondContact O-N 3.22Å; K454-Y598 WeakPolarHBondContact O-CB 3.47Å; K454-E599 IonicContact NZ-OE1 2.72Å; K454-E599 PolarHBondContact NZ-OE1 2.7Å; K454-E599 IonicContact NZ-OE2 2.73Å; K454-E599 PolarHBondContact NZ-OE2 3.23Å; K454-L904 PolarHBondContact N-O 3.26Å
455	R	93.4	Very high	93.8	Very high	61 Å²	61	22.4 Å²	22.4	23%	0.23	11%	0.113	C	C	.	.			trans	-77.2	136.8	-174	-63.9	173.7	-56.8	161.1	6.1	111.4	D453 T457 G458 E903 D909	D453-R455 VanDerWaalsContact OD1-CB 3.31Å; D453-R455 WeakPolarHBondContact OD1-CB 3.34Å; D453-R455 IonicContact OD1-CZ 2.92Å; D453-R455 PolarHBondContact OD1-N 3.2Å; D453-R455 VanDerWaalsContact OD1-N 3.08Å; D453-R455 IonicContact OD1-NE 3.01Å; D453-R455 PolarHBondContact OD1-NE 2.75Å; D453-R455 IonicContact OD1-NH2 2.56Å; D453-R455 IonicContact OD2-CZ 2.61Å; D453-R455 IonicContact OD2-NE 3.83Å; D453-R455 IonicContact OD2-NH2 3.8Å; D453-R455 PolarHBondContact OD2-NH2 2.88Å; R455-T457 PolarHBondContact O-N 3.27Å; R455-G458 WeakPolarHBondContact O-CA 3.26Å; R455-G458 PolarHBondContact O-N 3.42Å; R455-E903 PolarHBondContact NE-O 3.24Å; R455-E903 PolarHBondContact NH1-O 3.11Å; R455-D909 WeakPolarHBondContact CB-OD2 3.49Å; R455-D909 HydrophobicContact CG-CB 4.49Å
456	P	93.9	Very high	94	Very high	4 Å²	4	20.6 Å²	20.6	3%	0.026	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.6	170.8	-25	36.8	0	0	0	114.3	G458 A461 G538 Y539 Y598 D909 V911	P456-G458 VanDerWaalsContact C-N 3.35Å; P456-A461 WeakPolarHBondContact O-CB 3.3Å; P456-G538 VanDerWaalsContact O-CA 3.26Å; P456-G538 WeakPolarHBondContact O-CA 3.44Å; P456-Y539 HydrophobicContact CB-CD1 3.47Å; P456-Y539 VanDerWaalsContact CB-CD1 3.47Å; P456-Y539 HydrophobicContact CB-CE1 3.57Å; P456-Y539 HydrophobicContact CB-CG 4.01Å; P456-Y539 HydrophobicContact CG-CD1 3.76Å; P456-Y539 HydrophobicContact CG-CE1 3.88Å; P456-Y598 HydrophobicContact CB-CE2 4.33Å; P456-Y598 HydrophobicContact CG-CE2 4.19Å; P456-D909 WeakPolarHBondContact CD-O 3.25Å; P456-V911 HydrophobicContact CG-CG2 3.62Å
457	T	92.6	Very high	94.2	Very high	73 Å²	73	17.8 Å²	17.8	45%	0.448	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	6.4	172.4	72.5	0	0	0	0	113.5	R455 Y539 D909	R455-T457 PolarHBondContact O-N 3.27Å; T457-Y539 HydrophobicContact CG2-CE2 4.38Å; T457-Y539 WeakPolarHBondContact CG2-OH 3.49Å; T457-D909 WeakPolarHBondContact CB-OD2 3.29Å; T457-D909 PolarHBondContact N-OD2 2.6Å; T457-D909 PolarHBondContact OG1-OD2 3.36Å
458	G	92.3	Very high	94.3	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.01	9%	0.089	C	C	.	.	S	Bend	trans	-78.4	177.8	-173.3	0	0	0	0	0	115.3	D453 R455 P456 F460 A461 N462	D453-G458 WeakPolarHBondContact OD2-CA 3.44Å; R455-G458 WeakPolarHBondContact O-CA 3.26Å; R455-G458 PolarHBondContact O-N 3.42Å; P456-G458 VanDerWaalsContact C-N 3.35Å; G458-F460 PolarHBondContact O-N 2.95Å; G458-A461 PolarHBondContact O-N 3.23Å; G458-N462 PolarHBondContact O-N 3.3Å; G458-N462 VanDerWaalsContact O-N 3.09Å
459	A	93.4	Very high	94.3	Very high	7 Å²	7	22.2 Å²	22.2	6%	0.058	11%	0.109	C	C	.	.	H	α-helix	trans	-61.7	-32.5	-177.7	0	0	0	0	0	112.7	F438 M449 A450 D453 L463	F438-A459 HydrophobicContact CE1-CB 4.29Å; M449-A459 HydrophobicContact CB-CB 4.4Å; A450-A459 HydrophobicContact CB-CB 3.91Å; D453-A459 PolarHBondContact OD2-N 3.11Å; A459-L463 PolarHBondContact O-N 3.36Å
460	F	95.7	Very high	94.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.5	-47.7	176.5	-170	-128.2	0	0	0	112.3	A450 G458 N462 L463 L464 V597 Y598 R605 L609	A450-F460 HydrophobicContact CB-CB 4.38Å; A450-F460 WeakPolarHBondContact O-CB 3.36Å; A450-F460 WeakPolarHBondContact O-CD2 3.27Å; A450-F460 VanDerWaalsContact O-CG 3.31Å; A450-F460 WeakPolarHBondContact O-CG 3.27Å; G458-F460 PolarHBondContact O-N 2.95Å; F460-N462 VanDerWaalsContact C-N 3.35Å; F460-L463 PolarHBondContact O-N 3.39Å; F460-L464 HydrophobicContact CD1-CD1 4.02Å; F460-L464 HydrophobicContact CE1-CD1 3.51Å; F460-L464 HydrophobicContact CE1-CG 4.4Å; F460-L464 HydrophobicContact CE2-CD1 4.11Å; F460-L464 HydrophobicContact CE2-CG 4.16Å; F460-L464 HydrophobicContact CZ-CD1 3.55Å; F460-L464 HydrophobicContact CZ-CD2 4.44Å; F460-L464 HydrophobicContact CZ-CG 4.08Å; F460-L464 PolarHBondContact O-N 2.99Å; F460-V597 HydrophobicContact CE1-CG1 4.14Å; F460-V597 HydrophobicContact CE1-CG2 3.92Å; F460-V597 HydrophobicContact CZ-CG2 4.18Å; F460-Y598 AromaticContact CD1-CD1 3.77Å; F460-Y598 HydrophobicContact CD1-CD1 3.77Å; F460-Y598 AromaticContact CD1-CE1 3.82Å; F460-Y598 HydrophobicContact CD1-CE1 3.82Å; F460-Y598 HydrophobicContact CE1-CD1 4.43Å; F460-R605 HydrophobicContact CD2-CB 4.43Å; F460-R605 HydrophobicContact CE1-CG 3.97Å; F460-R605 HydrophobicContact CE2-CB 3.61Å; F460-R605 HydrophobicContact CE2-CG 3.92Å; F460-R605 HydrophobicContact CZ-CB 3.68Å; F460-R605 HydrophobicContact CZ-CG 3.55Å; F460-L609 HydrophobicContact CD2-CD1 4.37Å; F460-L609 HydrophobicContact CE2-CD1 4.11Å; F460-L609 HydrophobicContact CE2-CD2 4.36Å; F460-L609 HydrophobicContact CE2-CG 4.16Å
461	A	95.9	Very high	94.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.2	-44.8	179	0	0	0	0	0	110.9	P456 G458 L463 L464 C465 L541 Y598	P456-A461 WeakPolarHBondContact O-CB 3.3Å; G458-A461 PolarHBondContact O-N 3.23Å; A461-L463 PolarHBondContact O-N 3.28Å; A461-L464 PolarHBondContact O-N 3.03Å; A461-C465 WeakPolarHBondContact O-CB 3.46Å; A461-C465 PolarHBondContact O-N 2.95Å; A461-C465 PolarHBondContact O-SG 2.84Å; A461-C465 VanDerWaalsContact O-SG 3.35Å; A461-L541 HydrophobicContact CB-CD1 3.88Å; A461-Y598 HydrophobicContact CB-CE1 4.06Å; A461-Y598 WeakPolarHBondContact CB-OH 3.31Å
462	N	95.4	Very high	94.2	Very high	53 Å²	53	23.1 Å²	23.1	28%	0.283	11%	0.111	S	C	.	.	H	α-helix	trans	-61.1	-41.9	177.6	-69.8	-14.7	0	0	0	112.3	F437 F438 G458 F460 M466	F437-N462 HydrophobicContact CB-CB 4.4Å; F437-N462 HydrophobicContact CD1-CB 4.38Å; F437-N462 WeakPolarHBondContact CD1-O 3.38Å; F438-N462 HydrophobicContact CE1-CB 4.29Å; F438-N462 HydrophobicContact CE2-CB 4.14Å; F438-N462 HydrophobicContact CZ-CB 3.68Å; G458-N462 PolarHBondContact O-N 3.3Å; G458-N462 VanDerWaalsContact O-N 3.09Å; F460-N462 VanDerWaalsContact C-N 3.35Å; N462-M466 VanDerWaalsContact O-CB 3.27Å; N462-M466 WeakPolarHBondContact O-CB 3.41Å; N462-M466 PolarHBondContact O-N 3.41Å
463	L	96.4	Very high	94	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.9	-47.3	174	-83.3	-176.2	0	0	0	112.3	I425 F438 F442 L447 A450 A459 F460 A461 M466 L467 L609	I425-L463 HydrophobicContact CD1-CD2 3.8Å; F438-L463 HydrophobicContact CE2-CD2 3.73Å; F438-L463 HydrophobicContact CE2-CG 4.14Å; F438-L463 HydrophobicContact CZ-CD2 3.85Å; F438-L463 HydrophobicContact CZ-CG 3.75Å; F442-L463 HydrophobicContact CD2-CD2 4.11Å; F442-L463 HydrophobicContact CE2-CD1 3.8Å; F442-L463 HydrophobicContact CE2-CD2 3.51Å; F442-L463 HydrophobicContact CE2-CG 3.85Å; F442-L463 HydrophobicContact CZ-CD1 3.69Å; F442-L463 HydrophobicContact CZ-CD2 3.73Å; F442-L463 HydrophobicContact CZ-CG 4.16Å; L447-L463 HydrophobicContact CD1-CD1 4.25Å; A450-L463 HydrophobicContact CB-CD1 3.51Å; A450-L463 HydrophobicContact CB-CG 4.37Å; A459-L463 PolarHBondContact O-N 3.36Å; F460-L463 PolarHBondContact O-N 3.39Å; A461-L463 PolarHBondContact O-N 3.28Å; L463-M466 HydrophobicContact CD2-CE 3.76Å; L463-M466 PolarHBondContact O-N 2.9Å; L463-L467 WeakPolarHBondContact O-CG 3.45Å; L463-L467 PolarHBondContact O-N 3.1Å; L463-L467 VanDerWaalsContact O-N 3.09Å; L463-L609 HydrophobicContact CB-CD2 3.97Å; L463-L609 HydrophobicContact CD1-CD1 4.06Å; L463-L609 HydrophobicContact CD1-CD2 4.45Å
464	L	96.4	Very high	93.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.7	-46.6	179.2	-77.6	178	0	0	0	111.7	F460 A461 L467 L468 L541 V597 V608 L609 L612	F460-L464 HydrophobicContact CD1-CD1 4.02Å; F460-L464 HydrophobicContact CE1-CD1 3.51Å; F460-L464 HydrophobicContact CE1-CG 4.4Å; F460-L464 HydrophobicContact CE2-CD1 4.11Å; F460-L464 HydrophobicContact CE2-CG 4.16Å; F460-L464 HydrophobicContact CZ-CD1 3.55Å; F460-L464 HydrophobicContact CZ-CD2 4.44Å; F460-L464 HydrophobicContact CZ-CG 4.08Å; F460-L464 PolarHBondContact O-N 2.99Å; A461-L464 PolarHBondContact O-N 3.03Å; L464-L467 PolarHBondContact O-N 3.44Å; L464-L468 VanDerWaalsContact O-CB 3.28Å; L464-L468 WeakPolarHBondContact O-CB 3.46Å; L464-L468 WeakPolarHBondContact O-CG 3.31Å; L464-L468 PolarHBondContact O-N 2.94Å; L464-L541 HydrophobicContact CB-CD1 3.67Å; L464-L541 HydrophobicContact CB-CD2 4.01Å; L464-L541 HydrophobicContact CD1-CD1 3.97Å; L464-L541 HydrophobicContact CG-CD1 4.48Å; L464-V597 HydrophobicContact CD1-CG1 4.4Å; L464-V608 HydrophobicContact CD2-CG1 3.57Å; L464-L609 HydrophobicContact CD2-CD2 3.89Å; L464-L609 HydrophobicContact CG-CD2 4.3Å; L464-L612 HydrophobicContact CD2-CD1 3.69Å
465	C	95.6	Very high	93.5	Very high	10 Å²	10	21 Å²	21	7%	0.068	11%	0.106	C	C	.	.	H	α-helix	trans	-58.7	-48.7	176.5	-72.1	0	0	0	0	111.1	F437 A461 L467 L468 E469 L536	F437-C465 HydrophobicContact CE1-CB 3.83Å; A461-C465 WeakPolarHBondContact O-CB 3.46Å; A461-C465 PolarHBondContact O-N 2.95Å; A461-C465 PolarHBondContact O-SG 2.84Å; A461-C465 VanDerWaalsContact O-SG 3.35Å; C465-L467 PolarHBondContact O-N 2.8Å; C465-L468 PolarHBondContact O-N 3.11Å; C465-E469 WeakPolarHBondContact O-CB 3.47Å; C465-E469 PolarHBondContact O-N 2.83Å; C465-L536 HydrophobicContact CB-CG 4.42Å
466	M	96	Very high	92.8	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-56.5	-46.7	178.9	-176.8	-176.4	66	0	0	112.4	I425 L432 V434 F437 N462 L463 R470	I425-M466 HydrophobicContact CD1-CE 4.38Å; I425-M466 HydrophobicContact CG1-CE 4.41Å; L432-M466 HydrophobicContact CB-CG 4.41Å; L432-M466 HydrophobicContact CB-SD 4.21Å; L432-M466 VanDerWaalsContact O-CG 3.32Å; L432-M466 WeakPolarHBondContact O-CG 3.44Å; V434-M466 HydrophobicContact CB-SD 4.36Å; V434-M466 HydrophobicContact CG2-SD 3.92Å; F437-M466 HydrophobicContact CB-SD 4.49Å; F437-M466 HydrophobicContact CD1-CB 4.01Å; F437-M466 HydrophobicContact CD2-CB 3.61Å; F437-M466 HydrophobicContact CD2-CG 3.56Å; F437-M466 HydrophobicContact CD2-SD 4.09Å; F437-M466 HydrophobicContact CE1-CB 4.09Å; F437-M466 HydrophobicContact CE2-CB 3.7Å; F437-M466 HydrophobicContact CE2-CG 3.74Å; F437-M466 HydrophobicContact CG-CB 3.77Å; F437-M466 HydrophobicContact CG-CG 4.15Å; F437-M466 HydrophobicContact CG-SD 4.48Å; F437-M466 HydrophobicContact CZ-CB 3.94Å; F437-M466 HydrophobicContact CZ-CG 4.45Å; N462-M466 VanDerWaalsContact O-CB 3.27Å; N462-M466 WeakPolarHBondContact O-CB 3.41Å; N462-M466 PolarHBondContact O-N 3.41Å; L463-M466 HydrophobicContact CD2-CE 3.76Å; L463-M466 PolarHBondContact O-N 2.9Å; M466-R470 PolarHBondContact O-N 3.46Å
467	L	97.1	Very high	92	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-70.5	-46	-179.4	-64.1	175.5	0	0	0	111.8	F424 L432 L463 L464 C465 R470 I471 L609 L612 L616	F424-L467 HydrophobicContact CE1-CD2 4.32Å; L432-L467 HydrophobicContact CD2-CD2 4.3Å; L463-L467 WeakPolarHBondContact O-CG 3.45Å; L463-L467 PolarHBondContact O-N 3.1Å; L463-L467 VanDerWaalsContact O-N 3.09Å; L464-L467 PolarHBondContact O-N 3.44Å; C465-L467 PolarHBondContact O-N 2.8Å; L467-R470 PolarHBondContact O-N 2.56Å; L467-I471 VanDerWaalsContact O-CG1 3.27Å; L467-I471 WeakPolarHBondContact O-CG1 3.44Å; L467-I471 PolarHBondContact O-N 2.97Å; L467-L609 HydrophobicContact CD1-CD2 3.89Å; L467-L612 HydrophobicContact CB-CB 4.12Å; L467-L612 HydrophobicContact CB-CD1 4.16Å; L467-L612 HydrophobicContact CD1-CB 4.05Å; L467-L612 HydrophobicContact CD1-CD1 4.42Å; L467-L616 HydrophobicContact CD2-CD1 3.64Å
468	L	95.3	Very high	91.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.5	-42.6	-180	-74.8	170.4	0	0	0	112.1	L464 C465 R470 I471 F472 L536 L541 L545 Y548 L612	L464-L468 VanDerWaalsContact O-CB 3.28Å; L464-L468 WeakPolarHBondContact O-CB 3.46Å; L464-L468 WeakPolarHBondContact O-CG 3.31Å; L464-L468 PolarHBondContact O-N 2.94Å; C465-L468 PolarHBondContact O-N 3.11Å; L468-R470 VanDerWaalsContact C-N 3.29Å; L468-R470 PolarHBondContact O-N 2.83Å; L468-I471 PolarHBondContact O-N 3.48Å; L468-F472 HydrophobicContact CB-CE2 4.36Å; L468-F472 HydrophobicContact CB-CZ 4.28Å; L468-F472 HydrophobicContact CD2-CE1 4.2Å; L468-F472 HydrophobicContact CD2-CZ 4.14Å; L468-F472 WeakPolarHBondContact O-CB 3.38Å; L468-F472 WeakPolarHBondContact O-CD1 3.32Å; L468-F472 WeakPolarHBondContact O-CG 3.48Å; L468-F472 PolarHBondContact O-N 3.18Å; L468-L536 HydrophobicContact CB-CD1 4.05Å; L468-L536 HydrophobicContact CB-CD2 3.95Å; L468-L536 HydrophobicContact CD1-CD1 3.95Å; L468-L541 HydrophobicContact CD1-CD2 3.78Å; L468-L545 HydrophobicContact CD1-CD1 4.36Å; L468-Y548 HydrophobicContact CD2-CD1 3.94Å; L468-Y548 HydrophobicContact CD2-CD2 4.49Å; L468-Y548 HydrophobicContact CD2-CE1 4.25Å; L468-Y548 HydrophobicContact CD2-CG 4.05Å; L468-L612 HydrophobicContact CD2-CD1 4.18Å; L468-L612 HydrophobicContact CD2-CD2 3.73Å; L468-L612 HydrophobicContact CG-CD1 4.05Å; L468-L612 HydrophobicContact CG-CD2 4.47Å
469	E	93.3	Very high	89.9	Confident	93 Å²	93	23.1 Å²	23.1	44%	0.435	12%	0.116	S	C	.	.	H	α-helix	trans	-58	-46	176.9	-171.9	178.9	153.7	0	0	109.9	F437 C465 I471 F472 V473 L536	F437-E469 WeakPolarHBondContact CZ-OE2 3.19Å; C465-E469 WeakPolarHBondContact O-CB 3.47Å; C465-E469 PolarHBondContact O-N 2.83Å; E469-I471 PolarHBondContact O-N 3.29Å; E469-F472 PolarHBondContact O-N 3.45Å; E469-V473 WeakPolarHBondContact O-CG2 3.45Å; E469-V473 PolarHBondContact O-N 3.36Å; E469-L536 HydrophobicContact CB-CD2 3.75Å
470	R	94.9	Very high	88	Confident	50 Å²	50	24.6 Å²	24.6	19%	0.189	13%	0.133	C	C	.	.	H	α-helix	trans	-65.6	-40	178.6	-170	56.2	174.5	143.6	5.2	112.5	M431 L432 M466 L467 L468 L474 E477 L616 F622	M431-R470 WeakPolarHBondContact O-CD 3.5Å; M431-R470 PolarHBondContact O-NE 2.91Å; L432-R470 HydrophobicContact CD2-CB 4.36Å; L432-R470 HydrophobicContact CD2-CG 4.23Å; M466-R470 PolarHBondContact O-N 3.46Å; L467-R470 PolarHBondContact O-N 2.56Å; L468-R470 VanDerWaalsContact C-N 3.29Å; L468-R470 PolarHBondContact O-N 2.83Å; R470-L474 HydrophobicContact CG-CD1 4.13Å; R470-L474 WeakPolarHBondContact O-CB 3.21Å; R470-L474 VanDerWaalsContact O-CG 3.3Å; R470-L474 WeakPolarHBondContact O-CG 3.34Å; R470-L474 PolarHBondContact O-N 2.67Å; R470-E477 IonicContact NH1-OE1 3.7Å; R470-L616 HydrophobicContact CB-CD2 4.12Å; R470-L616 HydrophobicContact CG-CD2 3.86Å; R470-F622 HydrophobicContact CG-CE2 4.41Å; R470-F622 HydrophobicContact CG-CZ 4.49Å
471	I	93.3	Very high	85.7	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.8	-47.6	173.3	-70.6	166.4	0	0	0	110	L467 L468 E469 V473 L474 Q475 Y548 L612 Q615 L616 F619	L467-I471 VanDerWaalsContact O-CG1 3.27Å; L467-I471 WeakPolarHBondContact O-CG1 3.44Å; L467-I471 PolarHBondContact O-N 2.97Å; L468-I471 PolarHBondContact O-N 3.48Å; E469-I471 PolarHBondContact O-N 3.29Å; I471-V473 PolarHBondContact O-N 3.01Å; I471-L474 PolarHBondContact O-N 3.22Å; I471-Q475 HydrophobicContact CG2-CG 4.18Å; I471-Q475 VanDerWaalsContact O-CG 3.31Å; I471-Q475 WeakPolarHBondContact O-CG 3.37Å; I471-Q475 PolarHBondContact O-N 3.26Å; I471-Y548 HydrophobicContact CG2-CE2 3.89Å; I471-L612 HydrophobicContact CD1-CB 4.08Å; I471-L612 HydrophobicContact CD1-CD2 3.74Å; I471-L612 HydrophobicContact CD1-CG 4.47Å; I471-Q615 HydrophobicContact CD1-CB 4.22Å; I471-Q615 HydrophobicContact CD1-CG 4.25Å; I471-Q615 HydrophobicContact CG1-CG 4.47Å; I471-L616 HydrophobicContact CD1-CG 4.3Å; I471-L616 HydrophobicContact CG1-CD2 3.57Å; I471-L616 HydrophobicContact CG1-CG 3.77Å; I471-F619 HydrophobicContact CG1-CE2 4.44Å; I471-F619 HydrophobicContact CG2-CE2 4.36Å; I471-F619 HydrophobicContact CG2-CZ 4.26Å
472	F	90.9	Very high	83.5	Confident	10 Å²	10	38.1 Å²	38.1	4%	0.044	20%	0.2	C	C	.	.	H	α-helix	trans	-64.7	-40.5	-177.3	-66.5	-10	0	0	0	112.4	L468 E469 T476 R532 L536 V544 Y548	L468-F472 HydrophobicContact CB-CE2 4.36Å; L468-F472 HydrophobicContact CB-CZ 4.28Å; L468-F472 HydrophobicContact CD2-CE1 4.2Å; L468-F472 HydrophobicContact CD2-CZ 4.14Å; L468-F472 WeakPolarHBondContact O-CB 3.38Å; L468-F472 WeakPolarHBondContact O-CD1 3.32Å; L468-F472 WeakPolarHBondContact O-CG 3.48Å; L468-F472 PolarHBondContact O-N 3.18Å; E469-F472 PolarHBondContact O-N 3.45Å; F472-T476 WeakPolarHBondContact O-CB 3.47Å; F472-T476 PolarHBondContact O-N 3.27Å; F472-T476 PolarHBondContact O-OG1 2.63Å; F472-R532 HydrophobicContact CB-CB 3.97Å; F472-R532 HydrophobicContact CB-CG 4.17Å; F472-R532 HydrophobicContact CD1-CG 4.19Å; F472-R532 WeakPolarHBondContact CD2-O 3.48Å; F472-R532 HydrophobicContact CG-CB 4.14Å; F472-R532 HydrophobicContact CG-CG 4.25Å; F472-L536 HydrophobicContact CD2-CD2 4.33Å; F472-L536 HydrophobicContact CE2-CD1 4.43Å; F472-L536 HydrophobicContact CE2-CD2 4.31Å; F472-V544 HydrophobicContact CE2-CG1 4.06Å; F472-V544 HydrophobicContact CZ-CG1 4.02Å; F472-Y548 AromaticContact CE1-CD2 3.68Å; F472-Y548 HydrophobicContact CE1-CD2 3.68Å; F472-Y548 HydrophobicContact CE1-CE2 4.26Å; F472-Y548 HydrophobicContact CE1-CG 4.31Å; F472-Y548 HydrophobicContact CZ-CD2 4.46Å
473	V	88.2	Confident	81	Confident	56 Å²	56	44.3 Å²	44.3	34%	0.339	23%	0.227	S	C	.	.	H	α-helix	trans	-60	-49.7	172.8	170.9	0	0	0	0	110.5	E469 I471 Q475 T476 E477	E469-V473 WeakPolarHBondContact O-CG2 3.45Å; E469-V473 PolarHBondContact O-N 3.36Å; I471-V473 PolarHBondContact O-N 3.01Å; V473-Q475 PolarHBondContact O-N 3.29Å; V473-T476 WeakPolarHBondContact O-CB 3.13Å; V473-T476 PolarHBondContact O-N 3Å; V473-T476 VanDerWaalsContact O-N 3.12Å; V473-E477 HydrophobicContact CG1-CG 4.5Å; V473-E477 WeakPolarHBondContact CG1-OE1 3.34Å; V473-E477 WeakPolarHBondContact O-CG 3.35Å; V473-E477 PolarHBondContact O-N 3.03Å
474	L	88.8	Confident	78.9	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-38.5	-178.9	-71.3	169.2	0	0	0	113.1	R470 I471 T476 E477 E478 L616 F619 A621 F622	R470-L474 HydrophobicContact CG-CD1 4.13Å; R470-L474 WeakPolarHBondContact O-CB 3.21Å; R470-L474 VanDerWaalsContact O-CG 3.3Å; R470-L474 WeakPolarHBondContact O-CG 3.34Å; R470-L474 PolarHBondContact O-N 2.67Å; I471-L474 PolarHBondContact O-N 3.22Å; L474-T476 VanDerWaalsContact C-N 3.26Å; L474-T476 PolarHBondContact O-N 3.14Å; L474-E477 PolarHBondContact O-N 2.91Å; L474-E478 WeakPolarHBondContact O-CG 3.45Å; L474-E478 PolarHBondContact O-N 2.99Å; L474-L616 HydrophobicContact CD1-CD2 3.93Å; L474-F619 HydrophobicContact CB-CD1 3.61Å; L474-F619 HydrophobicContact CB-CD2 4.37Å; L474-F619 HydrophobicContact CB-CE1 3.64Å; L474-F619 HydrophobicContact CB-CE2 4.39Å; L474-F619 HydrophobicContact CB-CG 3.99Å; L474-F619 HydrophobicContact CB-CZ 4.06Å; L474-F619 HydrophobicContact CD1-CB 4.04Å; L474-F619 HydrophobicContact CD1-CD1 4.37Å; L474-F619 HydrophobicContact CD1-CD2 3.94Å; L474-F619 HydrophobicContact CD1-CE2 4.45Å; L474-F619 HydrophobicContact CD1-CG 3.88Å; L474-F619 HydrophobicContact CG-CG 4.48Å; L474-A621 HydrophobicContact CD2-CB 3.96Å; L474-F622 HydrophobicContact CD1-CD2 4.11Å; L474-F622 HydrophobicContact CD1-CE2 3.75Å
475	Q	84.7	Confident	76.6	Confident	14 Å²	14	54.6 Å²	54.6	7%	0.065	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-32.3	174.1	-69.9	-174.9	-7.7	0	0	112.2	I471 V473 D479 R532 F619	I471-Q475 HydrophobicContact CG2-CG 4.18Å; I471-Q475 VanDerWaalsContact O-CG 3.31Å; I471-Q475 WeakPolarHBondContact O-CG 3.37Å; I471-Q475 PolarHBondContact O-N 3.26Å; V473-Q475 PolarHBondContact O-N 3.29Å; Q475-D479 PolarHBondContact O-N 3.47Å; Q475-D479 VanDerWaalsContact O-N 3.16Å; Q475-R532 VanDerWaalsContact CB-NE 3.29Å; Q475-R532 PolarHBondContact O-NH1 3.26Å; Q475-R532 VanDerWaalsContact O-NH1 3.15Å; Q475-F619 HydrophobicContact CG-CE1 3.94Å; Q475-F619 HydrophobicContact CG-CZ 3.67Å
476	T	79.7	Confident	74.6	Confident	36 Å²	36	61.8 Å²	61.8	22%	0.221	31%	0.31	C	S	.	.	H	α-helix	trans	-70.4	-43.8	175	-55.3	0	0	0	0	110.8	F472 V473 L474 E478 D479 G480 R532 Y533	F472-T476 WeakPolarHBondContact O-CB 3.47Å; F472-T476 PolarHBondContact O-N 3.27Å; F472-T476 PolarHBondContact O-OG1 2.63Å; V473-T476 WeakPolarHBondContact O-CB 3.13Å; V473-T476 PolarHBondContact O-N 3Å; V473-T476 VanDerWaalsContact O-N 3.12Å; L474-T476 VanDerWaalsContact C-N 3.26Å; L474-T476 PolarHBondContact O-N 3.14Å; T476-E478 VanDerWaalsContact C-N 3.29Å; T476-E478 PolarHBondContact O-N 2.94Å; T476-D479 PolarHBondContact O-N 2.91Å; T476-G480 PolarHBondContact O-N 3.32Å; T476-R532 WeakPolarHBondContact OG1-CD 3.38Å; T476-Y533 WeakPolarHBondContact CG2-OH 3.26Å
477	E	77.3	Confident	72.5	Confident	120 Å²	120	69.3 Å²	69.3	56%	0.561	34%	0.339	S	S	*	.	H	α-helix	trans	-59.6	-37.2	174.1	-70.3	174.6	-163.6	0	0	112.4	R470 V473 L474	R470-E477 IonicContact NH1-OE1 3.7Å; V473-E477 HydrophobicContact CG1-CG 4.5Å; V473-E477 WeakPolarHBondContact CG1-OE1 3.34Å; V473-E477 WeakPolarHBondContact O-CG 3.35Å; V473-E477 PolarHBondContact O-N 3.03Å; L474-E477 PolarHBondContact O-N 2.91Å
478	E	73.5	Confident	70.2	Confident	14 Å²	14	70.6 Å²	70.6	7%	0.065	35%	0.345	C	S	.	.	H	α-helix	trans	-77.9	-32.5	-179.1	-76.8	-174.1	151.4	0	0	114.8	L474 T476 G480 F563 R564 S567 R568 F619	L474-E478 WeakPolarHBondContact O-CG 3.45Å; L474-E478 PolarHBondContact O-N 2.99Å; T476-E478 VanDerWaalsContact C-N 3.29Å; T476-E478 PolarHBondContact O-N 2.94Å; E478-G480 VanDerWaalsContact C-N 3.27Å; E478-F563 HydrophobicContact CB-CE1 4.5Å; E478-F563 WeakPolarHBondContact O-CD1 3.42Å; E478-F563 WeakPolarHBondContact O-CE1 3.22Å; E478-R564 HydrophobicContact CB-CG 4.47Å; E478-S567 PolarHBondContact OE1-OG 3.27Å; E478-R568 VanDerWaalsContact CD-NE 3.34Å; E478-R568 WeakPolarHBondContact OE1-CG 3.35Å; E478-R568 IonicContact OE1-NE 3.62Å; E478-R568 PolarHBondContact OE1-NE 3.38Å; E478-R568 VanDerWaalsContact OE1-NE 3.16Å; E478-R568 IonicContact OE2-CZ 3.69Å; E478-R568 IonicContact OE2-NE 3.12Å; E478-R568 PolarHBondContact OE2-NE 3.43Å; E478-R568 IonicContact OE2-NH2 3.98Å; E478-R568 PolarHBondContact OE2-NH2 3Å; E478-F619 VanDerWaalsContact CD-CD1 3.49Å; E478-F619 HydrophobicContact CG-CD1 4.41Å; E478-F619 WeakPolarHBondContact OE1-CD1 3.32Å; E478-F619 WeakPolarHBondContact OE2-CD1 3.33Å; E478-F619 VanDerWaalsContact OE2-CE1 3.27Å; E478-F619 WeakPolarHBondContact OE2-CE1 3.44Å
479	D	65.9	Low	68.1	Low	14 Å²	14	75.4 Å²	75.4	8%	0.075	37%	0.368	C	S	.	.	H	α-helix	trans	-79.7	-15.1	179.6	-75.5	-5.6	0	0	0	113.3	Q475 T476 R532 Y554 N560 R564	Q475-D479 PolarHBondContact O-N 3.47Å; Q475-D479 VanDerWaalsContact O-N 3.16Å; T476-D479 PolarHBondContact O-N 2.91Å; D479-R532 IonicContact OD2-CZ 3.74Å; D479-R532 IonicContact OD2-NH1 3.7Å; D479-R532 PolarHBondContact OD2-NH1 3.38Å; D479-R532 IonicContact OD2-NH2 2.96Å; D479-R532 PolarHBondContact OD2-NH2 3.11Å; D479-Y554 PolarHBondContact OD2-OH 3.49Å; D479-N560 PolarHBondContact O-ND2 2.97Å; D479-R564 IonicContact OD1-CZ 3.63Å; D479-R564 IonicContact OD1-NE 3.84Å; D479-R564 PolarHBondContact OD1-NE 2.85Å; D479-R564 IonicContact OD1-NH2 2.87Å; D479-R564 PolarHBondContact OD1-NH2 3.25Å; D479-R564 IonicContact OD2-CZ 3.67Å; D479-R564 IonicContact OD2-NH2 2.86Å; D479-R564 PolarHBondContact OD2-NH2 3Å
480	G	53.7	Low	65.9	Low	39 Å²	39	77.6 Å²	77.6	40%	0.402	38%	0.378	S	S	.	.			trans	68.8	153.4	-175	0	0	0	0	0	112.5	T476 E478	T476-G480 PolarHBondContact O-N 3.32Å; E478-G480 VanDerWaalsContact C-N 3.27Å
481	D	48.7	Very low	63.5	Low	117 Å²	117	76 Å²	76	63%	0.626	38%	0.376	S	S	*	.			trans	-66.6	137.4	153	-65.3	-39.1	0	0	0	106.2	E483 D484	D481-E483 PolarHBondContact O-N 3.43Å; D481-D484 PolarHBondContact O-N 3.08Å
482	E	47.7	Very low	61.2	Low	167 Å²	167	77.2 Å²	77.2	78%	0.78	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-3.7	179.5	-65.6	-179.8	165.1	0	0	114.4
483	E	44.3	Very low	59.3	Low	182 Å²	182	81.9 Å²	81.9	85%	0.85	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-11.8	-174.9	-59.8	-171.8	169.1	0	0	115.3	D481 E485	D481-E483 PolarHBondContact O-N 3.43Å; E483-E485 PolarHBondContact O-N 3.43Å
484	D	51.3	Low	57.4	Low	88 Å²	88	81.4 Å²	81.4	47%	0.471	42%	0.416	S	S	.	.			trans	-103.2	51.3	-178.5	-142.3	9.2	0	0	0	112.6	D481 E486 R487 M488	D481-D484 PolarHBondContact O-N 3.08Å; D484-E486 VanDerWaalsContact C-N 3.26Å; D484-E486 PolarHBondContact O-N 3.34Å; D484-R487 PolarHBondContact O-N 3.5Å; D484-R487 VanDerWaalsContact O-N 3.17Å; D484-M488 PolarHBondContact O-N 3.01Å
485	E	49.6	Very low	55.3	Low	129 Å²	129	84.2 Å²	84.2	60%	0.603	43%	0.431	S	S	*	.	H	α-helix	trans	-52	-40.2	-177.2	-72.8	-172.4	146.1	0	0	113.1	E483 R487 M488 E489	E483-E485 PolarHBondContact O-N 3.43Å; E485-R487 PolarHBondContact O-N 2.88Å; E485-M488 PolarHBondContact O-N 2.94Å; E485-E489 WeakPolarHBondContact O-CB 3.15Å; E485-E489 PolarHBondContact O-N 3.27Å
486	E	53	Low	53.2	Low	160 Å²	160	91.3 Å²	91.3	75%	0.748	46%	0.464	S	S	*	.	H	α-helix	trans	-61.5	-40.2	-178.6	-77.3	-174	160.9	0	0	112.4	D484 E489 E490	D484-E486 VanDerWaalsContact C-N 3.26Å; D484-E486 PolarHBondContact O-N 3.34Å; E486-E489 PolarHBondContact O-N 2.93Å; E486-E490 PolarHBondContact O-N 3.03Å
487	R	52.1	Low	51.4	Low	160 Å²	160	96.8 Å²	96.8	60%	0.604	49%	0.492	S	S	*	.	H	α-helix	trans	-72.6	-36.5	-178	-162.4	178.1	-174.6	-167.3	-2.3	111.5	D484 E485 A491	D484-R487 PolarHBondContact O-N 3.5Å; D484-R487 VanDerWaalsContact O-N 3.17Å; E485-R487 PolarHBondContact O-N 2.88Å; R487-A491 PolarHBondContact O-N 3.31Å
488	M	48.6	Very low	49.7	Very low	29 Å²	29	96.6 Å²	96.6	14%	0.143	50%	0.504	C	S	.	.	H	α-helix	trans	-66.5	-37.7	171.8	-75.3	-166.2	-82.3	0	0	111.7	D484 E485 A492 K559 N560	D484-M488 PolarHBondContact O-N 3.01Å; E485-M488 PolarHBondContact O-N 2.94Å; M488-A492 WeakPolarHBondContact O-CB 3.37Å; M488-A492 PolarHBondContact O-N 2.68Å; M488-K559 HydrophobicContact SD-CB 4.23Å; M488-N560 PolarHBondContact SD-OD1 3.11Å
489	E	50.1	Low	48.5	Very low	101 Å²	101	101.5 Å²	101.5	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-72.4	-41.4	-179.5	-137.3	144.8	-119.4	0	0	112.3	E485 E486 A491 A492 V493 K559	E485-E489 WeakPolarHBondContact O-CB 3.15Å; E485-E489 PolarHBondContact O-N 3.27Å; E486-E489 PolarHBondContact O-N 2.93Å; E489-A491 VanDerWaalsContact C-N 3.32Å; E489-A491 PolarHBondContact O-N 2.86Å; E489-A492 CarbonylContact O-C 3.57Å; E489-A492 WeakPolarHBondContact O-CA 3.3Å; E489-A492 PolarHBondContact O-N 3.37Å; E489-A492 VanDerWaalsContact O-N 3.07Å; E489-V493 WeakPolarHBondContact O-CG2 3.36Å; E489-V493 PolarHBondContact O-N 2.72Å; E489-K559 IonicContact OE1-NZ 2.94Å; E489-K559 PolarHBondContact OE1-NZ 3.25Å
490	E	48	Very low	47.7	Very low	138 Å²	138	105.3 Å²	105.3	65%	0.645	55%	0.546	S	S	*	.	H	α-helix	trans	-61.2	-38.5	172.9	-76.8	-170.3	160.6	0	0	112.3	E486	E486-E490 PolarHBondContact O-N 3.03Å
491	A	45.4	Very low	47.6	Very low	18 Å²	18	109.1 Å²	109.1	15%	0.149	56%	0.561	C	S	.	*	H	α-helix	trans	-69.6	-35.9	172	0	0	0	0	0	112.3	R487 E489 V493 A494 R562 F563 L566	R487-A491 PolarHBondContact O-N 3.31Å; E489-A491 VanDerWaalsContact C-N 3.32Å; E489-A491 PolarHBondContact O-N 2.86Å; A491-V493 VanDerWaalsContact C-N 3.31Å; A491-V493 PolarHBondContact O-N 3.26Å; A491-A494 PolarHBondContact O-N 3.16Å; A491-R562 PolarHBondContact O-NE 3.3Å; A491-R562 VanDerWaalsContact O-NE 3.08Å; A491-R562 PolarHBondContact O-NH2 2.7Å; A491-F563 HydrophobicContact CB-CD2 4.43Å; A491-L566 HydrophobicContact CB-CD1 4.18Å
492	A	44.7	Very low	48.1	Very low	24 Å²	24	106.3 Å²	106.3	20%	0.198	55%	0.546	C	S	.	.	H	α-helix	trans	-77.1	-4	177.3	0	0	0	0	0	115	M488 E489 R562	M488-A492 WeakPolarHBondContact O-CB 3.37Å; M488-A492 PolarHBondContact O-N 2.68Å; E489-A492 CarbonylContact O-C 3.57Å; E489-A492 WeakPolarHBondContact O-CA 3.3Å; E489-A492 PolarHBondContact O-N 3.37Å; E489-A492 VanDerWaalsContact O-N 3.07Å; A492-R562 VanDerWaalsContact CA-CZ 3.41Å; A492-R562 PolarHBondContact O-NH1 2.76Å; A492-R562 PolarHBondContact O-NH2 2.73Å
493	V	50.7	Low	48.9	Very low	109 Å²	109	107.1 Å²	107.1	66%	0.661	55%	0.547	S	S	*	.	H	α-helix	trans	-96.1	-25.8	168.6	173.8	0	0	0	0	112.3	E489 A491 L495	E489-V493 WeakPolarHBondContact O-CG2 3.36Å; E489-V493 PolarHBondContact O-N 2.72Å; A491-V493 VanDerWaalsContact C-N 3.31Å; A491-V493 PolarHBondContact O-N 3.26Å; V493-L495 PolarHBondContact O-N 3.32Å; V493-L495 VanDerWaalsContact O-N 3.16Å
494	A	48.6	Very low	50.5	Low	45 Å²	45	105.2 Å²	105.2	37%	0.372	54%	0.536	S	S	.	.	S	Bend	trans	-82.6	20.6	-172	0	0	0	0	0	118.7	A491 R1206	A491-A494 PolarHBondContact O-N 3.16Å; A494-R1206 PolarHBondContact O-NH1 2.9Å
495	L	44.3	Very low	51.9	Low	65 Å²	65	103.1 Å²	103.1	34%	0.34	52%	0.522	S	S	.	.			trans	-173.4	49.8	-159.8	-111.4	168.7	0	0	0	110.6	V493 R562 Y565 L566	V493-L495 PolarHBondContact O-N 3.32Å; V493-L495 VanDerWaalsContact O-N 3.16Å; L495-R562 VanDerWaalsContact CA-CZ 3.48Å; L495-R562 HydrophobicContact CB-CG 4.39Å; L495-R562 HydrophobicContact CD1-CG 4.11Å; L495-R562 PolarHBondContact O-NH1 3.13Å; L495-R562 PolarHBondContact O-NH2 3.24Å; L495-Y565 HydrophobicContact CD1-CD1 4.05Å; L495-Y565 HydrophobicContact CD1-CE1 4.3Å; L495-L566 HydrophobicContact CD1-CD1 3.88Å; L495-L566 HydrophobicContact CD1-CD2 3.45Å; L495-L566 VanDerWaalsContact CD1-CD2 3.45Å; L495-L566 HydrophobicContact CD1-CG 3.61Å
496	E	40	Very low	53.1	Low	163 Å²	163	99.2 Å²	99.2	76%	0.762	51%	0.509	S	S	*	.			trans	-77.8	132.1	166.2	-84.2	-179.7	157.1	0	0	110.4
497	N	41.6	Very low	54.5	Low	151 Å²	151	95 Å²	95	81%	0.807	50%	0.498	S	S	*	.	S	Bend	trans	97.1	105.8	172.5	-55.5	-37.6	0	0	0	118.3
498	S	41	Very low	56.2	Low	115 Å²	115	91.2 Å²	91.2	80%	0.804	49%	0.487	S	S	*	.			trans	67.4	112.3	155.5	-66.3	0	0	0	0	119.1
499	E	48.7	Very low	58	Low	118 Å²	118	90.6 Å²	90.6	55%	0.551	48%	0.484	S	S	*	.			trans	172	18.9	140.3	-98.1	173	-159.6	0	0	117.6	K572	E499-K572 WeakPolarHBondContact OE2-CE 3.44Å; E499-K572 IonicContact OE2-NZ 2.75Å; E499-K572 PolarHBondContact OE2-NZ 3.17Å
500	I	49.4	Very low	59.5	Low	93 Å²	93	90.8 Å²	90.8	48%	0.477	49%	0.489	S	S	.	.	S	Bend	trans	-79.8	-17.2	176.2	-64.1	171.1	0	0	0	112.9	N502 F555	I500-N502 PolarHBondContact O-N 3.16Å; I500-F555 HydrophobicContact CD1-CE2 4.13Å; I500-F555 HydrophobicContact CD1-CZ 4.39Å; I500-F555 HydrophobicContact CG2-CD2 4.19Å; I500-F555 HydrophobicContact CG2-CE2 3.58Å; I500-F555 HydrophobicContact CG2-CZ 4.17Å
501	V	50.7	Low	61.5	Low	119 Å²	119	90 Å²	90	72%	0.721	48%	0.483	S	S	*	.			trans	-105.6	77.4	-174.4	-165.6	0	0	0	0	111.4	K503	V501-K503 PolarHBondContact O-N 3.49Å
502	N	60.5	Low	63.6	Low	58 Å²	58	89.2 Å²	89.2	31%	0.31	48%	0.477	S	S	.	.			trans	-75	107.9	158.8	-173.2	-29.8	0	0	0	107.8	I500 F504 Y505 S506 F574	I500-N502 PolarHBondContact O-N 3.16Å; N502-F504 PolarHBondContact O-N 3.09Å; N502-F504 VanDerWaalsContact O-N 3.13Å; N502-F504 VanDerWaalsContact OD1-CB 3.3Å; N502-F504 WeakPolarHBondContact OD1-CB 3.19Å; N502-F504 PolarHBondContact OD1-N 3.07Å; N502-Y505 HydrophobicContact CB-CD2 3.91Å; N502-Y505 VanDerWaalsContact CG-CD2 3.43Å; N502-Y505 WeakPolarHBondContact ND2-CD2 3.27Å; N502-Y505 VanDerWaalsContact ND2-CE2 3.29Å; N502-Y505 WeakPolarHBondContact ND2-CE2 3.28Å; N502-Y505 PolarHBondContact O-N 3.21Å; N502-Y505 VanDerWaalsContact O-N 3.1Å; N502-S506 PolarHBondContact O-N 3.42Å; N502-F574 HydrophobicContact CB-CD1 4.43Å; N502-F574 HydrophobicContact CB-CE1 3.84Å; N502-F574 HydrophobicContact CB-CZ 3.93Å
503	K	65	Low	65.5	Low	184 Å²	184	89.2 Å²	89.2	80%	0.8	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-35.2	-179	-73.3	-175.3	179.1	178.9	0	112.6	V501 S506	V501-K503 PolarHBondContact O-N 3.49Å; K503-S506 PolarHBondContact O-OG 2.73Å
504	F	76.7	Confident	67.2	Low	143 Å²	143	91 Å²	91	63%	0.627	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-40.8	-179.5	-176.4	-95.3	0	0	0	112.4	N502	N502-F504 PolarHBondContact O-N 3.09Å; N502-F504 VanDerWaalsContact O-N 3.13Å; N502-F504 VanDerWaalsContact OD1-CB 3.3Å; N502-F504 WeakPolarHBondContact OD1-CB 3.19Å; N502-F504 PolarHBondContact OD1-N 3.07Å
505	Y	81.7	Confident	69.2	Low	43 Å²	43	90.8 Å²	90.8	17%	0.169	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-12	-178.6	-59.5	-61.3	0	0	0	114	N502 S507 H508 V509 F574 F579 L583	N502-Y505 HydrophobicContact CB-CD2 3.91Å; N502-Y505 VanDerWaalsContact CG-CD2 3.43Å; N502-Y505 WeakPolarHBondContact ND2-CD2 3.27Å; N502-Y505 VanDerWaalsContact ND2-CE2 3.29Å; N502-Y505 WeakPolarHBondContact ND2-CE2 3.28Å; N502-Y505 PolarHBondContact O-N 3.21Å; N502-Y505 VanDerWaalsContact O-N 3.1Å; Y505-S507 PolarHBondContact O-N 2.83Å; Y505-H508 WeakPolarHBondContact O-CB 3.48Å; Y505-H508 PolarHBondContact O-N 2.94Å; Y505-V509 WeakPolarHBondContact O-CG2 3.29Å; Y505-V509 PolarHBondContact O-N 3.39Å; Y505-F574 HydrophobicContact CD1-CB 4.49Å; Y505-F574 HydrophobicContact CD2-CB 3.87Å; Y505-F574 HydrophobicContact CD2-CD1 4.19Å; Y505-F574 AromaticContact CD2-CD2 3.68Å; Y505-F574 HydrophobicContact CD2-CD2 3.68Å; Y505-F574 HydrophobicContact CD2-CE2 4.21Å; Y505-F574 AromaticContact CD2-CG 3.65Å; Y505-F574 HydrophobicContact CD2-CG 3.65Å; Y505-F574 AromaticContact CE2-CD2 3.89Å; Y505-F574 HydrophobicContact CE2-CD2 3.89Å; Y505-F574 HydrophobicContact CE2-CE2 4.36Å; Y505-F574 HydrophobicContact CE2-CG 4.29Å; Y505-F574 HydrophobicContact CG-CB 3.89Å; Y505-F574 HydrophobicContact CG-CG 4.13Å; Y505-F579 AromaticContact CD1-CE1 3.72Å; Y505-F579 HydrophobicContact CD1-CE1 3.72Å; Y505-F579 HydrophobicContact CD1-CZ 4.17Å; Y505-F579 HydrophobicContact CE1-CE1 4.27Å; Y505-F579 HydrophobicContact CG-CE1 4.19Å; Y505-L583 HydrophobicContact CD1-CD1 3.7Å; Y505-L583 HydrophobicContact CE1-CD1 3.5Å
506	S	74.4	Confident	71.2	Confident	47 Å²	47	88.3 Å²	88.3	33%	0.329	45%	0.453	S	S	.	.	H	α-helix	trans	-48.2	-53.9	-174	59.5	0	0	0	0	114	N502 K503 H508 V509 D510	N502-S506 PolarHBondContact O-N 3.42Å; K503-S506 PolarHBondContact O-OG 2.73Å; S506-H508 VanDerWaalsContact C-N 3.29Å; S506-H508 PolarHBondContact O-N 3.12Å; S506-V509 PolarHBondContact O-N 3.44Å; S506-D510 WeakPolarHBondContact O-CB 3.48Å; S506-D510 PolarHBondContact O-N 3.05Å
507	S	83	Confident	73.2	Confident	73 Å²	73	85 Å²	85	51%	0.51	44%	0.438	S	S	.	.	H	α-helix	trans	-62.5	-33.2	179.4	59.5	0	0	0	0	113.8	Y505 F511	Y505-S507 PolarHBondContact O-N 2.83Å; S507-F511 WeakPolarHBondContact O-CB 3.41Å; S507-F511 PolarHBondContact O-N 3.47Å
508	H	87.9	Confident	75.3	Confident	80 Å²	80	80.9 Å²	80.9	37%	0.37	42%	0.415	S	S	.	.	H	α-helix	trans	-76.5	-39	179.6	-64.5	93.7	0	0	0	111.3	Y505 S506 F511 A512 F579 L583	Y505-H508 WeakPolarHBondContact O-CB 3.48Å; Y505-H508 PolarHBondContact O-N 2.94Å; S506-H508 VanDerWaalsContact C-N 3.29Å; S506-H508 PolarHBondContact O-N 3.12Å; H508-F511 PolarHBondContact O-N 3.45Å; H508-A512 WeakPolarHBondContact O-CB 3.29Å; H508-A512 PolarHBondContact O-N 2.84Å; H508-F579 HydrophobicContact CB-CE2 3.88Å; H508-F579 HydrophobicContact CB-CZ 3.69Å; H508-L583 HydrophobicContact CB-CD2 4.2Å; H508-L583 WeakPolarHBondContact CD2-CD2 3.46Å
509	V	84.9	Confident	77.5	Confident	15 Å²	15	76 Å²	76	9%	0.091	38%	0.381	C	S	.	.	H	α-helix	trans	-65.7	-42.1	173	173.5	0	0	0	0	110.5	Y505 S506 F511 A512 T513 F555 F574 F579	Y505-V509 WeakPolarHBondContact O-CG2 3.29Å; Y505-V509 PolarHBondContact O-N 3.39Å; S506-V509 PolarHBondContact O-N 3.44Å; V509-F511 VanDerWaalsContact C-N 3.34Å; V509-F511 PolarHBondContact O-N 2.88Å; V509-A512 PolarHBondContact O-N 3.3Å; V509-T513 WeakPolarHBondContact O-CB 3.46Å; V509-T513 PolarHBondContact O-N 3.21Å; V509-T513 PolarHBondContact O-OG1 2.67Å; V509-F555 HydrophobicContact CG1-CB 4Å; V509-F574 HydrophobicContact CG2-CB 4.44Å; V509-F579 HydrophobicContact CG2-CE2 4.33Å; V509-F579 HydrophobicContact CG2-CZ 4.04Å
510	D	82.6	Confident	79	Confident	106 Å²	106	75.9 Å²	75.9	57%	0.567	38%	0.375	S	S	*	.	H	α-helix	trans	-61.5	-43.2	175.5	-69.8	-18.7	0	0	0	111.2	S506 T513 K514	S506-D510 WeakPolarHBondContact O-CB 3.48Å; S506-D510 PolarHBondContact O-N 3.05Å; D510-T513 PolarHBondContact O-N 3.45Å; D510-K514 WeakPolarHBondContact O-CB 3.38Å; D510-K514 PolarHBondContact O-N 2.9Å
511	F	89.7	Confident	80.4	Confident	121 Å²	121	72.9 Å²	72.9	53%	0.531	36%	0.36	S	S	.	.	H	α-helix	trans	-61.1	-51	174.2	176.6	-99	0	0	0	111.9	S507 H508 V509 T513 K514 M515 I550	S507-F511 WeakPolarHBondContact O-CB 3.41Å; S507-F511 PolarHBondContact O-N 3.47Å; H508-F511 PolarHBondContact O-N 3.45Å; V509-F511 VanDerWaalsContact C-N 3.34Å; V509-F511 PolarHBondContact O-N 2.88Å; F511-T513 PolarHBondContact O-N 2.61Å; F511-K514 PolarHBondContact O-N 3.19Å; F511-M515 HydrophobicContact CD1-CG 4.26Å; F511-M515 HydrophobicContact CD2-CG 4.35Å; F511-M515 HydrophobicContact CE1-CG 3.88Å; F511-M515 HydrophobicContact CE2-CG 3.96Å; F511-M515 HydrophobicContact CE2-SD 4.22Å; F511-M515 HydrophobicContact CG-CG 4.49Å; F511-M515 HydrophobicContact CZ-CG 3.71Å; F511-M515 HydrophobicContact CZ-SD 4.18Å; F511-M515 VanDerWaalsContact O-CG 3.3Å; F511-M515 WeakPolarHBondContact O-CG 3.43Å; F511-M515 PolarHBondContact O-N 3.39Å; F511-I550 HydrophobicContact CE1-CG2 3.95Å; F511-I550 HydrophobicContact CZ-CG2 4.41Å
512	A	88.5	Confident	82	Confident	2 Å²	2	67.7 Å²	67.7	2%	0.017	33%	0.328	C	S	.	.	H	α-helix	trans	-59.1	-37.8	177.9	0	0	0	0	0	112	H508 V509 M515 S516 S552	H508-A512 WeakPolarHBondContact O-CB 3.29Å; H508-A512 PolarHBondContact O-N 2.84Å; V509-A512 PolarHBondContact O-N 3.3Å; A512-M515 PolarHBondContact O-N 3.32Å; A512-S516 WeakPolarHBondContact O-CB 3.29Å; A512-S516 PolarHBondContact O-N 2.83Å; A512-S552 WeakPolarHBondContact CB-O 3.43Å
513	T	85.1	Confident	83	Confident	23 Å²	23	65.7 Å²	65.7	14%	0.141	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-50.1	175.8	-52.7	0	0	0	0	111.7	V509 D510 F511 M515 S516 E517 F555	V509-T513 WeakPolarHBondContact O-CB 3.46Å; V509-T513 PolarHBondContact O-N 3.21Å; V509-T513 PolarHBondContact O-OG1 2.67Å; D510-T513 PolarHBondContact O-N 3.45Å; F511-T513 PolarHBondContact O-N 2.61Å; T513-M515 VanDerWaalsContact C-N 3.28Å; T513-M515 PolarHBondContact O-N 2.94Å; T513-S516 WeakPolarHBondContact O-CB 3.48Å; T513-S516 PolarHBondContact O-N 3.38Å; T513-S516 VanDerWaalsContact O-N 3.15Å; T513-E517 WeakPolarHBondContact O-CG 3.27Å; T513-E517 PolarHBondContact O-N 3.25Å; T513-F555 HydrophobicContact CG2-CB 4.36Å; T513-F555 WeakPolarHBondContact OG1-CB 3.45Å; T513-F555 PolarHBondContact OG1-N 3.02Å
514	K	87.3	Confident	83.1	Confident	147 Å²	147	57.2 Å²	57.2	64%	0.639	28%	0.282	S	S	*	.	H	α-helix	trans	-60.1	-38.6	176.1	-173.4	177.1	-178.6	179.5	0	112.2	D510 F511 E517 L518	D510-K514 WeakPolarHBondContact O-CB 3.38Å; D510-K514 PolarHBondContact O-N 2.9Å; F511-K514 PolarHBondContact O-N 3.19Å; K514-E517 PolarHBondContact O-N 2.72Å; K514-L518 WeakPolarHBondContact O-CB 3.14Å; K514-L518 PolarHBondContact O-N 3.41Å
515	M	90	Very high	82.3	Confident	41 Å²	41	55.2 Å²	55.2	20%	0.202	27%	0.274	C	S	.	.	H	α-helix	trans	-70.5	-34.7	177.4	-68.9	-56.3	-60.4	0	0	112.5	F511 A512 T513 L518 T519 I550 V551	F511-M515 HydrophobicContact CD1-CG 4.26Å; F511-M515 HydrophobicContact CD2-CG 4.35Å; F511-M515 HydrophobicContact CE1-CG 3.88Å; F511-M515 HydrophobicContact CE2-CG 3.96Å; F511-M515 HydrophobicContact CE2-SD 4.22Å; F511-M515 HydrophobicContact CG-CG 4.49Å; F511-M515 HydrophobicContact CZ-CG 3.71Å; F511-M515 HydrophobicContact CZ-SD 4.18Å; F511-M515 VanDerWaalsContact O-CG 3.3Å; F511-M515 WeakPolarHBondContact O-CG 3.43Å; F511-M515 PolarHBondContact O-N 3.39Å; A512-M515 PolarHBondContact O-N 3.32Å; T513-M515 VanDerWaalsContact C-N 3.28Å; T513-M515 PolarHBondContact O-N 2.94Å; M515-L518 HydrophobicContact CE-CD2 4.23Å; M515-L518 PolarHBondContact O-N 3.01Å; M515-L518 HydrophobicContact SD-CD2 4.18Å; M515-T519 WeakPolarHBondContact O-CB 3.43Å; M515-T519 PolarHBondContact O-N 2.9Å; M515-T519 PolarHBondContact O-OG1 3.13Å; M515-I550 HydrophobicContact CB-CG2 3.52Å; M515-I550 HydrophobicContact CE-CG2 3.96Å; M515-I550 HydrophobicContact CG-CG2 3.5Å; M515-I550 VanDerWaalsContact CG-CG2 3.5Å; M515-V551 HydrophobicContact CB-CG1 4.28Å
516	S	86.5	Confident	80.7	Confident	13 Å²	13	58.8 Å²	58.8	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-45.9	172.4	-174.7	0	0	0	0	111.3	A512 T513 T519 R520	A512-S516 WeakPolarHBondContact O-CB 3.29Å; A512-S516 PolarHBondContact O-N 2.83Å; T513-S516 WeakPolarHBondContact O-CB 3.48Å; T513-S516 PolarHBondContact O-N 3.38Å; T513-S516 VanDerWaalsContact O-N 3.15Å; S516-T519 PolarHBondContact O-N 2.69Å; S516-R520 PolarHBondContact O-N 3.12Å
517	E	82.2	Confident	79.1	Confident	93 Å²	93	58.9 Å²	58.9	44%	0.435	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-47	174.6	-68.1	174.2	173	0	0	111.9	T513 K514 T519 R520 D521	T513-E517 WeakPolarHBondContact O-CG 3.27Å; T513-E517 PolarHBondContact O-N 3.25Å; K514-E517 PolarHBondContact O-N 2.72Å; E517-T519 VanDerWaalsContact C-N 3.33Å; E517-T519 PolarHBondContact O-N 3.02Å; E517-R520 WeakPolarHBondContact O-CB 3.5Å; E517-R520 PolarHBondContact O-N 2.96Å; E517-D521 VanDerWaalsContact O-CG 3.27Å; E517-D521 PolarHBondContact O-N 3.35Å
518	L	85.3	Confident	77.1	Confident	65 Å²	65	59.6 Å²	59.6	34%	0.34	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-42	178.2	-178.7	61.5	0	0	0	111.9	K514 M515 R520 D521 I522	K514-L518 WeakPolarHBondContact O-CB 3.14Å; K514-L518 PolarHBondContact O-N 3.41Å; M515-L518 HydrophobicContact CE-CD2 4.23Å; M515-L518 PolarHBondContact O-N 3.01Å; M515-L518 HydrophobicContact SD-CD2 4.18Å; L518-R520 VanDerWaalsContact C-N 3.34Å; L518-R520 PolarHBondContact O-N 3.33Å; L518-D521 PolarHBondContact O-N 3.09Å; L518-I522 HydrophobicContact CD1-CD1 3.82Å; L518-I522 HydrophobicContact CD1-CG1 4.24Å; L518-I522 HydrophobicContact CD2-CD1 4.43Å; L518-I522 HydrophobicContact CG-CD1 3.69Å; L518-I522 WeakPolarHBondContact O-CD1 2.97Å; L518-I522 VanDerWaalsContact O-CG1 3.28Å; L518-I522 WeakPolarHBondContact O-CG1 3.42Å; L518-I522 PolarHBondContact O-N 2.93Å
519	T	86.8	Confident	75.5	Confident	12 Å²	12	56.9 Å²	56.9	7%	0.074	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-44.7	176.6	-59.1	0	0	0	0	111	M515 S516 E517 D521 I522 H523 A531 L534 V547	M515-T519 WeakPolarHBondContact O-CB 3.43Å; M515-T519 PolarHBondContact O-N 2.9Å; M515-T519 PolarHBondContact O-OG1 3.13Å; S516-T519 PolarHBondContact O-N 2.69Å; E517-T519 VanDerWaalsContact C-N 3.33Å; E517-T519 PolarHBondContact O-N 3.02Å; T519-D521 VanDerWaalsContact C-N 3.32Å; T519-D521 PolarHBondContact O-N 3.35Å; T519-I522 PolarHBondContact O-N 2.99Å; T519-H523 PolarHBondContact O-N 2.65Å; T519-A531 HydrophobicContact CG2-CB 4.37Å; T519-L534 HydrophobicContact CG2-CD1 4.39Å; T519-V547 HydrophobicContact CG2-CG1 3.59Å
520	R	80.1	Confident	74.4	Confident	116 Å²	116	57.3 Å²	57.3	44%	0.438	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-42.9	175.3	178.2	-177.7	66.5	-157.5	-4.5	111.4	S516 E517 L518 I522 G524 L529	S516-R520 PolarHBondContact O-N 3.12Å; E517-R520 WeakPolarHBondContact O-CB 3.5Å; E517-R520 PolarHBondContact O-N 2.96Å; L518-R520 VanDerWaalsContact C-N 3.34Å; L518-R520 PolarHBondContact O-N 3.33Å; R520-I522 VanDerWaalsContact C-N 3.35Å; R520-I522 PolarHBondContact O-N 2.93Å; R520-G524 WeakPolarHBondContact O-CA 3.31Å; R520-G524 PolarHBondContact O-N 2.95Å; R520-L529 WeakPolarHBondContact CA-O 3.45Å; R520-L529 WeakPolarHBondContact CB-O 3.25Å; R520-L529 WeakPolarHBondContact CG-O 3.13Å
521	D	79.7	Confident	73.4	Confident	29 Å²	29	52.5 Å²	52.5	16%	0.155	27%	0.267	C	S	.	.	H	α-helix	trans	-67	-35.8	-179.5	-71.1	0.8	0	0	0	112.3	E517 L518 T519 V989 R1009 K1012	E517-D521 VanDerWaalsContact O-CG 3.27Å; E517-D521 PolarHBondContact O-N 3.35Å; L518-D521 PolarHBondContact O-N 3.09Å; T519-D521 VanDerWaalsContact C-N 3.32Å; T519-D521 PolarHBondContact O-N 3.35Å; D521-V989 HydrophobicContact CB-CG1 3.83Å; D521-V989 WeakPolarHBondContact OD1-CG1 3.29Å; D521-R1009 WeakPolarHBondContact O-CD 3.27Å; D521-R1009 VanDerWaalsContact O-CG 3.29Å; D521-R1009 WeakPolarHBondContact O-CG 3.45Å; D521-R1009 PolarHBondContact O-NE 3.36Å; D521-K1012 HydrophobicContact CB-CD 3.89Å; D521-K1012 IonicContact OD2-NZ 3.41Å; D521-K1012 PolarHBondContact OD2-NZ 3.44Å
522	I	83.8	Confident	72.5	Confident	11 Å²	11	47.9 Å²	47.9	6%	0.056	25%	0.246	C	C	.	.	H	α-helix	trans	-77.5	-55.9	178.6	-65.1	160	0	0	0	110.6	L518 T519 R520 R1009 K1012 W1013	L518-I522 HydrophobicContact CD1-CD1 3.82Å; L518-I522 HydrophobicContact CD1-CG1 4.24Å; L518-I522 HydrophobicContact CD2-CD1 4.43Å; L518-I522 HydrophobicContact CG-CD1 3.69Å; L518-I522 WeakPolarHBondContact O-CD1 2.97Å; L518-I522 VanDerWaalsContact O-CG1 3.28Å; L518-I522 WeakPolarHBondContact O-CG1 3.42Å; L518-I522 PolarHBondContact O-N 2.93Å; T519-I522 PolarHBondContact O-N 2.99Å; R520-I522 VanDerWaalsContact C-N 3.35Å; R520-I522 PolarHBondContact O-N 2.93Å; I522-R1009 PolarHBondContact O-NE 3.42Å; I522-R1009 PolarHBondContact O-NH2 3.02Å; I522-K1012 HydrophobicContact CG1-CB 4.26Å; I522-W1013 HydrophobicContact CG2-CB 4.43Å
523	H	81.9	Confident	71.8	Confident	15 Å²	15	53 Å²	53	7%	0.069	27%	0.266	C	S	.	.	H	α-helix	trans	-101.7	-9.7	-167.2	-64.5	-65	0	0	0	114.7	T519 L534 R1009 T1032	T519-H523 PolarHBondContact O-N 2.65Å; H523-L534 HydrophobicContact CB-CD2 3.43Å; H523-L534 VanDerWaalsContact CB-CD2 3.43Å; H523-R1009 PolarHBondContact O-NH2 2.95Å; H523-T1032 PolarHBondContact ND1-OG1 2.97Å
524	G	67.8	Low	71.7	Confident	6 Å²	6	52.3 Å²	52.3	6%	0.062	26%	0.261	C	S	.	.			trans	-82	125.7	-173.3	0	0	0	0	0	119	R520 R1009	R520-G524 WeakPolarHBondContact O-CA 3.31Å; R520-G524 PolarHBondContact O-N 2.95Å; G524-R1009 VanDerWaalsContact C-CZ 3.42Å; G524-R1009 VanDerWaalsContact C-NH2 3.33Å; G524-R1009 PolarHBondContact O-NE 2.83Å; G524-R1009 PolarHBondContact O-NH1 3.3Å; G524-R1009 PolarHBondContact O-NH2 3.36Å; G524-R1009 VanDerWaalsContact O-NH2 3.11Å
525	E	60.1	Low	71.5	Confident	102 Å²	102	47.6 Å²	47.6	48%	0.477	25%	0.245	S	C	.	.			trans	-51.4	159.5	167.1	-79.8	-179.9	-171.8	0	0	113	S527 C528 L529	E525-S527 CarbonylContact O-C 3.28Å; E525-S527 VanDerWaalsContact O-C 3.32Å; E525-S527 PolarHBondContact O-N 2.76Å; E525-C528 PolarHBondContact O-N 3.28Å; E525-C528 VanDerWaalsContact O-N 3.1Å; E525-L529 HydrophobicContact CB-CD1 3.93Å; E525-L529 HydrophobicContact CB-CD2 4.38Å; E525-L529 HydrophobicContact CB-CG 4.04Å; E525-L529 HydrophobicContact CG-CD1 3.86Å; E525-L529 HydrophobicContact CG-CG 4.49Å; E525-L529 VanDerWaalsContact N-CG 3.34Å
526	L	48.1	Very low	71.4	Confident	118 Å²	118	47.7 Å²	47.7	62%	0.618	25%	0.247	S	C	*	.	S	Bend	trans	-51.1	-12.8	175.9	-87	109.9	0	0	0	114.2	E985 P987	L526-E985 VanDerWaalsContact CD1-CD 3.49Å; L526-E985 HydrophobicContact CD1-CG 3.86Å; L526-E985 VanDerWaalsContact CD1-OE1 3.26Å; L526-E985 WeakPolarHBondContact CD1-OE1 3.43Å; L526-P987 HydrophobicContact CD1-CG 4.42Å; L526-P987 HydrophobicContact CD2-CB 4.31Å; L526-P987 HydrophobicContact CG-CB 4.21Å; L526-P987 HydrophobicContact CG-CG 4.29Å
527	S	39.1	Very low	71.6	Confident	48 Å²	48	50.3 Å²	50.3	34%	0.336	26%	0.259	S	S	.	.	S	Bend	trans	-118.4	79.7	165.3	55.5	0	0	0	0	111.2	E525	E525-S527 CarbonylContact O-C 3.28Å; E525-S527 VanDerWaalsContact O-C 3.32Å; E525-S527 PolarHBondContact O-N 2.76Å
528	C	42.5	Very low	72.1	Confident	88 Å²	88	46.2 Å²	46.2	60%	0.595	24%	0.243	S	C	*	.			trans	48	83.4	155.4	-46.7	0	0	0	0	116.1	E525	E525-C528 PolarHBondContact O-N 3.28Å; E525-C528 VanDerWaalsContact O-N 3.1Å
529	L	54.6	Low	72.5	Confident	24 Å²	24	45.4 Å²	45.4	13%	0.126	24%	0.235	C	C	.	.			trans	-96.5	109.9	164.4	-47.1	173.8	0	0	0	111.1	R520 E525 Y533	R520-L529 WeakPolarHBondContact CA-O 3.45Å; R520-L529 WeakPolarHBondContact CB-O 3.25Å; R520-L529 WeakPolarHBondContact CG-O 3.13Å; E525-L529 HydrophobicContact CB-CD1 3.93Å; E525-L529 HydrophobicContact CB-CD2 4.38Å; E525-L529 HydrophobicContact CB-CG 4.04Å; E525-L529 HydrophobicContact CG-CD1 3.86Å; E525-L529 HydrophobicContact CG-CG 4.49Å; E525-L529 VanDerWaalsContact N-CG 3.34Å; L529-Y533 HydrophobicContact CB-CD2 4.25Å; L529-Y533 HydrophobicContact CD2-CD1 4.37Å; L529-Y533 HydrophobicContact CD2-CD2 3.91Å; L529-Y533 HydrophobicContact CD2-CG 3.65Å
530	S	60.9	Low	72.9	Confident	23 Å²	23	45.1 Å²	45.1	16%	0.161	23%	0.233	C	C	.	.			trans	-62	162.1	151.2	175	0	0	0	0	109.9	R532 Y533	S530-R532 PolarHBondContact O-N 3.13Å; S530-R532 PolarHBondContact OG-NE 3.43Å; S530-Y533 PolarHBondContact O-N 3.07Å
531	A	61.4	Low	73.6	Confident	5 Å²	5	39.6 Å²	39.6	4%	0.041	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-50.1	-20.1	173	0	0	0	0	0	113.7	T519 Y533 L534 V547 V551	T519-A531 HydrophobicContact CG2-CB 4.37Å; A531-Y533 PolarHBondContact O-N 3.41Å; A531-L534 HydrophobicContact CB-CD1 4.28Å; A531-L534 VanDerWaalsContact O-CG 3.29Å; A531-L534 WeakPolarHBondContact O-CG 3.37Å; A531-L534 PolarHBondContact O-N 3.37Å; A531-V547 HydrophobicContact CB-CG1 3.84Å; A531-V551 HydrophobicContact CB-CG2 3.99Å
532	R	71.8	Confident	74.3	Confident	24 Å²	24	38.2 Å²	38.2	9%	0.091	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-64.3	-19.6	177.6	-60.7	171.6	-160.5	157.6	4.4	115.7	F472 Q475 T476 D479 S530 Y554	F472-R532 HydrophobicContact CB-CB 3.97Å; F472-R532 HydrophobicContact CB-CG 4.17Å; F472-R532 HydrophobicContact CD1-CG 4.19Å; F472-R532 WeakPolarHBondContact CD2-O 3.48Å; F472-R532 HydrophobicContact CG-CB 4.14Å; F472-R532 HydrophobicContact CG-CG 4.25Å; Q475-R532 VanDerWaalsContact CB-NE 3.29Å; Q475-R532 PolarHBondContact O-NH1 3.26Å; Q475-R532 VanDerWaalsContact O-NH1 3.15Å; T476-R532 WeakPolarHBondContact OG1-CD 3.38Å; D479-R532 IonicContact OD2-CZ 3.74Å; D479-R532 IonicContact OD2-NH1 3.7Å; D479-R532 PolarHBondContact OD2-NH1 3.38Å; D479-R532 IonicContact OD2-NH2 2.96Å; D479-R532 PolarHBondContact OD2-NH2 3.11Å; S530-R532 PolarHBondContact O-N 3.13Å; S530-R532 PolarHBondContact OG-NE 3.43Å; R532-Y554 PolarHBondContact NH2-OH 2.95Å
533	Y	73.7	Confident	74.8	Confident	110 Å²	110	37.8 Å²	37.8	43%	0.431	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-112	12.5	-179.2	-52.9	-86.7	0	0	0	112.4	T476 L529 S530 A531	T476-Y533 WeakPolarHBondContact CG2-OH 3.26Å; L529-Y533 HydrophobicContact CB-CD2 4.25Å; L529-Y533 HydrophobicContact CD2-CD1 4.37Å; L529-Y533 HydrophobicContact CD2-CD2 3.91Å; L529-Y533 HydrophobicContact CD2-CG 3.65Å; S530-Y533 PolarHBondContact O-N 3.07Å; A531-Y533 PolarHBondContact O-N 3.41Å
534	L	82.1	Confident	75.3	Confident	9 Å²	9	37.1 Å²	37.1	5%	0.047	20%	0.2	C	C	.	.	S	Bend	trans	-61.9	142.6	167.2	-62.6	175.3	0	0	0	108.5	T519 H523 A531 L536 V544 V547 L1028	T519-L534 HydrophobicContact CG2-CD1 4.39Å; H523-L534 HydrophobicContact CB-CD2 3.43Å; H523-L534 VanDerWaalsContact CB-CD2 3.43Å; A531-L534 HydrophobicContact CB-CD1 4.28Å; A531-L534 VanDerWaalsContact O-CG 3.29Å; A531-L534 WeakPolarHBondContact O-CG 3.37Å; A531-L534 PolarHBondContact O-N 3.37Å; L534-L536 PolarHBondContact O-N 2.86Å; L534-V544 HydrophobicContact CB-CG2 4.15Å; L534-V547 HydrophobicContact CD1-CB 4.23Å; L534-V547 HydrophobicContact CD1-CG1 3.92Å; L534-L1028 HydrophobicContact CB-CD1 4.31Å; L534-L1028 HydrophobicContact CD1-CD2 4.33Å; L534-L1028 HydrophobicContact CD2-CD1 4.24Å; L534-L1028 HydrophobicContact CD2-CD2 4.36Å
535	P	82.9	Confident	76.6	Confident	48 Å²	48	36.9 Å²	36.9	31%	0.312	20%	0.197	S	C	.	.			trans	-49.6	117.7	171.2	-25.4	32.6	0	0	0	109.7	T540 V544 L1028 A1031	P535-T540 PolarHBondContact O-OG1 3.11Å; P535-V544 WeakPolarHBondContact O-CG2 3.47Å; P535-L1028 HydrophobicContact CG-CD1 4.29Å; P535-A1031 HydrophobicContact CG-CB 4.24Å
536	L	88	Confident	78.2	Confident	43 Å²	43	33.9 Å²	33.9	23%	0.225	18%	0.182	C	C	.	.			trans	-106.8	89.3	-179.2	-177.9	66.6	0	0	0	108.3	C465 L468 E469 F472 L534 L541 V544	C465-L536 HydrophobicContact CB-CG 4.42Å; L468-L536 HydrophobicContact CB-CD1 4.05Å; L468-L536 HydrophobicContact CB-CD2 3.95Å; L468-L536 HydrophobicContact CD1-CD1 3.95Å; E469-L536 HydrophobicContact CB-CD2 3.75Å; F472-L536 HydrophobicContact CD2-CD2 4.33Å; F472-L536 HydrophobicContact CE2-CD1 4.43Å; F472-L536 HydrophobicContact CE2-CD2 4.31Å; L534-L536 PolarHBondContact O-N 2.86Å; L536-L541 HydrophobicContact CD1-CD2 3.59Å; L536-V544 HydrophobicContact CD1-CG1 3.92Å
537	D	90.5	Very high	80.3	Confident	67 Å²	67	28.6 Å²	28.6	36%	0.358	15%	0.154	S	C	.	.	S	Bend	trans	-136	164.9	172.5	64.4	48.6	0	0	0	110	Y539 T540 L541	D537-Y539 PolarHBondContact O-N 3.39Å; D537-Y539 WeakPolarHBondContact OD1-CA 3.38Å; D537-Y539 WeakPolarHBondContact OD1-CB 3.36Å; D537-Y539 PolarHBondContact OD1-N 3.11Å; D537-T540 VanDerWaalsContact CG-OG1 3.31Å; D537-T540 PolarHBondContact N-OG1 2.99Å; D537-T540 PolarHBondContact O-N 3.5Å; D537-T540 VanDerWaalsContact O-N 3.11Å; D537-T540 PolarHBondContact O-OG1 3.25Å; D537-T540 PolarHBondContact OD1-N 3.03Å; D537-T540 PolarHBondContact OD1-OG1 3.23Å; D537-L541 WeakPolarHBondContact O-CG 3.18Å; D537-L541 PolarHBondContact O-N 3.21Å
538	G	92.9	Very high	82.9	Confident	8 Å²	8	26.5 Å²	26.5	8%	0.082	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-28.7	-178.5	0	0	0	0	0	115.2	P456 Y598	P456-G538 VanDerWaalsContact O-CA 3.26Å; P456-G538 WeakPolarHBondContact O-CA 3.44Å; G538-Y598 VanDerWaalsContact C-OH 3.3Å; G538-Y598 WeakPolarHBondContact CA-OH 3.03Å; G538-Y598 WeakPolarHBondContact O-CE2 3.18Å; G538-Y598 PolarHBondContact O-OH 3.01Å
539	Y	94.9	Very high	85.3	Confident	48 Å²	48	22.4 Å²	22.4	19%	0.188	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-26.7	-176.9	-54.4	-81.8	0	0	0	112.3	P456 T457 D537 D909 V911 Q914 S1024	P456-Y539 HydrophobicContact CB-CD1 3.47Å; P456-Y539 VanDerWaalsContact CB-CD1 3.47Å; P456-Y539 HydrophobicContact CB-CE1 3.57Å; P456-Y539 HydrophobicContact CB-CG 4.01Å; P456-Y539 HydrophobicContact CG-CD1 3.76Å; P456-Y539 HydrophobicContact CG-CE1 3.88Å; T457-Y539 HydrophobicContact CG2-CE2 4.38Å; T457-Y539 WeakPolarHBondContact CG2-OH 3.49Å; D537-Y539 PolarHBondContact O-N 3.39Å; D537-Y539 WeakPolarHBondContact OD1-CA 3.38Å; D537-Y539 WeakPolarHBondContact OD1-CB 3.36Å; D537-Y539 PolarHBondContact OD1-N 3.11Å; Y539-D909 PolarHBondContact OH-OD1 2.91Å; Y539-V911 WeakPolarHBondContact O-CG1 3.48Å; Y539-Q914 HydrophobicContact CD1-CB 3.46Å; Y539-Q914 VanDerWaalsContact CD1-CB 3.46Å; Y539-Q914 HydrophobicContact CD1-CG 3.61Å; Y539-Q914 HydrophobicContact CD2-CG 4.05Å; Y539-Q914 HydrophobicContact CE1-CB 3.56Å; Y539-Q914 HydrophobicContact CE1-CG 3.81Å; Y539-Q914 HydrophobicContact CE2-CG 4.24Å; Y539-Q914 HydrophobicContact CG-CB 4.09Å; Y539-Q914 HydrophobicContact CG-CG 3.72Å; Y539-S1024 WeakPolarHBondContact O-CA 3.44Å; Y539-S1024 VanDerWaalsContact O-CB 3.24Å; Y539-S1024 WeakPolarHBondContact O-CB 3.39Å; Y539-S1024 PolarHBondContact O-OG 3.22Å
540	T	93.8	Very high	87.1	Confident	5 Å²	5	22 Å²	22	3%	0.031	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-14.6	178.7	50.1	0	0	0	0	113.5	P535 D537 T542 E543 V544 L1027	P535-T540 PolarHBondContact O-OG1 3.11Å; D537-T540 VanDerWaalsContact CG-OG1 3.31Å; D537-T540 PolarHBondContact N-OG1 2.99Å; D537-T540 PolarHBondContact O-N 3.5Å; D537-T540 VanDerWaalsContact O-N 3.11Å; D537-T540 PolarHBondContact O-OG1 3.25Å; D537-T540 PolarHBondContact OD1-N 3.03Å; D537-T540 PolarHBondContact OD1-OG1 3.23Å; T540-T542 PolarHBondContact O-N 2.83Å; T540-T542 VanDerWaalsContact O-N 3.16Å; T540-E543 PolarHBondContact O-N 3.45Å; T540-V544 PolarHBondContact O-N 3.39Å; T540-L1027 HydrophobicContact CG2-CB 4.41Å
541	L	94.2	Very high	88.5	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-49.4	-43.2	-172.7	-90.3	-177.5	0	0	0	115.7	A461 L464 L468 L536 D537 E543 V544 L545 Y598	A461-L541 HydrophobicContact CB-CD1 3.88Å; L464-L541 HydrophobicContact CB-CD1 3.67Å; L464-L541 HydrophobicContact CB-CD2 4.01Å; L464-L541 HydrophobicContact CD1-CD1 3.97Å; L464-L541 HydrophobicContact CG-CD1 4.48Å; L468-L541 HydrophobicContact CD1-CD2 3.78Å; L536-L541 HydrophobicContact CD1-CD2 3.59Å; D537-L541 WeakPolarHBondContact O-CG 3.18Å; D537-L541 PolarHBondContact O-N 3.21Å; L541-E543 VanDerWaalsContact C-N 3.27Å; L541-E543 PolarHBondContact O-N 2.94Å; L541-V544 PolarHBondContact O-N 3.42Å; L541-L545 WeakPolarHBondContact O-CB 3.23Å; L541-L545 PolarHBondContact O-N 3.43Å; L541-Y598 WeakPolarHBondContact CD1-OH 3.34Å
542	T	95.4	Very high	89.9	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-56.1	-44	179.7	-58.7	0	0	0	0	111.3	T540 R546 L592 E595 V597 T1022	T540-T542 PolarHBondContact O-N 2.83Å; T540-T542 VanDerWaalsContact O-N 3.16Å; T542-R546 WeakPolarHBondContact O-CB 3.37Å; T542-R546 PolarHBondContact O-N 3.06Å; T542-R546 VanDerWaalsContact O-N 3.16Å; T542-L592 HydrophobicContact CG2-CD2 4.05Å; T542-E595 VanDerWaalsContact CG2-O 3.29Å; T542-E595 WeakPolarHBondContact CG2-O 3.4Å; T542-V597 PolarHBondContact OG1-N 2.99Å; T542-V597 VanDerWaalsContact OG1-N 3.14Å; T542-T1022 HydrophobicContact CG2-CG2 4.45Å
543	E	93.5	Very high	90.5	Very high	3 Å²	3	20.1 Å²	20.1	1%	0.014	10%	0.099	C	C	.	.	H	α-helix	trans	-78.8	-40.7	-178.9	-176.2	70.6	160.6	0	0	111.9	T540 L541 L545 R546 V547 S1025 L1028	T540-E543 PolarHBondContact O-N 3.45Å; L541-E543 VanDerWaalsContact C-N 3.27Å; L541-E543 PolarHBondContact O-N 2.94Å; E543-L545 VanDerWaalsContact C-N 3.3Å; E543-L545 PolarHBondContact O-N 2.82Å; E543-R546 VanDerWaalsContact CD-NH2 3.3Å; E543-R546 WeakPolarHBondContact O-CB 3.45Å; E543-R546 PolarHBondContact O-N 3Å; E543-R546 IonicContact OE1-CZ 2.61Å; E543-R546 IonicContact OE1-NE 3.45Å; E543-R546 IonicContact OE1-NH2 2.67Å; E543-R546 PolarHBondContact OE1-NH2 3.33Å; E543-R546 IonicContact OE2-CZ 2.73Å; E543-R546 IonicContact OE2-NE 3.19Å; E543-R546 PolarHBondContact OE2-NE 2.66Å; E543-R546 IonicContact OE2-NH2 3.38Å; E543-R546 PolarHBondContact OE2-NH2 3.3Å; E543-V547 HydrophobicContact CG-CG2 4.43Å; E543-V547 WeakPolarHBondContact O-CG2 3.39Å; E543-V547 PolarHBondContact O-N 3.02Å; E543-S1025 VanDerWaalsContact CD-CB 3.48Å; E543-S1025 VanDerWaalsContact CD-OG 3.31Å; E543-S1025 PolarHBondContact OE1-OG 3.4Å; E543-L1028 HydrophobicContact CB-CD2 4.31Å; E543-L1028 HydrophobicContact CG-CB 4.32Å; E543-L1028 HydrophobicContact CG-CD2 3.52Å
544	V	93.5	Very high	91.1	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.006	8%	0.084	C	C	.	.	H	α-helix	trans	-60.9	-42.7	177.2	176.1	0	0	0	0	110.8	F472 L534 P535 L536 T540 L541 V547 Y548	F472-V544 HydrophobicContact CE2-CG1 4.06Å; F472-V544 HydrophobicContact CZ-CG1 4.02Å; L534-V544 HydrophobicContact CB-CG2 4.15Å; P535-V544 WeakPolarHBondContact O-CG2 3.47Å; L536-V544 HydrophobicContact CD1-CG1 3.92Å; T540-V544 PolarHBondContact O-N 3.39Å; L541-V544 PolarHBondContact O-N 3.42Å; V544-V547 PolarHBondContact O-N 3.03Å; V544-Y548 VanDerWaalsContact O-CB 3.3Å; V544-Y548 WeakPolarHBondContact O-CB 3.29Å; V544-Y548 PolarHBondContact O-N 3.2Å
545	L	94.5	Very high	91	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64	-44.1	175.9	-175	66.7	0	0	0	111.4	L468 L541 E543 V547 Y548 F549 L592 V597 V608	L468-L545 HydrophobicContact CD1-CD1 4.36Å; L541-L545 WeakPolarHBondContact O-CB 3.23Å; L541-L545 PolarHBondContact O-N 3.43Å; E543-L545 VanDerWaalsContact C-N 3.3Å; E543-L545 PolarHBondContact O-N 2.82Å; L545-V547 PolarHBondContact O-N 3.49Å; L545-Y548 HydrophobicContact CD1-CD1 4.48Å; L545-Y548 PolarHBondContact O-N 3.15Å; L545-F549 HydrophobicContact CD1-CD2 3.95Å; L545-F549 HydrophobicContact CD1-CE2 3.44Å; L545-F549 VanDerWaalsContact CD1-CE2 3.44Å; L545-F549 HydrophobicContact CD1-CZ 4.09Å; L545-F549 HydrophobicContact CD2-CE2 4.03Å; L545-F549 HydrophobicContact CG-CD2 3.8Å; L545-F549 HydrophobicContact CG-CE2 3.53Å; L545-F549 VanDerWaalsContact O-CD2 3.25Å; L545-F549 WeakPolarHBondContact O-CD2 3.23Å; L545-F549 PolarHBondContact O-N 3.43Å; L545-L592 HydrophobicContact CD2-CD1 4.22Å; L545-L592 HydrophobicContact CG-CD1 4.24Å; L545-V597 HydrophobicContact CD2-CG2 3.74Å; L545-V608 HydrophobicContact CD1-CG1 3.92Å; L545-V608 HydrophobicContact CD2-CG1 3.82Å; L545-V608 HydrophobicContact CD2-CG2 4.31Å
546	R	94	Very high	90.6	Very high	40 Å²	40	17.6 Å²	17.6	15%	0.151	9%	0.086	C	C	.	.	H	α-helix	trans	-59	-47.4	176.1	-169	-173.4	69.2	78.9	-1.9	111.5	T542 E543 I550 V589 L592	T542-R546 WeakPolarHBondContact O-CB 3.37Å; T542-R546 PolarHBondContact O-N 3.06Å; T542-R546 VanDerWaalsContact O-N 3.16Å; E543-R546 VanDerWaalsContact CD-NH2 3.3Å; E543-R546 WeakPolarHBondContact O-CB 3.45Å; E543-R546 PolarHBondContact O-N 3Å; E543-R546 IonicContact OE1-CZ 2.61Å; E543-R546 IonicContact OE1-NE 3.45Å; E543-R546 IonicContact OE1-NH2 2.67Å; E543-R546 PolarHBondContact OE1-NH2 3.33Å; E543-R546 IonicContact OE2-CZ 2.73Å; E543-R546 IonicContact OE2-NE 3.19Å; E543-R546 PolarHBondContact OE2-NE 2.66Å; E543-R546 IonicContact OE2-NH2 3.38Å; E543-R546 PolarHBondContact OE2-NH2 3.3Å; R546-I550 HydrophobicContact CG-CD1 3.98Å; R546-I550 WeakPolarHBondContact O-CD1 3.34Å; R546-I550 VanDerWaalsContact O-CG1 3.27Å; R546-I550 WeakPolarHBondContact O-CG1 3.45Å; R546-I550 PolarHBondContact O-N 3.27Å; R546-I550 VanDerWaalsContact O-N 3.12Å; R546-V589 HydrophobicContact CG-CG1 4.34Å; R546-L592 HydrophobicContact CB-CB 3.96Å; R546-L592 HydrophobicContact CB-CD1 4.14Å; R546-L592 HydrophobicContact CG-CB 3.88Å
547	V	92.2	Very high	89.9	Confident	7 Å²	7	16.8 Å²	16.8	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-62.6	-48.8	177.3	172	0	0	0	0	110.2	T519 A531 L534 E543 V544 L545 F549 I550 V551	T519-V547 HydrophobicContact CG2-CG1 3.59Å; A531-V547 HydrophobicContact CB-CG1 3.84Å; L534-V547 HydrophobicContact CD1-CB 4.23Å; L534-V547 HydrophobicContact CD1-CG1 3.92Å; E543-V547 HydrophobicContact CG-CG2 4.43Å; E543-V547 WeakPolarHBondContact O-CG2 3.39Å; E543-V547 PolarHBondContact O-N 3.02Å; V544-V547 PolarHBondContact O-N 3.03Å; L545-V547 PolarHBondContact O-N 3.49Å; V547-F549 VanDerWaalsContact C-N 3.34Å; V547-F549 PolarHBondContact O-N 3.07Å; V547-I550 PolarHBondContact O-N 2.83Å; V547-V551 HydrophobicContact CG1-CG1 4.19Å; V547-V551 WeakPolarHBondContact O-CG1 3.36Å; V547-V551 WeakPolarHBondContact O-CG2 3.44Å; V547-V551 PolarHBondContact O-N 3.45Å
548	Y	93.5	Very high	88.8	Confident	3 Å²	3	17.4 Å²	17.4	1%	0.012	10%	0.098	C	C	.	.	H	α-helix	trans	-53.2	-48.6	178.2	168.2	-106.2	0	0	0	112.3	L468 I471 F472 V544 L545 V551 S552 A578 L612 Q615	L468-Y548 HydrophobicContact CD2-CD1 3.94Å; L468-Y548 HydrophobicContact CD2-CD2 4.49Å; L468-Y548 HydrophobicContact CD2-CE1 4.25Å; L468-Y548 HydrophobicContact CD2-CG 4.05Å; I471-Y548 HydrophobicContact CG2-CE2 3.89Å; F472-Y548 AromaticContact CE1-CD2 3.68Å; F472-Y548 HydrophobicContact CE1-CD2 3.68Å; F472-Y548 HydrophobicContact CE1-CE2 4.26Å; F472-Y548 HydrophobicContact CE1-CG 4.31Å; F472-Y548 HydrophobicContact CZ-CD2 4.46Å; V544-Y548 VanDerWaalsContact O-CB 3.3Å; V544-Y548 WeakPolarHBondContact O-CB 3.29Å; V544-Y548 PolarHBondContact O-N 3.2Å; L545-Y548 HydrophobicContact CD1-CD1 4.48Å; L545-Y548 PolarHBondContact O-N 3.15Å; Y548-V551 PolarHBondContact O-N 3Å; Y548-S552 WeakPolarHBondContact O-CB 3.3Å; Y548-S552 PolarHBondContact O-N 3.32Å; Y548-S552 PolarHBondContact O-OG 3.25Å; Y548-A578 HydrophobicContact CD1-CB 4.49Å; Y548-A578 HydrophobicContact CE1-CB 3.55Å; Y548-L612 HydrophobicContact CD1-CD2 4.15Å; Y548-L612 HydrophobicContact CE1-CD2 3.47Å; Y548-L612 VanDerWaalsContact CE1-CD2 3.47Å; Y548-Q615 WeakPolarHBondContact OH-CG 3.49Å
549	F	94	Very high	87.5	Confident	2 Å²	2	21 Å²	21	1%	0.009	11%	0.111	C	C	.	.	H	α-helix	trans	-61.8	-46.4	177.7	-82.4	-54.3	0	0	0	112.3	L545 V547 V551 S552 A578 F581 V582 F588 V589 L592 V608 V611	L545-F549 HydrophobicContact CD1-CD2 3.95Å; L545-F549 HydrophobicContact CD1-CE2 3.44Å; L545-F549 VanDerWaalsContact CD1-CE2 3.44Å; L545-F549 HydrophobicContact CD1-CZ 4.09Å; L545-F549 HydrophobicContact CD2-CE2 4.03Å; L545-F549 HydrophobicContact CG-CD2 3.8Å; L545-F549 HydrophobicContact CG-CE2 3.53Å; L545-F549 VanDerWaalsContact O-CD2 3.25Å; L545-F549 WeakPolarHBondContact O-CD2 3.23Å; L545-F549 PolarHBondContact O-N 3.43Å; V547-F549 VanDerWaalsContact C-N 3.34Å; V547-F549 PolarHBondContact O-N 3.07Å; F549-V551 VanDerWaalsContact C-N 3.33Å; F549-V551 PolarHBondContact O-N 3.1Å; F549-S552 WeakPolarHBondContact O-CB 3.43Å; F549-S552 PolarHBondContact O-N 3.46Å; F549-A578 HydrophobicContact CD1-CB 3.86Å; F549-A578 HydrophobicContact CE1-CB 3.95Å; F549-F581 HydrophobicContact CD1-CD1 4.28Å; F549-F581 AromaticContact CE1-CD1 3.74Å; F549-F581 HydrophobicContact CE1-CD1 3.74Å; F549-F581 HydrophobicContact CE1-CE1 4.39Å; F549-F581 HydrophobicContact CZ-CD1 4.03Å; F549-F581 HydrophobicContact CZ-CE1 4.23Å; F549-V582 HydrophobicContact CB-CG2 3.64Å; F549-V582 HydrophobicContact CD1-CG2 3.9Å; F549-V582 HydrophobicContact CG-CG2 4.09Å; F549-F588 HydrophobicContact CD2-CE1 4.4Å; F549-F588 HydrophobicContact CE2-CD1 4.36Å; F549-F588 AromaticContact CE2-CE1 3.88Å; F549-F588 HydrophobicContact CE2-CE1 3.88Å; F549-V589 HydrophobicContact CB-CG2 4.07Å; F549-L592 HydrophobicContact CD2-CD1 4.23Å; F549-V608 HydrophobicContact CZ-CG1 4.42Å; F549-V611 HydrophobicContact CE1-CG1 3.95Å; F549-V611 HydrophobicContact CZ-CG1 4.5Å
550	I	91.6	Very high	86.3	Confident	15 Å²	15	20.3 Å²	20.3	8%	0.077	11%	0.111	C	C	.	.	H	α-helix	trans	-64.2	-37	-178.6	-70.4	168.4	0	0	0	112.4	F511 M515 R546 V547 V589	F511-I550 HydrophobicContact CE1-CG2 3.95Å; F511-I550 HydrophobicContact CZ-CG2 4.41Å; M515-I550 HydrophobicContact CB-CG2 3.52Å; M515-I550 HydrophobicContact CE-CG2 3.96Å; M515-I550 HydrophobicContact CG-CG2 3.5Å; M515-I550 VanDerWaalsContact CG-CG2 3.5Å; R546-I550 HydrophobicContact CG-CD1 3.98Å; R546-I550 WeakPolarHBondContact O-CD1 3.34Å; R546-I550 VanDerWaalsContact O-CG1 3.27Å; R546-I550 WeakPolarHBondContact O-CG1 3.45Å; R546-I550 PolarHBondContact O-N 3.27Å; R546-I550 VanDerWaalsContact O-N 3.12Å; V547-I550 PolarHBondContact O-N 2.83Å; I550-V589 HydrophobicContact CD1-CG1 3.64Å; I550-V589 HydrophobicContact CG1-CG1 3.44Å; I550-V589 VanDerWaalsContact CG1-CG1 3.44Å
551	V	90.2	Very high	85.2	Confident	9 Å²	9	21 Å²	21	6%	0.055	12%	0.117	C	C	.	.	H	α-helix	trans	-88.9	-7.4	-179.4	-52.3	0	0	0	0	113	M515 A531 V547 Y548 F549 G553 Y554	M515-V551 HydrophobicContact CB-CG1 4.28Å; A531-V551 HydrophobicContact CB-CG2 3.99Å; V547-V551 HydrophobicContact CG1-CG1 4.19Å; V547-V551 WeakPolarHBondContact O-CG1 3.36Å; V547-V551 WeakPolarHBondContact O-CG2 3.44Å; V547-V551 PolarHBondContact O-N 3.45Å; Y548-V551 PolarHBondContact O-N 3Å; F549-V551 VanDerWaalsContact C-N 3.33Å; F549-V551 PolarHBondContact O-N 3.1Å; V551-G553 PolarHBondContact O-N 3.15Å; V551-Y554 VanDerWaalsContact O-CB 3.31Å; V551-Y554 WeakPolarHBondContact O-CB 3.4Å; V551-Y554 VanDerWaalsContact O-CD1 3.25Å; V551-Y554 WeakPolarHBondContact O-CD1 3.33Å; V551-Y554 PolarHBondContact O-N 3.46Å; V551-Y554 VanDerWaalsContact O-N 3.16Å
552	S	89.8	Confident	84	Confident	5 Å²	5	23.1 Å²	23.1	4%	0.035	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	139.3	177.6	-71.6	0	0	0	0	110.1	A512 Y548 F549 Y554 A578 F579	A512-S552 WeakPolarHBondContact CB-O 3.43Å; Y548-S552 WeakPolarHBondContact O-CB 3.3Å; Y548-S552 PolarHBondContact O-N 3.32Å; Y548-S552 PolarHBondContact O-OG 3.25Å; F549-S552 WeakPolarHBondContact O-CB 3.43Å; F549-S552 PolarHBondContact O-N 3.46Å; S552-Y554 VanDerWaalsContact C-N 3.3Å; S552-Y554 PolarHBondContact O-N 3.46Å; S552-A578 WeakPolarHBondContact OG-CB 3.3Å; S552-F579 VanDerWaalsContact O-CD2 3.22Å; S552-F579 WeakPolarHBondContact O-CD2 3.34Å
553	G	85.8	Confident	82.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	6.8	-176	0	0	0	0	0	116.6	V551 C573 D576	V551-G553 PolarHBondContact O-N 3.15Å; G553-C573 VanDerWaalsContact CA-O 3.22Å; G553-C573 WeakPolarHBondContact CA-O 3.39Å; G553-C573 WeakPolarHBondContact O-CB 3.5Å; G553-C573 PolarHBondContact O-SG 3.33Å; G553-D576 PolarHBondContact N-OD2 3.37Å
554	Y	85.1	Confident	82	Confident	28 Å²	28	25.6 Å²	25.6	11%	0.11	14%	0.136	C	C	.	.			trans	-59	149.1	175	84.7	-83.2	0	0	0	113.2	D479 R532 V551 S552 T556	D479-Y554 PolarHBondContact OD2-OH 3.49Å; R532-Y554 PolarHBondContact NH2-OH 2.95Å; V551-Y554 VanDerWaalsContact O-CB 3.31Å; V551-Y554 WeakPolarHBondContact O-CB 3.4Å; V551-Y554 VanDerWaalsContact O-CD1 3.25Å; V551-Y554 WeakPolarHBondContact O-CD1 3.33Å; V551-Y554 PolarHBondContact O-N 3.46Å; V551-Y554 VanDerWaalsContact O-N 3.16Å; S552-Y554 VanDerWaalsContact C-N 3.3Å; S552-Y554 PolarHBondContact O-N 3.46Å; Y554-T556 HydrophobicContact CD2-CG2 4.14Å; Y554-T556 HydrophobicContact CE1-CG2 4.3Å; Y554-T556 HydrophobicContact CE2-CG2 3.34Å; Y554-T556 VanDerWaalsContact CZ-CG2 3.43Å; Y554-T556 WeakPolarHBondContact OH-CG2 3.48Å
555	F	80.8	Confident	81.3	Confident	62 Å²	62	29.1 Å²	29.1	27%	0.272	15%	0.149	S	C	.	.			trans	-82	119.2	179.6	-174.5	-117.1	0	0	0	111.1	I500 V509 T513 G557 A561	I500-F555 HydrophobicContact CD1-CE2 4.13Å; I500-F555 HydrophobicContact CD1-CZ 4.39Å; I500-F555 HydrophobicContact CG2-CD2 4.19Å; I500-F555 HydrophobicContact CG2-CE2 3.58Å; I500-F555 HydrophobicContact CG2-CZ 4.17Å; V509-F555 HydrophobicContact CG1-CB 4Å; T513-F555 HydrophobicContact CG2-CB 4.36Å; T513-F555 WeakPolarHBondContact OG1-CB 3.45Å; T513-F555 PolarHBondContact OG1-N 3.02Å; F555-G557 VanDerWaalsContact C-N 3.29Å; F555-G557 PolarHBondContact O-N 3Å; F555-A561 HydrophobicContact CD2-CB 4.13Å; F555-A561 HydrophobicContact CE2-CB 3.65Å
556	T	74.6	Confident	80.3	Confident	24 Å²	24	32 Å²	32	15%	0.147	16%	0.164	C	C	.	.			trans	-87.1	10.6	179.1	41.8	0	0	0	0	115	Y554 N560 A561	Y554-T556 HydrophobicContact CD2-CG2 4.14Å; Y554-T556 HydrophobicContact CE1-CG2 4.3Å; Y554-T556 HydrophobicContact CE2-CG2 3.34Å; Y554-T556 VanDerWaalsContact CZ-CG2 3.43Å; Y554-T556 WeakPolarHBondContact OH-CG2 3.48Å; T556-N560 VanDerWaalsContact OG1-CB 3.29Å; T556-N560 WeakPolarHBondContact OG1-CB 3.45Å; T556-A561 PolarHBondContact OG1-N 3.48Å
557	G	72.5	Confident	79.4	Confident	26 Å²	26	31.2 Å²	31.2	27%	0.268	17%	0.165	S	C	.	.			trans	87.2	157.2	-168.6	0	0	0	0	0	112.3	F555 K559 N560 A561	F555-G557 VanDerWaalsContact C-N 3.29Å; F555-G557 PolarHBondContact O-N 3Å; G557-K559 VanDerWaalsContact C-N 3.33Å; G557-K559 PolarHBondContact O-N 3Å; G557-N560 PolarHBondContact O-N 3.15Å; G557-A561 VanDerWaalsContact O-CB 3.28Å; G557-A561 WeakPolarHBondContact O-CB 3.49Å; G557-A561 PolarHBondContact O-N 3.24Å
558	S	67.4	Low	78.8	Confident	79 Å²	79	31 Å²	31	55%	0.552	16%	0.164	S	C	*	.	H	α-helix	trans	-62.1	-35.5	-169.5	-54.4	0	0	0	0	114.1	R562	S558-R562 VanDerWaalsContact O-CB 3.23Å; S558-R562 WeakPolarHBondContact O-CB 3.43Å; S558-R562 PolarHBondContact O-N 2.75Å
559	K	65.4	Low	77.9	Confident	84 Å²	84	33 Å²	33	37%	0.365	19%	0.186	S	C	.	.	H	α-helix	trans	-65	-52.7	178.1	-71	-172	172.8	-168.2	0	110.5	M488 E489 G557 R562 F563	M488-K559 HydrophobicContact SD-CB 4.23Å; E489-K559 IonicContact OE1-NZ 2.94Å; E489-K559 PolarHBondContact OE1-NZ 3.25Å; G557-K559 VanDerWaalsContact C-N 3.33Å; G557-K559 PolarHBondContact O-N 3Å; K559-R562 PolarHBondContact O-N 2.91Å; K559-F563 PolarHBondContact O-N 3.49Å
560	N	70.8	Confident	77.2	Confident	34 Å²	34	34.4 Å²	34.4	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-70	-40.4	-179	-71.1	-4.4	0	0	0	112.9	D479 M488 T556 G557 R562 F563 R564	D479-N560 PolarHBondContact O-ND2 2.97Å; M488-N560 PolarHBondContact SD-OD1 3.11Å; T556-N560 VanDerWaalsContact OG1-CB 3.29Å; T556-N560 WeakPolarHBondContact OG1-CB 3.45Å; G557-N560 PolarHBondContact O-N 3.15Å; N560-R562 PolarHBondContact O-N 2.95Å; N560-F563 PolarHBondContact O-N 3.04Å; N560-R564 WeakPolarHBondContact O-CB 3.38Å; N560-R564 WeakPolarHBondContact O-CG 3.36Å; N560-R564 PolarHBondContact O-N 3.45Å
561	A	71.5	Confident	76.6	Confident	20 Å²	20	36.6 Å²	36.6	17%	0.165	21%	0.209	C	C	.	.	H	α-helix	trans	-59.3	-38.6	176.6	0	0	0	0	0	111.9	F555 T556 G557 Y565	F555-A561 HydrophobicContact CD2-CB 4.13Å; F555-A561 HydrophobicContact CE2-CB 3.65Å; T556-A561 PolarHBondContact OG1-N 3.48Å; G557-A561 VanDerWaalsContact O-CB 3.28Å; G557-A561 WeakPolarHBondContact O-CB 3.49Å; G557-A561 PolarHBondContact O-N 3.24Å; A561-Y565 WeakPolarHBondContact O-CB 3.11Å; A561-Y565 PolarHBondContact O-N 3.25Å
562	R	67.7	Low	76.2	Confident	44 Å²	44	38.4 Å²	38.4	17%	0.166	22%	0.216	C	C	.	.	H	α-helix	trans	-73.7	-37.3	177.1	-177.1	167.7	166.8	175.1	-7.4	112.8	A491 A492 L495 S558 K559 N560 L566	A491-R562 PolarHBondContact O-NE 3.3Å; A491-R562 VanDerWaalsContact O-NE 3.08Å; A491-R562 PolarHBondContact O-NH2 2.7Å; A492-R562 VanDerWaalsContact CA-CZ 3.41Å; A492-R562 PolarHBondContact O-NH1 2.76Å; A492-R562 PolarHBondContact O-NH2 2.73Å; L495-R562 VanDerWaalsContact CA-CZ 3.48Å; L495-R562 HydrophobicContact CB-CG 4.39Å; L495-R562 HydrophobicContact CD1-CG 4.11Å; L495-R562 PolarHBondContact O-NH1 3.13Å; L495-R562 PolarHBondContact O-NH2 3.24Å; S558-R562 VanDerWaalsContact O-CB 3.23Å; S558-R562 WeakPolarHBondContact O-CB 3.43Å; S558-R562 PolarHBondContact O-N 2.75Å; K559-R562 PolarHBondContact O-N 2.91Å; N560-R562 PolarHBondContact O-N 2.95Å; R562-L566 WeakPolarHBondContact O-CG 3.22Å; R562-L566 PolarHBondContact O-N 2.79Å; R562-L566 VanDerWaalsContact O-N 3.13Å
563	F	70.2	Confident	75.7	Confident	48 Å²	48	39.2 Å²	39.2	21%	0.211	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-49.9	170.9	-179.3	-90.5	0	0	0	111	E478 A491 K559 N560 Y565 L566 S567	E478-F563 HydrophobicContact CB-CE1 4.5Å; E478-F563 WeakPolarHBondContact O-CD1 3.42Å; E478-F563 WeakPolarHBondContact O-CE1 3.22Å; A491-F563 HydrophobicContact CB-CD2 4.43Å; K559-F563 PolarHBondContact O-N 3.49Å; N560-F563 PolarHBondContact O-N 3.04Å; F563-Y565 VanDerWaalsContact C-N 3.34Å; F563-Y565 PolarHBondContact O-N 2.92Å; F563-L566 CarbonylContact O-C 3.55Å; F563-L566 PolarHBondContact O-N 3.13Å; F563-L566 VanDerWaalsContact O-N 3.09Å; F563-S567 WeakPolarHBondContact O-CB 3.43Å; F563-S567 PolarHBondContact O-N 3.12Å; F563-S567 PolarHBondContact O-OG 2.96Å
564	R	77.7	Confident	75.6	Confident	7 Å²	7	40 Å²	40	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-55.1	-46.1	175.4	-74.7	-178.3	178.8	-173	-2.1	112.5	E478 D479 N560 L566 S567 R568	E478-R564 HydrophobicContact CB-CG 4.47Å; D479-R564 IonicContact OD1-CZ 3.63Å; D479-R564 IonicContact OD1-NE 3.84Å; D479-R564 PolarHBondContact OD1-NE 2.85Å; D479-R564 IonicContact OD1-NH2 2.87Å; D479-R564 PolarHBondContact OD1-NH2 3.25Å; D479-R564 IonicContact OD2-CZ 3.67Å; D479-R564 IonicContact OD2-NH2 2.86Å; D479-R564 PolarHBondContact OD2-NH2 3Å; N560-R564 WeakPolarHBondContact O-CB 3.38Å; N560-R564 WeakPolarHBondContact O-CG 3.36Å; N560-R564 PolarHBondContact O-N 3.45Å; R564-L566 VanDerWaalsContact C-N 3.29Å; R564-L566 PolarHBondContact O-N 3.23Å; R564-S567 WeakPolarHBondContact CA-OG 3.21Å; R564-S567 PolarHBondContact O-N 2.86Å; R564-S567 PolarHBondContact O-OG 2.79Å; R564-S567 VanDerWaalsContact O-OG 3.11Å; R564-R568 VanDerWaalsContact O-CB 3.25Å; R564-R568 WeakPolarHBondContact O-CB 3.39Å; R564-R568 WeakPolarHBondContact O-CG 3.38Å; R564-R568 PolarHBondContact O-N 3.41Å
565	Y	78	Confident	75.7	Confident	74 Å²	74	41 Å²	41	29%	0.29	23%	0.233	S	C	.	.	H	α-helix	trans	-57.4	-43.1	176.7	176.6	-100.9	0	0	0	112.3	L495 A561 F563 G569 G570 F571 K572	L495-Y565 HydrophobicContact CD1-CD1 4.05Å; L495-Y565 HydrophobicContact CD1-CE1 4.3Å; A561-Y565 WeakPolarHBondContact O-CB 3.11Å; A561-Y565 PolarHBondContact O-N 3.25Å; F563-Y565 VanDerWaalsContact C-N 3.34Å; F563-Y565 PolarHBondContact O-N 2.92Å; Y565-G569 PolarHBondContact O-N 2.92Å; Y565-G570 WeakPolarHBondContact CD2-O 3.28Å; Y565-G570 WeakPolarHBondContact CE2-O 2.99Å; Y565-G570 PolarHBondContact O-N 3.34Å; Y565-F571 WeakPolarHBondContact CA-O 3.36Å; Y565-K572 HydrophobicContact CD2-CG 3.66Å; Y565-K572 HydrophobicContact CE2-CG 4.07Å
566	L	73.8	Confident	76.1	Confident	60 Å²	60	38.1 Å²	38.1	31%	0.314	22%	0.22	S	C	.	.	H	α-helix	trans	-72.1	-46.2	177.7	-73.8	176.9	0	0	0	113	A491 L495 R562 F563 R564 G569	A491-L566 HydrophobicContact CB-CD1 4.18Å; L495-L566 HydrophobicContact CD1-CD1 3.88Å; L495-L566 HydrophobicContact CD1-CD2 3.45Å; L495-L566 VanDerWaalsContact CD1-CD2 3.45Å; L495-L566 HydrophobicContact CD1-CG 3.61Å; R562-L566 WeakPolarHBondContact O-CG 3.22Å; R562-L566 PolarHBondContact O-N 2.79Å; R562-L566 VanDerWaalsContact O-N 3.13Å; F563-L566 CarbonylContact O-C 3.55Å; F563-L566 PolarHBondContact O-N 3.13Å; F563-L566 VanDerWaalsContact O-N 3.09Å; R564-L566 VanDerWaalsContact C-N 3.29Å; R564-L566 PolarHBondContact O-N 3.23Å; L566-G569 PolarHBondContact O-N 2.86Å
567	S	74.3	Confident	77	Confident	25 Å²	25	40.2 Å²	40.2	18%	0.175	23%	0.228	C	C	.	.	H	α-helix	trans	-63.5	-47.2	-178.7	66.6	0	0	0	0	109.9	E478 F563 R564 G569 T620	E478-S567 PolarHBondContact OE1-OG 3.27Å; F563-S567 WeakPolarHBondContact O-CB 3.43Å; F563-S567 PolarHBondContact O-N 3.12Å; F563-S567 PolarHBondContact O-OG 2.96Å; R564-S567 WeakPolarHBondContact CA-OG 3.21Å; R564-S567 PolarHBondContact O-N 2.86Å; R564-S567 PolarHBondContact O-OG 2.79Å; R564-S567 VanDerWaalsContact O-OG 3.11Å; S567-G569 PolarHBondContact O-N 2.9Å; S567-G569 VanDerWaalsContact O-N 3.16Å; S567-T620 WeakPolarHBondContact O-CB 3.34Å; S567-T620 WeakPolarHBondContact O-CG2 3.34Å; S567-T620 PolarHBondContact O-OG1 2.92Å
568	R	79.5	Confident	78	Confident	2 Å²	2	39 Å²	39	1%	0.008	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	9.6	-179.2	-60.1	-170.8	-179.7	176.7	2.5	113.7	E478 R564 G570 F571 D576 R623	E478-R568 VanDerWaalsContact CD-NE 3.34Å; E478-R568 WeakPolarHBondContact OE1-CG 3.35Å; E478-R568 IonicContact OE1-NE 3.62Å; E478-R568 PolarHBondContact OE1-NE 3.38Å; E478-R568 VanDerWaalsContact OE1-NE 3.16Å; E478-R568 IonicContact OE2-CZ 3.69Å; E478-R568 IonicContact OE2-NE 3.12Å; E478-R568 PolarHBondContact OE2-NE 3.43Å; E478-R568 IonicContact OE2-NH2 3.98Å; E478-R568 PolarHBondContact OE2-NH2 3Å; R564-R568 VanDerWaalsContact O-CB 3.25Å; R564-R568 WeakPolarHBondContact O-CB 3.39Å; R564-R568 WeakPolarHBondContact O-CG 3.38Å; R564-R568 PolarHBondContact O-N 3.41Å; R568-G570 PolarHBondContact O-N 2.99Å; R568-F571 HydrophobicContact CB-CB 3.82Å; R568-F571 HydrophobicContact CB-CD2 4.18Å; R568-F571 WeakPolarHBondContact O-CD2 3.27Å; R568-D576 IonicContact CZ-OD1 3.32Å; R568-D576 IonicContact NH1-OD1 2.71Å; R568-D576 PolarHBondContact NH1-OD1 3.31Å; R568-R623 PolarHBondContact O-NH1 3.1Å
569	G	75.4	Confident	79.2	Confident	46 Å²	46	35.7 Å²	35.7	47%	0.474	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	43.3	174.3	0	0	0	0	0	113.7	Y565 L566 S567 R623	Y565-G569 PolarHBondContact O-N 2.92Å; L566-G569 PolarHBondContact O-N 2.86Å; S567-G569 PolarHBondContact O-N 2.9Å; S567-G569 VanDerWaalsContact O-N 3.16Å; G569-R623 PolarHBondContact O-NH1 3.38Å
570	G	78.4	Confident	80.5	Confident	30 Å²	30	34.6 Å²	34.6	31%	0.309	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	107	-8.8	174.4	0	0	0	0	0	115.9	Y565 R568	Y565-G570 WeakPolarHBondContact CD2-O 3.28Å; Y565-G570 WeakPolarHBondContact CE2-O 2.99Å; Y565-G570 PolarHBondContact O-N 3.34Å; R568-G570 PolarHBondContact O-N 2.99Å
571	F	80.9	Confident	81.6	Confident	61 Å²	61	33.7 Å²	33.7	27%	0.268	18%	0.182	S	C	.	.			trans	-74	128.1	176.6	-69.3	-72.8	0	0	0	111.3	Y565 R568 D575 R623	Y565-F571 WeakPolarHBondContact CA-O 3.36Å; R568-F571 HydrophobicContact CB-CB 3.82Å; R568-F571 HydrophobicContact CB-CD2 4.18Å; R568-F571 WeakPolarHBondContact O-CD2 3.27Å; F571-D575 HydrophobicContact CB-CB 4.33Å; F571-D575 HydrophobicContact CD1-CB 3.74Å; F571-R623 VanDerWaalsContact CE2-NH1 3.32Å
572	K	81.3	Confident	82.6	Confident	47 Å²	47	34.3 Å²	34.3	20%	0.204	18%	0.184	C	C	.	.			trans	-94.2	172.2	174.2	-61.8	172.2	-176.3	173.7	0	110.3	E499 Y565 F574 D575	E499-K572 WeakPolarHBondContact OE2-CE 3.44Å; E499-K572 IonicContact OE2-NZ 2.75Å; E499-K572 PolarHBondContact OE2-NZ 3.17Å; Y565-K572 HydrophobicContact CD2-CG 3.66Å; Y565-K572 HydrophobicContact CE2-CG 4.07Å; K572-F574 VanDerWaalsContact C-N 3.27Å; K572-F574 HydrophobicContact CB-CD1 4.34Å; K572-F574 HydrophobicContact CB-CD2 4.3Å; K572-F574 HydrophobicContact CB-CE1 4.06Å; K572-F574 HydrophobicContact CB-CE2 4.02Å; K572-F574 HydrophobicContact CB-CG 4.48Å; K572-F574 HydrophobicContact CB-CZ 3.92Å; K572-F574 HydrophobicContact CD-CE1 3.84Å; K572-F574 HydrophobicContact CD-CE2 3.73Å; K572-F574 HydrophobicContact CD-CZ 3.19Å; K572-F574 HydrophobicContact CG-CE2 4.48Å; K572-F574 HydrophobicContact CG-CZ 4.19Å; K572-F574 PolarHBondContact O-N 2.98Å; K572-D575 WeakPolarHBondContact CB-OD2 3.33Å; K572-D575 PolarHBondContact N-OD2 3.35Å; K572-D575 WeakPolarHBondContact O-CB 3.44Å; K572-D575 PolarHBondContact O-N 3.49Å
573	C	78.8	Confident	83.7	Confident	23 Å²	23	34.8 Å²	34.8	16%	0.155	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-60.2	-36.7	179	63.5	0	0	0	0	112.5	G553 D575 D576	G553-C573 VanDerWaalsContact CA-O 3.22Å; G553-C573 WeakPolarHBondContact CA-O 3.39Å; G553-C573 WeakPolarHBondContact O-CB 3.5Å; G553-C573 PolarHBondContact O-SG 3.33Å; C573-D575 PolarHBondContact O-N 2.66Å; C573-D576 WeakPolarHBondContact O-CB 3.26Å; C573-D576 PolarHBondContact O-N 3.37Å
574	F	83.7	Confident	84.6	Confident	16 Å²	16	36.1 Å²	36.1	7%	0.07	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-77.2	-4.6	175.2	54.1	-107.2	0	0	0	113.9	N502 Y505 V509 K572 D576 F579 Q580	N502-F574 HydrophobicContact CB-CD1 4.43Å; N502-F574 HydrophobicContact CB-CE1 3.84Å; N502-F574 HydrophobicContact CB-CZ 3.93Å; Y505-F574 HydrophobicContact CD1-CB 4.49Å; Y505-F574 HydrophobicContact CD2-CB 3.87Å; Y505-F574 HydrophobicContact CD2-CD1 4.19Å; Y505-F574 AromaticContact CD2-CD2 3.68Å; Y505-F574 HydrophobicContact CD2-CD2 3.68Å; Y505-F574 HydrophobicContact CD2-CE2 4.21Å; Y505-F574 AromaticContact CD2-CG 3.65Å; Y505-F574 HydrophobicContact CD2-CG 3.65Å; Y505-F574 AromaticContact CE2-CD2 3.89Å; Y505-F574 HydrophobicContact CE2-CD2 3.89Å; Y505-F574 HydrophobicContact CE2-CE2 4.36Å; Y505-F574 HydrophobicContact CE2-CG 4.29Å; Y505-F574 HydrophobicContact CG-CB 3.89Å; Y505-F574 HydrophobicContact CG-CG 4.13Å; V509-F574 HydrophobicContact CG2-CB 4.44Å; K572-F574 VanDerWaalsContact C-N 3.27Å; K572-F574 HydrophobicContact CB-CD1 4.34Å; K572-F574 HydrophobicContact CB-CD2 4.3Å; K572-F574 HydrophobicContact CB-CE1 4.06Å; K572-F574 HydrophobicContact CB-CE2 4.02Å; K572-F574 HydrophobicContact CB-CG 4.48Å; K572-F574 HydrophobicContact CB-CZ 3.92Å; K572-F574 HydrophobicContact CD-CE1 3.84Å; K572-F574 HydrophobicContact CD-CE2 3.73Å; K572-F574 HydrophobicContact CD-CZ 3.19Å; K572-F574 HydrophobicContact CG-CE2 4.48Å; K572-F574 HydrophobicContact CG-CZ 4.19Å; K572-F574 PolarHBondContact O-N 2.98Å; F574-D576 VanDerWaalsContact C-N 3.32Å; F574-F579 HydrophobicContact CB-CD1 3.92Å; F574-F579 HydrophobicContact CB-CE1 3.48Å; F574-F579 VanDerWaalsContact CB-CE1 3.48Å; F574-F579 HydrophobicContact CB-CZ 4.15Å; F574-F579 WeakPolarHBondContact O-CD1 3.18Å; F574-Q580 PolarHBondContact O-NE2 2.86Å
575	D	86.7	Confident	85.1	Confident	49 Å²	49	39.5 Å²	39.5	26%	0.262	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-90.7	1.1	171.2	-54.4	-45.9	0	0	0	112.2	F571 K572 C573 Q577	F571-D575 HydrophobicContact CB-CB 4.33Å; F571-D575 HydrophobicContact CD1-CB 3.74Å; K572-D575 WeakPolarHBondContact CB-OD2 3.33Å; K572-D575 PolarHBondContact N-OD2 3.35Å; K572-D575 WeakPolarHBondContact O-CB 3.44Å; K572-D575 PolarHBondContact O-N 3.49Å; C573-D575 PolarHBondContact O-N 2.66Å; D575-Q577 PolarHBondContact O-N 3.4Å; D575-Q577 PolarHBondContact O-NE2 2.78Å
576	D	89.1	Confident	85.5	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.011	24%	0.236	C	C	.	.			trans	-56.9	130	170.8	-81.3	-19.1	0	0	0	110.1	G553 R568 C573 F574 A578 F579 Q580 Q615	G553-D576 PolarHBondContact N-OD2 3.37Å; R568-D576 IonicContact CZ-OD1 3.32Å; R568-D576 IonicContact NH1-OD1 2.71Å; R568-D576 PolarHBondContact NH1-OD1 3.31Å; C573-D576 WeakPolarHBondContact O-CB 3.26Å; C573-D576 PolarHBondContact O-N 3.37Å; F574-D576 VanDerWaalsContact C-N 3.32Å; D576-A578 VanDerWaalsContact C-N 3.29Å; D576-A578 PolarHBondContact O-N 2.75Å; D576-F579 HydrophobicContact CB-CB 3.87Å; D576-F579 WeakPolarHBondContact O-CB 3.38Å; D576-F579 PolarHBondContact O-N 3.34Å; D576-Q580 PolarHBondContact O-N 3.1Å; D576-Q615 PolarHBondContact OD1-NE2 3.23Å
577	Q	94.5	Very high	86.3	Confident	68 Å²	68	42.9 Å²	42.9	32%	0.318	24%	0.239	S	C	.	.	H	α-helix	trans	-64.5	-38	-177.6	-62.2	-59.2	-53.7	0	0	111.1	D575 F579 Q580 F581 V611 D614 Q615 T618	D575-Q577 PolarHBondContact O-N 3.4Å; D575-Q577 PolarHBondContact O-NE2 2.78Å; Q577-F579 VanDerWaalsContact C-N 3.32Å; Q577-F579 PolarHBondContact O-N 3.23Å; Q577-Q580 PolarHBondContact O-N 3.47Å; Q577-F581 VanDerWaalsContact O-CB 3.27Å; Q577-F581 WeakPolarHBondContact O-CB 3.46Å; Q577-F581 PolarHBondContact O-N 2.94Å; Q577-V611 HydrophobicContact CB-CG1 4.4Å; Q577-D614 HydrophobicContact CB-CB 4.22Å; Q577-D614 HydrophobicContact CG-CB 3.77Å; Q577-Q615 HydrophobicContact CB-CB 4.3Å; Q577-T618 HydrophobicContact CG-CG2 4.03Å
578	A	92.8	Very high	87.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-35.5	173.8	0	0	0	0	0	112.4	Y548 F549 S552 D576 V582 V611	Y548-A578 HydrophobicContact CD1-CB 4.49Å; Y548-A578 HydrophobicContact CE1-CB 3.55Å; F549-A578 HydrophobicContact CD1-CB 3.86Å; F549-A578 HydrophobicContact CE1-CB 3.95Å; S552-A578 WeakPolarHBondContact OG-CB 3.3Å; D576-A578 VanDerWaalsContact C-N 3.29Å; D576-A578 PolarHBondContact O-N 2.75Å; A578-V582 VanDerWaalsContact O-CG2 3.31Å; A578-V582 WeakPolarHBondContact O-CG2 3.44Å; A578-V582 PolarHBondContact O-N 3.18Å; A578-V582 VanDerWaalsContact O-N 3.12Å; A578-V611 HydrophobicContact CB-CG1 4.28Å
579	F	92.9	Very high	87.6	Confident	10 Å²	10	42.2 Å²	42.2	4%	0.044	23%	0.234	C	C	.	.	H	α-helix	trans	-67.6	-47.1	174.6	178.4	-97.8	0	0	0	111.5	Y505 H508 V509 S552 F574 D576 Q577 F581 V582 L583	Y505-F579 AromaticContact CD1-CE1 3.72Å; Y505-F579 HydrophobicContact CD1-CE1 3.72Å; Y505-F579 HydrophobicContact CD1-CZ 4.17Å; Y505-F579 HydrophobicContact CE1-CE1 4.27Å; Y505-F579 HydrophobicContact CG-CE1 4.19Å; H508-F579 HydrophobicContact CB-CE2 3.88Å; H508-F579 HydrophobicContact CB-CZ 3.69Å; V509-F579 HydrophobicContact CG2-CE2 4.33Å; V509-F579 HydrophobicContact CG2-CZ 4.04Å; S552-F579 VanDerWaalsContact O-CD2 3.22Å; S552-F579 WeakPolarHBondContact O-CD2 3.34Å; F574-F579 HydrophobicContact CB-CD1 3.92Å; F574-F579 HydrophobicContact CB-CE1 3.48Å; F574-F579 VanDerWaalsContact CB-CE1 3.48Å; F574-F579 HydrophobicContact CB-CZ 4.15Å; F574-F579 WeakPolarHBondContact O-CD1 3.18Å; D576-F579 HydrophobicContact CB-CB 3.87Å; D576-F579 WeakPolarHBondContact O-CB 3.38Å; D576-F579 PolarHBondContact O-N 3.34Å; Q577-F579 VanDerWaalsContact C-N 3.32Å; Q577-F579 PolarHBondContact O-N 3.23Å; F579-F581 VanDerWaalsContact C-N 3.29Å; F579-F581 PolarHBondContact O-N 2.9Å; F579-V582 PolarHBondContact O-N 3.39Å; F579-L583 HydrophobicContact CD1-CD1 3.98Å; F579-L583 HydrophobicContact CE1-CD1 3.53Å; F579-L583 HydrophobicContact CE1-CG 4.29Å; F579-L583 HydrophobicContact CZ-CD1 4.08Å; F579-L583 WeakPolarHBondContact O-CG 3.3Å; F579-L583 PolarHBondContact O-N 3.43Å; F579-L583 VanDerWaalsContact O-N 3.14Å
580	Q	93.3	Very high	88.3	Confident	60 Å²	60	43.7 Å²	43.7	28%	0.28	23%	0.231	S	C	.	.	H	α-helix	trans	-63.1	-35.5	176.6	-69.2	-64.9	-33.8	0	0	112.4	F574 D576 Q577 L583 S584	F574-Q580 PolarHBondContact O-NE2 2.86Å; D576-Q580 PolarHBondContact O-N 3.1Å; Q577-Q580 PolarHBondContact O-N 3.47Å; Q580-L583 PolarHBondContact O-N 3.05Å; Q580-S584 PolarHBondContact O-N 2.99Å; Q580-S584 VanDerWaalsContact O-N 3.09Å; Q580-S584 PolarHBondContact O-OG 2.86Å
581	F	94.1	Very high	89.1	Confident	15 Å²	15	44.9 Å²	44.9	7%	0.066	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-45.9	175.2	-174.5	-104.8	0	0	0	111.9	F549 Q577 F579 L583 S584 H585 F588 D607 V611	F549-F581 HydrophobicContact CD1-CD1 4.28Å; F549-F581 AromaticContact CE1-CD1 3.74Å; F549-F581 HydrophobicContact CE1-CD1 3.74Å; F549-F581 HydrophobicContact CE1-CE1 4.39Å; F549-F581 HydrophobicContact CZ-CD1 4.03Å; F549-F581 HydrophobicContact CZ-CE1 4.23Å; Q577-F581 VanDerWaalsContact O-CB 3.27Å; Q577-F581 WeakPolarHBondContact O-CB 3.46Å; Q577-F581 PolarHBondContact O-N 2.94Å; F579-F581 VanDerWaalsContact C-N 3.29Å; F579-F581 PolarHBondContact O-N 2.9Å; F581-L583 VanDerWaalsContact C-N 3.29Å; F581-L583 PolarHBondContact O-N 3.42Å; F581-S584 WeakPolarHBondContact CA-OG 3.36Å; F581-S584 PolarHBondContact O-N 3.4Å; F581-S584 VanDerWaalsContact O-N 3.14Å; F581-S584 PolarHBondContact O-OG 3.4Å; F581-H585 AromaticContact CD2-ND1 3.53Å; F581-H585 HydrophobicContact CE1-CB 4.39Å; F581-H585 HydrophobicContact CE2-CB 4.36Å; F581-H585 AromaticContact CE2-CE1 3.88Å; F581-H585 AromaticContact CE2-CG 3.88Å; F581-H585 AromaticContact CE2-ND1 3.5Å; F581-H585 HydrophobicContact CZ-CB 4.2Å; F581-H585 PolarHBondContact O-N 2.82Å; F581-H585 PolarHBondContact O-ND1 3.03Å; F581-F588 HydrophobicContact CE1-CB 4.21Å; F581-F588 AromaticContact CE1-CD1 3.8Å; F581-F588 HydrophobicContact CE1-CD1 3.8Å; F581-F588 HydrophobicContact CE1-CD2 4.05Å; F581-F588 HydrophobicContact CE1-CE1 4.21Å; F581-F588 HydrophobicContact CE1-CE2 4.45Å; F581-F588 AromaticContact CE1-CG 3.74Å; F581-F588 HydrophobicContact CE1-CG 3.74Å; F581-F588 HydrophobicContact CZ-CD2 4.01Å; F581-F588 HydrophobicContact CZ-CE2 4.35Å; F581-F588 HydrophobicContact CZ-CG 4.14Å; F581-D607 HydrophobicContact CE2-CB 4.23Å; F581-D607 HydrophobicContact CZ-CB 4.27Å; F581-V611 HydrophobicContact CB-CG1 3.85Å; F581-V611 HydrophobicContact CB-CG2 3.91Å; F581-V611 HydrophobicContact CD1-CG2 4.26Å; F581-V611 HydrophobicContact CD2-CG2 3.29Å; F581-V611 HydrophobicContact CE2-CG2 3.78Å; F581-V611 HydrophobicContact CG-CB 4.44Å; F581-V611 HydrophobicContact CG-CG1 4.16Å; F581-V611 HydrophobicContact CG-CG2 3.55Å; F581-V611 HydrophobicContact CZ-CG2 4.44Å
582	V	92	Very high	89.7	Confident	34 Å²	34	42 Å²	42	21%	0.206	21%	0.214	C	C	.	.	H	α-helix	trans	-61.9	-36.7	176.6	172.5	0	0	0	0	112.1	F549 A578 F579 S584 H586 V589	F549-V582 HydrophobicContact CB-CG2 3.64Å; F549-V582 HydrophobicContact CD1-CG2 3.9Å; F549-V582 HydrophobicContact CG-CG2 4.09Å; A578-V582 VanDerWaalsContact O-CG2 3.31Å; A578-V582 WeakPolarHBondContact O-CG2 3.44Å; A578-V582 PolarHBondContact O-N 3.18Å; A578-V582 VanDerWaalsContact O-N 3.12Å; F579-V582 PolarHBondContact O-N 3.39Å; V582-S584 VanDerWaalsContact C-N 3.33Å; V582-H586 PolarHBondContact O-N 3.03Å; V582-V589 HydrophobicContact CB-CG2 4.46Å; V582-V589 HydrophobicContact CG1-CG2 4.1Å; V582-V589 HydrophobicContact CG2-CG2 3.74Å
583	L	90.7	Very high	90.2	Very high	53 Å²	53	44.2 Å²	44.2	28%	0.277	22%	0.223	S	C	.	.	H	α-helix	trans	-68.4	-31.9	176.4	-66.9	-178.2	0	0	0	113.2	Y505 H508 F579 Q580 F581	Y505-L583 HydrophobicContact CD1-CD1 3.7Å; Y505-L583 HydrophobicContact CE1-CD1 3.5Å; H508-L583 HydrophobicContact CB-CD2 4.2Å; H508-L583 WeakPolarHBondContact CD2-CD2 3.46Å; F579-L583 HydrophobicContact CD1-CD1 3.98Å; F579-L583 HydrophobicContact CE1-CD1 3.53Å; F579-L583 HydrophobicContact CE1-CG 4.29Å; F579-L583 HydrophobicContact CZ-CD1 4.08Å; F579-L583 WeakPolarHBondContact O-CG 3.3Å; F579-L583 PolarHBondContact O-N 3.43Å; F579-L583 VanDerWaalsContact O-N 3.14Å; Q580-L583 PolarHBondContact O-N 3.05Å; F581-L583 VanDerWaalsContact C-N 3.29Å; F581-L583 PolarHBondContact O-N 3.42Å
584	S	89.6	Confident	90.7	Very high	76 Å²	76	47.5 Å²	47.5	53%	0.531	24%	0.243	S	C	.	.	H	α-helix	trans	-87.9	-27.6	-179.7	45.7	0	0	0	0	113.2	Q580 F581 V582	Q580-S584 PolarHBondContact O-N 2.99Å; Q580-S584 VanDerWaalsContact O-N 3.09Å; Q580-S584 PolarHBondContact O-OG 2.86Å; F581-S584 WeakPolarHBondContact CA-OG 3.36Å; F581-S584 PolarHBondContact O-N 3.4Å; F581-S584 VanDerWaalsContact O-N 3.14Å; F581-S584 PolarHBondContact O-OG 3.4Å; V582-S584 VanDerWaalsContact C-N 3.33Å
585	H	88.3	Confident	91.1	Very high	78 Å²	78	50.7 Å²	50.7	36%	0.361	26%	0.258	S	S	.	.			trans	-131.8	58.3	-173.7	-55.1	84.4	0	0	0	111.3	F581 D587 F588	F581-H585 AromaticContact CD2-ND1 3.53Å; F581-H585 HydrophobicContact CE1-CB 4.39Å; F581-H585 HydrophobicContact CE2-CB 4.36Å; F581-H585 AromaticContact CE2-CE1 3.88Å; F581-H585 AromaticContact CE2-CG 3.88Å; F581-H585 AromaticContact CE2-ND1 3.5Å; F581-H585 HydrophobicContact CZ-CB 4.2Å; F581-H585 PolarHBondContact O-N 2.82Å; F581-H585 PolarHBondContact O-ND1 3.03Å; H585-D587 VanDerWaalsContact C-OD1 3.31Å; H585-D587 PolarHBondContact O-N 2.98Å; H585-F588 HydrophobicContact CB-CB 4.06Å; H585-F588 WeakPolarHBondContact O-CB 3.35Å; H585-F588 PolarHBondContact O-N 3.44Å
586	H	85	Confident	91.4	Very high	133 Å²	133	49.9 Å²	49.9	62%	0.616	26%	0.256	S	S	*	.	H	α-helix	trans	-56.2	-34.4	-178.3	69.9	-70.9	0	0	0	113.6	V582 F588 V589 D590	V582-H586 PolarHBondContact O-N 3.03Å; H586-F588 PolarHBondContact O-N 3.24Å; H586-V589 PolarHBondContact O-N 3.49Å; H586-D590 PolarHBondContact O-N 3.13Å
587	D	90.3	Very high	91.7	Very high	73 Å²	73	49.8 Å²	49.8	39%	0.39	26%	0.255	S	S	.	.	H	α-helix	trans	-61.7	-28.6	176.7	63.4	-57	0	0	0	112.3	H585 D590 R591	H585-D587 VanDerWaalsContact C-OD1 3.31Å; H585-D587 PolarHBondContact O-N 2.98Å; D587-D590 PolarHBondContact O-N 2.76Å; D587-R591 WeakPolarHBondContact O-CG 3.38Å; D587-R591 PolarHBondContact O-N 3.3Å
588	F	91.2	Very high	91.7	Very high	3 Å²	3	46.7 Å²	46.7	1%	0.013	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-46.6	178.3	-166.8	-84.2	0	0	0	112.1	F549 F581 H585 H586 D590 R591 L592 F600 D604 V608	F549-F588 HydrophobicContact CD2-CE1 4.4Å; F549-F588 HydrophobicContact CE2-CD1 4.36Å; F549-F588 AromaticContact CE2-CE1 3.88Å; F549-F588 HydrophobicContact CE2-CE1 3.88Å; F581-F588 HydrophobicContact CE1-CB 4.21Å; F581-F588 AromaticContact CE1-CD1 3.8Å; F581-F588 HydrophobicContact CE1-CD1 3.8Å; F581-F588 HydrophobicContact CE1-CD2 4.05Å; F581-F588 HydrophobicContact CE1-CE1 4.21Å; F581-F588 HydrophobicContact CE1-CE2 4.45Å; F581-F588 AromaticContact CE1-CG 3.74Å; F581-F588 HydrophobicContact CE1-CG 3.74Å; F581-F588 HydrophobicContact CZ-CD2 4.01Å; F581-F588 HydrophobicContact CZ-CE2 4.35Å; F581-F588 HydrophobicContact CZ-CG 4.14Å; H585-F588 HydrophobicContact CB-CB 4.06Å; H585-F588 WeakPolarHBondContact O-CB 3.35Å; H585-F588 PolarHBondContact O-N 3.44Å; H586-F588 PolarHBondContact O-N 3.24Å; F588-D590 VanDerWaalsContact C-N 3.33Å; F588-R591 PolarHBondContact O-N 3.24Å; F588-L592 HydrophobicContact CD1-CD1 4.07Å; F588-L592 HydrophobicContact CD1-CG 4.46Å; F588-L592 HydrophobicContact CE1-CD1 3.75Å; F588-L592 HydrophobicContact CE1-CG 4.19Å; F588-L592 PolarHBondContact O-N 2.96Å; F588-L592 VanDerWaalsContact O-N 3.17Å; F588-F600 HydrophobicContact CD1-CE2 4.4Å; F588-F600 HydrophobicContact CD2-CE2 4.13Å; F588-F600 HydrophobicContact CE1-CD2 4.5Å; F588-F600 AromaticContact CE1-CE2 3.84Å; F588-F600 HydrophobicContact CE1-CE2 3.84Å; F588-F600 AromaticContact CE2-CD2 3.66Å; F588-F600 HydrophobicContact CE2-CD2 3.66Å; F588-F600 AromaticContact CE2-CE2 3.52Å; F588-F600 HydrophobicContact CE2-CE2 3.52Å; F588-F600 AromaticContact CZ-CD2 3.58Å; F588-F600 HydrophobicContact CZ-CD2 3.58Å; F588-F600 AromaticContact CZ-CE2 3.31Å; F588-F600 HydrophobicContact CZ-CE2 3.31Å; F588-D604 HydrophobicContact CE2-CB 4.22Å; F588-V608 HydrophobicContact CE1-CG2 3.79Å; F588-V608 HydrophobicContact CE2-CG2 3.97Å; F588-V608 HydrophobicContact CZ-CG2 3.13Å
589	V	90.2	Very high	91.6	Very high	10 Å²	10	52 Å²	52	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-69.1	-35.2	178.7	176.9	0	0	0	0	111.2	R546 F549 I550 V582 H586 L592 K593	R546-V589 HydrophobicContact CG-CG1 4.34Å; F549-V589 HydrophobicContact CB-CG2 4.07Å; I550-V589 HydrophobicContact CD1-CG1 3.64Å; I550-V589 HydrophobicContact CG1-CG1 3.44Å; I550-V589 VanDerWaalsContact CG1-CG1 3.44Å; V582-V589 HydrophobicContact CB-CG2 4.46Å; V582-V589 HydrophobicContact CG1-CG2 4.1Å; V582-V589 HydrophobicContact CG2-CG2 3.74Å; H586-V589 PolarHBondContact O-N 3.49Å; V589-L592 PolarHBondContact O-N 2.89Å; V589-K593 PolarHBondContact O-N 3.27Å
590	D	90.9	Very high	91.7	Very high	77 Å²	77	51.8 Å²	51.8	41%	0.412	27%	0.265	S	S	.	.	H	α-helix	trans	-67.7	-39.1	175.9	-75.3	-30	0	0	0	111.9	H586 D587 F588 K593	H586-D590 PolarHBondContact O-N 3.13Å; D587-D590 PolarHBondContact O-N 2.76Å; F588-D590 VanDerWaalsContact C-N 3.33Å; D590-K593 WeakPolarHBondContact O-CB 3.41Å; D590-K593 PolarHBondContact O-N 3.01Å; D590-K593 IonicContact OD1-NZ 2.89Å; D590-K593 PolarHBondContact OD1-NZ 3.19Å
591	R	94.4	Very high	91.7	Very high	55 Å²	55	51.2 Å²	51.2	21%	0.208	27%	0.267	C	S	.	.	H	α-helix	trans	-59.6	-46	172.1	-75.6	-170.2	-69.5	160.9	-6.1	111.9	D587 F588 K593 T594 E595 F600 D604	D587-R591 WeakPolarHBondContact O-CG 3.38Å; D587-R591 PolarHBondContact O-N 3.3Å; F588-R591 PolarHBondContact O-N 3.24Å; R591-K593 PolarHBondContact O-N 2.97Å; R591-T594 PolarHBondContact O-N 3.4Å; R591-T594 PolarHBondContact O-OG1 3.5Å; R591-E595 WeakPolarHBondContact O-CB 3.33Å; R591-E595 PolarHBondContact O-N 3.42Å; R591-F600 HydrophobicContact CB-CE1 4.1Å; R591-F600 HydrophobicContact CB-CZ 3.68Å; R591-D604 IonicContact CZ-OD1 3.68Å; R591-D604 IonicContact CZ-OD2 3.43Å; R591-D604 IonicContact NH1-OD1 2.73Å; R591-D604 IonicContact NH1-OD2 3.06Å; R591-D604 PolarHBondContact NH1-OD2 3.27Å; R591-D604 IonicContact NH2-OD1 2.7Å; R591-D604 PolarHBondContact NH2-OD1 3.1Å; R591-D604 IonicContact NH2-OD2 2.93Å
592	L	94.3	Very high	91.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-17.8	177.9	-73.9	176.1	0	0	0	114.1	T542 L545 R546 F549 F588 V589 T594 V597 F600	T542-L592 HydrophobicContact CG2-CD2 4.05Å; L545-L592 HydrophobicContact CD2-CD1 4.22Å; L545-L592 HydrophobicContact CG-CD1 4.24Å; R546-L592 HydrophobicContact CB-CB 3.96Å; R546-L592 HydrophobicContact CB-CD1 4.14Å; R546-L592 HydrophobicContact CG-CB 3.88Å; F549-L592 HydrophobicContact CD2-CD1 4.23Å; F588-L592 HydrophobicContact CD1-CD1 4.07Å; F588-L592 HydrophobicContact CD1-CG 4.46Å; F588-L592 HydrophobicContact CE1-CD1 3.75Å; F588-L592 HydrophobicContact CE1-CG 4.19Å; F588-L592 PolarHBondContact O-N 2.96Å; F588-L592 VanDerWaalsContact O-N 3.17Å; V589-L592 PolarHBondContact O-N 2.89Å; L592-T594 VanDerWaalsContact C-N 3.3Å; L592-V597 HydrophobicContact CD2-CB 3.97Å; L592-V597 HydrophobicContact CD2-CG2 4.23Å; L592-F600 HydrophobicContact CD2-CE1 4.38Å; L592-F600 HydrophobicContact CD2-CE2 3.8Å; L592-F600 HydrophobicContact CD2-CZ 3.6Å; L592-F600 HydrophobicContact CG-CE2 4.04Å; L592-F600 HydrophobicContact CG-CZ 3.82Å
593	K	91.4	Very high	91.7	Very high	93 Å²	93	51.7 Å²	51.7	40%	0.404	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-25.5	173.7	-68	173	-178.4	159	0	112.8	V589 D590 R591 R1021	V589-K593 PolarHBondContact O-N 3.27Å; D590-K593 WeakPolarHBondContact O-CB 3.41Å; D590-K593 PolarHBondContact O-N 3.01Å; D590-K593 IonicContact OD1-NZ 2.89Å; D590-K593 PolarHBondContact OD1-NZ 3.19Å; R591-K593 PolarHBondContact O-N 2.97Å; K593-R1021 WeakPolarHBondContact O-CB 3.35Å
594	T	90.2	Very high	91.9	Very high	92 Å²	92	50.7 Å²	50.7	56%	0.564	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	-22.3	-172.5	50.9	0	0	0	0	113.8	R591 L592	R591-T594 PolarHBondContact O-N 3.4Å; R591-T594 PolarHBondContact O-OG1 3.5Å; L592-T594 VanDerWaalsContact C-N 3.3Å
595	E	91.9	Very high	92.1	Very high	83 Å²	83	47.4 Å²	47.4	39%	0.388	24%	0.244	S	C	.	.	S	Bend	trans	-114.6	148.9	-175.3	-64.9	171.2	-155.6	0	0	110.8	T542 R591 F600	T542-E595 VanDerWaalsContact CG2-O 3.29Å; T542-E595 WeakPolarHBondContact CG2-O 3.4Å; R591-E595 WeakPolarHBondContact O-CB 3.33Å; R591-E595 PolarHBondContact O-N 3.42Å; E595-F600 HydrophobicContact CB-CE1 3.82Å
596	S	93.1	Very high	92.5	Very high	32 Å²	32	43.7 Å²	43.7	22%	0.224	23%	0.227	C	C	.	.			trans	-75.4	140.4	172.2	179.5	0	0	0	0	110.3	Y598 E599 F600	S596-Y598 PolarHBondContact O-N 2.98Å; S596-Y598 VanDerWaalsContact O-N 3.14Å; S596-Y598 VanDerWaalsContact OG-CD2 3.3Å; S596-Y598 WeakPolarHBondContact OG-CD2 3.42Å; S596-Y598 PolarHBondContact OG-N 3.23Å; S596-E599 PolarHBondContact O-N 3.25Å; S596-F600 WeakPolarHBondContact O-CD1 3.38Å
597	V	94.8	Very high	93	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-60.8	-24.5	173.2	73.1	0	0	0	0	111.6	F460 L464 T542 L545 L592 E599 F600	F460-V597 HydrophobicContact CE1-CG1 4.14Å; F460-V597 HydrophobicContact CE1-CG2 3.92Å; F460-V597 HydrophobicContact CZ-CG2 4.18Å; L464-V597 HydrophobicContact CD1-CG1 4.4Å; T542-V597 PolarHBondContact OG1-N 2.99Å; T542-V597 VanDerWaalsContact OG1-N 3.14Å; L545-V597 HydrophobicContact CD2-CG2 3.74Å; L592-V597 HydrophobicContact CD2-CB 3.97Å; L592-V597 HydrophobicContact CD2-CG2 4.23Å; V597-E599 VanDerWaalsContact C-N 3.25Å; V597-E599 PolarHBondContact O-N 3.4Å; V597-F600 HydrophobicContact CG2-CD2 4.4Å; V597-F600 WeakPolarHBondContact O-CB 3.42Å; V597-F600 PolarHBondContact O-N 3.43Å
598	Y	94.3	Very high	93.2	Very high	3 Å²	3	35.6 Å²	35.6	1%	0.012	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-73	-11	173.7	-55.4	-66.4	0	0	0	113.8	K454 P456 F460 A461 G538 L541 S596 R605 V911	K454-Y598 WeakPolarHBondContact O-CB 3.47Å; P456-Y598 HydrophobicContact CB-CE2 4.33Å; P456-Y598 HydrophobicContact CG-CE2 4.19Å; F460-Y598 AromaticContact CD1-CD1 3.77Å; F460-Y598 HydrophobicContact CD1-CD1 3.77Å; F460-Y598 AromaticContact CD1-CE1 3.82Å; F460-Y598 HydrophobicContact CD1-CE1 3.82Å; F460-Y598 HydrophobicContact CE1-CD1 4.43Å; A461-Y598 HydrophobicContact CB-CE1 4.06Å; A461-Y598 WeakPolarHBondContact CB-OH 3.31Å; G538-Y598 VanDerWaalsContact C-OH 3.3Å; G538-Y598 WeakPolarHBondContact CA-OH 3.03Å; G538-Y598 WeakPolarHBondContact O-CE2 3.18Å; G538-Y598 PolarHBondContact O-OH 3.01Å; L541-Y598 WeakPolarHBondContact CD1-OH 3.34Å; S596-Y598 PolarHBondContact O-N 2.98Å; S596-Y598 VanDerWaalsContact O-N 3.14Å; S596-Y598 VanDerWaalsContact OG-CD2 3.3Å; S596-Y598 WeakPolarHBondContact OG-CD2 3.42Å; S596-Y598 PolarHBondContact OG-N 3.23Å; Y598-R605 PolarHBondContact O-NH2 2.94Å; Y598-V911 HydrophobicContact CD2-CG2 4.28Å; Y598-V911 HydrophobicContact CE2-CG2 4.21Å
599	E	91.3	Very high	93.5	Very high	111 Å²	111	35.4 Å²	35.4	52%	0.519	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-98.6	-2.5	173.1	-65.1	-55.9	141.2	0	0	112.6	K454 S596 V597	K454-E599 IonicContact NZ-OE1 2.72Å; K454-E599 PolarHBondContact NZ-OE1 2.7Å; K454-E599 IonicContact NZ-OE2 2.73Å; K454-E599 PolarHBondContact NZ-OE2 3.23Å; S596-E599 PolarHBondContact O-N 3.25Å; V597-E599 VanDerWaalsContact C-N 3.25Å; V597-E599 PolarHBondContact O-N 3.4Å
600	F	94	Very high	93.8	Very high	6 Å²	6	35.7 Å²	35.7	3%	0.026	19%	0.19	C	C	.	.	S	Bend	trans	-69.5	149.6	178.7	-76.9	19.1	0	0	0	110.8	F588 R591 L592 E595 S596 V597 D604 R605	F588-F600 HydrophobicContact CD1-CE2 4.4Å; F588-F600 HydrophobicContact CD2-CE2 4.13Å; F588-F600 HydrophobicContact CE1-CD2 4.5Å; F588-F600 AromaticContact CE1-CE2 3.84Å; F588-F600 HydrophobicContact CE1-CE2 3.84Å; F588-F600 AromaticContact CE2-CD2 3.66Å; F588-F600 HydrophobicContact CE2-CD2 3.66Å; F588-F600 AromaticContact CE2-CE2 3.52Å; F588-F600 HydrophobicContact CE2-CE2 3.52Å; F588-F600 AromaticContact CZ-CD2 3.58Å; F588-F600 HydrophobicContact CZ-CD2 3.58Å; F588-F600 AromaticContact CZ-CE2 3.31Å; F588-F600 HydrophobicContact CZ-CE2 3.31Å; R591-F600 HydrophobicContact CB-CE1 4.1Å; R591-F600 HydrophobicContact CB-CZ 3.68Å; L592-F600 HydrophobicContact CD2-CE1 4.38Å; L592-F600 HydrophobicContact CD2-CE2 3.8Å; L592-F600 HydrophobicContact CD2-CZ 3.6Å; L592-F600 HydrophobicContact CG-CE2 4.04Å; L592-F600 HydrophobicContact CG-CZ 3.82Å; E595-F600 HydrophobicContact CB-CE1 3.82Å; S596-F600 WeakPolarHBondContact O-CD1 3.38Å; V597-F600 HydrophobicContact CG2-CD2 4.4Å; V597-F600 WeakPolarHBondContact O-CB 3.42Å; V597-F600 PolarHBondContact O-N 3.43Å; F600-D604 HydrophobicContact CB-CB 3.9Å; F600-D604 HydrophobicContact CD2-CB 4.09Å; F600-D604 HydrophobicContact CG-CB 4.37Å; F600-R605 HydrophobicContact CB-CG 4.12Å; F600-R605 PolarHBondContact O-NE 2.96Å; F600-R605 VanDerWaalsContact O-NE 3.11Å
601	S	93.5	Very high	94.1	Very high	48 Å²	48	32.7 Å²	32.7	34%	0.336	17%	0.174	S	C	.	.			trans	-59.9	152.6	178.9	71.8	0	0	0	0	111.1	S603 D604 R605	S601-S603 PolarHBondContact O-N 3.49Å; S601-S603 VanDerWaalsContact O-N 3.09Å; S601-D604 WeakPolarHBondContact O-CB 3.5Å; S601-D604 PolarHBondContact O-N 3.42Å; S601-D604 WeakPolarHBondContact OG-CB 3.45Å; S601-D604 PolarHBondContact OG-N 3.38Å; S601-D604 VanDerWaalsContact OG-N 3.13Å; S601-D604 PolarHBondContact OG-OD2 2.99Å; S601-R605 WeakPolarHBondContact O-CG 3.28Å; S601-R605 PolarHBondContact O-N 3.47Å
602	P	93.7	Very high	94.3	Very high	25 Å²	25	30 Å²	30	16%	0.162	16%	0.164	C	C	.	.	H	α-helix	trans	-52.9	-33.9	175.7	-28.5	35.6	0	0	0	113.2	I410 L451 F452 L606	I410-P602 HydrophobicContact CD1-CB 3.58Å; I410-P602 HydrophobicContact CG1-CB 4.35Å; L451-P602 HydrophobicContact CB-CB 4.26Å; F452-P602 HydrophobicContact CD1-CG 3.84Å; F452-P602 HydrophobicContact CE1-CB 4.17Å; F452-P602 HydrophobicContact CE1-CG 3.41Å; F452-P602 VanDerWaalsContact CE1-CG 3.41Å; F452-P602 HydrophobicContact CZ-CB 4.11Å; F452-P602 HydrophobicContact CZ-CG 3.85Å; P602-L606 WeakPolarHBondContact O-CB 3.29Å; P602-L606 PolarHBondContact O-N 3.13Å
603	S	93.1	Very high	94.4	Very high	35 Å²	35	30.7 Å²	30.7	25%	0.245	17%	0.166	C	C	.	.	H	α-helix	trans	-66.3	-49.2	174.5	-171.7	0	0	0	0	112.2	R414 S601 R605 L606 D607	R414-S603 PolarHBondContact NH1-OG 3.39Å; S601-S603 PolarHBondContact O-N 3.49Å; S601-S603 VanDerWaalsContact O-N 3.09Å; S603-R605 VanDerWaalsContact C-N 3.3Å; S603-R605 PolarHBondContact O-N 3.39Å; S603-L606 WeakPolarHBondContact O-CB 3.26Å; S603-L606 PolarHBondContact O-N 2.95Å; S603-D607 PolarHBondContact O-N 3.28Å; S603-D607 VanDerWaalsContact O-OD2 3.12Å
604	D	93.6	Very high	94.6	Very high	32 Å²	32	28.4 Å²	28.4	17%	0.171	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-40.9	177.1	-73.7	-52.3	0	0	0	111.4	F588 R591 F600 S601 L606 D607 V608	F588-D604 HydrophobicContact CE2-CB 4.22Å; R591-D604 IonicContact CZ-OD1 3.68Å; R591-D604 IonicContact CZ-OD2 3.43Å; R591-D604 IonicContact NH1-OD1 2.73Å; R591-D604 IonicContact NH1-OD2 3.06Å; R591-D604 PolarHBondContact NH1-OD2 3.27Å; R591-D604 IonicContact NH2-OD1 2.7Å; R591-D604 PolarHBondContact NH2-OD1 3.1Å; R591-D604 IonicContact NH2-OD2 2.93Å; F600-D604 HydrophobicContact CB-CB 3.9Å; F600-D604 HydrophobicContact CD2-CB 4.09Å; F600-D604 HydrophobicContact CG-CB 4.37Å; S601-D604 WeakPolarHBondContact O-CB 3.5Å; S601-D604 PolarHBondContact O-N 3.42Å; S601-D604 WeakPolarHBondContact OG-CB 3.45Å; S601-D604 PolarHBondContact OG-N 3.38Å; S601-D604 VanDerWaalsContact OG-N 3.13Å; S601-D604 PolarHBondContact OG-OD2 2.99Å; D604-L606 VanDerWaalsContact C-N 3.33Å; D604-L606 PolarHBondContact O-N 2.93Å; D604-D607 WeakPolarHBondContact O-CB 3.18Å; D604-D607 PolarHBondContact O-N 2.77Å; D604-V608 PolarHBondContact O-N 3.33Å; D604-V608 VanDerWaalsContact O-N 3.11Å
605	R	95.7	Very high	94.8	Very high	6 Å²	6	24 Å²	24	2%	0.023	13%	0.132	C	C	.	.	H	α-helix	trans	-63	-40.3	176.6	-68.3	-174.7	-169.4	-168	5.7	111.9	A450 L451 D453 F460 Y598 F600 S601 S603 D607 V608 L609	A450-R605 PolarHBondContact O-NH1 3.28Å; L451-R605 HydrophobicContact CD2-CB 4.28Å; L451-R605 WeakPolarHBondContact O-CD 3.3Å; L451-R605 PolarHBondContact O-NH1 3.29Å; D453-R605 PolarHBondContact O-NH1 2.87Å; D453-R605 PolarHBondContact O-NH2 2.83Å; F460-R605 HydrophobicContact CD2-CB 4.43Å; F460-R605 HydrophobicContact CE1-CG 3.97Å; F460-R605 HydrophobicContact CE2-CB 3.61Å; F460-R605 HydrophobicContact CE2-CG 3.92Å; F460-R605 HydrophobicContact CZ-CB 3.68Å; F460-R605 HydrophobicContact CZ-CG 3.55Å; Y598-R605 PolarHBondContact O-NH2 2.94Å; F600-R605 HydrophobicContact CB-CG 4.12Å; F600-R605 PolarHBondContact O-NE 2.96Å; F600-R605 VanDerWaalsContact O-NE 3.11Å; S601-R605 WeakPolarHBondContact O-CG 3.28Å; S601-R605 PolarHBondContact O-N 3.47Å; S603-R605 VanDerWaalsContact C-N 3.3Å; S603-R605 PolarHBondContact O-N 3.39Å; R605-D607 VanDerWaalsContact C-N 3.34Å; R605-V608 PolarHBondContact O-N 3.08Å; R605-L609 WeakPolarHBondContact O-CG 3.43Å; R605-L609 PolarHBondContact O-N 3.42Å; R605-L609 VanDerWaalsContact O-N 3.14Å
606	L	96.2	Very high	94.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-65.5	-36.7	175.3	-177.6	59.2	0	0	0	112	R414 D417 L421 L451 P602 S603 D604 L609 T610	R414-L606 HydrophobicContact CB-CD2 3.97Å; D417-L606 HydrophobicContact CB-CD1 4.27Å; D417-L606 HydrophobicContact CB-CD2 3.95Å; D417-L606 HydrophobicContact CB-CG 4.15Å; L421-L606 HydrophobicContact CD2-CD1 4.42Å; L451-L606 HydrophobicContact CD2-CB 3.93Å; L451-L606 HydrophobicContact CD2-CD1 4.41Å; P602-L606 WeakPolarHBondContact O-CB 3.29Å; P602-L606 PolarHBondContact O-N 3.13Å; S603-L606 WeakPolarHBondContact O-CB 3.26Å; S603-L606 PolarHBondContact O-N 2.95Å; D604-L606 VanDerWaalsContact C-N 3.33Å; D604-L606 PolarHBondContact O-N 2.93Å; L606-L609 PolarHBondContact O-N 3.26Å; L606-T610 WeakPolarHBondContact O-CB 3.25Å; L606-T610 PolarHBondContact O-N 3.24Å; L606-T610 PolarHBondContact O-OG1 2.96Å
607	D	95	Very high	94.9	Very high	36 Å²	36	21.4 Å²	21.4	19%	0.193	12%	0.118	C	C	.	.	H	α-helix	trans	-60.9	-44.1	173.4	-73.3	-44.4	0	0	0	111.5	R414 F581 S603 D604 R605 L609 T610 V611	R414-D607 IonicContact CZ-OD1 2.61Å; R414-D607 IonicContact CZ-OD2 3.85Å; R414-D607 IonicContact NH1-OD1 2.74Å; R414-D607 PolarHBondContact NH1-OD1 2.98Å; R414-D607 IonicContact NH1-OD2 3.07Å; R414-D607 PolarHBondContact NH1-OD2 3.25Å; R414-D607 IonicContact NH2-OD1 3.1Å; R414-D607 PolarHBondContact NH2-OD1 3.01Å; R414-D607 IonicContact NH2-OD2 2.79Å; F581-D607 HydrophobicContact CE2-CB 4.23Å; F581-D607 HydrophobicContact CZ-CB 4.27Å; S603-D607 PolarHBondContact O-N 3.28Å; S603-D607 VanDerWaalsContact O-OD2 3.12Å; D604-D607 WeakPolarHBondContact O-CB 3.18Å; D604-D607 PolarHBondContact O-N 2.77Å; R605-D607 VanDerWaalsContact C-N 3.34Å; D607-L609 PolarHBondContact O-N 2.94Å; D607-T610 WeakPolarHBondContact O-CB 3.4Å; D607-T610 PolarHBondContact O-N 3.47Å; D607-V611 WeakPolarHBondContact O-CG2 3.48Å; D607-V611 PolarHBondContact O-N 3.1Å
608	V	95.7	Very high	94.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-58.5	-51.8	174.6	179.2	0	0	0	0	111.5	L464 L545 F549 F588 D604 R605 T610 V611 L612	L464-V608 HydrophobicContact CD2-CG1 3.57Å; L545-V608 HydrophobicContact CD1-CG1 3.92Å; L545-V608 HydrophobicContact CD2-CG1 3.82Å; L545-V608 HydrophobicContact CD2-CG2 4.31Å; F549-V608 HydrophobicContact CZ-CG1 4.42Å; F588-V608 HydrophobicContact CE1-CG2 3.79Å; F588-V608 HydrophobicContact CE2-CG2 3.97Å; F588-V608 HydrophobicContact CZ-CG2 3.13Å; D604-V608 PolarHBondContact O-N 3.33Å; D604-V608 VanDerWaalsContact O-N 3.11Å; R605-V608 PolarHBondContact O-N 3.08Å; V608-T610 VanDerWaalsContact C-N 3.28Å; V608-T610 PolarHBondContact O-N 3Å; V608-V611 PolarHBondContact O-N 3.18Å; V608-L612 HydrophobicContact CG1-CD1 4.07Å; V608-L612 HydrophobicContact CG1-CG 4.39Å; V608-L612 WeakPolarHBondContact O-CG 3.37Å; V608-L612 PolarHBondContact O-N 3.37Å
609	L	97.5	Very high	94.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.8	-38.6	-177.8	-65.8	171.6	0	0	0	111.7	L421 L451 F460 L463 L464 L467 R605 L606 D607 L612 R613	L421-L609 HydrophobicContact CD2-CB 3.66Å; L421-L609 HydrophobicContact CD2-CD1 3.98Å; L421-L609 HydrophobicContact CD2-CG 4.4Å; L451-L609 HydrophobicContact CD2-CD1 4.17Å; F460-L609 HydrophobicContact CD2-CD1 4.37Å; F460-L609 HydrophobicContact CE2-CD1 4.11Å; F460-L609 HydrophobicContact CE2-CD2 4.36Å; F460-L609 HydrophobicContact CE2-CG 4.16Å; L463-L609 HydrophobicContact CB-CD2 3.97Å; L463-L609 HydrophobicContact CD1-CD1 4.06Å; L463-L609 HydrophobicContact CD1-CD2 4.45Å; L464-L609 HydrophobicContact CD2-CD2 3.89Å; L464-L609 HydrophobicContact CG-CD2 4.3Å; L467-L609 HydrophobicContact CD1-CD2 3.89Å; R605-L609 WeakPolarHBondContact O-CG 3.43Å; R605-L609 PolarHBondContact O-N 3.42Å; R605-L609 VanDerWaalsContact O-N 3.14Å; L606-L609 PolarHBondContact O-N 3.26Å; D607-L609 PolarHBondContact O-N 2.94Å; L609-L612 PolarHBondContact O-N 3.39Å; L609-R613 WeakPolarHBondContact O-CB 3.39Å; L609-R613 PolarHBondContact O-N 3.47Å
610	T	96.4	Very high	94.4	Very high	16 Å²	16	18.5 Å²	18.5	10%	0.098	11%	0.108	C	C	.	.	H	α-helix	trans	-62	-47.7	175.7	-67.2	0	0	0	0	111.2	L606 D607 V608 L612 R613 D614	L606-T610 WeakPolarHBondContact O-CB 3.25Å; L606-T610 PolarHBondContact O-N 3.24Å; L606-T610 PolarHBondContact O-OG1 2.96Å; D607-T610 WeakPolarHBondContact O-CB 3.4Å; D607-T610 PolarHBondContact O-N 3.47Å; V608-T610 VanDerWaalsContact C-N 3.28Å; V608-T610 PolarHBondContact O-N 3Å; T610-L612 PolarHBondContact O-N 2.99Å; T610-R613 WeakPolarHBondContact O-CB 3.45Å; T610-R613 PolarHBondContact O-N 3.17Å; T610-D614 WeakPolarHBondContact O-CB 3.49Å; T610-D614 PolarHBondContact O-N 3.33Å
611	V	96.9	Very high	94.2	Very high	13 Å²	13	20 Å²	20	8%	0.079	12%	0.121	C	C	.	.	H	α-helix	trans	-64.8	-39.9	179.2	172.7	0	0	0	0	111.8	F549 Q577 A578 F581 D607 V608 D614 Q615	F549-V611 HydrophobicContact CE1-CG1 3.95Å; F549-V611 HydrophobicContact CZ-CG1 4.5Å; Q577-V611 HydrophobicContact CB-CG1 4.4Å; A578-V611 HydrophobicContact CB-CG1 4.28Å; F581-V611 HydrophobicContact CB-CG1 3.85Å; F581-V611 HydrophobicContact CB-CG2 3.91Å; F581-V611 HydrophobicContact CD1-CG2 4.26Å; F581-V611 HydrophobicContact CD2-CG2 3.29Å; F581-V611 HydrophobicContact CE2-CG2 3.78Å; F581-V611 HydrophobicContact CG-CB 4.44Å; F581-V611 HydrophobicContact CG-CG1 4.16Å; F581-V611 HydrophobicContact CG-CG2 3.55Å; F581-V611 HydrophobicContact CZ-CG2 4.44Å; D607-V611 WeakPolarHBondContact O-CG2 3.48Å; D607-V611 PolarHBondContact O-N 3.1Å; V608-V611 PolarHBondContact O-N 3.18Å; V611-D614 PolarHBondContact O-N 3.17Å; V611-Q615 WeakPolarHBondContact O-CB 3.32Å; V611-Q615 PolarHBondContact O-N 3.04Å
612	L	97.4	Very high	94.2	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-67.4	-41.8	176.4	-64.7	179.5	0	0	0	112	L464 L467 L468 I471 Y548 V608 L609 T610 Q615 L616	L464-L612 HydrophobicContact CD2-CD1 3.69Å; L467-L612 HydrophobicContact CB-CB 4.12Å; L467-L612 HydrophobicContact CB-CD1 4.16Å; L467-L612 HydrophobicContact CD1-CB 4.05Å; L467-L612 HydrophobicContact CD1-CD1 4.42Å; L468-L612 HydrophobicContact CD2-CD1 4.18Å; L468-L612 HydrophobicContact CD2-CD2 3.73Å; L468-L612 HydrophobicContact CG-CD1 4.05Å; L468-L612 HydrophobicContact CG-CD2 4.47Å; I471-L612 HydrophobicContact CD1-CB 4.08Å; I471-L612 HydrophobicContact CD1-CD2 3.74Å; I471-L612 HydrophobicContact CD1-CG 4.47Å; Y548-L612 HydrophobicContact CD1-CD2 4.15Å; Y548-L612 HydrophobicContact CE1-CD2 3.47Å; Y548-L612 VanDerWaalsContact CE1-CD2 3.47Å; V608-L612 HydrophobicContact CG1-CD1 4.07Å; V608-L612 HydrophobicContact CG1-CG 4.39Å; V608-L612 WeakPolarHBondContact O-CG 3.37Å; V608-L612 PolarHBondContact O-N 3.37Å; L609-L612 PolarHBondContact O-N 3.39Å; T610-L612 PolarHBondContact O-N 2.99Å; L612-Q615 WeakPolarHBondContact O-CB 3.47Å; L612-Q615 PolarHBondContact O-N 3.27Å; L612-L616 PolarHBondContact O-N 3.47Å
613	R	96.3	Very high	94	Very high	14 Å²	14	20.1 Å²	20.1	5%	0.053	11%	0.111	C	C	.	.	H	α-helix	trans	-57	-49.4	171.1	173.3	-158.5	65.3	-148.5	-7.8	111	S420 L421 F424 L609 T610 Q615 L616 L617	S420-R613 PolarHBondContact OG-NH1 3.38Å; L421-R613 HydrophobicContact CD1-CB 4Å; L421-R613 HydrophobicContact CD1-CG 4.33Å; F424-R613 HydrophobicContact CB-CG 4.15Å; F424-R613 HydrophobicContact CD1-CB 4.4Å; F424-R613 HydrophobicContact CD1-CG 3.66Å; F424-R613 HydrophobicContact CD2-CG 3.73Å; F424-R613 HydrophobicContact CE1-CB 4.38Å; F424-R613 HydrophobicContact CE1-CG 3.9Å; F424-R613 HydrophobicContact CE2-CG 3.98Å; F424-R613 HydrophobicContact CG-CG 3.57Å; F424-R613 HydrophobicContact CZ-CG 4.06Å; L609-R613 WeakPolarHBondContact O-CB 3.39Å; L609-R613 PolarHBondContact O-N 3.47Å; T610-R613 WeakPolarHBondContact O-CB 3.45Å; T610-R613 PolarHBondContact O-N 3.17Å; R613-Q615 VanDerWaalsContact C-N 3.28Å; R613-Q615 PolarHBondContact O-N 3.38Å; R613-L616 WeakPolarHBondContact O-CB 3.49Å; R613-L616 PolarHBondContact O-N 3.08Å; R613-L616 VanDerWaalsContact O-N 3.08Å; R613-L617 PolarHBondContact O-N 3.01Å
614	D	95.6	Very high	93.7	Very high	45 Å²	45	21 Å²	21	24%	0.241	12%	0.115	C	C	.	.	H	α-helix	trans	-67.1	-34.1	-176.9	-63.6	-16.1	0	0	0	110.8	Q577 T610 V611 L616 L617 T618	Q577-D614 HydrophobicContact CB-CB 4.22Å; Q577-D614 HydrophobicContact CG-CB 3.77Å; T610-D614 WeakPolarHBondContact O-CB 3.49Å; T610-D614 PolarHBondContact O-N 3.33Å; V611-D614 PolarHBondContact O-N 3.17Å; D614-L616 PolarHBondContact O-N 3.12Å; D614-L617 PolarHBondContact O-N 2.9Å; D614-T618 PolarHBondContact O-N 2.76Å
615	Q	94.2	Very high	93.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.1	-44.3	170.4	-175.4	70.4	42.8	0	0	111.5	I471 Y548 D576 Q577 V611 L612 R613 L617 T618 F619	I471-Q615 HydrophobicContact CD1-CB 4.22Å; I471-Q615 HydrophobicContact CD1-CG 4.25Å; I471-Q615 HydrophobicContact CG1-CG 4.47Å; Y548-Q615 WeakPolarHBondContact OH-CG 3.49Å; D576-Q615 PolarHBondContact OD1-NE2 3.23Å; Q577-Q615 HydrophobicContact CB-CB 4.3Å; V611-Q615 WeakPolarHBondContact O-CB 3.32Å; V611-Q615 PolarHBondContact O-N 3.04Å; L612-Q615 WeakPolarHBondContact O-CB 3.47Å; L612-Q615 PolarHBondContact O-N 3.27Å; R613-Q615 VanDerWaalsContact C-N 3.28Å; R613-Q615 PolarHBondContact O-N 3.38Å; Q615-L617 PolarHBondContact O-N 3.04Å; Q615-T618 PolarHBondContact NE2-OG1 2.86Å; Q615-T618 WeakPolarHBondContact O-CB 3.43Å; Q615-T618 PolarHBondContact O-N 3.21Å; Q615-T618 PolarHBondContact O-OG1 2.78Å; Q615-F619 HydrophobicContact CG-CE2 4Å; Q615-F619 VanDerWaalsContact O-CD2 3.29Å; Q615-F619 WeakPolarHBondContact O-CD2 3.46Å
616	L	95.4	Very high	93.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.8	-37.5	177.8	-74.6	166.8	0	0	0	112	F424 L432 L467 R470 I471 L474 L612 R613 D614 T618 F619 F622	F424-L616 HydrophobicContact CE1-CD1 4.08Å; F424-L616 HydrophobicContact CZ-CB 3.96Å; F424-L616 HydrophobicContact CZ-CD1 3.89Å; L432-L616 HydrophobicContact CD2-CD1 3.87Å; L467-L616 HydrophobicContact CD2-CD1 3.64Å; R470-L616 HydrophobicContact CB-CD2 4.12Å; R470-L616 HydrophobicContact CG-CD2 3.86Å; I471-L616 HydrophobicContact CD1-CG 4.3Å; I471-L616 HydrophobicContact CG1-CD2 3.57Å; I471-L616 HydrophobicContact CG1-CG 3.77Å; L474-L616 HydrophobicContact CD1-CD2 3.93Å; L612-L616 PolarHBondContact O-N 3.47Å; R613-L616 WeakPolarHBondContact O-CB 3.49Å; R613-L616 PolarHBondContact O-N 3.08Å; R613-L616 VanDerWaalsContact O-N 3.08Å; D614-L616 PolarHBondContact O-N 3.12Å; L616-T618 PolarHBondContact O-N 2.95Å; L616-F619 PolarHBondContact O-N 2.88Å; L616-F622 HydrophobicContact CB-CD2 4.3Å; L616-F622 HydrophobicContact CB-CE1 4.39Å; L616-F622 HydrophobicContact CB-CE2 4.07Å; L616-F622 HydrophobicContact CB-CZ 4.13Å; L616-F622 HydrophobicContact CD1-CZ 4.39Å; L616-F622 HydrophobicContact CD2-CE2 3.74Å; L616-F622 HydrophobicContact CD2-CZ 4.04Å; L616-F622 HydrophobicContact CG-CE2 4.43Å; L616-F622 HydrophobicContact CG-CZ 4.44Å; L616-F622 WeakPolarHBondContact O-CB 3.33Å; L616-F622 VanDerWaalsContact O-CD2 3.27Å; L616-F622 WeakPolarHBondContact O-CD2 3.44Å; L616-F622 WeakPolarHBondContact O-CG 3.5Å
617	L	91.9	Very high	92.8	Very high	60 Å²	60	29.6 Å²	29.6	31%	0.314	16%	0.155	S	C	.	.	H	α-helix	trans	-67.2	-14.2	176.8	-66.7	173.7	0	0	0	113.9	F424 Y428 R613 D614 Q615 R623	F424-L617 HydrophobicContact CD2-CD2 4.18Å; F424-L617 HydrophobicContact CD2-CG 4.46Å; F424-L617 HydrophobicContact CE2-CD2 3.76Å; F424-L617 HydrophobicContact CE2-CG 4Å; Y428-L617 HydrophobicContact CE2-CD2 4.36Å; R613-L617 PolarHBondContact O-N 3.01Å; D614-L617 PolarHBondContact O-N 2.9Å; Q615-L617 PolarHBondContact O-N 3.04Å; L617-R623 VanDerWaalsContact O-CG 3.3Å; L617-R623 WeakPolarHBondContact O-CG 3.37Å
618	T	90.1	Very high	92.6	Very high	3 Å²	3	36 Å²	36	2%	0.018	18%	0.177	C	C	.	.	H	α-helix	trans	-78.5	-23.4	174	71.7	0	0	0	0	113.5	Q577 D614 Q615 L616	Q577-T618 HydrophobicContact CG-CG2 4.03Å; D614-T618 PolarHBondContact O-N 2.76Å; Q615-T618 PolarHBondContact NE2-OG1 2.86Å; Q615-T618 WeakPolarHBondContact O-CB 3.43Å; Q615-T618 PolarHBondContact O-N 3.21Å; Q615-T618 PolarHBondContact O-OG1 2.78Å; L616-T618 PolarHBondContact O-N 2.95Å
619	F	91.1	Very high	92.3	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	18%	0.181	C	C	.	.	S	Bend	trans	-77.1	147.5	-176.1	-68.6	-86.3	0	0	0	112.6	I471 L474 Q475 E478 Q615 L616 A621 F622 R623	I471-F619 HydrophobicContact CG1-CE2 4.44Å; I471-F619 HydrophobicContact CG2-CE2 4.36Å; I471-F619 HydrophobicContact CG2-CZ 4.26Å; L474-F619 HydrophobicContact CB-CD1 3.61Å; L474-F619 HydrophobicContact CB-CD2 4.37Å; L474-F619 HydrophobicContact CB-CE1 3.64Å; L474-F619 HydrophobicContact CB-CE2 4.39Å; L474-F619 HydrophobicContact CB-CG 3.99Å; L474-F619 HydrophobicContact CB-CZ 4.06Å; L474-F619 HydrophobicContact CD1-CB 4.04Å; L474-F619 HydrophobicContact CD1-CD1 4.37Å; L474-F619 HydrophobicContact CD1-CD2 3.94Å; L474-F619 HydrophobicContact CD1-CE2 4.45Å; L474-F619 HydrophobicContact CD1-CG 3.88Å; L474-F619 HydrophobicContact CG-CG 4.48Å; Q475-F619 HydrophobicContact CG-CE1 3.94Å; Q475-F619 HydrophobicContact CG-CZ 3.67Å; E478-F619 VanDerWaalsContact CD-CD1 3.49Å; E478-F619 HydrophobicContact CG-CD1 4.41Å; E478-F619 WeakPolarHBondContact OE1-CD1 3.32Å; E478-F619 WeakPolarHBondContact OE2-CD1 3.33Å; E478-F619 VanDerWaalsContact OE2-CE1 3.27Å; E478-F619 WeakPolarHBondContact OE2-CE1 3.44Å; Q615-F619 HydrophobicContact CG-CE2 4Å; Q615-F619 VanDerWaalsContact O-CD2 3.29Å; Q615-F619 WeakPolarHBondContact O-CD2 3.46Å; L616-F619 PolarHBondContact O-N 2.88Å; F619-A621 PolarHBondContact O-N 3.36Å; F619-A621 VanDerWaalsContact O-N 3.16Å; F619-F622 PolarHBondContact O-N 3.48Å; F619-R623 PolarHBondContact O-N 2.86Å; F619-R623 VanDerWaalsContact O-N 3.12Å
620	T	88.8	Confident	91.7	Very high	49 Å²	49	39.2 Å²	39.2	30%	0.301	19%	0.194	S	C	.	.	H	α-helix	trans	-52.6	-40.9	180	-40.8	0	0	0	0	113	S567 F622 R623 V624	S567-T620 WeakPolarHBondContact O-CB 3.34Å; S567-T620 WeakPolarHBondContact O-CG2 3.34Å; S567-T620 PolarHBondContact O-OG1 2.92Å; T620-F622 VanDerWaalsContact C-N 3.34Å; T620-F622 PolarHBondContact O-N 3.05Å; T620-R623 PolarHBondContact O-N 3.05Å; T620-V624 HydrophobicContact CG2-CG2 3.89Å; T620-V624 WeakPolarHBondContact O-CB 3.42Å; T620-V624 VanDerWaalsContact O-CG2 3.28Å; T620-V624 WeakPolarHBondContact O-CG2 3.22Å; T620-V624 PolarHBondContact O-N 3.22Å
621	A	90.4	Very high	91.2	Very high	37 Å²	37	42.5 Å²	42.5	31%	0.306	21%	0.208	S	C	.	.	H	α-helix	trans	-58.8	-44.4	-176.4	0	0	0	0	0	112.1	M431 L474 F619 R625	M431-A621 HydrophobicContact CE-CB 3.83Å; L474-A621 HydrophobicContact CD2-CB 3.96Å; F619-A621 PolarHBondContact O-N 3.36Å; F619-A621 VanDerWaalsContact O-N 3.16Å; A621-R625 PolarHBondContact O-N 3.19Å
622	F	92.6	Very high	90.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-75.6	-43.3	179.4	-76.3	-96.5	0	0	0	111.4	F424 Y428 M431 L432 R470 L474 L616 F619 T620 V624 R625 L626	F424-F622 HydrophobicContact CE2-CD1 4.02Å; F424-F622 AromaticContact CE2-CE1 3.94Å; F424-F622 HydrophobicContact CE2-CE1 3.94Å; F424-F622 HydrophobicContact CZ-CD1 4.16Å; F424-F622 AromaticContact CZ-CE1 3.64Å; F424-F622 HydrophobicContact CZ-CE1 3.64Å; F424-F622 HydrophobicContact CZ-CZ 4.37Å; Y428-F622 AromaticContact CD1-CD1 3.46Å; Y428-F622 HydrophobicContact CD1-CD1 3.46Å; Y428-F622 VanDerWaalsContact CD1-CD1 3.46Å; Y428-F622 AromaticContact CD1-CE1 3.66Å; Y428-F622 HydrophobicContact CD1-CE1 3.66Å; Y428-F622 HydrophobicContact CD2-CD1 4.19Å; Y428-F622 HydrophobicContact CD2-CE1 4.19Å; Y428-F622 AromaticContact CE1-CD1 3.66Å; Y428-F622 HydrophobicContact CE1-CD1 3.66Å; Y428-F622 HydrophobicContact CE1-CE1 4.31Å; Y428-F622 HydrophobicContact CE2-CD1 4.38Å; Y428-F622 AromaticContact CG-CD1 3.76Å; Y428-F622 HydrophobicContact CG-CD1 3.76Å; Y428-F622 AromaticContact CG-CE1 3.58Å; Y428-F622 HydrophobicContact CG-CE1 3.58Å; M431-F622 HydrophobicContact CB-CZ 4.27Å; M431-F622 HydrophobicContact CE-CD1 4.1Å; M431-F622 HydrophobicContact CE-CD2 3.75Å; M431-F622 HydrophobicContact CE-CE1 4.17Å; M431-F622 HydrophobicContact CE-CE2 3.8Å; M431-F622 HydrophobicContact CE-CG 3.9Å; M431-F622 HydrophobicContact CE-CZ 4.01Å; L432-F622 HydrophobicContact CD2-CZ 4.01Å; R470-F622 HydrophobicContact CG-CE2 4.41Å; R470-F622 HydrophobicContact CG-CZ 4.49Å; L474-F622 HydrophobicContact CD1-CD2 4.11Å; L474-F622 HydrophobicContact CD1-CE2 3.75Å; L616-F622 HydrophobicContact CB-CD2 4.3Å; L616-F622 HydrophobicContact CB-CE1 4.39Å; L616-F622 HydrophobicContact CB-CE2 4.07Å; L616-F622 HydrophobicContact CB-CZ 4.13Å; L616-F622 HydrophobicContact CD1-CZ 4.39Å; L616-F622 HydrophobicContact CD2-CE2 3.74Å; L616-F622 HydrophobicContact CD2-CZ 4.04Å; L616-F622 HydrophobicContact CG-CE2 4.43Å; L616-F622 HydrophobicContact CG-CZ 4.44Å; L616-F622 WeakPolarHBondContact O-CB 3.33Å; L616-F622 VanDerWaalsContact O-CD2 3.27Å; L616-F622 WeakPolarHBondContact O-CD2 3.44Å; L616-F622 WeakPolarHBondContact O-CG 3.5Å; F619-F622 PolarHBondContact O-N 3.48Å; T620-F622 VanDerWaalsContact C-N 3.34Å; T620-F622 PolarHBondContact O-N 3.05Å; F622-V624 PolarHBondContact O-N 3.29Å; F622-R625 WeakPolarHBondContact O-CB 3.33Å; F622-R625 PolarHBondContact O-N 2.79Å; F622-L626 PolarHBondContact O-N 2.91Å
623	R	89.6	Confident	90.3	Very high	76 Å²	76	48 Å²	48	29%	0.287	23%	0.228	S	C	.	.	H	α-helix	trans	-58.7	-48.8	177.1	-70.8	-174.2	57.5	163.1	-0.4	113	R568 G569 F571 L617 F619 T620 R625 L626 D627	R568-R623 PolarHBondContact O-NH1 3.1Å; G569-R623 PolarHBondContact O-NH1 3.38Å; F571-R623 VanDerWaalsContact CE2-NH1 3.32Å; L617-R623 VanDerWaalsContact O-CG 3.3Å; L617-R623 WeakPolarHBondContact O-CG 3.37Å; F619-R623 PolarHBondContact O-N 2.86Å; F619-R623 VanDerWaalsContact O-N 3.12Å; T620-R623 PolarHBondContact O-N 3.05Å; R623-R625 VanDerWaalsContact C-N 3.25Å; R623-R625 PolarHBondContact O-N 3.46Å; R623-L626 PolarHBondContact O-N 2.95Å; R623-L626 VanDerWaalsContact O-N 3.15Å; R623-D627 PolarHBondContact O-N 3.06Å
624	V	88.5	Confident	89.7	Confident	54 Å²	54	53.1 Å²	53.1	33%	0.327	25%	0.247	S	C	.	.	H	α-helix	trans	-63	-34.3	178.9	170.7	0	0	0	0	111.2	T620 F622 R628	T620-V624 HydrophobicContact CG2-CG2 3.89Å; T620-V624 WeakPolarHBondContact O-CB 3.42Å; T620-V624 VanDerWaalsContact O-CG2 3.28Å; T620-V624 WeakPolarHBondContact O-CG2 3.22Å; T620-V624 PolarHBondContact O-N 3.22Å; F622-V624 PolarHBondContact O-N 3.29Å; V624-R628 HydrophobicContact CG1-CG 4.43Å; V624-R628 WeakPolarHBondContact O-CB 3.42Å; V624-R628 WeakPolarHBondContact O-CG 3.44Å; V624-R628 PolarHBondContact O-N 3.03Å
625	R	90.1	Very high	89.2	Confident	75 Å²	75	54.4 Å²	54.4	28%	0.283	25%	0.254	S	S	.	.	H	α-helix	trans	-65.4	-46.2	174.1	179.1	67.5	71.5	95.8	-3.1	110.9	Y428 D430 M431 A621 F622 R623 R628 N629	Y428-R625 HydrophobicContact CD1-CG 4.27Å; Y428-R625 HydrophobicContact CE1-CB 4.16Å; Y428-R625 HydrophobicContact CE1-CG 3.8Å; D430-R625 IonicContact OD1-CZ 3.32Å; D430-R625 IonicContact OD1-NH1 3.67Å; D430-R625 PolarHBondContact OD1-NH1 2.9Å; D430-R625 IonicContact OD1-NH2 3.74Å; D430-R625 IonicContact OD2-CZ 3.12Å; D430-R625 VanDerWaalsContact OD2-CZ 3.29Å; D430-R625 IonicContact OD2-NH1 3.05Å; D430-R625 PolarHBondContact OD2-NH1 3.4Å; D430-R625 IonicContact OD2-NH2 3.44Å; D430-R625 PolarHBondContact OD2-NH2 3.29Å; M431-R625 HydrophobicContact SD-CB 4.19Å; M431-R625 HydrophobicContact SD-CG 4.19Å; A621-R625 PolarHBondContact O-N 3.19Å; F622-R625 WeakPolarHBondContact O-CB 3.33Å; F622-R625 PolarHBondContact O-N 2.79Å; R623-R625 VanDerWaalsContact C-N 3.25Å; R623-R625 PolarHBondContact O-N 3.46Å; R625-R628 PolarHBondContact O-N 3.14Å; R625-N629 VanDerWaalsContact O-CG 3.23Å; R625-N629 PolarHBondContact O-N 3.3Å; R625-N629 PolarHBondContact O-OD1 2.77Å
626	L	88.4	Confident	88.9	Confident	53 Å²	53	54.8 Å²	54.8	28%	0.277	26%	0.256	S	S	.	.	H	α-helix	trans	-61.8	-48.8	176.9	-177.4	62	0	0	0	111.7	F622 R623 R628 N629 L630 C763	F622-L626 PolarHBondContact O-N 2.91Å; R623-L626 PolarHBondContact O-N 2.95Å; R623-L626 VanDerWaalsContact O-N 3.15Å; L626-R628 VanDerWaalsContact C-N 3.33Å; L626-R628 PolarHBondContact O-N 2.79Å; L626-N629 PolarHBondContact O-N 3.36Å; L626-N629 VanDerWaalsContact O-N 3.09Å; L626-L630 HydrophobicContact CG-CD1 4.23Å; L626-L630 PolarHBondContact O-N 3.38Å; L626-C763 HydrophobicContact CD1-CB 4.39Å
627	D	87.3	Confident	88.2	Confident	89 Å²	89	57.8 Å²	57.8	48%	0.476	27%	0.267	S	S	.	.	H	α-helix	trans	-59.7	-42.1	178.7	-71	-23.3	0	0	0	111.7	R623 L630 E631	R623-D627 PolarHBondContact O-N 3.06Å; D627-L630 PolarHBondContact O-N 2.85Å; D627-E631 VanDerWaalsContact O-CB 3.31Å; D627-E631 WeakPolarHBondContact O-CB 3.17Å; D627-E631 PolarHBondContact O-N 3.48Å
628	R	90.2	Very high	87.6	Confident	172 Å²	172	57.4 Å²	57.4	65%	0.649	27%	0.267	S	S	*	.	H	α-helix	trans	-63.3	-40.4	174.4	-77.2	174.8	-176	177	4.6	112.3	V624 R625 L626 R632	V624-R628 HydrophobicContact CG1-CG 4.43Å; V624-R628 WeakPolarHBondContact O-CB 3.42Å; V624-R628 WeakPolarHBondContact O-CG 3.44Å; V624-R628 PolarHBondContact O-N 3.03Å; R625-R628 PolarHBondContact O-N 3.14Å; L626-R628 VanDerWaalsContact C-N 3.33Å; L626-R628 PolarHBondContact O-N 2.79Å; R628-R632 WeakPolarHBondContact O-CB 3.3Å; R628-R632 PolarHBondContact O-N 2.79Å
629	N	89	Confident	87.3	Confident	18 Å²	18	62 Å²	62	10%	0.096	29%	0.289	C	S	.	.	H	α-helix	trans	-66.2	-45.8	177.8	-69.9	-14.4	0	0	0	110.8	R625 L626 E631 R632 V633 L759 C763	R625-N629 VanDerWaalsContact O-CG 3.23Å; R625-N629 PolarHBondContact O-N 3.3Å; R625-N629 PolarHBondContact O-OD1 2.77Å; L626-N629 PolarHBondContact O-N 3.36Å; L626-N629 VanDerWaalsContact O-N 3.09Å; N629-E631 VanDerWaalsContact C-N 3.34Å; N629-E631 PolarHBondContact O-N 3.38Å; N629-R632 WeakPolarHBondContact O-CB 3.21Å; N629-R632 PolarHBondContact O-N 2.99Å; N629-R632 VanDerWaalsContact O-N 3.15Å; N629-V633 WeakPolarHBondContact O-CG2 3.48Å; N629-V633 PolarHBondContact O-N 3.22Å; N629-L759 HydrophobicContact CB-CD2 4.06Å; N629-C763 VanDerWaalsContact CB-SG 3.5Å
630	L	85.3	Confident	86.8	Confident	49 Å²	49	63.1 Å²	63.1	26%	0.257	29%	0.294	S	S	.	.	H	α-helix	trans	-61	-41.2	175.8	-72.7	172.9	0	0	0	112.1	L626 D627 R632 V633 R634 C763 I765	L626-L630 HydrophobicContact CG-CD1 4.23Å; L626-L630 PolarHBondContact O-N 3.38Å; D627-L630 PolarHBondContact O-N 2.85Å; L630-R632 VanDerWaalsContact C-N 3.31Å; L630-R632 PolarHBondContact O-N 3.08Å; L630-V633 WeakPolarHBondContact O-CB 3.37Å; L630-V633 PolarHBondContact O-N 3.29Å; L630-R634 WeakPolarHBondContact O-CG 3.46Å; L630-R634 PolarHBondContact O-N 3.24Å; L630-C763 HydrophobicContact CD2-CB 3.83Å; L630-C763 HydrophobicContact CG-CB 4.49Å; L630-I765 HydrophobicContact CD2-CD1 4.29Å
631	E	85.8	Confident	86.3	Confident	84 Å²	84	67.6 Å²	67.6	39%	0.393	31%	0.306	S	S	.	.	H	α-helix	trans	-65.3	-37.2	175.7	-173.6	51.7	-147.9	0	0	111.7	D627 N629 R634 N635	D627-E631 VanDerWaalsContact O-CB 3.31Å; D627-E631 WeakPolarHBondContact O-CB 3.17Å; D627-E631 PolarHBondContact O-N 3.48Å; N629-E631 VanDerWaalsContact C-N 3.34Å; N629-E631 PolarHBondContact O-N 3.38Å; E631-R634 PolarHBondContact O-N 3.02Å; E631-R634 IonicContact OE2-NH1 3.24Å; E631-R634 PolarHBondContact OE2-NH1 3.24Å; E631-N635 WeakPolarHBondContact O-CB 3.43Å; E631-N635 PolarHBondContact O-N 2.86Å; E631-N635 PolarHBondContact O-ND2 3.32Å; E631-N635 PolarHBondContact OE1-ND2 3.07Å
632	R	90.7	Very high	85.9	Confident	124 Å²	124	71.5 Å²	71.5	47%	0.468	32%	0.317	S	S	.	.	H	α-helix	trans	-66.9	-39.1	175	-163.9	172	167.4	-175.9	-7	111.9	R628 N629 L630 N635 L636 E755 L759	R628-R632 WeakPolarHBondContact O-CB 3.3Å; R628-R632 PolarHBondContact O-N 2.79Å; N629-R632 WeakPolarHBondContact O-CB 3.21Å; N629-R632 PolarHBondContact O-N 2.99Å; N629-R632 VanDerWaalsContact O-N 3.15Å; L630-R632 VanDerWaalsContact C-N 3.31Å; L630-R632 PolarHBondContact O-N 3.08Å; R632-N635 PolarHBondContact O-N 3.43Å; R632-L636 HydrophobicContact CG-CD1 4.49Å; R632-L636 WeakPolarHBondContact O-CB 3.33Å; R632-L636 VanDerWaalsContact O-CG 3.31Å; R632-L636 WeakPolarHBondContact O-CG 3.39Å; R632-L636 PolarHBondContact O-N 3.35Å; R632-E755 IonicContact CZ-OE1 2.74Å; R632-E755 IonicContact NE-OE1 2.68Å; R632-E755 PolarHBondContact NE-OE1 2.88Å; R632-E755 IonicContact NH2-OE1 4Å; R632-E755 PolarHBondContact NH2-OE1 2.64Å; R632-E755 IonicContact NH2-OE2 3.98Å; R632-L759 HydrophobicContact CB-CD1 3.88Å; R632-L759 HydrophobicContact CG-CD1 3.58Å
633	V	84.5	Confident	85.3	Confident	6 Å²	6	72.2 Å²	72.2	4%	0.036	32%	0.321	C	S	.	.	H	α-helix	trans	-56.2	-50	170.7	167.8	0	0	0	0	110.7	N629 L630 N635 L636 R637 L756 L759 I765	N629-V633 WeakPolarHBondContact O-CG2 3.48Å; N629-V633 PolarHBondContact O-N 3.22Å; L630-V633 WeakPolarHBondContact O-CB 3.37Å; L630-V633 PolarHBondContact O-N 3.29Å; V633-N635 PolarHBondContact O-N 2.85Å; V633-L636 PolarHBondContact O-N 3.11Å; V633-R637 WeakPolarHBondContact O-CG 3.49Å; V633-R637 PolarHBondContact O-N 2.79Å; V633-R637 VanDerWaalsContact O-N 3.07Å; V633-L756 HydrophobicContact CB-CD1 4.12Å; V633-L756 HydrophobicContact CG1-CD1 3.76Å; V633-L756 HydrophobicContact CG2-CD1 4.18Å; V633-L759 HydrophobicContact CG2-CB 3.58Å; V633-L759 HydrophobicContact CG2-CD1 4.34Å; V633-I765 HydrophobicContact CG1-CD1 4.36Å
634	R	84.1	Confident	84.7	Confident	121 Å²	121	72.3 Å²	72.3	46%	0.457	33%	0.332	S	S	.	.	H	α-helix	trans	-59.9	-47.1	177.5	-67.5	179.6	-165.4	127.4	1.6	112	L630 E631 L636 R637 V638	L630-R634 WeakPolarHBondContact O-CG 3.46Å; L630-R634 PolarHBondContact O-N 3.24Å; E631-R634 PolarHBondContact O-N 3.02Å; E631-R634 IonicContact OE2-NH1 3.24Å; E631-R634 PolarHBondContact OE2-NH1 3.24Å; R634-L636 PolarHBondContact O-N 3.38Å; R634-R637 PolarHBondContact O-N 2.92Å; R634-V638 WeakPolarHBondContact O-CG2 3.34Å; R634-V638 PolarHBondContact O-N 3.07Å
635	N	86.2	Confident	84.3	Confident	72 Å²	72	74.5 Å²	74.5	39%	0.385	35%	0.345	S	S	.	.	H	α-helix	trans	-63.5	-39.8	-179.3	-77.7	-56.5	0	0	0	112.5	E631 R632 V633 V638 Q639	E631-N635 WeakPolarHBondContact O-CB 3.43Å; E631-N635 PolarHBondContact O-N 2.86Å; E631-N635 PolarHBondContact O-ND2 3.32Å; E631-N635 PolarHBondContact OE1-ND2 3.07Å; R632-N635 PolarHBondContact O-N 3.43Å; V633-N635 PolarHBondContact O-N 2.85Å; N635-V638 PolarHBondContact O-N 3.43Å; N635-Q639 VanDerWaalsContact O-CG 3.31Å; N635-Q639 WeakPolarHBondContact O-CG 3.14Å; N635-Q639 PolarHBondContact O-N 2.88Å
636	L	86.9	Confident	84	Confident	7 Å²	7	72.2 Å²	72.2	4%	0.037	34%	0.339	C	S	.	.	H	α-helix	trans	-63.5	-45.9	174.6	-74.1	168.1	0	0	0	111.6	R632 V633 R634 V638 Q639 M640 M752 E755 L756 L759	R632-L636 HydrophobicContact CG-CD1 4.49Å; R632-L636 WeakPolarHBondContact O-CB 3.33Å; R632-L636 VanDerWaalsContact O-CG 3.31Å; R632-L636 WeakPolarHBondContact O-CG 3.39Å; R632-L636 PolarHBondContact O-N 3.35Å; V633-L636 PolarHBondContact O-N 3.11Å; R634-L636 PolarHBondContact O-N 3.38Å; L636-V638 VanDerWaalsContact C-N 3.31Å; L636-V638 PolarHBondContact O-N 3.02Å; L636-Q639 PolarHBondContact O-N 3.36Å; L636-Q639 VanDerWaalsContact O-N 3.17Å; L636-M640 WeakPolarHBondContact O-CG 3.48Å; L636-M640 PolarHBondContact O-N 3.28Å; L636-M752 HydrophobicContact CD2-CB 4.23Å; L636-M752 HydrophobicContact CD2-CG 3.97Å; L636-E755 HydrophobicContact CD1-CB 4Å; L636-E755 HydrophobicContact CD1-CG 3.71Å; L636-L756 HydrophobicContact CB-CD1 4.24Å; L636-L756 HydrophobicContact CD1-CB 4.41Å; L636-L756 HydrophobicContact CD1-CD1 4.34Å; L636-L759 HydrophobicContact CD1-CD1 3.57Å
637	R	80.9	Confident	83.9	Confident	63 Å²	63	72.1 Å²	72.1	24%	0.238	34%	0.338	C	S	.	.	H	α-helix	trans	-58.4	-42	175.7	-71.2	-177.5	179.2	-176.2	2.9	111.9	D273 V633 R634 M640 R641 L756	D273-R637 IonicContact OD1-CZ 3.2Å; D273-R637 IonicContact OD1-NH1 2.76Å; D273-R637 PolarHBondContact OD1-NH1 2.97Å; D273-R637 IonicContact OD1-NH2 3.44Å; D273-R637 PolarHBondContact OD1-NH2 3.07Å; V633-R637 WeakPolarHBondContact O-CG 3.49Å; V633-R637 PolarHBondContact O-N 2.79Å; V633-R637 VanDerWaalsContact O-N 3.07Å; R634-R637 PolarHBondContact O-N 2.92Å; R637-M640 PolarHBondContact O-N 3.28Å; R637-R641 PolarHBondContact O-N 3.26Å; R637-R641 VanDerWaalsContact O-N 3.12Å; R637-L756 HydrophobicContact CG-CD1 4.31Å; R637-L756 HydrophobicContact CG-CD2 4.16Å
638	V	78.9	Confident	83.8	Confident	53 Å²	53	71.1 Å²	71.1	32%	0.321	34%	0.338	S	S	.	.	H	α-helix	trans	-62.8	-47	174.5	172	0	0	0	0	111.4	R634 N635 L636 M640 R641 H642	R634-V638 WeakPolarHBondContact O-CG2 3.34Å; R634-V638 PolarHBondContact O-N 3.07Å; N635-V638 PolarHBondContact O-N 3.43Å; L636-V638 VanDerWaalsContact C-N 3.31Å; L636-V638 PolarHBondContact O-N 3.02Å; V638-M640 VanDerWaalsContact C-N 3.33Å; V638-M640 PolarHBondContact O-N 3.38Å; V638-R641 PolarHBondContact O-N 2.87Å; V638-H642 PolarHBondContact O-CD2 3.47Å; V638-H642 PolarHBondContact O-N 3.5Å
639	Q	83.8	Confident	83.8	Confident	100 Å²	100	66.6 Å²	66.6	47%	0.467	32%	0.321	S	S	.	.	H	α-helix	trans	-62.1	-38.2	178.4	-73.9	179.9	40.9	0	0	112.8	N635 L636 H642 M643 M752	N635-Q639 VanDerWaalsContact O-CG 3.31Å; N635-Q639 WeakPolarHBondContact O-CG 3.14Å; N635-Q639 PolarHBondContact O-N 2.88Å; L636-Q639 PolarHBondContact O-N 3.36Å; L636-Q639 VanDerWaalsContact O-N 3.17Å; Q639-H642 WeakPolarHBondContact O-CB 3.45Å; Q639-H642 PolarHBondContact O-N 3.34Å; Q639-M643 PolarHBondContact O-N 3.38Å; Q639-M752 HydrophobicContact CB-SD 3.75Å
640	M	81.2	Confident	83.8	Confident	23 Å²	23	65.9 Å²	65.9	11%	0.113	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-45.9	174.8	-72.6	-174.5	66.6	0	0	111.6	L636 R637 V638 H642 M643 C644 M752 V753 F877	L636-M640 WeakPolarHBondContact O-CG 3.48Å; L636-M640 PolarHBondContact O-N 3.28Å; R637-M640 PolarHBondContact O-N 3.28Å; V638-M640 VanDerWaalsContact C-N 3.33Å; V638-M640 PolarHBondContact O-N 3.38Å; M640-H642 VanDerWaalsContact C-N 3.28Å; M640-H642 PolarHBondContact O-N 3.42Å; M640-M643 WeakPolarHBondContact O-CB 3.28Å; M640-M643 PolarHBondContact O-N 3.27Å; M640-C644 PolarHBondContact O-N 3.36Å; M640-C644 VanDerWaalsContact O-N 3.08Å; M640-C644 PolarHBondContact O-SG 3.31Å; M640-M752 HydrophobicContact CG-CB 3.81Å; M640-M752 HydrophobicContact CG-CE 4.43Å; M640-M752 HydrophobicContact CG-CG 4.42Å; M640-M752 HydrophobicContact CG-SD 3.78Å; M640-M752 HydrophobicContact SD-CB 4.03Å; M640-V753 HydrophobicContact CE-CG2 3.57Å; M640-V753 HydrophobicContact SD-CG2 4.18Å; M640-F877 HydrophobicContact CE-CE2 3.5Å; M640-F877 HydrophobicContact CE-CZ 3.45Å; M640-F877 VanDerWaalsContact CE-CZ 3.45Å; M640-F877 HydrophobicContact SD-CE2 4.43Å; M640-F877 HydrophobicContact SD-CZ 3.84Å
641	R	78.2	Confident	84.1	Confident	144 Å²	144	65.8 Å²	65.8	54%	0.543	32%	0.316	S	S	.	.	H	α-helix	trans	-56.7	-42	172.8	-73.1	-170.4	-70	-103.5	5.7	111.9	R637 V638 M643 C644 V645	R637-R641 PolarHBondContact O-N 3.26Å; R637-R641 VanDerWaalsContact O-N 3.12Å; V638-R641 PolarHBondContact O-N 2.87Å; R641-M643 VanDerWaalsContact C-N 3.31Å; R641-M643 PolarHBondContact O-N 2.95Å; R641-C644 PolarHBondContact O-N 3.33Å; R641-V645 WeakPolarHBondContact O-CG2 3.36Å; R641-V645 PolarHBondContact O-N 2.99Å
642	H	81.1	Confident	84.2	Confident	118 Å²	118	68 Å²	68	55%	0.546	32%	0.324	S	S	.	.	H	α-helix	trans	-61	-35.8	174.6	-75.6	-68.6	0	0	0	113.1	V638 Q639 M640 L646	V638-H642 PolarHBondContact O-CD2 3.47Å; V638-H642 PolarHBondContact O-N 3.5Å; Q639-H642 WeakPolarHBondContact O-CB 3.45Å; Q639-H642 PolarHBondContact O-N 3.34Å; M640-H642 VanDerWaalsContact C-N 3.28Å; M640-H642 PolarHBondContact O-N 3.42Å; H642-L646 VanDerWaalsContact O-CB 3.25Å; H642-L646 WeakPolarHBondContact O-CB 3.48Å; H642-L646 PolarHBondContact O-N 3.31Å
643	M	81.6	Confident	84.2	Confident	16 Å²	16	64.6 Å²	64.6	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-69.1	-39.6	175.7	-67.5	-56.3	89.3	0	0	112.5	Q639 M640 R641 L646 D647 L745 M752	Q639-M643 PolarHBondContact O-N 3.38Å; M640-M643 WeakPolarHBondContact O-CB 3.28Å; M640-M643 PolarHBondContact O-N 3.27Å; R641-M643 VanDerWaalsContact C-N 3.31Å; R641-M643 PolarHBondContact O-N 2.95Å; M643-L646 HydrophobicContact CE-CD2 3.88Å; M643-L646 PolarHBondContact O-N 2.66Å; M643-L646 HydrophobicContact SD-CD2 4.29Å; M643-D647 PolarHBondContact O-N 3.4Å; M643-L745 HydrophobicContact CB-CD2 4.41Å; M643-L745 HydrophobicContact CG-CD2 4.49Å; M643-L745 HydrophobicContact SD-CD2 3.64Å; M643-M752 HydrophobicContact CG-CE 3.63Å
644	C	75.5	Confident	84.6	Confident	78 Å²	78	64.3 Å²	64.3	53%	0.527	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-43	174.8	-62.5	0	0	0	0	112	M640 R641 L646 D647 S648	M640-C644 PolarHBondContact O-N 3.36Å; M640-C644 VanDerWaalsContact O-N 3.08Å; M640-C644 PolarHBondContact O-SG 3.31Å; R641-C644 PolarHBondContact O-N 3.33Å; C644-L646 VanDerWaalsContact C-N 3.34Å; C644-D647 PolarHBondContact O-N 3.32Å; C644-S648 PolarHBondContact O-N 3.24Å; C644-S648 VanDerWaalsContact O-N 3.11Å; C644-S648 PolarHBondContact O-OG 3.36Å
645	V	80	Confident	84.9	Confident	99 Å²	99	60.7 Å²	60.7	60%	0.6	30%	0.303	S	S	*	.	H	α-helix	trans	-63.3	-41.7	174.6	173.3	0	0	0	0	110.8	R641 S648 R649	R641-V645 WeakPolarHBondContact O-CG2 3.36Å; R641-V645 PolarHBondContact O-N 2.99Å; V645-S648 PolarHBondContact O-N 2.72Å; V645-R649 WeakPolarHBondContact O-CB 3.36Å; V645-R649 PolarHBondContact O-N 2.94Å
646	L	84.4	Confident	85.1	Confident	28 Å²	28	60.4 Å²	60.4	15%	0.147	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-41.9	178.4	-174.2	63	0	0	0	112.3	H642 M643 C644 R649 F650 L745	H642-L646 VanDerWaalsContact O-CB 3.25Å; H642-L646 WeakPolarHBondContact O-CB 3.48Å; H642-L646 PolarHBondContact O-N 3.31Å; M643-L646 HydrophobicContact CE-CD2 3.88Å; M643-L646 PolarHBondContact O-N 2.66Å; M643-L646 HydrophobicContact SD-CD2 4.29Å; C644-L646 VanDerWaalsContact C-N 3.34Å; L646-R649 WeakPolarHBondContact O-CB 3.28Å; L646-R649 PolarHBondContact O-N 2.97Å; L646-F650 HydrophobicContact CD1-CD1 4.48Å; L646-F650 HydrophobicContact CD1-CE1 3.71Å; L646-F650 HydrophobicContact CD1-CE2 3.99Å; L646-F650 HydrophobicContact CD1-CZ 3.4Å; L646-F650 HydrophobicContact CD2-CE2 3.96Å; L646-F650 HydrophobicContact CD2-CZ 3.9Å; L646-F650 HydrophobicContact CG-CD2 4.26Å; L646-F650 HydrophobicContact CG-CE1 4.23Å; L646-F650 HydrophobicContact CG-CE2 3.55Å; L646-F650 HydrophobicContact CG-CZ 3.5Å; L646-F650 WeakPolarHBondContact O-CD2 3.47Å; L646-F650 WeakPolarHBondContact O-CG 3.28Å; L646-F650 PolarHBondContact O-N 2.97Å; L646-L745 HydrophobicContact CD2-CD2 4.11Å
647	D	87.5	Confident	85.3	Confident	50 Å²	50	60.2 Å²	60.2	27%	0.267	30%	0.303	S	S	.	.	H	α-helix	trans	-64.1	-45.6	176.7	-166.2	35.4	0	0	0	111.9	M643 C644 R649 F650 E651 R738 L745	M643-D647 PolarHBondContact O-N 3.4Å; C644-D647 PolarHBondContact O-N 3.32Å; D647-R649 PolarHBondContact O-N 2.92Å; D647-F650 PolarHBondContact O-N 3.33Å; D647-F650 VanDerWaalsContact O-N 3.17Å; D647-E651 PolarHBondContact O-N 2.81Å; D647-R738 IonicContact OD1-CZ 2.73Å; D647-R738 IonicContact OD1-NH1 2.64Å; D647-R738 PolarHBondContact OD1-NH1 2.96Å; D647-R738 IonicContact OD1-NH2 2.75Å; D647-R738 PolarHBondContact OD1-NH2 3.1Å; D647-R738 IonicContact OD2-NH2 3.15Å; D647-L745 HydrophobicContact CB-CD1 3.68Å
648	S	85.2	Confident	85.7	Confident	68 Å²	68	59.7 Å²	59.7	48%	0.476	30%	0.301	S	S	.	.	H	α-helix	trans	-57.3	-40.3	176.8	-62.3	0	0	0	0	111.4	C644 V645 E651 K652	C644-S648 PolarHBondContact O-N 3.24Å; C644-S648 VanDerWaalsContact O-N 3.11Å; C644-S648 PolarHBondContact O-OG 3.36Å; V645-S648 PolarHBondContact O-N 2.72Å; S648-E651 PolarHBondContact O-N 2.77Å; S648-K652 WeakPolarHBondContact O-CG 3.18Å; S648-K652 PolarHBondContact O-N 2.72Å; S648-K652 VanDerWaalsContact O-N 3.15Å
649	R	88.8	Confident	86.1	Confident	77 Å²	77	64.5 Å²	64.5	29%	0.291	32%	0.318	S	S	.	.	H	α-helix	trans	-64.7	-49.4	175.7	-179.6	-176.8	167.1	-162.2	-9.2	112.1	V645 L646 D647 E651 K652 E653 F1229	V645-R649 WeakPolarHBondContact O-CB 3.36Å; V645-R649 PolarHBondContact O-N 2.94Å; L646-R649 WeakPolarHBondContact O-CB 3.28Å; L646-R649 PolarHBondContact O-N 2.97Å; D647-R649 PolarHBondContact O-N 2.92Å; R649-E651 VanDerWaalsContact C-N 3.25Å; R649-E651 PolarHBondContact O-N 2.74Å; R649-K652 PolarHBondContact O-N 3.45Å; R649-E653 IonicContact CZ-OE1 2.79Å; R649-E653 VanDerWaalsContact CZ-OE1 3.31Å; R649-E653 IonicContact NE-OE1 2.71Å; R649-E653 PolarHBondContact NE-OE1 3.19Å; R649-E653 IonicContact NH2-OE1 3.88Å; R649-E653 PolarHBondContact NH2-OE1 3.13Å; R649-E653 WeakPolarHBondContact O-CG 3.22Å; R649-E653 PolarHBondContact O-N 3.47Å; R649-F1229 VanDerWaalsContact NH2-CD1 3.35Å; R649-F1229 VanDerWaalsContact NH2-CE1 3.25Å
650	F	90.4	Very high	86.2	Confident	3 Å²	3	65.3 Å²	65.3	1%	0.013	32%	0.317	C	S	.	.	H	α-helix	trans	-60.1	-35.7	177.5	-66.1	-29.4	0	0	0	112.5	L646 D647 E653 A654 N722 Q741 L745	L646-F650 HydrophobicContact CD1-CD1 4.48Å; L646-F650 HydrophobicContact CD1-CE1 3.71Å; L646-F650 HydrophobicContact CD1-CE2 3.99Å; L646-F650 HydrophobicContact CD1-CZ 3.4Å; L646-F650 HydrophobicContact CD2-CE2 3.96Å; L646-F650 HydrophobicContact CD2-CZ 3.9Å; L646-F650 HydrophobicContact CG-CD2 4.26Å; L646-F650 HydrophobicContact CG-CE1 4.23Å; L646-F650 HydrophobicContact CG-CE2 3.55Å; L646-F650 HydrophobicContact CG-CZ 3.5Å; L646-F650 WeakPolarHBondContact O-CD2 3.47Å; L646-F650 WeakPolarHBondContact O-CG 3.28Å; L646-F650 PolarHBondContact O-N 2.97Å; D647-F650 PolarHBondContact O-N 3.33Å; D647-F650 VanDerWaalsContact O-N 3.17Å; F650-E653 PolarHBondContact O-N 3.05Å; F650-A654 WeakPolarHBondContact O-CB 3.26Å; F650-A654 PolarHBondContact O-N 3.31Å; F650-N722 HydrophobicContact CZ-CB 4.26Å; F650-Q741 HydrophobicContact CD2-CB 4.4Å; F650-Q741 HydrophobicContact CD2-CG 4.34Å; F650-L745 HydrophobicContact CD2-CD1 4.03Å; F650-L745 HydrophobicContact CE2-CD1 4.14Å
651	E	89.8	Confident	86.4	Confident	48 Å²	48	66.1 Å²	66.1	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-66.7	-40.8	176.5	-164.5	60.3	-137.5	0	0	112.4	D647 S648 R649 T655 R658 R738 R742	D647-E651 PolarHBondContact O-N 2.81Å; S648-E651 PolarHBondContact O-N 2.77Å; R649-E651 VanDerWaalsContact C-N 3.25Å; R649-E651 PolarHBondContact O-N 2.74Å; E651-T655 VanDerWaalsContact O-CB 3.22Å; E651-T655 WeakPolarHBondContact O-CB 3.46Å; E651-T655 PolarHBondContact O-N 3.29Å; E651-T655 PolarHBondContact O-OG1 2.88Å; E651-R658 IonicContact OE1-NH1 2.72Å; E651-R658 PolarHBondContact OE1-NH1 2.99Å; E651-R738 IonicContact OE2-CZ 3.26Å; E651-R738 VanDerWaalsContact OE2-CZ 3.25Å; E651-R738 IonicContact OE2-NE 2.7Å; E651-R738 PolarHBondContact OE2-NE 3.02Å; E651-R738 IonicContact OE2-NH2 3.4Å; E651-R738 PolarHBondContact OE2-NH2 3.3Å; E651-R742 VanDerWaalsContact CD-NH2 3.33Å; E651-R742 IonicContact OE1-NH2 2.68Å; E651-R742 IonicContact OE2-CZ 3.76Å; E651-R742 IonicContact OE2-NE 3.68Å; E651-R742 IonicContact OE2-NH2 2.7Å; E651-R742 PolarHBondContact OE2-NH2 2.85Å
652	K	88.6	Confident	86.6	Confident	130 Å²	130	61.5 Å²	61.5	57%	0.565	31%	0.311	S	S	*	.	H	α-helix	trans	-62.1	-46.2	174.4	-73.2	-179	178.4	-170.3	0	111.8	S648 R649 T655 T656	S648-K652 WeakPolarHBondContact O-CG 3.18Å; S648-K652 PolarHBondContact O-N 2.72Å; S648-K652 VanDerWaalsContact O-N 3.15Å; R649-K652 PolarHBondContact O-N 3.45Å; K652-T655 PolarHBondContact O-N 2.91Å; K652-T656 WeakPolarHBondContact O-CB 3.42Å; K652-T656 PolarHBondContact O-N 2.95Å; K652-T656 PolarHBondContact O-OG1 3.46Å
653	E	90.7	Very high	86.6	Confident	52 Å²	52	58.2 Å²	58.2	24%	0.243	30%	0.304	C	S	.	.	H	α-helix	trans	-62.8	-45.8	178.8	-69.9	176.6	-172.8	0	0	111.4	R649 F650 T656 A657 F726	R649-E653 IonicContact CZ-OE1 2.79Å; R649-E653 VanDerWaalsContact CZ-OE1 3.31Å; R649-E653 IonicContact NE-OE1 2.71Å; R649-E653 PolarHBondContact NE-OE1 3.19Å; R649-E653 IonicContact NH2-OE1 3.88Å; R649-E653 PolarHBondContact NH2-OE1 3.13Å; R649-E653 WeakPolarHBondContact O-CG 3.22Å; R649-E653 PolarHBondContact O-N 3.47Å; F650-E653 PolarHBondContact O-N 3.05Å; E653-T656 PolarHBondContact O-N 3.29Å; E653-A657 PolarHBondContact O-N 3.35Å; E653-F726 HydrophobicContact CB-CD2 3.81Å; E653-F726 HydrophobicContact CB-CE2 3.93Å
654	A	92.3	Very high	86.4	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65.5	-41.9	177.4	0	0	0	0	0	112.8	F650 A657 R658 F726 I734 R738	F650-A654 WeakPolarHBondContact O-CB 3.26Å; F650-A654 PolarHBondContact O-N 3.31Å; A654-A657 PolarHBondContact O-N 3.07Å; A654-R658 WeakPolarHBondContact O-CG 3.12Å; A654-R658 PolarHBondContact O-N 2.91Å; A654-F726 HydrophobicContact CB-CD1 3.99Å; A654-F726 HydrophobicContact CB-CD2 4.44Å; A654-F726 HydrophobicContact CB-CE1 3.86Å; A654-F726 HydrophobicContact CB-CE2 4.32Å; A654-F726 HydrophobicContact CB-CG 4.27Å; A654-F726 HydrophobicContact CB-CZ 4.03Å; A654-I734 HydrophobicContact CB-CG2 3.91Å; A654-R738 HydrophobicContact CB-CG 3.69Å
655	T	90.4	Very high	86.2	Confident	46 Å²	46	66 Å²	66	28%	0.282	33%	0.331	S	S	.	.	H	α-helix	trans	-62.5	-44.1	177.6	-62	0	0	0	0	111.1	E651 K652 A657 R658 F659	E651-T655 VanDerWaalsContact O-CB 3.22Å; E651-T655 WeakPolarHBondContact O-CB 3.46Å; E651-T655 PolarHBondContact O-N 3.29Å; E651-T655 PolarHBondContact O-OG1 2.88Å; K652-T655 PolarHBondContact O-N 2.91Å; T655-A657 VanDerWaalsContact C-N 3.33Å; T655-A657 PolarHBondContact O-N 3.39Å; T655-R658 PolarHBondContact O-N 3.48Å; T655-F659 HydrophobicContact CG2-CD2 3.79Å; T655-F659 HydrophobicContact CG2-CE2 3.44Å; T655-F659 VanDerWaalsContact CG2-CE2 3.44Å; T655-F659 WeakPolarHBondContact O-CD2 3.37Å; T655-F659 PolarHBondContact O-N 3.34Å; T655-F659 VanDerWaalsContact O-N 3.1Å
656	T	90.2	Very high	85.9	Confident	66 Å²	66	69.5 Å²	69.5	41%	0.405	34%	0.338	S	S	.	.	H	α-helix	trans	-60	-43.1	175.4	-57	0	0	0	0	111.6	K652 E653 F659 R660	K652-T656 WeakPolarHBondContact O-CB 3.42Å; K652-T656 PolarHBondContact O-N 2.95Å; K652-T656 PolarHBondContact O-OG1 3.46Å; E653-T656 PolarHBondContact O-N 3.29Å; T656-F659 PolarHBondContact O-N 3.31Å; T656-R660 WeakPolarHBondContact O-CG 3.46Å; T656-R660 PolarHBondContact O-N 2.83Å; T656-R660 VanDerWaalsContact O-N 3.15Å
657	A	91	Very high	84.7	Confident	2 Å²	2	71 Å²	71	2%	0.017	35%	0.351	C	S	.	.	H	α-helix	trans	-64.9	-43.1	177.4	0	0	0	0	0	112.8	E653 A654 T655 F659 R660 L661 F726 E727 I734	E653-A657 PolarHBondContact O-N 3.35Å; A654-A657 PolarHBondContact O-N 3.07Å; T655-A657 VanDerWaalsContact C-N 3.33Å; T655-A657 PolarHBondContact O-N 3.39Å; A657-F659 PolarHBondContact O-N 3.44Å; A657-R660 PolarHBondContact O-N 3.28Å; A657-L661 WeakPolarHBondContact O-CG 3.11Å; A657-L661 PolarHBondContact O-N 2.92Å; A657-F726 HydrophobicContact CB-CB 3.48Å; A657-F726 VanDerWaalsContact CB-CB 3.48Å; A657-E727 HydrophobicContact CB-CG 4.38Å; A657-I734 HydrophobicContact CB-CD1 4Å
658	R	90.5	Very high	83.3	Confident	53 Å²	53	75.9 Å²	75.9	20%	0.2	38%	0.377	C	S	.	.	H	α-helix	trans	-56.5	-49.3	174.9	-70.5	177.6	-168.2	115.4	-4.3	111.4	E651 A654 T655 R660 L661 S662 I734 D735	E651-R658 IonicContact OE1-NH1 2.72Å; E651-R658 PolarHBondContact OE1-NH1 2.99Å; A654-R658 WeakPolarHBondContact O-CG 3.12Å; A654-R658 PolarHBondContact O-N 2.91Å; T655-R658 PolarHBondContact O-N 3.48Å; R658-R660 VanDerWaalsContact C-N 3.33Å; R658-R660 PolarHBondContact O-N 2.85Å; R658-L661 PolarHBondContact O-N 3.11Å; R658-S662 PolarHBondContact O-N 3.3Å; R658-S662 PolarHBondContact O-OG 3.17Å; R658-I734 HydrophobicContact CG-CD1 4.38Å; R658-I734 HydrophobicContact CG-CG2 4.17Å; R658-D735 IonicContact CZ-OD1 3.3Å; R658-D735 VanDerWaalsContact CZ-OD1 3.32Å; R658-D735 IonicContact NE-OD1 3.96Å; R658-D735 PolarHBondContact NE-OD1 2.92Å; R658-D735 IonicContact NH2-OD1 3.27Å; R658-D735 PolarHBondContact NH2-OD1 2.88Å
659	F	87.7	Confident	81.7	Confident	153 Å²	153	77.6 Å²	77.6	67%	0.671	39%	0.389	S	S	*	.	H	α-helix	trans	-58.9	-42.2	178.6	-80	-62.2	0	0	0	112.5	T655 T656 A657 A663	T655-F659 HydrophobicContact CG2-CD2 3.79Å; T655-F659 HydrophobicContact CG2-CE2 3.44Å; T655-F659 VanDerWaalsContact CG2-CE2 3.44Å; T655-F659 WeakPolarHBondContact O-CD2 3.37Å; T655-F659 PolarHBondContact O-N 3.34Å; T655-F659 VanDerWaalsContact O-N 3.1Å; T656-F659 PolarHBondContact O-N 3.31Å; A657-F659 PolarHBondContact O-N 3.44Å; F659-A663 VanDerWaalsContact O-CB 3.3Å; F659-A663 WeakPolarHBondContact O-CB 3.45Å; F659-A663 PolarHBondContact O-N 3.35Å
660	R	86.1	Confident	79.8	Confident	118 Å²	118	80.4 Å²	80.4	45%	0.445	41%	0.41	S	S	.	.	H	α-helix	trans	-65.6	-39.9	177.7	-71.4	-177.5	-171.8	168.4	10.5	112.6	T656 A657 R658 A663 K664 E727	T656-R660 WeakPolarHBondContact O-CG 3.46Å; T656-R660 PolarHBondContact O-N 2.83Å; T656-R660 VanDerWaalsContact O-N 3.15Å; A657-R660 PolarHBondContact O-N 3.28Å; R658-R660 VanDerWaalsContact C-N 3.33Å; R658-R660 PolarHBondContact O-N 2.85Å; R660-A663 PolarHBondContact O-N 3.36Å; R660-K664 WeakPolarHBondContact O-CG 3.31Å; R660-K664 PolarHBondContact O-N 3.15Å; R660-E727 IonicContact CZ-OE1 2.85Å; R660-E727 IonicContact NH1-OE1 3.81Å; R660-E727 PolarHBondContact NH1-OE1 2.87Å; R660-E727 IonicContact NH1-OE2 2.88Å; R660-E727 PolarHBondContact NH1-OE2 3.42Å
661	L	84.6	Confident	77.6	Confident	39 Å²	39	89.1 Å²	89.1	20%	0.204	46%	0.456	C	S	.	.	H	α-helix	trans	-66	-47.2	177.4	-70.1	169.7	0	0	0	111.4	A657 R658 A663 K664 E665 L729 V731 I734	A657-L661 WeakPolarHBondContact O-CG 3.11Å; A657-L661 PolarHBondContact O-N 2.92Å; R658-L661 PolarHBondContact O-N 3.11Å; L661-A663 VanDerWaalsContact C-N 3.31Å; L661-A663 PolarHBondContact O-N 2.86Å; L661-K664 PolarHBondContact O-N 3.41Å; L661-K664 VanDerWaalsContact O-N 3.15Å; L661-E665 PolarHBondContact O-N 2.88Å; L661-L729 WeakPolarHBondContact CD1-O 3.31Å; L661-V731 HydrophobicContact CB-CG2 4.24Å; L661-V731 HydrophobicContact CD1-CG2 4.03Å; L661-I734 HydrophobicContact CD1-CD1 3.63Å
662	S	81.8	Confident	75.7	Confident	47 Å²	47	90.2 Å²	90.2	33%	0.329	47%	0.474	S	S	.	.	H	α-helix	trans	-64.4	-34	176.1	-59.2	0	0	0	0	112.9	R658 E665 K666	R658-S662 PolarHBondContact O-N 3.3Å; R658-S662 PolarHBondContact O-OG 3.17Å; S662-E665 PolarHBondContact O-N 2.85Å; S662-K666 WeakPolarHBondContact O-CG 3.39Å; S662-K666 PolarHBondContact O-N 3.28Å; S662-K666 VanDerWaalsContact O-N 3.11Å
663	A	82	Confident	73.7	Confident	49 Å²	49	90.4 Å²	90.4	41%	0.405	49%	0.486	S	S	.	.	H	α-helix	trans	-65.3	-41.3	173.2	0	0	0	0	0	111.6	F659 R660 L661 K666 S667	F659-A663 VanDerWaalsContact O-CB 3.3Å; F659-A663 WeakPolarHBondContact O-CB 3.45Å; F659-A663 PolarHBondContact O-N 3.35Å; R660-A663 PolarHBondContact O-N 3.36Å; L661-A663 VanDerWaalsContact C-N 3.31Å; L661-A663 PolarHBondContact O-N 2.86Å; A663-K666 PolarHBondContact O-N 3.4Å; A663-S667 WeakPolarHBondContact O-CB 3.43Å; A663-S667 PolarHBondContact O-N 2.89Å; A663-S667 PolarHBondContact O-OG 3.49Å
664	K	76.4	Confident	72	Confident	123 Å²	123	94.9 Å²	94.9	54%	0.535	52%	0.517	S	S	.	.	H	α-helix	trans	-64.5	-39.4	175.4	-74.1	177.2	-178.5	-179.1	0	112.4	R660 L661 S667 N668	R660-K664 WeakPolarHBondContact O-CG 3.31Å; R660-K664 PolarHBondContact O-N 3.15Å; L661-K664 PolarHBondContact O-N 3.41Å; L661-K664 VanDerWaalsContact O-N 3.15Å; K664-S667 PolarHBondContact O-N 3.39Å; K664-N668 PolarHBondContact O-N 3.32Å
665	E	73	Confident	70.2	Confident	135 Å²	135	103 Å²	103	63%	0.631	56%	0.555	S	S	*	*	H	α-helix	trans	-62.4	-42.4	175	-72.4	176.3	164.6	0	0	112.2	L661 S662	L661-E665 PolarHBondContact O-N 2.88Å; S662-E665 PolarHBondContact O-N 2.85Å
666	K	72.7	Confident	68.4	Low	173 Å²	173	106.5 Å²	106.5	75%	0.752	58%	0.578	S	S	*	*	H	α-helix	trans	-68.6	-33.1	174.4	-69	176.2	-177.2	-178	0	112.7	S662 A663	S662-K666 WeakPolarHBondContact O-CG 3.39Å; S662-K666 PolarHBondContact O-N 3.28Å; S662-K666 VanDerWaalsContact O-N 3.11Å; A663-K666 PolarHBondContact O-N 3.4Å
667	S	59.6	Low	67	Low	59 Å²	59	109.7 Å²	109.7	41%	0.413	59%	0.588	S	S	.	*	H	α-helix	trans	-77.4	-25.9	-178.1	-54.5	0	0	0	0	113.1	A663 K664 S669 N670	A663-S667 WeakPolarHBondContact O-CB 3.43Å; A663-S667 PolarHBondContact O-N 2.89Å; A663-S667 PolarHBondContact O-OG 3.49Å; K664-S667 PolarHBondContact O-N 3.39Å; S667-S669 PolarHBondContact O-N 3.06Å; S667-N670 PolarHBondContact O-N 2.92Å
668	N	57.6	Low	65.8	Low	153 Å²	153	112.9 Å²	112.9	82%	0.818	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-0.5	178	-94.2	-6.3	0	0	0	114.5	K664	K664-N668 PolarHBondContact O-N 3.32Å
669	S	52.4	Low	65	Low	103 Å²	103	116.5 Å²	116.5	72%	0.72	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-11.5	167.8	-91.1	0	0	0	0	114.9	S667	S667-S669 PolarHBondContact O-N 3.06Å
670	N	49.2	Very low	64.4	Low	137 Å²	137	111.7 Å²	111.7	73%	0.733	62%	0.62	S	S	*	*	S	Bend	trans	-142.4	124.1	178.5	-76.5	-41.6	0	0	0	110.9	S667 A672	S667-N670 PolarHBondContact O-N 2.92Å; N670-A672 PolarHBondContact O-N 3.4Å
671	N	44.3	Very low	64.1	Low	185 Å²	185	110.2 Å²	110.2	99%	0.989	62%	0.621	S	S	*	*			trans	-33.4	105.4	178.7	-80.5	-26.6	0	0	0	113.5
672	A	48.1	Very low	64	Low	71 Å²	71	116.9 Å²	116.9	59%	0.587	65%	0.648	S	S	*	*			trans	-114.7	134	-178.4	0	0	0	0	0	111.8	N670	N670-A672 PolarHBondContact O-N 3.4Å
673	T	48.2	Very low	64	Low	135 Å²	135	123.8 Å²	123.8	83%	0.828	67%	0.667	S	S	*	*			trans	-47.9	130.8	170	31.6	0	0	0	0	112.3	E675	T673-E675 PolarHBondContact O-N 2.82Å
674	V	53.2	Low	63.9	Low	146 Å²	146	122.4 Å²	122.4	89%	0.885	65%	0.653	S	S	*	*			trans	-66.2	102	177.4	-178.9	0	0	0	0	109.3
675	E	55	Low	64.3	Low	171 Å²	171	118.6 Å²	118.6	80%	0.799	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-65.8	139.6	165	-72.2	-152.1	156.3	0	0	109.9	T673 E677	T673-E675 PolarHBondContact O-N 2.82Å; E675-E677 PolarHBondContact O-N 2.89Å
676	P	53.9	Low	64.9	Low	119 Å²	119	116.3 Å²	116.3	77%	0.773	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-61.9	125.5	177.4	24	-30.7	0	0	0	110.4
677	E	59.9	Low	65.4	Low	133 Å²	133	108.9 Å²	108.9	62%	0.621	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-55.1	130.8	174.4	-89.8	-109.5	147.5	0	0	110.4	E675 S679 K728	E675-E677 PolarHBondContact O-N 2.89Å; E677-S679 PolarHBondContact O-N 3.49Å; E677-K728 IonicContact OE1-NZ 3.13Å; E677-K728 PolarHBondContact OE1-NZ 3.21Å; E677-K728 IonicContact OE2-NZ 3.42Å; E677-K728 PolarHBondContact OE2-NZ 2.98Å
678	P	65	Low	66.8	Low	68 Å²	68	106.1 Å²	106.1	44%	0.442	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-58.6	138.2	172.9	-19.1	29.1	0	0	0	110.8	Y680	P678-Y680 HydrophobicContact CB-CE1 4.33Å; P678-Y680 HydrophobicContact CB-CE2 3.93Å; P678-Y680 HydrophobicContact CG-CE2 4.33Å; P678-Y680 WeakPolarHBondContact O-CD2 3.28Å; P678-Y680 VanDerWaalsContact O-CE2 3.22Å; P678-Y680 WeakPolarHBondContact O-CE2 3.29Å; P678-Y680 PolarHBondContact O-N 3.5Å
679	S	73.8	Confident	68.2	Low	129 Å²	129	104.6 Å²	104.6	90%	0.902	56%	0.561	S	S	*	*			trans	-81	109.5	175.4	-170.9	0	0	0	0	110	E677	E677-S679 PolarHBondContact O-N 3.49Å
680	Y	75.5	Confident	69.9	Low	52 Å²	52	103.5 Å²	103.5	20%	0.204	54%	0.543	C	S	.	.			trans	-92.4	149.5	178.9	-60	-79.1	0	0	0	112.4	P678 K682 L725 E727 K728	P678-Y680 HydrophobicContact CB-CE1 4.33Å; P678-Y680 HydrophobicContact CB-CE2 3.93Å; P678-Y680 HydrophobicContact CG-CE2 4.33Å; P678-Y680 WeakPolarHBondContact O-CD2 3.28Å; P678-Y680 VanDerWaalsContact O-CE2 3.22Å; P678-Y680 WeakPolarHBondContact O-CE2 3.29Å; P678-Y680 PolarHBondContact O-N 3.5Å; Y680-K682 PolarHBondContact O-N 2.84Å; Y680-L725 HydrophobicContact CD1-CD1 3.82Å; Y680-L725 HydrophobicContact CD1-CD2 3.57Å; Y680-L725 HydrophobicContact CD1-CG 4.28Å; Y680-L725 HydrophobicContact CE1-CD2 4.02Å; Y680-L725 HydrophobicContact CG-CD1 3.95Å; Y680-L725 HydrophobicContact CG-CD2 4.5Å; Y680-E727 VanDerWaalsContact OH-CD 3.25Å; Y680-E727 PolarHBondContact OH-OE2 2.75Å; Y680-K728 HydrophobicContact CE2-CD 4.5Å
681	D	79.5	Confident	71.8	Confident	88 Å²	88	97 Å²	97	47%	0.471	51%	0.509	S	S	.	.			trans	-61.2	126.1	170.2	-172.3	-25.7	0	0	0	109.8	R683 M684 L685	D681-R683 PolarHBondContact O-N 3.23Å; D681-R683 VanDerWaalsContact O-N 3.14Å; D681-R683 WeakPolarHBondContact OD1-CB 3.49Å; D681-R683 PolarHBondContact OD1-N 3.32Å; D681-M684 HydrophobicContact CB-CB 4.31Å; D681-M684 HydrophobicContact CB-CG 4.07Å; D681-M684 HydrophobicContact CB-SD 4.25Å; D681-M684 PolarHBondContact O-N 3.14Å; D681-L685 PolarHBondContact O-N 3.11Å
682	K	82.9	Confident	73.9	Confident	179 Å²	179	90.5 Å²	90.5	78%	0.778	47%	0.472	S	S	*	.	H	α-helix	trans	-54.3	-32.8	178	-170.2	177	-179.8	-179.2	0	112.4	Y680 E686	Y680-K682 PolarHBondContact O-N 2.84Å; K682-E686 WeakPolarHBondContact O-CB 3.46Å; K682-E686 PolarHBondContact O-N 3Å
683	R	81.3	Confident	75.8	Confident	192 Å²	192	95 Å²	95	73%	0.725	47%	0.474	S	S	*	.	H	α-helix	trans	-67.3	-45.1	175.9	-68.3	-179	176.1	-178.7	-2	111.8	D681 L685 E686 A687	D681-R683 PolarHBondContact O-N 3.23Å; D681-R683 VanDerWaalsContact O-N 3.14Å; D681-R683 WeakPolarHBondContact OD1-CB 3.49Å; D681-R683 PolarHBondContact OD1-N 3.32Å; R683-L685 VanDerWaalsContact C-N 3.34Å; R683-E686 PolarHBondContact O-N 2.83Å; R683-A687 WeakPolarHBondContact O-CB 3.31Å; R683-A687 PolarHBondContact O-N 3.1Å
684	M	81.2	Confident	77.6	Confident	20 Å²	20	90.8 Å²	90.8	10%	0.099	45%	0.446	C	S	.	.	H	α-helix	trans	-67.1	-37.1	177.1	-67.3	-177.3	75.1	0	0	111.8	D681 A687 T688 N723 L725 F1229 H1230	D681-M684 HydrophobicContact CB-CB 4.31Å; D681-M684 HydrophobicContact CB-CG 4.07Å; D681-M684 HydrophobicContact CB-SD 4.25Å; D681-M684 PolarHBondContact O-N 3.14Å; M684-A687 PolarHBondContact O-N 3.09Å; M684-T688 WeakPolarHBondContact O-CB 3.48Å; M684-T688 PolarHBondContact O-N 3.36Å; M684-T688 PolarHBondContact O-OG1 3.36Å; M684-N723 HydrophobicContact CE-CB 4.21Å; M684-L725 HydrophobicContact CB-CD1 3.84Å; M684-L725 HydrophobicContact CB-CD2 4.34Å; M684-L725 HydrophobicContact CB-CG 3.99Å; M684-L725 HydrophobicContact CE-CD2 3.56Å; M684-L725 HydrophobicContact CE-CG 4.12Å; M684-L725 HydrophobicContact SD-CD2 4.28Å; M684-F1229 HydrophobicContact CE-CE2 4.37Å; M684-F1229 HydrophobicContact CE-CZ 4.15Å; M684-H1230 PolarHBondContact SD-CE1 2.76Å; M684-H1230 PolarHBondContact SD-NE2 3.13Å; M684-H1230 VanDerWaalsContact SD-NE2 3.38Å
685	L	85.2	Confident	79.2	Confident	42 Å²	42	83.9 Å²	83.9	22%	0.22	40%	0.404	C	S	.	.	H	α-helix	trans	-64.4	-43.5	175.1	-168.3	71.3	0	0	0	111.6	D681 R683 T688 R689 L725 K728	D681-L685 PolarHBondContact O-N 3.11Å; R683-L685 VanDerWaalsContact C-N 3.34Å; L685-T688 PolarHBondContact O-N 3.46Å; L685-R689 WeakPolarHBondContact O-CG 3.35Å; L685-R689 PolarHBondContact O-N 2.86Å; L685-L725 HydrophobicContact CB-CD1 4.36Å; L685-L725 HydrophobicContact CD1-CD1 4.28Å; L685-K728 HydrophobicContact CD1-CD 4.46Å; L685-K728 HydrophobicContact CD1-CG 4.03Å
686	E	84.8	Confident	80.8	Confident	88 Å²	88	77.7 Å²	77.7	41%	0.411	38%	0.383	S	S	.	.	H	α-helix	trans	-68.3	-37.8	176.1	-168.6	59.3	-154.7	0	0	111.9	K682 R683 R689 K690 R693	K682-E686 WeakPolarHBondContact O-CB 3.46Å; K682-E686 PolarHBondContact O-N 3Å; R683-E686 PolarHBondContact O-N 2.83Å; E686-R689 PolarHBondContact O-N 3.2Å; E686-R689 IonicContact OE2-NH1 3.44Å; E686-K690 WeakPolarHBondContact O-CB 3.41Å; E686-K690 PolarHBondContact O-N 3.47Å; E686-R693 IonicContact OE1-NH2 3.7Å
687	A	83.5	Confident	82.3	Confident	17 Å²	17	79.7 Å²	79.7	14%	0.14	38%	0.379	C	S	.	.	H	α-helix	trans	-60.6	-45.9	172.7	0	0	0	0	0	111.7	R683 M684 R689 K690 L691 L720	R683-A687 WeakPolarHBondContact O-CB 3.31Å; R683-A687 PolarHBondContact O-N 3.1Å; M684-A687 PolarHBondContact O-N 3.09Å; A687-R689 PolarHBondContact O-N 3.45Å; A687-K690 WeakPolarHBondContact O-CB 3.27Å; A687-K690 PolarHBondContact O-N 3.37Å; A687-L691 PolarHBondContact O-N 3.43Å; A687-L720 HydrophobicContact CB-CD2 3.76Å
688	T	88	Confident	83.5	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.006	36%	0.355	C	S	.	.	H	α-helix	trans	-63.6	-41.3	177.7	-55.1	0	0	0	0	111.1	M684 L685 L691 Q692 L725 K728 L729	M684-T688 WeakPolarHBondContact O-CB 3.48Å; M684-T688 PolarHBondContact O-N 3.36Å; M684-T688 PolarHBondContact O-OG1 3.36Å; L685-T688 PolarHBondContact O-N 3.46Å; T688-L691 WeakPolarHBondContact O-CB 3.47Å; T688-L691 PolarHBondContact O-N 2.98Å; T688-Q692 WeakPolarHBondContact O-CG 3.35Å; T688-Q692 PolarHBondContact O-N 3.15Å; T688-L725 HydrophobicContact CG2-CB 4.27Å; T688-L725 WeakPolarHBondContact OG1-CB 3.49Å; T688-L725 PolarHBondContact OG1-N 2.93Å; T688-L725 VanDerWaalsContact OG1-N 3.13Å; T688-K728 HydrophobicContact CG2-CB 4.33Å; T688-L729 HydrophobicContact CG2-CD2 3.86Å; T688-L729 HydrophobicContact CG2-CG 4.26Å
689	R	88.4	Confident	84.5	Confident	120 Å²	120	74.2 Å²	74.2	45%	0.453	35%	0.35	S	S	.	.	H	α-helix	trans	-64.8	-39	173.5	-73.8	172.5	179	169	-1	113	L685 E686 A687 L691 Q692 R693	L685-R689 WeakPolarHBondContact O-CG 3.35Å; L685-R689 PolarHBondContact O-N 2.86Å; E686-R689 PolarHBondContact O-N 3.2Å; E686-R689 IonicContact OE2-NH1 3.44Å; A687-R689 PolarHBondContact O-N 3.45Å; R689-L691 VanDerWaalsContact C-N 3.31Å; R689-Q692 PolarHBondContact O-N 3.37Å; R689-R693 WeakPolarHBondContact O-CG 3.28Å; R689-R693 PolarHBondContact O-N 3.43Å; R689-R693 VanDerWaalsContact O-N 3.16Å
690	K	87.8	Confident	85	Confident	80 Å²	80	75.9 Å²	75.9	35%	0.348	34%	0.344	S	S	.	.	H	α-helix	trans	-62.8	-42.8	174.5	-173.7	-180	173.7	-164.8	0	109.9	E686 A687 R693 L694 S716 L720	E686-K690 WeakPolarHBondContact O-CB 3.41Å; E686-K690 PolarHBondContact O-N 3.47Å; A687-K690 WeakPolarHBondContact O-CB 3.27Å; A687-K690 PolarHBondContact O-N 3.37Å; K690-R693 PolarHBondContact O-N 2.89Å; K690-L694 HydrophobicContact CG-CD1 4.33Å; K690-L694 WeakPolarHBondContact O-CG 3.25Å; K690-L694 PolarHBondContact O-N 3Å; K690-L694 VanDerWaalsContact O-N 3.12Å; K690-S716 PolarHBondContact NZ-OG 2.84Å; K690-L720 HydrophobicContact CB-CD2 4.41Å; K690-L720 HydrophobicContact CD-CD1 4.03Å; K690-L720 HydrophobicContact CD-CD2 4.19Å; K690-L720 HydrophobicContact CG-CD1 4.38Å
691	L	87.7	Confident	85.4	Confident	0 Å²	0	76 Å²	76	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.2	-47.7	175.1	-177.7	62.5	0	0	0	111.7	A687 T688 R689 R693 L694 I695 V713 L721 V724 V737	A687-L691 PolarHBondContact O-N 3.43Å; T688-L691 WeakPolarHBondContact O-CB 3.47Å; T688-L691 PolarHBondContact O-N 2.98Å; R689-L691 VanDerWaalsContact C-N 3.31Å; L691-R693 VanDerWaalsContact C-N 3.3Å; L691-R693 PolarHBondContact O-N 3.22Å; L691-L694 PolarHBondContact O-N 3.24Å; L691-I695 HydrophobicContact CD1-CG2 3.96Å; L691-I695 HydrophobicContact CG-CG2 4.38Å; L691-I695 WeakPolarHBondContact O-CG1 3.46Å; L691-I695 PolarHBondContact O-N 2.88Å; L691-V713 HydrophobicContact CD1-CG1 4.35Å; L691-L721 HydrophobicContact CD1-CD2 4.24Å; L691-V724 HydrophobicContact CD2-CG1 4.14Å; L691-V724 HydrophobicContact CD2-CG2 3.63Å; L691-V737 HydrophobicContact CD2-CG1 3.96Å; L691-V737 HydrophobicContact CD2-CG2 3.82Å; L691-V737 HydrophobicContact CG-CG2 4.23Å
692	Q	88.8	Confident	85	Confident	49 Å²	49	78.2 Å²	78.2	23%	0.229	37%	0.367	C	S	.	.	H	α-helix	trans	-53.6	-44.3	175.6	-75	178.2	-55.7	0	0	112.5	T688 R689 L694 I695 A696 K728 L729 E733	T688-Q692 WeakPolarHBondContact O-CG 3.35Å; T688-Q692 PolarHBondContact O-N 3.15Å; R689-Q692 PolarHBondContact O-N 3.37Å; Q692-L694 VanDerWaalsContact C-N 3.33Å; Q692-L694 PolarHBondContact O-N 2.9Å; Q692-I695 WeakPolarHBondContact O-CG1 3.27Å; Q692-I695 PolarHBondContact O-N 3.26Å; Q692-A696 WeakPolarHBondContact O-CB 3.41Å; Q692-A696 PolarHBondContact O-N 3.45Å; Q692-K728 PolarHBondContact NE2-O 3.33Å; Q692-L729 HydrophobicContact CG-CD2 3.42Å; Q692-L729 VanDerWaalsContact CG-CD2 3.42Å; Q692-E733 PolarHBondContact NE2-OE1 3.28Å; Q692-E733 PolarHBondContact NE2-OE2 2.83Å; Q692-E733 VanDerWaalsContact NE2-OE2 3.07Å
693	R	88.1	Confident	84.9	Confident	167 Å²	167	74.4 Å²	74.4	63%	0.63	36%	0.363	S	S	*	.	H	α-helix	trans	-64.5	-36.8	176.7	-66	179.5	-153.7	146.2	11.2	112.7	E686 R689 K690 L691	E686-R693 IonicContact OE1-NH2 3.7Å; R689-R693 WeakPolarHBondContact O-CG 3.28Å; R689-R693 PolarHBondContact O-N 3.43Å; R689-R693 VanDerWaalsContact O-N 3.16Å; K690-R693 PolarHBondContact O-N 2.89Å; L691-R693 VanDerWaalsContact C-N 3.3Å; L691-R693 PolarHBondContact O-N 3.22Å
694	L	85.9	Confident	84.7	Confident	46 Å²	46	67.6 Å²	67.6	24%	0.241	34%	0.344	C	S	.	.	H	α-helix	trans	-72.5	-33.8	180	-69.6	171.4	0	0	0	112.2	K690 L691 Q692 P698 V713 L720	K690-L694 HydrophobicContact CG-CD1 4.33Å; K690-L694 WeakPolarHBondContact O-CG 3.25Å; K690-L694 PolarHBondContact O-N 3Å; K690-L694 VanDerWaalsContact O-N 3.12Å; L691-L694 PolarHBondContact O-N 3.24Å; Q692-L694 VanDerWaalsContact C-N 3.33Å; Q692-L694 PolarHBondContact O-N 2.9Å; L694-P698 VanDerWaalsContact O-CD 3.24Å; L694-P698 WeakPolarHBondContact O-CD 3.43Å; L694-P698 WeakPolarHBondContact O-CG 3.26Å; L694-V713 HydrophobicContact CB-CG2 4.32Å; L694-V713 HydrophobicContact CD1-CG2 4.38Å; L694-L720 HydrophobicContact CD1-CD1 3.95Å
695	I	87.4	Confident	84.6	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-88.6	-20.3	-178.7	69	179.8	0	0	0	114	L691 Q692 K697 P698 M699 E733 F736 V737 L740	L691-I695 HydrophobicContact CD1-CG2 3.96Å; L691-I695 HydrophobicContact CG-CG2 4.38Å; L691-I695 WeakPolarHBondContact O-CG1 3.46Å; L691-I695 PolarHBondContact O-N 2.88Å; Q692-I695 WeakPolarHBondContact O-CG1 3.27Å; Q692-I695 PolarHBondContact O-N 3.26Å; I695-K697 VanDerWaalsContact C-N 3.33Å; I695-K697 PolarHBondContact O-N 3.38Å; I695-P698 VanDerWaalsContact O-CD 3.3Å; I695-P698 WeakPolarHBondContact O-CD 3.48Å; I695-M699 HydrophobicContact CB-CG 4.41Å; I695-M699 HydrophobicContact CB-SD 4.26Å; I695-M699 HydrophobicContact CD1-SD 3.82Å; I695-M699 HydrophobicContact CG1-SD 3.85Å; I695-M699 WeakPolarHBondContact O-CB 3.42Å; I695-M699 VanDerWaalsContact O-CG 3.26Å; I695-M699 WeakPolarHBondContact O-CG 3.24Å; I695-M699 PolarHBondContact O-N 3.32Å; I695-E733 HydrophobicContact CD1-CB 4.22Å; I695-E733 HydrophobicContact CD1-CG 4.42Å; I695-F736 HydrophobicContact CB-CD1 3.69Å; I695-F736 HydrophobicContact CB-CE1 3.69Å; I695-F736 HydrophobicContact CD1-CD1 4.42Å; I695-F736 HydrophobicContact CG2-CD1 3.89Å; I695-F736 HydrophobicContact CG2-CE1 3.84Å; I695-V737 HydrophobicContact CD1-CG2 3.65Å; I695-L740 HydrophobicContact CG2-CD1 3.55Å
696	A	87.9	Confident	84.2	Confident	42 Å²	42	70.1 Å²	70.1	35%	0.347	36%	0.363	S	S	.	.	H	α-helix	trans	-55.9	-42.6	-174.9	0	0	0	0	0	113.9	Q692 Q700	Q692-A696 WeakPolarHBondContact O-CB 3.41Å; Q692-A696 PolarHBondContact O-N 3.45Å; A696-Q700 WeakPolarHBondContact O-CG 3.32Å
697	K	85.4	Confident	83.8	Confident	161 Å²	161	71.2 Å²	71.2	70%	0.7	37%	0.368	S	S	*	.	H	α-helix	trans	-73.1	-51.4	177.4	179.1	-175.4	-178.2	-171.9	0	111.8	I695 M699 Q700 D701	I695-K697 VanDerWaalsContact C-N 3.33Å; I695-K697 PolarHBondContact O-N 3.38Å; K697-M699 VanDerWaalsContact C-N 3.26Å; K697-M699 PolarHBondContact O-N 3.29Å; K697-Q700 PolarHBondContact O-N 2.88Å; K697-Q700 VanDerWaalsContact O-N 3.09Å; K697-D701 WeakPolarHBondContact O-CB 3.42Å; K697-D701 PolarHBondContact O-N 3.17Å; K697-D701 VanDerWaalsContact O-N 3.14Å
698	P	85.8	Confident	83.6	Confident	18 Å²	18	72.8 Å²	72.8	12%	0.117	38%	0.381	C	S	.	.	H	α-helix	trans	-53.9	-35.9	173.7	-29.7	34.3	0	0	0	115.2	L694 I695 Q700 D701 C704 T709 F736	L694-P698 VanDerWaalsContact O-CD 3.24Å; L694-P698 WeakPolarHBondContact O-CD 3.43Å; L694-P698 WeakPolarHBondContact O-CG 3.26Å; I695-P698 VanDerWaalsContact O-CD 3.3Å; I695-P698 WeakPolarHBondContact O-CD 3.48Å; P698-Q700 VanDerWaalsContact C-N 3.3Å; P698-Q700 PolarHBondContact O-N 3.03Å; P698-D701 PolarHBondContact O-N 2.93Å; P698-C704 HydrophobicContact CB-CB 4.41Å; P698-T709 HydrophobicContact CB-CG2 3.86Å; P698-T709 HydrophobicContact CG-CG2 3.64Å; P698-F736 HydrophobicContact CB-CE1 3.98Å; P698-F736 HydrophobicContact CB-CZ 3.53Å
699	M	86.4	Confident	83.3	Confident	67 Å²	67	72.9 Å²	72.9	33%	0.33	38%	0.382	S	S	.	.	H	α-helix	trans	-67.8	-28.4	177.8	-76.6	179.5	68.1	0	0	113.5	I695 K697 A732 E733 F736	I695-M699 HydrophobicContact CB-CG 4.41Å; I695-M699 HydrophobicContact CB-SD 4.26Å; I695-M699 HydrophobicContact CD1-SD 3.82Å; I695-M699 HydrophobicContact CG1-SD 3.85Å; I695-M699 WeakPolarHBondContact O-CB 3.42Å; I695-M699 VanDerWaalsContact O-CG 3.26Å; I695-M699 WeakPolarHBondContact O-CG 3.24Å; I695-M699 PolarHBondContact O-N 3.32Å; K697-M699 VanDerWaalsContact C-N 3.26Å; K697-M699 PolarHBondContact O-N 3.29Å; M699-A732 HydrophobicContact CE-CB 4.1Å; M699-A732 WeakPolarHBondContact CE-O 3.45Å; M699-E733 HydrophobicContact CE-CB 4.4Å; M699-E733 HydrophobicContact CE-CG 3.93Å; M699-E733 HydrophobicContact SD-CB 4.47Å; M699-E733 HydrophobicContact SD-CG 4.05Å; M699-F736 HydrophobicContact CE-CB 4.25Å; M699-F736 HydrophobicContact CG-CB 3.86Å; M699-F736 HydrophobicContact CG-CD1 3.48Å; M699-F736 VanDerWaalsContact CG-CD1 3.48Å; M699-F736 HydrophobicContact CG-CD2 3.69Å; M699-F736 HydrophobicContact CG-CE1 3.86Å; M699-F736 HydrophobicContact CG-CE2 4.08Å; M699-F736 HydrophobicContact CG-CG 3.37Å; M699-F736 HydrophobicContact CG-CZ 4.17Å; M699-F736 HydrophobicContact SD-CB 3.93Å; M699-F736 HydrophobicContact SD-CD1 4.05Å; M699-F736 HydrophobicContact SD-CG 4.03Å
700	Q	83.6	Confident	82.7	Confident	164 Å²	164	67.2 Å²	67.2	77%	0.766	36%	0.36	S	S	*	.	H	α-helix	trans	-93.7	-13.9	-178.6	-67.6	175.5	12.5	0	0	113	A696 K697 P698 P702	A696-Q700 WeakPolarHBondContact O-CG 3.32Å; K697-Q700 PolarHBondContact O-N 2.88Å; K697-Q700 VanDerWaalsContact O-N 3.09Å; P698-Q700 VanDerWaalsContact C-N 3.3Å; P698-Q700 PolarHBondContact O-N 3.03Å; Q700-P702 WeakPolarHBondContact O-CD 3.49Å
701	D	82.8	Confident	82.2	Confident	54 Å²	54	66.1 Å²	66.1	29%	0.289	36%	0.363	S	S	.	.			trans	-113.8	98.9	-174.8	-174.3	-2.2	0	0	0	110.9	K697 P698 S703 C704	K697-D701 WeakPolarHBondContact O-CB 3.42Å; K697-D701 PolarHBondContact O-N 3.17Å; K697-D701 VanDerWaalsContact O-N 3.14Å; P698-D701 PolarHBondContact O-N 2.93Å; D701-S703 VanDerWaalsContact CG-OG 3.23Å; D701-S703 PolarHBondContact O-N 3.48Å; D701-S703 VanDerWaalsContact O-N 3.08Å; D701-S703 VanDerWaalsContact OD1-CB 3.29Å; D701-S703 WeakPolarHBondContact OD1-CB 3.49Å; D701-S703 PolarHBondContact OD1-N 2.97Å; D701-S703 PolarHBondContact OD1-OG 3.41Å; D701-S703 PolarHBondContact OD2-OG 2.99Å; D701-C704 HydrophobicContact CB-CB 4.22Å; D701-C704 VanDerWaalsContact O-CB 3.28Å; D701-C704 WeakPolarHBondContact O-CB 3.38Å; D701-C704 PolarHBondContact O-N 2.85Å
702	P	73	Confident	81.6	Confident	136 Å²	136	70 Å²	70	88%	0.883	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.8	177.4	-19	30.4	0	0	0	113.9	Q700 C704	Q700-P702 WeakPolarHBondContact O-CD 3.49Å; P702-C704 VanDerWaalsContact C-N 3.3Å
703	S	79.9	Confident	80.9	Confident	99 Å²	99	67.7 Å²	67.7	69%	0.692	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-12	176.7	77.4	0	0	0	0	113	D701 S705	D701-S703 VanDerWaalsContact CG-OG 3.23Å; D701-S703 PolarHBondContact O-N 3.48Å; D701-S703 VanDerWaalsContact O-N 3.08Å; D701-S703 VanDerWaalsContact OD1-CB 3.29Å; D701-S703 WeakPolarHBondContact OD1-CB 3.49Å; D701-S703 PolarHBondContact OD1-N 2.97Å; D701-S703 PolarHBondContact OD1-OG 3.41Å; D701-S703 PolarHBondContact OD2-OG 2.99Å; S703-S705 PolarHBondContact O-N 3.19Å
704	C	76.3	Confident	79.8	Confident	48 Å²	48	65.5 Å²	65.5	32%	0.324	37%	0.371	S	S	.	.	S	Bend	trans	-75.8	115.7	-179	-163.6	0	0	0	0	110.9	P698 D701 P702 L706 T709	P698-C704 HydrophobicContact CB-CB 4.41Å; D701-C704 HydrophobicContact CB-CB 4.22Å; D701-C704 VanDerWaalsContact O-CB 3.28Å; D701-C704 WeakPolarHBondContact O-CB 3.38Å; D701-C704 PolarHBondContact O-N 2.85Å; P702-C704 VanDerWaalsContact C-N 3.3Å; C704-L706 PolarHBondContact O-N 2.67Å; C704-T709 PolarHBondContact SG-OG1 3.5Å; C704-T709 VanDerWaalsContact SG-OG1 3.42Å
705	S	79.2	Confident	78.6	Confident	62 Å²	62	70.2 Å²	70.2	43%	0.434	40%	0.396	S	S	.	.			trans	-61.6	132.9	174	160.7	0	0	0	0	111	S703 Q707 A708 T709	S703-S705 PolarHBondContact O-N 3.19Å; S705-Q707 PolarHBondContact O-N 3.2Å; S705-Q707 PolarHBondContact OG-N 2.83Å; S705-Q707 VanDerWaalsContact OG-N 3.15Å; S705-A708 PolarHBondContact O-N 2.87Å; S705-A708 PolarHBondContact OG-N 3.35Å; S705-T709 PolarHBondContact O-N 3.49Å; S705-T709 PolarHBondContact O-OG1 3.11Å; S705-T709 VanDerWaalsContact O-OG1 3.05Å
706	L	77.3	Confident	77.1	Confident	53 Å²	53	72 Å²	72	28%	0.277	41%	0.409	S	S	.	.	H	α-helix	trans	-56.8	-38.5	173.4	-169.2	70.1	0	0	0	110.9	C704 T709 V710 K739 L740 Q743	C704-L706 PolarHBondContact O-N 2.67Å; L706-T709 WeakPolarHBondContact O-CB 3.42Å; L706-T709 PolarHBondContact O-N 3.26Å; L706-V710 WeakPolarHBondContact O-CG2 3.48Å; L706-V710 PolarHBondContact O-N 3.43Å; L706-K739 HydrophobicContact CD1-CB 4.21Å; L706-K739 HydrophobicContact CD2-CB 4.41Å; L706-L740 HydrophobicContact CD1-CD2 3.56Å; L706-L740 HydrophobicContact CD1-CG 4.11Å; L706-L740 HydrophobicContact CG-CD2 4.24Å; L706-Q743 HydrophobicContact CD2-CB 3.84Å; L706-Q743 HydrophobicContact CD2-CG 4.17Å; L706-Q743 HydrophobicContact CG-CB 4.26Å; L706-Q743 HydrophobicContact CG-CG 4.37Å
707	Q	77	Confident	75.5	Confident	112 Å²	112	70.7 Å²	70.7	52%	0.523	40%	0.398	S	S	.	.	H	α-helix	trans	-67.8	-40.6	178.3	-163.8	170.6	18.5	0	0	112.2	S705 T709 V710 S711	S705-Q707 PolarHBondContact O-N 3.2Å; S705-Q707 PolarHBondContact OG-N 2.83Å; S705-Q707 VanDerWaalsContact OG-N 3.15Å; Q707-T709 VanDerWaalsContact C-N 3.26Å; Q707-T709 PolarHBondContact O-N 3.21Å; Q707-V710 PolarHBondContact O-N 3.3Å; Q707-S711 PolarHBondContact O-N 3.08Å; Q707-S711 PolarHBondContact O-OG 3.37Å
708	A	80	Confident	74.5	Confident	50 Å²	50	69 Å²	69	41%	0.413	39%	0.387	S	S	.	.	H	α-helix	trans	-63.4	-35.8	173.4	0	0	0	0	0	111.7	S705 S711 T712	S705-A708 PolarHBondContact O-N 2.87Å; S705-A708 PolarHBondContact OG-N 3.35Å; A708-S711 PolarHBondContact O-N 3.27Å; A708-T712 PolarHBondContact O-N 3.26Å; A708-T712 PolarHBondContact O-OG1 3.43Å
709	T	80	Confident	73.8	Confident	3 Å²	3	70.9 Å²	70.9	2%	0.018	40%	0.401	C	S	.	.	H	α-helix	trans	-67.8	-43.7	174.5	-52.5	0	0	0	0	111.2	P698 C704 S705 L706 Q707 S711 T712 V713 F736 L740	P698-T709 HydrophobicContact CB-CG2 3.86Å; P698-T709 HydrophobicContact CG-CG2 3.64Å; C704-T709 PolarHBondContact SG-OG1 3.5Å; C704-T709 VanDerWaalsContact SG-OG1 3.42Å; S705-T709 PolarHBondContact O-N 3.49Å; S705-T709 PolarHBondContact O-OG1 3.11Å; S705-T709 VanDerWaalsContact O-OG1 3.05Å; L706-T709 WeakPolarHBondContact O-CB 3.42Å; L706-T709 PolarHBondContact O-N 3.26Å; Q707-T709 VanDerWaalsContact C-N 3.26Å; Q707-T709 PolarHBondContact O-N 3.21Å; T709-S711 PolarHBondContact O-N 3.42Å; T709-T712 PolarHBondContact O-N 3.43Å; T709-V713 HydrophobicContact CG2-CG2 4.46Å; T709-V713 VanDerWaalsContact O-CG2 3.29Å; T709-V713 WeakPolarHBondContact O-CG2 3.42Å; T709-V713 PolarHBondContact O-N 3.2Å; T709-F736 HydrophobicContact CG2-CE1 4.28Å; T709-F736 HydrophobicContact CG2-CZ 4.36Å; T709-L740 HydrophobicContact CG2-CD1 4.02Å; T709-L740 HydrophobicContact CG2-CD2 3.54Å; T709-L740 HydrophobicContact CG2-CG 4.41Å
710	V	77	Confident	73.3	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.006	39%	0.388	C	S	.	.	H	α-helix	trans	-57.1	-48.5	172.8	169.7	0	0	0	0	110.4	L706 Q707 T712 V713 K714 L740 Q743 Y744	L706-V710 WeakPolarHBondContact O-CG2 3.48Å; L706-V710 PolarHBondContact O-N 3.43Å; Q707-V710 PolarHBondContact O-N 3.3Å; V710-T712 VanDerWaalsContact C-N 3.34Å; V710-T712 PolarHBondContact O-N 3.34Å; V710-V713 CarbonylContact O-C 3.46Å; V710-V713 PolarHBondContact O-N 2.84Å; V710-V713 VanDerWaalsContact O-N 3.16Å; V710-K714 WeakPolarHBondContact O-CA 3.38Å; V710-K714 WeakPolarHBondContact O-CB 3.29Å; V710-K714 PolarHBondContact O-N 3.3Å; V710-L740 HydrophobicContact CG2-CD2 3.8Å; V710-Q743 HydrophobicContact CG2-CB 3.9Å; V710-Q743 HydrophobicContact CG2-CG 3.81Å; V710-Y744 HydrophobicContact CG1-CD2 4.14Å
711	S	76.8	Confident	73.2	Confident	56 Å²	56	60.6 Å²	60.6	39%	0.392	35%	0.353	S	S	.	.	H	α-helix	trans	-58.2	-44	177	-63	0	0	0	0	112.5	Q707 A708 T709 V713 K714 D715	Q707-S711 PolarHBondContact O-N 3.08Å; Q707-S711 PolarHBondContact O-OG 3.37Å; A708-S711 PolarHBondContact O-N 3.27Å; T709-S711 PolarHBondContact O-N 3.42Å; S711-V713 VanDerWaalsContact C-N 3.31Å; S711-V713 PolarHBondContact O-N 3.12Å; S711-K714 WeakPolarHBondContact O-CB 3.33Å; S711-K714 PolarHBondContact O-N 2.87Å; S711-D715 PolarHBondContact O-N 3.22Å
712	T	75.8	Confident	73	Confident	81 Å²	81	59.7 Å²	59.7	50%	0.497	35%	0.347	S	S	.	.	H	α-helix	trans	-62.8	-37.3	177.5	-52.2	0	0	0	0	112.2	A708 T709 V710	A708-T712 PolarHBondContact O-N 3.26Å; A708-T712 PolarHBondContact O-OG1 3.43Å; T709-T712 PolarHBondContact O-N 3.43Å; V710-T712 VanDerWaalsContact C-N 3.34Å; V710-T712 PolarHBondContact O-N 3.34Å
713	V	73	Confident	73.4	Confident	1 Å²	1	54 Å²	54	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-77.1	-34.2	176.2	176.7	0	0	0	0	111.3	L691 L694 T709 V710 S711 S716 L721	L691-V713 HydrophobicContact CD1-CG1 4.35Å; L694-V713 HydrophobicContact CB-CG2 4.32Å; L694-V713 HydrophobicContact CD1-CG2 4.38Å; T709-V713 HydrophobicContact CG2-CG2 4.46Å; T709-V713 VanDerWaalsContact O-CG2 3.29Å; T709-V713 WeakPolarHBondContact O-CG2 3.42Å; T709-V713 PolarHBondContact O-N 3.2Å; V710-V713 CarbonylContact O-C 3.46Å; V710-V713 PolarHBondContact O-N 2.84Å; V710-V713 VanDerWaalsContact O-N 3.16Å; S711-V713 VanDerWaalsContact C-N 3.31Å; S711-V713 PolarHBondContact O-N 3.12Å; V713-S716 CarbonylContact O-C 3.56Å; V713-S716 WeakPolarHBondContact O-CA 3.49Å; V713-S716 PolarHBondContact O-N 2.85Å; V713-L721 HydrophobicContact CG1-CD1 4Å; V713-L721 HydrophobicContact CG1-CD2 4.01Å; V713-L721 HydrophobicContact CG1-CG 3.77Å
714	K	66	Low	73.6	Confident	122 Å²	122	49.6 Å²	49.6	53%	0.53	28%	0.278	S	S	.	.	H	α-helix	trans	-63.9	-41.8	-179.7	-176.3	179.8	179.7	179.1	0	111.6	V710 S711 S716 A717 Y744	V710-K714 WeakPolarHBondContact O-CA 3.38Å; V710-K714 WeakPolarHBondContact O-CB 3.29Å; V710-K714 PolarHBondContact O-N 3.3Å; S711-K714 WeakPolarHBondContact O-CB 3.33Å; S711-K714 PolarHBondContact O-N 2.87Å; K714-S716 PolarHBondContact O-N 3.43Å; K714-A717 PolarHBondContact O-N 3.44Å; K714-Y744 HydrophobicContact CG-CE2 4.47Å
715	D	60.4	Low	74.3	Confident	144 Å²	144	48.1 Å²	48.1	77%	0.77	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-10.1	174	-65.4	-16.7	0	0	0	112.9	S711	S711-D715 PolarHBondContact O-N 3.22Å
716	S	56.4	Low	74.9	Confident	39 Å²	39	45.6 Å²	45.6	27%	0.273	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.5	20.3	-176	-93.4	0	0	0	0	115.5	K690 V713 K714 L720	K690-S716 PolarHBondContact NZ-OG 2.84Å; V713-S716 CarbonylContact O-C 3.56Å; V713-S716 WeakPolarHBondContact O-CA 3.49Å; V713-S716 PolarHBondContact O-N 2.85Å; K714-S716 PolarHBondContact O-N 3.43Å; S716-L720 WeakPolarHBondContact O-CD1 3.45Å; S716-L720 WeakPolarHBondContact O-CG 3.38Å
717	A	53.6	Low	75.3	Confident	14 Å²	14	46.3 Å²	46.3	12%	0.116	25%	0.25	C	S	.	.			trans	102.8	125	166.2	0	0	0	0	0	116.1	K714 S719 L720 D1235	K714-A717 PolarHBondContact O-N 3.44Å; A717-S719 PolarHBondContact O-N 2.89Å; A717-L720 PolarHBondContact O-N 3.11Å; A717-D1235 VanDerWaalsContact CB-OD2 3.27Å; A717-D1235 WeakPolarHBondContact CB-OD2 3.31Å
718	R	65.3	Low	75.9	Confident	124 Å²	124	43.9 Å²	43.9	47%	0.468	24%	0.238	S	C	.	.	H	α-helix	trans	-41.9	-28.8	158.6	-177.9	173.3	-170.6	-177.8	4	112	L720 N722 Y744	R718-L720 PolarHBondContact O-N 3.14Å; R718-N722 VanDerWaalsContact O-CB 3.26Å; R718-N722 WeakPolarHBondContact O-CB 3.45Å; R718-N722 PolarHBondContact O-N 3.26Å; R718-N722 VanDerWaalsContact O-N 3.07Å; R718-N722 PolarHBondContact O-OD1 2.91Å; R718-Y744 WeakPolarHBondContact CD-OH 3.38Å; R718-Y744 HydrophobicContact CG-CE1 4.38Å; R718-Y744 VanDerWaalsContact CG-OH 3.31Å; R718-Y744 WeakPolarHBondContact CG-OH 3.12Å
719	S	70.1	Confident	76.5	Confident	59 Å²	59	41.8 Å²	41.8	41%	0.413	22%	0.22	S	C	.	.	H	α-helix	trans	-58.8	-37.1	172.7	-170.5	0	0	0	0	115	A717 N722 N723	A717-S719 PolarHBondContact O-N 2.89Å; S719-N722 PolarHBondContact O-N 2.74Å; S719-N723 WeakPolarHBondContact O-CB 3.37Å; S719-N723 PolarHBondContact O-N 2.79Å; S719-N723 VanDerWaalsContact O-N 3.16Å; S719-N723 PolarHBondContact O-ND2 2.85Å; S719-N723 VanDerWaalsContact O-ND2 3.12Å; S719-N723 PolarHBondContact OG-ND2 3.44Å
720	L	77	Confident	77	Confident	11 Å²	11	48.2 Å²	48.2	6%	0.058	25%	0.25	C	S	.	.	H	α-helix	trans	-69.3	-41.6	-178	-69	-178.6	0	0	0	112.5	A687 K690 L694 S716 A717 R718 V724	A687-L720 HydrophobicContact CB-CD2 3.76Å; K690-L720 HydrophobicContact CB-CD2 4.41Å; K690-L720 HydrophobicContact CD-CD1 4.03Å; K690-L720 HydrophobicContact CD-CD2 4.19Å; K690-L720 HydrophobicContact CG-CD1 4.38Å; L694-L720 HydrophobicContact CD1-CD1 3.95Å; S716-L720 WeakPolarHBondContact O-CD1 3.45Å; S716-L720 WeakPolarHBondContact O-CG 3.38Å; A717-L720 PolarHBondContact O-N 3.11Å; R718-L720 PolarHBondContact O-N 3.14Å; L720-V724 VanDerWaalsContact O-CG2 3.28Å; L720-V724 WeakPolarHBondContact O-CG2 3.4Å
721	L	80.3	Confident	77.6	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-78.7	-26.7	177.1	-68.8	176	0	0	0	111.9	L691 V713 L740 Q741 Y744	L691-L721 HydrophobicContact CD1-CD2 4.24Å; V713-L721 HydrophobicContact CG1-CD1 4Å; V713-L721 HydrophobicContact CG1-CD2 4.01Å; V713-L721 HydrophobicContact CG1-CG 3.77Å; L721-L740 HydrophobicContact CD2-CB 4.34Å; L721-Q741 HydrophobicContact CB-CG 4.26Å; L721-Q741 HydrophobicContact CD2-CG 4.11Å; L721-Q741 PolarHBondContact O-NE2 3.29Å; L721-Y744 HydrophobicContact CD1-CD1 4.19Å; L721-Y744 HydrophobicContact CD1-CD2 4.3Å; L721-Y744 HydrophobicContact CD1-CG 3.84Å
722	N	79.9	Confident	78.2	Confident	34 Å²	34	50.8 Å²	50.8	18%	0.182	27%	0.269	C	S	.	.	H	α-helix	trans	-82.1	-22.4	-179	-73.1	0.2	0	0	0	114.8	F650 R718 S719	F650-N722 HydrophobicContact CZ-CB 4.26Å; R718-N722 VanDerWaalsContact O-CB 3.26Å; R718-N722 WeakPolarHBondContact O-CB 3.45Å; R718-N722 PolarHBondContact O-N 3.26Å; R718-N722 VanDerWaalsContact O-N 3.07Å; R718-N722 PolarHBondContact O-OD1 2.91Å; S719-N722 PolarHBondContact O-N 2.74Å
723	N	79.6	Confident	79	Confident	17 Å²	17	48.3 Å²	48.3	9%	0.091	25%	0.252	C	S	.	.	S	Bend	trans	-122	47.3	-172.5	-61	-61.8	0	0	0	112.1	M684 S719 F1229 H1230	M684-N723 HydrophobicContact CE-CB 4.21Å; S719-N723 WeakPolarHBondContact O-CB 3.37Å; S719-N723 PolarHBondContact O-N 2.79Å; S719-N723 VanDerWaalsContact O-N 3.16Å; S719-N723 PolarHBondContact O-ND2 2.85Å; S719-N723 VanDerWaalsContact O-ND2 3.12Å; S719-N723 PolarHBondContact OG-ND2 3.44Å; N723-F1229 WeakPolarHBondContact OD1-CE1 3.34Å; N723-H1230 PolarHBondContact OD1-CE1 2.6Å; N723-H1230 VanDerWaalsContact OD1-CE1 3.32Å; N723-H1230 PolarHBondContact OD1-ND1 2.99Å
724	V	85.6	Confident	80	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.036	25%	0.252	C	S	.	.			trans	-80.9	125.7	-178.3	-177.3	0	0	0	0	110.8	L691 L720 F726 L729 V737	L691-V724 HydrophobicContact CD2-CG1 4.14Å; L691-V724 HydrophobicContact CD2-CG2 3.63Å; L720-V724 VanDerWaalsContact O-CG2 3.28Å; L720-V724 WeakPolarHBondContact O-CG2 3.4Å; V724-F726 HydrophobicContact CB-CE2 4.29Å; V724-F726 HydrophobicContact CB-CZ 4.29Å; V724-F726 HydrophobicContact CG1-CD1 4.02Å; V724-F726 HydrophobicContact CG1-CD2 4.48Å; V724-F726 HydrophobicContact CG1-CE1 4.08Å; V724-F726 HydrophobicContact CG1-CG 4.23Å; V724-F726 HydrophobicContact CG1-CZ 4.36Å; V724-F726 PolarHBondContact O-N 3.23Å; V724-L729 HydrophobicContact CG1-CD1 3.68Å; V724-V737 HydrophobicContact CG1-CG1 4.18Å; V724-V737 HydrophobicContact CG2-CG1 4.05Å
725	L	89.8	Confident	81.2	Confident	18 Å²	18	45.5 Å²	45.5	9%	0.094	24%	0.243	C	C	.	.			trans	-84	85.1	167.7	-64.5	174.8	0	0	0	109.8	Y680 M684 L685 T688 E727 K728	Y680-L725 HydrophobicContact CD1-CD1 3.82Å; Y680-L725 HydrophobicContact CD1-CD2 3.57Å; Y680-L725 HydrophobicContact CD1-CG 4.28Å; Y680-L725 HydrophobicContact CE1-CD2 4.02Å; Y680-L725 HydrophobicContact CG-CD1 3.95Å; Y680-L725 HydrophobicContact CG-CD2 4.5Å; M684-L725 HydrophobicContact CB-CD1 3.84Å; M684-L725 HydrophobicContact CB-CD2 4.34Å; M684-L725 HydrophobicContact CB-CG 3.99Å; M684-L725 HydrophobicContact CE-CD2 3.56Å; M684-L725 HydrophobicContact CE-CG 4.12Å; M684-L725 HydrophobicContact SD-CD2 4.28Å; L685-L725 HydrophobicContact CB-CD1 4.36Å; L685-L725 HydrophobicContact CD1-CD1 4.28Å; T688-L725 HydrophobicContact CG2-CB 4.27Å; T688-L725 WeakPolarHBondContact OG1-CB 3.49Å; T688-L725 PolarHBondContact OG1-N 2.93Å; T688-L725 VanDerWaalsContact OG1-N 3.13Å; L725-E727 PolarHBondContact O-N 3.25Å; L725-E727 VanDerWaalsContact O-N 3.1Å; L725-K728 HydrophobicContact CB-CB 4.42Å; L725-K728 HydrophobicContact CB-CG 4.25Å; L725-K728 PolarHBondContact O-N 3.05Å
726	F	91.7	Very high	82.7	Confident	8 Å²	8	40.2 Å²	40.2	4%	0.035	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-56	-28.9	-178.6	-69.3	-75.6	0	0	0	113.4	E653 A654 A657 V724 K728 L729 I734 V737 R738	E653-F726 HydrophobicContact CB-CD2 3.81Å; E653-F726 HydrophobicContact CB-CE2 3.93Å; A654-F726 HydrophobicContact CB-CD1 3.99Å; A654-F726 HydrophobicContact CB-CD2 4.44Å; A654-F726 HydrophobicContact CB-CE1 3.86Å; A654-F726 HydrophobicContact CB-CE2 4.32Å; A654-F726 HydrophobicContact CB-CG 4.27Å; A654-F726 HydrophobicContact CB-CZ 4.03Å; A657-F726 HydrophobicContact CB-CB 3.48Å; A657-F726 VanDerWaalsContact CB-CB 3.48Å; V724-F726 HydrophobicContact CB-CE2 4.29Å; V724-F726 HydrophobicContact CB-CZ 4.29Å; V724-F726 HydrophobicContact CG1-CD1 4.02Å; V724-F726 HydrophobicContact CG1-CD2 4.48Å; V724-F726 HydrophobicContact CG1-CE1 4.08Å; V724-F726 HydrophobicContact CG1-CG 4.23Å; V724-F726 HydrophobicContact CG1-CZ 4.36Å; V724-F726 PolarHBondContact O-N 3.23Å; F726-K728 PolarHBondContact O-N 2.72Å; F726-L729 HydrophobicContact CD1-CD1 4.34Å; F726-L729 PolarHBondContact O-N 2.99Å; F726-I734 HydrophobicContact CD1-CG1 4.27Å; F726-I734 HydrophobicContact CD1-CG2 3.99Å; F726-I734 HydrophobicContact CE1-CG2 4.44Å; F726-V737 HydrophobicContact CE1-CG1 4.14Å; F726-R738 HydrophobicContact CE1-CG 4.23Å
727	E	86.6	Confident	84.4	Confident	68 Å²	68	38.4 Å²	38.4	32%	0.318	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-66.7	-11.9	176.8	-61.3	-174.4	-137.1	0	0	114.6	A657 R660 Y680 L725	A657-E727 HydrophobicContact CB-CG 4.38Å; R660-E727 IonicContact CZ-OE1 2.85Å; R660-E727 IonicContact NH1-OE1 3.81Å; R660-E727 PolarHBondContact NH1-OE1 2.87Å; R660-E727 IonicContact NH1-OE2 2.88Å; R660-E727 PolarHBondContact NH1-OE2 3.42Å; Y680-E727 VanDerWaalsContact OH-CD 3.25Å; Y680-E727 PolarHBondContact OH-OE2 2.75Å; L725-E727 PolarHBondContact O-N 3.25Å; L725-E727 VanDerWaalsContact O-N 3.1Å
728	K	89.5	Confident	86.2	Confident	62 Å²	62	37.9 Å²	37.9	27%	0.27	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-104.5	6.6	177.7	-63	-60.4	-175.6	-172.4	0	113.1	E677 Y680 L685 T688 Q692 L725 F726	E677-K728 IonicContact OE1-NZ 3.13Å; E677-K728 PolarHBondContact OE1-NZ 3.21Å; E677-K728 IonicContact OE2-NZ 3.42Å; E677-K728 PolarHBondContact OE2-NZ 2.98Å; Y680-K728 HydrophobicContact CE2-CD 4.5Å; L685-K728 HydrophobicContact CD1-CD 4.46Å; L685-K728 HydrophobicContact CD1-CG 4.03Å; T688-K728 HydrophobicContact CG2-CB 4.33Å; Q692-K728 PolarHBondContact NE2-O 3.33Å; L725-K728 HydrophobicContact CB-CB 4.42Å; L725-K728 HydrophobicContact CB-CG 4.25Å; L725-K728 PolarHBondContact O-N 3.05Å; F726-K728 PolarHBondContact O-N 2.72Å
729	L	91.5	Very high	87.5	Confident	5 Å²	5	38 Å²	38	3%	0.026	20%	0.199	C	C	.	.	S	Bend	trans	-108.1	150.8	178.3	-62.6	-177.3	0	0	0	110.7	L661 T688 Q692 V724 F726 E733 I734 V737	L661-L729 WeakPolarHBondContact CD1-O 3.31Å; T688-L729 HydrophobicContact CG2-CD2 3.86Å; T688-L729 HydrophobicContact CG2-CG 4.26Å; Q692-L729 HydrophobicContact CG-CD2 3.42Å; Q692-L729 VanDerWaalsContact CG-CD2 3.42Å; V724-L729 HydrophobicContact CG1-CD1 3.68Å; F726-L729 HydrophobicContact CD1-CD1 4.34Å; F726-L729 PolarHBondContact O-N 2.99Å; L729-E733 VanDerWaalsContact CA-OE2 3.29Å; L729-E733 WeakPolarHBondContact CA-OE2 3.41Å; L729-E733 HydrophobicContact CB-CB 3.96Å; L729-E733 HydrophobicContact CD2-CB 4.31Å; L729-I734 HydrophobicContact CB-CG1 3.71Å; L729-I734 HydrophobicContact CD1-CG1 4.42Å; L729-V737 HydrophobicContact CD1-CB 4.39Å; L729-V737 HydrophobicContact CD1-CG2 3.96Å
730	E	90.5	Very high	88.4	Confident	139 Å²	139	35.2 Å²	35.2	65%	0.65	18%	0.18	S	C	*	.			trans	-73.4	158.4	167	-63.6	-176.2	176.8	0	0	110.9	A732 E733 I734	E730-A732 PolarHBondContact O-N 2.9Å; E730-E733 HydrophobicContact CB-CG 4.2Å; E730-E733 PolarHBondContact N-OE2 3Å; E730-E733 CarbonylContact O-C 3.59Å; E730-E733 WeakPolarHBondContact O-CA 3.42Å; E730-E733 WeakPolarHBondContact O-CB 3.22Å; E730-E733 PolarHBondContact O-N 3.33Å; E730-I734 WeakPolarHBondContact O-CG1 3.37Å; E730-I734 PolarHBondContact O-N 2.81Å
731	V	89.6	Confident	89	Confident	51 Å²	51	34.8 Å²	34.8	31%	0.309	18%	0.177	S	C	.	.	H	α-helix	trans	-54.8	-41.4	-178.1	179.4	0	0	0	0	112	L661 E733 I734 D735	L661-V731 HydrophobicContact CB-CG2 4.24Å; L661-V731 HydrophobicContact CD1-CG2 4.03Å; V731-E733 VanDerWaalsContact C-N 3.34Å; V731-E733 PolarHBondContact O-N 3.45Å; V731-I734 PolarHBondContact O-N 2.98Å; V731-D735 PolarHBondContact O-N 3.3Å
732	A	90.7	Very high	89.4	Confident	59 Å²	59	40.2 Å²	40.2	49%	0.488	20%	0.197	S	C	.	.	H	α-helix	trans	-64.4	-36.4	176	0	0	0	0	0	112.9	M699 E730 F736	M699-A732 HydrophobicContact CE-CB 4.1Å; M699-A732 WeakPolarHBondContact CE-O 3.45Å; E730-A732 PolarHBondContact O-N 2.9Å; A732-F736 WeakPolarHBondContact O-CB 3.37Å; A732-F736 PolarHBondContact O-N 3.16Å; A732-F736 VanDerWaalsContact O-N 3.11Å
733	E	92.4	Very high	89.8	Confident	30 Å²	30	40.7 Å²	40.7	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-70.1	-41.3	175.2	-64.1	-178.5	130.7	0	0	111	Q692 I695 M699 L729 E730 V731 D735 F736 V737	Q692-E733 PolarHBondContact NE2-OE1 3.28Å; Q692-E733 PolarHBondContact NE2-OE2 2.83Å; Q692-E733 VanDerWaalsContact NE2-OE2 3.07Å; I695-E733 HydrophobicContact CD1-CB 4.22Å; I695-E733 HydrophobicContact CD1-CG 4.42Å; M699-E733 HydrophobicContact CE-CB 4.4Å; M699-E733 HydrophobicContact CE-CG 3.93Å; M699-E733 HydrophobicContact SD-CB 4.47Å; M699-E733 HydrophobicContact SD-CG 4.05Å; L729-E733 VanDerWaalsContact CA-OE2 3.29Å; L729-E733 WeakPolarHBondContact CA-OE2 3.41Å; L729-E733 HydrophobicContact CB-CB 3.96Å; L729-E733 HydrophobicContact CD2-CB 4.31Å; E730-E733 HydrophobicContact CB-CG 4.2Å; E730-E733 PolarHBondContact N-OE2 3Å; E730-E733 CarbonylContact O-C 3.59Å; E730-E733 WeakPolarHBondContact O-CA 3.42Å; E730-E733 WeakPolarHBondContact O-CB 3.22Å; E730-E733 PolarHBondContact O-N 3.33Å; V731-E733 VanDerWaalsContact C-N 3.34Å; V731-E733 PolarHBondContact O-N 3.45Å; E733-D735 VanDerWaalsContact C-N 3.32Å; E733-D735 PolarHBondContact O-N 2.95Å; E733-F736 PolarHBondContact O-N 3.4Å; E733-V737 WeakPolarHBondContact O-CB 3.08Å; E733-V737 VanDerWaalsContact O-CG2 3.27Å; E733-V737 WeakPolarHBondContact O-CG2 3.48Å; E733-V737 PolarHBondContact O-N 3.19Å
734	I	93.3	Very high	90.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-56.7	-48.4	175.3	-66.4	174.2	0	0	0	110.1	A654 A657 R658 L661 F726 L729 E730 V731 F736 V737 R738	A654-I734 HydrophobicContact CB-CG2 3.91Å; A657-I734 HydrophobicContact CB-CD1 4Å; R658-I734 HydrophobicContact CG-CD1 4.38Å; R658-I734 HydrophobicContact CG-CG2 4.17Å; L661-I734 HydrophobicContact CD1-CD1 3.63Å; F726-I734 HydrophobicContact CD1-CG1 4.27Å; F726-I734 HydrophobicContact CD1-CG2 3.99Å; F726-I734 HydrophobicContact CE1-CG2 4.44Å; L729-I734 HydrophobicContact CB-CG1 3.71Å; L729-I734 HydrophobicContact CD1-CG1 4.42Å; E730-I734 WeakPolarHBondContact O-CG1 3.37Å; E730-I734 PolarHBondContact O-N 2.81Å; V731-I734 PolarHBondContact O-N 2.98Å; I734-F736 PolarHBondContact O-N 2.92Å; I734-V737 PolarHBondContact O-N 3.21Å; I734-R738 WeakPolarHBondContact O-CG 3.36Å; I734-R738 PolarHBondContact O-N 3.5Å
735	D	92.1	Very high	90.2	Very high	63 Å²	63	41 Å²	41	34%	0.337	20%	0.198	S	C	.	.	H	α-helix	trans	-66.4	-37.9	-178.8	-70.5	-19.7	0	0	0	112.1	R658 V731 E733 K739	R658-D735 IonicContact CZ-OD1 3.3Å; R658-D735 VanDerWaalsContact CZ-OD1 3.32Å; R658-D735 IonicContact NE-OD1 3.96Å; R658-D735 PolarHBondContact NE-OD1 2.92Å; R658-D735 IonicContact NH2-OD1 3.27Å; R658-D735 PolarHBondContact NH2-OD1 2.88Å; V731-D735 PolarHBondContact O-N 3.3Å; E733-D735 VanDerWaalsContact C-N 3.32Å; E733-D735 PolarHBondContact O-N 2.95Å; D735-K739 WeakPolarHBondContact O-CG 3.33Å; D735-K739 PolarHBondContact O-N 2.84Å
736	F	91.6	Very high	90	Very high	34 Å²	34	46 Å²	46	15%	0.149	22%	0.221	C	C	.	.	H	α-helix	trans	-67.8	-42.8	174.7	-168.9	-98.9	0	0	0	112.4	I695 P698 M699 T709 A732 E733 I734 K739 L740	I695-F736 HydrophobicContact CB-CD1 3.69Å; I695-F736 HydrophobicContact CB-CE1 3.69Å; I695-F736 HydrophobicContact CD1-CD1 4.42Å; I695-F736 HydrophobicContact CG2-CD1 3.89Å; I695-F736 HydrophobicContact CG2-CE1 3.84Å; P698-F736 HydrophobicContact CB-CE1 3.98Å; P698-F736 HydrophobicContact CB-CZ 3.53Å; M699-F736 HydrophobicContact CE-CB 4.25Å; M699-F736 HydrophobicContact CG-CB 3.86Å; M699-F736 HydrophobicContact CG-CD1 3.48Å; M699-F736 VanDerWaalsContact CG-CD1 3.48Å; M699-F736 HydrophobicContact CG-CD2 3.69Å; M699-F736 HydrophobicContact CG-CE1 3.86Å; M699-F736 HydrophobicContact CG-CE2 4.08Å; M699-F736 HydrophobicContact CG-CG 3.37Å; M699-F736 HydrophobicContact CG-CZ 4.17Å; M699-F736 HydrophobicContact SD-CB 3.93Å; M699-F736 HydrophobicContact SD-CD1 4.05Å; M699-F736 HydrophobicContact SD-CG 4.03Å; T709-F736 HydrophobicContact CG2-CE1 4.28Å; T709-F736 HydrophobicContact CG2-CZ 4.36Å; A732-F736 WeakPolarHBondContact O-CB 3.37Å; A732-F736 PolarHBondContact O-N 3.16Å; A732-F736 VanDerWaalsContact O-N 3.11Å; E733-F736 PolarHBondContact O-N 3.4Å; I734-F736 PolarHBondContact O-N 2.92Å; F736-K739 WeakPolarHBondContact O-CB 3.33Å; F736-K739 PolarHBondContact O-N 2.82Å; F736-L740 HydrophobicContact CD1-CD1 3.86Å; F736-L740 HydrophobicContact CD1-CG 4.28Å; F736-L740 HydrophobicContact CE1-CD1 3.59Å; F736-L740 HydrophobicContact CE1-CD2 4.44Å; F736-L740 HydrophobicContact CE1-CG 4.01Å; F736-L740 HydrophobicContact CZ-CD1 4.5Å; F736-L740 PolarHBondContact O-N 3.14Å
737	V	91.5	Very high	89.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.6	-40	176.4	171.2	0	0	0	0	111.5	L691 I695 V724 F726 L729 E733 I734 K739 L740 Q741	L691-V737 HydrophobicContact CD2-CG1 3.96Å; L691-V737 HydrophobicContact CD2-CG2 3.82Å; L691-V737 HydrophobicContact CG-CG2 4.23Å; I695-V737 HydrophobicContact CD1-CG2 3.65Å; V724-V737 HydrophobicContact CG1-CG1 4.18Å; V724-V737 HydrophobicContact CG2-CG1 4.05Å; F726-V737 HydrophobicContact CE1-CG1 4.14Å; L729-V737 HydrophobicContact CD1-CB 4.39Å; L729-V737 HydrophobicContact CD1-CG2 3.96Å; E733-V737 WeakPolarHBondContact O-CB 3.08Å; E733-V737 VanDerWaalsContact O-CG2 3.27Å; E733-V737 WeakPolarHBondContact O-CG2 3.48Å; E733-V737 PolarHBondContact O-N 3.19Å; I734-V737 PolarHBondContact O-N 3.21Å; V737-K739 VanDerWaalsContact C-N 3.35Å; V737-K739 PolarHBondContact O-N 2.8Å; V737-L740 WeakPolarHBondContact O-CB 3.07Å; V737-L740 PolarHBondContact O-N 2.94Å; V737-Q741 HydrophobicContact CG1-CG 4.34Å; V737-Q741 WeakPolarHBondContact O-CG 3.36Å; V737-Q741 PolarHBondContact O-N 3.43Å
738	R	92.8	Very high	89.8	Confident	3 Å²	3	45.9 Å²	45.9	1%	0.011	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-38.9	173.2	-76.6	-60.2	-61.9	138.5	-3.3	112	D647 E651 A654 F726 I734 L740 Q741 R742	D647-R738 IonicContact OD1-CZ 2.73Å; D647-R738 IonicContact OD1-NH1 2.64Å; D647-R738 PolarHBondContact OD1-NH1 2.96Å; D647-R738 IonicContact OD1-NH2 2.75Å; D647-R738 PolarHBondContact OD1-NH2 3.1Å; D647-R738 IonicContact OD2-NH2 3.15Å; E651-R738 IonicContact OE2-CZ 3.26Å; E651-R738 VanDerWaalsContact OE2-CZ 3.25Å; E651-R738 IonicContact OE2-NE 2.7Å; E651-R738 PolarHBondContact OE2-NE 3.02Å; E651-R738 IonicContact OE2-NH2 3.4Å; E651-R738 PolarHBondContact OE2-NH2 3.3Å; A654-R738 HydrophobicContact CB-CG 3.69Å; F726-R738 HydrophobicContact CE1-CG 4.23Å; I734-R738 WeakPolarHBondContact O-CG 3.36Å; I734-R738 PolarHBondContact O-N 3.5Å; R738-L740 VanDerWaalsContact C-N 3.34Å; R738-L740 PolarHBondContact O-N 3.48Å; R738-Q741 VanDerWaalsContact CD-OE1 3.23Å; R738-Q741 PolarHBondContact O-N 3.4Å; R738-R742 WeakPolarHBondContact O-CB 3.47Å; R738-R742 WeakPolarHBondContact O-CG 3.44Å; R738-R742 PolarHBondContact O-N 3.4Å
739	K	90.8	Very high	89.6	Confident	127 Å²	127	44.3 Å²	44.3	55%	0.552	22%	0.222	S	C	*	.	H	α-helix	trans	-59.4	-44.3	171.6	-74.4	173.8	-177.2	178.4	0	111.5	L706 D735 F736 V737 Q743	L706-K739 HydrophobicContact CD1-CB 4.21Å; L706-K739 HydrophobicContact CD2-CB 4.41Å; D735-K739 WeakPolarHBondContact O-CG 3.33Å; D735-K739 PolarHBondContact O-N 2.84Å; F736-K739 WeakPolarHBondContact O-CB 3.33Å; F736-K739 PolarHBondContact O-N 2.82Å; V737-K739 VanDerWaalsContact C-N 3.35Å; V737-K739 PolarHBondContact O-N 2.8Å; K739-Q743 WeakPolarHBondContact O-CB 3.34Å; K739-Q743 PolarHBondContact O-N 2.98Å
740	L	88.9	Confident	89.4	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-64.7	-45.1	175.9	-71.7	173.9	0	0	0	113.1	I695 L706 T709 V710 L721 F736 V737 R738 Q743 Y744	I695-L740 HydrophobicContact CG2-CD1 3.55Å; L706-L740 HydrophobicContact CD1-CD2 3.56Å; L706-L740 HydrophobicContact CD1-CG 4.11Å; L706-L740 HydrophobicContact CG-CD2 4.24Å; T709-L740 HydrophobicContact CG2-CD1 4.02Å; T709-L740 HydrophobicContact CG2-CD2 3.54Å; T709-L740 HydrophobicContact CG2-CG 4.41Å; V710-L740 HydrophobicContact CG2-CD2 3.8Å; L721-L740 HydrophobicContact CD2-CB 4.34Å; F736-L740 HydrophobicContact CD1-CD1 3.86Å; F736-L740 HydrophobicContact CD1-CG 4.28Å; F736-L740 HydrophobicContact CE1-CD1 3.59Å; F736-L740 HydrophobicContact CE1-CD2 4.44Å; F736-L740 HydrophobicContact CE1-CG 4.01Å; F736-L740 HydrophobicContact CZ-CD1 4.5Å; F736-L740 PolarHBondContact O-N 3.14Å; V737-L740 WeakPolarHBondContact O-CB 3.07Å; V737-L740 PolarHBondContact O-N 2.94Å; R738-L740 VanDerWaalsContact C-N 3.34Å; R738-L740 PolarHBondContact O-N 3.48Å; L740-Q743 PolarHBondContact O-N 3.43Å; L740-Y744 WeakPolarHBondContact O-CB 3.5Å; L740-Y744 PolarHBondContact O-N 2.88Å
741	Q	90.3	Very high	89.4	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-45.3	177.7	-77.9	178.1	-26.6	0	0	111.5	F650 L721 V737 R738 Y744 L745	F650-Q741 HydrophobicContact CD2-CB 4.4Å; F650-Q741 HydrophobicContact CD2-CG 4.34Å; L721-Q741 HydrophobicContact CB-CG 4.26Å; L721-Q741 HydrophobicContact CD2-CG 4.11Å; L721-Q741 PolarHBondContact O-NE2 3.29Å; V737-Q741 HydrophobicContact CG1-CG 4.34Å; V737-Q741 WeakPolarHBondContact O-CG 3.36Å; V737-Q741 PolarHBondContact O-N 3.43Å; R738-Q741 VanDerWaalsContact CD-OE1 3.23Å; R738-Q741 PolarHBondContact O-N 3.4Å; Q741-Y744 PolarHBondContact O-N 3.12Å; Q741-L745 WeakPolarHBondContact O-CB 3.36Å; Q741-L745 VanDerWaalsContact O-CG 3.27Å; Q741-L745 WeakPolarHBondContact O-CG 3.45Å; Q741-L745 PolarHBondContact O-N 3.28Å
742	R	89.8	Confident	89.4	Confident	118 Å²	118	41.7 Å²	41.7	45%	0.445	22%	0.215	S	C	.	.	H	α-helix	trans	-61.3	-45.6	176.6	-72.9	-180	-167.4	168.5	3.5	111.6	E651 R738 Y744 L745 Q746	E651-R742 VanDerWaalsContact CD-NH2 3.33Å; E651-R742 IonicContact OE1-NH2 2.68Å; E651-R742 IonicContact OE2-CZ 3.76Å; E651-R742 IonicContact OE2-NE 3.68Å; E651-R742 IonicContact OE2-NH2 2.7Å; E651-R742 PolarHBondContact OE2-NH2 2.85Å; R738-R742 WeakPolarHBondContact O-CB 3.47Å; R738-R742 WeakPolarHBondContact O-CG 3.44Å; R738-R742 PolarHBondContact O-N 3.4Å; R742-Y744 PolarHBondContact O-N 2.78Å; R742-L745 PolarHBondContact O-N 3.29Å; R742-Q746 VanDerWaalsContact O-CB 3.24Å; R742-Q746 WeakPolarHBondContact O-CB 3.35Å; R742-Q746 PolarHBondContact O-N 2.67Å
743	Q	87.6	Confident	89.3	Confident	45 Å²	45	39.4 Å²	39.4	21%	0.21	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-44.4	176	-174.8	65.9	57	0	0	111.8	L706 V710 K739 L740 Q746 D747	L706-Q743 HydrophobicContact CD2-CB 3.84Å; L706-Q743 HydrophobicContact CD2-CG 4.17Å; L706-Q743 HydrophobicContact CG-CB 4.26Å; L706-Q743 HydrophobicContact CG-CG 4.37Å; V710-Q743 HydrophobicContact CG2-CB 3.9Å; V710-Q743 HydrophobicContact CG2-CG 3.81Å; K739-Q743 WeakPolarHBondContact O-CB 3.34Å; K739-Q743 PolarHBondContact O-N 2.98Å; L740-Q743 PolarHBondContact O-N 3.43Å; Q743-Q746 PolarHBondContact O-N 3.41Å; Q743-D747 PolarHBondContact NE2-OD1 2.81Å; Q743-D747 PolarHBondContact O-N 3.16Å
744	Y	87.1	Confident	89.2	Confident	21 Å²	21	41 Å²	41	8%	0.082	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-44.8	177.6	173	-102.8	0	0	0	112.7	V710 K714 R718 L721 L740 Q741 R742 D747 C748	V710-Y744 HydrophobicContact CG1-CD2 4.14Å; K714-Y744 HydrophobicContact CG-CE2 4.47Å; R718-Y744 WeakPolarHBondContact CD-OH 3.38Å; R718-Y744 HydrophobicContact CG-CE1 4.38Å; R718-Y744 VanDerWaalsContact CG-OH 3.31Å; R718-Y744 WeakPolarHBondContact CG-OH 3.12Å; L721-Y744 HydrophobicContact CD1-CD1 4.19Å; L721-Y744 HydrophobicContact CD1-CD2 4.3Å; L721-Y744 HydrophobicContact CD1-CG 3.84Å; L740-Y744 WeakPolarHBondContact O-CB 3.5Å; L740-Y744 PolarHBondContact O-N 2.88Å; Q741-Y744 PolarHBondContact O-N 3.12Å; R742-Y744 PolarHBondContact O-N 2.78Å; Y744-D747 PolarHBondContact O-N 2.88Å; Y744-C748 PolarHBondContact O-N 3.43Å; Y744-C748 PolarHBondContact O-SG 3.16Å
745	L	86.4	Confident	89.2	Confident	8 Å²	8	43.7 Å²	43.7	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-40.5	177.6	-70.2	168.7	0	0	0	111	M643 L646 D647 F650 Q741 R742 C748 C749	M643-L745 HydrophobicContact CB-CD2 4.41Å; M643-L745 HydrophobicContact CG-CD2 4.49Å; M643-L745 HydrophobicContact SD-CD2 3.64Å; L646-L745 HydrophobicContact CD2-CD2 4.11Å; D647-L745 HydrophobicContact CB-CD1 3.68Å; F650-L745 HydrophobicContact CD2-CD1 4.03Å; F650-L745 HydrophobicContact CE2-CD1 4.14Å; Q741-L745 WeakPolarHBondContact O-CB 3.36Å; Q741-L745 VanDerWaalsContact O-CG 3.27Å; Q741-L745 WeakPolarHBondContact O-CG 3.45Å; Q741-L745 PolarHBondContact O-N 3.28Å; R742-L745 PolarHBondContact O-N 3.29Å; L745-C748 PolarHBondContact O-N 3.47Å; L745-C749 WeakPolarHBondContact O-CB 3.41Å; L745-C749 PolarHBondContact O-N 3.49Å; L745-C749 PolarHBondContact O-SG 3.36Å
746	Q	85.9	Confident	89.1	Confident	122 Å²	122	40.9 Å²	40.9	57%	0.57	20%	0.2	S	C	*	.	H	α-helix	trans	-60.9	-45.2	174	-173.8	175.7	4.2	0	0	111.8	R742 Q743 C748 C749 Q750	R742-Q746 VanDerWaalsContact O-CB 3.24Å; R742-Q746 WeakPolarHBondContact O-CB 3.35Å; R742-Q746 PolarHBondContact O-N 2.67Å; Q743-Q746 PolarHBondContact O-N 3.41Å; Q746-C748 VanDerWaalsContact C-N 3.32Å; Q746-C748 PolarHBondContact O-N 3.07Å; Q746-C749 PolarHBondContact O-N 2.81Å; Q746-Q750 VanDerWaalsContact O-CB 3.31Å; Q746-Q750 WeakPolarHBondContact O-CB 3.38Å; Q746-Q750 PolarHBondContact O-N 3.07Å
747	D	85.6	Confident	88.9	Confident	45 Å²	45	40.1 Å²	40.1	24%	0.241	20%	0.197	C	C	.	.	H	α-helix	trans	-61.4	-39.8	176.1	-67.9	-8.4	0	0	0	111.6	Q743 Y744 A751	Q743-D747 PolarHBondContact NE2-OD1 2.81Å; Q743-D747 PolarHBondContact O-N 3.16Å; Y744-D747 PolarHBondContact O-N 2.88Å; D747-A751 PolarHBondContact O-N 2.91Å; D747-A751 VanDerWaalsContact O-N 3.16Å
748	C	87.2	Confident	88.7	Confident	29 Å²	29	45 Å²	45	20%	0.196	22%	0.219	C	C	.	.	H	α-helix	trans	-67.8	-45.9	176.5	-66.3	0	0	0	0	112	Y744 L745 Q746 Q750 A751 M752	Y744-C748 PolarHBondContact O-N 3.43Å; Y744-C748 PolarHBondContact O-SG 3.16Å; L745-C748 PolarHBondContact O-N 3.47Å; Q746-C748 VanDerWaalsContact C-N 3.32Å; Q746-C748 PolarHBondContact O-N 3.07Å; C748-Q750 VanDerWaalsContact C-N 3.34Å; C748-A751 PolarHBondContact O-N 3.48Å; C748-M752 HydrophobicContact CB-CE 4.09Å; C748-M752 VanDerWaalsContact O-CE 3.28Å; C748-M752 WeakPolarHBondContact O-CE 3.48Å; C748-M752 WeakPolarHBondContact O-CG 3.47Å; C748-M752 PolarHBondContact O-N 3.39Å; C748-M752 VanDerWaalsContact O-N 3.11Å
749	C	86.5	Confident	88.5	Confident	29 Å²	29	45 Å²	45	20%	0.196	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-43.4	176	-71.3	0	0	0	0	111	L745 Q746 A751 M752 V753	L745-C749 WeakPolarHBondContact O-CB 3.41Å; L745-C749 PolarHBondContact O-N 3.49Å; L745-C749 PolarHBondContact O-SG 3.36Å; Q746-C749 PolarHBondContact O-N 2.81Å; C749-A751 PolarHBondContact O-N 3.48Å; C749-M752 WeakPolarHBondContact O-CB 3.34Å; C749-M752 PolarHBondContact O-N 2.93Å; C749-M752 VanDerWaalsContact O-N 3.11Å; C749-V753 VanDerWaalsContact O-CG2 3.32Å; C749-V753 WeakPolarHBondContact O-CG2 3.43Å; C749-V753 PolarHBondContact O-N 3.26Å
750	Q	87.5	Confident	88.2	Confident	69 Å²	69	39.7 Å²	39.7	32%	0.322	20%	0.197	S	C	.	.	H	α-helix	trans	-59.3	-44.7	178	-175.8	63.6	23.5	0	0	111.9	Q746 C748 M752 V753 E754 S880 Q881	Q746-Q750 VanDerWaalsContact O-CB 3.31Å; Q746-Q750 WeakPolarHBondContact O-CB 3.38Å; Q746-Q750 PolarHBondContact O-N 3.07Å; C748-Q750 VanDerWaalsContact C-N 3.34Å; Q750-M752 VanDerWaalsContact C-N 3.32Å; Q750-M752 PolarHBondContact O-N 3.37Å; Q750-V753 PolarHBondContact O-N 3.32Å; Q750-E754 PolarHBondContact NE2-OE1 3.04Å; Q750-E754 WeakPolarHBondContact O-CG 3.25Å; Q750-E754 PolarHBondContact O-N 3.25Å; Q750-S880 PolarHBondContact NE2-OG 3.4Å; Q750-Q881 VanDerWaalsContact NE2-NE2 3.18Å
751	A	88.9	Confident	87.7	Confident	53 Å²	53	40.1 Å²	40.1	44%	0.438	20%	0.202	S	C	.	.	H	α-helix	trans	-62.1	-39.1	175.6	0	0	0	0	0	112.3	D747 C748 C749 E754 E755	D747-A751 PolarHBondContact O-N 2.91Å; D747-A751 VanDerWaalsContact O-N 3.16Å; C748-A751 PolarHBondContact O-N 3.48Å; C749-A751 PolarHBondContact O-N 3.48Å; A751-E754 PolarHBondContact O-N 3.42Å; A751-E755 PolarHBondContact O-N 3.29Å; A751-E755 VanDerWaalsContact O-N 3.11Å
752	M	90.6	Very high	87.4	Confident	18 Å²	18	43.4 Å²	43.4	9%	0.089	22%	0.216	C	C	.	.	H	α-helix	trans	-66.7	-39.3	175.5	-72	-177.1	-94.4	0	0	112.5	L636 Q639 M640 M643 C748 C749 Q750 E755 L756	L636-M752 HydrophobicContact CD2-CB 4.23Å; L636-M752 HydrophobicContact CD2-CG 3.97Å; Q639-M752 HydrophobicContact CB-SD 3.75Å; M640-M752 HydrophobicContact CG-CB 3.81Å; M640-M752 HydrophobicContact CG-CE 4.43Å; M640-M752 HydrophobicContact CG-CG 4.42Å; M640-M752 HydrophobicContact CG-SD 3.78Å; M640-M752 HydrophobicContact SD-CB 4.03Å; M643-M752 HydrophobicContact CG-CE 3.63Å; C748-M752 HydrophobicContact CB-CE 4.09Å; C748-M752 VanDerWaalsContact O-CE 3.28Å; C748-M752 WeakPolarHBondContact O-CE 3.48Å; C748-M752 WeakPolarHBondContact O-CG 3.47Å; C748-M752 PolarHBondContact O-N 3.39Å; C748-M752 VanDerWaalsContact O-N 3.11Å; C749-M752 WeakPolarHBondContact O-CB 3.34Å; C749-M752 PolarHBondContact O-N 2.93Å; C749-M752 VanDerWaalsContact O-N 3.11Å; Q750-M752 VanDerWaalsContact C-N 3.32Å; Q750-M752 PolarHBondContact O-N 3.37Å; M752-E755 PolarHBondContact O-N 3.35Å; M752-L756 VanDerWaalsContact O-CB 3.25Å; M752-L756 WeakPolarHBondContact O-CB 3.12Å; M752-L756 PolarHBondContact O-N 2.95Å
753	V	89.4	Confident	87	Confident	11 Å²	11	38.9 Å²	38.9	7%	0.067	20%	0.203	C	C	.	.	H	α-helix	trans	-65.3	-41.3	176.2	178.5	0	0	0	0	110.9	M640 C749 Q750 L756 F757 F877 F878	M640-V753 HydrophobicContact CE-CG2 3.57Å; M640-V753 HydrophobicContact SD-CG2 4.18Å; C749-V753 VanDerWaalsContact O-CG2 3.32Å; C749-V753 WeakPolarHBondContact O-CG2 3.43Å; C749-V753 PolarHBondContact O-N 3.26Å; Q750-V753 PolarHBondContact O-N 3.32Å; V753-L756 PolarHBondContact O-N 3.33Å; V753-F757 WeakPolarHBondContact O-CB 3.31Å; V753-F757 PolarHBondContact O-N 3.38Å; V753-F877 HydrophobicContact CG1-CD1 4.35Å; V753-F877 HydrophobicContact CG1-CE1 3.97Å; V753-F877 HydrophobicContact CG1-CZ 4.48Å; V753-F877 HydrophobicContact CG2-CE1 4.11Å; V753-F877 HydrophobicContact CG2-CE2 4.29Å; V753-F877 HydrophobicContact CG2-CZ 3.8Å; V753-F878 HydrophobicContact CG1-CD1 3.71Å; V753-F878 HydrophobicContact CG1-CE1 3.9Å
754	E	90.5	Very high	86.2	Confident	64 Å²	64	39.6 Å²	39.6	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-60.5	-45.8	175.5	-71.5	178.9	168.2	0	0	111.8	Q750 A751 F757 E758 Q881 R884	Q750-E754 PolarHBondContact NE2-OE1 3.04Å; Q750-E754 WeakPolarHBondContact O-CG 3.25Å; Q750-E754 PolarHBondContact O-N 3.25Å; A751-E754 PolarHBondContact O-N 3.42Å; E754-F757 PolarHBondContact O-N 3.46Å; E754-E758 PolarHBondContact O-N 3.02Å; E754-E758 VanDerWaalsContact O-N 3.14Å; E754-Q881 HydrophobicContact CG-CG 4.21Å; E754-R884 IonicContact OE1-CZ 3.01Å; E754-R884 IonicContact OE1-NH1 3.56Å; E754-R884 PolarHBondContact OE1-NH1 3.41Å; E754-R884 IonicContact OE1-NH2 3.48Å; E754-R884 PolarHBondContact OE1-NH2 2.96Å
755	E	91.5	Very high	85.1	Confident	57 Å²	57	39.9 Å²	39.9	27%	0.266	23%	0.225	S	C	.	.	H	α-helix	trans	-65.4	-40.1	176.3	-168.5	-179	153.5	0	0	112.3	R632 L636 A751 M752 E758 L759	R632-E755 IonicContact CZ-OE1 2.74Å; R632-E755 IonicContact NE-OE1 2.68Å; R632-E755 PolarHBondContact NE-OE1 2.88Å; R632-E755 IonicContact NH2-OE1 4Å; R632-E755 PolarHBondContact NH2-OE1 2.64Å; R632-E755 IonicContact NH2-OE2 3.98Å; L636-E755 HydrophobicContact CD1-CB 4Å; L636-E755 HydrophobicContact CD1-CG 3.71Å; A751-E755 PolarHBondContact O-N 3.29Å; A751-E755 VanDerWaalsContact O-N 3.11Å; M752-E755 PolarHBondContact O-N 3.35Å; E755-E758 PolarHBondContact O-N 2.9Å; E755-L759 HydrophobicContact CG-CD1 4.11Å; E755-L759 WeakPolarHBondContact O-CG 3.44Å; E755-L759 PolarHBondContact O-N 3.09Å
756	L	90.3	Very high	84	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-64.1	-43.3	177.6	-168.9	65.4	0	0	0	111.2	V633 L636 R637 M752 V753 E758 L759 M760 F877 F878	V633-L756 HydrophobicContact CB-CD1 4.12Å; V633-L756 HydrophobicContact CG1-CD1 3.76Å; V633-L756 HydrophobicContact CG2-CD1 4.18Å; L636-L756 HydrophobicContact CB-CD1 4.24Å; L636-L756 HydrophobicContact CD1-CB 4.41Å; L636-L756 HydrophobicContact CD1-CD1 4.34Å; R637-L756 HydrophobicContact CG-CD1 4.31Å; R637-L756 HydrophobicContact CG-CD2 4.16Å; M752-L756 VanDerWaalsContact O-CB 3.25Å; M752-L756 WeakPolarHBondContact O-CB 3.12Å; M752-L756 PolarHBondContact O-N 2.95Å; V753-L756 PolarHBondContact O-N 3.33Å; L756-E758 VanDerWaalsContact C-N 3.34Å; L756-E758 PolarHBondContact O-N 2.85Å; L756-L759 PolarHBondContact O-N 3.15Å; L756-M760 HydrophobicContact CG-CG 4.39Å; L756-M760 HydrophobicContact CG-SD 4.09Å; L756-M760 WeakPolarHBondContact O-CB 3.26Å; L756-M760 VanDerWaalsContact O-CG 3.29Å; L756-M760 WeakPolarHBondContact O-CG 3.31Å; L756-M760 PolarHBondContact O-N 2.97Å; L756-F877 HydrophobicContact CD2-CE1 3.81Å; L756-F877 HydrophobicContact CD2-CZ 3.99Å; L756-F878 HydrophobicContact CB-CE1 4.42Å; L756-F878 HydrophobicContact CD2-CZ 4.14Å; L756-F878 HydrophobicContact CG-CE1 4.48Å; L756-F878 HydrophobicContact CG-CZ 4.21Å
757	F	88.6	Confident	82.8	Confident	18 Å²	18	37.1 Å²	37.1	8%	0.079	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-42.9	175.9	-175.8	-95.7	0	0	0	111.8	V753 E754 G761 L778 R780 F878 Q881 I882 M885	V753-F757 WeakPolarHBondContact O-CB 3.31Å; V753-F757 PolarHBondContact O-N 3.38Å; E754-F757 PolarHBondContact O-N 3.46Å; F757-G761 PolarHBondContact O-N 3.01Å; F757-L778 HydrophobicContact CD2-CD2 3.63Å; F757-L778 HydrophobicContact CE1-CD2 4.38Å; F757-L778 HydrophobicContact CE2-CD1 3.63Å; F757-L778 HydrophobicContact CE2-CD2 3.2Å; F757-L778 HydrophobicContact CE2-CG 3.98Å; F757-L778 HydrophobicContact CG-CD2 4.42Å; F757-L778 HydrophobicContact CZ-CD1 3.69Å; F757-L778 HydrophobicContact CZ-CD2 3.64Å; F757-L778 HydrophobicContact CZ-CG 4.09Å; F757-R780 HydrophobicContact CE1-CG 3.93Å; F757-R780 HydrophobicContact CZ-CG 4.39Å; F757-F878 HydrophobicContact CB-CD1 3.83Å; F757-F878 HydrophobicContact CB-CE1 3.78Å; F757-F878 HydrophobicContact CD2-CB 3.93Å; F757-F878 AromaticContact CD2-CD1 3.54Å; F757-F878 HydrophobicContact CD2-CD1 3.54Å; F757-F878 HydrophobicContact CD2-CE1 4.15Å; F757-F878 AromaticContact CD2-CG 3.75Å; F757-F878 HydrophobicContact CD2-CG 3.75Å; F757-F878 HydrophobicContact CE2-CB 4.17Å; F757-F878 HydrophobicContact CE2-CG 4.41Å; F757-F878 HydrophobicContact CG-CD1 4.16Å; F757-F878 HydrophobicContact CG-CE1 4.5Å; F757-Q881 HydrophobicContact CB-CB 4.37Å; F757-Q881 HydrophobicContact CB-CG 4.12Å; F757-Q881 HydrophobicContact CD1-CB 3.94Å; F757-Q881 HydrophobicContact CD1-CG 4.34Å; F757-Q881 HydrophobicContact CD2-CB 3.67Å; F757-Q881 HydrophobicContact CD2-CG 4.31Å; F757-Q881 HydrophobicContact CE1-CB 4.02Å; F757-Q881 HydrophobicContact CE2-CB 3.71Å; F757-Q881 HydrophobicContact CG-CB 3.75Å; F757-Q881 HydrophobicContact CG-CG 4.03Å; F757-Q881 HydrophobicContact CZ-CB 3.89Å; F757-I882 HydrophobicContact CE2-CG1 4.04Å; F757-M885 HydrophobicContact CZ-SD 4.29Å
758	E	87.3	Confident	82.7	Confident	102 Å²	102	35.8 Å²	35.8	48%	0.477	21%	0.212	S	C	.	.	H	α-helix	trans	-64.9	-42.5	175.2	-73.9	-173.4	-173.6	0	0	113.1	E754 E755 L756 K762	E754-E758 PolarHBondContact O-N 3.02Å; E754-E758 VanDerWaalsContact O-N 3.14Å; E755-E758 PolarHBondContact O-N 2.9Å; L756-E758 VanDerWaalsContact C-N 3.34Å; L756-E758 PolarHBondContact O-N 2.85Å; E758-K762 WeakPolarHBondContact O-CG 3.46Å; E758-K762 PolarHBondContact O-N 3.15Å
759	L	88.3	Confident	82.8	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-72.3	-37.7	-178.7	-72.7	167.1	0	0	0	112.4	N629 R632 V633 L636 E755 L756 G761 K762 C763	N629-L759 HydrophobicContact CB-CD2 4.06Å; R632-L759 HydrophobicContact CB-CD1 3.88Å; R632-L759 HydrophobicContact CG-CD1 3.58Å; V633-L759 HydrophobicContact CG2-CB 3.58Å; V633-L759 HydrophobicContact CG2-CD1 4.34Å; L636-L759 HydrophobicContact CD1-CD1 3.57Å; E755-L759 HydrophobicContact CG-CD1 4.11Å; E755-L759 WeakPolarHBondContact O-CG 3.44Å; E755-L759 PolarHBondContact O-N 3.09Å; L756-L759 PolarHBondContact O-N 3.15Å; L759-G761 VanDerWaalsContact C-N 3.31Å; L759-G761 PolarHBondContact O-N 3.45Å; L759-K762 CarbonylContact O-C 3.32Å; L759-K762 PolarHBondContact O-N 2.98Å; L759-K762 VanDerWaalsContact O-N 3.1Å; L759-C763 PolarHBondContact O-N 3.28Å; L759-C763 PolarHBondContact O-SG 2.95Å
760	M	83.3	Confident	83.1	Confident	14 Å²	14	37.9 Å²	37.9	7%	0.069	21%	0.212	C	C	.	.	H	α-helix	trans	-60.2	-42.8	176.8	-78.1	-177.9	59.8	0	0	111.3	L756 K762 C763 G764 I765 F878	L756-M760 HydrophobicContact CG-CG 4.39Å; L756-M760 HydrophobicContact CG-SD 4.09Å; L756-M760 WeakPolarHBondContact O-CB 3.26Å; L756-M760 VanDerWaalsContact O-CG 3.29Å; L756-M760 WeakPolarHBondContact O-CG 3.31Å; L756-M760 PolarHBondContact O-N 2.97Å; M760-K762 VanDerWaalsContact C-N 3.33Å; M760-K762 PolarHBondContact O-N 3.49Å; M760-C763 PolarHBondContact O-N 3.14Å; M760-C763 VanDerWaalsContact O-N 3.15Å; M760-G764 PolarHBondContact O-N 3.39Å; M760-G764 VanDerWaalsContact O-N 3.1Å; M760-I765 HydrophobicContact CB-CB 4.37Å; M760-I765 HydrophobicContact CE-CB 4.13Å; M760-I765 HydrophobicContact CE-CG2 3.71Å; M760-I765 HydrophobicContact CG-CB 4.42Å; M760-I765 HydrophobicContact CG-CD1 4.08Å; M760-I765 PolarHBondContact O-N 3.46Å; M760-F878 HydrophobicContact CE-CE2 3.88Å; M760-F878 HydrophobicContact CE-CZ 4.26Å; M760-F878 HydrophobicContact SD-CE1 4.49Å; M760-F878 HydrophobicContact SD-CE2 3.59Å; M760-F878 VanDerWaalsContact SD-CE2 3.59Å; M760-F878 HydrophobicContact SD-CZ 3.33Å; M760-F878 WeakPolarHBondContact SD-CZ 3.45Å
761	G	78.8	Confident	83.2	Confident	10 Å²	10	34.6 Å²	34.6	10%	0.103	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-39.9	172.5	0	0	0	0	0	113	F757 L759 C763 G764	F757-G761 PolarHBondContact O-N 3.01Å; L759-G761 VanDerWaalsContact C-N 3.31Å; L759-G761 PolarHBondContact O-N 3.45Å; G761-C763 VanDerWaalsContact C-N 3.26Å; G761-C763 PolarHBondContact O-N 3.4Å; G761-G764 PolarHBondContact O-N 3.07Å
762	K	83.8	Confident	83.2	Confident	70 Å²	70	32.1 Å²	32.1	30%	0.304	18%	0.176	S	C	.	.	H	α-helix	trans	-70.8	-18.1	176.4	-69.7	174.6	-180	170	0	114.4	S427 E758 L759 M760	S427-K762 WeakPolarHBondContact OG-CA 3.27Å; E758-K762 WeakPolarHBondContact O-CG 3.46Å; E758-K762 PolarHBondContact O-N 3.15Å; L759-K762 CarbonylContact O-C 3.32Å; L759-K762 PolarHBondContact O-N 2.98Å; L759-K762 VanDerWaalsContact O-N 3.1Å; M760-K762 VanDerWaalsContact C-N 3.33Å; M760-K762 PolarHBondContact O-N 3.49Å
763	C	80.8	Confident	83.1	Confident	24 Å²	24	32.8 Å²	32.8	16%	0.162	18%	0.178	C	C	.	.	H	α-helix	trans	-101.7	-5.6	-179.7	-61.3	0	0	0	0	113.1	L626 N629 L630 L759 M760 G761 I765	L626-C763 HydrophobicContact CD1-CB 4.39Å; N629-C763 VanDerWaalsContact CB-SG 3.5Å; L630-C763 HydrophobicContact CD2-CB 3.83Å; L630-C763 HydrophobicContact CG-CB 4.49Å; L759-C763 PolarHBondContact O-N 3.28Å; L759-C763 PolarHBondContact O-SG 2.95Å; M760-C763 PolarHBondContact O-N 3.14Å; M760-C763 VanDerWaalsContact O-N 3.15Å; G761-C763 VanDerWaalsContact C-N 3.26Å; G761-C763 PolarHBondContact O-N 3.4Å; C763-I765 HydrophobicContact CB-CD1 3.89Å; C763-I765 HydrophobicContact CB-CG1 3.9Å
764	G	70.9	Confident	83.1	Confident	60 Å²	60	33 Å²	33	62%	0.619	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.3	29.9	-177.7	0	0	0	0	0	114.3	M760 G761	M760-G764 PolarHBondContact O-N 3.39Å; M760-G764 VanDerWaalsContact O-N 3.1Å; G761-G764 PolarHBondContact O-N 3.07Å
765	I	64.6	Low	83.1	Confident	27 Å²	27	31.4 Å²	31.4	14%	0.138	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-80.1	128.7	-178.5	-59	170.3	0	0	0	109.8	L630 V633 M760 C763	L630-I765 HydrophobicContact CD2-CD1 4.29Å; V633-I765 HydrophobicContact CG1-CD1 4.36Å; M760-I765 HydrophobicContact CB-CB 4.37Å; M760-I765 HydrophobicContact CE-CB 4.13Å; M760-I765 HydrophobicContact CE-CG2 3.71Å; M760-I765 HydrophobicContact CG-CB 4.42Å; M760-I765 HydrophobicContact CG-CD1 4.08Å; M760-I765 PolarHBondContact O-N 3.46Å; C763-I765 HydrophobicContact CB-CD1 3.89Å; C763-I765 HydrophobicContact CB-CG1 3.9Å
766	L	63.1	Low	83.1	Confident	64 Å²	64	28.7 Å²	28.7	34%	0.335	16%	0.158	S	C	.	.	P	Polyproline II helix	trans	-69.5	155.5	-174.4	-114.4	98	0	0	0	113.9	H775 W777	L766-H775 HydrophobicContact CD2-CB 4.22Å; L766-H775 VanDerWaalsContact CD2-ND1 3.28Å; L766-H775 WeakPolarHBondContact CD2-ND1 3.43Å; L766-W777 HydrophobicContact CD1-CE3 3.88Å; L766-W777 HydrophobicContact CD1-CH2 3.24Å; L766-W777 HydrophobicContact CD1-CZ2 3.96Å; L766-W777 HydrophobicContact CD1-CZ3 3.17Å; L766-W777 HydrophobicContact CD2-CH2 4.39Å; L766-W777 HydrophobicContact CD2-CZ2 4.31Å; L766-W777 HydrophobicContact CG-CD2 4.25Å; L766-W777 HydrophobicContact CG-CE3 3.85Å; L766-W777 HydrophobicContact CG-CH2 3.93Å; L766-W777 HydrophobicContact CG-CZ2 4.27Å; L766-W777 HydrophobicContact CG-CZ3 3.69Å
767	G	61.2	Low	83.1	Confident	8 Å²	8	32.3 Å²	32.3	8%	0.082	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	154.1	153.7	0	0	0	0	0	110.3	Y776	G767-Y776 CarbonylContact C-O 3.55Å; G767-Y776 WeakPolarHBondContact CA-O 3.42Å; G767-Y776 PolarHBondContact N-O 3.44Å
768	G	83	Confident	83	Confident	16 Å²	16	33.1 Å²	33.1	17%	0.165	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	-164.3	-170.1	0	0	0	0	0	116.9	Y776	G768-Y776 PolarHBondContact O-N 3.39Å; G768-Y776 VanDerWaalsContact O-N 3.12Å
769	R	89.8	Confident	82.9	Confident	102 Å²	102	28.8 Å²	28.8	39%	0.385	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	157.4	-176.7	-71.4	177.2	-75.7	-175.1	0.3	112.3	R774 H775 D791 R867	R769-R774 VanDerWaalsContact CA-O 3.29Å; R769-R774 WeakPolarHBondContact CA-O 3.39Å; R769-H775 VanDerWaalsContact CD-CE1 3.43Å; R769-H775 WeakPolarHBondContact CD-CE1 3.33Å; R769-D791 IonicContact NH1-OD2 2.86Å; R769-D791 PolarHBondContact NH1-OD2 3.36Å; R769-R867 HydrophobicContact CB-CB 4.32Å; R769-R867 CarbonylContact O-C 3.36Å; R769-R867 VanDerWaalsContact O-C 3.28Å; R769-R867 WeakPolarHBondContact O-CB 3.36Å
770	D	92	Very high	82.7	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.168	C	C	.	.			trans	-103.5	-177.7	170.7	72.4	13.6	0	0	0	114	F398 A772 F773 R774 Y776 L861 R867 E868 L871	F398-D770 HydrophobicContact CZ-CB 4.05Å; D770-A772 PolarHBondContact O-N 3.19Å; D770-A772 VanDerWaalsContact O-N 3.1Å; D770-A772 WeakPolarHBondContact OD1-CA 3.42Å; D770-A772 WeakPolarHBondContact OD1-CB 3.42Å; D770-A772 PolarHBondContact OD1-N 3.32Å; D770-F773 PolarHBondContact O-N 3.33Å; D770-F773 PolarHBondContact OD1-N 2.68Å; D770-R774 PolarHBondContact N-O 3.48Å; D770-R774 PolarHBondContact OD1-N 3.11Å; D770-R774 IonicContact OD1-NE 3.77Å; D770-R774 IonicContact OD2-CZ 3.67Å; D770-R774 IonicContact OD2-NE 3.54Å; D770-R774 PolarHBondContact OD2-NE 2.9Å; D770-R774 IonicContact OD2-NH2 2.85Å; D770-R774 PolarHBondContact OD2-NH2 3.4Å; D770-Y776 HydrophobicContact CB-CE2 3.9Å; D770-Y776 PolarHBondContact OD2-OH 3.47Å; D770-L861 HydrophobicContact CB-CD2 4.39Å; D770-R867 PolarHBondContact O-NH1 3.16Å; D770-E868 HydrophobicContact CB-CG 4.34Å; D770-L871 HydrophobicContact CB-CD2 4.35Å
771	R	90.7	Very high	82.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.2	178.9	73	-175.3	69.2	146.5	6.7	114.5	D389 L390 H395 K396 F398 L823 R860 R867 E868	D389-R771 HydrophobicContact CB-CB 3.51Å; D389-R771 WeakPolarHBondContact OD2-CA 2.93Å; D389-R771 PolarHBondContact OD2-N 2.87Å; L390-R771 WeakPolarHBondContact CD2-O 3.49Å; H395-R771 PolarHBondContact ND1-NE 3.44Å; H395-R771 PolarHBondContact ND1-NH1 3.03Å; K396-R771 PolarHBondContact O-NH1 3.03Å; K396-R771 VanDerWaalsContact O-NH1 3.13Å; F398-R771 HydrophobicContact CE2-CG 3.98Å; R771-L823 PolarHBondContact NH1-O 2.95Å; R771-R860 PolarHBondContact NH2-O 3.27Å; R771-R867 PolarHBondContact O-NH2 2.56Å; R771-E868 HydrophobicContact CB-CG 4.44Å; R771-E868 WeakPolarHBondContact CB-OE1 3.33Å; R771-E868 WeakPolarHBondContact CG-OE1 3.22Å; R771-E868 IonicContact CZ-OE1 3.29Å; R771-E868 VanDerWaalsContact CZ-OE1 3.27Å; R771-E868 IonicContact CZ-OE2 3.99Å; R771-E868 PolarHBondContact N-OE1 3.23Å; R771-E868 VanDerWaalsContact NE-CD 3.32Å; R771-E868 IonicContact NE-OE1 2.79Å; R771-E868 PolarHBondContact NE-OE1 2.92Å; R771-E868 IonicContact NE-OE2 2.78Å; R771-E868 PolarHBondContact NE-OE2 3.22Å; R771-E868 IonicContact NH2-OE1 2.86Å; R771-E868 PolarHBondContact NH2-OE1 2.88Å; R771-E868 VanDerWaalsContact NH2-OE1 3.15Å; R771-E868 IonicContact NH2-OE2 3.25Å; R771-E868 PolarHBondContact NH2-OE2 3.16Å
772	A	88	Confident	83.3	Confident	1 Å²	1	32 Å²	32	1%	0.008	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	9.6	178.8	0	0	0	0	0	112.9	D770 R774 L824	D770-A772 PolarHBondContact O-N 3.19Å; D770-A772 VanDerWaalsContact O-N 3.1Å; D770-A772 WeakPolarHBondContact OD1-CA 3.42Å; D770-A772 WeakPolarHBondContact OD1-CB 3.42Å; D770-A772 PolarHBondContact OD1-N 3.32Å; A772-R774 HydrophobicContact CB-CG 4.22Å; A772-R774 PolarHBondContact O-N 3.5Å; A772-L824 HydrophobicContact CB-CB 4.09Å; A772-L824 HydrophobicContact CB-CD1 4.19Å
773	F	88.5	Confident	83.5	Confident	32 Å²	32	29 Å²	29	14%	0.14	16%	0.158	C	C	.	.			trans	64.2	20.5	-177	-55.5	-100.7	0	0	0	113.8	L390 D770 D791 I794 V835	L390-F773 HydrophobicContact CD1-CE2 4.17Å; D770-F773 PolarHBondContact O-N 3.33Å; D770-F773 PolarHBondContact OD1-N 2.68Å; F773-D791 HydrophobicContact CB-CB 4.15Å; F773-I794 HydrophobicContact CB-CG1 4.36Å; F773-V835 HydrophobicContact CD2-CG1 4.09Å; F773-V835 HydrophobicContact CE2-CG1 4.19Å
774	R	90.6	Very high	84	Confident	17 Å²	17	28 Å²	28	6%	0.064	15%	0.151	C	C	.	.			trans	-76.3	135.9	174.9	-58	-176.3	-62.2	173.3	1.1	110.1	R769 D770 A772 Y776 V787 E788 D789	R769-R774 VanDerWaalsContact CA-O 3.29Å; R769-R774 WeakPolarHBondContact CA-O 3.39Å; D770-R774 PolarHBondContact N-O 3.48Å; D770-R774 PolarHBondContact OD1-N 3.11Å; D770-R774 IonicContact OD1-NE 3.77Å; D770-R774 IonicContact OD2-CZ 3.67Å; D770-R774 IonicContact OD2-NE 3.54Å; D770-R774 PolarHBondContact OD2-NE 2.9Å; D770-R774 IonicContact OD2-NH2 2.85Å; D770-R774 PolarHBondContact OD2-NH2 3.4Å; A772-R774 HydrophobicContact CB-CG 4.22Å; A772-R774 PolarHBondContact O-N 3.5Å; R774-Y776 HydrophobicContact CB-CE2 4.45Å; R774-Y776 PolarHBondContact NH2-OH 3.4Å; R774-V787 HydrophobicContact CB-CG1 3.86Å; R774-E788 CarbonylContact C-O 3.6Å; R774-E788 VanDerWaalsContact CA-O 3.27Å; R774-E788 WeakPolarHBondContact CA-O 3.3Å; R774-D789 HydrophobicContact CG-CB 4.13Å
775	H	90.1	Very high	85	Confident	30 Å²	30	25.2 Å²	25.2	14%	0.139	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	136	178.5	-72.4	-90.7	0	0	0	111	L766 R769 V787 E788 Y790 D791	L766-H775 HydrophobicContact CD2-CB 4.22Å; L766-H775 VanDerWaalsContact CD2-ND1 3.28Å; L766-H775 WeakPolarHBondContact CD2-ND1 3.43Å; R769-H775 VanDerWaalsContact CD-CE1 3.43Å; R769-H775 WeakPolarHBondContact CD-CE1 3.33Å; H775-V787 CarbonylContact O-C 3.51Å; H775-V787 WeakPolarHBondContact O-CA 3.39Å; H775-E788 HydrophobicContact CB-CB 4.41Å; H775-E788 PolarHBondContact N-O 2.69Å; H775-E788 PolarHBondContact O-N 2.89Å; H775-Y790 PolarHBondContact CD2-O 3.11Å; H775-D791 IonicContact CD2-OD2 2.97Å; H775-D791 IonicContact CE1-OD2 2.66Å; H775-D791 IonicContact NE2-OD2 2.72Å; H775-D791 PolarHBondContact NE2-OD2 3Å
776	Y	92.4	Very high	86.3	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	115.7	-179.8	-73.6	-101.1	0	0	0	110.6	G767 G768 D770 R774 L785 V787 L857 L871	G767-Y776 CarbonylContact C-O 3.55Å; G767-Y776 WeakPolarHBondContact CA-O 3.42Å; G767-Y776 PolarHBondContact N-O 3.44Å; G768-Y776 PolarHBondContact O-N 3.39Å; G768-Y776 VanDerWaalsContact O-N 3.12Å; D770-Y776 HydrophobicContact CB-CE2 3.9Å; D770-Y776 PolarHBondContact OD2-OH 3.47Å; R774-Y776 HydrophobicContact CB-CE2 4.45Å; R774-Y776 PolarHBondContact NH2-OH 3.4Å; Y776-L785 HydrophobicContact CD1-CD2 3.64Å; Y776-L785 HydrophobicContact CD1-CG 4.13Å; Y776-L785 HydrophobicContact CE1-CD2 4.39Å; Y776-V787 HydrophobicContact CD1-CG2 3.66Å; Y776-V787 HydrophobicContact CE1-CB 4.45Å; Y776-V787 HydrophobicContact CE1-CG1 4.15Å; Y776-V787 HydrophobicContact CE1-CG2 3.49Å; Y776-V787 VanDerWaalsContact CE1-CG2 3.49Å; Y776-V787 HydrophobicContact CE2-CG1 4.27Å; Y776-L857 HydrophobicContact CD1-CD2 4.23Å; Y776-L857 HydrophobicContact CE1-CD1 4.2Å; Y776-L857 HydrophobicContact CE1-CD2 3.6Å; Y776-L857 WeakPolarHBondContact OH-CD1 3.22Å; Y776-L871 HydrophobicContact CD2-CD1 4.02Å; Y776-L871 HydrophobicContact CD2-CD2 3.57Å; Y776-L871 HydrophobicContact CD2-CG 4.48Å; Y776-L871 HydrophobicContact CE2-CD2 3.53Å; Y776-L871 HydrophobicContact CG-CD1 3.93Å; Y776-L871 HydrophobicContact CG-CD2 4.11Å
777	W	89.5	Confident	87.7	Confident	79 Å²	79	20.9 Å²	20.9	30%	0.299	10%	0.1	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.6	-175.9	-57.9	91.1	0	0	0	111.2	L766 C779 L785 L786 E788 W845	L766-W777 HydrophobicContact CD1-CE3 3.88Å; L766-W777 HydrophobicContact CD1-CH2 3.24Å; L766-W777 HydrophobicContact CD1-CZ2 3.96Å; L766-W777 HydrophobicContact CD1-CZ3 3.17Å; L766-W777 HydrophobicContact CD2-CH2 4.39Å; L766-W777 HydrophobicContact CD2-CZ2 4.31Å; L766-W777 HydrophobicContact CG-CD2 4.25Å; L766-W777 HydrophobicContact CG-CE3 3.85Å; L766-W777 HydrophobicContact CG-CH2 3.93Å; L766-W777 HydrophobicContact CG-CZ2 4.27Å; L766-W777 HydrophobicContact CG-CZ3 3.69Å; W777-C779 PolarHBondContact O-N 3.18Å; W777-L785 CarbonylContact O-C 3.28Å; W777-L785 WeakPolarHBondContact O-CA 3.35Å; W777-L785 VanDerWaalsContact O-CD1 3.3Å; W777-L785 WeakPolarHBondContact O-CD1 3.45Å; W777-L786 HydrophobicContact CB-CB 4.2Å; W777-L786 PolarHBondContact N-O 3.33Å; W777-L786 PolarHBondContact O-N 3.4Å; W777-E788 PolarHBondContact NE1-OE2 3.1Å; W777-W845 AromaticContact CD1-CZ3 3.87Å
778	L	87	Confident	89.2	Confident	34 Å²	34	21.4 Å²	21.4	18%	0.178	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	104.3	173.7	-178.8	73.6	0	0	0	110.1	F757 L785 I882 M885	F757-L778 HydrophobicContact CD2-CD2 3.63Å; F757-L778 HydrophobicContact CE1-CD2 4.38Å; F757-L778 HydrophobicContact CE2-CD1 3.63Å; F757-L778 HydrophobicContact CE2-CD2 3.2Å; F757-L778 HydrophobicContact CE2-CG 3.98Å; F757-L778 HydrophobicContact CG-CD2 4.42Å; F757-L778 HydrophobicContact CZ-CD1 3.69Å; F757-L778 HydrophobicContact CZ-CD2 3.64Å; F757-L778 HydrophobicContact CZ-CG 4.09Å; L778-L785 HydrophobicContact CB-CD1 4.5Å; L778-I882 HydrophobicContact CD1-CG1 4.16Å; L778-M885 HydrophobicContact CD1-CE 3.79Å; L778-M885 HydrophobicContact CD1-SD 3.8Å
779	C	85.1	Confident	89.5	Confident	11 Å²	11	21.1 Å²	21.1	7%	0.074	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	96.1	-178.3	-64.8	0	0	0	0	111.2	W777 S781 V782 G783 A784 L786	W777-C779 PolarHBondContact O-N 3.18Å; C779-S781 VanDerWaalsContact C-N 3.27Å; C779-S781 PolarHBondContact O-N 3.42Å; C779-V782 HydrophobicContact CB-CG2 3.67Å; C779-V782 PolarHBondContact O-N 3.03Å; C779-G783 PolarHBondContact O-N 3.41Å; C779-A784 PolarHBondContact N-O 3.02Å; C779-A784 PolarHBondContact O-N 3.26Å; C779-L786 HydrophobicContact CB-CD1 4.08Å; C779-L786 HydrophobicContact CB-CG 4.26Å; C779-L786 WeakPolarHBondContact SG-CD1 3.41Å
780	R	83.3	Confident	89	Confident	69 Å²	69	21.5 Å²	21.5	26%	0.26	10%	0.097	S	C	.	.	G	3₁₀ helix	trans	-66.4	-31.6	-177	-64.3	179.6	-60.8	135.1	7.6	111.9	E423 F757 V782 G783 M885	E423-R780 PolarHBondContact OE1-N 3.26Å; F757-R780 HydrophobicContact CE1-CG 3.93Å; F757-R780 HydrophobicContact CZ-CG 4.39Å; R780-V782 PolarHBondContact O-N 3.46Å; R780-G783 PolarHBondContact O-N 2.88Å; R780-M885 HydrophobicContact CG-SD 4.43Å
781	S	85.7	Confident	88	Confident	25 Å²	25	22.1 Å²	22.1	18%	0.175	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-63.6	-25.6	-177.4	-54.9	0	0	0	0	113.9	E423 H426 C779	E423-S781 WeakPolarHBondContact OE1-CB 3.43Å; E423-S781 PolarHBondContact OE1-N 3.3Å; E423-S781 PolarHBondContact OE1-OG 2.79Å; H426-S781 WeakPolarHBondContact ND1-CB 3.39Å; H426-S781 PolarHBondContact ND1-OG 3.12Å; C779-S781 VanDerWaalsContact C-N 3.27Å; C779-S781 PolarHBondContact O-N 3.42Å
782	V	88.9	Confident	86.9	Confident	4 Å²	4	26.2 Å²	26.2	2%	0.024	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-114.2	-0.7	-179.8	-63.4	0	0	0	0	113	M419 L422 L444 C779 R780 A784 N890 L893	M419-V782 HydrophobicContact SD-CG1 4.23Å; L422-V782 HydrophobicContact CD2-CG1 3.85Å; L444-V782 HydrophobicContact CB-CG1 4.19Å; L444-V782 HydrophobicContact CD2-CG1 3.92Å; C779-V782 HydrophobicContact CB-CG2 3.67Å; C779-V782 PolarHBondContact O-N 3.03Å; R780-V782 PolarHBondContact O-N 3.46Å; V782-A784 VanDerWaalsContact C-N 3.32Å; V782-A784 HydrophobicContact CG2-CB 4.19Å; V782-A784 PolarHBondContact O-N 3.49Å; V782-N890 WeakPolarHBondContact O-CB 3.38Å; V782-L893 HydrophobicContact CB-CD1 4.27Å; V782-L893 HydrophobicContact CG2-CD1 4.14Å
783	G	88.3	Confident	85.8	Confident	7 Å²	7	28.8 Å²	28.8	7%	0.072	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	33.4	178.6	0	0	0	0	0	113.8	C779 R780	C779-G783 PolarHBondContact O-N 3.41Å; R780-G783 PolarHBondContact O-N 2.88Å
784	A	90.9	Very high	84.9	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.008	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	154.4	-174.5	0	0	0	0	0	112.5	C779 V782 L786 I848 L893	C779-A784 PolarHBondContact N-O 3.02Å; C779-A784 PolarHBondContact O-N 3.26Å; V782-A784 VanDerWaalsContact C-N 3.32Å; V782-A784 HydrophobicContact CG2-CB 4.19Å; V782-A784 PolarHBondContact O-N 3.49Å; A784-L786 HydrophobicContact CB-CD2 4.45Å; A784-I848 WeakPolarHBondContact CA-O 3.47Å; A784-I848 WeakPolarHBondContact CB-O 3.45Å; A784-L893 HydrophobicContact CB-CD1 3.56Å
785	L	91.7	Very high	83.8	Confident	2 Å²	2	31 Å²	31	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	111	164.6	-172.4	70.3	0	0	0	107.8	Y776 W777 L778 F847 I848 L857 L875	Y776-L785 HydrophobicContact CD1-CD2 3.64Å; Y776-L785 HydrophobicContact CD1-CG 4.13Å; Y776-L785 HydrophobicContact CE1-CD2 4.39Å; W777-L785 CarbonylContact O-C 3.28Å; W777-L785 WeakPolarHBondContact O-CA 3.35Å; W777-L785 VanDerWaalsContact O-CD1 3.3Å; W777-L785 WeakPolarHBondContact O-CD1 3.45Å; L778-L785 HydrophobicContact CB-CD1 4.5Å; L785-F847 CarbonylContact O-C 3.53Å; L785-F847 WeakPolarHBondContact O-CA 3.22Å; L785-I848 HydrophobicContact CB-CB 4.2Å; L785-I848 HydrophobicContact CD2-CD1 4.19Å; L785-I848 PolarHBondContact N-O 2.84Å; L785-I848 PolarHBondContact O-N 3.25Å; L785-L857 HydrophobicContact CD2-CD2 4.37Å; L785-L875 HydrophobicContact CD1-CD2 4.46Å; L785-L875 HydrophobicContact CD2-CD2 3.92Å
786	L	92.7	Very high	83.1	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	139.4	178	-54.7	177.1	0	0	0	109.2	F415 M419 W777 C779 A784 W845 F847 L893	F415-L786 HydrophobicContact CE1-CD1 3.95Å; F415-L786 HydrophobicContact CZ-CD1 4.24Å; M419-L786 HydrophobicContact CG-CD1 3.69Å; M419-L786 HydrophobicContact SD-CD1 3.82Å; W777-L786 HydrophobicContact CB-CB 4.2Å; W777-L786 PolarHBondContact N-O 3.33Å; W777-L786 PolarHBondContact O-N 3.4Å; C779-L786 HydrophobicContact CB-CD1 4.08Å; C779-L786 HydrophobicContact CB-CG 4.26Å; C779-L786 WeakPolarHBondContact SG-CD1 3.41Å; A784-L786 HydrophobicContact CB-CD2 4.45Å; L786-W845 HydrophobicContact CB-CE3 4.25Å; L786-W845 HydrophobicContact CB-CZ3 4.14Å; L786-F847 HydrophobicContact CD2-CB 3.81Å; L786-L893 HydrophobicContact CD2-CD1 3.86Å; L786-L893 HydrophobicContact CD2-CD2 4.32Å
787	V	93.5	Very high	82.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	111.4	179.6	-174.7	0	0	0	0	107.6	F401 R774 H775 Y776 T846	F401-V787 HydrophobicContact CD2-CG2 4.36Å; F401-V787 HydrophobicContact CE2-CG2 4.41Å; R774-V787 HydrophobicContact CB-CG1 3.86Å; H775-V787 CarbonylContact O-C 3.51Å; H775-V787 WeakPolarHBondContact O-CA 3.39Å; Y776-V787 HydrophobicContact CD1-CG2 3.66Å; Y776-V787 HydrophobicContact CE1-CB 4.45Å; Y776-V787 HydrophobicContact CE1-CG1 4.15Å; Y776-V787 HydrophobicContact CE1-CG2 3.49Å; Y776-V787 VanDerWaalsContact CE1-CG2 3.49Å; Y776-V787 HydrophobicContact CE2-CG1 4.27Å; V787-T846 WeakPolarHBondContact CB-OG1 3.49Å; V787-T846 PolarHBondContact N-O 2.99Å; V787-T846 PolarHBondContact O-N 2.79Å
788	E	92.5	Very high	81.6	Confident	18 Å²	18	39.4 Å²	39.4	8%	0.084	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	122.3	178.3	-167.5	177.8	-167.2	0	0	110.4	R774 H775 W777 Y790 R844 W845	R774-E788 CarbonylContact C-O 3.6Å; R774-E788 VanDerWaalsContact CA-O 3.27Å; R774-E788 WeakPolarHBondContact CA-O 3.3Å; H775-E788 HydrophobicContact CB-CB 4.41Å; H775-E788 PolarHBondContact N-O 2.69Å; H775-E788 PolarHBondContact O-N 2.89Å; W777-E788 PolarHBondContact NE1-OE2 3.1Å; E788-Y790 VanDerWaalsContact C-N 3.34Å; E788-Y790 PolarHBondContact O-N 3.29Å; E788-R844 CarbonylContact C-O 3.58Å; E788-R844 WeakPolarHBondContact CA-O 3.26Å; E788-R844 HydrophobicContact CG-CG 4.32Å; E788-R844 IonicContact OE1-CZ 2.81Å; E788-R844 IonicContact OE1-NE 3.39Å; E788-R844 PolarHBondContact OE1-NE 3.33Å; E788-R844 VanDerWaalsContact OE1-NE 3.13Å; E788-R844 IonicContact OE1-NH2 3.07Å; E788-R844 PolarHBondContact OE1-NH2 3.22Å; E788-W845 HydrophobicContact CB-CD2 4.37Å; E788-W845 HydrophobicContact CB-CE3 3.91Å; E788-W845 HydrophobicContact CB-CH2 3.7Å; E788-W845 HydrophobicContact CB-CZ2 4.18Å; E788-W845 HydrophobicContact CB-CZ3 3.57Å; E788-W845 HydrophobicContact CG-CD2 4.18Å; E788-W845 HydrophobicContact CG-CE3 4.2Å; E788-W845 HydrophobicContact CG-CH2 3.68Å; E788-W845 HydrophobicContact CG-CZ2 3.64Å; E788-W845 HydrophobicContact CG-CZ3 3.99Å; E788-W845 VanDerWaalsContact OE1-CZ2 3.27Å; E788-W845 WeakPolarHBondContact OE1-CZ2 3.37Å; E788-W845 WeakPolarHBondContact OE2-CH2 3.3Å
789	D	89.3	Confident	81.3	Confident	10 Å²	10	45.9 Å²	45.9	5%	0.053	25%	0.246	C	C	.	.			trans	-98.4	61.5	176.2	-165.3	5.8	0	0	0	110.7	R774 R842 R844	R774-D789 HydrophobicContact CG-CB 4.13Å; D789-R842 VanDerWaalsContact CG-NH2 3.34Å; D789-R842 IonicContact OD1-CZ 2.97Å; D789-R842 IonicContact OD1-NE 3.53Å; D789-R842 IonicContact OD1-NH2 3.53Å; D789-R842 PolarHBondContact OD1-NH2 3.49Å; D789-R842 WeakPolarHBondContact OD2-CB 3.31Å; D789-R842 WeakPolarHBondContact OD2-CD 3.18Å; D789-R842 IonicContact OD2-CZ 2.82Å; D789-R842 VanDerWaalsContact OD2-CZ 3.24Å; D789-R842 IonicContact OD2-NE 2.9Å; D789-R842 PolarHBondContact OD2-NE 3.2Å; D789-R842 IonicContact OD2-NH2 3.65Å; D789-R842 PolarHBondContact OD2-NH2 2.83Å; D789-R842 VanDerWaalsContact OD2-NH2 3.15Å; D789-R844 PolarHBondContact N-O 3.42Å
790	Y	77.9	Confident	81.4	Confident	111 Å²	111	47.6 Å²	47.6	44%	0.435	26%	0.261	S	S	.	.			trans	-151	115.4	175.7	-177.7	-99.3	0	0	0	109	H775 E788	H775-Y790 PolarHBondContact CD2-O 3.11Å; E788-Y790 VanDerWaalsContact C-N 3.34Å; E788-Y790 PolarHBondContact O-N 3.29Å
791	D	71.9	Confident	81.7	Confident	13 Å²	13	44.6 Å²	44.6	7%	0.07	25%	0.251	C	S	.	.			trans	-129.2	124.2	166.5	-169.2	-44.2	0	0	0	106.7	R769 F773 H775 V793 I794	R769-D791 IonicContact NH1-OD2 2.86Å; R769-D791 PolarHBondContact NH1-OD2 3.36Å; F773-D791 HydrophobicContact CB-CB 4.15Å; H775-D791 IonicContact CD2-OD2 2.97Å; H775-D791 IonicContact CE1-OD2 2.66Å; H775-D791 IonicContact NE2-OD2 2.72Å; H775-D791 PolarHBondContact NE2-OD2 3Å; D791-V793 PolarHBondContact O-N 3.36Å; D791-V793 VanDerWaalsContact O-N 3.11Å; D791-V793 WeakPolarHBondContact OD1-CA 3.45Å; D791-V793 PolarHBondContact OD1-N 3.14Å; D791-I794 HydrophobicContact CB-CG1 4.04Å; D791-I794 WeakPolarHBondContact O-CD1 3.47Å; D791-I794 VanDerWaalsContact O-CG1 3.29Å; D791-I794 WeakPolarHBondContact O-CG1 3.27Å
792	P	66.6	Low	81.7	Confident	86 Å²	86	45.5 Å²	45.5	56%	0.558	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-13.6	178.3	24.2	-31.4	0	0	0	112.7
793	V	65.8	Low	81.6	Confident	54 Å²	54	47.1 Å²	47.1	33%	0.327	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	54.6	-178.7	-163.7	0	0	0	0	110.7	D791	D791-V793 PolarHBondContact O-N 3.36Å; D791-V793 VanDerWaalsContact O-N 3.11Å; D791-V793 WeakPolarHBondContact OD1-CA 3.45Å; D791-V793 PolarHBondContact OD1-N 3.14Å
794	I	69.2	Low	81.3	Confident	55 Å²	55	54.6 Å²	54.6	28%	0.282	30%	0.299	S	S	.	.			trans	-76.6	121.9	167.3	-65	160.9	0	0	0	108.2	F773 D791 H836	F773-I794 HydrophobicContact CB-CG1 4.36Å; D791-I794 HydrophobicContact CB-CG1 4.04Å; D791-I794 WeakPolarHBondContact O-CD1 3.47Å; D791-I794 VanDerWaalsContact O-CG1 3.29Å; D791-I794 WeakPolarHBondContact O-CG1 3.27Å; I794-H836 HydrophobicContact CG2-CB 4.32Å
795	G	67.3	Low	80.9	Confident	40 Å²	40	59.2 Å²	59.2	41%	0.412	32%	0.318	S	S	.	.			trans	-60	179	179.4	0	0	0	0	0	114.2	H836	G795-H836 PolarHBondContact O-CD2 2.74Å
796	S	75	Confident	80.4	Confident	82 Å²	82	59.8 Å²	59.8	57%	0.573	32%	0.322	S	S	*	.			trans	-96.1	147.5	175.2	57	0	0	0	0	112.4	F798	S796-F798 PolarHBondContact O-N 3.16Å
797	C	79.2	Confident	79	Confident	25 Å²	25	64.4 Å²	64.4	17%	0.169	36%	0.355	C	S	.	.			trans	-56.2	122.3	166	-70.8	0	0	0	0	111.1	C833 H836	C797-C833 WeakPolarHBondContact SG-CB 3.38Å; C797-C833 PolarHBondContact SG-SG 3.01Å; C797-H836 PolarHBondContact SG-ND1 3.13Å; C797-H836 VanDerWaalsContact SG-ND1 3.36Å
798	F	72.7	Confident	77.1	Confident	179 Å²	179	73.7 Å²	73.7	79%	0.785	40%	0.395	S	S	*	.			trans	-106.3	-89.9	166.7	-96.7	-90.9	0	0	0	109.8	S796	S796-F798 PolarHBondContact O-N 3.16Å
799	E	80.9	Confident	75.2	Confident	170 Å²	170	76 Å²	76	79%	0.794	42%	0.424	S	S	*	.	S	Bend	trans	-103.2	154.8	175.5	-64.6	-175.5	168.8	0	0	109.9
800	A	86.1	Confident	73.4	Confident	47 Å²	47	78 Å²	78	39%	0.388	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-70.2	136.4	174.2	0	0	0	0	0	109.4	S802 S827	A800-S802 PolarHBondContact O-N 3.25Å; A800-S827 WeakPolarHBondContact CB-O 3.38Å
801	T	89	Confident	72.1	Confident	6 Å²	6	79.9 Å²	79.9	4%	0.037	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-58.2	134.1	175.2	-60.3	0	0	0	0	109.8	L390 C392 R820 V825 C826	L390-T801 WeakPolarHBondContact O-CB 3.36Å; L390-T801 WeakPolarHBondContact O-CG2 3.29Å; L390-T801 PolarHBondContact O-OG1 3.15Å; C392-T801 WeakPolarHBondContact O-CG2 3.39Å; T801-R820 PolarHBondContact O-NH1 3.39Å; T801-R820 PolarHBondContact O-NH2 2.85Å; T801-V825 HydrophobicContact CG2-CB 3.93Å; T801-V825 HydrophobicContact CG2-CG1 4.06Å; T801-C826 PolarHBondContact N-O 3.45Å; T801-C826 PolarHBondContact OG1-N 3.3Å
802	S	87	Confident	71.4	Confident	45 Å²	45	87.1 Å²	87.1	32%	0.315	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-63	138.9	179.6	-178.7	0	0	0	0	111.3	A800 E804	A800-S802 PolarHBondContact O-N 3.25Å; S802-E804 WeakPolarHBondContact OG-CG 3.48Å; S802-E804 PolarHBondContact OG-N 3.49Å
803	L	86.6	Confident	71	Confident	38 Å²	38	85.3 Å²	85.3	20%	0.199	48%	0.475	C	S	.	.			trans	-109.1	10.1	176.2	-57.6	179.7	0	0	0	112.3	K805 V806 E816 M819 R820 L823 V825	L803-K805 VanDerWaalsContact C-N 3.32Å; L803-K805 PolarHBondContact O-N 3.27Å; L803-V806 HydrophobicContact CB-CG2 4.28Å; L803-V806 HydrophobicContact CD2-CG2 4.05Å; L803-V806 PolarHBondContact O-N 3.41Å; L803-E816 HydrophobicContact CD1-CG 3.96Å; L803-M819 HydrophobicContact CD1-SD 4.3Å; L803-R820 HydrophobicContact CD1-CG 4.2Å; L803-L823 HydrophobicContact CD2-CD1 3.7Å; L803-V825 HydrophobicContact CD2-CG2 4.21Å
804	E	82.5	Confident	70.7	Confident	164 Å²	164	90.7 Å²	90.7	77%	0.766	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-35.7	-169.5	-74.5	-178.7	179.7	0	0	114.4	S802	S802-E804 WeakPolarHBondContact OG-CG 3.48Å; S802-E804 PolarHBondContact OG-N 3.49Å
805	K	81.3	Confident	71	Confident	97 Å²	97	90 Å²	90	42%	0.422	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	9	-178.4	-59.4	-169	-173.9	129.5	0	113.6	W383 D393 D394 L803 S807	W383-K805 HydrophobicContact CZ2-CD 4.34Å; D393-K805 HydrophobicContact CB-CB 4.34Å; D393-K805 HydrophobicContact CB-CG 4.45Å; D393-K805 CarbonylContact O-C 3.57Å; D393-K805 VanDerWaalsContact O-C 3.22Å; D393-K805 WeakPolarHBondContact O-CA 3.15Å; D393-K805 WeakPolarHBondContact O-CB 3.46Å; D393-K805 PolarHBondContact O-N 3.14Å; D393-K805 WeakPolarHBondContact OD2-CD 3.37Å; D393-K805 VanDerWaalsContact OD2-CE 3.23Å; D393-K805 WeakPolarHBondContact OD2-CE 3.41Å; D393-K805 WeakPolarHBondContact OD2-CG 3.23Å; D393-K805 IonicContact OD2-NZ 3.43Å; D393-K805 PolarHBondContact OD2-NZ 3.09Å; D394-K805 HydrophobicContact CB-CB 4.34Å; L803-K805 VanDerWaalsContact C-N 3.32Å; L803-K805 PolarHBondContact O-N 3.27Å; K805-S807 PolarHBondContact O-N 3.44Å; K805-S807 VanDerWaalsContact O-N 3.16Å
806	V	80.6	Confident	71.7	Confident	14 Å²	14	93.9 Å²	93.9	9%	0.085	52%	0.515	C	S	.	.	S	Bend	trans	-66.9	115.3	168.8	179.3	0	0	0	0	107.2	D393 L803 K808 M819 L823	D393-V806 PolarHBondContact O-N 2.72Å; L803-V806 HydrophobicContact CB-CG2 4.28Å; L803-V806 HydrophobicContact CD2-CG2 4.05Å; L803-V806 PolarHBondContact O-N 3.41Å; V806-K808 PolarHBondContact O-N 3.35Å; V806-K808 VanDerWaalsContact O-N 3.08Å; V806-M819 HydrophobicContact CG1-SD 4.45Å; V806-L823 HydrophobicContact CG1-CD1 4.08Å; V806-L823 HydrophobicContact CG1-CD2 4.43Å; V806-L823 HydrophobicContact CG2-CD1 3.95Å
807	S	63	Low	72	Confident	99 Å²	99	92.7 Å²	92.7	69%	0.692	50%	0.502	S	S	*	.			trans	-48.4	118	-175.4	-63.8	0	0	0	0	111.3	K805 G809	K805-S807 PolarHBondContact O-N 3.44Å; K805-S807 VanDerWaalsContact O-N 3.16Å; S807-G809 PolarHBondContact O-N 3.33Å
808	K	54.4	Low	72.1	Confident	194 Å²	194	95.7 Å²	95.7	84%	0.843	51%	0.513	S	S	*	.	S	Bend	trans	-59.6	10.5	177.6	-67.5	-174.8	177	-179	0	115.1	V806 Q810	V806-K808 PolarHBondContact O-N 3.35Å; V806-K808 VanDerWaalsContact O-N 3.08Å; K808-Q810 VanDerWaalsContact C-N 3.3Å; K808-Q810 PolarHBondContact O-N 3.17Å
809	G	51.9	Low	72.7	Confident	68 Å²	68	89.2 Å²	89.2	70%	0.701	49%	0.486	S	S	*	.			trans	-88.2	16.6	177.7	0	0	0	0	0	114.6	S807	S807-G809 PolarHBondContact O-N 3.33Å
810	Q	52.9	Low	73.1	Confident	52 Å²	52	81.8 Å²	81.8	24%	0.243	45%	0.45	C	S	.	.			trans	-104	47.3	174.5	-63.9	-170.8	-86.2	0	0	111.5	K808 N812 I813	K808-Q810 VanDerWaalsContact C-N 3.3Å; K808-Q810 PolarHBondContact O-N 3.17Å; Q810-N812 PolarHBondContact O-N 3.4Å; Q810-I813 PolarHBondContact O-N 3.31Å
811	D	50.8	Low	73.1	Confident	150 Å²	150	85.4 Å²	85.4	80%	0.802	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	8.2	-176.2	-69	-38.8	0	0	0	115.5
812	N	55.9	Low	73	Confident	165 Å²	165	86.9 Å²	86.9	88%	0.882	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	5	-176.5	-88.6	-8.2	0	0	0	114.8	Q810	Q810-N812 PolarHBondContact O-N 3.4Å
813	I	59.3	Low	73.1	Confident	48 Å²	48	84.8 Å²	84.8	25%	0.246	45%	0.45	C	S	.	.			trans	-107	105.3	177.1	-57.4	176.8	0	0	0	109.2	Q810 G815 E818 M819	Q810-I813 PolarHBondContact O-N 3.31Å; I813-G815 PolarHBondContact O-N 3.11Å; I813-E818 HydrophobicContact CG2-CB 3.66Å; I813-E818 HydrophobicContact CG2-CG 3.7Å; I813-M819 HydrophobicContact CG2-CB 4.36Å
814	D	59	Low	73.2	Confident	167 Å²	167	83.7 Å²	83.7	89%	0.893	44%	0.444	S	S	*	.			trans	-81.5	103.4	-177.8	-144.5	5.2	0	0	0	109.9
815	G	76.1	Confident	73.6	Confident	41 Å²	41	75.9 Å²	75.9	42%	0.423	41%	0.408	S	S	.	.	S	Bend	trans	111.3	134.1	174	0	0	0	0	0	115.9	I813 M817 E818 M819	I813-G815 PolarHBondContact O-N 3.11Å; G815-M817 VanDerWaalsContact C-N 3.28Å; G815-M817 PolarHBondContact O-N 3.36Å; G815-E818 PolarHBondContact O-N 3.35Å; G815-E818 VanDerWaalsContact O-N 3.08Å; G815-M819 PolarHBondContact O-N 3.25Å
816	E	82.3	Confident	74	Confident	121 Å²	121	71.4 Å²	71.4	57%	0.565	39%	0.389	S	S	*	.	H	α-helix	trans	-55.4	-39.6	-179	-172.9	-173.3	155.9	0	0	112.8	L803 E818 M819 R820	L803-E816 HydrophobicContact CD1-CG 3.96Å; E816-E818 VanDerWaalsContact C-N 3.32Å; E816-E818 PolarHBondContact O-N 2.94Å; E816-M819 WeakPolarHBondContact O-CB 3.19Å; E816-M819 PolarHBondContact O-N 2.75Å; E816-R820 WeakPolarHBondContact O-CG 3.4Å; E816-R820 PolarHBondContact O-N 2.93Å; E816-R820 IonicContact OE1-CZ 3.4Å; E816-R820 IonicContact OE1-NE 3.29Å; E816-R820 PolarHBondContact OE1-NE 3.36Å; E816-R820 IonicContact OE1-NH2 3.65Å; E816-R820 PolarHBondContact OE1-NH2 3.14Å
817	M	81	Confident	74.3	Confident	57 Å²	57	71.2 Å²	71.2	28%	0.281	39%	0.388	S	S	.	.	H	α-helix	trans	-64.7	-35	179.4	-83.1	-65	-160.3	0	0	113.1	G815 R820 R821 T832	G815-M817 VanDerWaalsContact C-N 3.28Å; G815-M817 PolarHBondContact O-N 3.36Å; M817-R820 PolarHBondContact O-N 3.5Å; M817-R821 PolarHBondContact O-N 3.35Å; M817-T832 HydrophobicContact CE-CG2 4.39Å; M817-T832 VanDerWaalsContact CE-OG1 3.24Å; M817-T832 WeakPolarHBondContact CE-OG1 3.37Å
818	E	81.6	Confident	75.4	Confident	87 Å²	87	67.7 Å²	67.7	41%	0.407	37%	0.368	S	S	.	.	H	α-helix	trans	-73	-37.4	178.4	-164.5	57	-148.6	0	0	111	I813 G815 E816 R821 S822	I813-E818 HydrophobicContact CG2-CB 3.66Å; I813-E818 HydrophobicContact CG2-CG 3.7Å; G815-E818 PolarHBondContact O-N 3.35Å; G815-E818 VanDerWaalsContact O-N 3.08Å; E816-E818 VanDerWaalsContact C-N 3.32Å; E816-E818 PolarHBondContact O-N 2.94Å; E818-R821 PolarHBondContact O-N 2.96Å; E818-R821 IonicContact OE2-CZ 3.99Å; E818-R821 VanDerWaalsContact OE2-CZ 3.31Å; E818-R821 IonicContact OE2-NE 2.76Å; E818-R821 PolarHBondContact OE2-NE 2.98Å; E818-R821 IonicContact OE2-NH2 3.15Å; E818-R821 PolarHBondContact OE2-NH2 3.48Å; E818-S822 WeakPolarHBondContact O-CB 3.48Å; E818-S822 PolarHBondContact O-N 3.47Å
819	M	85.4	Confident	76.8	Confident	44 Å²	44	66 Å²	66	22%	0.217	36%	0.356	C	S	.	.	H	α-helix	trans	-60.8	-46.8	170	-176.1	176.4	-73.9	0	0	111.4	L803 V806 I813 G815 E816 R821 S822 L823	L803-M819 HydrophobicContact CD1-SD 4.3Å; V806-M819 HydrophobicContact CG1-SD 4.45Å; I813-M819 HydrophobicContact CG2-CB 4.36Å; G815-M819 PolarHBondContact O-N 3.25Å; E816-M819 WeakPolarHBondContact O-CB 3.19Å; E816-M819 PolarHBondContact O-N 2.75Å; M819-R821 VanDerWaalsContact C-N 3.33Å; M819-R821 PolarHBondContact O-N 3.44Å; M819-S822 PolarHBondContact O-N 2.91Å; M819-L823 HydrophobicContact CG-CD1 3.8Å; M819-L823 HydrophobicContact CG-CG 4.34Å; M819-L823 WeakPolarHBondContact O-CB 3.34Å; M819-L823 VanDerWaalsContact O-CG 3.25Å; M819-L823 WeakPolarHBondContact O-CG 3.34Å; M819-L823 PolarHBondContact O-N 2.92Å
820	R	88.1	Confident	78	Confident	14 Å²	14	70.4 Å²	70.4	5%	0.053	36%	0.356	C	S	.	.	H	α-helix	trans	-61.9	-38.1	177.2	-71.2	-175.8	177.8	-66.5	-7.5	112.9	T801 L803 E816 M817 L824 V825 C826 P834	T801-R820 PolarHBondContact O-NH1 3.39Å; T801-R820 PolarHBondContact O-NH2 2.85Å; L803-R820 HydrophobicContact CD1-CG 4.2Å; E816-R820 WeakPolarHBondContact O-CG 3.4Å; E816-R820 PolarHBondContact O-N 2.93Å; E816-R820 IonicContact OE1-CZ 3.4Å; E816-R820 IonicContact OE1-NE 3.29Å; E816-R820 PolarHBondContact OE1-NE 3.36Å; E816-R820 IonicContact OE1-NH2 3.65Å; E816-R820 PolarHBondContact OE1-NH2 3.14Å; M817-R820 PolarHBondContact O-N 3.5Å; R820-L824 PolarHBondContact O-N 3.22Å; R820-V825 HydrophobicContact CB-CG2 4.11Å; R820-V825 HydrophobicContact CG-CG2 4.02Å; R820-V825 PolarHBondContact O-N 2.76Å; R820-C826 PolarHBondContact NH1-O 3.08Å; R820-P834 HydrophobicContact CB-CG 4.29Å
821	R	86.1	Confident	79.2	Confident	122 Å²	122	73.5 Å²	73.5	46%	0.46	37%	0.374	S	S	.	.	H	α-helix	trans	-61.4	-47.7	172	-85.7	-169.6	-80.6	-110.5	4.9	111.9	M817 E818 M819 L823 L824 P834	M817-R821 PolarHBondContact O-N 3.35Å; E818-R821 PolarHBondContact O-N 2.96Å; E818-R821 IonicContact OE2-CZ 3.99Å; E818-R821 VanDerWaalsContact OE2-CZ 3.31Å; E818-R821 IonicContact OE2-NE 2.76Å; E818-R821 PolarHBondContact OE2-NE 2.98Å; E818-R821 IonicContact OE2-NH2 3.15Å; E818-R821 PolarHBondContact OE2-NH2 3.48Å; M819-R821 VanDerWaalsContact C-N 3.33Å; M819-R821 PolarHBondContact O-N 3.44Å; R821-L823 VanDerWaalsContact C-N 3.32Å; R821-L823 PolarHBondContact O-N 2.56Å; R821-L824 WeakPolarHBondContact O-CD2 3.39Å; R821-L824 PolarHBondContact O-N 3.2Å; R821-P834 HydrophobicContact CB-CB 4.46Å; R821-P834 HydrophobicContact CG-CB 3.85Å
822	S	86.8	Confident	80.5	Confident	38 Å²	38	69.1 Å²	69.1	27%	0.266	35%	0.353	S	S	.	.	H	α-helix	trans	-63.9	-36	179.6	-173.6	0	0	0	0	113	P397 F398 E818 M819	P397-S822 WeakPolarHBondContact CA-O 3.49Å; P397-S822 WeakPolarHBondContact CB-OG 3.34Å; F398-S822 PolarHBondContact N-O 3.31Å; E818-S822 WeakPolarHBondContact O-CB 3.48Å; E818-S822 PolarHBondContact O-N 3.47Å; M819-S822 PolarHBondContact O-N 2.91Å
823	L	89.9	Confident	81.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-81.2	-16	177.9	-65.8	174	0	0	0	114	H395 P397 R771 L803 V806 M819 R821 V825	H395-L823 HydrophobicContact CB-CD2 4.16Å; H395-L823 WeakPolarHBondContact O-CD2 3.46Å; P397-L823 HydrophobicContact CG-CD2 3.94Å; R771-L823 PolarHBondContact NH1-O 2.95Å; L803-L823 HydrophobicContact CD2-CD1 3.7Å; V806-L823 HydrophobicContact CG1-CD1 4.08Å; V806-L823 HydrophobicContact CG1-CD2 4.43Å; V806-L823 HydrophobicContact CG2-CD1 3.95Å; M819-L823 HydrophobicContact CG-CD1 3.8Å; M819-L823 HydrophobicContact CG-CG 4.34Å; M819-L823 WeakPolarHBondContact O-CB 3.34Å; M819-L823 VanDerWaalsContact O-CG 3.25Å; M819-L823 WeakPolarHBondContact O-CG 3.34Å; M819-L823 PolarHBondContact O-N 2.92Å; R821-L823 VanDerWaalsContact C-N 3.32Å; R821-L823 PolarHBondContact O-N 2.56Å; L823-V825 HydrophobicContact CB-CB 4.5Å; L823-V825 HydrophobicContact CB-CG1 3.92Å; L823-V825 HydrophobicContact CB-CG2 3.93Å; L823-V825 HydrophobicContact CD1-CG2 4.43Å
824	L	89.3	Confident	83.1	Confident	15 Å²	15	60 Å²	60	8%	0.079	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	53.7	-169.9	-63.5	176.5	0	0	0	113	F398 A772 R820 R821 V835	F398-L824 HydrophobicContact CB-CD1 4.14Å; F398-L824 HydrophobicContact CD2-CB 4.3Å; F398-L824 HydrophobicContact CD2-CD1 3.74Å; F398-L824 HydrophobicContact CD2-CG 4.28Å; F398-L824 HydrophobicContact CE2-CD1 4.38Å; F398-L824 HydrophobicContact CG-CD1 4.06Å; A772-L824 HydrophobicContact CB-CB 4.09Å; A772-L824 HydrophobicContact CB-CD1 4.19Å; R820-L824 PolarHBondContact O-N 3.22Å; R821-L824 WeakPolarHBondContact O-CD2 3.39Å; R821-L824 PolarHBondContact O-N 3.2Å; L824-V835 VanDerWaalsContact O-CG2 3.32Å; L824-V835 WeakPolarHBondContact O-CG2 3.43Å
825	V	90.1	Very high	84.4	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.263	C	S	.	.			trans	-120.9	154.6	-177.2	-63.2	0	0	0	0	112.7	H395 T801 L803 R820 L823 S827 P834	H395-V825 HydrophobicContact CB-CG1 4.23Å; H395-V825 WeakPolarHBondContact CD2-CG1 3.28Å; T801-V825 HydrophobicContact CG2-CB 3.93Å; T801-V825 HydrophobicContact CG2-CG1 4.06Å; L803-V825 HydrophobicContact CD2-CG2 4.21Å; R820-V825 HydrophobicContact CB-CG2 4.11Å; R820-V825 HydrophobicContact CG-CG2 4.02Å; R820-V825 PolarHBondContact O-N 2.76Å; L823-V825 HydrophobicContact CB-CB 4.5Å; L823-V825 HydrophobicContact CB-CG1 3.92Å; L823-V825 HydrophobicContact CB-CG2 3.93Å; L823-V825 HydrophobicContact CD1-CG2 4.43Å; V825-S827 PolarHBondContact O-N 2.88Å; V825-P834 WeakPolarHBondContact O-CD 3.41Å; V825-P834 WeakPolarHBondContact O-CG 3.15Å
826	C	89.6	Confident	84.7	Confident	4 Å²	4	51.3 Å²	51.3	3%	0.027	25%	0.249	C	C	.	.			trans	-61.6	133.1	-176.5	-175.5	0	0	0	0	111.4	T801 R820 G828	T801-C826 PolarHBondContact N-O 3.45Å; T801-C826 PolarHBondContact OG1-N 3.3Å; R820-C826 PolarHBondContact NH1-O 3.08Å; C826-G828 PolarHBondContact SG-N 3Å
827	S	87.9	Confident	84.1	Confident	9 Å²	9	45.9 Å²	45.9	6%	0.063	23%	0.225	C	C	.	.			trans	-88.6	-7.1	173.2	70.5	0	0	0	0	113.6	A800 V825 R829 C833	A800-S827 WeakPolarHBondContact CB-O 3.38Å; V825-S827 PolarHBondContact O-N 2.88Å; S827-R829 PolarHBondContact O-N 3.25Å; S827-R829 PolarHBondContact OG-N 3.49Å; S827-R829 VanDerWaalsContact OG-N 3.16Å; S827-R829 PolarHBondContact OG-O 3.07Å; S827-C833 PolarHBondContact N-SG 2.95Å; S827-C833 WeakPolarHBondContact OG-CA 3.47Å
828	G	85.3	Confident	82.9	Confident	26 Å²	26	47.7 Å²	47.7	27%	0.268	25%	0.249	S	C	.	.	S	Bend	trans	72.1	-0.8	-169.3	0	0	0	0	0	114.2	C826	C826-G828 PolarHBondContact SG-N 3Å
829	R	82.8	Confident	81.6	Confident	159 Å²	159	48.5 Å²	48.5	60%	0.6	26%	0.256	S	S	*	.			trans	-120.2	110.8	-175.6	-61	-175.6	-174.9	-177.9	2.4	111.5	S827 D831 T832 C833	S827-R829 PolarHBondContact O-N 3.25Å; S827-R829 PolarHBondContact OG-N 3.49Å; S827-R829 VanDerWaalsContact OG-N 3.16Å; S827-R829 PolarHBondContact OG-O 3.07Å; R829-D831 WeakPolarHBondContact CB-OD1 3.23Å; R829-D831 PolarHBondContact O-N 3.24Å; R829-D831 VanDerWaalsContact O-N 3.13Å; R829-T832 VanDerWaalsContact CB-OG1 3.3Å; R829-T832 WeakPolarHBondContact CB-OG1 3.22Å; R829-T832 PolarHBondContact O-N 2.97Å; R829-T832 VanDerWaalsContact O-N 3.1Å; R829-C833 WeakPolarHBondContact O-CA 3.49Å; R829-C833 WeakPolarHBondContact O-CB 3.43Å; R829-C833 PolarHBondContact O-N 2.76Å
830	K	78	Confident	80.2	Confident	159 Å²	159	50.3 Å²	50.3	69%	0.691	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-31.7	-173.1	-172.4	177.1	-179.2	178.1	0	114.6	G837	K830-G837 WeakPolarHBondContact O-CA 3.4Å
831	D	77.1	Confident	79.3	Confident	117 Å²	117	59.4 Å²	59.4	63%	0.626	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-26.5	-178.8	62.1	-19.9	0	0	0	113.8	R829	R829-D831 WeakPolarHBondContact CB-OD1 3.23Å; R829-D831 PolarHBondContact O-N 3.24Å; R829-D831 VanDerWaalsContact O-N 3.13Å
832	T	79.1	Confident	79.1	Confident	59 Å²	59	56.1 Å²	56.1	36%	0.362	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	4.6	-169	47	0	0	0	0	112.9	M817 R829	M817-T832 HydrophobicContact CE-CG2 4.39Å; M817-T832 VanDerWaalsContact CE-OG1 3.24Å; M817-T832 WeakPolarHBondContact CE-OG1 3.37Å; R829-T832 VanDerWaalsContact CB-OG1 3.3Å; R829-T832 WeakPolarHBondContact CB-OG1 3.22Å; R829-T832 PolarHBondContact O-N 2.97Å; R829-T832 VanDerWaalsContact O-N 3.1Å
833	C	86	Confident	79.2	Confident	7 Å²	7	56.9 Å²	56.9	5%	0.047	29%	0.293	C	S	.	.			trans	-69.6	127	-176.7	-169.8	0	0	0	0	111.2	C797 S827 R829 V835 H836 G837	C797-C833 WeakPolarHBondContact SG-CB 3.38Å; C797-C833 PolarHBondContact SG-SG 3.01Å; S827-C833 PolarHBondContact N-SG 2.95Å; S827-C833 WeakPolarHBondContact OG-CA 3.47Å; R829-C833 WeakPolarHBondContact O-CA 3.49Å; R829-C833 WeakPolarHBondContact O-CB 3.43Å; R829-C833 PolarHBondContact O-N 2.76Å; C833-V835 PolarHBondContact O-N 3.3Å; C833-H836 HydrophobicContact CB-CB 4.41Å; C833-H836 PolarHBondContact SG-N 2.88Å; C833-H836 VanDerWaalsContact SG-N 3.42Å; C833-G837 VanDerWaalsContact O-CA 3.28Å; C833-G837 WeakPolarHBondContact O-CA 3.39Å; C833-G837 PolarHBondContact O-N 3.01Å; C833-G837 VanDerWaalsContact O-N 3.07Å
834	P	83.6	Confident	79.2	Confident	13 Å²	13	59.4 Å²	59.4	8%	0.084	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	14.4	176.5	36	-38.5	0	0	0	113.3	R820 R821 V825 R842	R820-P834 HydrophobicContact CB-CG 4.29Å; R821-P834 HydrophobicContact CB-CB 4.46Å; R821-P834 HydrophobicContact CG-CB 3.85Å; V825-P834 WeakPolarHBondContact O-CD 3.41Å; V825-P834 WeakPolarHBondContact O-CG 3.15Å; P834-R842 VanDerWaalsContact C-NH1 3.27Å; P834-R842 PolarHBondContact O-NH1 2.93Å
835	V	86.1	Confident	79.4	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.006	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	-60.3	179.7	179	0	0	0	0	108.9	L390 F773 L824 C833	L390-V835 HydrophobicContact CD1-CG1 4.36Å; L390-V835 HydrophobicContact CD2-CG2 4.32Å; F773-V835 HydrophobicContact CD2-CG1 4.09Å; F773-V835 HydrophobicContact CE2-CG1 4.19Å; L824-V835 VanDerWaalsContact O-CG2 3.32Å; L824-V835 WeakPolarHBondContact O-CG2 3.43Å; C833-V835 PolarHBondContact O-N 3.3Å
836	H	83.3	Confident	79.7	Confident	26 Å²	26	59.9 Å²	59.9	12%	0.12	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	3.5	-176.6	-43.9	113.4	0	0	0	115	I794 G795 C797 C833	I794-H836 HydrophobicContact CG2-CB 4.32Å; G795-H836 PolarHBondContact O-CD2 2.74Å; C797-H836 PolarHBondContact SG-ND1 3.13Å; C797-H836 VanDerWaalsContact SG-ND1 3.36Å; C833-H836 HydrophobicContact CB-CB 4.41Å; C833-H836 PolarHBondContact SG-N 2.88Å; C833-H836 VanDerWaalsContact SG-N 3.42Å
837	G	68.4	Low	79.9	Confident	7 Å²	7	59.7 Å²	59.7	7%	0.072	30%	0.303	C	S	.	.			trans	-69.5	140.2	-171.5	0	0	0	0	0	113.2	K830 C833 D839 N840	K830-G837 WeakPolarHBondContact O-CA 3.4Å; C833-G837 VanDerWaalsContact O-CA 3.28Å; C833-G837 WeakPolarHBondContact O-CA 3.39Å; C833-G837 PolarHBondContact O-N 3.01Å; C833-G837 VanDerWaalsContact O-N 3.07Å; G837-D839 PolarHBondContact O-N 3.09Å; G837-N840 PolarHBondContact O-OD1 3.11Å
838	A	55.7	Low	80.1	Confident	94 Å²	94	59.3 Å²	59.3	78%	0.777	30%	0.3	S	S	*	.	S	Bend	trans	-68.9	-22.7	177.9	0	0	0	0	0	113.4	N840	A838-N840 VanDerWaalsContact C-N 3.33Å; A838-N840 PolarHBondContact O-N 3.29Å; A838-N840 VanDerWaalsContact O-N 3.15Å
839	D	54.3	Low	80.3	Confident	104 Å²	104	59.6 Å²	59.6	56%	0.556	30%	0.296	S	S	*	.	S	Bend	trans	-87.4	74.2	177.7	-148.7	33.4	0	0	0	108	G837 R841	G837-D839 PolarHBondContact O-N 3.09Å; D839-R841 PolarHBondContact O-N 3.27Å; D839-R841 IonicContact OD2-CZ 2.71Å; D839-R841 IonicContact OD2-NE 3.5Å; D839-R841 PolarHBondContact OD2-NE 3.38Å; D839-R841 IonicContact OD2-NH2 2.76Å; D839-R841 PolarHBondContact OD2-NH2 3.13Å; D839-R841 VanDerWaalsContact OD2-NH2 3.15Å
840	N	57.5	Low	80.8	Confident	83 Å²	83	54.5 Å²	54.5	44%	0.444	28%	0.28	S	S	.	.			trans	-63.6	70.3	178.6	-93.1	-6.2	0	0	0	111.1	G837 A838 R842	G837-N840 PolarHBondContact O-OD1 3.11Å; A838-N840 VanDerWaalsContact C-N 3.33Å; A838-N840 PolarHBondContact O-N 3.29Å; A838-N840 VanDerWaalsContact O-N 3.15Å; N840-R842 PolarHBondContact O-N 3.27Å
841	R	67.8	Low	81.5	Confident	205 Å²	205	49 Å²	49	77%	0.774	26%	0.26	S	S	*	.			trans	-69.6	-9	175.7	-65.1	-173.8	-175.4	-155.3	-1.4	113	D839	D839-R841 PolarHBondContact O-N 3.27Å; D839-R841 IonicContact OD2-CZ 2.71Å; D839-R841 IonicContact OD2-NE 3.5Å; D839-R841 PolarHBondContact OD2-NE 3.38Å; D839-R841 IonicContact OD2-NH2 2.76Å; D839-R841 PolarHBondContact OD2-NH2 3.13Å; D839-R841 VanDerWaalsContact OD2-NH2 3.15Å
842	R	82.5	Confident	82.2	Confident	52 Å²	52	51.3 Å²	51.3	20%	0.196	27%	0.267	C	S	.	.	S	Bend	trans	-80.6	133.9	176.4	-60.5	-167	-53.1	-75.5	-13.3	108.5	D789 P834 N840 R844	D789-R842 VanDerWaalsContact CG-NH2 3.34Å; D789-R842 IonicContact OD1-CZ 2.97Å; D789-R842 IonicContact OD1-NE 3.53Å; D789-R842 IonicContact OD1-NH2 3.53Å; D789-R842 PolarHBondContact OD1-NH2 3.49Å; D789-R842 WeakPolarHBondContact OD2-CB 3.31Å; D789-R842 WeakPolarHBondContact OD2-CD 3.18Å; D789-R842 IonicContact OD2-CZ 2.82Å; D789-R842 VanDerWaalsContact OD2-CZ 3.24Å; D789-R842 IonicContact OD2-NE 2.9Å; D789-R842 PolarHBondContact OD2-NE 3.2Å; D789-R842 IonicContact OD2-NH2 3.65Å; D789-R842 PolarHBondContact OD2-NH2 2.83Å; D789-R842 VanDerWaalsContact OD2-NH2 3.15Å; P834-R842 VanDerWaalsContact C-NH1 3.27Å; P834-R842 PolarHBondContact O-NH1 2.93Å; N840-R842 PolarHBondContact O-N 3.27Å; R842-R844 PolarHBondContact O-N 3.05Å
843	P	87.9	Confident	82.9	Confident	54 Å²	54	50 Å²	50	35%	0.351	26%	0.258	S	S	.	.			trans	-61.3	134.2	174.6	25.3	-33.2	0	0	0	109.7	T403 W845 T846	T403-P843 HydrophobicContact CG2-CB 3.59Å; T403-P843 HydrophobicContact CG2-CG 4.22Å; T403-P843 WeakPolarHBondContact OG1-CG 3.14Å; P843-W845 PolarHBondContact O-N 3.02Å; P843-T846 HydrophobicContact CB-CG2 4.32Å; P843-T846 HydrophobicContact CG-CG2 3.55Å
844	R	90.8	Very high	83.3	Confident	53 Å²	53	49.7 Å²	49.7	20%	0.2	26%	0.255	C	S	.	.	S	Bend	trans	-57.2	-38	179.6	-178.4	174.4	176	163.7	-2.9	112.5	E413 E788 D789 R842	E413-R844 VanDerWaalsContact CA-NH1 3.31Å; E788-R844 CarbonylContact C-O 3.58Å; E788-R844 WeakPolarHBondContact CA-O 3.26Å; E788-R844 HydrophobicContact CG-CG 4.32Å; E788-R844 IonicContact OE1-CZ 2.81Å; E788-R844 IonicContact OE1-NE 3.39Å; E788-R844 PolarHBondContact OE1-NE 3.33Å; E788-R844 VanDerWaalsContact OE1-NE 3.13Å; E788-R844 IonicContact OE1-NH2 3.07Å; E788-R844 PolarHBondContact OE1-NH2 3.22Å; D789-R844 PolarHBondContact N-O 3.42Å; R842-R844 PolarHBondContact O-N 3.05Å
845	W	94	Very high	83.8	Confident	12 Å²	12	51.4 Å²	51.4	5%	0.045	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120.9	-178.8	-66.9	101.3	0	0	0	111.6	V404 S412 F415 W777 L786 E788 P843	V404-W845 HydrophobicContact CB-CB 4.03Å; V404-W845 HydrophobicContact CG2-CB 3.78Å; V404-W845 PolarHBondContact N-O 2.89Å; S412-W845 PolarHBondContact O-NE1 3.48Å; F415-W845 HydrophobicContact CD1-CB 4.18Å; F415-W845 AromaticContact CD1-CD1 3.78Å; F415-W845 AromaticContact CD1-CD2 3.5Å; F415-W845 HydrophobicContact CD1-CD2 3.5Å; F415-W845 AromaticContact CD1-CE2 3.71Å; F415-W845 AromaticContact CD1-CE3 3.97Å; F415-W845 HydrophobicContact CD1-CE3 3.97Å; F415-W845 AromaticContact CD1-CG 3.58Å; F415-W845 HydrophobicContact CD1-CG 3.58Å; F415-W845 HydrophobicContact CD1-CZ2 4.34Å; F415-W845 AromaticContact CD1-NE1 3.87Å; F415-W845 HydrophobicContact CE1-CB 4.42Å; F415-W845 AromaticContact CE1-CD2 3.99Å; F415-W845 HydrophobicContact CE1-CD2 3.99Å; F415-W845 HydrophobicContact CE1-CE3 4.01Å; F415-W845 HydrophobicContact CE1-CG 4.17Å; F415-W845 HydrophobicContact CG-CG 4.48Å; W777-W845 AromaticContact CD1-CZ3 3.87Å; L786-W845 HydrophobicContact CB-CE3 4.25Å; L786-W845 HydrophobicContact CB-CZ3 4.14Å; E788-W845 HydrophobicContact CB-CD2 4.37Å; E788-W845 HydrophobicContact CB-CE3 3.91Å; E788-W845 HydrophobicContact CB-CH2 3.7Å; E788-W845 HydrophobicContact CB-CZ2 4.18Å; E788-W845 HydrophobicContact CB-CZ3 3.57Å; E788-W845 HydrophobicContact CG-CD2 4.18Å; E788-W845 HydrophobicContact CG-CE3 4.2Å; E788-W845 HydrophobicContact CG-CH2 3.68Å; E788-W845 HydrophobicContact CG-CZ2 3.64Å; E788-W845 HydrophobicContact CG-CZ3 3.99Å; E788-W845 VanDerWaalsContact OE1-CZ2 3.27Å; E788-W845 WeakPolarHBondContact OE1-CZ2 3.37Å; E788-W845 WeakPolarHBondContact OE2-CH2 3.3Å; P843-W845 PolarHBondContact O-N 3.02Å
846	T	94.9	Very high	84.2	Confident	13 Å²	13	54.2 Å²	54.2	8%	0.08	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	170.8	167.7	58.5	0	0	0	0	109.7	F401 P402 V787 P843	F401-T846 HydrophobicContact CB-CG2 4.32Å; P402-T846 CarbonylContact O-C 3.58Å; P402-T846 WeakPolarHBondContact O-CA 3.48Å; P402-T846 VanDerWaalsContact O-CB 3.26Å; P402-T846 WeakPolarHBondContact O-CB 3.2Å; V787-T846 WeakPolarHBondContact CB-OG1 3.49Å; V787-T846 PolarHBondContact N-O 2.99Å; V787-T846 PolarHBondContact O-N 2.79Å; P843-T846 HydrophobicContact CB-CG2 4.32Å; P843-T846 HydrophobicContact CG-CG2 3.55Å
847	F	94.2	Very high	84.8	Confident	1 Å²	1	53 Å²	53	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	158.9	-176.8	65.3	-86.8	0	0	0	113.9	P402 V404 L785 L786 N849 L893	P402-F847 HydrophobicContact CB-CD1 4.29Å; P402-F847 HydrophobicContact CB-CE1 3.7Å; P402-F847 HydrophobicContact CB-CE2 4.2Å; P402-F847 HydrophobicContact CB-CZ 3.65Å; P402-F847 WeakPolarHBondContact CD-O 3.09Å; P402-F847 HydrophobicContact CG-CZ 4.42Å; P402-F847 WeakPolarHBondContact O-CD1 3.25Å; P402-F847 PolarHBondContact O-N 2.67Å; P402-F847 VanDerWaalsContact O-N 3.08Å; V404-F847 HydrophobicContact CG2-CD1 3.67Å; V404-F847 HydrophobicContact CG2-CE1 4.37Å; L785-F847 CarbonylContact O-C 3.53Å; L785-F847 WeakPolarHBondContact O-CA 3.22Å; L786-F847 HydrophobicContact CD2-CB 3.81Å; F847-N849 HydrophobicContact CD2-CB 3.81Å; F847-N849 HydrophobicContact CE2-CB 3.79Å; F847-L893 HydrophobicContact CB-CD1 4.29Å; F847-L893 HydrophobicContact CD1-CB 4.1Å; F847-L893 HydrophobicContact CD2-CB 4.31Å; F847-L893 HydrophobicContact CD2-CD1 4.02Å; F847-L893 HydrophobicContact CE1-CB 3.82Å; F847-L893 HydrophobicContact CE2-CB 4.06Å; F847-L893 HydrophobicContact CE2-CD1 4.48Å; F847-L893 HydrophobicContact CG-CB 4.32Å; F847-L893 HydrophobicContact CG-CD1 4.04Å; F847-L893 HydrophobicContact CZ-CB 3.79Å
848	I	93.4	Very high	86	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.9	172.2	-54.1	-177.3	0	0	0	107.4	F401 A784 L785 L853 F854 L857 L886	F401-I848 HydrophobicContact CD1-CD1 4.14Å; F401-I848 HydrophobicContact CD1-CG1 3.72Å; F401-I848 HydrophobicContact CE1-CD1 3.46Å; F401-I848 VanDerWaalsContact CE1-CD1 3.46Å; F401-I848 HydrophobicContact CE1-CG1 3.58Å; F401-I848 HydrophobicContact CE2-CD1 4.45Å; F401-I848 HydrophobicContact CG-CG1 4.37Å; F401-I848 HydrophobicContact CZ-CD1 3.66Å; F401-I848 HydrophobicContact CZ-CG1 4.14Å; A784-I848 WeakPolarHBondContact CA-O 3.47Å; A784-I848 WeakPolarHBondContact CB-O 3.45Å; L785-I848 HydrophobicContact CB-CB 4.2Å; L785-I848 HydrophobicContact CD2-CD1 4.19Å; L785-I848 PolarHBondContact N-O 2.84Å; L785-I848 PolarHBondContact O-N 3.25Å; I848-L853 HydrophobicContact CG2-CB 3.82Å; I848-F854 HydrophobicContact CG2-CB 3.97Å; I848-L857 HydrophobicContact CD1-CB 4.17Å; I848-L857 HydrophobicContact CD1-CD2 3.56Å; I848-L857 HydrophobicContact CD1-CG 4.44Å; I848-L886 HydrophobicContact CG2-CD1 4.39Å; I848-L886 WeakPolarHBondContact O-CD2 3.23Å
849	N	89.8	Confident	87.9	Confident	33 Å²	33	55.9 Å²	55.9	18%	0.176	27%	0.267	C	S	.	.			trans	-122.9	7.4	-174.9	69	-14.9	0	0	0	114.1	F847	F847-N849 HydrophobicContact CD2-CB 3.81Å; F847-N849 HydrophobicContact CE2-CB 3.79Å
850	N	91.4	Very high	89.8	Confident	51 Å²	51	55 Å²	55	27%	0.273	26%	0.256	S	S	.	.	S	Bend	trans	-148.8	156.9	179.1	65.6	70.6	0	0	0	110.9	E852 L853 F854	N850-E852 VanDerWaalsContact C-N 3.3Å; N850-E852 PolarHBondContact O-N 3.44Å; N850-E852 WeakPolarHBondContact OD1-CB 3.46Å; N850-E852 PolarHBondContact OD1-N 3.44Å; N850-L853 WeakPolarHBondContact ND2-CD1 3.28Å; N850-L853 PolarHBondContact O-N 2.92Å; N850-L853 PolarHBondContact OD1-N 3.08Å; N850-F854 PolarHBondContact O-N 3.27Å
851	V	92.9	Very high	91.5	Very high	44 Å²	44	51.3 Å²	51.3	27%	0.267	24%	0.236	S	C	.	.	H	α-helix	trans	-64.5	-33	-176.1	-179.5	0	0	0	0	112.1	F854 D855 E883 L886	V851-F854 PolarHBondContact O-N 3.32Å; V851-D855 PolarHBondContact O-N 2.87Å; V851-E883 HydrophobicContact CG1-CG 4.06Å; V851-E883 HydrophobicContact CG2-CB 4.3Å; V851-E883 HydrophobicContact CG2-CG 4.32Å; V851-L886 HydrophobicContact CG2-CB 4.31Å
852	E	93.2	Very high	92.7	Very high	165 Å²	165	41.9 Å²	41.9	77%	0.771	20%	0.201	S	C	*	.	H	α-helix	trans	-64.7	-45	-179.1	-61	-179.4	-178.7	0	0	112.3	N850 L856	N850-E852 VanDerWaalsContact C-N 3.3Å; N850-E852 PolarHBondContact O-N 3.44Å; N850-E852 WeakPolarHBondContact OD1-CB 3.46Å; N850-E852 PolarHBondContact OD1-N 3.44Å; E852-L856 WeakPolarHBondContact O-CB 3.4Å; E852-L856 PolarHBondContact O-N 3.3Å
853	L	93.1	Very high	93.2	Very high	32 Å²	32	43.1 Å²	43.1	17%	0.168	22%	0.216	C	C	.	.	H	α-helix	trans	-67	-36.7	175.2	-75	179.6	0	0	0	111.9	P402 I848 N850 L856 L857	P402-L853 HydrophobicContact CG-CD1 4.47Å; I848-L853 HydrophobicContact CG2-CB 3.82Å; N850-L853 WeakPolarHBondContact ND2-CD1 3.28Å; N850-L853 PolarHBondContact O-N 2.92Å; N850-L853 PolarHBondContact OD1-N 3.08Å; L853-L856 PolarHBondContact O-N 2.84Å; L853-L857 PolarHBondContact O-N 3.01Å
854	F	94.3	Very high	93.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.6	-49	175.2	174.5	-110.2	0	0	0	111.8	I848 N850 V851 L856 L857 M858 L875 R879 I882 E883 L886	I848-F854 HydrophobicContact CG2-CB 3.97Å; N850-F854 PolarHBondContact O-N 3.27Å; V851-F854 PolarHBondContact O-N 3.32Å; F854-L856 PolarHBondContact O-N 3.24Å; F854-L857 WeakPolarHBondContact O-CB 3.48Å; F854-L857 PolarHBondContact O-N 2.99Å; F854-M858 HydrophobicContact CE1-CG 4.35Å; F854-M858 HydrophobicContact CE2-CG 4.19Å; F854-M858 HydrophobicContact CE2-SD 4.38Å; F854-M858 HydrophobicContact CZ-CG 4.07Å; F854-M858 HydrophobicContact CZ-SD 4.36Å; F854-M858 WeakPolarHBondContact O-CG 3.43Å; F854-M858 PolarHBondContact O-N 3.4Å; F854-L875 HydrophobicContact CE2-CB 4.15Å; F854-L875 HydrophobicContact CE2-CD1 4.33Å; F854-L875 HydrophobicContact CE2-CD2 4.28Å; F854-L875 HydrophobicContact CE2-CG 4.48Å; F854-L875 HydrophobicContact CZ-CB 4.38Å; F854-R879 HydrophobicContact CE1-CG 4.27Å; F854-I882 HydrophobicContact CD1-CG2 4.38Å; F854-I882 HydrophobicContact CD2-CG2 3.89Å; F854-I882 HydrophobicContact CE1-CG2 4.25Å; F854-I882 HydrophobicContact CE2-CD1 4.09Å; F854-I882 HydrophobicContact CE2-CG2 3.77Å; F854-I882 HydrophobicContact CG-CG2 4.2Å; F854-I882 HydrophobicContact CZ-CB 4.32Å; F854-I882 HydrophobicContact CZ-CD1 4.14Å; F854-I882 HydrophobicContact CZ-CG2 3.95Å; F854-E883 HydrophobicContact CD1-CG 4.38Å; F854-E883 HydrophobicContact CE1-CG 4.37Å; F854-L886 HydrophobicContact CB-CD1 3.68Å; F854-L886 HydrophobicContact CG-CD1 4.06Å
855	D	95.1	Very high	93.3	Very high	50 Å²	50	38.8 Å²	38.8	27%	0.267	19%	0.192	S	C	.	.	H	α-helix	trans	-63.4	-33.1	175.3	-84.3	-21.7	0	0	0	112.5	V851 K859 R879	V851-D855 PolarHBondContact O-N 2.87Å; D855-K859 WeakPolarHBondContact O-CD 3.42Å; D855-K859 VanDerWaalsContact O-CG 3.27Å; D855-K859 WeakPolarHBondContact O-CG 3.33Å; D855-K859 PolarHBondContact O-N 2.82Å; D855-K859 VanDerWaalsContact O-N 3.16Å; D855-R879 IonicContact OD1-NH1 3.15Å; D855-R879 PolarHBondContact OD1-NH1 2.9Å
856	L	94.4	Very high	93.1	Very high	59 Å²	59	42.6 Å²	42.6	31%	0.309	21%	0.212	S	C	.	.	H	α-helix	trans	-67.2	-44.8	174.2	-172.2	54.9	0	0	0	110.9	P399 E852 L853 F854 M858 K859 R860	P399-L856 HydrophobicContact CB-CD2 3.62Å; P399-L856 HydrophobicContact CB-CG 3.95Å; P399-L856 HydrophobicContact CG-CD2 4.34Å; P399-L856 HydrophobicContact CG-CG 4.14Å; E852-L856 WeakPolarHBondContact O-CB 3.4Å; E852-L856 PolarHBondContact O-N 3.3Å; L853-L856 PolarHBondContact O-N 2.84Å; F854-L856 PolarHBondContact O-N 3.24Å; L856-M858 PolarHBondContact O-N 3.41Å; L856-K859 PolarHBondContact O-N 3.2Å; L856-R860 HydrophobicContact CD1-CG 4.42Å; L856-R860 VanDerWaalsContact O-CG 3.25Å; L856-R860 WeakPolarHBondContact O-CG 3.37Å; L856-R860 PolarHBondContact O-N 3.35Å
857	L	94.5	Very high	92.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-53.7	-53.5	172.1	168.2	65.5	0	0	0	110.9	F398 F401 Y776 L785 I848 L853 F854 K859 R860 L861 L875	F398-L857 HydrophobicContact CD1-CD1 4.11Å; F398-L857 HydrophobicContact CE1-CD1 3.69Å; F401-L857 HydrophobicContact CZ-CB 4.29Å; F401-L857 HydrophobicContact CZ-CD1 4.16Å; Y776-L857 HydrophobicContact CD1-CD2 4.23Å; Y776-L857 HydrophobicContact CE1-CD1 4.2Å; Y776-L857 HydrophobicContact CE1-CD2 3.6Å; Y776-L857 WeakPolarHBondContact OH-CD1 3.22Å; L785-L857 HydrophobicContact CD2-CD2 4.37Å; I848-L857 HydrophobicContact CD1-CB 4.17Å; I848-L857 HydrophobicContact CD1-CD2 3.56Å; I848-L857 HydrophobicContact CD1-CG 4.44Å; L853-L857 PolarHBondContact O-N 3.01Å; F854-L857 WeakPolarHBondContact O-CB 3.48Å; F854-L857 PolarHBondContact O-N 2.99Å; L857-K859 PolarHBondContact O-N 3.09Å; L857-K859 VanDerWaalsContact O-N 3.13Å; L857-R860 PolarHBondContact O-N 3.32Å; L857-L861 HydrophobicContact CD1-CD1 4.13Å; L857-L861 HydrophobicContact CD1-CD2 4.04Å; L857-L861 HydrophobicContact CD1-CG 3.94Å; L857-L861 HydrophobicContact CG-CD1 4.17Å; L857-L861 HydrophobicContact CG-CG 4.4Å; L857-L861 PolarHBondContact O-N 3.38Å; L857-L861 VanDerWaalsContact O-N 3.16Å; L857-L875 HydrophobicContact CD2-CD1 3.79Å
858	M	94.7	Very high	92.9	Very high	28 Å²	28	43 Å²	43	14%	0.138	21%	0.212	C	C	.	.	H	α-helix	trans	-56	-33.5	-178.6	-69.4	-61.1	-73.1	0	0	112.6	F854 L856 L861 I872 L875 D876	F854-M858 HydrophobicContact CE1-CG 4.35Å; F854-M858 HydrophobicContact CE2-CG 4.19Å; F854-M858 HydrophobicContact CE2-SD 4.38Å; F854-M858 HydrophobicContact CZ-CG 4.07Å; F854-M858 HydrophobicContact CZ-SD 4.36Å; F854-M858 WeakPolarHBondContact O-CG 3.43Å; F854-M858 PolarHBondContact O-N 3.4Å; L856-M858 PolarHBondContact O-N 3.41Å; M858-L861 HydrophobicContact SD-CD1 4.49Å; M858-I872 HydrophobicContact CE-CG2 4.29Å; M858-L875 HydrophobicContact CE-CB 4.22Å; M858-L875 HydrophobicContact SD-CB 3.62Å; M858-L875 HydrophobicContact SD-CD1 3.89Å; M858-L875 HydrophobicContact SD-CG 4.43Å; M858-D876 HydrophobicContact CE-CB 3.86Å
859	K	94.3	Very high	92.8	Very high	135 Å²	135	45.5 Å²	45.5	59%	0.587	22%	0.224	S	C	*	.	H	α-helix	trans	-76.1	-19.1	177.1	-72.6	167.1	-173.3	164.2	0	114.4	K396 D855 L856 L857	K396-K859 WeakPolarHBondContact CD-O 3.49Å; K396-K859 PolarHBondContact NZ-O 3.13Å; K396-K859 VanDerWaalsContact NZ-O 3.11Å; D855-K859 WeakPolarHBondContact O-CD 3.42Å; D855-K859 VanDerWaalsContact O-CG 3.27Å; D855-K859 WeakPolarHBondContact O-CG 3.33Å; D855-K859 PolarHBondContact O-N 2.82Å; D855-K859 VanDerWaalsContact O-N 3.16Å; L856-K859 PolarHBondContact O-N 3.2Å; L857-K859 PolarHBondContact O-N 3.09Å; L857-K859 VanDerWaalsContact O-N 3.13Å
860	R	94.5	Very high	92.8	Very high	85 Å²	85	47.6 Å²	47.6	32%	0.321	24%	0.235	S	C	.	.	H	α-helix	trans	-101.6	-22.6	-173.8	-61.2	-54.7	-176.4	165.9	0.3	114.4	P397 R771 L856 L857	P397-R860 WeakPolarHBondContact O-CD 3.38Å; P397-R860 WeakPolarHBondContact O-CG 3.45Å; P397-R860 PolarHBondContact O-NE 3.43Å; R771-R860 PolarHBondContact NH2-O 3.27Å; L856-R860 HydrophobicContact CD1-CG 4.42Å; L856-R860 VanDerWaalsContact O-CG 3.25Å; L856-R860 WeakPolarHBondContact O-CG 3.37Å; L856-R860 PolarHBondContact O-N 3.35Å; L857-R860 PolarHBondContact O-N 3.32Å
861	L	94.4	Very high	92.8	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	22%	0.222	C	C	.	.	S	Bend	trans	-59.7	144.9	168.9	-65.1	172.5	0	0	0	110.4	F398 D770 L857 M858 E868 L871 I872 L875	F398-L861 HydrophobicContact CE1-CD2 3.86Å; F398-L861 HydrophobicContact CZ-CD2 3.82Å; D770-L861 HydrophobicContact CB-CD2 4.39Å; L857-L861 HydrophobicContact CD1-CD1 4.13Å; L857-L861 HydrophobicContact CD1-CD2 4.04Å; L857-L861 HydrophobicContact CD1-CG 3.94Å; L857-L861 HydrophobicContact CG-CD1 4.17Å; L857-L861 HydrophobicContact CG-CG 4.4Å; L857-L861 PolarHBondContact O-N 3.38Å; L857-L861 VanDerWaalsContact O-N 3.16Å; M858-L861 HydrophobicContact SD-CD1 4.49Å; L861-E868 HydrophobicContact CB-CB 4.47Å; L861-E868 HydrophobicContact CD2-CB 4.24Å; L861-E868 HydrophobicContact CD2-CG 3.92Å; L861-L871 HydrophobicContact CD1-CD2 3.94Å; L861-L871 HydrophobicContact CD1-CG 4.07Å; L861-L871 HydrophobicContact CD2-CD2 3.89Å; L861-I872 HydrophobicContact CB-CD1 3.7Å; L861-I872 HydrophobicContact CB-CG1 3.7Å; L861-I872 HydrophobicContact CD1-CG1 3.74Å; L861-I872 HydrophobicContact CG-CG1 4.36Å; L861-L875 HydrophobicContact CD1-CD1 4.35Å
862	N	92.8	Very high	92.8	Very high	8 Å²	8	44.6 Å²	44.6	4%	0.043	22%	0.217	C	C	.	.			trans	-101	114.7	-177.1	-167.8	-22.2	0	0	0	110	C392 D394 R864 G865 E868	C392-N862 VanDerWaalsContact CB-ND2 3.34Å; C392-N862 WeakPolarHBondContact CB-ND2 3.05Å; D394-N862 PolarHBondContact OD1-ND2 2.78Å; N862-R864 PolarHBondContact O-N 3.02Å; N862-R864 WeakPolarHBondContact OD1-CB 3.06Å; N862-R864 PolarHBondContact OD1-N 3.38Å; N862-G865 PolarHBondContact O-N 2.92Å; N862-G865 VanDerWaalsContact O-N 3.08Å; N862-E868 WeakPolarHBondContact CA-OE2 3.45Å; N862-E868 WeakPolarHBondContact CB-OE2 3.47Å; N862-E868 PolarHBondContact N-OE2 3.43Å; N862-E868 WeakPolarHBondContact O-CB 3.18Å
863	P	92.1	Very high	92.6	Very high	77 Å²	77	40 Å²	40	50%	0.5	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-1.5	179.3	30.5	-36.7	0	0	0	114	M869 I872	P863-M869 VanDerWaalsContact CA-CE 3.46Å; P863-M869 HydrophobicContact CB-CE 3.45Å; P863-M869 VanDerWaalsContact CB-CE 3.45Å; P863-M869 WeakPolarHBondContact O-CE 3.34Å; P863-I872 HydrophobicContact CB-CD1 4.34Å
864	R	91.7	Very high	92.4	Very high	17 Å²	17	40.9 Å²	40.9	6%	0.064	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-13.9	172.5	-64.8	166.4	60.9	-144.3	-4.1	112.7	W383 S386 R387 D393 D394 N862	W383-R864 VanDerWaalsContact CE2-NH1 3.32Å; W383-R864 VanDerWaalsContact NE1-NH1 3.12Å; W383-R864 VanDerWaalsContact O-CZ 3.24Å; W383-R864 PolarHBondContact O-NE 3.29Å; W383-R864 PolarHBondContact O-NH2 3.38Å; W383-R864 VanDerWaalsContact O-NH2 3.07Å; S386-R864 WeakPolarHBondContact CA-O 3.46Å; R387-R864 PolarHBondContact N-O 2.65Å; D393-R864 IonicContact OD1-CZ 3.03Å; D393-R864 IonicContact OD1-NH1 4Å; D393-R864 PolarHBondContact OD1-NH1 2.88Å; D393-R864 IonicContact OD1-NH2 3.79Å; D394-R864 IonicContact OD1-CZ 3.84Å; D394-R864 IonicContact OD1-NH1 3.72Å; D394-R864 PolarHBondContact OD1-NH1 2.87Å; D394-R864 IonicContact OD2-CZ 2.79Å; D394-R864 IonicContact OD2-NH1 2.72Å; D394-R864 PolarHBondContact OD2-NH1 3.38Å; N862-R864 PolarHBondContact O-N 3.02Å; N862-R864 WeakPolarHBondContact OD1-CB 3.06Å; N862-R864 PolarHBondContact OD1-N 3.38Å
865	G	90.3	Very high	92.3	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-82.7	132.3	177.1	0	0	0	0	0	110.6	R387 D389 N862 M869	R387-G865 WeakPolarHBondContact O-CA 3.41Å; D389-G865 VanDerWaalsContact OD1-CA 3.23Å; D389-G865 WeakPolarHBondContact OD1-CA 3.49Å; N862-G865 PolarHBondContact O-N 2.92Å; N862-G865 VanDerWaalsContact O-N 3.08Å; G865-M869 VanDerWaalsContact O-CB 3.27Å; G865-M869 WeakPolarHBondContact O-CB 3.42Å; G865-M869 PolarHBondContact O-N 2.93Å
866	M	89.2	Confident	92.1	Very high	91 Å²	91	42.8 Å²	42.8	45%	0.448	21%	0.21	S	C	.	.	H	α-helix	trans	-53.1	-56.7	177.1	-69	-175.3	-68.4	0	0	112.8	R387 D388 D389 M869 D870	R387-M866 WeakPolarHBondContact O-CG 3.38Å; R387-M866 PolarHBondContact O-N 3.22Å; D388-M866 HydrophobicContact CB-CE 3.9Å; D389-M866 PolarHBondContact OD1-N 3.41Å; M866-M869 PolarHBondContact O-N 3.11Å; M866-D870 PolarHBondContact O-N 3.24Å
867	R	90.5	Very high	91.7	Very high	24 Å²	24	44.1 Å²	44.1	9%	0.091	21%	0.214	C	C	.	.	H	α-helix	trans	-72.5	-37.6	-174.8	-53.8	165.2	-78.3	-175.8	-16.5	111.3	D389 R769 D770 R771 M869 D870 L871	D389-R867 PolarHBondContact OD1-N 3.08Å; D389-R867 IonicContact OD1-NE 3.94Å; D389-R867 VanDerWaalsContact OD2-CB 3.29Å; D389-R867 WeakPolarHBondContact OD2-CB 3.28Å; D389-R867 IonicContact OD2-CZ 3.34Å; D389-R867 IonicContact OD2-NE 3.96Å; D389-R867 PolarHBondContact OD2-NE 2.86Å; D389-R867 IonicContact OD2-NH2 2.89Å; R769-R867 HydrophobicContact CB-CB 4.32Å; R769-R867 CarbonylContact O-C 3.36Å; R769-R867 VanDerWaalsContact O-C 3.28Å; R769-R867 WeakPolarHBondContact O-CB 3.36Å; D770-R867 PolarHBondContact O-NH1 3.16Å; R771-R867 PolarHBondContact O-NH2 2.56Å; R867-M869 VanDerWaalsContact C-N 3.31Å; R867-M869 PolarHBondContact O-N 3.24Å; R867-D870 PolarHBondContact O-N 3.48Å; R867-L871 WeakPolarHBondContact O-CB 3.45Å; R867-L871 PolarHBondContact O-N 2.87Å
868	E	93.5	Very high	91.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67	-31.6	177.6	-69	-166.5	157	0	0	112.6	F398 D770 R771 L861 N862 I872	F398-E868 VanDerWaalsContact CZ-OE1 3.29Å; F398-E868 WeakPolarHBondContact CZ-OE1 3.5Å; D770-E868 HydrophobicContact CB-CG 4.34Å; R771-E868 HydrophobicContact CB-CG 4.44Å; R771-E868 WeakPolarHBondContact CB-OE1 3.33Å; R771-E868 WeakPolarHBondContact CG-OE1 3.22Å; R771-E868 IonicContact CZ-OE1 3.29Å; R771-E868 VanDerWaalsContact CZ-OE1 3.27Å; R771-E868 IonicContact CZ-OE2 3.99Å; R771-E868 PolarHBondContact N-OE1 3.23Å; R771-E868 VanDerWaalsContact NE-CD 3.32Å; R771-E868 IonicContact NE-OE1 2.79Å; R771-E868 PolarHBondContact NE-OE1 2.92Å; R771-E868 IonicContact NE-OE2 2.78Å; R771-E868 PolarHBondContact NE-OE2 3.22Å; R771-E868 IonicContact NH2-OE1 2.86Å; R771-E868 PolarHBondContact NH2-OE1 2.88Å; R771-E868 VanDerWaalsContact NH2-OE1 3.15Å; R771-E868 IonicContact NH2-OE2 3.25Å; R771-E868 PolarHBondContact NH2-OE2 3.16Å; L861-E868 HydrophobicContact CB-CB 4.47Å; L861-E868 HydrophobicContact CD2-CB 4.24Å; L861-E868 HydrophobicContact CD2-CG 3.92Å; N862-E868 WeakPolarHBondContact CA-OE2 3.45Å; N862-E868 WeakPolarHBondContact CB-OE2 3.47Å; N862-E868 PolarHBondContact N-OE2 3.43Å; N862-E868 WeakPolarHBondContact O-CB 3.18Å; E868-I872 WeakPolarHBondContact O-CB 3.27Å; E868-I872 WeakPolarHBondContact O-CD1 3.42Å; E868-I872 WeakPolarHBondContact O-CG1 3.18Å; E868-I872 PolarHBondContact O-N 2.9Å
869	M	92.7	Very high	91.4	Very high	52 Å²	52	46.3 Å²	46.3	26%	0.256	22%	0.221	S	C	.	.	H	α-helix	trans	-66	-49	171.2	-178.5	56.9	70.8	0	0	111	P863 G865 M866 R867 L871 I872 E873	P863-M869 VanDerWaalsContact CA-CE 3.46Å; P863-M869 HydrophobicContact CB-CE 3.45Å; P863-M869 VanDerWaalsContact CB-CE 3.45Å; P863-M869 WeakPolarHBondContact O-CE 3.34Å; G865-M869 VanDerWaalsContact O-CB 3.27Å; G865-M869 WeakPolarHBondContact O-CB 3.42Å; G865-M869 PolarHBondContact O-N 2.93Å; M866-M869 PolarHBondContact O-N 3.11Å; R867-M869 VanDerWaalsContact C-N 3.31Å; R867-M869 PolarHBondContact O-N 3.24Å; M869-L871 PolarHBondContact O-N 3.31Å; M869-I872 WeakPolarHBondContact O-CA 3.4Å; M869-I872 WeakPolarHBondContact O-CB 3.44Å; M869-I872 PolarHBondContact O-N 3.43Å; M869-E873 HydrophobicContact CG-CG 4.41Å; M869-E873 WeakPolarHBondContact O-CG 3.48Å; M869-E873 PolarHBondContact O-N 3.35Å; M869-E873 HydrophobicContact SD-CG 4.1Å
870	D	88.9	Confident	91.2	Very high	77 Å²	77	41.9 Å²	41.9	41%	0.412	21%	0.207	S	C	.	.	H	α-helix	trans	-55.7	-42.7	176.3	-60.8	-16.9	0	0	0	110.9	M866 R867 E873 I874	M866-D870 PolarHBondContact O-N 3.24Å; R867-D870 PolarHBondContact O-N 3.48Å; D870-E873 PolarHBondContact O-N 3.39Å; D870-I874 VanDerWaalsContact O-CG1 3.29Å; D870-I874 WeakPolarHBondContact O-CG1 3.39Å; D870-I874 PolarHBondContact O-N 2.66Å; D870-I874 VanDerWaalsContact O-N 3.08Å
871	L	92.2	Very high	91	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-41.8	175.6	-178.5	62	0	0	0	112.2	D770 Y776 L861 R867 M869 L875	D770-L871 HydrophobicContact CB-CD2 4.35Å; Y776-L871 HydrophobicContact CD2-CD1 4.02Å; Y776-L871 HydrophobicContact CD2-CD2 3.57Å; Y776-L871 HydrophobicContact CD2-CG 4.48Å; Y776-L871 HydrophobicContact CE2-CD2 3.53Å; Y776-L871 HydrophobicContact CG-CD1 3.93Å; Y776-L871 HydrophobicContact CG-CD2 4.11Å; L861-L871 HydrophobicContact CD1-CD2 3.94Å; L861-L871 HydrophobicContact CD1-CG 4.07Å; L861-L871 HydrophobicContact CD2-CD2 3.89Å; R867-L871 WeakPolarHBondContact O-CB 3.45Å; R867-L871 PolarHBondContact O-N 2.87Å; M869-L871 PolarHBondContact O-N 3.31Å; L871-L875 HydrophobicContact CD1-CD1 3.77Å; L871-L875 HydrophobicContact CD1-CD2 4.34Å; L871-L875 HydrophobicContact CD1-CG 3.82Å; L871-L875 HydrophobicContact CD2-CD1 4.48Å; L871-L875 HydrophobicContact CG-CD1 3.83Å; L871-L875 HydrophobicContact CG-CG 4.23Å; L871-L875 WeakPolarHBondContact O-CB 3.31Å; L871-L875 WeakPolarHBondContact O-CG 3.27Å; L871-L875 PolarHBondContact O-N 3.47Å
872	I	93.6	Very high	90.8	Very high	32 Å²	32	38 Å²	38	16%	0.164	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-47.3	175.4	-74.3	161.5	0	0	0	110.2	M858 L861 P863 E868 M869 I874 L875 D876	M858-I872 HydrophobicContact CE-CG2 4.29Å; L861-I872 HydrophobicContact CB-CD1 3.7Å; L861-I872 HydrophobicContact CB-CG1 3.7Å; L861-I872 HydrophobicContact CD1-CG1 3.74Å; L861-I872 HydrophobicContact CG-CG1 4.36Å; P863-I872 HydrophobicContact CB-CD1 4.34Å; E868-I872 WeakPolarHBondContact O-CB 3.27Å; E868-I872 WeakPolarHBondContact O-CD1 3.42Å; E868-I872 WeakPolarHBondContact O-CG1 3.18Å; E868-I872 PolarHBondContact O-N 2.9Å; M869-I872 WeakPolarHBondContact O-CA 3.4Å; M869-I872 WeakPolarHBondContact O-CB 3.44Å; M869-I872 PolarHBondContact O-N 3.43Å; I872-I874 PolarHBondContact O-N 3.16Å; I872-L875 PolarHBondContact O-N 3.38Å; I872-D876 WeakPolarHBondContact O-CB 3.46Å; I872-D876 PolarHBondContact O-N 2.85Å
873	E	88.7	Confident	90.8	Very high	69 Å²	69	40.3 Å²	40.3	32%	0.322	20%	0.203	S	C	.	.	H	α-helix	trans	-60.5	-47.2	-178.7	-72	-177.3	164.7	0	0	110.9	S277 M869 D870 F877	S277-E873 WeakPolarHBondContact CB-OE1 3.36Å; M869-E873 HydrophobicContact CG-CG 4.41Å; M869-E873 WeakPolarHBondContact O-CG 3.48Å; M869-E873 PolarHBondContact O-N 3.35Å; M869-E873 HydrophobicContact SD-CG 4.1Å; D870-E873 PolarHBondContact O-N 3.39Å; E873-F877 WeakPolarHBondContact O-CB 3.32Å; E873-F877 PolarHBondContact O-N 3.41Å
874	I	87.9	Confident	90.7	Very high	49 Å²	49	42 Å²	42	25%	0.251	20%	0.199	S	C	.	.	H	α-helix	trans	-63.9	-48.1	178.2	-65.5	165.7	0	0	0	111.6	D870 I872 F878	D870-I874 VanDerWaalsContact O-CG1 3.29Å; D870-I874 WeakPolarHBondContact O-CG1 3.39Å; D870-I874 PolarHBondContact O-N 2.66Å; D870-I874 VanDerWaalsContact O-N 3.08Å; I872-I874 PolarHBondContact O-N 3.16Å; I874-F878 HydrophobicContact CG2-CD2 4.3Å; I874-F878 WeakPolarHBondContact O-CD2 3.39Å; I874-F878 PolarHBondContact O-N 2.75Å
875	L	91.7	Very high	90.5	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-69	-35.6	-177.4	-68.1	-178.7	0	0	0	112.3	L785 F854 L857 M858 L861 L871 I872 R879 I882	L785-L875 HydrophobicContact CD1-CD2 4.46Å; L785-L875 HydrophobicContact CD2-CD2 3.92Å; F854-L875 HydrophobicContact CE2-CB 4.15Å; F854-L875 HydrophobicContact CE2-CD1 4.33Å; F854-L875 HydrophobicContact CE2-CD2 4.28Å; F854-L875 HydrophobicContact CE2-CG 4.48Å; F854-L875 HydrophobicContact CZ-CB 4.38Å; L857-L875 HydrophobicContact CD2-CD1 3.79Å; M858-L875 HydrophobicContact CE-CB 4.22Å; M858-L875 HydrophobicContact SD-CB 3.62Å; M858-L875 HydrophobicContact SD-CD1 3.89Å; M858-L875 HydrophobicContact SD-CG 4.43Å; L861-L875 HydrophobicContact CD1-CD1 4.35Å; L871-L875 HydrophobicContact CD1-CD1 3.77Å; L871-L875 HydrophobicContact CD1-CD2 4.34Å; L871-L875 HydrophobicContact CD1-CG 3.82Å; L871-L875 HydrophobicContact CD2-CD1 4.48Å; L871-L875 HydrophobicContact CG-CD1 3.83Å; L871-L875 HydrophobicContact CG-CG 4.23Å; L871-L875 WeakPolarHBondContact O-CB 3.31Å; L871-L875 WeakPolarHBondContact O-CG 3.27Å; L871-L875 PolarHBondContact O-N 3.47Å; I872-L875 PolarHBondContact O-N 3.38Å; L875-R879 WeakPolarHBondContact O-CA 3.3Å; L875-R879 PolarHBondContact O-N 3.21Å; L875-I882 HydrophobicContact CD2-CD1 3.86Å
876	D	91.1	Very high	90.5	Very high	86 Å²	86	42.6 Å²	42.6	46%	0.46	20%	0.203	S	C	.	.	H	α-helix	trans	-74.3	-38.9	177.6	-157.9	58.2	0	0	0	111.5	M858 I872 F878 R879	M858-D876 HydrophobicContact CE-CB 3.86Å; I872-D876 WeakPolarHBondContact O-CB 3.46Å; I872-D876 PolarHBondContact O-N 2.85Å; D876-F878 PolarHBondContact O-N 3.12Å; D876-R879 VanDerWaalsContact O-CB 3.22Å; D876-R879 WeakPolarHBondContact O-CB 3.36Å; D876-R879 PolarHBondContact O-N 3.47Å; D876-R879 VanDerWaalsContact O-N 3.1Å; D876-R879 IonicContact OD1-CZ 3.87Å; D876-R879 IonicContact OD1-NE 2.88Å; D876-R879 PolarHBondContact OD1-NE 2.61Å; D876-R879 IonicContact OD1-NH2 3.16Å; D876-R879 PolarHBondContact OD1-NH2 2.73Å
877	F	87.5	Confident	90.3	Very high	88 Å²	88	45.1 Å²	45.1	39%	0.386	21%	0.214	S	C	.	.	H	α-helix	trans	-57.4	-38.1	174.7	-178.4	-90.9	0	0	0	112.3	M640 V753 L756 E873	M640-F877 HydrophobicContact CE-CE2 3.5Å; M640-F877 HydrophobicContact CE-CZ 3.45Å; M640-F877 VanDerWaalsContact CE-CZ 3.45Å; M640-F877 HydrophobicContact SD-CE2 4.43Å; M640-F877 HydrophobicContact SD-CZ 3.84Å; V753-F877 HydrophobicContact CG1-CD1 4.35Å; V753-F877 HydrophobicContact CG1-CE1 3.97Å; V753-F877 HydrophobicContact CG1-CZ 4.48Å; V753-F877 HydrophobicContact CG2-CE1 4.11Å; V753-F877 HydrophobicContact CG2-CE2 4.29Å; V753-F877 HydrophobicContact CG2-CZ 3.8Å; L756-F877 HydrophobicContact CD2-CE1 3.81Å; L756-F877 HydrophobicContact CD2-CZ 3.99Å; E873-F877 WeakPolarHBondContact O-CB 3.32Å; E873-F877 PolarHBondContact O-N 3.41Å
878	F	90	Very high	89.5	Confident	11 Å²	11	49.2 Å²	49.2	5%	0.048	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	12	177.1	-67.5	-60	0	0	0	114.8	V753 L756 F757 M760 I874 D876 S880 Q881 I882	V753-F878 HydrophobicContact CG1-CD1 3.71Å; V753-F878 HydrophobicContact CG1-CE1 3.9Å; L756-F878 HydrophobicContact CB-CE1 4.42Å; L756-F878 HydrophobicContact CD2-CZ 4.14Å; L756-F878 HydrophobicContact CG-CE1 4.48Å; L756-F878 HydrophobicContact CG-CZ 4.21Å; F757-F878 HydrophobicContact CB-CD1 3.83Å; F757-F878 HydrophobicContact CB-CE1 3.78Å; F757-F878 HydrophobicContact CD2-CB 3.93Å; F757-F878 AromaticContact CD2-CD1 3.54Å; F757-F878 HydrophobicContact CD2-CD1 3.54Å; F757-F878 HydrophobicContact CD2-CE1 4.15Å; F757-F878 AromaticContact CD2-CG 3.75Å; F757-F878 HydrophobicContact CD2-CG 3.75Å; F757-F878 HydrophobicContact CE2-CB 4.17Å; F757-F878 HydrophobicContact CE2-CG 4.41Å; F757-F878 HydrophobicContact CG-CD1 4.16Å; F757-F878 HydrophobicContact CG-CE1 4.5Å; M760-F878 HydrophobicContact CE-CE2 3.88Å; M760-F878 HydrophobicContact CE-CZ 4.26Å; M760-F878 HydrophobicContact SD-CE1 4.49Å; M760-F878 HydrophobicContact SD-CE2 3.59Å; M760-F878 VanDerWaalsContact SD-CE2 3.59Å; M760-F878 HydrophobicContact SD-CZ 3.33Å; M760-F878 WeakPolarHBondContact SD-CZ 3.45Å; I874-F878 HydrophobicContact CG2-CD2 4.3Å; I874-F878 WeakPolarHBondContact O-CD2 3.39Å; I874-F878 PolarHBondContact O-N 2.75Å; D876-F878 PolarHBondContact O-N 3.12Å; F878-S880 VanDerWaalsContact C-N 3.33Å; F878-S880 PolarHBondContact O-N 3.2Å; F878-Q881 PolarHBondContact O-N 3.19Å; F878-Q881 PolarHBondContact O-OE1 2.64Å; F878-I882 HydrophobicContact CB-CD1 3.88Å; F878-I882 HydrophobicContact CB-CG1 4.09Å; F878-I882 WeakPolarHBondContact O-CG1 3.43Å; F878-I882 PolarHBondContact O-N 3.16Å
879	R	91.5	Very high	88.2	Confident	63 Å²	63	52.3 Å²	52.3	24%	0.238	27%	0.267	C	S	.	.	H	α-helix	trans	-47.5	-51.6	-173.1	170.6	176.9	-70.6	-80.2	0.9	113.2	F854 D855 L875 D876 Q881 I882 E883	F854-R879 HydrophobicContact CE1-CG 4.27Å; D855-R879 IonicContact OD1-NH1 3.15Å; D855-R879 PolarHBondContact OD1-NH1 2.9Å; L875-R879 WeakPolarHBondContact O-CA 3.3Å; L875-R879 PolarHBondContact O-N 3.21Å; D876-R879 VanDerWaalsContact O-CB 3.22Å; D876-R879 WeakPolarHBondContact O-CB 3.36Å; D876-R879 PolarHBondContact O-N 3.47Å; D876-R879 VanDerWaalsContact O-N 3.1Å; D876-R879 IonicContact OD1-CZ 3.87Å; D876-R879 IonicContact OD1-NE 2.88Å; D876-R879 PolarHBondContact OD1-NE 2.61Å; D876-R879 IonicContact OD1-NH2 3.16Å; D876-R879 PolarHBondContact OD1-NH2 2.73Å; R879-Q881 VanDerWaalsContact C-N 3.26Å; R879-Q881 PolarHBondContact O-N 3.39Å; R879-I882 PolarHBondContact O-N 3.01Å; R879-E883 HydrophobicContact CG-CG 4.36Å; R879-E883 WeakPolarHBondContact CG-OE1 3.45Å; R879-E883 IonicContact NH1-OE1 2.76Å; R879-E883 PolarHBondContact NH1-OE1 3.12Å; R879-E883 WeakPolarHBondContact O-CB 3.29Å; R879-E883 WeakPolarHBondContact O-CG 3.4Å; R879-E883 PolarHBondContact O-N 3.43Å
880	S	90.3	Very high	87.1	Confident	41 Å²	41	51.7 Å²	51.7	29%	0.287	27%	0.265	S	S	.	.	H	α-helix	trans	-65.8	-30.3	-174.5	73.5	0	0	0	0	113.3	Q750 F878 R884	Q750-S880 PolarHBondContact NE2-OG 3.4Å; F878-S880 VanDerWaalsContact C-N 3.33Å; F878-S880 PolarHBondContact O-N 3.2Å; S880-R884 WeakPolarHBondContact O-CB 3.48Å; S880-R884 PolarHBondContact O-N 3.29Å
881	Q	90.2	Very high	86.7	Confident	6 Å²	6	51.7 Å²	51.7	3%	0.028	27%	0.269	C	S	.	.	H	α-helix	trans	-80.9	-40.1	179.9	-67.3	73.2	2.2	0	0	110	Q750 E754 F757 F878 R879 R884 M885	Q750-Q881 VanDerWaalsContact NE2-NE2 3.18Å; E754-Q881 HydrophobicContact CG-CG 4.21Å; F757-Q881 HydrophobicContact CB-CB 4.37Å; F757-Q881 HydrophobicContact CB-CG 4.12Å; F757-Q881 HydrophobicContact CD1-CB 3.94Å; F757-Q881 HydrophobicContact CD1-CG 4.34Å; F757-Q881 HydrophobicContact CD2-CB 3.67Å; F757-Q881 HydrophobicContact CD2-CG 4.31Å; F757-Q881 HydrophobicContact CE1-CB 4.02Å; F757-Q881 HydrophobicContact CE2-CB 3.71Å; F757-Q881 HydrophobicContact CG-CB 3.75Å; F757-Q881 HydrophobicContact CG-CG 4.03Å; F757-Q881 HydrophobicContact CZ-CB 3.89Å; F878-Q881 PolarHBondContact O-N 3.19Å; F878-Q881 PolarHBondContact O-OE1 2.64Å; R879-Q881 VanDerWaalsContact C-N 3.26Å; R879-Q881 PolarHBondContact O-N 3.39Å; Q881-R884 PolarHBondContact O-N 3.31Å; Q881-M885 VanDerWaalsContact O-CB 3.31Å; Q881-M885 WeakPolarHBondContact O-CB 3.27Å; Q881-M885 PolarHBondContact O-N 3.38Å
882	I	90.7	Very high	86.3	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-48.2	172.9	-66	168.8	0	0	0	110	F757 L778 F854 L875 F878 R879 R884 M885 L886	F757-I882 HydrophobicContact CE2-CG1 4.04Å; L778-I882 HydrophobicContact CD1-CG1 4.16Å; F854-I882 HydrophobicContact CD1-CG2 4.38Å; F854-I882 HydrophobicContact CD2-CG2 3.89Å; F854-I882 HydrophobicContact CE1-CG2 4.25Å; F854-I882 HydrophobicContact CE2-CD1 4.09Å; F854-I882 HydrophobicContact CE2-CG2 3.77Å; F854-I882 HydrophobicContact CG-CG2 4.2Å; F854-I882 HydrophobicContact CZ-CB 4.32Å; F854-I882 HydrophobicContact CZ-CD1 4.14Å; F854-I882 HydrophobicContact CZ-CG2 3.95Å; L875-I882 HydrophobicContact CD2-CD1 3.86Å; F878-I882 HydrophobicContact CB-CD1 3.88Å; F878-I882 HydrophobicContact CB-CG1 4.09Å; F878-I882 WeakPolarHBondContact O-CG1 3.43Å; F878-I882 PolarHBondContact O-N 3.16Å; R879-I882 PolarHBondContact O-N 3.01Å; I882-R884 VanDerWaalsContact C-N 3.3Å; I882-R884 PolarHBondContact O-N 3.02Å; I882-M885 WeakPolarHBondContact O-CB 3.4Å; I882-M885 PolarHBondContact O-N 3.32Å; I882-M885 VanDerWaalsContact O-N 3.12Å; I882-L886 HydrophobicContact CG2-CD1 3.64Å; I882-L886 HydrophobicContact CG2-CG 4.1Å; I882-L886 WeakPolarHBondContact O-CB 3.18Å; I882-L886 VanDerWaalsContact O-CG 3.22Å; I882-L886 WeakPolarHBondContact O-CG 3.38Å; I882-L886 PolarHBondContact O-N 3.05Å
883	E	92	Very high	86.2	Confident	55 Å²	55	50.8 Å²	50.8	26%	0.257	27%	0.265	S	S	.	.	H	α-helix	trans	-58.7	-41.8	177.4	-74.8	174.1	-171.9	0	0	111.7	V851 F854 R879 L886 Q887	V851-E883 HydrophobicContact CG1-CG 4.06Å; V851-E883 HydrophobicContact CG2-CB 4.3Å; V851-E883 HydrophobicContact CG2-CG 4.32Å; F854-E883 HydrophobicContact CD1-CG 4.38Å; F854-E883 HydrophobicContact CE1-CG 4.37Å; R879-E883 HydrophobicContact CG-CG 4.36Å; R879-E883 WeakPolarHBondContact CG-OE1 3.45Å; R879-E883 IonicContact NH1-OE1 2.76Å; R879-E883 PolarHBondContact NH1-OE1 3.12Å; R879-E883 WeakPolarHBondContact O-CB 3.29Å; R879-E883 WeakPolarHBondContact O-CG 3.4Å; R879-E883 PolarHBondContact O-N 3.43Å; E883-L886 PolarHBondContact O-N 3.27Å; E883-Q887 WeakPolarHBondContact O-CG 3.49Å; E883-Q887 PolarHBondContact O-N 3.01Å
884	R	89.6	Confident	86.1	Confident	113 Å²	113	49.5 Å²	49.5	43%	0.426	26%	0.263	S	S	.	.	H	α-helix	trans	-65.5	-40.9	174.9	-168.8	-171.4	-53.2	149	-1.1	112.4	E754 S880 Q881 I882 Q887	E754-R884 IonicContact OE1-CZ 3.01Å; E754-R884 IonicContact OE1-NH1 3.56Å; E754-R884 PolarHBondContact OE1-NH1 3.41Å; E754-R884 IonicContact OE1-NH2 3.48Å; E754-R884 PolarHBondContact OE1-NH2 2.96Å; S880-R884 WeakPolarHBondContact O-CB 3.48Å; S880-R884 PolarHBondContact O-N 3.29Å; Q881-R884 PolarHBondContact O-N 3.31Å; I882-R884 VanDerWaalsContact C-N 3.3Å; I882-R884 PolarHBondContact O-N 3.02Å; R884-Q887 WeakPolarHBondContact O-CB 3.39Å; R884-Q887 PolarHBondContact O-N 2.97Å
885	M	89.1	Confident	86	Confident	23 Å²	23	52.2 Å²	52.2	11%	0.113	28%	0.278	C	S	.	.	H	α-helix	trans	-62	-45.4	175.7	-180	-170.9	74.4	0	0	111	F757 L778 R780 Q881 I882 Q887 V888	F757-M885 HydrophobicContact CZ-SD 4.29Å; L778-M885 HydrophobicContact CD1-CE 3.79Å; L778-M885 HydrophobicContact CD1-SD 3.8Å; R780-M885 HydrophobicContact CG-SD 4.43Å; Q881-M885 VanDerWaalsContact O-CB 3.31Å; Q881-M885 WeakPolarHBondContact O-CB 3.27Å; Q881-M885 PolarHBondContact O-N 3.38Å; I882-M885 WeakPolarHBondContact O-CB 3.4Å; I882-M885 PolarHBondContact O-N 3.32Å; I882-M885 VanDerWaalsContact O-N 3.12Å; M885-Q887 PolarHBondContact O-N 2.91Å; M885-V888 PolarHBondContact O-N 2.95Å
886	L	90.2	Very high	85.6	Confident	6 Å²	6	54.7 Å²	54.7	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-72.6	-9.1	-178.8	-63.8	175	0	0	0	113.8	I848 V851 F854 I882 E883 V888	I848-L886 HydrophobicContact CG2-CD1 4.39Å; I848-L886 WeakPolarHBondContact O-CD2 3.23Å; V851-L886 HydrophobicContact CG2-CB 4.31Å; F854-L886 HydrophobicContact CB-CD1 3.68Å; F854-L886 HydrophobicContact CG-CD1 4.06Å; I882-L886 HydrophobicContact CG2-CD1 3.64Å; I882-L886 HydrophobicContact CG2-CG 4.1Å; I882-L886 WeakPolarHBondContact O-CB 3.18Å; I882-L886 VanDerWaalsContact O-CG 3.22Å; I882-L886 WeakPolarHBondContact O-CG 3.38Å; I882-L886 PolarHBondContact O-N 3.05Å; E883-L886 PolarHBondContact O-N 3.27Å; L886-V888 VanDerWaalsContact C-N 3.27Å
887	Q	84.2	Confident	85.2	Confident	144 Å²	144	51.8 Å²	51.8	67%	0.673	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-23.8	172	-76.1	166.3	18.2	0	0	112.4	E883 R884 M885	E883-Q887 WeakPolarHBondContact O-CG 3.49Å; E883-Q887 PolarHBondContact O-N 3.01Å; R884-Q887 WeakPolarHBondContact O-CB 3.39Å; R884-Q887 PolarHBondContact O-N 2.97Å; M885-Q887 PolarHBondContact O-N 2.91Å
888	V	74.4	Confident	84.8	Confident	111 Å²	111	54.4 Å²	54.4	67%	0.673	30%	0.303	S	S	*	.	S	Bend	trans	-101.6	83.1	178.8	-173.1	0	0	0	0	108.6	M885 L886 N890	M885-V888 PolarHBondContact O-N 2.95Å; L886-V888 VanDerWaalsContact C-N 3.27Å; V888-N890 PolarHBondContact O-N 3.39Å
889	A	64.9	Low	84.4	Confident	65 Å²	65	56.1 Å²	56.1	54%	0.537	31%	0.312	S	S	.	.			trans	-67.7	121.2	-179.7	0	0	0	0	0	111	P891	A889-P891 WeakPolarHBondContact O-CD 3.44Å
890	N	69.7	Low	83.5	Confident	39 Å²	39	56.4 Å²	56.4	21%	0.209	32%	0.318	C	S	.	.			trans	-92.1	111.3	169.1	-166.7	-26.3	0	0	0	109.9	V782 V888 V892	V782-N890 WeakPolarHBondContact O-CB 3.38Å; V888-N890 PolarHBondContact O-N 3.39Å; N890-V892 PolarHBondContact O-N 3.46Å; N890-V892 VanDerWaalsContact OD1-CB 3.25Å; N890-V892 WeakPolarHBondContact OD1-CB 3.29Å; N890-V892 WeakPolarHBondContact OD1-CG2 3.45Å; N890-V892 PolarHBondContact OD1-N 2.66Å; N890-V892 VanDerWaalsContact OD1-N 3.13Å
891	P	80.7	Confident	82.7	Confident	77 Å²	77	58.3 Å²	58.3	50%	0.5	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-70.7	-11.7	-176.1	29.7	-35.5	0	0	0	113.6	A889 L893 S894 N895	A889-P891 WeakPolarHBondContact O-CD 3.44Å; P891-L893 VanDerWaalsContact C-N 3.27Å; P891-L893 PolarHBondContact O-N 3.08Å; P891-S894 PolarHBondContact O-N 3.06Å; P891-S894 VanDerWaalsContact O-N 3.11Å; P891-S894 PolarHBondContact O-OG 2.7Å; P891-N895 PolarHBondContact O-N 3.19Å
892	V	85.1	Confident	81.8	Confident	13 Å²	13	64 Å²	64	8%	0.079	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-64.8	-27.4	-173.6	178.1	0	0	0	0	112.8	L444 T445 Y448 N890 N895 P897	L444-V892 HydrophobicContact CB-CG1 4.2Å; L444-V892 HydrophobicContact CD2-CB 4.47Å; L444-V892 HydrophobicContact CD2-CG1 3.77Å; L444-V892 HydrophobicContact CG-CG1 3.83Å; T445-V892 WeakPolarHBondContact OG1-CG2 3.24Å; Y448-V892 HydrophobicContact CD2-CG1 4.13Å; Y448-V892 HydrophobicContact CE2-CG1 3.9Å; N890-V892 PolarHBondContact O-N 3.46Å; N890-V892 VanDerWaalsContact OD1-CB 3.25Å; N890-V892 WeakPolarHBondContact OD1-CB 3.29Å; N890-V892 WeakPolarHBondContact OD1-CG2 3.45Å; N890-V892 PolarHBondContact OD1-N 2.66Å; N890-V892 VanDerWaalsContact OD1-N 3.13Å; V892-N895 CarbonylContact C-O 3.4Å; V892-N895 WeakPolarHBondContact CA-O 3.1Å; V892-N895 VanDerWaalsContact O-O 3.1Å; V892-P897 HydrophobicContact CG1-CG 3.97Å
893	L	89.9	Confident	81.1	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-70.9	-31.2	175.6	-66.3	177.2	0	0	0	112.7	V404 S405 F415 L444 V782 A784 L786 F847 P891	V404-L893 HydrophobicContact CG1-CD2 4.32Å; S405-L893 PolarHBondContact N-O 2.55Å; F415-L893 HydrophobicContact CE2-CD2 4.38Å; F415-L893 HydrophobicContact CZ-CD2 3.87Å; L444-L893 HydrophobicContact CD2-CD2 3.9Å; V782-L893 HydrophobicContact CB-CD1 4.27Å; V782-L893 HydrophobicContact CG2-CD1 4.14Å; A784-L893 HydrophobicContact CB-CD1 3.56Å; L786-L893 HydrophobicContact CD2-CD1 3.86Å; L786-L893 HydrophobicContact CD2-CD2 4.32Å; F847-L893 HydrophobicContact CB-CD1 4.29Å; F847-L893 HydrophobicContact CD1-CB 4.1Å; F847-L893 HydrophobicContact CD2-CB 4.31Å; F847-L893 HydrophobicContact CD2-CD1 4.02Å; F847-L893 HydrophobicContact CE1-CB 3.82Å; F847-L893 HydrophobicContact CE2-CB 4.06Å; F847-L893 HydrophobicContact CE2-CD1 4.48Å; F847-L893 HydrophobicContact CG-CB 4.32Å; F847-L893 HydrophobicContact CG-CD1 4.04Å; F847-L893 HydrophobicContact CZ-CB 3.79Å; P891-L893 VanDerWaalsContact C-N 3.27Å; P891-L893 PolarHBondContact O-N 3.08Å
894	S	87.9	Confident	80.4	Confident	42 Å²	42	67.6 Å²	67.6	29%	0.294	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-33.6	177.8	42.4	0	0	0	0	113.2	S405 P891	S405-S894 WeakPolarHBondContact CB-O 3.48Å; S405-S894 PolarHBondContact OG-O 2.83Å; P891-S894 PolarHBondContact O-N 3.06Å; P891-S894 VanDerWaalsContact O-N 3.11Å; P891-S894 PolarHBondContact O-OG 2.7Å
895	N	86.2	Confident	79.9	Confident	106 Å²	106	66 Å²	66	57%	0.567	38%	0.379	S	S	*	.	S	Bend	trans	-124.9	115.4	-174.4	-62.4	-39.6	0	0	0	108.9	P891 V892 P897	P891-N895 PolarHBondContact O-N 3.19Å; V892-N895 CarbonylContact C-O 3.4Å; V892-N895 WeakPolarHBondContact CA-O 3.1Å; V892-N895 VanDerWaalsContact O-O 3.1Å; N895-P897 WeakPolarHBondContact O-CD 3.36Å
896	V	82.9	Confident	79.5	Confident	55 Å²	55	66.7 Å²	66.7	33%	0.333	39%	0.386	S	S	.	.			trans	-59.3	127.4	170.3	-173.3	0	0	0	0	107.8	L406 P407 T898	L406-V896 WeakPolarHBondContact O-CG2 3.27Å; P407-V896 HydrophobicContact CB-CG1 3.68Å; P407-V896 HydrophobicContact CG-CG1 4.47Å; V896-T898 PolarHBondContact O-N 3.16Å
897	P	81.3	Confident	78.8	Confident	26 Å²	26	71.4 Å²	71.4	17%	0.169	42%	0.42	C	S	.	.			trans	-53.1	141.5	173.2	-24.8	34.1	0	0	0	110.5	T445 Y448 V892 N895 L899	T445-P897 HydrophobicContact CG2-CB 3.98Å; T445-P897 HydrophobicContact CG2-CG 3.89Å; Y448-P897 HydrophobicContact CD2-CG 4.23Å; V892-P897 HydrophobicContact CG1-CG 3.97Å; N895-P897 WeakPolarHBondContact O-CD 3.36Å; P897-L899 PolarHBondContact O-N 2.94Å
898	T	79.2	Confident	78.7	Confident	142 Å²	142	71.5 Å²	71.5	87%	0.871	42%	0.42	S	S	*	.			trans	-67.6	99.7	171.4	45.8	0	0	0	0	108.6	V896 D900	V896-T898 PolarHBondContact O-N 3.16Å; T898-D900 PolarHBondContact O-N 3.39Å
899	L	81.3	Confident	79.4	Confident	47 Å²	47	67.2 Å²	67.2	25%	0.246	39%	0.394	C	S	.	.			trans	-81.8	86.3	174	-63.1	176	0	0	0	107.8	P407 M449 F452 P897 S901 L904	P407-L899 HydrophobicContact CB-CD1 4.08Å; M449-L899 HydrophobicContact CG-CD2 3.91Å; F452-L899 HydrophobicContact CB-CD1 4.38Å; F452-L899 HydrophobicContact CD2-CD1 3.37Å; F452-L899 HydrophobicContact CE2-CD1 3.74Å; F452-L899 HydrophobicContact CG-CD1 3.86Å; F452-L899 HydrophobicContact CZ-CD1 4.45Å; P897-L899 PolarHBondContact O-N 2.94Å; L899-S901 PolarHBondContact O-N 3.37Å; L899-L904 HydrophobicContact CB-CD1 3.66Å; L899-L904 HydrophobicContact CD2-CD1 4.1Å; L899-L904 HydrophobicContact CG-CD1 4.39Å
900	D	74.7	Confident	80.6	Confident	69 Å²	69	66.1 Å²	66.1	37%	0.369	38%	0.38	S	S	.	.			trans	-67	118.5	176.5	-171.9	-12.3	0	0	0	109.2	T898 N902 E903 L904	T898-D900 PolarHBondContact O-N 3.39Å; D900-N902 PolarHBondContact O-N 3.25Å; D900-N902 VanDerWaalsContact O-N 3.17Å; D900-N902 WeakPolarHBondContact OD1-CB 3.47Å; D900-N902 PolarHBondContact OD1-N 3.01Å; D900-N902 PolarHBondContact OD1-ND2 3.48Å; D900-N902 VanDerWaalsContact OD1-ND2 3.09Å; D900-E903 HydrophobicContact CB-CB 4.27Å; D900-E903 HydrophobicContact CB-CG 4.1Å; D900-E903 PolarHBondContact O-N 3.48Å; D900-L904 WeakPolarHBondContact O-CG 3.27Å; D900-L904 PolarHBondContact O-N 2.91Å; D900-L904 VanDerWaalsContact O-N 3.15Å
901	S	73.1	Confident	81.7	Confident	82 Å²	82	64.9 Å²	64.9	57%	0.573	37%	0.374	S	S	*	.	H	α-helix	trans	-56.4	-30.6	177.3	52	0	0	0	0	112.3	L899 D905	L899-S901 PolarHBondContact O-N 3.37Å; S901-D905 VanDerWaalsContact O-CB 3.3Å; S901-D905 WeakPolarHBondContact O-CB 3.3Å; S901-D905 PolarHBondContact O-N 2.85Å
902	N	70.5	Confident	82.2	Confident	125 Å²	125	65.2 Å²	65.2	67%	0.668	37%	0.369	S	S	*	.	H	α-helix	trans	-75.7	-22.7	179	-55.1	-54.2	0	0	0	113.2	D900 D905	D900-N902 PolarHBondContact O-N 3.25Å; D900-N902 VanDerWaalsContact O-N 3.17Å; D900-N902 WeakPolarHBondContact OD1-CB 3.47Å; D900-N902 PolarHBondContact OD1-N 3.01Å; D900-N902 PolarHBondContact OD1-ND2 3.48Å; D900-N902 VanDerWaalsContact OD1-ND2 3.09Å; N902-D905 CarbonylContact C-O 3.48Å; N902-D905 VanDerWaalsContact O-O 3.06Å
903	E	75.9	Confident	82.5	Confident	122 Å²	122	69 Å²	69	57%	0.57	39%	0.385	S	S	*	.	H	α-helix	trans	-85.3	-28.8	174.6	-69.9	-171.8	168.2	0	0	111.6	R455 D900	R455-E903 PolarHBondContact NE-O 3.24Å; R455-E903 PolarHBondContact NH1-O 3.11Å; D900-E903 HydrophobicContact CB-CB 4.27Å; D900-E903 HydrophobicContact CB-CG 4.1Å; D900-E903 PolarHBondContact O-N 3.48Å
904	L	77.7	Confident	82.7	Confident	12 Å²	12	71.6 Å²	71.6	6%	0.063	40%	0.398	C	S	.	.	H	α-helix	trans	-93.1	-8.5	-177.4	-64.8	169.9	0	0	0	113.5	M449 F452 D453 K454 L899 D900	M449-L904 HydrophobicContact CB-CD2 4.33Å; M449-L904 HydrophobicContact CE-CD2 4.19Å; M449-L904 HydrophobicContact CG-CD2 4.5Å; F452-L904 HydrophobicContact CB-CD1 4.11Å; D453-L904 HydrophobicContact CB-CD2 3.78Å; K454-L904 PolarHBondContact N-O 3.26Å; L899-L904 HydrophobicContact CB-CD1 3.66Å; L899-L904 HydrophobicContact CD2-CD1 4.1Å; L899-L904 HydrophobicContact CG-CD1 4.39Å; D900-L904 WeakPolarHBondContact O-CG 3.27Å; D900-L904 PolarHBondContact O-N 2.91Å; D900-L904 VanDerWaalsContact O-N 3.15Å
905	D	79.8	Confident	82.9	Confident	79 Å²	79	69.6 Å²	69.6	42%	0.422	38%	0.384	S	S	.	.			trans	-139.9	120	176.6	-167.4	-4.6	0	0	0	108.5	S901 N902	S901-D905 VanDerWaalsContact O-CB 3.3Å; S901-D905 WeakPolarHBondContact O-CB 3.3Å; S901-D905 PolarHBondContact O-N 2.85Å; N902-D905 CarbonylContact C-O 3.48Å; N902-D905 VanDerWaalsContact O-O 3.06Å
906	S	80.6	Confident	83.2	Confident	38 Å²	38	69 Å²	69	27%	0.266	38%	0.376	S	S	.	.			trans	-125.6	126.2	-179.7	168.4	0	0	0	0	108.8	E908 D909 T910	S906-E908 PolarHBondContact O-N 3.12Å; S906-E908 PolarHBondContact OG-N 3.17Å; S906-D909 CarbonylContact O-C 3.52Å; S906-D909 PolarHBondContact O-N 2.98Å; S906-D909 PolarHBondContact OG-N 2.96Å; S906-T910 VanDerWaalsContact O-CG2 3.26Å; S906-T910 WeakPolarHBondContact O-CG2 3.25Å
907	S	75.5	Confident	83.7	Confident	105 Å²	105	69 Å²	69	73%	0.734	38%	0.378	S	S	*	.	S	Bend	trans	-62.3	-24.6	177.3	57.9	0	0	0	0	113.4
908	E	81.8	Confident	84.2	Confident	147 Å²	147	70.5 Å²	70.5	69%	0.687	38%	0.381	S	S	*	.	S	Bend	trans	-87.8	-28	179.3	-63.5	-173.5	169.6	0	0	112.4	S906 T910 H913	S906-E908 PolarHBondContact O-N 3.12Å; S906-E908 PolarHBondContact OG-N 3.17Å; E908-T910 PolarHBondContact O-N 3.31Å; E908-H913 PolarHBondContact O-CD2 3.35Å
909	D	88.3	Confident	84.8	Confident	21 Å²	21	65.2 Å²	65.2	11%	0.112	35%	0.346	C	S	.	.	S	Bend	trans	-102.1	68.8	178.7	-172	16.5	0	0	0	110.7	R455 P456 T457 Y539 S906	R455-D909 WeakPolarHBondContact CB-OD2 3.49Å; R455-D909 HydrophobicContact CG-CB 4.49Å; P456-D909 WeakPolarHBondContact CD-O 3.25Å; T457-D909 WeakPolarHBondContact CB-OD2 3.29Å; T457-D909 PolarHBondContact N-OD2 2.6Å; T457-D909 PolarHBondContact OG1-OD2 3.36Å; Y539-D909 PolarHBondContact OH-OD1 2.91Å; S906-D909 CarbonylContact O-C 3.52Å; S906-D909 PolarHBondContact O-N 2.98Å; S906-D909 PolarHBondContact OG-N 2.96Å
910	T	91.1	Very high	85.3	Confident	41 Å²	41	67.6 Å²	67.6	25%	0.252	36%	0.356	S	S	.	.	S	Bend	trans	-124.4	153.6	176.1	64.7	0	0	0	0	110.8	S906 E908 E912 H913 Q914	S906-T910 VanDerWaalsContact O-CG2 3.26Å; S906-T910 WeakPolarHBondContact O-CG2 3.25Å; E908-T910 PolarHBondContact O-N 3.31Å; T910-E912 PolarHBondContact O-N 3.11Å; T910-H913 PolarHBondContact O-N 2.85Å; T910-H913 WeakPolarHBondContact OG1-CB 3.33Å; T910-H913 PolarHBondContact OG1-N 3.01Å; T910-H913 VanDerWaalsContact OG1-N 3.1Å; T910-Q914 PolarHBondContact O-N 3.24Å
911	V	91.8	Very high	86	Confident	13 Å²	13	68 Å²	68	8%	0.079	36%	0.355	C	S	.	.	H	α-helix	trans	-59.4	-34.7	174.5	-170.2	0	0	0	0	111.2	P456 Y539 Y598 L915 L1027	P456-V911 HydrophobicContact CG-CG2 3.62Å; Y539-V911 WeakPolarHBondContact O-CG1 3.48Å; Y598-V911 HydrophobicContact CD2-CG2 4.28Å; Y598-V911 HydrophobicContact CE2-CG2 4.21Å; V911-L915 WeakPolarHBondContact O-CB 3.29Å; V911-L915 PolarHBondContact O-N 3Å; V911-L1027 HydrophobicContact CG1-CD1 3.52Å
912	E	91.8	Very high	86.8	Confident	85 Å²	85	64 Å²	64	40%	0.397	33%	0.328	S	S	.	.	H	α-helix	trans	-64	-49.3	175.7	-173.8	179	153.1	0	0	112	T910 Q914 L915 K916 Y1023	T910-E912 PolarHBondContact O-N 3.11Å; E912-Q914 VanDerWaalsContact C-N 3.32Å; E912-Q914 PolarHBondContact O-N 3.48Å; E912-L915 PolarHBondContact O-N 3.26Å; E912-K916 WeakPolarHBondContact O-CB 3.46Å; E912-K916 PolarHBondContact O-N 3.05Å; E912-Y1023 HydrophobicContact CB-CD2 3.9Å; E912-Y1023 HydrophobicContact CB-CE2 3.59Å; E912-Y1023 HydrophobicContact CB-CG 4.5Å; E912-Y1023 VanDerWaalsContact CD-OH 3.29Å; E912-Y1023 HydrophobicContact CG-CE1 4.2Å; E912-Y1023 HydrophobicContact CG-CE2 3.9Å; E912-Y1023 PolarHBondContact OE2-OH 3.38Å
913	H	91.4	Very high	87.7	Confident	91 Å²	91	59.1 Å²	59.1	42%	0.421	30%	0.303	S	S	.	.	H	α-helix	trans	-60.3	-44.6	179.6	-173.8	82.2	0	0	0	111.1	E908 T910 K916 S917	E908-H913 PolarHBondContact O-CD2 3.35Å; T910-H913 PolarHBondContact O-N 2.85Å; T910-H913 WeakPolarHBondContact OG1-CB 3.33Å; T910-H913 PolarHBondContact OG1-N 3.01Å; T910-H913 VanDerWaalsContact OG1-N 3.1Å; H913-K916 PolarHBondContact O-N 3.42Å; H913-S917 WeakPolarHBondContact O-CB 3.38Å; H913-S917 PolarHBondContact O-N 3.47Å
914	Q	93.5	Very high	88.1	Confident	55 Å²	55	57.3 Å²	57.3	26%	0.257	30%	0.297	S	S	.	.	H	α-helix	trans	-63.8	-43.4	177.2	-174.5	65.8	1.2	0	0	112.1	Y539 T910 E912 S917 R918	Y539-Q914 HydrophobicContact CD1-CB 3.46Å; Y539-Q914 VanDerWaalsContact CD1-CB 3.46Å; Y539-Q914 HydrophobicContact CD1-CG 3.61Å; Y539-Q914 HydrophobicContact CD2-CG 4.05Å; Y539-Q914 HydrophobicContact CE1-CB 3.56Å; Y539-Q914 HydrophobicContact CE1-CG 3.81Å; Y539-Q914 HydrophobicContact CE2-CG 4.24Å; Y539-Q914 HydrophobicContact CG-CB 4.09Å; Y539-Q914 HydrophobicContact CG-CG 3.72Å; T910-Q914 PolarHBondContact O-N 3.24Å; E912-Q914 VanDerWaalsContact C-N 3.32Å; E912-Q914 PolarHBondContact O-N 3.48Å; Q914-S917 PolarHBondContact O-N 3.4Å; Q914-R918 HydrophobicContact CG-CG 4.23Å; Q914-R918 VanDerWaalsContact O-CB 3.31Å; Q914-R918 WeakPolarHBondContact O-CB 3.21Å; Q914-R918 WeakPolarHBondContact O-CG 3.36Å; Q914-R918 PolarHBondContact O-N 3.45Å
915	L	93.4	Very high	88.6	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-59.8	-47.3	175.3	174.8	59.7	0	0	0	111.4	V911 E912 R918 F919 Y968 Y1023 V1026 L1027 L1030	V911-L915 WeakPolarHBondContact O-CB 3.29Å; V911-L915 PolarHBondContact O-N 3Å; E912-L915 PolarHBondContact O-N 3.26Å; L915-R918 PolarHBondContact O-N 3.17Å; L915-F919 WeakPolarHBondContact O-CB 3.47Å; L915-F919 PolarHBondContact O-N 3.08Å; L915-Y968 HydrophobicContact CD2-CD1 4.15Å; L915-Y968 HydrophobicContact CD2-CD2 3.84Å; L915-Y968 HydrophobicContact CD2-CE2 4.45Å; L915-Y968 HydrophobicContact CD2-CG 3.67Å; L915-Y968 HydrophobicContact CG-CD1 4.2Å; L915-Y968 HydrophobicContact CG-CG 4.23Å; L915-Y1023 HydrophobicContact CD2-CD1 3.58Å; L915-Y1023 HydrophobicContact CD2-CE1 4.49Å; L915-Y1023 HydrophobicContact CD2-CG 4.2Å; L915-V1026 HydrophobicContact CD1-CB 4.33Å; L915-V1026 HydrophobicContact CD1-CG1 3.89Å; L915-V1026 HydrophobicContact CD2-CB 4.13Å; L915-V1026 HydrophobicContact CD2-CG1 4.18Å; L915-L1027 HydrophobicContact CB-CD1 4.25Å; L915-L1027 HydrophobicContact CB-CD2 4Å; L915-L1027 HydrophobicContact CB-CG 3.91Å; L915-L1027 HydrophobicContact CD1-CD2 3.85Å; L915-L1027 HydrophobicContact CD1-CG 3.9Å; L915-L1027 HydrophobicContact CG-CG 4.41Å; L915-L1030 HydrophobicContact CD1-CD2 4.2Å
916	K	91.6	Very high	88.8	Confident	95 Å²	95	56.5 Å²	56.5	41%	0.413	29%	0.287	S	S	.	.	H	α-helix	trans	-59.2	-50.1	178.2	-176.8	-177.5	174.2	-173.7	0	111.3	E912 H913 F919 E920	E912-K916 WeakPolarHBondContact O-CB 3.46Å; E912-K916 PolarHBondContact O-N 3.05Å; H913-K916 PolarHBondContact O-N 3.42Å; K916-F919 PolarHBondContact O-N 3.33Å; K916-E920 WeakPolarHBondContact CE-OE1 3.31Å; K916-E920 WeakPolarHBondContact O-CB 3.33Å; K916-E920 WeakPolarHBondContact O-CG 3.29Å; K916-E920 PolarHBondContact O-N 2.57Å
917	S	92.5	Very high	88.8	Confident	54 Å²	54	59.6 Å²	59.6	38%	0.378	30%	0.298	S	S	.	.	H	α-helix	trans	-58.1	-50.5	179	-179.7	0	0	0	0	111.6	H913 Q914 F919 E920 E921	H913-S917 WeakPolarHBondContact O-CB 3.38Å; H913-S917 PolarHBondContact O-N 3.47Å; Q914-S917 PolarHBondContact O-N 3.4Å; S917-F919 PolarHBondContact O-N 3.24Å; S917-E920 PolarHBondContact O-N 2.95Å; S917-E921 WeakPolarHBondContact O-CB 3.12Å; S917-E921 PolarHBondContact O-N 3.03Å
918	R	92.4	Very high	88.8	Confident	58 Å²	58	59.4 Å²	59.4	22%	0.219	29%	0.288	C	S	.	.	H	α-helix	trans	-67.8	-36	-179.2	-66.6	-75.7	-73.5	124.6	6.9	112.7	Q914 L915 E921 M922 L1030 E1034	Q914-R918 HydrophobicContact CG-CG 4.23Å; Q914-R918 VanDerWaalsContact O-CB 3.31Å; Q914-R918 WeakPolarHBondContact O-CB 3.21Å; Q914-R918 WeakPolarHBondContact O-CG 3.36Å; Q914-R918 PolarHBondContact O-N 3.45Å; L915-R918 PolarHBondContact O-N 3.17Å; R918-E921 IonicContact NH1-OE1 3.84Å; R918-E921 IonicContact NH1-OE2 3.5Å; R918-E921 PolarHBondContact NH1-OE2 3.32Å; R918-M922 WeakPolarHBondContact O-CB 3.36Å; R918-M922 PolarHBondContact O-N 2.8Å; R918-L1030 HydrophobicContact CB-CD2 3.73Å; R918-E1034 IonicContact CZ-OE2 2.64Å; R918-E1034 IonicContact NH1-OE1 3.92Å; R918-E1034 IonicContact NH1-OE2 3.4Å; R918-E1034 PolarHBondContact NH1-OE2 3.31Å; R918-E1034 IonicContact NH2-OE2 3.35Å; R918-E1034 PolarHBondContact NH2-OE2 3.18Å
919	F	92.4	Very high	88.5	Confident	30 Å²	30	52.6 Å²	52.6	13%	0.132	26%	0.257	C	S	.	.	H	α-helix	trans	-66	-47.1	174.9	-175.3	-86.1	0	0	0	111.5	L915 K916 S917 M922 S923 A971 L972 L975	L915-F919 WeakPolarHBondContact O-CB 3.47Å; L915-F919 PolarHBondContact O-N 3.08Å; K916-F919 PolarHBondContact O-N 3.33Å; S917-F919 PolarHBondContact O-N 3.24Å; F919-M922 PolarHBondContact O-N 2.93Å; F919-S923 VanDerWaalsContact O-CB 3.29Å; F919-S923 WeakPolarHBondContact O-CB 3.48Å; F919-S923 PolarHBondContact O-N 3.4Å; F919-A971 HydrophobicContact CE2-CB 4.15Å; F919-A971 HydrophobicContact CZ-CB 3.79Å; F919-L972 HydrophobicContact CD2-CD1 4.42Å; F919-L972 HydrophobicContact CE2-CB 4.09Å; F919-L972 HydrophobicContact CE2-CD1 4.2Å; F919-L975 HydrophobicContact CE2-CD2 3.98Å; F919-L975 HydrophobicContact CZ-CB 4.44Å; F919-L975 HydrophobicContact CZ-CD2 4.06Å
920	E	90.9	Very high	87.9	Confident	98 Å²	98	56.5 Å²	56.5	46%	0.458	27%	0.27	S	S	.	.	H	α-helix	trans	-62.3	-44.7	175.9	-74.6	176.8	-172	0	0	111.2	K916 S917 M922 S923 N924	K916-E920 WeakPolarHBondContact CE-OE1 3.31Å; K916-E920 WeakPolarHBondContact O-CB 3.33Å; K916-E920 WeakPolarHBondContact O-CG 3.29Å; K916-E920 PolarHBondContact O-N 2.57Å; S917-E920 PolarHBondContact O-N 2.95Å; E920-M922 PolarHBondContact O-N 3.3Å; E920-S923 PolarHBondContact O-N 3.14Å; E920-N924 VanDerWaalsContact O-CB 3.31Å; E920-N924 WeakPolarHBondContact O-CB 3.41Å; E920-N924 PolarHBondContact O-N 3.38Å; E920-N924 PolarHBondContact O-ND2 2.96Å; E920-N924 VanDerWaalsContact O-ND2 3.15Å
921	E	90.6	Very high	87.3	Confident	76 Å²	76	54.6 Å²	54.6	36%	0.355	26%	0.259	S	S	.	.	H	α-helix	trans	-57	-50.5	175.5	-168.5	-147.1	143.1	0	0	111.4	S917 R918 N924 R925	S917-E921 WeakPolarHBondContact O-CB 3.12Å; S917-E921 PolarHBondContact O-N 3.03Å; R918-E921 IonicContact NH1-OE1 3.84Å; R918-E921 IonicContact NH1-OE2 3.5Å; R918-E921 PolarHBondContact NH1-OE2 3.32Å; E921-N924 PolarHBondContact O-N 2.61Å; E921-R925 WeakPolarHBondContact O-CB 3.25Å; E921-R925 WeakPolarHBondContact O-CG 3.49Å; E921-R925 PolarHBondContact O-N 3.41Å; E921-R925 WeakPolarHBondContact OE1-CD 3.47Å; E921-R925 IonicContact OE1-CZ 2.9Å; E921-R925 IonicContact OE1-NH1 3.01Å; E921-R925 PolarHBondContact OE1-NH1 3.17Å
922	M	89.2	Confident	86.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-43	-179.7	-168.5	-180	75.5	0	0	111.8	R918 F919 E920 R925 L926 L972 L975 L1030 L1033 E1034 I1037 W1039	R918-M922 WeakPolarHBondContact O-CB 3.36Å; R918-M922 PolarHBondContact O-N 2.8Å; F919-M922 PolarHBondContact O-N 2.93Å; E920-M922 PolarHBondContact O-N 3.3Å; M922-R925 PolarHBondContact O-N 2.89Å; M922-L926 HydrophobicContact CE-CD1 4.48Å; M922-L926 HydrophobicContact CG-CD1 4.19Å; M922-L926 WeakPolarHBondContact O-CB 3.35Å; M922-L926 VanDerWaalsContact O-CG 3.31Å; M922-L926 WeakPolarHBondContact O-CG 3.44Å; M922-L926 PolarHBondContact O-N 3.28Å; M922-L972 HydrophobicContact CE-CD1 3.81Å; M922-L975 HydrophobicContact CE-CD2 3.39Å; M922-L975 HydrophobicContact CE-CG 4.3Å; M922-L1030 HydrophobicContact CE-CD1 3.16Å; M922-L1030 HydrophobicContact SD-CD1 3.47Å; M922-L1030 WeakPolarHBondContact SD-CD1 3.43Å; M922-L1030 HydrophobicContact SD-CG 4.48Å; M922-L1033 HydrophobicContact CE-CD2 3.93Å; M922-E1034 HydrophobicContact SD-CB 4.28Å; M922-I1037 HydrophobicContact SD-CD1 4.38Å; M922-W1039 HydrophobicContact CG-CH2 4.47Å; M922-W1039 HydrophobicContact CG-CZ2 4.48Å
923	S	88.6	Confident	85.7	Confident	21 Å²	21	57 Å²	57	15%	0.147	27%	0.265	C	S	.	.	H	α-helix	trans	-60	-47.5	176.7	180	0	0	0	0	111.5	F919 E920 L926 Q927	F919-S923 VanDerWaalsContact O-CB 3.29Å; F919-S923 WeakPolarHBondContact O-CB 3.48Å; F919-S923 PolarHBondContact O-N 3.4Å; E920-S923 PolarHBondContact O-N 3.14Å; S923-L926 PolarHBondContact O-N 2.74Å; S923-Q927 WeakPolarHBondContact O-CG 3.42Å; S923-Q927 PolarHBondContact O-N 2.99Å
924	N	85.9	Confident	84	Confident	85 Å²	85	58.9 Å²	58.9	46%	0.455	27%	0.273	S	S	.	.	H	α-helix	trans	-63.4	-44.9	177.5	-69	-24.1	0	0	0	111.1	E920 E921 L926 Q927 D928	E920-N924 VanDerWaalsContact O-CB 3.31Å; E920-N924 WeakPolarHBondContact O-CB 3.41Å; E920-N924 PolarHBondContact O-N 3.38Å; E920-N924 PolarHBondContact O-ND2 2.96Å; E920-N924 VanDerWaalsContact O-ND2 3.15Å; E921-N924 PolarHBondContact O-N 2.61Å; N924-L926 VanDerWaalsContact C-N 3.3Å; N924-L926 PolarHBondContact O-N 3.2Å; N924-Q927 PolarHBondContact O-N 3.13Å; N924-D928 VanDerWaalsContact O-CB 3.32Å; N924-D928 WeakPolarHBondContact O-CB 3.29Å; N924-D928 PolarHBondContact O-N 3.46Å
925	R	86.8	Confident	81.8	Confident	73 Å²	73	62.4 Å²	62.4	28%	0.275	30%	0.298	S	S	.	.	H	α-helix	trans	-58.8	-39.9	176.7	-77.8	170.4	57	-166.4	-11.1	112.5	E921 M922 S929 E1034 W1039	E921-R925 WeakPolarHBondContact O-CB 3.25Å; E921-R925 WeakPolarHBondContact O-CG 3.49Å; E921-R925 PolarHBondContact O-N 3.41Å; E921-R925 WeakPolarHBondContact OE1-CD 3.47Å; E921-R925 IonicContact OE1-CZ 2.9Å; E921-R925 IonicContact OE1-NH1 3.01Å; E921-R925 PolarHBondContact OE1-NH1 3.17Å; M922-R925 PolarHBondContact O-N 2.89Å; R925-S929 WeakPolarHBondContact O-CB 3.29Å; R925-S929 PolarHBondContact O-N 3.39Å; R925-S929 VanDerWaalsContact O-N 3.08Å; R925-S929 PolarHBondContact O-OG 3.29Å; R925-E1034 IonicContact CZ-OE1 3.09Å; R925-E1034 IonicContact NH1-OE1 3.96Å; R925-E1034 PolarHBondContact NH1-OE1 3.36Å; R925-E1034 IonicContact NH2-OE1 2.76Å; R925-E1034 PolarHBondContact NH2-OE1 3.24Å; R925-E1034 VanDerWaalsContact NH2-OE1 3.09Å; R925-W1039 HydrophobicContact CB-CH2 4.15Å; R925-W1039 HydrophobicContact CB-CZ3 4.16Å
926	L	85.1	Confident	79.2	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-68.4	-44.4	177	-77.9	171.2	0	0	0	112.2	M922 S923 N924 S929 R930 M931 T932 L975 I979 I1037 W1039	M922-L926 HydrophobicContact CE-CD1 4.48Å; M922-L926 HydrophobicContact CG-CD1 4.19Å; M922-L926 WeakPolarHBondContact O-CB 3.35Å; M922-L926 VanDerWaalsContact O-CG 3.31Å; M922-L926 WeakPolarHBondContact O-CG 3.44Å; M922-L926 PolarHBondContact O-N 3.28Å; S923-L926 PolarHBondContact O-N 2.74Å; N924-L926 VanDerWaalsContact C-N 3.3Å; N924-L926 PolarHBondContact O-N 3.2Å; L926-S929 CarbonylContact O-C 3.55Å; L926-S929 PolarHBondContact O-N 3.24Å; L926-R930 PolarHBondContact O-N 3.29Å; L926-R930 VanDerWaalsContact O-N 3.14Å; L926-M931 HydrophobicContact CD2-CB 3.99Å; L926-M931 HydrophobicContact CD2-SD 4.39Å; L926-M931 PolarHBondContact O-N 3.33Å; L926-M931 VanDerWaalsContact O-N 3.11Å; L926-T932 HydrophobicContact CB-CG2 4Å; L926-L975 HydrophobicContact CD1-CD1 3.9Å; L926-L975 HydrophobicContact CD1-CD2 4.28Å; L926-L975 HydrophobicContact CD1-CG 4.06Å; L926-I979 HydrophobicContact CD1-CD1 3.79Å; L926-I979 HydrophobicContact CD1-CG1 3.97Å; L926-I979 HydrophobicContact CD2-CD1 4.16Å; L926-I979 HydrophobicContact CD2-CG1 4.13Å; L926-I1037 HydrophobicContact CD1-CD1 4.5Å; L926-I1037 HydrophobicContact CD2-CD1 4.16Å; L926-W1039 HydrophobicContact CD2-CH2 4.03Å; L926-W1039 HydrophobicContact CD2-CZ3 4.29Å; L926-W1039 HydrophobicContact CG-CH2 4.12Å
927	Q	79.4	Confident	76.5	Confident	104 Å²	104	73 Å²	73	49%	0.486	35%	0.349	S	S	.	.	H	α-helix	trans	-64.9	-50	177.3	-73.2	-180	5.5	0	0	111.9	S923 N924 S929 R930	S923-Q927 WeakPolarHBondContact O-CG 3.42Å; S923-Q927 PolarHBondContact O-N 2.99Å; N924-Q927 PolarHBondContact O-N 3.13Å; Q927-S929 PolarHBondContact O-N 2.88Å; Q927-R930 PolarHBondContact O-N 2.87Å
928	D	75.9	Confident	73.7	Confident	100 Å²	100	75.3 Å²	75.3	54%	0.535	37%	0.365	S	S	.	.	H	α-helix	trans	-59.4	-35.7	177	-76.8	-19.3	0	0	0	111.3	N924 R930 T1057	N924-D928 VanDerWaalsContact O-CB 3.32Å; N924-D928 WeakPolarHBondContact O-CB 3.29Å; N924-D928 PolarHBondContact O-N 3.46Å; D928-R930 VanDerWaalsContact C-N 3.3Å; D928-R930 PolarHBondContact O-N 3.47Å; D928-T1057 WeakPolarHBondContact O-CG2 3.09Å
929	S	74.8	Confident	70.6	Confident	5 Å²	5	76.5 Å²	76.5	4%	0.035	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	2.2	177.6	-59.5	0	0	0	0	114.1	R925 L926 Q927 M931 L1043	R925-S929 WeakPolarHBondContact O-CB 3.29Å; R925-S929 PolarHBondContact O-N 3.39Å; R925-S929 VanDerWaalsContact O-N 3.08Å; R925-S929 PolarHBondContact O-OG 3.29Å; L926-S929 CarbonylContact O-C 3.55Å; L926-S929 PolarHBondContact O-N 3.24Å; Q927-S929 PolarHBondContact O-N 2.88Å; S929-M931 WeakPolarHBondContact O-CG 3.39Å; S929-M931 PolarHBondContact O-N 2.9Å; S929-M931 VanDerWaalsContact O-N 3.11Å; S929-L1043 WeakPolarHBondContact O-CD1 3.15Å; S929-L1043 WeakPolarHBondContact O-CG 3.29Å
930	R	75.7	Confident	67.6	Low	102 Å²	102	78.4 Å²	78.4	39%	0.385	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	36.3	-177.6	-58.5	-167	175.3	-170.7	-3.7	113.9	L926 Q927 D928 F934 L1043	L926-R930 PolarHBondContact O-N 3.29Å; L926-R930 VanDerWaalsContact O-N 3.14Å; Q927-R930 PolarHBondContact O-N 2.87Å; D928-R930 VanDerWaalsContact C-N 3.3Å; D928-R930 PolarHBondContact O-N 3.47Å; R930-F934 HydrophobicContact CB-CE2 3.62Å; R930-F934 HydrophobicContact CB-CZ 4.07Å; R930-F934 HydrophobicContact CG-CE2 3.63Å; R930-F934 HydrophobicContact CG-CZ 3.65Å; R930-L1043 HydrophobicContact CB-CD1 3.46Å; R930-L1043 VanDerWaalsContact CB-CD1 3.46Å; R930-L1043 HydrophobicContact CB-CG 4.37Å; R930-L1043 HydrophobicContact CG-CD1 3.43Å; R930-L1043 VanDerWaalsContact CG-CD1 3.43Å
931	M	79.7	Confident	64.7	Low	1 Å²	1	83.8 Å²	83.8	1%	0.005	44%	0.442	C	S	.	.			trans	-89.7	-8.3	-178.4	-66.9	174.6	71.2	0	0	112.6	L926 S929 D980 Y983 I1037 W1039	L926-M931 HydrophobicContact CD2-CB 3.99Å; L926-M931 HydrophobicContact CD2-SD 4.39Å; L926-M931 PolarHBondContact O-N 3.33Å; L926-M931 VanDerWaalsContact O-N 3.11Å; S929-M931 WeakPolarHBondContact O-CG 3.39Å; S929-M931 PolarHBondContact O-N 2.9Å; S929-M931 VanDerWaalsContact O-N 3.11Å; M931-D980 PolarHBondContact O-N 3.46Å; M931-Y983 HydrophobicContact CB-CD2 3.85Å; M931-Y983 HydrophobicContact CB-CE2 4.09Å; M931-Y983 HydrophobicContact CB-CG 4.3Å; M931-Y983 HydrophobicContact CE-CD1 3.77Å; M931-Y983 HydrophobicContact CE-CD2 4.36Å; M931-Y983 HydrophobicContact CE-CG 3.65Å; M931-Y983 HydrophobicContact CG-CD1 4.39Å; M931-Y983 HydrophobicContact CG-CD2 4.15Å; M931-Y983 HydrophobicContact CG-CE1 4.41Å; M931-Y983 HydrophobicContact CG-CE2 4.2Å; M931-Y983 HydrophobicContact CG-CG 4.26Å; M931-Y983 WeakPolarHBondContact O-CD2 2.99Å; M931-I1037 HydrophobicContact CE-CG2 3.5Å; M931-I1037 VanDerWaalsContact CE-CG2 3.5Å; M931-W1039 HydrophobicContact SD-CE3 4.26Å; M931-W1039 HydrophobicContact SD-CZ3 4.29Å
932	T	80.5	Confident	61.8	Low	18 Å²	18	87.6 Å²	87.6	11%	0.11	46%	0.46	C	S	.	.	B	Isolated β-bridge	trans	-102.2	155.6	177.7	58.2	0	0	0	0	111.4	L926 F934 S978 I979	L926-T932 HydrophobicContact CB-CG2 4Å; T932-F934 PolarHBondContact O-N 3.06Å; T932-S978 CarbonylContact C-O 3.55Å; T932-S978 WeakPolarHBondContact CA-O 3.3Å; T932-S978 WeakPolarHBondContact CB-O 3.32Å; T932-S978 WeakPolarHBondContact CG2-OG 3.47Å; T932-I979 HydrophobicContact CG2-CG1 4.29Å
933	Y	70.1	Confident	58.9	Low	130 Å²	130	97.6 Å²	97.6	51%	0.51	50%	0.503	S	S	.	.			trans	-62.7	120.4	169.2	-67.3	-73.4	0	0	0	110.1	V935 S978 D980 P981	Y933-V935 PolarHBondContact O-N 3.47Å; Y933-S978 WeakPolarHBondContact CD2-O 3.43Å; Y933-S978 PolarHBondContact N-O 3.23Å; Y933-D980 HydrophobicContact CE1-CB 4.47Å; Y933-D980 HydrophobicContact CE2-CB 4.24Å; Y933-P981 VanDerWaalsContact OH-CD 3.3Å; Y933-P981 WeakPolarHBondContact OH-CD 3.3Å
934	F	53.9	Low	56.1	Low	132 Å²	132	102.2 Å²	102.2	58%	0.579	53%	0.531	S	S	*	.			trans	-72.8	114.5	170.9	-77.6	-88.2	0	0	0	108.9	R930 T932 E936	R930-F934 HydrophobicContact CB-CE2 3.62Å; R930-F934 HydrophobicContact CB-CZ 4.07Å; R930-F934 HydrophobicContact CG-CE2 3.63Å; R930-F934 HydrophobicContact CG-CZ 3.65Å; T932-F934 PolarHBondContact O-N 3.06Å; F934-E936 PolarHBondContact O-N 3.31Å
935	V	48.3	Very low	53.4	Low	128 Å²	128	102.8 Å²	102.8	78%	0.776	54%	0.541	S	S	*	.			trans	-79.4	100.3	159.7	-176.3	0	0	0	0	105.9	Y933 E937	Y933-V935 PolarHBondContact O-N 3.47Å; V935-E937 VanDerWaalsContact C-N 3.34Å; V935-E937 PolarHBondContact O-N 3.29Å
936	E	39.2	Very low	50.6	Low	129 Å²	129	108.1 Å²	108.1	60%	0.603	57%	0.569	S	S	*	*			trans	-64.9	100.5	164.3	-72.3	-172.4	159.3	0	0	107.5	F934 S938 P1085	F934-E936 PolarHBondContact O-N 3.31Å; E936-S938 PolarHBondContact O-N 2.76Å; E936-S938 PolarHBondContact O-OG 3.27Å; E936-P1085 WeakPolarHBondContact OE1-CG 3.34Å
937	E	34.4	Very low	47.9	Very low	188 Å²	188	120.2 Å²	120.2	88%	0.879	62%	0.615	S	S	*	*			trans	-63.5	81.1	159.7	-75.2	-175.4	169.4	0	0	107.7	V935 G939	V935-E937 VanDerWaalsContact C-N 3.34Å; V935-E937 PolarHBondContact O-N 3.29Å; E937-G939 PolarHBondContact O-N 3.42Å
938	S	33.1	Very low	45.6	Very low	103 Å²	103	122.6 Å²	122.6	72%	0.72	63%	0.626	S	S	*	*			trans	-68	121.8	166.1	19.1	0	0	0	0	106.5	E936 A940	E936-S938 PolarHBondContact O-N 2.76Å; E936-S938 PolarHBondContact O-OG 3.27Å; S938-A940 PolarHBondContact O-N 2.75Å
939	G	28.8	Very low	43.5	Very low	84 Å²	84	123.4 Å²	123.4	87%	0.866	64%	0.637	S	S	*	*			trans	-47.1	125.3	-165.5	0	0	0	0	0	114.7	E937	E937-G939 PolarHBondContact O-N 3.42Å
940	A	28.6	Very low	41.4	Very low	69 Å²	69	127.4 Å²	127.4	57%	0.57	67%	0.671	S	S	*	*			trans	-142.7	99.9	153.3	0	0	0	0	0	107.2	S938 E942	S938-A940 PolarHBondContact O-N 2.75Å; A940-E942 HydrophobicContact CB-CB 4.03Å; A940-E942 HydrophobicContact CB-CG 4.33Å; A940-E942 PolarHBondContact O-N 2.99Å
941	E	29.9	Very low	39.2	Very low	212 Å²	212	130.9 Å²	130.9	99%	0.991	69%	0.691	S	S	*	*			trans	-61.1	75.9	148.2	-70.2	-179.8	158	0	0	107
942	E	29.7	Very low	37.1	Very low	156 Å²	156	136.8 Å²	136.8	73%	0.729	73%	0.728	S	S	*	*			trans	-121.2	122.9	177.6	-97.8	-173.9	153.4	0	0	111.7	A940 T944	A940-E942 HydrophobicContact CB-CB 4.03Å; A940-E942 HydrophobicContact CB-CG 4.33Å; A940-E942 PolarHBondContact O-N 2.99Å; E942-T944 PolarHBondContact O-N 3.48Å
943	K	28.5	Very low	34.8	Very low	209 Å²	209	141.3 Å²	141.3	91%	0.909	76%	0.76	S	S	*	*			trans	-60.1	112.5	168.5	-64.9	164.6	175.1	173.7	0	109.5
944	T	29.8	Very low	33.1	Very low	119 Å²	119	139.2 Å²	139.2	73%	0.73	77%	0.769	S	S	*	*			trans	-138.1	93.8	161.3	50	0	0	0	0	107	E942	E942-T944 PolarHBondContact O-N 3.48Å
945	S	28.5	Very low	32.2	Very low	97 Å²	97	140.8 Å²	140.8	68%	0.678	78%	0.784	S	S	*	*				61.9	105.4	85.6	76.1	0	0	0	0	113.4
946	E	29.6	Very low	31.4	Very low	185 Å²	185	138.3 Å²	138.3	86%	0.864	78%	0.784	S	S	*	*			trans	50.6	96.8	134.2	-64.4	174.9	177.4	0	0	118
947	R	28.7	Very low	31.2	Very low	253 Å²	253	139.8 Å²	139.8	96%	0.955	80%	0.796	S	S	*	*				-145	103	122.1	-127.3	176.8	-177.1	-177.5	0.2	109
948	E	29.3	Very low	31.2	Very low	154 Å²	154	140.4 Å²	140.4	72%	0.72	80%	0.799	S	S	*	*			trans	-56.7	143.5	178.3	-62.3	-172.2	155.4	0	0	112.4
949	P	32	Very low	31.2	Very low	117 Å²	117	144.5 Å²	144.5	76%	0.76	81%	0.809	S	S	*	*			trans	-73.7	123	144.8	27.5	-18.2	0	0	0	107.5	E951	P949-E951 PolarHBondContact O-N 2.82Å
950	A	31.2	Very low	31.6	Very low	90 Å²	90	148.8 Å²	148.8	74%	0.744	81%	0.806	S	S	*	*			trans	-49.5	113.3	-178.5	0	0	0	0	0	111.4	T952	A950-T952 PolarHBondContact O-N 3.21Å
951	E	29.8	Very low	32.5	Very low	174 Å²	174	152.1 Å²	152.1	81%	0.813	81%	0.813	S	S	*	*			trans	-67.8	111.1	169.1	-65.4	-174.5	164.2	0	0	109.2	P949	P949-E951 PolarHBondContact O-N 2.82Å
952	T	35.1	Very low	33.7	Very low	126 Å²	126	147.9 Å²	147.9	77%	0.773	80%	0.802	S	S	*	*			trans	-127.6	100.6	155.3	39.8	0	0	0	0	110.3	A950	A950-T952 PolarHBondContact O-N 3.21Å
953	S	33	Very low	35.6	Very low	113 Å²	113	144.8 Å²	144.8	79%	0.79	79%	0.786	S	S	*	*			trans	63.4	108.3	148.8	66.5	0	0	0	0	120.6
954	A	34	Very low	38.2	Very low	86 Å²	86	138.7 Å²	138.7	71%	0.711	76%	0.763	S	S	*	*				62.8	85.7	123.2	0	0	0	0	0	118.9
955	N	34.9	Very low	40.8	Very low	165 Å²	165	133.2 Å²	133.2	88%	0.882	73%	0.73	S	S	*	*				165.8	140.1	114	-83	-28.5	0	0	0	108.3	D957	N955-D957 PolarHBondContact O-N 3.25Å
956	G	31.5	Very low	43.6	Very low	75 Å²	75	130.4 Å²	130.4	77%	0.773	71%	0.713	S	S	*	*			trans	-60.5	131	-165.5	0	0	0	0	0	114.7
957	D	35.8	Very low	46.6	Very low	161 Å²	161	126.7 Å²	126.7	86%	0.861	69%	0.691	S	S	*	*			trans	-157.5	137.6	144.3	-92.9	-29.9	0	0	0	107.6	N955 M959	N955-D957 PolarHBondContact O-N 3.25Å; D957-M959 PolarHBondContact O-N 3.01Å; D957-M959 VanDerWaalsContact O-N 3.08Å
958	Q	34.3	Very low	49.6	Very low	201 Å²	201	115.1 Å²	115.1	94%	0.939	65%	0.647	S	S	*	*			trans	-64.5	106.8	173.7	-78.2	172.8	-22.7	0	0	108.4	E960	Q958-E960 PolarHBondContact O-N 2.97Å
959	M	31.3	Very low	52.7	Low	188 Å²	188	107.9 Å²	107.9	93%	0.926	61%	0.614	S	S	*	*			trans	-76.3	93.3	178.1	-153.2	163.2	99.2	0	0	109.2	D957 I961	D957-M959 PolarHBondContact O-N 3.01Å; D957-M959 VanDerWaalsContact O-N 3.08Å; M959-I961 PolarHBondContact O-N 3.39Å
960	E	38.9	Very low	55.5	Low	174 Å²	174	103.8 Å²	103.8	81%	0.813	59%	0.593	S	S	*	*			trans	-60.6	127.3	167.6	-140.8	173	-169	0	0	108.2	Q958 V962	Q958-E960 PolarHBondContact O-N 2.97Å; E960-V962 PolarHBondContact O-N 3.07Å
961	I	46.6	Very low	58.4	Low	139 Å²	139	100.3 Å²	100.3	71%	0.713	56%	0.564	S	S	*	*			trans	-69.4	98	179.6	-60.5	172.4	0	0	0	107.6	M959 K963	M959-I961 PolarHBondContact O-N 3.39Å; I961-K963 PolarHBondContact O-N 3.26Å
962	V	54.9	Low	61.4	Low	124 Å²	124	92 Å²	92	75%	0.752	53%	0.525	S	S	*	.			trans	-64.5	115.1	174	-177.2	0	0	0	0	108.3	E960 D964	E960-V962 PolarHBondContact O-N 3.07Å; V962-D964 PolarHBondContact O-N 2.95Å
963	K	69.8	Low	64.2	Low	90 Å²	90	87.8 Å²	87.8	39%	0.391	50%	0.498	S	S	.	.			trans	-92	94.4	179.2	-68	179	176.3	-177.4	0	109.4	I961 W967 Y968 Y1023	I961-K963 PolarHBondContact O-N 3.26Å; K963-W967 HydrophobicContact CB-CB 4.48Å; K963-W967 HydrophobicContact CB-CD2 4.01Å; K963-W967 HydrophobicContact CB-CE3 3.9Å; K963-W967 HydrophobicContact CB-CG 4.25Å; K963-W967 HydrophobicContact CD-CD2 4.06Å; K963-W967 HydrophobicContact CD-CE3 3.82Å; K963-W967 HydrophobicContact CD-CH2 3.82Å; K963-W967 HydrophobicContact CD-CZ2 4Å; K963-W967 HydrophobicContact CD-CZ3 3.71Å; K963-W967 HydrophobicContact CG-CD2 3.76Å; K963-W967 HydrophobicContact CG-CE3 3.91Å; K963-W967 HydrophobicContact CG-CG 4.18Å; K963-W967 HydrophobicContact CG-CZ2 4.39Å; K963-W967 HydrophobicContact CG-CZ3 4.32Å; K963-Y968 HydrophobicContact CB-CE2 4.03Å; K963-Y1023 PolarHBondContact O-OH 2.92Å
964	D	82.4	Confident	67	Low	82 Å²	82	90.1 Å²	90.1	44%	0.439	49%	0.493	S	S	.	.			trans	-84.4	-179	178.5	66.7	9.2	0	0	0	112.9	V962 A966 W967 Y968	V962-D964 PolarHBondContact O-N 2.95Å; D964-A966 PolarHBondContact O-N 2.7Å; D964-A966 WeakPolarHBondContact OD1-CB 3.25Å; D964-A966 PolarHBondContact OD1-N 3.08Å; D964-A966 VanDerWaalsContact OD1-N 3.12Å; D964-W967 WeakPolarHBondContact O-CB 3.48Å; D964-W967 PolarHBondContact O-N 2.73Å; D964-W967 VanDerWaalsContact O-N 3.15Å; D964-W967 PolarHBondContact OD1-N 2.79Å; D964-Y968 WeakPolarHBondContact O-CD2 3.38Å; D964-Y968 PolarHBondContact O-N 3.43Å; D964-Y968 VanDerWaalsContact O-N 3.11Å
965	G	84.6	Confident	69.6	Low	3 Å²	3	86.8 Å²	86.8	3%	0.031	46%	0.464	C	S	.	.	H	α-helix	trans	-60.1	-31.4	177.5	0	0	0	0	0	113.3	Y968 A969 R1021 V1026	G965-Y968 PolarHBondContact O-N 3.4Å; G965-A969 WeakPolarHBondContact O-CB 3.31Å; G965-A969 PolarHBondContact O-N 2.61Å; G965-R1021 WeakPolarHBondContact CA-O 3.37Å; G965-V1026 WeakPolarHBondContact O-CG2 3.33Å
966	A	88.9	Confident	72.2	Confident	38 Å²	38	79.1 Å²	79.1	31%	0.314	42%	0.423	S	S	.	.	H	α-helix	trans	-68.7	-38.2	175.8	0	0	0	0	0	111.8	D964 A969 G970	D964-A966 PolarHBondContact O-N 2.7Å; D964-A966 WeakPolarHBondContact OD1-CB 3.25Å; D964-A966 PolarHBondContact OD1-N 3.08Å; D964-A966 VanDerWaalsContact OD1-N 3.12Å; A966-A969 PolarHBondContact O-N 3.22Å; A966-G970 PolarHBondContact O-N 2.99Å
967	W	91.5	Very high	75	Confident	107 Å²	107	80.1 Å²	80.1	41%	0.405	41%	0.411	S	S	.	.	H	α-helix	trans	-61.2	-48.3	172.9	-174	94.1	0	0	0	111.4	K963 D964 A969 G970 A971	K963-W967 HydrophobicContact CB-CB 4.48Å; K963-W967 HydrophobicContact CB-CD2 4.01Å; K963-W967 HydrophobicContact CB-CE3 3.9Å; K963-W967 HydrophobicContact CB-CG 4.25Å; K963-W967 HydrophobicContact CD-CD2 4.06Å; K963-W967 HydrophobicContact CD-CE3 3.82Å; K963-W967 HydrophobicContact CD-CH2 3.82Å; K963-W967 HydrophobicContact CD-CZ2 4Å; K963-W967 HydrophobicContact CD-CZ3 3.71Å; K963-W967 HydrophobicContact CG-CD2 3.76Å; K963-W967 HydrophobicContact CG-CE3 3.91Å; K963-W967 HydrophobicContact CG-CG 4.18Å; K963-W967 HydrophobicContact CG-CZ2 4.39Å; K963-W967 HydrophobicContact CG-CZ3 4.32Å; D964-W967 WeakPolarHBondContact O-CB 3.48Å; D964-W967 PolarHBondContact O-N 2.73Å; D964-W967 VanDerWaalsContact O-N 3.15Å; D964-W967 PolarHBondContact OD1-N 2.79Å; W967-A969 VanDerWaalsContact C-N 3.34Å; W967-A969 PolarHBondContact O-N 2.74Å; W967-G970 PolarHBondContact O-N 3.22Å; W967-A971 HydrophobicContact CE3-CB 4.35Å; W967-A971 HydrophobicContact CH2-CB 4.29Å; W967-A971 HydrophobicContact CZ3-CB 4.03Å; W967-A971 PolarHBondContact O-N 2.92Å
968	Y	92.3	Very high	77.4	Confident	10 Å²	10	74 Å²	74	4%	0.039	38%	0.381	C	S	.	.	H	α-helix	trans	-66.7	-34.6	178	-80.2	-77.4	0	0	0	112.7	L915 K963 D964 G965 A971 L972 Y1023	L915-Y968 HydrophobicContact CD2-CD1 4.15Å; L915-Y968 HydrophobicContact CD2-CD2 3.84Å; L915-Y968 HydrophobicContact CD2-CE2 4.45Å; L915-Y968 HydrophobicContact CD2-CG 3.67Å; L915-Y968 HydrophobicContact CG-CD1 4.2Å; L915-Y968 HydrophobicContact CG-CG 4.23Å; K963-Y968 HydrophobicContact CB-CE2 4.03Å; D964-Y968 WeakPolarHBondContact O-CD2 3.38Å; D964-Y968 PolarHBondContact O-N 3.43Å; D964-Y968 VanDerWaalsContact O-N 3.11Å; G965-Y968 PolarHBondContact O-N 3.4Å; Y968-A971 PolarHBondContact O-N 3.48Å; Y968-L972 VanDerWaalsContact O-CB 3.3Å; Y968-L972 WeakPolarHBondContact O-CB 3.49Å; Y968-L972 PolarHBondContact O-N 3.15Å; Y968-Y1023 HydrophobicContact CD2-CD1 4.23Å; Y968-Y1023 AromaticContact CD2-CE1 3.88Å; Y968-Y1023 HydrophobicContact CD2-CE1 3.88Å; Y968-Y1023 HydrophobicContact CE2-CE1 4.13Å
969	A	93	Very high	80	Confident	3 Å²	3	64.7 Å²	64.7	3%	0.025	34%	0.337	C	S	.	.	H	α-helix	trans	-59.8	-46.9	171.8	0	0	0	0	0	111.5	G965 A966 W967 A971 L972 L973 L1017 A1020 V1026	G965-A969 WeakPolarHBondContact O-CB 3.31Å; G965-A969 PolarHBondContact O-N 2.61Å; A966-A969 PolarHBondContact O-N 3.22Å; W967-A969 VanDerWaalsContact C-N 3.34Å; W967-A969 PolarHBondContact O-N 2.74Å; A969-A971 VanDerWaalsContact C-N 3.34Å; A969-A971 PolarHBondContact O-N 3.46Å; A969-L972 PolarHBondContact O-N 3.16Å; A969-L973 WeakPolarHBondContact O-CG 3.41Å; A969-L973 PolarHBondContact O-N 3.38Å; A969-L1017 HydrophobicContact CB-CD1 3.83Å; A969-L1017 HydrophobicContact CB-CG 4.26Å; A969-L1017 WeakPolarHBondContact CB-O 3.46Å; A969-A1020 HydrophobicContact CB-CB 4.39Å; A969-V1026 HydrophobicContact CB-CG2 4.02Å
970	G	92.5	Very high	82.4	Confident	30 Å²	30	57.4 Å²	57.4	31%	0.309	30%	0.302	S	S	.	.	H	α-helix	trans	-62.7	-37.4	174.4	0	0	0	0	0	113.5	A966 W967 K974	A966-G970 PolarHBondContact O-N 2.99Å; W967-G970 PolarHBondContact O-N 3.22Å; G970-K974 WeakPolarHBondContact O-CG 3.35Å; G970-K974 PolarHBondContact O-N 2.86Å
971	A	92	Very high	84.5	Confident	17 Å²	17	53.3 Å²	53.3	14%	0.14	29%	0.291	C	S	.	.	H	α-helix	trans	-67.5	-41.4	175.1	0	0	0	0	0	112	F919 W967 Y968 A969 K974 L975	F919-A971 HydrophobicContact CE2-CB 4.15Å; F919-A971 HydrophobicContact CZ-CB 3.79Å; W967-A971 HydrophobicContact CE3-CB 4.35Å; W967-A971 HydrophobicContact CH2-CB 4.29Å; W967-A971 HydrophobicContact CZ3-CB 4.03Å; W967-A971 PolarHBondContact O-N 2.92Å; Y968-A971 PolarHBondContact O-N 3.48Å; A969-A971 VanDerWaalsContact C-N 3.34Å; A969-A971 PolarHBondContact O-N 3.46Å; A971-K974 PolarHBondContact O-N 3.36Å; A971-L975 PolarHBondContact O-N 3Å
972	L	93.1	Very high	86.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.3	-37.1	177.8	-176.2	59.7	0	0	0	112.2	F919 M922 Y968 A969 L975 A976 W1013 L1017 V1026 H1029 L1030 L1033	F919-L972 HydrophobicContact CD2-CD1 4.42Å; F919-L972 HydrophobicContact CE2-CB 4.09Å; F919-L972 HydrophobicContact CE2-CD1 4.2Å; M922-L972 HydrophobicContact CE-CD1 3.81Å; Y968-L972 VanDerWaalsContact O-CB 3.3Å; Y968-L972 WeakPolarHBondContact O-CB 3.49Å; Y968-L972 PolarHBondContact O-N 3.15Å; A969-L972 PolarHBondContact O-N 3.16Å; L972-L975 HydrophobicContact CD1-CD2 4.49Å; L972-L975 PolarHBondContact O-N 3.34Å; L972-A976 WeakPolarHBondContact O-CB 3.33Å; L972-A976 PolarHBondContact O-N 2.74Å; L972-W1013 HydrophobicContact CD2-CH2 4.34Å; L972-W1013 HydrophobicContact CD2-CZ2 4.18Å; L972-W1013 HydrophobicContact CG-CH2 4.11Å; L972-W1013 HydrophobicContact CG-CZ2 4.42Å; L972-L1017 HydrophobicContact CB-CD2 3.96Å; L972-L1017 HydrophobicContact CD2-CD1 4.04Å; L972-L1017 HydrophobicContact CD2-CD2 3.83Å; L972-L1017 HydrophobicContact CG-CD2 3.76Å; L972-V1026 HydrophobicContact CD2-CG1 3.94Å; L972-H1029 HydrophobicContact CD2-CB 4.23Å; L972-L1030 HydrophobicContact CD1-CD1 3.68Å; L972-L1030 HydrophobicContact CD2-CB 4.05Å; L972-L1030 HydrophobicContact CD2-CD1 4.44Å; L972-L1033 HydrophobicContact CD1-CD2 3.79Å
973	L	92.6	Very high	87.6	Confident	37 Å²	37	45.4 Å²	45.4	19%	0.194	24%	0.241	C	C	.	.	H	α-helix	trans	-58.3	-48.1	170.8	-76.8	169.1	0	0	0	111.6	A969 L975 A976 D977 K1014 L1017	A969-L973 WeakPolarHBondContact O-CG 3.41Å; A969-L973 PolarHBondContact O-N 3.38Å; L973-L975 VanDerWaalsContact C-N 3.34Å; L973-L975 PolarHBondContact O-N 3.15Å; L973-A976 PolarHBondContact O-N 3.46Å; L973-D977 PolarHBondContact O-N 3.04Å; L973-K1014 HydrophobicContact CD2-CB 3.92Å; L973-K1014 HydrophobicContact CD2-CG 3.85Å; L973-L1017 HydrophobicContact CD2-CB 4.27Å; L973-L1017 HydrophobicContact CD2-CD2 3.77Å; L973-L1017 HydrophobicContact CD2-CG 4.18Å; L973-L1017 HydrophobicContact CG-CD2 3.68Å; L973-L1017 HydrophobicContact CG-CG 3.98Å
974	K	91.1	Very high	88.2	Confident	162 Å²	162	42.4 Å²	42.4	70%	0.704	23%	0.229	S	C	*	.	H	α-helix	trans	-62.4	-40.7	177	-71.4	175.9	-177.5	178.8	0	112.4	G970 A971 D977 S978	G970-K974 WeakPolarHBondContact O-CG 3.35Å; G970-K974 PolarHBondContact O-N 2.86Å; A971-K974 PolarHBondContact O-N 3.36Å; K974-D977 PolarHBondContact O-N 2.72Å; K974-S978 PolarHBondContact O-N 3.46Å; K974-S978 VanDerWaalsContact O-N 3.09Å
975	L	90.2	Very high	87.9	Confident	17 Å²	17	42.2 Å²	42.2	9%	0.089	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-45.4	176.7	-177	60.2	0	0	0	110.6	F919 M922 L926 A971 L972 L973 D977 S978 I979	F919-L975 HydrophobicContact CE2-CD2 3.98Å; F919-L975 HydrophobicContact CZ-CB 4.44Å; F919-L975 HydrophobicContact CZ-CD2 4.06Å; M922-L975 HydrophobicContact CE-CD2 3.39Å; M922-L975 HydrophobicContact CE-CG 4.3Å; L926-L975 HydrophobicContact CD1-CD1 3.9Å; L926-L975 HydrophobicContact CD1-CD2 4.28Å; L926-L975 HydrophobicContact CD1-CG 4.06Å; A971-L975 PolarHBondContact O-N 3Å; L972-L975 HydrophobicContact CD1-CD2 4.49Å; L972-L975 PolarHBondContact O-N 3.34Å; L973-L975 VanDerWaalsContact C-N 3.34Å; L973-L975 PolarHBondContact O-N 3.15Å; L975-D977 PolarHBondContact O-N 2.89Å; L975-S978 WeakPolarHBondContact O-CB 3.41Å; L975-S978 PolarHBondContact O-N 3.25Å; L975-S978 VanDerWaalsContact O-N 3.1Å; L975-S978 PolarHBondContact O-OG 2.82Å; L975-I979 PolarHBondContact O-N 3.47Å
976	A	89.5	Confident	87.3	Confident	4 Å²	4	44.8 Å²	44.8	3%	0.033	24%	0.238	C	C	.	.	H	α-helix	trans	-59.5	-42.8	176.4	0	0	0	0	0	112.6	L972 L973 S978 I979 M1010 W1013 L1033	L972-A976 WeakPolarHBondContact O-CB 3.33Å; L972-A976 PolarHBondContact O-N 2.74Å; L973-A976 PolarHBondContact O-N 3.46Å; A976-S978 PolarHBondContact O-N 3.07Å; A976-I979 PolarHBondContact O-N 3.43Å; A976-M1010 HydrophobicContact CB-CE 3.63Å; A976-W1013 HydrophobicContact CB-CH2 4.05Å; A976-W1013 HydrophobicContact CB-CZ3 3.89Å; A976-L1033 HydrophobicContact CB-CD1 4.47Å; A976-L1033 HydrophobicContact CB-CD2 3.89Å
977	D	88.9	Confident	86.1	Confident	95 Å²	95	44.5 Å²	44.5	51%	0.508	23%	0.233	S	C	.	.	H	α-helix	trans	-67.7	-22.9	176.1	-77.6	-22.1	0	0	0	113.5	L973 K974 L975 K1014	L973-D977 PolarHBondContact O-N 3.04Å; K974-D977 PolarHBondContact O-N 2.72Å; L975-D977 PolarHBondContact O-N 2.89Å; D977-K1014 VanDerWaalsContact OD1-CE 3.24Å; D977-K1014 WeakPolarHBondContact OD1-CE 3.39Å; D977-K1014 IonicContact OD1-NZ 3Å; D977-K1014 PolarHBondContact OD1-NZ 3.42Å
978	S	87.8	Confident	84.7	Confident	34 Å²	34	42.6 Å²	42.6	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-78.4	-19	178.1	78.6	0	0	0	0	113.8	T932 Y933 K974 L975 A976	T932-S978 CarbonylContact C-O 3.55Å; T932-S978 WeakPolarHBondContact CA-O 3.3Å; T932-S978 WeakPolarHBondContact CB-O 3.32Å; T932-S978 WeakPolarHBondContact CG2-OG 3.47Å; Y933-S978 WeakPolarHBondContact CD2-O 3.43Å; Y933-S978 PolarHBondContact N-O 3.23Å; K974-S978 PolarHBondContact O-N 3.46Å; K974-S978 VanDerWaalsContact O-N 3.09Å; L975-S978 WeakPolarHBondContact O-CB 3.41Å; L975-S978 PolarHBondContact O-N 3.25Å; L975-S978 VanDerWaalsContact O-N 3.1Å; L975-S978 PolarHBondContact O-OG 2.82Å; A976-S978 PolarHBondContact O-N 3.07Å
979	I	87.2	Confident	83.2	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.021	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-75.6	128.7	-179.3	-59.4	167.8	0	0	0	109.1	L926 T932 L975 A976 I984 L1033 I1037	L926-I979 HydrophobicContact CD1-CD1 3.79Å; L926-I979 HydrophobicContact CD1-CG1 3.97Å; L926-I979 HydrophobicContact CD2-CD1 4.16Å; L926-I979 HydrophobicContact CD2-CG1 4.13Å; T932-I979 HydrophobicContact CG2-CG1 4.29Å; L975-I979 PolarHBondContact O-N 3.47Å; A976-I979 PolarHBondContact O-N 3.43Å; I979-I984 HydrophobicContact CB-CD1 4.05Å; I979-I984 HydrophobicContact CB-CG1 4.39Å; I979-I984 HydrophobicContact CG2-CD1 3.96Å; I979-I984 HydrophobicContact CG2-CG1 3.74Å; I979-L1033 HydrophobicContact CD1-CD1 4.41Å; I979-L1033 HydrophobicContact CD1-CD2 4.48Å; I979-I1037 HydrophobicContact CD1-CD1 3.88Å; I979-I1037 HydrophobicContact CD1-CG1 4.18Å
980	D	83.2	Confident	81.8	Confident	35 Å²	35	45.6 Å²	45.6	19%	0.187	26%	0.258	C	S	.	.			trans	-61.2	127.6	175.9	-179.2	-37.5	0	0	0	109.7	M931 Y933 K982 Y983	M931-D980 PolarHBondContact O-N 3.46Å; Y933-D980 HydrophobicContact CE1-CB 4.47Å; Y933-D980 HydrophobicContact CE2-CB 4.24Å; D980-K982 HydrophobicContact CB-CG 4.41Å; D980-K982 PolarHBondContact O-N 2.74Å; D980-K982 VanDerWaalsContact OD1-CG 3.24Å; D980-K982 WeakPolarHBondContact OD1-CG 3.27Å; D980-K982 PolarHBondContact OD1-N 2.89Å; D980-K982 WeakPolarHBondContact OD2-CE 3.35Å; D980-Y983 HydrophobicContact CB-CD2 3.71Å; D980-Y983 HydrophobicContact CB-CE2 3.86Å; D980-Y983 WeakPolarHBondContact O-CB 3.33Å; D980-Y983 PolarHBondContact O-N 3.19Å
981	P	82.4	Confident	80.4	Confident	89 Å²	89	49.9 Å²	49.9	58%	0.578	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-51.5	-25.6	-177.1	-29	35.1	0	0	0	114.8	Y933 Y983 I984	Y933-P981 VanDerWaalsContact OH-CD 3.3Å; Y933-P981 WeakPolarHBondContact OH-CD 3.3Å; P981-Y983 PolarHBondContact O-N 3.01Å; P981-Y983 VanDerWaalsContact O-N 3.13Å; P981-I984 PolarHBondContact O-N 2.88Å
982	K	79.7	Confident	79.2	Confident	72 Å²	72	53.7 Å²	53.7	31%	0.313	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-64.3	-15.1	177.1	78.4	-168.9	174.3	173.5	0	113.9	D980 K1041 E1067	D980-K982 HydrophobicContact CB-CG 4.41Å; D980-K982 PolarHBondContact O-N 2.74Å; D980-K982 VanDerWaalsContact OD1-CG 3.24Å; D980-K982 WeakPolarHBondContact OD1-CG 3.27Å; D980-K982 PolarHBondContact OD1-N 2.89Å; D980-K982 WeakPolarHBondContact OD2-CE 3.35Å; K982-K1041 PolarHBondContact O-NZ 3.05Å; K982-E1067 IonicContact NZ-OE1 2.77Å; K982-E1067 PolarHBondContact NZ-OE1 3.22Å; K982-E1067 IonicContact NZ-OE2 2.95Å; K982-E1067 PolarHBondContact NZ-OE2 2.82Å
983	Y	86.1	Confident	78.2	Confident	25 Å²	25	57.9 Å²	57.9	10%	0.098	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-102.3	-2.5	179	-58.9	-59.9	0	0	0	114.2	M931 D980 P981 I1038 K1041	M931-Y983 HydrophobicContact CB-CD2 3.85Å; M931-Y983 HydrophobicContact CB-CE2 4.09Å; M931-Y983 HydrophobicContact CB-CG 4.3Å; M931-Y983 HydrophobicContact CE-CD1 3.77Å; M931-Y983 HydrophobicContact CE-CD2 4.36Å; M931-Y983 HydrophobicContact CE-CG 3.65Å; M931-Y983 HydrophobicContact CG-CD1 4.39Å; M931-Y983 HydrophobicContact CG-CD2 4.15Å; M931-Y983 HydrophobicContact CG-CE1 4.41Å; M931-Y983 HydrophobicContact CG-CE2 4.2Å; M931-Y983 HydrophobicContact CG-CG 4.26Å; M931-Y983 WeakPolarHBondContact O-CD2 2.99Å; D980-Y983 HydrophobicContact CB-CD2 3.71Å; D980-Y983 HydrophobicContact CB-CE2 3.86Å; D980-Y983 WeakPolarHBondContact O-CB 3.33Å; D980-Y983 PolarHBondContact O-N 3.19Å; P981-Y983 PolarHBondContact O-N 3.01Å; P981-Y983 VanDerWaalsContact O-N 3.13Å; Y983-I1038 PolarHBondContact O-N 3.06Å; Y983-K1041 HydrophobicContact CD1-CB 3.7Å; Y983-K1041 HydrophobicContact CD1-CD 4.06Å; Y983-K1041 HydrophobicContact CE1-CB 3.79Å; Y983-K1041 HydrophobicContact CE1-CD 4.43Å
984	I	83.2	Confident	77	Confident	26 Å²	26	60.3 Å²	60.3	13%	0.133	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-105.8	128.7	177.5	-61.5	176.9	0	0	0	109.1	I979 P981 N986 C1036	I979-I984 HydrophobicContact CB-CD1 4.05Å; I979-I984 HydrophobicContact CB-CG1 4.39Å; I979-I984 HydrophobicContact CG2-CD1 3.96Å; I979-I984 HydrophobicContact CG2-CG1 3.74Å; P981-I984 PolarHBondContact O-N 2.88Å; I984-N986 HydrophobicContact CG2-CB 4.17Å; I984-N986 PolarHBondContact O-N 2.85Å; I984-C1036 HydrophobicContact CG2-CB 4.45Å
985	E	77.2	Confident	76.1	Confident	78 Å²	78	57.8 Å²	57.8	36%	0.364	31%	0.312	S	S	.	.			trans	-82.7	101.5	166.5	-169.1	167.8	-160.6	0	0	108.7	L526 P987 C1036 I1038	L526-E985 VanDerWaalsContact CD1-CD 3.49Å; L526-E985 HydrophobicContact CD1-CG 3.86Å; L526-E985 VanDerWaalsContact CD1-OE1 3.26Å; L526-E985 WeakPolarHBondContact CD1-OE1 3.43Å; E985-P987 WeakPolarHBondContact O-CD 3.42Å; E985-C1036 PolarHBondContact N-O 2.78Å; E985-I1038 HydrophobicContact CB-CD1 4.38Å; E985-I1038 HydrophobicContact CB-CG1 4.11Å
986	N	70	Confident	74.2	Confident	58 Å²	58	64.2 Å²	64.2	31%	0.31	34%	0.342	S	S	.	.			trans	-117.5	89.3	-176.1	-170.3	7.3	0	0	0	110.6	I984 R1009 M1010	I984-N986 HydrophobicContact CG2-CB 4.17Å; I984-N986 PolarHBondContact O-N 2.85Å; N986-R1009 PolarHBondContact OD1-N 2.73Å; N986-M1010 VanDerWaalsContact ND2-CB 3.27Å; N986-M1010 WeakPolarHBondContact ND2-CB 3.28Å; N986-M1010 PolarHBondContact OD1-N 2.85Å
987	P	64.8	Low	73	Confident	31 Å²	31	64.9 Å²	64.9	20%	0.201	35%	0.349	C	S	.	.			trans	-67.1	142.7	179.1	27.2	-32.8	0	0	0	111	L526 E985 V989 R1009	L526-P987 HydrophobicContact CD1-CG 4.42Å; L526-P987 HydrophobicContact CD2-CB 4.31Å; L526-P987 HydrophobicContact CG-CB 4.21Å; L526-P987 HydrophobicContact CG-CG 4.29Å; E985-P987 WeakPolarHBondContact O-CD 3.42Å; P987-V989 PolarHBondContact O-N 3.42Å; P987-R1009 HydrophobicContact CG-CB 4.18Å; P987-R1009 PolarHBondContact O-N 3.34Å
988	V	62.3	Low	71.9	Confident	68 Å²	68	67.2 Å²	67.2	41%	0.412	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	124.8	165.2	179.2	0	0	0	0	107.4	G990 E1006 Y1008	V988-G990 WeakPolarHBondContact CG1-O 3.47Å; V988-E1006 HydrophobicContact CG1-CB 4.05Å; V988-E1006 HydrophobicContact CG1-CG 4.2Å; V988-E1006 HydrophobicContact CG2-CB 4.37Å; V988-E1006 HydrophobicContact CG2-CG 4.47Å; V988-Y1008 HydrophobicContact CG2-CD1 3.99Å; V988-Y1008 HydrophobicContact CG2-CE1 3.58Å
989	V	61.2	Low	71	Confident	45 Å²	45	72.2 Å²	72.2	27%	0.273	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-19.3	-177.1	-174.4	0	0	0	0	111.3	D521 P987 V1007 R1009	D521-V989 HydrophobicContact CB-CG1 3.83Å; D521-V989 WeakPolarHBondContact OD1-CG1 3.29Å; P987-V989 PolarHBondContact O-N 3.42Å; V989-V1007 PolarHBondContact N-O 3.32Å; V989-R1009 VanDerWaalsContact CG2-CA 3.46Å; V989-R1009 HydrophobicContact CG2-CB 3.44Å; V989-R1009 VanDerWaalsContact CG2-CB 3.44Å; V989-R1009 HydrophobicContact CG2-CG 4.19Å
990	G	63.7	Low	69.9	Low	31 Å²	31	75 Å²	75	32%	0.32	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.8	179.6	173	0	0	0	0	0	112.5	V988 V1007	V988-G990 WeakPolarHBondContact CG1-O 3.47Å; G990-V1007 PolarHBondContact N-O 2.87Å; G990-V1007 PolarHBondContact O-N 3.49Å
991	E	62.9	Low	68.4	Low	120 Å²	120	80.3 Å²	80.3	56%	0.561	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	131	173.9	-74.1	-179.2	-155.3	0	0	108.9	T1004 Q1005 E1006	E991-T1004 HydrophobicContact CB-CG2 4.41Å; E991-T1004 PolarHBondContact OE2-OG1 3.42Å; E991-T1004 VanDerWaalsContact OE2-OG1 3.09Å; E991-Q1005 WeakPolarHBondContact CA-O 3.48Å; E991-E1006 HydrophobicContact CG-CG 4.27Å
992	I	67.1	Low	67.4	Low	97 Å²	97	81.6 Å²	81.6	50%	0.497	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.8	173.7	-61.7	169.3	0	0	0	108.4	L994 T1004 Q1005 V1007	I992-L994 PolarHBondContact O-N 3.39Å; I992-T1004 CarbonylContact O-C 3.51Å; I992-T1004 WeakPolarHBondContact O-CA 3.27Å; I992-Q1005 PolarHBondContact N-O 3.21Å; I992-Q1005 PolarHBondContact O-N 3.01Å; I992-V1007 HydrophobicContact CB-CG2 4.43Å; I992-V1007 HydrophobicContact CD1-CG2 3.29Å; I992-V1007 HydrophobicContact CG1-CG2 3.47Å; I992-V1007 VanDerWaalsContact CG1-CG2 3.47Å
993	I	70.2	Confident	66.9	Low	87 Å²	87	81.9 Å²	81.9	45%	0.446	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	116.8	171.3	-58.5	163.7	0	0	0	108.4	E1002 T1004	I993-E1002 HydrophobicContact CD1-CG 4.46Å; I993-E1002 WeakPolarHBondContact CD1-OE2 3.12Å; I993-E1002 HydrophobicContact CG1-CB 4.45Å; I993-E1002 HydrophobicContact CG2-CB 4.1Å; I993-E1002 HydrophobicContact CG2-CG 4.31Å; I993-T1004 HydrophobicContact CG1-CG2 3.88Å
994	L	68	Low	66	Low	89 Å²	89	83.5 Å²	83.5	47%	0.466	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-41.5	-178.4	-69	178	0	0	0	112.4	I992 I1003 Q1005	I992-L994 PolarHBondContact O-N 3.39Å; L994-I1003 HydrophobicContact CD1-CG2 4.45Å; L994-I1003 PolarHBondContact N-O 3.12Å; L994-Q1005 HydrophobicContact CD1-CB 3.86Å; L994-Q1005 HydrophobicContact CD2-CB 4.21Å; L994-Q1005 HydrophobicContact CG-CB 3.92Å
995	H	71.4	Confident	65.4	Low	108 Å²	108	87.4 Å²	87.4	50%	0.5	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.9	154.7	174.5	52	-69.5	0	0	0	109.6	G997 I1003	H995-G997 PolarHBondContact O-N 2.89Å; H995-I1003 PolarHBondContact O-N 3.38Å
996	E	51.8	Low	65	Low	153 Å²	153	87.8 Å²	87.8	72%	0.715	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	120	166.4	-71	178.3	174	0	0	108.6
997	G	63.8	Low	64.9	Low	18 Å²	18	86.3 Å²	86.3	19%	0.186	47%	0.471	C	S	.	.			trans	-62.6	161.3	172.7	0	0	0	0	0	111.5	H995 D999 G1000 E1001	H995-G997 PolarHBondContact O-N 2.89Å; G997-D999 PolarHBondContact O-N 3.28Å; G997-G1000 PolarHBondContact O-N 3.42Å; G997-E1001 WeakPolarHBondContact CA-O 3.41Å; G997-E1001 PolarHBondContact N-O 3.03Å
998	T	66.5	Low	65.3	Low	144 Å²	144	89.7 Å²	89.7	88%	0.883	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-16.5	179.6	49.6	0	0	0	0	114.1
999	D	68.1	Low	66	Low	139 Å²	139	87.3 Å²	87.3	74%	0.743	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	5	-173.5	-55.2	-1.6	0	0	0	111.7	G997 E1001	G997-D999 PolarHBondContact O-N 3.28Å; D999-E1001 VanDerWaalsContact C-N 3.31Å
1000	G	63.3	Low	67.1	Low	62 Å²	62	86.1 Å²	86.1	64%	0.639	46%	0.456	S	S	*	.	S	Bend	trans	80	7.4	-175.6	0	0	0	0	0	114.3	G997	G997-G1000 PolarHBondContact O-N 3.42Å
1001	E	52.2	Low	68	Low	147 Å²	147	89.8 Å²	89.8	69%	0.687	47%	0.465	S	S	*	.			trans	-80.9	120.8	171.1	-72.2	-171.6	159.1	0	0	110.3	G997 D999 I1003	G997-E1001 WeakPolarHBondContact CA-O 3.41Å; G997-E1001 PolarHBondContact N-O 3.03Å; D999-E1001 VanDerWaalsContact C-N 3.31Å; E1001-I1003 PolarHBondContact O-N 2.86Å
1002	E	62	Low	69	Low	116 Å²	116	86.9 Å²	86.9	54%	0.542	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	113.2	172	-68.6	178.4	172.7	0	0	109.2	I993 T1004	I993-E1002 HydrophobicContact CD1-CG 4.46Å; I993-E1002 WeakPolarHBondContact CD1-OE2 3.12Å; I993-E1002 HydrophobicContact CG1-CB 4.45Å; I993-E1002 HydrophobicContact CG2-CB 4.1Å; I993-E1002 HydrophobicContact CG2-CG 4.31Å; E1002-T1004 PolarHBondContact O-N 3.21Å
1003	I	69.4	Low	70.1	Confident	78 Å²	78	82.5 Å²	82.5	40%	0.4	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	104.7	174.3	-63.1	173.3	0	0	0	107.6	L994 H995 E1001	L994-I1003 HydrophobicContact CD1-CG2 4.45Å; L994-I1003 PolarHBondContact N-O 3.12Å; H995-I1003 PolarHBondContact O-N 3.38Å; E1001-I1003 PolarHBondContact O-N 2.86Å
1004	T	67.1	Low	71.1	Confident	59 Å²	59	80.9 Å²	80.9	36%	0.362	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	145.8	176.2	60.1	0	0	0	0	112.1	E991 I992 I993 E1002	E991-T1004 HydrophobicContact CB-CG2 4.41Å; E991-T1004 PolarHBondContact OE2-OG1 3.42Å; E991-T1004 VanDerWaalsContact OE2-OG1 3.09Å; I992-T1004 CarbonylContact O-C 3.51Å; I992-T1004 WeakPolarHBondContact O-CA 3.27Å; I993-T1004 HydrophobicContact CG1-CG2 3.88Å; E1002-T1004 PolarHBondContact O-N 3.21Å
1005	Q	70.1	Confident	72.2	Confident	108 Å²	108	82.1 Å²	82.1	51%	0.505	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.2	169.2	-179.7	175.9	-5.1	0	0	108.9	E991 I992 L994 V1007	E991-Q1005 WeakPolarHBondContact CA-O 3.48Å; I992-Q1005 PolarHBondContact N-O 3.21Å; I992-Q1005 PolarHBondContact O-N 3.01Å; L994-Q1005 HydrophobicContact CD1-CB 3.86Å; L994-Q1005 HydrophobicContact CD2-CB 4.21Å; L994-Q1005 HydrophobicContact CG-CB 3.92Å; Q1005-V1007 PolarHBondContact O-N 3.5Å
1006	E	69	Low	73.1	Confident	85 Å²	85	78.3 Å²	78.3	40%	0.397	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	129.4	173.7	-66.6	-178.9	171.7	0	0	110.7	V988 E991 Y1008	V988-E1006 HydrophobicContact CG1-CB 4.05Å; V988-E1006 HydrophobicContact CG1-CG 4.2Å; V988-E1006 HydrophobicContact CG2-CB 4.37Å; V988-E1006 HydrophobicContact CG2-CG 4.47Å; E991-E1006 HydrophobicContact CG-CG 4.27Å; E1006-Y1008 HydrophobicContact CB-CE2 3.98Å; E1006-Y1008 VanDerWaalsContact OE2-CZ 3.25Å; E1006-Y1008 PolarHBondContact OE2-OH 2.71Å
1007	V	68.3	Low	75.1	Confident	27 Å²	27	71 Å²	71	16%	0.164	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	112.4	174.2	-177	0	0	0	0	108.5	V989 G990 I992 Q1005 K1012	V989-V1007 PolarHBondContact N-O 3.32Å; G990-V1007 PolarHBondContact N-O 2.87Å; G990-V1007 PolarHBondContact O-N 3.49Å; I992-V1007 HydrophobicContact CB-CG2 4.43Å; I992-V1007 HydrophobicContact CD1-CG2 3.29Å; I992-V1007 HydrophobicContact CG1-CG2 3.47Å; I992-V1007 VanDerWaalsContact CG1-CG2 3.47Å; Q1005-V1007 PolarHBondContact O-N 3.5Å; V1007-K1012 HydrophobicContact CG1-CG 4.36Å
1008	Y	73.1	Confident	76.4	Confident	102 Å²	102	73 Å²	73	40%	0.4	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	142.7	179.2	-64.7	-81.9	0	0	0	111.5	V988 E1006 M1010 E1011	V988-Y1008 HydrophobicContact CG2-CD1 3.99Å; V988-Y1008 HydrophobicContact CG2-CE1 3.58Å; E1006-Y1008 HydrophobicContact CB-CE2 3.98Å; E1006-Y1008 VanDerWaalsContact OE2-CZ 3.25Å; E1006-Y1008 PolarHBondContact OE2-OH 2.71Å; Y1008-M1010 PolarHBondContact O-N 3.39Å; Y1008-E1011 PolarHBondContact O-N 3.09Å
1009	R	77.1	Confident	77.6	Confident	19 Å²	19	71.5 Å²	71.5	7%	0.072	37%	0.371	C	S	.	.	H	α-helix	trans	-52.1	-43.1	177.4	-178.9	153.7	179.6	-132.9	-9.7	112.9	D521 I522 H523 G524 N986 P987 V989 E1011 K1012 W1013	D521-R1009 WeakPolarHBondContact O-CD 3.27Å; D521-R1009 VanDerWaalsContact O-CG 3.29Å; D521-R1009 WeakPolarHBondContact O-CG 3.45Å; D521-R1009 PolarHBondContact O-NE 3.36Å; I522-R1009 PolarHBondContact O-NE 3.42Å; I522-R1009 PolarHBondContact O-NH2 3.02Å; H523-R1009 PolarHBondContact O-NH2 2.95Å; G524-R1009 VanDerWaalsContact C-CZ 3.42Å; G524-R1009 VanDerWaalsContact C-NH2 3.33Å; G524-R1009 PolarHBondContact O-NE 2.83Å; G524-R1009 PolarHBondContact O-NH1 3.3Å; G524-R1009 PolarHBondContact O-NH2 3.36Å; G524-R1009 VanDerWaalsContact O-NH2 3.11Å; N986-R1009 PolarHBondContact OD1-N 2.73Å; P987-R1009 HydrophobicContact CG-CB 4.18Å; P987-R1009 PolarHBondContact O-N 3.34Å; V989-R1009 VanDerWaalsContact CG2-CA 3.46Å; V989-R1009 HydrophobicContact CG2-CB 3.44Å; V989-R1009 VanDerWaalsContact CG2-CB 3.44Å; V989-R1009 HydrophobicContact CG2-CG 4.19Å; R1009-E1011 PolarHBondContact O-N 3.22Å; R1009-K1012 PolarHBondContact O-N 3.36Å; R1009-W1013 PolarHBondContact O-N 3.16Å
1010	M	83	Confident	78.7	Confident	19 Å²	19	65 Å²	65	9%	0.094	34%	0.337	C	S	.	.	H	α-helix	trans	-60.1	-29.6	-178	-164.1	62.9	-177.4	0	0	112.9	A976 N986 Y1008 W1013 K1014 L1033	A976-M1010 HydrophobicContact CB-CE 3.63Å; N986-M1010 VanDerWaalsContact ND2-CB 3.27Å; N986-M1010 WeakPolarHBondContact ND2-CB 3.28Å; N986-M1010 PolarHBondContact OD1-N 2.85Å; Y1008-M1010 PolarHBondContact O-N 3.39Å; M1010-W1013 HydrophobicContact CE-CD2 4.42Å; M1010-W1013 HydrophobicContact CE-CE3 3.52Å; M1010-W1013 HydrophobicContact CE-CH2 4.24Å; M1010-W1013 HydrophobicContact CE-CZ3 3.42Å; M1010-W1013 VanDerWaalsContact CE-CZ3 3.42Å; M1010-W1013 HydrophobicContact SD-CD2 4.29Å; M1010-W1013 HydrophobicContact SD-CE3 3.79Å; M1010-W1013 HydrophobicContact SD-CZ3 4.3Å; M1010-K1014 WeakPolarHBondContact O-CB 3.38Å; M1010-K1014 WeakPolarHBondContact O-CG 3.3Å; M1010-K1014 PolarHBondContact O-N 3.23Å; M1010-L1033 HydrophobicContact CE-CD1 3.89Å
1011	E	82.6	Confident	80.1	Confident	109 Å²	109	67.6 Å²	67.6	51%	0.509	33%	0.327	S	S	.	.	H	α-helix	trans	-72.5	-45.7	179.2	-167	61.2	-163.9	0	0	111.4	Y1008 R1009 W1013 K1014 M1015	Y1008-E1011 PolarHBondContact O-N 3.09Å; R1009-E1011 PolarHBondContact O-N 3.22Å; E1011-W1013 VanDerWaalsContact C-N 3.29Å; E1011-W1013 PolarHBondContact O-N 2.82Å; E1011-K1014 PolarHBondContact O-N 2.99Å; E1011-M1015 WeakPolarHBondContact O-CG 3.31Å; E1011-M1015 PolarHBondContact O-N 3.21Å
1012	K	84.4	Confident	82	Confident	59 Å²	59	61 Å²	61	26%	0.257	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-40	173.4	-67.1	-172	-178.9	-171.8	0	111.5	D521 I522 V1007 R1009 M1015 S1016	D521-K1012 HydrophobicContact CB-CD 3.89Å; D521-K1012 IonicContact OD2-NZ 3.41Å; D521-K1012 PolarHBondContact OD2-NZ 3.44Å; I522-K1012 HydrophobicContact CG1-CB 4.26Å; V1007-K1012 HydrophobicContact CG1-CG 4.36Å; R1009-K1012 PolarHBondContact O-N 3.36Å; K1012-M1015 PolarHBondContact O-N 3.33Å; K1012-S1016 WeakPolarHBondContact O-CB 3.3Å; K1012-S1016 PolarHBondContact O-N 3.04Å
1013	W	90.7	Very high	83.6	Confident	4 Å²	4	58 Å²	58	2%	0.015	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-43.6	174.9	178.2	93.4	0	0	0	112.2	I522 L972 A976 R1009 M1010 E1011 S1016 L1017 H1029 L1033	I522-W1013 HydrophobicContact CG2-CB 4.43Å; L972-W1013 HydrophobicContact CD2-CH2 4.34Å; L972-W1013 HydrophobicContact CD2-CZ2 4.18Å; L972-W1013 HydrophobicContact CG-CH2 4.11Å; L972-W1013 HydrophobicContact CG-CZ2 4.42Å; A976-W1013 HydrophobicContact CB-CH2 4.05Å; A976-W1013 HydrophobicContact CB-CZ3 3.89Å; R1009-W1013 PolarHBondContact O-N 3.16Å; M1010-W1013 HydrophobicContact CE-CD2 4.42Å; M1010-W1013 HydrophobicContact CE-CE3 3.52Å; M1010-W1013 HydrophobicContact CE-CH2 4.24Å; M1010-W1013 HydrophobicContact CE-CZ3 3.42Å; M1010-W1013 VanDerWaalsContact CE-CZ3 3.42Å; M1010-W1013 HydrophobicContact SD-CD2 4.29Å; M1010-W1013 HydrophobicContact SD-CE3 3.79Å; M1010-W1013 HydrophobicContact SD-CZ3 4.3Å; E1011-W1013 VanDerWaalsContact C-N 3.29Å; E1011-W1013 PolarHBondContact O-N 2.82Å; W1013-S1016 PolarHBondContact O-N 3.29Å; W1013-L1017 HydrophobicContact CE3-CD2 4.47Å; W1013-L1017 HydrophobicContact CH2-CD2 3.3Å; W1013-L1017 HydrophobicContact CZ2-CD2 3.78Å; W1013-L1017 HydrophobicContact CZ3-CD2 3.69Å; W1013-L1017 WeakPolarHBondContact O-CB 3.35Å; W1013-L1017 PolarHBondContact O-N 3.24Å; W1013-H1029 AromaticContact CD1-CD2 3.75Å; W1013-H1029 AromaticContact CE2-CD2 3.97Å; W1013-H1029 HydrophobicContact CZ2-CB 3.91Å; W1013-H1029 WeakPolarHBondContact CZ2-O 3.43Å; W1013-H1029 AromaticContact NE1-CD2 3.53Å; W1013-H1029 AromaticContact NE1-CG 3.95Å; W1013-H1029 PolarHBondContact NE1-O 3.14Å; W1013-L1033 HydrophobicContact CH2-CB 4.22Å; W1013-L1033 HydrophobicContact CH2-CD2 4Å; W1013-L1033 HydrophobicContact CZ2-CB 3.77Å; W1013-L1033 HydrophobicContact CZ2-CD2 4.35Å
1014	K	91.2	Very high	84.8	Confident	53 Å²	53	54.4 Å²	54.4	23%	0.23	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-42.9	176	-78.1	173.8	174	-169.9	0	112.1	L973 D977 M1010 E1011 L1017 S1018	L973-K1014 HydrophobicContact CD2-CB 3.92Å; L973-K1014 HydrophobicContact CD2-CG 3.85Å; D977-K1014 VanDerWaalsContact OD1-CE 3.24Å; D977-K1014 WeakPolarHBondContact OD1-CE 3.39Å; D977-K1014 IonicContact OD1-NZ 3Å; D977-K1014 PolarHBondContact OD1-NZ 3.42Å; M1010-K1014 WeakPolarHBondContact O-CB 3.38Å; M1010-K1014 WeakPolarHBondContact O-CG 3.3Å; M1010-K1014 PolarHBondContact O-N 3.23Å; E1011-K1014 PolarHBondContact O-N 2.99Å; K1014-L1017 PolarHBondContact O-N 3.08Å; K1014-S1018 PolarHBondContact O-N 3Å
1015	M	90.1	Very high	86.1	Confident	116 Å²	116	51.9 Å²	51.9	57%	0.571	25%	0.248	S	C	*	.	H	α-helix	trans	-61.1	-49.6	175.5	-69	-180	69.6	0	0	111.2	E1011 K1012 L1017 S1018 D1019	E1011-M1015 WeakPolarHBondContact O-CG 3.31Å; E1011-M1015 PolarHBondContact O-N 3.21Å; K1012-M1015 PolarHBondContact O-N 3.33Å; M1015-L1017 VanDerWaalsContact C-N 3.33Å; M1015-L1017 PolarHBondContact O-N 2.85Å; M1015-S1018 PolarHBondContact O-N 3.15Å; M1015-S1018 VanDerWaalsContact O-N 3.15Å; M1015-S1018 PolarHBondContact O-OG 3.17Å; M1015-D1019 PolarHBondContact O-N 3.27Å
1016	S	91.3	Very high	87.2	Confident	28 Å²	28	46.7 Å²	46.7	20%	0.196	22%	0.224	C	C	.	.	H	α-helix	trans	-59	-43.3	176.9	-178.2	0	0	0	0	112.3	K1012 W1013 S1018 D1019 A1020 H1029	K1012-S1016 WeakPolarHBondContact O-CB 3.3Å; K1012-S1016 PolarHBondContact O-N 3.04Å; W1013-S1016 PolarHBondContact O-N 3.29Å; S1016-S1018 VanDerWaalsContact C-N 3.33Å; S1016-S1018 PolarHBondContact O-N 3.02Å; S1016-D1019 PolarHBondContact O-N 3Å; S1016-A1020 PolarHBondContact O-N 2.87Å; S1016-H1029 VanDerWaalsContact CB-NE2 3.35Å; S1016-H1029 WeakPolarHBondContact CB-NE2 3.48Å; S1016-H1029 PolarHBondContact OG-CE1 3.25Å; S1016-H1029 PolarHBondContact OG-NE2 3.02Å
1017	L	93.7	Very high	88.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.6	-38.2	176.7	179.9	57.8	0	0	0	111.9	A969 L972 L973 W1013 K1014 M1015 D1019 A1020 V1026 H1029	A969-L1017 HydrophobicContact CB-CD1 3.83Å; A969-L1017 HydrophobicContact CB-CG 4.26Å; A969-L1017 WeakPolarHBondContact CB-O 3.46Å; L972-L1017 HydrophobicContact CB-CD2 3.96Å; L972-L1017 HydrophobicContact CD2-CD1 4.04Å; L972-L1017 HydrophobicContact CD2-CD2 3.83Å; L972-L1017 HydrophobicContact CG-CD2 3.76Å; L973-L1017 HydrophobicContact CD2-CB 4.27Å; L973-L1017 HydrophobicContact CD2-CD2 3.77Å; L973-L1017 HydrophobicContact CD2-CG 4.18Å; L973-L1017 HydrophobicContact CG-CD2 3.68Å; L973-L1017 HydrophobicContact CG-CG 3.98Å; W1013-L1017 HydrophobicContact CE3-CD2 4.47Å; W1013-L1017 HydrophobicContact CH2-CD2 3.3Å; W1013-L1017 HydrophobicContact CZ2-CD2 3.78Å; W1013-L1017 HydrophobicContact CZ3-CD2 3.69Å; W1013-L1017 WeakPolarHBondContact O-CB 3.35Å; W1013-L1017 PolarHBondContact O-N 3.24Å; K1014-L1017 PolarHBondContact O-N 3.08Å; M1015-L1017 VanDerWaalsContact C-N 3.33Å; M1015-L1017 PolarHBondContact O-N 2.85Å; L1017-D1019 PolarHBondContact O-N 3.09Å; L1017-A1020 HydrophobicContact CD1-CB 4.27Å; L1017-A1020 VanDerWaalsContact O-CB 3.26Å; L1017-A1020 WeakPolarHBondContact O-CB 3.45Å; L1017-A1020 PolarHBondContact O-N 2.96Å; L1017-V1026 HydrophobicContact CD1-CG1 4.41Å; L1017-H1029 HydrophobicContact CD1-CB 3.81Å; L1017-H1029 PolarHBondContact N-NE2 2.86Å
1018	S	92.1	Very high	89.5	Confident	58 Å²	58	42 Å²	42	41%	0.406	20%	0.2	S	C	.	.	H	α-helix	trans	-63.5	-25.1	177.6	75.6	0	0	0	0	113.3	K1014 M1015 S1016 R1021	K1014-S1018 PolarHBondContact O-N 3Å; M1015-S1018 PolarHBondContact O-N 3.15Å; M1015-S1018 VanDerWaalsContact O-N 3.15Å; M1015-S1018 PolarHBondContact O-OG 3.17Å; S1016-S1018 VanDerWaalsContact C-N 3.33Å; S1016-S1018 PolarHBondContact O-N 3.02Å; S1018-R1021 PolarHBondContact O-NH1 3.32Å
1019	D	90.9	Very high	90.5	Very high	114 Å²	114	37.1 Å²	37.1	61%	0.61	18%	0.181	S	C	*	.	H	α-helix	trans	-91.8	-8.6	175.7	-72.9	-26.4	0	0	0	113.5	M1015 S1016 L1017 R1021	M1015-D1019 PolarHBondContact O-N 3.27Å; S1016-D1019 PolarHBondContact O-N 3Å; L1017-D1019 PolarHBondContact O-N 3.09Å; D1019-R1021 PolarHBondContact O-N 2.9Å; D1019-R1021 PolarHBondContact O-NH1 3.46Å
1020	A	92	Very high	91.2	Very high	3 Å²	3	36.3 Å²	36.3	3%	0.025	18%	0.178	C	C	.	.			trans	-63.3	135.6	177.1	0	0	0	0	0	111.2	A969 S1016 L1017 S1025 V1026	A969-A1020 HydrophobicContact CB-CB 4.39Å; S1016-A1020 PolarHBondContact O-N 2.87Å; L1017-A1020 HydrophobicContact CD1-CB 4.27Å; L1017-A1020 VanDerWaalsContact O-CB 3.26Å; L1017-A1020 WeakPolarHBondContact O-CB 3.45Å; L1017-A1020 PolarHBondContact O-N 2.96Å; A1020-S1025 WeakPolarHBondContact CB-OG 3.43Å; A1020-V1026 HydrophobicContact CB-CG2 4.12Å
1021	R	92	Very high	91.5	Very high	115 Å²	115	36.3 Å²	36.3	43%	0.434	18%	0.181	S	C	.	.			trans	-125.5	-29	178.7	-57.3	-66	175.5	-96.2	-4.5	113.5	K593 G965 S1018 D1019	K593-R1021 WeakPolarHBondContact O-CB 3.35Å; G965-R1021 WeakPolarHBondContact CA-O 3.37Å; S1018-R1021 PolarHBondContact O-NH1 3.32Å; D1019-R1021 PolarHBondContact O-N 2.9Å; D1019-R1021 PolarHBondContact O-NH1 3.46Å
1022	T	92.7	Very high	91.7	Very high	10 Å²	10	31.5 Å²	31.5	6%	0.061	16%	0.159	C	C	.	.	S	Bend	trans	-91.1	149.1	177.7	63.1	0	0	0	0	111.8	T542 S1024 S1025 V1026	T542-T1022 HydrophobicContact CG2-CG2 4.45Å; T1022-S1024 VanDerWaalsContact C-N 3.27Å; T1022-S1024 PolarHBondContact O-N 3.4Å; T1022-S1025 PolarHBondContact O-N 3.37Å; T1022-S1025 VanDerWaalsContact O-N 3.13Å; T1022-S1025 WeakPolarHBondContact OG1-CB 3.47Å; T1022-S1025 PolarHBondContact OG1-N 3.23Å; T1022-V1026 PolarHBondContact O-N 3.47Å; T1022-V1026 VanDerWaalsContact O-N 3.15Å
1023	Y	94.7	Very high	91.9	Very high	52 Å²	52	28.8 Å²	28.8	20%	0.204	15%	0.147	C	C	.	.	H	α-helix	trans	-59.3	-37.4	175.1	-60	-52.3	0	0	0	112.4	E912 L915 K963 Y968 S1025 V1026 L1027	E912-Y1023 HydrophobicContact CB-CD2 3.9Å; E912-Y1023 HydrophobicContact CB-CE2 3.59Å; E912-Y1023 HydrophobicContact CB-CG 4.5Å; E912-Y1023 VanDerWaalsContact CD-OH 3.29Å; E912-Y1023 HydrophobicContact CG-CE1 4.2Å; E912-Y1023 HydrophobicContact CG-CE2 3.9Å; E912-Y1023 PolarHBondContact OE2-OH 3.38Å; L915-Y1023 HydrophobicContact CD2-CD1 3.58Å; L915-Y1023 HydrophobicContact CD2-CE1 4.49Å; L915-Y1023 HydrophobicContact CD2-CG 4.2Å; K963-Y1023 PolarHBondContact O-OH 2.92Å; Y968-Y1023 HydrophobicContact CD2-CD1 4.23Å; Y968-Y1023 AromaticContact CD2-CE1 3.88Å; Y968-Y1023 HydrophobicContact CD2-CE1 3.88Å; Y968-Y1023 HydrophobicContact CE2-CE1 4.13Å; Y1023-S1025 VanDerWaalsContact C-N 3.33Å; Y1023-S1025 PolarHBondContact O-N 2.61Å; Y1023-V1026 PolarHBondContact O-N 2.92Å; Y1023-L1027 WeakPolarHBondContact O-CB 3.41Å; Y1023-L1027 WeakPolarHBondContact O-CG 3.45Å; Y1023-L1027 PolarHBondContact O-N 3.34Å
1024	S	94.5	Very high	91.7	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-62	-38.4	175.3	-60.2	0	0	0	0	112.5	Y539 T1022 L1027 L1028	Y539-S1024 WeakPolarHBondContact O-CA 3.44Å; Y539-S1024 VanDerWaalsContact O-CB 3.24Å; Y539-S1024 WeakPolarHBondContact O-CB 3.39Å; Y539-S1024 PolarHBondContact O-OG 3.22Å; T1022-S1024 VanDerWaalsContact C-N 3.27Å; T1022-S1024 PolarHBondContact O-N 3.4Å; S1024-L1027 PolarHBondContact O-N 3.17Å; S1024-L1028 PolarHBondContact O-N 3.12Å
1025	S	93.6	Very high	91.3	Very high	5 Å²	5	32.2 Å²	32.2	4%	0.035	17%	0.168	C	C	.	.	H	α-helix	trans	-65.6	-44.1	175.3	-173.5	0	0	0	0	110.8	E543 A1020 T1022 Y1023 L1027 L1028 H1029	E543-S1025 VanDerWaalsContact CD-CB 3.48Å; E543-S1025 VanDerWaalsContact CD-OG 3.31Å; E543-S1025 PolarHBondContact OE1-OG 3.4Å; A1020-S1025 WeakPolarHBondContact CB-OG 3.43Å; T1022-S1025 PolarHBondContact O-N 3.37Å; T1022-S1025 VanDerWaalsContact O-N 3.13Å; T1022-S1025 WeakPolarHBondContact OG1-CB 3.47Å; T1022-S1025 PolarHBondContact OG1-N 3.23Å; Y1023-S1025 VanDerWaalsContact C-N 3.33Å; Y1023-S1025 PolarHBondContact O-N 2.61Å; S1025-L1027 PolarHBondContact O-N 2.93Å; S1025-L1028 PolarHBondContact O-N 3.23Å; S1025-H1029 PolarHBondContact O-N 3.42Å; S1025-H1029 PolarHBondContact O-ND1 3.05Å
1026	V	94.9	Very high	91	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.1	-39.7	175.7	-175.7	0	0	0	0	111.8	L915 G965 A969 L972 L1017 A1020 T1022 Y1023 H1029 L1030	L915-V1026 HydrophobicContact CD1-CB 4.33Å; L915-V1026 HydrophobicContact CD1-CG1 3.89Å; L915-V1026 HydrophobicContact CD2-CB 4.13Å; L915-V1026 HydrophobicContact CD2-CG1 4.18Å; G965-V1026 WeakPolarHBondContact O-CG2 3.33Å; A969-V1026 HydrophobicContact CB-CG2 4.02Å; L972-V1026 HydrophobicContact CD2-CG1 3.94Å; L1017-V1026 HydrophobicContact CD1-CG1 4.41Å; A1020-V1026 HydrophobicContact CB-CG2 4.12Å; T1022-V1026 PolarHBondContact O-N 3.47Å; T1022-V1026 VanDerWaalsContact O-N 3.15Å; Y1023-V1026 PolarHBondContact O-N 2.92Å; V1026-H1029 PolarHBondContact O-N 3.24Å; V1026-L1030 WeakPolarHBondContact O-CB 3.28Å; V1026-L1030 PolarHBondContact O-N 2.86Å
1027	L	93.9	Very high	90.7	Very high	12 Å²	12	26.4 Å²	26.4	6%	0.063	14%	0.138	C	C	.	.	H	α-helix	trans	-61.2	-41.9	174.5	-85.1	171	0	0	0	112.4	T540 V911 L915 Y1023 S1024 S1025 H1029 L1030 A1031	T540-L1027 HydrophobicContact CG2-CB 4.41Å; V911-L1027 HydrophobicContact CG1-CD1 3.52Å; L915-L1027 HydrophobicContact CB-CD1 4.25Å; L915-L1027 HydrophobicContact CB-CD2 4Å; L915-L1027 HydrophobicContact CB-CG 3.91Å; L915-L1027 HydrophobicContact CD1-CD2 3.85Å; L915-L1027 HydrophobicContact CD1-CG 3.9Å; L915-L1027 HydrophobicContact CG-CG 4.41Å; Y1023-L1027 WeakPolarHBondContact O-CB 3.41Å; Y1023-L1027 WeakPolarHBondContact O-CG 3.45Å; Y1023-L1027 PolarHBondContact O-N 3.34Å; S1024-L1027 PolarHBondContact O-N 3.17Å; S1025-L1027 PolarHBondContact O-N 2.93Å; L1027-H1029 VanDerWaalsContact C-N 3.33Å; L1027-H1029 PolarHBondContact O-N 3.49Å; L1027-L1030 HydrophobicContact CD2-CD2 4.21Å; L1027-L1030 WeakPolarHBondContact O-CB 3.5Å; L1027-L1030 PolarHBondContact O-N 3.48Å; L1027-A1031 WeakPolarHBondContact O-CB 3.16Å; L1027-A1031 PolarHBondContact O-N 2.75Å
1028	L	91.8	Very high	90.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.1	-41.8	175.8	-173.9	64.9	0	0	0	111.2	L534 P535 E543 S1024 S1025 A1031 T1032	L534-L1028 HydrophobicContact CB-CD1 4.31Å; L534-L1028 HydrophobicContact CD1-CD2 4.33Å; L534-L1028 HydrophobicContact CD2-CD1 4.24Å; L534-L1028 HydrophobicContact CD2-CD2 4.36Å; P535-L1028 HydrophobicContact CG-CD1 4.29Å; E543-L1028 HydrophobicContact CB-CD2 4.31Å; E543-L1028 HydrophobicContact CG-CB 4.32Å; E543-L1028 HydrophobicContact CG-CD2 3.52Å; S1024-L1028 PolarHBondContact O-N 3.12Å; S1025-L1028 PolarHBondContact O-N 3.23Å; L1028-A1031 PolarHBondContact O-N 3.02Å; L1028-T1032 PolarHBondContact O-N 2.96Å; L1028-T1032 PolarHBondContact O-OG1 2.83Å
1029	H	92.6	Very high	89.8	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.8	-39.5	173.9	-72.4	83.1	0	0	0	112	L972 W1013 S1016 L1017 S1025 V1026 L1027 T1032 L1033	L972-H1029 HydrophobicContact CD2-CB 4.23Å; W1013-H1029 AromaticContact CD1-CD2 3.75Å; W1013-H1029 AromaticContact CE2-CD2 3.97Å; W1013-H1029 HydrophobicContact CZ2-CB 3.91Å; W1013-H1029 WeakPolarHBondContact CZ2-O 3.43Å; W1013-H1029 AromaticContact NE1-CD2 3.53Å; W1013-H1029 AromaticContact NE1-CG 3.95Å; W1013-H1029 PolarHBondContact NE1-O 3.14Å; S1016-H1029 VanDerWaalsContact CB-NE2 3.35Å; S1016-H1029 WeakPolarHBondContact CB-NE2 3.48Å; S1016-H1029 PolarHBondContact OG-CE1 3.25Å; S1016-H1029 PolarHBondContact OG-NE2 3.02Å; L1017-H1029 HydrophobicContact CD1-CB 3.81Å; L1017-H1029 PolarHBondContact N-NE2 2.86Å; S1025-H1029 PolarHBondContact O-N 3.42Å; S1025-H1029 PolarHBondContact O-ND1 3.05Å; V1026-H1029 PolarHBondContact O-N 3.24Å; L1027-H1029 VanDerWaalsContact C-N 3.33Å; L1027-H1029 PolarHBondContact O-N 3.49Å; H1029-T1032 WeakPolarHBondContact O-CB 3.34Å; H1029-T1032 PolarHBondContact O-N 2.86Å; H1029-L1033 PolarHBondContact O-N 3.4Å
1030	L	92.2	Very high	89	Confident	3 Å²	3	28.6 Å²	28.6	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-60	-48.2	175.6	178.7	66.6	0	0	0	111.1	L915 R918 M922 L972 V1026 L1027 T1032 L1033 E1034	L915-L1030 HydrophobicContact CD1-CD2 4.2Å; R918-L1030 HydrophobicContact CB-CD2 3.73Å; M922-L1030 HydrophobicContact CE-CD1 3.16Å; M922-L1030 HydrophobicContact SD-CD1 3.47Å; M922-L1030 WeakPolarHBondContact SD-CD1 3.43Å; M922-L1030 HydrophobicContact SD-CG 4.48Å; L972-L1030 HydrophobicContact CD1-CD1 3.68Å; L972-L1030 HydrophobicContact CD2-CB 4.05Å; L972-L1030 HydrophobicContact CD2-CD1 4.44Å; V1026-L1030 WeakPolarHBondContact O-CB 3.28Å; V1026-L1030 PolarHBondContact O-N 2.86Å; L1027-L1030 HydrophobicContact CD2-CD2 4.21Å; L1027-L1030 WeakPolarHBondContact O-CB 3.5Å; L1027-L1030 PolarHBondContact O-N 3.48Å; L1030-T1032 VanDerWaalsContact C-N 3.28Å; L1030-T1032 PolarHBondContact O-N 3.31Å; L1030-L1033 PolarHBondContact O-N 3.32Å; L1030-E1034 PolarHBondContact O-N 3.35Å
1031	A	88.9	Confident	88.2	Confident	18 Å²	18	33 Å²	33	15%	0.149	16%	0.156	C	C	.	.	H	α-helix	trans	-60.5	-39.6	175.1	0	0	0	0	0	111.6	P535 L1027 L1028 E1034 N1035	P535-A1031 HydrophobicContact CG-CB 4.24Å; L1027-A1031 WeakPolarHBondContact O-CB 3.16Å; L1027-A1031 PolarHBondContact O-N 2.75Å; L1028-A1031 PolarHBondContact O-N 3.02Å; A1031-E1034 PolarHBondContact O-N 3.05Å; A1031-N1035 PolarHBondContact O-N 2.66Å; A1031-N1035 VanDerWaalsContact O-N 3.09Å
1032	T	87.5	Confident	87.4	Confident	9 Å²	9	27.6 Å²	27.6	6%	0.055	14%	0.135	C	C	.	.	H	α-helix	trans	-62.9	-44.8	175.6	-53.7	0	0	0	0	111.6	H523 L1028 H1029 L1030 N1035 C1036	H523-T1032 PolarHBondContact ND1-OG1 2.97Å; L1028-T1032 PolarHBondContact O-N 2.96Å; L1028-T1032 PolarHBondContact O-OG1 2.83Å; H1029-T1032 WeakPolarHBondContact O-CB 3.34Å; H1029-T1032 PolarHBondContact O-N 2.86Å; L1030-T1032 VanDerWaalsContact C-N 3.28Å; L1030-T1032 PolarHBondContact O-N 3.31Å; T1032-N1035 PolarHBondContact O-N 2.93Å; T1032-C1036 PolarHBondContact O-N 3.37Å; T1032-C1036 VanDerWaalsContact O-N 3.15Å; T1032-C1036 PolarHBondContact O-SG 3.43Å
1033	L	88.5	Confident	86.2	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-43.8	176.8	178.6	59.2	0	0	0	111.5	M922 L972 A976 I979 M1010 W1013 H1029 L1030 N1035 C1036 I1037	M922-L1033 HydrophobicContact CE-CD2 3.93Å; L972-L1033 HydrophobicContact CD1-CD2 3.79Å; A976-L1033 HydrophobicContact CB-CD1 4.47Å; A976-L1033 HydrophobicContact CB-CD2 3.89Å; I979-L1033 HydrophobicContact CD1-CD1 4.41Å; I979-L1033 HydrophobicContact CD1-CD2 4.48Å; M1010-L1033 HydrophobicContact CE-CD1 3.89Å; W1013-L1033 HydrophobicContact CH2-CB 4.22Å; W1013-L1033 HydrophobicContact CH2-CD2 4Å; W1013-L1033 HydrophobicContact CZ2-CB 3.77Å; W1013-L1033 HydrophobicContact CZ2-CD2 4.35Å; H1029-L1033 PolarHBondContact O-N 3.4Å; L1030-L1033 PolarHBondContact O-N 3.32Å; L1033-N1035 VanDerWaalsContact C-N 3.25Å; L1033-N1035 PolarHBondContact O-N 3.15Å; L1033-C1036 PolarHBondContact O-N 2.94Å; L1033-I1037 HydrophobicContact CD1-CG1 4.48Å; L1033-I1037 HydrophobicContact CG-CD1 4.22Å; L1033-I1037 WeakPolarHBondContact O-CG1 3.38Å; L1033-I1037 PolarHBondContact O-N 3.07Å
1034	E	87.3	Confident	84.8	Confident	27 Å²	27	28 Å²	28	13%	0.126	15%	0.145	C	C	.	.	H	α-helix	trans	-57.8	-40.4	178.1	-174.8	169	-164.3	0	0	111.9	R918 M922 R925 L1030 A1031 C1036 I1037 W1039	R918-E1034 IonicContact CZ-OE2 2.64Å; R918-E1034 IonicContact NH1-OE1 3.92Å; R918-E1034 IonicContact NH1-OE2 3.4Å; R918-E1034 PolarHBondContact NH1-OE2 3.31Å; R918-E1034 IonicContact NH2-OE2 3.35Å; R918-E1034 PolarHBondContact NH2-OE2 3.18Å; M922-E1034 HydrophobicContact SD-CB 4.28Å; R925-E1034 IonicContact CZ-OE1 3.09Å; R925-E1034 IonicContact NH1-OE1 3.96Å; R925-E1034 PolarHBondContact NH1-OE1 3.36Å; R925-E1034 IonicContact NH2-OE1 2.76Å; R925-E1034 PolarHBondContact NH2-OE1 3.24Å; R925-E1034 VanDerWaalsContact NH2-OE1 3.09Å; L1030-E1034 PolarHBondContact O-N 3.35Å; A1031-E1034 PolarHBondContact O-N 3.05Å; E1034-C1036 VanDerWaalsContact C-N 3.32Å; E1034-I1037 PolarHBondContact O-N 3.41Å; E1034-W1039 HydrophobicContact CG-CZ2 4.1Å; E1034-W1039 PolarHBondContact O-NE1 2.8Å
1035	N	81.7	Confident	83.7	Confident	103 Å²	103	32.2 Å²	32.2	55%	0.551	17%	0.165	S	C	*	.	H	α-helix	trans	-72	-22.9	176.2	-70.7	-14.7	0	0	0	113.5	A1031 T1032 L1033	A1031-N1035 PolarHBondContact O-N 2.66Å; A1031-N1035 VanDerWaalsContact O-N 3.09Å; T1032-N1035 PolarHBondContact O-N 2.93Å; L1033-N1035 VanDerWaalsContact C-N 3.25Å; L1033-N1035 PolarHBondContact O-N 3.15Å
1036	C	83.5	Confident	82.8	Confident	13 Å²	13	34.6 Å²	34.6	9%	0.088	18%	0.176	C	C	.	.	H	α-helix	trans	-83.5	-13	175.3	-64.1	0	0	0	0	113.1	I984 E985 T1032 L1033 E1034	I984-C1036 HydrophobicContact CG2-CB 4.45Å; E985-C1036 PolarHBondContact N-O 2.78Å; T1032-C1036 PolarHBondContact O-N 3.37Å; T1032-C1036 VanDerWaalsContact O-N 3.15Å; T1032-C1036 PolarHBondContact O-SG 3.43Å; L1033-C1036 PolarHBondContact O-N 2.94Å; E1034-C1036 VanDerWaalsContact C-N 3.32Å
1037	I	85.2	Confident	82.2	Confident	8 Å²	8	41.8 Å²	41.8	4%	0.041	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-81.3	127.5	179.5	-67	160.8	0	0	0	110	M922 L926 M931 I979 L1033 E1034 W1039	M922-I1037 HydrophobicContact SD-CD1 4.38Å; L926-I1037 HydrophobicContact CD1-CD1 4.5Å; L926-I1037 HydrophobicContact CD2-CD1 4.16Å; M931-I1037 HydrophobicContact CE-CG2 3.5Å; M931-I1037 VanDerWaalsContact CE-CG2 3.5Å; I979-I1037 HydrophobicContact CD1-CD1 3.88Å; I979-I1037 HydrophobicContact CD1-CG1 4.18Å; L1033-I1037 HydrophobicContact CD1-CG1 4.48Å; L1033-I1037 HydrophobicContact CG-CD1 4.22Å; L1033-I1037 WeakPolarHBondContact O-CG1 3.38Å; L1033-I1037 PolarHBondContact O-N 3.07Å; E1034-I1037 PolarHBondContact O-N 3.41Å; I1037-W1039 HydrophobicContact CB-CD2 4.37Å; I1037-W1039 HydrophobicContact CB-CZ2 4.14Å; I1037-W1039 HydrophobicContact CD1-CH2 4.32Å; I1037-W1039 HydrophobicContact CD1-CZ2 3.76Å; I1037-W1039 HydrophobicContact CG2-CD2 3.71Å; I1037-W1039 HydrophobicContact CG2-CE3 4.1Å; I1037-W1039 HydrophobicContact CG2-CG 4.11Å; I1037-W1039 HydrophobicContact CG2-CH2 4.32Å; I1037-W1039 HydrophobicContact CG2-CZ2 3.93Å; I1037-W1039 HydrophobicContact CG2-CZ3 4.39Å; I1037-W1039 PolarHBondContact O-N 3.41Å
1038	I	84.8	Confident	81.8	Confident	37 Å²	37	41.2 Å²	41.2	19%	0.19	20%	0.2	C	C	.	.			trans	-77.8	73.2	176.6	-49.5	171.3	0	0	0	109.4	Y983 E985 Q1040 K1041	Y983-I1038 PolarHBondContact O-N 3.06Å; E985-I1038 HydrophobicContact CB-CD1 4.38Å; E985-I1038 HydrophobicContact CB-CG1 4.11Å; I1038-Q1040 PolarHBondContact O-N 3.36Å; I1038-K1041 HydrophobicContact CB-CD 4.38Å; I1038-K1041 HydrophobicContact CG2-CD 4.04Å; I1038-K1041 HydrophobicContact CG2-CG 3.86Å; I1038-K1041 PolarHBondContact O-N 3.17Å
1039	W	83.3	Confident	81.5	Confident	45 Å²	45	45.1 Å²	45.1	17%	0.17	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-58.5	-20.9	-177.8	-67.2	106.7	0	0	0	113.7	M922 R925 L926 M931 E1034 I1037 K1041 S1042	M922-W1039 HydrophobicContact CG-CH2 4.47Å; M922-W1039 HydrophobicContact CG-CZ2 4.48Å; R925-W1039 HydrophobicContact CB-CH2 4.15Å; R925-W1039 HydrophobicContact CB-CZ3 4.16Å; L926-W1039 HydrophobicContact CD2-CH2 4.03Å; L926-W1039 HydrophobicContact CD2-CZ3 4.29Å; L926-W1039 HydrophobicContact CG-CH2 4.12Å; M931-W1039 HydrophobicContact SD-CE3 4.26Å; M931-W1039 HydrophobicContact SD-CZ3 4.29Å; E1034-W1039 HydrophobicContact CG-CZ2 4.1Å; E1034-W1039 PolarHBondContact O-NE1 2.8Å; I1037-W1039 HydrophobicContact CB-CD2 4.37Å; I1037-W1039 HydrophobicContact CB-CZ2 4.14Å; I1037-W1039 HydrophobicContact CD1-CH2 4.32Å; I1037-W1039 HydrophobicContact CD1-CZ2 3.76Å; I1037-W1039 HydrophobicContact CG2-CD2 3.71Å; I1037-W1039 HydrophobicContact CG2-CE3 4.1Å; I1037-W1039 HydrophobicContact CG2-CG 4.11Å; I1037-W1039 HydrophobicContact CG2-CH2 4.32Å; I1037-W1039 HydrophobicContact CG2-CZ2 3.93Å; I1037-W1039 HydrophobicContact CG2-CZ3 4.39Å; I1037-W1039 PolarHBondContact O-N 3.41Å; W1039-K1041 PolarHBondContact O-N 2.87Å; W1039-S1042 WeakPolarHBondContact O-CB 3.35Å; W1039-S1042 PolarHBondContact O-N 3.27Å; W1039-S1042 PolarHBondContact O-OG 3.05Å
1040	Q	74.3	Confident	81.3	Confident	136 Å²	136	49.1 Å²	49.1	64%	0.636	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-64.8	-20.8	175.1	-55.7	84.3	-5.9	0	0	112.7	I1038	I1038-Q1040 PolarHBondContact O-N 3.36Å
1041	K	74.6	Confident	81.1	Confident	97 Å²	97	51.3 Å²	51.3	42%	0.422	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-89.3	-1.5	173.6	-64.1	-178.1	-175.4	177.2	0	113	K982 Y983 I1038 W1039	K982-K1041 PolarHBondContact O-NZ 3.05Å; Y983-K1041 HydrophobicContact CD1-CB 3.7Å; Y983-K1041 HydrophobicContact CD1-CD 4.06Å; Y983-K1041 HydrophobicContact CE1-CB 3.79Å; Y983-K1041 HydrophobicContact CE1-CD 4.43Å; I1038-K1041 HydrophobicContact CB-CD 4.38Å; I1038-K1041 HydrophobicContact CG2-CD 4.04Å; I1038-K1041 HydrophobicContact CG2-CG 3.86Å; I1038-K1041 PolarHBondContact O-N 3.17Å; W1039-K1041 PolarHBondContact O-N 2.87Å
1042	S	74.3	Confident	80.9	Confident	1 Å²	1	59 Å²	59	1%	0.007	28%	0.279	C	S	.	.	S	Bend	trans	-65	152	179.7	79.9	0	0	0	0	111.5	W1039 S1044 Q1045 M1046	W1039-S1042 WeakPolarHBondContact O-CB 3.35Å; W1039-S1042 PolarHBondContact O-N 3.27Å; W1039-S1042 PolarHBondContact O-OG 3.05Å; S1042-S1044 PolarHBondContact O-N 3.46Å; S1042-S1044 PolarHBondContact OG-OG 3.16Å; S1042-Q1045 PolarHBondContact O-N 2.74Å; S1042-Q1045 VanDerWaalsContact O-N 3.12Å; S1042-Q1045 WeakPolarHBondContact OG-CG 3.42Å; S1042-Q1045 PolarHBondContact OG-N 3.19Å; S1042-M1046 VanDerWaalsContact O-CG 3.25Å; S1042-M1046 WeakPolarHBondContact O-CG 3.15Å; S1042-M1046 PolarHBondContact O-N 2.88Å
1043	L	68.1	Low	80.7	Confident	10 Å²	10	67.4 Å²	67.4	5%	0.052	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.4	176.6	-66.5	-177.1	0	0	0	113.8	S929 R930 Q1045 M1046 T1057 F1062	S929-L1043 WeakPolarHBondContact O-CD1 3.15Å; S929-L1043 WeakPolarHBondContact O-CG 3.29Å; R930-L1043 HydrophobicContact CB-CD1 3.46Å; R930-L1043 VanDerWaalsContact CB-CD1 3.46Å; R930-L1043 HydrophobicContact CB-CG 4.37Å; R930-L1043 HydrophobicContact CG-CD1 3.43Å; R930-L1043 VanDerWaalsContact CG-CD1 3.43Å; L1043-Q1045 VanDerWaalsContact C-N 3.26Å; L1043-Q1045 PolarHBondContact O-N 2.92Å; L1043-M1046 HydrophobicContact CD2-CE 4.26Å; L1043-M1046 HydrophobicContact CD2-CG 4.27Å; L1043-M1046 PolarHBondContact O-N 2.98Å; L1043-T1057 HydrophobicContact CB-CG2 3.98Å; L1043-F1062 HydrophobicContact CB-CZ 4.11Å; L1043-F1062 HydrophobicContact CD1-CD2 4.35Å; L1043-F1062 HydrophobicContact CD1-CE1 3.98Å; L1043-F1062 HydrophobicContact CD1-CE2 3.64Å; L1043-F1062 HydrophobicContact CD1-CZ 3.43Å; L1043-F1062 VanDerWaalsContact CD1-CZ 3.43Å; L1043-F1062 HydrophobicContact CD2-CD1 3.86Å; L1043-F1062 HydrophobicContact CD2-CE1 3.05Å; L1043-F1062 HydrophobicContact CD2-CE2 4.31Å; L1043-F1062 HydrophobicContact CD2-CZ 3.32Å; L1043-F1062 HydrophobicContact CG-CE1 4.02Å; L1043-F1062 HydrophobicContact CG-CE2 4.48Å; L1043-F1062 HydrophobicContact CG-CZ 3.78Å
1044	S	66.1	Low	80.2	Confident	61 Å²	61	72.5 Å²	72.5	43%	0.427	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-23.7	174.9	55.7	0	0	0	0	113.2	S1042	S1042-S1044 PolarHBondContact O-N 3.46Å; S1042-S1044 PolarHBondContact OG-OG 3.16Å
1045	Q	71.1	Confident	79.2	Confident	91 Å²	91	72.2 Å²	72.2	43%	0.425	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-15.2	174.9	-62.9	-60.4	-16	0	0	113.5	S1042 L1043	S1042-Q1045 PolarHBondContact O-N 2.74Å; S1042-Q1045 VanDerWaalsContact O-N 3.12Å; S1042-Q1045 WeakPolarHBondContact OG-CG 3.42Å; S1042-Q1045 PolarHBondContact OG-N 3.19Å; L1043-Q1045 VanDerWaalsContact C-N 3.26Å; L1043-Q1045 PolarHBondContact O-N 2.92Å
1046	M	73.6	Confident	78.5	Confident	55 Å²	55	72.1 Å²	72.1	27%	0.271	34%	0.336	S	S	.	.			trans	-71.7	141.4	-176.3	-72.9	-93.8	-105.8	0	0	112.5	S1042 L1043 E1067 P1069	S1042-M1046 VanDerWaalsContact O-CG 3.25Å; S1042-M1046 WeakPolarHBondContact O-CG 3.15Å; S1042-M1046 PolarHBondContact O-N 2.88Å; L1043-M1046 HydrophobicContact CD2-CE 4.26Å; L1043-M1046 HydrophobicContact CD2-CG 4.27Å; L1043-M1046 PolarHBondContact O-N 2.98Å; M1046-E1067 WeakPolarHBondContact CE-O 3.44Å; M1046-P1069 HydrophobicContact CB-CG 3.87Å
1047	R	82.3	Confident	77.6	Confident	150 Å²	150	72.9 Å²	72.9	57%	0.566	34%	0.34	S	S	*	.	B	Isolated β-bridge	trans	-108	137.7	-178.2	-68.4	172.1	178.6	-106.6	5.2	110.4	R1049 R1052 K1054 P1069	R1047-R1049 PolarHBondContact O-N 3.35Å; R1047-R1052 WeakPolarHBondContact CD-O 3.48Å; R1047-R1052 PolarHBondContact NH1-O 2.97Å; R1047-R1052 VanDerWaalsContact NH1-O 3.15Å; R1047-K1054 HydrophobicContact CG-CG 4.09Å; R1047-P1069 VanDerWaalsContact O-CG 3.3Å; R1047-P1069 WeakPolarHBondContact O-CG 3.36Å
1048	C	86.5	Confident	76.9	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.007	37%	0.365	C	S	.	.			trans	-48.6	126.7	175.3	177.7	0	0	0	0	110.9	V1050 C1051 R1052 R1053 F1060 H1071	C1048-V1050 PolarHBondContact O-N 2.95Å; C1048-V1050 PolarHBondContact SG-N 3.19Å; C1048-V1050 VanDerWaalsContact SG-N 3.42Å; C1048-C1051 WeakPolarHBondContact CB-SG 3.32Å; C1048-R1052 WeakPolarHBondContact O-CA 3.26Å; C1048-R1052 PolarHBondContact O-N 2.78Å; C1048-R1053 PolarHBondContact N-O 3.27Å; C1048-F1060 HydrophobicContact CB-CE1 3.93Å; C1048-H1071 VanDerWaalsContact CB-ND1 3.34Å; C1048-H1071 WeakPolarHBondContact CB-ND1 3.38Å; C1048-H1071 PolarHBondContact SG-N 3.04Å
1049	R	85.9	Confident	76.5	Confident	82 Å²	82	77.8 Å²	77.8	31%	0.309	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-25.1	-179.9	-167.4	-179.6	-174.6	148.1	-4.6	113	R1047 C1066 R1068 P1069 F1070	R1047-R1049 PolarHBondContact O-N 3.35Å; R1049-C1066 PolarHBondContact NH1-SG 3.32Å; R1049-R1068 HydrophobicContact CB-CB 4.33Å; R1049-P1069 PolarHBondContact N-O 3.15Å; R1049-F1070 HydrophobicContact CB-CD1 4.15Å; R1049-F1070 HydrophobicContact CB-CE1 3.75Å; R1049-F1070 HydrophobicContact CB-CE2 4.42Å; R1049-F1070 HydrophobicContact CB-CZ 3.91Å; R1049-F1070 HydrophobicContact CG-CE1 4.21Å; R1049-F1070 HydrophobicContact CG-CZ 4.22Å
1050	V	86.8	Confident	76.5	Confident	84 Å²	84	75.6 Å²	75.6	51%	0.509	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-58.3	-177.1	-176.5	0	0	0	0	111.4	C1048 F1070 C1074	C1048-V1050 PolarHBondContact O-N 2.95Å; C1048-V1050 PolarHBondContact SG-N 3.19Å; C1048-V1050 VanDerWaalsContact SG-N 3.42Å; V1050-F1070 HydrophobicContact CG2-CD1 3.7Å; V1050-F1070 HydrophobicContact CG2-CE1 4.16Å; V1050-C1074 HydrophobicContact CB-CB 3.78Å; V1050-C1074 HydrophobicContact CG1-CB 4.07Å; V1050-C1074 HydrophobicContact CG2-CB 4.07Å
1051	C	89	Confident	76.8	Confident	48 Å²	48	69.1 Å²	69.1	32%	0.324	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-5.5	-172.9	72.5	0	0	0	0	114.6	C1048 R1053 H1071 C1074	C1048-C1051 WeakPolarHBondContact CB-SG 3.32Å; C1051-R1053 PolarHBondContact O-N 3.15Å; C1051-H1071 PolarHBondContact SG-ND1 3.26Å; C1051-C1074 VanDerWaalsContact SG-SG 3.67Å
1052	R	85.1	Confident	77	Confident	181 Å²	181	65.9 Å²	65.9	68%	0.683	32%	0.32	S	S	*	.			trans	59.2	9.8	179.6	-52.8	-129.4	-176.7	-174.4	6.1	116.1	R1047 C1048	R1047-R1052 WeakPolarHBondContact CD-O 3.48Å; R1047-R1052 PolarHBondContact NH1-O 2.97Å; R1047-R1052 VanDerWaalsContact NH1-O 3.15Å; C1048-R1052 WeakPolarHBondContact O-CA 3.26Å; C1048-R1052 PolarHBondContact O-N 2.78Å
1053	R	82.7	Confident	77.4	Confident	185 Å²	185	66 Å²	66	70%	0.698	32%	0.32	S	S	*	.			trans	-85.3	146.7	172.2	-61.4	-178.3	-176.4	173.5	-1	110.5	C1048 C1051	C1048-R1053 PolarHBondContact N-O 3.27Å; C1051-R1053 PolarHBondContact O-N 3.15Å
1054	K	77.7	Confident	77.9	Confident	108 Å²	108	67.9 Å²	67.9	47%	0.47	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-64.4	152.4	164.5	-65.3	-170.5	178.5	-169.3	0	108.7	R1047	R1047-K1054 HydrophobicContact CG-CG 4.09Å
1055	G	65.8	Low	78.5	Confident	21 Å²	21	70.5 Å²	70.5	22%	0.216	34%	0.34	C	S	.	.			trans	-149.5	158.3	-175.9	0	0	0	0	0	110.4	F1060 H1071	G1055-F1060 VanDerWaalsContact CA-CZ 3.45Å; G1055-F1060 VanDerWaalsContact N-CZ 3.31Å; G1055-F1060 WeakPolarHBondContact O-CE2 3.47Å; G1055-H1071 WeakPolarHBondContact CA-NE2 3.5Å
1056	N	67.2	Low	78.9	Confident	100 Å²	100	67.9 Å²	67.9	54%	0.535	33%	0.331	S	S	.	.			trans	-69.8	142.3	173.5	-165.5	-19.8	0	0	0	109	T1058 T1059 F1060	N1056-T1058 VanDerWaalsContact CG-OG1 3.29Å; N1056-T1058 PolarHBondContact O-N 3.35Å; N1056-T1058 VanDerWaalsContact O-N 3.15Å; N1056-T1058 PolarHBondContact OD1-OG1 3.45Å; N1056-T1059 HydrophobicContact CB-CG2 4.43Å; N1056-T1059 PolarHBondContact N-OG1 2.73Å; N1056-T1059 WeakPolarHBondContact O-CA 3.37Å; N1056-T1059 PolarHBondContact O-N 2.83Å; N1056-T1059 PolarHBondContact O-OG1 2.92Å; N1056-F1060 PolarHBondContact O-N 3.11Å
1057	T	65	Low	78.9	Confident	30 Å²	30	70.2 Å²	70.2	18%	0.184	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-55.2	-31.6	178.4	52.1	0	0	0	0	111.7	D928 L1043 T1059 F1060	D928-T1057 WeakPolarHBondContact O-CG2 3.09Å; L1043-T1057 HydrophobicContact CB-CG2 3.98Å; T1057-T1059 PolarHBondContact O-N 3.13Å; T1057-F1060 PolarHBondContact O-N 3.41Å
1058	T	71.3	Confident	78.9	Confident	91 Å²	91	69.3 Å²	69.3	56%	0.558	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-66.3	-19.7	173.9	58.6	0	0	0	0	114.6	N1056 V1082	N1056-T1058 VanDerWaalsContact CG-OG1 3.29Å; N1056-T1058 PolarHBondContact O-N 3.35Å; N1056-T1058 VanDerWaalsContact O-N 3.15Å; N1056-T1058 PolarHBondContact OD1-OG1 3.45Å; T1058-V1082 WeakPolarHBondContact O-CG2 3.03Å
1059	T	76.6	Confident	78.7	Confident	56 Å²	56	69.4 Å²	69.4	34%	0.344	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-105.4	3.4	-179.4	65.6	0	0	0	0	113.2	N1056 T1057 H1071 L1072	N1056-T1059 HydrophobicContact CB-CG2 4.43Å; N1056-T1059 PolarHBondContact N-OG1 2.73Å; N1056-T1059 WeakPolarHBondContact O-CA 3.37Å; N1056-T1059 PolarHBondContact O-N 2.83Å; N1056-T1059 PolarHBondContact O-OG1 2.92Å; T1057-T1059 PolarHBondContact O-N 3.13Å; T1059-H1071 CarbonylContact O-C 3.23Å; T1059-H1071 VanDerWaalsContact O-CA 3.25Å; T1059-H1071 WeakPolarHBondContact O-CA 3.33Å; T1059-L1072 WeakPolarHBondContact O-CG 3.45Å; T1059-L1072 PolarHBondContact O-N 2.98Å
1060	F	82.6	Confident	78.8	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	136.3	179.1	-75.6	-38.4	0	0	0	112.6	C1048 G1055 N1056 T1057 F1062 P1069 F1070 H1071 V1082	C1048-F1060 HydrophobicContact CB-CE1 3.93Å; G1055-F1060 VanDerWaalsContact CA-CZ 3.45Å; G1055-F1060 VanDerWaalsContact N-CZ 3.31Å; G1055-F1060 WeakPolarHBondContact O-CE2 3.47Å; N1056-F1060 PolarHBondContact O-N 3.11Å; T1057-F1060 PolarHBondContact O-N 3.41Å; F1060-F1062 HydrophobicContact CB-CD2 4.37Å; F1060-F1062 HydrophobicContact CB-CE2 3.58Å; F1060-F1062 HydrophobicContact CB-CZ 3.69Å; F1060-F1062 HydrophobicContact CD2-CZ 4.03Å; F1060-F1062 HydrophobicContact CG-CZ 4.21Å; F1060-P1069 HydrophobicContact CB-CB 4.15Å; F1060-P1069 HydrophobicContact CD1-CB 3.73Å; F1060-P1069 HydrophobicContact CD2-CB 3.94Å; F1060-P1069 HydrophobicContact CE1-CB 4Å; F1060-P1069 HydrophobicContact CE2-CB 4.17Å; F1060-P1069 HydrophobicContact CG-CB 3.7Å; F1060-P1069 HydrophobicContact CZ-CB 4.19Å; F1060-F1070 CarbonylContact C-O 3.52Å; F1060-F1070 WeakPolarHBondContact CA-O 3.42Å; F1060-H1071 AromaticContact CD1-CD2 3.71Å; F1060-H1071 AromaticContact CE1-CD2 3.4Å; F1060-H1071 VanDerWaalsContact CE1-CD2 3.4Å; F1060-H1071 WeakPolarHBondContact CE1-CD2 3.41Å; F1060-H1071 AromaticContact CE1-CE1 3.8Å; F1060-H1071 AromaticContact CE1-CG 3.84Å; F1060-H1071 AromaticContact CE1-NE2 3.39Å; F1060-H1071 WeakPolarHBondContact CE1-NE2 3.36Å; F1060-H1071 AromaticContact CZ-NE2 3.91Å; F1060-V1082 WeakPolarHBondContact O-CG1 3.43Å
1061	A	80.7	Confident	78.8	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	136	159	0	0	0	0	0	109.3	P1069 F1070 L1072 L1075 P1083 W1087	A1061-P1069 CarbonylContact O-C 3.21Å; A1061-P1069 WeakPolarHBondContact O-CA 3.36Å; A1061-F1070 PolarHBondContact N-O 3.29Å; A1061-F1070 PolarHBondContact O-N 3.12Å; A1061-L1072 HydrophobicContact CB-CD2 3.99Å; A1061-L1075 HydrophobicContact CB-CD1 3.75Å; A1061-P1083 VanDerWaalsContact CB-CD 3.48Å; A1061-P1083 HydrophobicContact CB-CG 3.61Å; A1061-W1087 HydrophobicContact CB-CE3 4.07Å; A1061-W1087 HydrophobicContact CB-CH2 4.09Å; A1061-W1087 HydrophobicContact CB-CZ3 3.84Å
1062	F	78.5	Confident	78.8	Confident	29 Å²	29	62 Å²	62	13%	0.127	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.5	-178.3	-72.7	-78.3	0	0	0	110.8	L1043 F1060 S1064 P1069 W1087	L1043-F1062 HydrophobicContact CB-CZ 4.11Å; L1043-F1062 HydrophobicContact CD1-CD2 4.35Å; L1043-F1062 HydrophobicContact CD1-CE1 3.98Å; L1043-F1062 HydrophobicContact CD1-CE2 3.64Å; L1043-F1062 HydrophobicContact CD1-CZ 3.43Å; L1043-F1062 VanDerWaalsContact CD1-CZ 3.43Å; L1043-F1062 HydrophobicContact CD2-CD1 3.86Å; L1043-F1062 HydrophobicContact CD2-CE1 3.05Å; L1043-F1062 HydrophobicContact CD2-CE2 4.31Å; L1043-F1062 HydrophobicContact CD2-CZ 3.32Å; L1043-F1062 HydrophobicContact CG-CE1 4.02Å; L1043-F1062 HydrophobicContact CG-CE2 4.48Å; L1043-F1062 HydrophobicContact CG-CZ 3.78Å; F1060-F1062 HydrophobicContact CB-CD2 4.37Å; F1060-F1062 HydrophobicContact CB-CE2 3.58Å; F1060-F1062 HydrophobicContact CB-CZ 3.69Å; F1060-F1062 HydrophobicContact CD2-CZ 4.03Å; F1060-F1062 HydrophobicContact CG-CZ 4.21Å; F1062-S1064 PolarHBondContact O-N 3.05Å; F1062-P1069 HydrophobicContact CD1-CB 4.15Å; F1062-P1069 HydrophobicContact CE1-CB 3.48Å; F1062-P1069 VanDerWaalsContact CE1-CB 3.48Å; F1062-P1069 HydrophobicContact CE1-CG 4.28Å; F1062-P1069 HydrophobicContact CZ-CB 3.94Å; F1062-W1087 VanDerWaalsContact O-CE3 3.3Å
1063	C	83.7	Confident	79	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.014	30%	0.298	C	S	.	.			trans	-70.8	121.7	175	-179.9	0	0	0	0	109.7	E1065 C1066 E1067 R1068 F1070 W1087 C1089 C1092	C1063-E1065 PolarHBondContact O-N 2.91Å; C1063-C1066 WeakPolarHBondContact CB-SG 3.46Å; C1063-E1067 VanDerWaalsContact O-CA 3.29Å; C1063-E1067 WeakPolarHBondContact O-CA 3.47Å; C1063-E1067 PolarHBondContact O-N 3.08Å; C1063-R1068 PolarHBondContact N-O 2.55Å; C1063-F1070 HydrophobicContact CB-CE2 4.03Å; C1063-W1087 WeakPolarHBondContact CA-O 3.26Å; C1063-W1087 HydrophobicContact CB-CZ3 4.1Å; C1063-C1089 HydrophobicContact CB-CB 3.86Å; C1063-C1089 PolarHBondContact SG-N 3.05Å; C1063-C1092 PolarHBondContact SG-SG 3.18Å
1064	S	77.8	Confident	79.3	Confident	50 Å²	50	51.4 Å²	51.4	35%	0.35	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.3	177.5	62.7	0	0	0	0	113.7	F1062 P1085 W1087 T1088	F1062-S1064 PolarHBondContact O-N 3.05Å; S1064-P1085 WeakPolarHBondContact CB-O 3.42Å; S1064-W1087 PolarHBondContact N-O 3.07Å; S1064-T1088 WeakPolarHBondContact OG-CG2 3.42Å
1065	E	78.2	Confident	79.7	Confident	116 Å²	116	47.2 Å²	47.2	54%	0.542	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-39	-175.2	-60.1	-55.2	132.9	0	0	114.5	C1063 T1088 C1092 V1096	C1063-E1065 PolarHBondContact O-N 2.91Å; E1065-T1088 HydrophobicContact CG-CG2 3.78Å; E1065-C1092 HydrophobicContact CB-CB 3.51Å; E1065-C1092 HydrophobicContact CG-CB 3.73Å; E1065-V1096 HydrophobicContact CG-CG2 4.34Å
1066	C	80.2	Confident	80.4	Confident	36 Å²	36	55.5 Å²	55.5	24%	0.243	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-0.4	-174.9	73.4	0	0	0	0	113.8	R1049 C1063 R1068 C1092	R1049-C1066 PolarHBondContact NH1-SG 3.32Å; C1063-C1066 WeakPolarHBondContact CB-SG 3.46Å; C1066-R1068 VanDerWaalsContact O-CG 3.28Å; C1066-R1068 WeakPolarHBondContact O-CG 3.24Å; C1066-R1068 PolarHBondContact O-N 3.09Å; C1066-C1092 VanDerWaalsContact CB-SG 3.56Å; C1066-C1092 VanDerWaalsContact SG-SG 3.67Å
1067	E	74.1	Confident	81.2	Confident	104 Å²	104	56 Å²	56	49%	0.486	30%	0.296	S	S	.	.			trans	55.2	14.7	178.9	-54.6	-170.6	163.1	0	0	114.9	K982 M1046 C1063	K982-E1067 IonicContact NZ-OE1 2.77Å; K982-E1067 PolarHBondContact NZ-OE1 3.22Å; K982-E1067 IonicContact NZ-OE2 2.95Å; K982-E1067 PolarHBondContact NZ-OE2 2.82Å; M1046-E1067 WeakPolarHBondContact CE-O 3.44Å; C1063-E1067 VanDerWaalsContact O-CA 3.29Å; C1063-E1067 WeakPolarHBondContact O-CA 3.47Å; C1063-E1067 PolarHBondContact O-N 3.08Å
1068	R	81.1	Confident	82.2	Confident	132 Å²	132	57.6 Å²	57.6	50%	0.498	31%	0.312	S	S	.	.			trans	-88.8	140.4	-178.9	-59.7	-154.5	-177.3	-163.1	-1.7	112.1	R1049 C1063 C1066 F1070	R1049-R1068 HydrophobicContact CB-CB 4.33Å; C1063-R1068 PolarHBondContact N-O 2.55Å; C1066-R1068 VanDerWaalsContact O-CG 3.28Å; C1066-R1068 WeakPolarHBondContact O-CG 3.24Å; C1066-R1068 PolarHBondContact O-N 3.09Å; R1068-F1070 HydrophobicContact CB-CE2 4.25Å; R1068-F1070 VanDerWaalsContact O-CD2 3.22Å; R1068-F1070 WeakPolarHBondContact O-CD2 3.37Å; R1068-F1070 WeakPolarHBondContact O-CE2 3.44Å
1069	P	82.5	Confident	82.9	Confident	2 Å²	2	56 Å²	56	1%	0.013	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	150.8	174.3	31.8	-37.8	0	0	0	112.5	M1046 R1047 R1049 F1060 A1061 F1062	M1046-P1069 HydrophobicContact CB-CG 3.87Å; R1047-P1069 VanDerWaalsContact O-CG 3.3Å; R1047-P1069 WeakPolarHBondContact O-CG 3.36Å; R1049-P1069 PolarHBondContact N-O 3.15Å; F1060-P1069 HydrophobicContact CB-CB 4.15Å; F1060-P1069 HydrophobicContact CD1-CB 3.73Å; F1060-P1069 HydrophobicContact CD2-CB 3.94Å; F1060-P1069 HydrophobicContact CE1-CB 4Å; F1060-P1069 HydrophobicContact CE2-CB 4.17Å; F1060-P1069 HydrophobicContact CG-CB 3.7Å; F1060-P1069 HydrophobicContact CZ-CB 4.19Å; A1061-P1069 CarbonylContact O-C 3.21Å; A1061-P1069 WeakPolarHBondContact O-CA 3.36Å; F1062-P1069 HydrophobicContact CD1-CB 4.15Å; F1062-P1069 HydrophobicContact CE1-CB 3.48Å; F1062-P1069 VanDerWaalsContact CE1-CB 3.48Å; F1062-P1069 HydrophobicContact CE1-CG 4.28Å; F1062-P1069 HydrophobicContact CZ-CB 3.94Å
1070	F	87.8	Confident	83.1	Confident	14 Å²	14	62.4 Å²	62.4	6%	0.061	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	126.7	170.9	-61.6	-103.3	0	0	0	107.8	R1049 V1050 F1060 A1061 C1063 R1068 L1072 L1075 W1087 C1089	R1049-F1070 HydrophobicContact CB-CD1 4.15Å; R1049-F1070 HydrophobicContact CB-CE1 3.75Å; R1049-F1070 HydrophobicContact CB-CE2 4.42Å; R1049-F1070 HydrophobicContact CB-CZ 3.91Å; R1049-F1070 HydrophobicContact CG-CE1 4.21Å; R1049-F1070 HydrophobicContact CG-CZ 4.22Å; V1050-F1070 HydrophobicContact CG2-CD1 3.7Å; V1050-F1070 HydrophobicContact CG2-CE1 4.16Å; F1060-F1070 CarbonylContact C-O 3.52Å; F1060-F1070 WeakPolarHBondContact CA-O 3.42Å; A1061-F1070 PolarHBondContact N-O 3.29Å; A1061-F1070 PolarHBondContact O-N 3.12Å; C1063-F1070 HydrophobicContact CB-CE2 4.03Å; R1068-F1070 HydrophobicContact CB-CE2 4.25Å; R1068-F1070 VanDerWaalsContact O-CD2 3.22Å; R1068-F1070 WeakPolarHBondContact O-CD2 3.37Å; R1068-F1070 WeakPolarHBondContact O-CE2 3.44Å; F1070-L1072 PolarHBondContact O-N 3.42Å; F1070-L1075 HydrophobicContact CB-CD2 3.54Å; F1070-L1075 HydrophobicContact CB-CG 4Å; F1070-L1075 HydrophobicContact CD1-CD2 3.87Å; F1070-L1075 HydrophobicContact CG-CD2 3.83Å; F1070-W1087 HydrophobicContact CB-CH2 4.43Å; F1070-W1087 AromaticContact CD2-CH2 3.85Å; F1070-W1087 HydrophobicContact CD2-CH2 3.85Å; F1070-W1087 AromaticContact CD2-CZ3 3.93Å; F1070-W1087 HydrophobicContact CD2-CZ3 3.93Å; F1070-W1087 HydrophobicContact CE2-CH2 4.35Å; F1070-W1087 HydrophobicContact CE2-CZ3 4.39Å; F1070-W1087 HydrophobicContact CG-CH2 4.16Å; F1070-C1089 HydrophobicContact CD2-CB 4.36Å; F1070-C1089 HydrophobicContact CE1-CB 4.18Å; F1070-C1089 HydrophobicContact CE2-CB 3.59Å; F1070-C1089 HydrophobicContact CZ-CB 3.47Å; F1070-C1089 VanDerWaalsContact CZ-CB 3.47Å
1071	H	88.1	Confident	83	Confident	24 Å²	24	70.4 Å²	70.4	11%	0.111	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	140.6	169.4	-70.6	119.6	0	0	0	109.3	C1048 C1051 G1055 T1059 F1060 T1073 C1074 L1075	C1048-H1071 VanDerWaalsContact CB-ND1 3.34Å; C1048-H1071 WeakPolarHBondContact CB-ND1 3.38Å; C1048-H1071 PolarHBondContact SG-N 3.04Å; C1051-H1071 PolarHBondContact SG-ND1 3.26Å; G1055-H1071 WeakPolarHBondContact CA-NE2 3.5Å; T1059-H1071 CarbonylContact O-C 3.23Å; T1059-H1071 VanDerWaalsContact O-CA 3.25Å; T1059-H1071 WeakPolarHBondContact O-CA 3.33Å; F1060-H1071 AromaticContact CD1-CD2 3.71Å; F1060-H1071 AromaticContact CE1-CD2 3.4Å; F1060-H1071 VanDerWaalsContact CE1-CD2 3.4Å; F1060-H1071 WeakPolarHBondContact CE1-CD2 3.41Å; F1060-H1071 AromaticContact CE1-CE1 3.8Å; F1060-H1071 AromaticContact CE1-CG 3.84Å; F1060-H1071 AromaticContact CE1-NE2 3.39Å; F1060-H1071 WeakPolarHBondContact CE1-NE2 3.36Å; F1060-H1071 AromaticContact CZ-NE2 3.91Å; H1071-T1073 PolarHBondContact O-N 3.11Å; H1071-T1073 VanDerWaalsContact O-N 3.12Å; H1071-C1074 HydrophobicContact CB-CB 3.87Å; H1071-C1074 WeakPolarHBondContact O-CA 3.41Å; H1071-C1074 WeakPolarHBondContact O-CB 3.43Å; H1071-C1074 PolarHBondContact O-N 3.27Å; H1071-L1075 PolarHBondContact O-N 3.36Å
1072	L	87.8	Confident	82.7	Confident	20 Å²	20	72.9 Å²	72.9	11%	0.105	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-53	-36.1	176.3	-63.3	177.8	0	0	0	111.9	T1059 A1061 F1070 A1078 L1079 V1082	T1059-L1072 WeakPolarHBondContact O-CG 3.45Å; T1059-L1072 PolarHBondContact O-N 2.98Å; A1061-L1072 HydrophobicContact CB-CD2 3.99Å; F1070-L1072 PolarHBondContact O-N 3.42Å; L1072-A1078 VanDerWaalsContact O-CA 3.29Å; L1072-A1078 WeakPolarHBondContact O-CA 2.97Å; L1072-L1079 HydrophobicContact CB-CB 4.48Å; L1072-L1079 WeakPolarHBondContact CB-O 3.26Å; L1072-L1079 HydrophobicContact CD2-CB 4Å; L1072-L1079 PolarHBondContact O-N 3.03Å; L1072-V1082 HydrophobicContact CD1-CG2 4.07Å; L1072-V1082 HydrophobicContact CD2-CG2 4.31Å
1073	T	89.2	Confident	82.6	Confident	116 Å²	116	72.9 Å²	72.9	71%	0.712	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-76.6	-20.6	175.5	56.8	0	0	0	0	114.5	H1071	H1071-T1073 PolarHBondContact O-N 3.11Å; H1071-T1073 VanDerWaalsContact O-N 3.12Å
1074	C	88.7	Confident	82	Confident	29 Å²	29	74.9 Å²	74.9	20%	0.196	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-84.8	-11.5	176.4	-75.4	0	0	0	0	113.1	V1050 C1051 H1071	V1050-C1074 HydrophobicContact CB-CB 3.78Å; V1050-C1074 HydrophobicContact CG1-CB 4.07Å; V1050-C1074 HydrophobicContact CG2-CB 4.07Å; C1051-C1074 VanDerWaalsContact SG-SG 3.67Å; H1071-C1074 HydrophobicContact CB-CB 3.87Å; H1071-C1074 WeakPolarHBondContact O-CA 3.41Å; H1071-C1074 WeakPolarHBondContact O-CB 3.43Å; H1071-C1074 PolarHBondContact O-N 3.27Å
1075	L	86	Confident	81.5	Confident	20 Å²	20	77 Å²	77	11%	0.105	41%	0.412	C	S	.	.	S	Bend	trans	-75	154.9	173.8	-65.4	175.4	0	0	0	111.2	A1061 F1070 H1071 P1077 A1078 L1079 W1087	A1061-L1075 HydrophobicContact CB-CD1 3.75Å; F1070-L1075 HydrophobicContact CB-CD2 3.54Å; F1070-L1075 HydrophobicContact CB-CG 4Å; F1070-L1075 HydrophobicContact CD1-CD2 3.87Å; F1070-L1075 HydrophobicContact CG-CD2 3.83Å; H1071-L1075 PolarHBondContact O-N 3.36Å; L1075-P1077 VanDerWaalsContact C-C 3.46Å; L1075-P1077 CarbonylContact C-O 3.57Å; L1075-P1077 WeakPolarHBondContact CB-O 3.09Å; L1075-P1077 CarbonylContact O-C 3.58Å; L1075-P1077 VanDerWaalsContact O-C 3.23Å; L1075-A1078 WeakPolarHBondContact O-CA 3.5Å; L1075-A1078 PolarHBondContact O-N 3.45Å; L1075-A1078 VanDerWaalsContact O-N 3.09Å; L1075-L1079 HydrophobicContact CD1-CB 4.42Å; L1075-L1079 HydrophobicContact CD1-CD1 3.46Å; L1075-L1079 VanDerWaalsContact CD1-CD1 3.46Å; L1075-L1079 HydrophobicContact CD1-CG 3.78Å; L1075-W1087 HydrophobicContact CD1-CH2 4.03Å; L1075-W1087 HydrophobicContact CD1-CZ2 3.68Å; L1075-W1087 HydrophobicContact CD2-CH2 3.58Å; L1075-W1087 HydrophobicContact CD2-CZ2 3.59Å; L1075-W1087 HydrophobicContact CG-CH2 4.46Å; L1075-W1087 HydrophobicContact CG-CZ2 4.3Å
1076	K	82.1	Confident	81.4	Confident	195 Å²	195	76.4 Å²	76.4	85%	0.848	42%	0.42	S	S	*	.	S	Bend	trans	-126.8	110.1	175.8	-70.6	-169.2	179.1	-175.7	0	110.3
1077	P	83.8	Confident	81.7	Confident	111 Å²	111	77.2 Å²	77.2	72%	0.721	42%	0.418	S	S	*	.	S	Bend	cis	-64.2	157.8	-6.8	29.8	-34.6	0	0	0	111.9	L1075	L1075-P1077 VanDerWaalsContact C-C 3.46Å; L1075-P1077 CarbonylContact C-O 3.57Å; L1075-P1077 WeakPolarHBondContact CB-O 3.09Å; L1075-P1077 CarbonylContact O-C 3.58Å; L1075-P1077 VanDerWaalsContact O-C 3.23Å
1078	A	85.5	Confident	82.2	Confident	62 Å²	62	74.2 Å²	74.2	51%	0.512	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-63.8	141.5	173.4	0	0	0	0	0	109.4	L1072 L1075	L1072-A1078 VanDerWaalsContact O-CA 3.29Å; L1072-A1078 WeakPolarHBondContact O-CA 2.97Å; L1075-A1078 WeakPolarHBondContact O-CA 3.5Å; L1075-A1078 PolarHBondContact O-N 3.45Å; L1075-A1078 VanDerWaalsContact O-N 3.09Å
1079	L	85.7	Confident	82.4	Confident	57 Å²	57	68 Å²	68	30%	0.298	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-94.8	146.1	176.9	-63	-178.5	0	0	0	109.9	L1072 L1075 P1083	L1072-L1079 HydrophobicContact CB-CB 4.48Å; L1072-L1079 WeakPolarHBondContact CB-O 3.26Å; L1072-L1079 HydrophobicContact CD2-CB 4Å; L1072-L1079 PolarHBondContact O-N 3.03Å; L1075-L1079 HydrophobicContact CD1-CB 4.42Å; L1075-L1079 HydrophobicContact CD1-CD1 3.46Å; L1075-L1079 VanDerWaalsContact CD1-CD1 3.46Å; L1075-L1079 HydrophobicContact CD1-CG 3.78Å; L1079-P1083 HydrophobicContact CD1-CB 3.96Å; L1079-P1083 HydrophobicContact CD1-CG 3.69Å
1080	E	81.8	Confident	82.4	Confident	191 Å²	191	75 Å²	75	89%	0.893	41%	0.414	S	S	*	.	S	Bend	trans	-87	-24.9	173.9	-67.7	-177.9	173.6	0	0	112.3
1081	K	80.1	Confident	82.2	Confident	169 Å²	169	79.7 Å²	79.7	74%	0.735	44%	0.436	S	S	*	.	S	Bend	trans	-132.5	149.4	-177.6	-63.2	-176.1	-178.9	-178.3	0	110.3
1082	V	73.3	Confident	81.9	Confident	52 Å²	52	79.3 Å²	79.3	32%	0.315	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-57.5	122.3	173	-179.6	0	0	0	0	108.7	T1058 F1060 L1072	T1058-V1082 WeakPolarHBondContact O-CG2 3.03Å; F1060-V1082 WeakPolarHBondContact O-CG1 3.43Å; L1072-V1082 HydrophobicContact CD1-CG2 4.07Å; L1072-V1082 HydrophobicContact CD2-CG2 4.31Å
1083	P	76.4	Confident	81.5	Confident	29 Å²	29	80.5 Å²	80.5	19%	0.188	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-72.1	155.3	-179.6	32.9	-36.1	0	0	0	110.3	A1061 L1079 W1087	A1061-P1083 VanDerWaalsContact CB-CD 3.48Å; A1061-P1083 HydrophobicContact CB-CG 3.61Å; L1079-P1083 HydrophobicContact CD1-CB 3.96Å; L1079-P1083 HydrophobicContact CD1-CG 3.69Å; P1083-W1087 HydrophobicContact CB-CB 3.63Å; P1083-W1087 HydrophobicContact CB-CD2 4.21Å; P1083-W1087 HydrophobicContact CB-CG 3.48Å; P1083-W1087 VanDerWaalsContact CB-CG 3.48Å; P1083-W1087 HydrophobicContact CG-CB 3.72Å; P1083-W1087 HydrophobicContact CG-CD2 3.53Å; P1083-W1087 HydrophobicContact CG-CE3 4.06Å; P1083-W1087 HydrophobicContact CG-CG 3.34Å
1084	G	71.7	Confident	80.7	Confident	43 Å²	43	81 Å²	81	44%	0.443	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-62.5	173.7	-177.1	0	0	0	0	0	114.2	S1086 W1087	G1084-S1086 PolarHBondContact O-N 3.29Å; G1084-S1086 VanDerWaalsContact O-N 3.09Å; G1084-W1087 VanDerWaalsContact O-CB 3.28Å; G1084-W1087 WeakPolarHBondContact O-CB 3.33Å; G1084-W1087 PolarHBondContact O-N 3.21Å
1085	P	68.3	Low	79.6	Confident	95 Å²	95	84.3 Å²	84.3	62%	0.617	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-21.1	-172.4	25.4	-35.5	0	0	0	114.3	E936 S1064 W1087	E936-P1085 WeakPolarHBondContact OE1-CG 3.34Å; S1064-P1085 WeakPolarHBondContact CB-O 3.42Å; P1085-W1087 VanDerWaalsContact C-N 3.3Å; P1085-W1087 PolarHBondContact O-N 2.94Å
1086	S	76.2	Confident	78.4	Confident	104 Å²	104	87 Å²	87	73%	0.727	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	3.5	176.7	56.5	0	0	0	0	114.4	G1084 T1088	G1084-S1086 PolarHBondContact O-N 3.29Å; G1084-S1086 VanDerWaalsContact O-N 3.09Å; S1086-T1088 PolarHBondContact O-N 3.1Å
1087	W	85.2	Confident	77.3	Confident	52 Å²	52	81.5 Å²	81.5	20%	0.197	47%	0.465	C	S	.	.			trans	-72.4	122.8	-177.5	-178.6	83.9	0	0	0	111.9	A1061 F1062 C1063 S1064 F1070 L1075 P1083 G1084 P1085 C1089	A1061-W1087 HydrophobicContact CB-CE3 4.07Å; A1061-W1087 HydrophobicContact CB-CH2 4.09Å; A1061-W1087 HydrophobicContact CB-CZ3 3.84Å; F1062-W1087 VanDerWaalsContact O-CE3 3.3Å; C1063-W1087 WeakPolarHBondContact CA-O 3.26Å; C1063-W1087 HydrophobicContact CB-CZ3 4.1Å; S1064-W1087 PolarHBondContact N-O 3.07Å; F1070-W1087 HydrophobicContact CB-CH2 4.43Å; F1070-W1087 AromaticContact CD2-CH2 3.85Å; F1070-W1087 HydrophobicContact CD2-CH2 3.85Å; F1070-W1087 AromaticContact CD2-CZ3 3.93Å; F1070-W1087 HydrophobicContact CD2-CZ3 3.93Å; F1070-W1087 HydrophobicContact CE2-CH2 4.35Å; F1070-W1087 HydrophobicContact CE2-CZ3 4.39Å; F1070-W1087 HydrophobicContact CG-CH2 4.16Å; L1075-W1087 HydrophobicContact CD1-CH2 4.03Å; L1075-W1087 HydrophobicContact CD1-CZ2 3.68Å; L1075-W1087 HydrophobicContact CD2-CH2 3.58Å; L1075-W1087 HydrophobicContact CD2-CZ2 3.59Å; L1075-W1087 HydrophobicContact CG-CH2 4.46Å; L1075-W1087 HydrophobicContact CG-CZ2 4.3Å; P1083-W1087 HydrophobicContact CB-CB 3.63Å; P1083-W1087 HydrophobicContact CB-CD2 4.21Å; P1083-W1087 HydrophobicContact CB-CG 3.48Å; P1083-W1087 VanDerWaalsContact CB-CG 3.48Å; P1083-W1087 HydrophobicContact CG-CB 3.72Å; P1083-W1087 HydrophobicContact CG-CD2 3.53Å; P1083-W1087 HydrophobicContact CG-CE3 4.06Å; P1083-W1087 HydrophobicContact CG-CG 3.34Å; G1084-W1087 VanDerWaalsContact O-CB 3.28Å; G1084-W1087 WeakPolarHBondContact O-CB 3.33Å; G1084-W1087 PolarHBondContact O-N 3.21Å; P1085-W1087 VanDerWaalsContact C-N 3.3Å; P1085-W1087 PolarHBondContact O-N 2.94Å; W1087-C1089 HydrophobicContact CH2-CB 3.74Å; W1087-C1089 HydrophobicContact CZ2-CB 4.39Å; W1087-C1089 HydrophobicContact CZ3-CB 4.14Å
1088	T	84.3	Confident	75.9	Confident	42 Å²	42	82.8 Å²	82.8	26%	0.258	47%	0.466	S	S	.	.			trans	-104.1	140.5	174	60.7	0	0	0	0	109.6	S1064 E1065 S1086 S1093	S1064-T1088 WeakPolarHBondContact OG-CG2 3.42Å; E1065-T1088 HydrophobicContact CG-CG2 3.78Å; S1086-T1088 PolarHBondContact O-N 3.1Å; T1088-S1093 WeakPolarHBondContact OG1-CB 3.38Å
1089	C	86.6	Confident	73.9	Confident	2 Å²	2	85.7 Å²	85.7	1%	0.014	47%	0.473	C	S	.	.			trans	-72.8	157.9	173	77.3	0	0	0	0	110.5	C1063 F1070 W1087 Q1091 C1092 S1093	C1063-C1089 HydrophobicContact CB-CB 3.86Å; C1063-C1089 PolarHBondContact SG-N 3.05Å; F1070-C1089 HydrophobicContact CD2-CB 4.36Å; F1070-C1089 HydrophobicContact CE1-CB 4.18Å; F1070-C1089 HydrophobicContact CE2-CB 3.59Å; F1070-C1089 HydrophobicContact CZ-CB 3.47Å; F1070-C1089 VanDerWaalsContact CZ-CB 3.47Å; W1087-C1089 HydrophobicContact CH2-CB 3.74Å; W1087-C1089 HydrophobicContact CZ2-CB 4.39Å; W1087-C1089 HydrophobicContact CZ3-CB 4.14Å; C1089-Q1091 PolarHBondContact O-N 2.91Å; C1089-C1092 PolarHBondContact O-N 3.46Å; C1089-C1092 PolarHBondContact SG-SG 3.02Å; C1089-S1093 PolarHBondContact O-N 3.08Å
1090	K	82.7	Confident	71.9	Confident	149 Å²	149	88.4 Å²	88.4	65%	0.648	49%	0.494	S	S	*	.	H	α-helix	trans	-53.2	-26	-178.3	-168	173.9	-176.2	173.7	0	115.1	S1093 K1094	K1090-S1093 WeakPolarHBondContact CA-OG 3.32Å; K1090-S1093 PolarHBondContact O-OG 3.17Å; K1090-K1094 VanDerWaalsContact O-CG 3.3Å; K1090-K1094 WeakPolarHBondContact O-CG 3.44Å
1091	Q	82	Confident	70	Confident	112 Å²	112	88.1 Å²	88.1	52%	0.523	50%	0.498	S	S	.	.	H	α-helix	trans	-75.4	-45.2	175.3	-71.9	-178.5	-18.4	0	0	111.1	C1089 K1094 V1095	C1089-Q1091 PolarHBondContact O-N 2.91Å; Q1091-K1094 PolarHBondContact O-N 3.25Å; Q1091-V1095 WeakPolarHBondContact O-CG2 3.43Å; Q1091-V1095 PolarHBondContact O-N 3.04Å
1092	C	83	Confident	68.2	Low	16 Å²	16	83.8 Å²	83.8	11%	0.108	49%	0.494	C	S	.	.	H	α-helix	trans	-74.2	-37.1	179.4	-56.7	0	0	0	0	111.8	C1063 E1065 C1066 C1089 K1094 V1095 V1096	C1063-C1092 PolarHBondContact SG-SG 3.18Å; E1065-C1092 HydrophobicContact CB-CB 3.51Å; E1065-C1092 HydrophobicContact CG-CB 3.73Å; C1066-C1092 VanDerWaalsContact CB-SG 3.56Å; C1066-C1092 VanDerWaalsContact SG-SG 3.67Å; C1089-C1092 PolarHBondContact O-N 3.46Å; C1089-C1092 PolarHBondContact SG-SG 3.02Å; C1092-K1094 PolarHBondContact O-N 2.94Å; C1092-V1095 PolarHBondContact O-N 3.49Å; C1092-V1096 WeakPolarHBondContact O-CG2 3.47Å; C1092-V1096 PolarHBondContact O-N 2.83Å
1093	S	78.5	Confident	66.7	Low	45 Å²	45	90.5 Å²	90.5	32%	0.315	52%	0.522	S	S	.	.	H	α-helix	trans	-59.5	-32	174.8	78.5	0	0	0	0	112.4	T1088 C1089 K1090 A1097	T1088-S1093 WeakPolarHBondContact OG1-CB 3.38Å; C1089-S1093 PolarHBondContact O-N 3.08Å; K1090-S1093 WeakPolarHBondContact CA-OG 3.32Å; K1090-S1093 PolarHBondContact O-OG 3.17Å; S1093-A1097 VanDerWaalsContact O-CB 3.26Å; S1093-A1097 WeakPolarHBondContact O-CB 3.47Å; S1093-A1097 PolarHBondContact O-N 3.41Å
1094	K	73	Confident	64.7	Low	127 Å²	127	94 Å²	94	55%	0.552	55%	0.553	S	S	*	*	H	α-helix	trans	-72.1	-40.1	174.1	-78.6	-179.5	174.8	-161.1	0	112.3	K1090 Q1091 C1092 V1096 A1097 D1098	K1090-K1094 VanDerWaalsContact O-CG 3.3Å; K1090-K1094 WeakPolarHBondContact O-CG 3.44Å; Q1091-K1094 PolarHBondContact O-N 3.25Å; C1092-K1094 PolarHBondContact O-N 2.94Å; K1094-V1096 VanDerWaalsContact C-N 3.32Å; K1094-A1097 PolarHBondContact O-N 3.25Å; K1094-D1098 PolarHBondContact O-N 2.69Å
1095	V	66.2	Low	63	Low	97 Å²	97	99.1 Å²	99.1	59%	0.588	57%	0.571	S	S	*	*	H	α-helix	trans	-64.5	-40.7	176.6	178.1	0	0	0	0	110.4	Q1091 C1092 L1099	Q1091-V1095 WeakPolarHBondContact O-CG2 3.43Å; Q1091-V1095 PolarHBondContact O-N 3.04Å; C1092-V1095 PolarHBondContact O-N 3.49Å; V1095-L1099 HydrophobicContact CG1-CD1 4.44Å; V1095-L1099 WeakPolarHBondContact O-CD1 3.39Å
1096	V	59.4	Low	61.4	Low	76 Å²	76	102.1 Å²	102.1	46%	0.461	58%	0.582	S	S	.	*	H	α-helix	trans	-69.7	-34.8	176.9	178.8	0	0	0	0	112.1	E1065 C1092 K1094 D1098	E1065-V1096 HydrophobicContact CG-CG2 4.34Å; C1092-V1096 WeakPolarHBondContact O-CG2 3.47Å; C1092-V1096 PolarHBondContact O-N 2.83Å; K1094-V1096 VanDerWaalsContact C-N 3.32Å; V1096-D1098 VanDerWaalsContact C-N 3.34Å; V1096-D1098 PolarHBondContact O-N 3.3Å
1097	A	59.1	Low	59.5	Low	80 Å²	80	104.3 Å²	104.3	66%	0.661	59%	0.59	S	S	*	*	H	α-helix	trans	-74	-19.5	179.3	0	0	0	0	0	114.6	S1093 K1094	S1093-A1097 VanDerWaalsContact O-CB 3.26Å; S1093-A1097 WeakPolarHBondContact O-CB 3.47Å; S1093-A1097 PolarHBondContact O-N 3.41Å; K1094-A1097 PolarHBondContact O-N 3.25Å
1098	D	55.2	Low	57	Low	139 Å²	139	111.6 Å²	111.6	74%	0.743	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	6.4	-178.1	-74.1	-25.2	0	0	0	113.5	K1094 V1096	K1094-D1098 PolarHBondContact O-N 2.69Å; V1096-D1098 VanDerWaalsContact C-N 3.34Å; V1096-D1098 PolarHBondContact O-N 3.3Å
1099	L	43.6	Very low	54.4	Low	123 Å²	123	113.7 Å²	113.7	64%	0.644	65%	0.645	S	S	*	*	S	Bend	trans	-96.7	121.8	179.7	-82.7	155.5	0	0	0	111.9	V1095	V1095-L1099 HydrophobicContact CG1-CD1 4.44Å; V1095-L1099 WeakPolarHBondContact O-CD1 3.39Å
1100	P	44.4	Very low	51.9	Low	114 Å²	114	121.6 Å²	121.6	74%	0.74	69%	0.685	S	S	*	*			trans	-68	144.5	175.6	-14.6	28.3	0	0	0	112.7	A1102	P1100-A1102 PolarHBondContact O-N 3.41Å
1101	D	41.1	Very low	49.5	Very low	184 Å²	184	120.4 Å²	120.4	98%	0.984	69%	0.693	S	S	*	*	S	Bend	trans	-53.2	25.5	-170.8	-99.3	-28.3	0	0	0	119.8
1102	A	43.2	Very low	47	Very low	79 Å²	79	118.3 Å²	118.3	65%	0.653	70%	0.701	S	S	*	*	S	Bend	trans	-143.6	68.6	-172	0	0	0	0	0	114.3	P1100	P1100-A1102 PolarHBondContact O-N 3.41Å
1103	Q	41.3	Very low	44.5	Very low	192 Å²	192	127 Å²	127	90%	0.897	74%	0.74	S	S	*	*			trans	-171.8	27.8	159.5	-108.1	155.3	26.5	0	0	116.8	N1105	Q1103-N1105 PolarHBondContact O-N 2.77Å
1104	A	34.5	Very low	42.4	Very low	102 Å²	102	129.2 Å²	129.2	84%	0.843	76%	0.761	S	S	*	*			trans	-73	8.1	-172.6	0	0	0	0	0	117.1
1105	N	36.2	Very low	40.4	Very low	152 Å²	152	130 Å²	130	81%	0.813	77%	0.771	S	S	*	*	S	Bend	trans	-143	77.1	-177.2	-79.8	-28	0	0	0	111.6	Q1103	Q1103-N1105 PolarHBondContact O-N 2.77Å
1106	N	34	Very low	38.7	Very low	158 Å²	158	133.1 Å²	133.1	85%	0.845	78%	0.777	S	S	*	*			trans	157.4	93.8	153.4	-93.9	-31.8	0	0	0	110.7
1107	V	35.9	Very low	37.5	Very low	150 Å²	150	136.6 Å²	136.6	91%	0.909	79%	0.793	S	S	*	*			trans	-154.5	95.1	142.1	-169.3	0	0	0	0	109.2
1108	K	32.8	Very low	36.2	Very low	204 Å²	204	137.5 Å²	137.5	89%	0.887	80%	0.8	S	S	*	*			trans	-83.8	136.9	153.5	-84.4	179.9	173.4	-179.5	0	107.7
1109	A	29.9	Very low	35.1	Very low	86 Å²	86	134.3 Å²	134.3	71%	0.711	79%	0.793	S	S	*	*			trans	44	129	153.3	0	0	0	0	0	120.3
1110	I	33.2	Very low	34.6	Very low	169 Å²	169	137 Å²	137	87%	0.867	80%	0.802	S	S	*	*				175.9	146.7	120.6	-85.6	157.5	0	0	0	109.5
1111	P	33.8	Very low	34.1	Very low	124 Å²	124	138 Å²	138	81%	0.805	80%	0.801	S	S	*	*			trans	-105.8	170.8	-154	35.6	-21.5	0	0	0	113.8
1112	G	28.8	Very low	33.9	Very low	67 Å²	67	136.3 Å²	136.3	69%	0.691	79%	0.788	S	S	*	*			trans	150.4	111.4	162.8	0	0	0	0	0	117.1
1113	E	30.2	Very low	33.3	Very low	199 Å²	199	139.8 Å²	139.8	93%	0.93	79%	0.79	S	S	*	*			trans	75.6	140.1	136.3	-59.2	-170.4	151.5	0	0	123.5
1114	A	34.1	Very low	32.9	Very low	92 Å²	92	136.2 Å²	136.2	76%	0.76	79%	0.786	S	S	*	*			trans	91.1	79	147.4	0	0	0	0	0	120.6
1115	N	31.4	Very low	32.7	Very low	143 Å²	143	135 Å²	135	77%	0.765	78%	0.777	S	S	*	*				56.1	133.6	105.7	-145.6	2.7	0	0	0	121.2
1116	K	31.7	Very low	32.5	Very low	163 Å²	163	136.6 Å²	136.6	71%	0.709	78%	0.779	S	S	*	*			trans	112	130	142.7	-59.6	-173.8	-178.4	173.5	0	119.3
1117	N	32.4	Very low	32.3	Very low	149 Å²	149	137 Å²	137	80%	0.797	78%	0.778	S	S	*	*			trans	99.9	102	154.4	-50.8	-32.4	0	0	0	115.9
1118	A	32	Very low	31.9	Very low	98 Å²	98	136.1 Å²	136.1	81%	0.81	77%	0.768	S	S	*	*				89.5	142.8	93	0	0	0	0	0	111.5
1119	A	32.7	Very low	31.7	Very low	72 Å²	72	134.4 Å²	134.4	60%	0.595	76%	0.763	S	S	*	*			cis	-162.5	157.5	-4.5	0	0	0	0	0	107
1120	E	33.4	Very low	31.7	Very low	180 Å²	180	136 Å²	136	84%	0.841	77%	0.769	S	S	*	*			trans	39.8	120.6	140	-63.3	166.3	-176.9	0	0	121
1121	D	34.3	Very low	31.7	Very low	134 Å²	134	133.8 Å²	133.8	72%	0.717	77%	0.766	S	S	*	*				172.9	133.1	102.4	-112.3	-12.6	0	0	0	114.9
1122	H	35.5	Very low	31.7	Very low	150 Å²	150	135.6 Å²	135.6	69%	0.694	76%	0.763	S	S	*	*			trans	19.1	151.6	145.5	-66.9	-51.1	0	0	0	122.1
1123	Q	32	Very low	32.4	Very low	151 Å²	151	137.7 Å²	137.7	71%	0.706	77%	0.767	S	S	*	*			cis	-175.9	155.4	9.3	-113.8	163.4	11.9	0	0	108.4
1124	S	31.6	Very low	33.6	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	74%	0.741	S	S	*	*			trans	61.6	143.3	151.1	48	0	0	0	0	120.8
1125	A	31.9	Very low	35.2	Very low	78 Å²	78	131.2 Å²	131.2	65%	0.645	72%	0.723	S	S	*	*			cis	-169.7	161.8	3	0	0	0	0	0	110.2
1126	E	30.2	Very low	37.3	Very low	185 Å²	185	128.7 Å²	128.7	86%	0.864	71%	0.709	S	S	*	*			trans	66.3	142.2	153	-71.6	164.8	-157.2	0	0	119.9
1127	M	31	Very low	39.9	Very low	166 Å²	166	120.9 Å²	120.9	82%	0.818	68%	0.676	S	S	*	*			cis	-172.4	134.9	-13.2	-134.6	174.9	71.3	0	0	105.5
1128	D	28	Very low	42.3	Very low	131 Å²	131	116.2 Å²	116.2	70%	0.701	65%	0.654	S	S	*	*			trans	148	115.8	145.6	-96.7	-7.9	0	0	0	116.2
1129	H	26.7	Very low	44.6	Very low	169 Å²	169	115.8 Å²	115.8	78%	0.782	64%	0.638	S	S	*	*			trans	48.8	121	148.7	-64.7	-67.9	0	0	0	125.4
1130	S	30.9	Very low	47.1	Very low	119 Å²	119	114.4 Å²	114.4	83%	0.832	62%	0.623	S	S	*	*			trans	76.8	151.1	166.9	89.7	0	0	0	0	118.4
1131	P	33.8	Very low	49.2	Very low	123 Å²	123	113.2 Å²	113.2	80%	0.799	62%	0.615	S	S	*	*	S	Bend	cis	-114.4	-176.5	-11	31.5	-10.7	0	0	0	112	S1133	P1131-S1133 PolarHBondContact O-N 2.84Å
1132	E	33.7	Very low	51.1	Low	161 Å²	161	112.3 Å²	112.3	75%	0.752	61%	0.61	S	S	*	*			trans	-29.1	113.5	-174	-64.4	-178	155.8	0	0	116.7	Y1134	E1132-Y1134 PolarHBondContact O-N 3.36Å
1133	S	43.7	Very low	52.2	Low	111 Å²	111	110.4 Å²	110.4	78%	0.776	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-74	126.7	-178.3	72.6	0	0	0	0	112.3	P1131	P1131-S1133 PolarHBondContact O-N 2.84Å
1134	Y	55.4	Low	53.6	Low	95 Å²	95	103.3 Å²	103.3	37%	0.373	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-72.8	139.8	172	-70.4	-81.8	0	0	0	109.8	E1132 N1136 V1144 R1147	E1132-Y1134 PolarHBondContact O-N 3.36Å; Y1134-N1136 PolarHBondContact O-N 2.86Å; Y1134-V1144 WeakPolarHBondContact CB-O 3.29Å; Y1134-R1147 HydrophobicContact CD1-CG 4.46Å; Y1134-R1147 HydrophobicContact CE1-CG 3.95Å
1135	P	65.9	Low	54.6	Low	60 Å²	60	102.5 Å²	102.5	39%	0.39	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-67.5	132.5	-175.9	25.9	-33	0	0	0	111.4	V1144 L1150 S1159	P1135-V1144 WeakPolarHBondContact O-CG2 3.18Å; P1135-L1150 HydrophobicContact CG-CD1 3.91Å; P1135-L1150 HydrophobicContact CG-CD2 4.2Å; P1135-S1159 WeakPolarHBondContact CB-OG 3.44Å; P1135-S1159 WeakPolarHBondContact CG-OG 3.31Å
1136	N	77.4	Confident	55.7	Low	90 Å²	90	105 Å²	105	48%	0.481	55%	0.552	S	S	.	*	B	Isolated β-bridge	trans	-65.9	140	177.2	-70.4	1.8	0	0	0	111.5	Y1134 S1138	Y1134-N1136 PolarHBondContact O-N 2.86Å; N1136-S1138 PolarHBondContact O-N 3.47Å
1137	C	84.7	Confident	56.9	Low	0 Å²	0	104.3 Å²	104.3	0%	0	54%	0.542	C	S	.	.	B	Isolated β-bridge	trans	-65.1	125.3	173.9	173.4	0	0	0	0	111	I1139 C1140 F1141 L1142 V1144 S1159 H1161	C1137-I1139 PolarHBondContact O-N 2.78Å; C1137-C1140 VanDerWaalsContact CB-SG 3.59Å; C1137-C1140 VanDerWaalsContact SG-SG 3.69Å; C1137-F1141 WeakPolarHBondContact O-CA 3.46Å; C1137-F1141 PolarHBondContact O-N 3.25Å; C1137-L1142 PolarHBondContact N-O 3.2Å; C1137-V1144 HydrophobicContact CB-CG2 4.26Å; C1137-S1159 CarbonylContact C-O 3.6Å; C1137-S1159 VanDerWaalsContact CA-O 3.27Å; C1137-S1159 WeakPolarHBondContact CA-O 3.38Å; C1137-H1161 VanDerWaalsContact CB-ND1 3.29Å; C1137-H1161 WeakPolarHBondContact CB-ND1 3.37Å; C1137-H1161 PolarHBondContact SG-N 2.95Å
1138	S	82.7	Confident	58.3	Low	50 Å²	50	103.1 Å²	103.1	35%	0.35	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	5.3	-177.7	-51.1	0	0	0	0	115.4	N1136 A1158 S1159	N1136-S1138 PolarHBondContact O-N 3.47Å; S1138-A1158 VanDerWaalsContact OG-CB 3.23Å; S1138-A1158 WeakPolarHBondContact OG-CB 3.44Å; S1138-S1159 PolarHBondContact N-O 3.01Å; S1138-S1159 PolarHBondContact OG-O 3.5Å
1139	I	82.1	Confident	60.3	Low	90 Å²	90	101.8 Å²	101.8	46%	0.462	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-51.8	172.7	-72	171	0	0	0	110.6	C1137 F1160 C1164	C1137-I1139 PolarHBondContact O-N 2.78Å; I1139-F1160 HydrophobicContact CD1-CD1 3.59Å; I1139-F1160 HydrophobicContact CD1-CE1 4Å; I1139-F1160 HydrophobicContact CG1-CD1 3.7Å; I1139-F1160 HydrophobicContact CG1-CE1 3.84Å; I1139-C1164 HydrophobicContact CB-CB 3.9Å; I1139-C1164 HydrophobicContact CD1-CB 3.9Å; I1139-C1164 WeakPolarHBondContact CD1-O 3.35Å; I1139-C1164 HydrophobicContact CG1-CB 4.46Å; I1139-C1164 HydrophobicContact CG2-CB 4Å
1140	C	85.2	Confident	62.9	Low	42 Å²	42	94.9 Å²	94.9	28%	0.284	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-4.6	-174.6	68.9	0	0	0	0	114.1	C1137 L1142 H1161	C1137-C1140 VanDerWaalsContact CB-SG 3.59Å; C1137-C1140 VanDerWaalsContact SG-SG 3.69Å; C1140-L1142 HydrophobicContact CB-CD1 4.33Å; C1140-L1142 PolarHBondContact O-N 3.49Å; C1140-H1161 VanDerWaalsContact SG-CE1 3.52Å; C1140-H1161 PolarHBondContact SG-ND1 2.88Å
1141	F	76.8	Confident	65.5	Low	155 Å²	155	89.3 Å²	89.3	68%	0.68	45%	0.451	S	S	*	.			trans	56.2	12	-179.9	-55	-81.8	0	0	0	115.4	C1137	C1137-F1141 WeakPolarHBondContact O-CA 3.46Å; C1137-F1141 PolarHBondContact O-N 3.25Å
1142	L	74.3	Confident	68	Low	116 Å²	116	85.5 Å²	85.5	61%	0.607	43%	0.43	S	S	*	.			trans	-85	139.9	173.5	-70.2	158.1	0	0	0	109.2	C1137 C1140	C1137-L1142 PolarHBondContact N-O 3.2Å; C1140-L1142 HydrophobicContact CB-CD1 4.33Å; C1140-L1142 PolarHBondContact O-N 3.49Å
1143	E	59	Low	70.6	Confident	110 Å²	110	78 Å²	78	51%	0.514	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-61.3	136.3	171.1	-170.6	173.5	-166.9	0	0	109.8	T1145	E1143-T1145 PolarHBondContact O-N 2.98Å
1144	V	60.8	Low	72.6	Confident	2 Å²	2	75.4 Å²	75.4	1%	0.012	38%	0.377	C	S	.	.			trans	-91	106	-176.1	-172.7	0	0	0	0	108.3	Y1134 P1135 C1137 Y1146 L1150 H1161	Y1134-V1144 WeakPolarHBondContact CB-O 3.29Å; P1135-V1144 WeakPolarHBondContact O-CG2 3.18Å; C1137-V1144 HydrophobicContact CB-CG2 4.26Å; V1144-Y1146 PolarHBondContact O-N 3.48Å; V1144-L1150 HydrophobicContact CB-CD1 3.49Å; V1144-L1150 VanDerWaalsContact CB-CD1 3.49Å; V1144-L1150 HydrophobicContact CB-CG 4.2Å; V1144-L1150 HydrophobicContact CG1-CB 4.1Å; V1144-L1150 HydrophobicContact CG1-CD1 3.55Å; V1144-L1150 HydrophobicContact CG1-CG 3.95Å; V1144-L1150 HydrophobicContact CG2-CD1 3.73Å; V1144-L1150 HydrophobicContact CG2-CG 4.06Å; V1144-H1161 WeakPolarHBondContact CG2-NE2 3.34Å
1145	T	52	Low	73.9	Confident	99 Å²	99	73.8 Å²	73.8	61%	0.607	38%	0.38	S	S	*	.	S	Bend	trans	-74.1	-4.7	-175.2	58.3	0	0	0	0	114.7	E1143	E1143-T1145 PolarHBondContact O-N 2.98Å
1146	Y	55.5	Low	74.9	Confident	130 Å²	130	73.5 Å²	73.5	51%	0.51	38%	0.378	S	S	.	.			trans	-147.3	120.9	-178.4	-72.3	-82.9	0	0	0	113.1	V1144 K1148 H1149	V1144-Y1146 PolarHBondContact O-N 3.48Å; Y1146-K1148 VanDerWaalsContact C-N 3.25Å; Y1146-K1148 PolarHBondContact O-N 3.02Å; Y1146-K1148 VanDerWaalsContact O-N 3.17Å; Y1146-H1149 PolarHBondContact O-N 2.98Å; Y1146-H1149 VanDerWaalsContact O-N 3.09Å
1147	R	56.2	Low	75.2	Confident	172 Å²	172	74.8 Å²	74.8	65%	0.649	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-54.4	-33.4	178.7	-78.4	-175.3	176.4	174.1	2.3	114.1	Y1134 H1149 L1150 K1169	Y1134-R1147 HydrophobicContact CD1-CG 4.46Å; Y1134-R1147 HydrophobicContact CE1-CG 3.95Å; R1147-H1149 PolarHBondContact O-N 3.29Å; R1147-H1149 VanDerWaalsContact O-N 3.16Å; R1147-L1150 WeakPolarHBondContact O-CB 3.41Å; R1147-L1150 PolarHBondContact O-N 2.83Å; R1147-K1169 PolarHBondContact O-NZ 3.27Å
1148	K	59.9	Low	75.3	Confident	141 Å²	141	75.9 Å²	75.9	61%	0.613	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-60.6	-26	179.4	-71.8	-170.3	177.5	-174.5	0	112.9	Y1146 K1169	Y1146-K1148 VanDerWaalsContact C-N 3.25Å; Y1146-K1148 PolarHBondContact O-N 3.02Å; Y1146-K1148 VanDerWaalsContact O-N 3.17Å; K1148-K1169 WeakPolarHBondContact O-CD 3.17Å; K1148-K1169 WeakPolarHBondContact O-CE 3.34Å; K1148-K1169 PolarHBondContact O-NZ 3.43Å
1149	H	70.5	Confident	75.5	Confident	102 Å²	102	74.1 Å²	74.1	47%	0.472	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-96.2	12.9	-178.1	-64	-49.7	0	0	0	114.8	Y1146 R1147 H1161 T1162	Y1146-H1149 PolarHBondContact O-N 2.98Å; Y1146-H1149 VanDerWaalsContact O-N 3.09Å; R1147-H1149 PolarHBondContact O-N 3.29Å; R1147-H1149 VanDerWaalsContact O-N 3.16Å; H1149-H1161 CarbonylContact O-C 3.21Å; H1149-H1161 VanDerWaalsContact O-CA 3.26Å; H1149-H1161 WeakPolarHBondContact O-CA 3.38Å; H1149-T1162 PolarHBondContact O-N 3.22Å; H1149-T1162 PolarHBondContact O-OG1 3.01Å
1150	L	79.7	Confident	75.9	Confident	25 Å²	25	70.4 Å²	70.4	13%	0.131	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.9	-167.8	-149.2	157.5	0	0	0	111.9	P1135 V1144 R1147 S1159 F1160 K1169	P1135-L1150 HydrophobicContact CG-CD1 3.91Å; P1135-L1150 HydrophobicContact CG-CD2 4.2Å; V1144-L1150 HydrophobicContact CB-CD1 3.49Å; V1144-L1150 VanDerWaalsContact CB-CD1 3.49Å; V1144-L1150 HydrophobicContact CB-CG 4.2Å; V1144-L1150 HydrophobicContact CG1-CB 4.1Å; V1144-L1150 HydrophobicContact CG1-CD1 3.55Å; V1144-L1150 HydrophobicContact CG1-CG 3.95Å; V1144-L1150 HydrophobicContact CG2-CD1 3.73Å; V1144-L1150 HydrophobicContact CG2-CG 4.06Å; R1147-L1150 WeakPolarHBondContact O-CB 3.41Å; R1147-L1150 PolarHBondContact O-N 2.83Å; L1150-S1159 WeakPolarHBondContact CD2-OG 2.84Å; L1150-F1160 CarbonylContact C-O 3.55Å; L1150-F1160 WeakPolarHBondContact CA-O 3.41Å; L1150-K1169 WeakPolarHBondContact O-CE 3.31Å; L1150-K1169 PolarHBondContact O-NZ 3.2Å
1151	I	85.9	Confident	76	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.3	174.2	-169.7	169.5	0	0	0	109.9	F1160 A1165 V1167 V1172 W1177	I1151-F1160 HydrophobicContact CG2-CB 4.02Å; I1151-F1160 PolarHBondContact N-O 2.89Å; I1151-F1160 PolarHBondContact O-N 2.86Å; I1151-A1165 HydrophobicContact CG2-CB 3.77Å; I1151-V1167 HydrophobicContact CD1-CG1 3.89Å; I1151-V1172 HydrophobicContact CD1-CG2 3.7Å; I1151-W1177 HydrophobicContact CD1-CB 3.96Å; I1151-W1177 HydrophobicContact CD1-CD2 3.55Å; I1151-W1177 HydrophobicContact CD1-CE3 3.84Å; I1151-W1177 HydrophobicContact CD1-CG 3.58Å; I1151-W1177 HydrophobicContact CG1-CD2 4.01Å; I1151-W1177 HydrophobicContact CG1-CE3 3.74Å; I1151-W1177 HydrophobicContact CG1-CG 4.38Å; I1151-W1177 HydrophobicContact CG1-CZ3 4.26Å; I1151-W1177 HydrophobicContact CG2-CE3 4.33Å; I1151-W1177 HydrophobicContact CG2-CH2 4.13Å; I1151-W1177 HydrophobicContact CG2-CZ3 4.02Å
1152	A	85.7	Confident	76.5	Confident	44 Å²	44	63.6 Å²	63.6	36%	0.364	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	139	179.9	0	0	0	0	0	110.9	S1154 A1158	A1152-S1154 PolarHBondContact O-N 3.25Å; A1152-A1158 WeakPolarHBondContact CA-O 3.5Å
1153	C	88.9	Confident	77	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.014	34%	0.343	C	S	.	.			trans	-72.1	123.7	173.5	176.1	0	0	0	0	110.7	S1155 C1156 T1157 A1158 F1160 W1177 C1179	C1153-S1155 PolarHBondContact O-N 3.4Å; C1153-S1155 PolarHBondContact SG-N 2.75Å; C1153-S1155 VanDerWaalsContact SG-N 3.4Å; C1153-C1156 VanDerWaalsContact CB-SG 3.59Å; C1153-C1156 PolarHBondContact SG-SG 3.04Å; C1153-T1157 VanDerWaalsContact O-CA 3.27Å; C1153-T1157 WeakPolarHBondContact O-CA 3.35Å; C1153-T1157 PolarHBondContact O-N 2.81Å; C1153-A1158 PolarHBondContact N-O 3.27Å; C1153-F1160 HydrophobicContact CB-CE2 3.92Å; C1153-W1177 HydrophobicContact CB-CE3 4.44Å; C1153-W1177 HydrophobicContact CB-CZ3 4.08Å; C1153-C1179 HydrophobicContact CB-CB 3.99Å; C1153-C1179 PolarHBondContact SG-N 3.22Å; C1153-C1179 VanDerWaalsContact SG-SG 3.69Å
1154	S	86	Confident	78.3	Confident	58 Å²	58	63.3 Å²	63.3	41%	0.406	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-15.9	176.9	65.7	0	0	0	0	114.4	A1152 S1175 L1176 W1177 K1178	A1152-S1154 PolarHBondContact O-N 3.25Å; S1154-S1175 WeakPolarHBondContact CB-O 3.36Å; S1154-L1176 PolarHBondContact OG-O 2.75Å; S1154-W1177 WeakPolarHBondContact CB-O 3.34Å; S1154-W1177 PolarHBondContact N-O 3.09Å; S1154-W1177 PolarHBondContact OG-O 2.92Å; S1154-K1178 WeakPolarHBondContact OG-CG 3.49Å
1155	S	83.2	Confident	79.5	Confident	61 Å²	61	64.1 Å²	64.1	43%	0.427	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-40.1	-176.9	-58.6	0	0	0	0	114.3	C1153 K1178	C1153-S1155 PolarHBondContact O-N 3.4Å; C1153-S1155 PolarHBondContact SG-N 2.75Å; C1153-S1155 VanDerWaalsContact SG-N 3.4Å; S1155-K1178 VanDerWaalsContact OG-CD 3.32Å; S1155-K1178 WeakPolarHBondContact OG-CD 3.39Å; S1155-K1178 WeakPolarHBondContact OG-CE 3.37Å; S1155-K1178 WeakPolarHBondContact OG-CG 3.46Å
1156	C	86.3	Confident	81.2	Confident	53 Å²	53	64.6 Å²	64.6	36%	0.358	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	4.5	-176.5	65.7	0	0	0	0	114.2	C1153 A1158	C1153-C1156 VanDerWaalsContact CB-SG 3.59Å; C1153-C1156 PolarHBondContact SG-SG 3.04Å; C1156-A1158 PolarHBondContact O-N 3.49Å
1157	T	83.5	Confident	82.5	Confident	118 Å²	118	59.6 Å²	59.6	72%	0.724	33%	0.328	S	S	*	.			trans	55.9	1.4	-179.6	62.7	0	0	0	0	115.8	C1153 S1159	C1153-T1157 VanDerWaalsContact O-CA 3.27Å; C1153-T1157 WeakPolarHBondContact O-CA 3.35Å; C1153-T1157 PolarHBondContact O-N 2.81Å; T1157-S1159 PolarHBondContact O-N 2.78Å
1158	A	86.2	Confident	83.7	Confident	23 Å²	23	57.3 Å²	57.3	19%	0.19	32%	0.323	C	S	.	.			trans	-56.6	136.1	172.2	0	0	0	0	0	110.4	S1138 A1152 C1153 C1156 F1160	S1138-A1158 VanDerWaalsContact OG-CB 3.23Å; S1138-A1158 WeakPolarHBondContact OG-CB 3.44Å; A1152-A1158 WeakPolarHBondContact CA-O 3.5Å; C1153-A1158 PolarHBondContact N-O 3.27Å; C1156-A1158 PolarHBondContact O-N 3.49Å; A1158-F1160 HydrophobicContact CB-CE2 3.64Å; A1158-F1160 HydrophobicContact CB-CZ 3.76Å; A1158-F1160 VanDerWaalsContact O-CD2 3.29Å; A1158-F1160 WeakPolarHBondContact O-CD2 3.34Å; A1158-F1160 WeakPolarHBondContact O-CE2 3.38Å
1159	S	87.4	Confident	84.4	Confident	13 Å²	13	54.1 Å²	54.1	9%	0.091	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	142.3	-179.8	-73.1	0	0	0	0	110.4	P1135 C1137 S1138 L1150 T1157	P1135-S1159 WeakPolarHBondContact CB-OG 3.44Å; P1135-S1159 WeakPolarHBondContact CG-OG 3.31Å; C1137-S1159 CarbonylContact C-O 3.6Å; C1137-S1159 VanDerWaalsContact CA-O 3.27Å; C1137-S1159 WeakPolarHBondContact CA-O 3.38Å; S1138-S1159 PolarHBondContact N-O 3.01Å; S1138-S1159 PolarHBondContact OG-O 3.5Å; L1150-S1159 WeakPolarHBondContact CD2-OG 2.84Å; T1157-S1159 PolarHBondContact O-N 2.78Å
1160	F	89.9	Confident	84.6	Confident	12 Å²	12	54.5 Å²	54.5	5%	0.053	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.1	-178.9	-57.4	-93.6	0	0	0	109.5	I1139 L1150 I1151 C1153 A1158 T1162 A1165 W1177 C1179	I1139-F1160 HydrophobicContact CD1-CD1 3.59Å; I1139-F1160 HydrophobicContact CD1-CE1 4Å; I1139-F1160 HydrophobicContact CG1-CD1 3.7Å; I1139-F1160 HydrophobicContact CG1-CE1 3.84Å; L1150-F1160 CarbonylContact C-O 3.55Å; L1150-F1160 WeakPolarHBondContact CA-O 3.41Å; I1151-F1160 HydrophobicContact CG2-CB 4.02Å; I1151-F1160 PolarHBondContact N-O 2.89Å; I1151-F1160 PolarHBondContact O-N 2.86Å; C1153-F1160 HydrophobicContact CB-CE2 3.92Å; A1158-F1160 HydrophobicContact CB-CE2 3.64Å; A1158-F1160 HydrophobicContact CB-CZ 3.76Å; A1158-F1160 VanDerWaalsContact O-CD2 3.29Å; A1158-F1160 WeakPolarHBondContact O-CD2 3.34Å; A1158-F1160 WeakPolarHBondContact O-CE2 3.38Å; F1160-T1162 PolarHBondContact O-N 3.25Å; F1160-A1165 HydrophobicContact CB-CB 3.82Å; F1160-A1165 HydrophobicContact CG-CB 4.45Å; F1160-W1177 HydrophobicContact CB-CH2 4.46Å; F1160-W1177 AromaticContact CD2-CH2 3.67Å; F1160-W1177 HydrophobicContact CD2-CH2 3.67Å; F1160-W1177 AromaticContact CD2-CZ3 3.59Å; F1160-W1177 HydrophobicContact CD2-CZ3 3.59Å; F1160-W1177 HydrophobicContact CE2-CH2 4.1Å; F1160-W1177 AromaticContact CE2-CZ3 3.98Å; F1160-W1177 HydrophobicContact CE2-CZ3 3.98Å; F1160-W1177 HydrophobicContact CG-CH2 4.06Å; F1160-W1177 HydrophobicContact CG-CZ3 4.39Å; F1160-C1179 HydrophobicContact CD2-CB 4.49Å; F1160-C1179 HydrophobicContact CE1-CB 4.21Å; F1160-C1179 HydrophobicContact CE2-CB 3.58Å; F1160-C1179 HydrophobicContact CZ-CB 3.41Å; F1160-C1179 VanDerWaalsContact CZ-CB 3.41Å
1161	H	89.3	Confident	84.5	Confident	37 Å²	37	59.2 Å²	59.2	17%	0.171	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	134.9	158.2	-65.3	114.8	0	0	0	108.3	C1137 C1140 V1144 H1149 K1163 C1164 A1165	C1137-H1161 VanDerWaalsContact CB-ND1 3.29Å; C1137-H1161 WeakPolarHBondContact CB-ND1 3.37Å; C1137-H1161 PolarHBondContact SG-N 2.95Å; C1140-H1161 VanDerWaalsContact SG-CE1 3.52Å; C1140-H1161 PolarHBondContact SG-ND1 2.88Å; V1144-H1161 WeakPolarHBondContact CG2-NE2 3.34Å; H1149-H1161 CarbonylContact O-C 3.21Å; H1149-H1161 VanDerWaalsContact O-CA 3.26Å; H1149-H1161 WeakPolarHBondContact O-CA 3.38Å; H1161-K1163 PolarHBondContact O-N 2.92Å; H1161-K1163 VanDerWaalsContact O-N 3.16Å; H1161-C1164 HydrophobicContact CB-CB 3.9Å; H1161-C1164 CarbonylContact O-C 3.52Å; H1161-C1164 WeakPolarHBondContact O-CA 3.24Å; H1161-C1164 WeakPolarHBondContact O-CB 3.21Å; H1161-C1164 PolarHBondContact O-N 3.31Å; H1161-A1165 WeakPolarHBondContact O-CB 3.43Å; H1161-A1165 PolarHBondContact O-N 3.46Å
1162	T	85.5	Confident	84.1	Confident	16 Å²	16	61.2 Å²	61.2	10%	0.098	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.8	-44.1	169.7	44.2	0	0	0	0	111.9	H1149 F1160 A1165 S1166 V1167 K1169	H1149-T1162 PolarHBondContact O-N 3.22Å; H1149-T1162 PolarHBondContact O-OG1 3.01Å; F1160-T1162 PolarHBondContact O-N 3.25Å; T1162-A1165 PolarHBondContact O-N 2.87Å; T1162-S1166 PolarHBondContact O-N 3.48Å; T1162-V1167 CarbonylContact C-O 3.45Å; T1162-V1167 WeakPolarHBondContact CA-O 3.3Å; T1162-V1167 VanDerWaalsContact CB-O 3.23Å; T1162-V1167 WeakPolarHBondContact CB-O 3.47Å; T1162-V1167 PolarHBondContact O-N 3.28Å; T1162-V1167 VanDerWaalsContact O-O 3.05Å; T1162-K1169 HydrophobicContact CG2-CD 4.43Å; T1162-K1169 HydrophobicContact CG2-CG 3.8Å
1163	K	85.4	Confident	83.8	Confident	183 Å²	183	62.7 Å²	62.7	80%	0.796	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-43.7	172.9	-70.1	-177.1	179.7	174.3	0	113.6	H1161 S1166	H1161-K1163 PolarHBondContact O-N 2.92Å; H1161-K1163 VanDerWaalsContact O-N 3.16Å; K1163-S1166 PolarHBondContact O-N 3.42Å; K1163-S1166 VanDerWaalsContact O-N 3.15Å
1164	C	86.8	Confident	83.4	Confident	37 Å²	37	66 Å²	66	25%	0.25	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-37.9	177.8	-67.9	0	0	0	0	112	I1139 H1161 S1166	I1139-C1164 HydrophobicContact CB-CB 3.9Å; I1139-C1164 HydrophobicContact CD1-CB 3.9Å; I1139-C1164 WeakPolarHBondContact CD1-O 3.35Å; I1139-C1164 HydrophobicContact CG1-CB 4.46Å; I1139-C1164 HydrophobicContact CG2-CB 4Å; H1161-C1164 HydrophobicContact CB-CB 3.9Å; H1161-C1164 CarbonylContact O-C 3.52Å; H1161-C1164 WeakPolarHBondContact O-CA 3.24Å; H1161-C1164 WeakPolarHBondContact O-CB 3.21Å; H1161-C1164 PolarHBondContact O-N 3.31Å; C1164-S1166 PolarHBondContact O-N 2.9Å
1165	A	86.3	Confident	82.8	Confident	19 Å²	19	67.2 Å²	67.2	16%	0.157	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-8.3	172.7	0	0	0	0	0	113.3	I1151 F1160 H1161 T1162 V1167 W1177	I1151-A1165 HydrophobicContact CG2-CB 3.77Å; F1160-A1165 HydrophobicContact CB-CB 3.82Å; F1160-A1165 HydrophobicContact CG-CB 4.45Å; H1161-A1165 WeakPolarHBondContact O-CB 3.43Å; H1161-A1165 PolarHBondContact O-N 3.46Å; T1162-A1165 PolarHBondContact O-N 2.87Å; A1165-V1167 VanDerWaalsContact C-N 3.28Å; A1165-V1167 HydrophobicContact CB-CB 4.36Å; A1165-V1167 WeakPolarHBondContact O-CG2 3.11Å; A1165-V1167 PolarHBondContact O-N 2.94Å; A1165-W1177 HydrophobicContact CB-CH2 3.71Å; A1165-W1177 HydrophobicContact CB-CZ2 3.62Å
1166	S	86.7	Confident	82.8	Confident	110 Å²	110	67.6 Å²	67.6	77%	0.769	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	42.1	-174.1	-56.7	0	0	0	0	113.1	T1162 K1163 C1164	T1162-S1166 PolarHBondContact O-N 3.48Å; K1163-S1166 PolarHBondContact O-N 3.42Å; K1163-S1166 VanDerWaalsContact O-N 3.15Å; C1164-S1166 PolarHBondContact O-N 2.9Å
1167	V	82.8	Confident	83	Confident	25 Å²	25	66.8 Å²	66.8	15%	0.152	37%	0.373	C	S	.	.			trans	-136.9	136	-173.6	164.2	0	0	0	0	110.2	I1151 T1162 A1165 V1172 W1177	I1151-V1167 HydrophobicContact CD1-CG1 3.89Å; T1162-V1167 CarbonylContact C-O 3.45Å; T1162-V1167 WeakPolarHBondContact CA-O 3.3Å; T1162-V1167 VanDerWaalsContact CB-O 3.23Å; T1162-V1167 WeakPolarHBondContact CB-O 3.47Å; T1162-V1167 PolarHBondContact O-N 3.28Å; T1162-V1167 VanDerWaalsContact O-O 3.05Å; A1165-V1167 VanDerWaalsContact C-N 3.28Å; A1165-V1167 HydrophobicContact CB-CB 4.36Å; A1165-V1167 WeakPolarHBondContact O-CG2 3.11Å; A1165-V1167 PolarHBondContact O-N 2.94Å; V1167-V1172 HydrophobicContact CG1-CB 4.13Å; V1167-V1172 HydrophobicContact CG1-CG1 3.52Å; V1167-V1172 HydrophobicContact CG1-CG2 3.45Å; V1167-V1172 VanDerWaalsContact CG1-CG2 3.45Å; V1167-V1172 HydrophobicContact CG2-CG1 4.47Å; V1167-W1177 HydrophobicContact CG2-CZ2 4.37Å
1168	K	81.8	Confident	83.2	Confident	124 Å²	124	66.2 Å²	66.2	54%	0.539	36%	0.36	S	S	.	.			trans	-90.3	132.2	164.4	-57.3	-168.5	-155	137.3	0	109.1	S1170 E1171	K1168-S1170 PolarHBondContact O-N 2.53Å; K1168-E1171 HydrophobicContact CB-CB 4.36Å; K1168-E1171 HydrophobicContact CB-CG 4.06Å; K1168-E1171 VanDerWaalsContact CD-OE1 3.32Å; K1168-E1171 WeakPolarHBondContact CD-OE1 3.38Å; K1168-E1171 WeakPolarHBondContact CE-OE1 3.43Å; K1168-E1171 IonicContact NZ-OE1 2.76Å; K1168-E1171 PolarHBondContact NZ-OE1 3.22Å; K1168-E1171 PolarHBondContact O-N 3.43Å
1169	K	74.4	Confident	83.4	Confident	73 Å²	73	65.3 Å²	65.3	32%	0.317	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-54.5	-36.6	179.1	-84.5	-173.8	177.8	-175.2	0	112.9	R1147 K1148 L1150 T1162 E1171 V1172	R1147-K1169 PolarHBondContact O-NZ 3.27Å; K1148-K1169 WeakPolarHBondContact O-CD 3.17Å; K1148-K1169 WeakPolarHBondContact O-CE 3.34Å; K1148-K1169 PolarHBondContact O-NZ 3.43Å; L1150-K1169 WeakPolarHBondContact O-CE 3.31Å; L1150-K1169 PolarHBondContact O-NZ 3.2Å; T1162-K1169 HydrophobicContact CG2-CD 4.43Å; T1162-K1169 HydrophobicContact CG2-CG 3.8Å; K1169-E1171 PolarHBondContact O-N 3.06Å; K1169-V1172 PolarHBondContact O-N 3.43Å
1170	S	74.5	Confident	83.3	Confident	110 Å²	110	68.8 Å²	68.8	77%	0.769	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-65.9	-14.2	177.3	56.5	0	0	0	0	114.8	K1168	K1168-S1170 PolarHBondContact O-N 2.53Å
1171	E	78	Confident	83	Confident	125 Å²	125	75.6 Å²	75.6	58%	0.584	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-105.9	0.2	-175.2	-66.1	172	-176.1	0	0	112.7	K1168 K1169	K1168-E1171 HydrophobicContact CB-CB 4.36Å; K1168-E1171 HydrophobicContact CB-CG 4.06Å; K1168-E1171 VanDerWaalsContact CD-OE1 3.32Å; K1168-E1171 WeakPolarHBondContact CD-OE1 3.38Å; K1168-E1171 WeakPolarHBondContact CE-OE1 3.43Å; K1168-E1171 IonicContact NZ-OE1 2.76Å; K1168-E1171 PolarHBondContact NZ-OE1 3.22Å; K1168-E1171 PolarHBondContact O-N 3.43Å; K1169-E1171 PolarHBondContact O-N 3.06Å
1172	V	77.2	Confident	82.7	Confident	43 Å²	43	75 Å²	75	26%	0.261	41%	0.414	S	S	.	.	S	Bend	trans	-135.4	148.3	-176.1	-64	0	0	0	0	112.5	I1151 V1167 K1169 V1174	I1151-V1172 HydrophobicContact CD1-CG2 3.7Å; V1167-V1172 HydrophobicContact CG1-CB 4.13Å; V1167-V1172 HydrophobicContact CG1-CG1 3.52Å; V1167-V1172 HydrophobicContact CG1-CG2 3.45Å; V1167-V1172 VanDerWaalsContact CG1-CG2 3.45Å; V1167-V1172 HydrophobicContact CG2-CG1 4.47Å; K1169-V1172 PolarHBondContact O-N 3.43Å; V1172-V1174 PolarHBondContact O-N 3.33Å; V1172-V1174 VanDerWaalsContact O-N 3.11Å
1173	N	80.9	Confident	82.4	Confident	75 Å²	75	77.5 Å²	77.5	40%	0.401	44%	0.437	S	S	.	.			trans	-75.3	100.7	166.6	-172.6	-54.8	0	0	0	108.9	S1175 L1176 W1177 R1199	N1173-S1175 PolarHBondContact O-N 3.2Å; N1173-S1175 VanDerWaalsContact O-N 3.15Å; N1173-S1175 PolarHBondContact OD1-N 3.15Å; N1173-S1175 PolarHBondContact OD1-OG 3.49Å; N1173-L1176 HydrophobicContact CB-CB 4.39Å; N1173-L1176 HydrophobicContact CB-CD1 4.45Å; N1173-L1176 PolarHBondContact O-N 3.19Å; N1173-L1176 PolarHBondContact OD1-N 3.29Å; N1173-W1177 PolarHBondContact O-N 3.34Å; N1173-W1177 VanDerWaalsContact O-N 3.07Å; N1173-R1199 PolarHBondContact ND2-NH2 3.29Å; N1173-R1199 VanDerWaalsContact ND2-NH2 3.15Å
1174	V	79	Confident	81.9	Confident	71 Å²	71	72.4 Å²	72.4	43%	0.43	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-37.7	-174.4	-178	0	0	0	0	112.1	V1172 L1176	V1172-V1174 PolarHBondContact O-N 3.33Å; V1172-V1174 VanDerWaalsContact O-N 3.11Å; V1174-L1176 VanDerWaalsContact C-N 3.27Å; V1174-L1176 PolarHBondContact O-N 2.65Å
1175	S	74.5	Confident	80.6	Confident	83 Å²	83	75.3 Å²	75.3	58%	0.58	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-18.8	-179.8	75.4	0	0	0	0	114.8	S1154 N1173	S1154-S1175 WeakPolarHBondContact CB-O 3.36Å; N1173-S1175 PolarHBondContact O-N 3.2Å; N1173-S1175 VanDerWaalsContact O-N 3.15Å; N1173-S1175 PolarHBondContact OD1-N 3.15Å; N1173-S1175 PolarHBondContact OD1-OG 3.49Å
1176	L	82.1	Confident	78.7	Confident	69 Å²	69	80.2 Å²	80.2	36%	0.361	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-10.5	-175.5	-68.4	171.9	0	0	0	113.5	S1154 N1173 V1174 K1178	S1154-L1176 PolarHBondContact OG-O 2.75Å; N1173-L1176 HydrophobicContact CB-CB 4.39Å; N1173-L1176 HydrophobicContact CB-CD1 4.45Å; N1173-L1176 PolarHBondContact O-N 3.19Å; N1173-L1176 PolarHBondContact OD1-N 3.29Å; V1174-L1176 VanDerWaalsContact C-N 3.27Å; V1174-L1176 PolarHBondContact O-N 2.65Å; L1176-K1178 PolarHBondContact O-N 3.24Å
1177	W	90.5	Very high	76.5	Confident	36 Å²	36	80.1 Å²	80.1	14%	0.136	48%	0.481	C	S	.	.			trans	-61.3	133	-176.5	-177.7	83.3	0	0	0	111.9	I1151 C1153 S1154 F1160 A1165 V1167 N1173 C1179	I1151-W1177 HydrophobicContact CD1-CB 3.96Å; I1151-W1177 HydrophobicContact CD1-CD2 3.55Å; I1151-W1177 HydrophobicContact CD1-CE3 3.84Å; I1151-W1177 HydrophobicContact CD1-CG 3.58Å; I1151-W1177 HydrophobicContact CG1-CD2 4.01Å; I1151-W1177 HydrophobicContact CG1-CE3 3.74Å; I1151-W1177 HydrophobicContact CG1-CG 4.38Å; I1151-W1177 HydrophobicContact CG1-CZ3 4.26Å; I1151-W1177 HydrophobicContact CG2-CE3 4.33Å; I1151-W1177 HydrophobicContact CG2-CH2 4.13Å; I1151-W1177 HydrophobicContact CG2-CZ3 4.02Å; C1153-W1177 HydrophobicContact CB-CE3 4.44Å; C1153-W1177 HydrophobicContact CB-CZ3 4.08Å; S1154-W1177 WeakPolarHBondContact CB-O 3.34Å; S1154-W1177 PolarHBondContact N-O 3.09Å; S1154-W1177 PolarHBondContact OG-O 2.92Å; F1160-W1177 HydrophobicContact CB-CH2 4.46Å; F1160-W1177 AromaticContact CD2-CH2 3.67Å; F1160-W1177 HydrophobicContact CD2-CH2 3.67Å; F1160-W1177 AromaticContact CD2-CZ3 3.59Å; F1160-W1177 HydrophobicContact CD2-CZ3 3.59Å; F1160-W1177 HydrophobicContact CE2-CH2 4.1Å; F1160-W1177 AromaticContact CE2-CZ3 3.98Å; F1160-W1177 HydrophobicContact CE2-CZ3 3.98Å; F1160-W1177 HydrophobicContact CG-CH2 4.06Å; F1160-W1177 HydrophobicContact CG-CZ3 4.39Å; A1165-W1177 HydrophobicContact CB-CH2 3.71Å; A1165-W1177 HydrophobicContact CB-CZ2 3.62Å; V1167-W1177 HydrophobicContact CG2-CZ2 4.37Å; N1173-W1177 PolarHBondContact O-N 3.34Å; N1173-W1177 VanDerWaalsContact O-N 3.07Å; W1177-C1179 HydrophobicContact CH2-CB 3.95Å; W1177-C1179 HydrophobicContact CZ3-CB 4.23Å
1178	K	88.1	Confident	74.6	Confident	106 Å²	106	87.8 Å²	87.8	46%	0.461	52%	0.516	S	S	.	.			trans	-115.6	139.9	175.9	-64.7	-171.5	179.6	-170.6	0	109.6	S1154 S1155 L1176 C1182 A1183	S1154-K1178 WeakPolarHBondContact OG-CG 3.49Å; S1155-K1178 VanDerWaalsContact OG-CD 3.32Å; S1155-K1178 WeakPolarHBondContact OG-CD 3.39Å; S1155-K1178 WeakPolarHBondContact OG-CE 3.37Å; S1155-K1178 WeakPolarHBondContact OG-CG 3.46Å; L1176-K1178 PolarHBondContact O-N 3.24Å; K1178-C1182 HydrophobicContact CB-CB 4.23Å; K1178-A1183 HydrophobicContact CB-CB 4.42Å
1179	C	91.6	Very high	72.5	Confident	4 Å²	4	90.1 Å²	90.1	3%	0.027	53%	0.528	C	S	.	.			trans	-66	161.3	171.8	72.9	0	0	0	0	111.1	C1153 F1160 W1177 Q1181 C1182 A1183	C1153-C1179 HydrophobicContact CB-CB 3.99Å; C1153-C1179 PolarHBondContact SG-N 3.22Å; C1153-C1179 VanDerWaalsContact SG-SG 3.69Å; F1160-C1179 HydrophobicContact CD2-CB 4.49Å; F1160-C1179 HydrophobicContact CE1-CB 4.21Å; F1160-C1179 HydrophobicContact CE2-CB 3.58Å; F1160-C1179 HydrophobicContact CZ-CB 3.41Å; F1160-C1179 VanDerWaalsContact CZ-CB 3.41Å; W1177-C1179 HydrophobicContact CH2-CB 3.95Å; W1177-C1179 HydrophobicContact CZ3-CB 4.23Å; C1179-Q1181 PolarHBondContact O-N 2.84Å; C1179-Q1181 VanDerWaalsContact O-N 3.1Å; C1179-C1182 PolarHBondContact O-N 3.43Å; C1179-C1182 PolarHBondContact SG-N 3.2Å; C1179-C1182 VanDerWaalsContact SG-SG 3.66Å; C1179-A1183 WeakPolarHBondContact O-CB 2.72Å; C1179-A1183 PolarHBondContact O-N 2.78Å
1180	A	83.7	Confident	70.6	Confident	86 Å²	86	98.2 Å²	98.2	71%	0.711	56%	0.557	S	S	*	*	H	α-helix	trans	-53.2	-35.6	-178.3	0	0	0	0	0	113.5	A1184	A1180-A1184 VanDerWaalsContact O-CB 3.27Å; A1180-A1184 WeakPolarHBondContact O-CB 3.46Å; A1180-A1184 PolarHBondContact O-N 2.56Å; A1180-A1184 VanDerWaalsContact O-N 3.13Å
1181	Q	83.4	Confident	68.6	Low	155 Å²	155	98 Å²	98	72%	0.724	56%	0.555	S	S	*	*	H	α-helix	trans	-68.5	-46.2	176.9	-71	170.8	-18.9	0	0	112.3	C1179 A1183 A1184	C1179-Q1181 PolarHBondContact O-N 2.84Å; C1179-Q1181 VanDerWaalsContact O-N 3.1Å; Q1181-A1183 VanDerWaalsContact C-N 3.32Å; Q1181-A1184 PolarHBondContact O-N 2.94Å
1182	C	82.7	Confident	66.2	Low	24 Å²	24	100.3 Å²	100.3	16%	0.162	56%	0.564	C	S	.	*	H	α-helix	trans	-74.9	-21.5	178.5	-67.9	0	0	0	0	113.5	K1178 C1179 T1185	K1178-C1182 HydrophobicContact CB-CB 4.23Å; C1179-C1182 PolarHBondContact O-N 3.43Å; C1179-C1182 PolarHBondContact SG-N 3.2Å; C1179-C1182 VanDerWaalsContact SG-SG 3.66Å; C1182-T1185 PolarHBondContact O-OG1 3.1Å
1183	A	81	Confident	63.9	Low	70 Å²	70	103.7 Å²	103.7	58%	0.579	58%	0.576	S	S	*	*	H	α-helix	trans	-76.8	-26.9	171.3	0	0	0	0	0	112.3	K1178 C1179 Q1181	K1178-A1183 HydrophobicContact CB-CB 4.42Å; C1179-A1183 WeakPolarHBondContact O-CB 2.72Å; C1179-A1183 PolarHBondContact O-N 2.78Å; Q1181-A1183 VanDerWaalsContact C-N 3.32Å
1184	A	74.6	Confident	61.2	Low	76 Å²	76	102.3 Å²	102.3	63%	0.628	57%	0.569	S	S	*	*	H	α-helix	trans	-88.6	-8.7	-176.6	0	0	0	0	0	115.2	A1180 Q1181 P1186	A1180-A1184 VanDerWaalsContact O-CB 3.27Å; A1180-A1184 WeakPolarHBondContact O-CB 3.46Å; A1180-A1184 PolarHBondContact O-N 2.56Å; A1180-A1184 VanDerWaalsContact O-N 3.13Å; Q1181-A1184 PolarHBondContact O-N 2.94Å; A1184-P1186 WeakPolarHBondContact O-CD 3.26Å
1185	T	59.3	Low	58.7	Low	98 Å²	98	104.4 Å²	104.4	60%	0.601	58%	0.582	S	S	*	*	S	Bend	trans	-84.4	121.9	178.9	43.8	0	0	0	0	112.2	C1182	C1182-T1185 PolarHBondContact O-OG1 3.1Å
1186	P	47.2	Very low	56.5	Low	121 Å²	121	108.1 Å²	108.1	79%	0.786	59%	0.588	S	S	*	*			trans	-63.3	148.3	175.1	-17.7	30.5	0	0	0	112.7	A1184 E1188	A1184-P1186 WeakPolarHBondContact O-CD 3.26Å; P1186-E1188 VanDerWaalsContact C-N 3.3Å; P1186-E1188 PolarHBondContact O-N 2.77Å
1187	A	39.5	Very low	53.8	Low	109 Å²	109	110.9 Å²	110.9	90%	0.901	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	21.8	-161.6	0	0	0	0	0	117.7
1188	E	41.9	Very low	50.9	Low	186 Å²	186	112.4 Å²	112.4	87%	0.869	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-1.2	-166.2	-73.7	-171.9	163.1	0	0	117.7	P1186	P1186-E1188 VanDerWaalsContact C-N 3.3Å; P1186-E1188 PolarHBondContact O-N 2.77Å
1189	E	38.1	Very low	48.1	Very low	172 Å²	172	115.9 Å²	115.9	80%	0.804	63%	0.633	S	S	*	*			trans	-136.3	105.5	177.1	-70.7	-177	169.1	0	0	111.9
1190	R	34.8	Very low	45.2	Very low	244 Å²	244	121.2 Å²	121.2	92%	0.921	67%	0.67	S	S	*	*			trans	158.6	133	138.9	-82.8	157.8	-170.4	-151.5	2	113.4
1191	S	32	Very low	42.5	Very low	105 Å²	105	120.7 Å²	120.7	73%	0.734	67%	0.674	S	S	*	*			trans	-66.9	159.2	-173.7	45.3	0	0	0	0	116.4
1192	K	29.2	Very low	39.8	Very low	174 Å²	174	124.4 Å²	124.4	76%	0.757	68%	0.681	S	S	*	*			trans	1.9	115.8	158.7	-55.5	176.5	173.2	179.9	0	114.2
1193	E	27.1	Very low	37	Very low	114 Å²	114	128.8 Å²	128.8	53%	0.533	71%	0.707	S	S	.	*				175.8	141	86.9	-87.4	-170	166	0	0	111	R1244 R1245	E1193-R1244 VanDerWaalsContact C-NE 3.3Å; E1193-R1244 HydrophobicContact CB-CG 4.41Å; E1193-R1244 HydrophobicContact CG-CB 4.49Å; E1193-R1244 PolarHBondContact O-NH1 3.07Å; E1193-R1244 IonicContact OE2-NH1 2.66Å; E1193-R1245 VanDerWaalsContact N-CZ 3.28Å; E1193-R1245 PolarHBondContact O-NH2 3.21Å
1194	D	26.1	Very low	34.4	Very low	45 Å²	45	133.8 Å²	133.8	24%	0.241	72%	0.723	C	S	.	*			trans	81.2	144.5	173.1	-87.5	-15.5	0	0	0	125.4	R1243 R1244 R1245	D1194-R1243 IonicContact OD2-CZ 2.6Å; D1194-R1243 IonicContact OD2-NE 3.8Å; D1194-R1243 PolarHBondContact OD2-NE 3.15Å; D1194-R1243 IonicContact OD2-NH2 3.75Å; D1194-R1244 VanDerWaalsContact CA-NE 3.26Å; D1194-R1244 HydrophobicContact CB-CG 4.03Å; D1194-R1244 VanDerWaalsContact OD1-CD 3.31Å; D1194-R1244 WeakPolarHBondContact OD1-CD 3.42Å; D1194-R1244 WeakPolarHBondContact OD1-CG 3.27Å; D1194-R1244 IonicContact OD1-CZ 3.85Å; D1194-R1244 IonicContact OD1-NE 2.77Å; D1194-R1244 PolarHBondContact OD1-NE 3.04Å; D1194-R1244 IonicContact OD2-CZ 3.27Å; D1194-R1244 IonicContact OD2-NE 3.31Å; D1194-R1244 PolarHBondContact OD2-NE 3.23Å; D1194-R1244 IonicContact OD2-NH2 2.69Å; D1194-R1244 PolarHBondContact OD2-NH2 3.42Å; D1194-R1245 PolarHBondContact O-NE 3.24Å; D1194-R1245 PolarHBondContact O-NH2 2.87Å
1195	V	25.8	Very low	32.1	Very low	116 Å²	116	139.3 Å²	139.3	70%	0.703	73%	0.733	S	S	*	*			trans	64.4	107.8	161.3	-164.9	0	0	0	0	115.5
1196	K	27.3	Very low	30.4	Very low	161 Å²	161	141.7 Å²	141.7	70%	0.7	73%	0.731	S	S	*	*			trans	-133.4	94.1	150.7	-79.1	-166.1	177.9	-169.9	0	109.5	N1247	K1196-N1247 PolarHBondContact NZ-ND2 3.19Å; K1196-N1247 PolarHBondContact NZ-OD1 3.4Å
1197	V	25.4	Very low	29.5	Very low	127 Å²	127	142 Å²	142	77%	0.77	73%	0.732	S	S	*	*			trans	-87.3	124.2	145	176.2	0	0	0	0	106
1198	S	29.8	Very low	28.8	Very low	67 Å²	67	144.8 Å²	144.8	47%	0.469	72%	0.724	S	S	.	*			trans	177.4	144.8	132.4	-114.4	0	0	0	0	114.2
1199	R	28.9	Very low	28	Very low	179 Å²	179	140.9 Å²	140.9	68%	0.675	72%	0.718	S	S	*	*			trans	71.2	81.7	136.8	-71.5	169	170	-162.8	-4.5	117.7	N1173	N1173-R1199 PolarHBondContact ND2-NH2 3.29Å; N1173-R1199 VanDerWaalsContact ND2-NH2 3.15Å
1200	S	30.7	Very low	27.4	Very low	116 Å²	116	139.8 Å²	139.8	81%	0.811	72%	0.716	S	S	*	*				-149.5	101.7	125.5	62.8	0	0	0	0	110.4	R1202	S1200-R1202 PolarHBondContact O-N 3.11Å
1201	G	27.1	Very low	26.9	Very low	76 Å²	76	133 Å²	133	78%	0.784	71%	0.706	S	S	*	*			trans	-59.2	116.8	161.8	0	0	0	0	0	109.5
1202	R	26.9	Very low	26.6	Very low	233 Å²	233	135.4 Å²	135.4	88%	0.879	70%	0.703	S	S	*	*			trans	-167.6	104.8	147.6	-116.4	179.1	-95.8	-170.2	-6.1	110.7	S1200	S1200-R1202 PolarHBondContact O-N 3.11Å
1203	V	24	Very low	26.4	Very low	116 Å²	116	130 Å²	130	70%	0.703	70%	0.698	S	S	*	*			trans	-4.4	113.2	151	-174.3	0	0	0	0	115.3
1204	L	26.7	Very low	26.2	Very low	174 Å²	174	127.3 Å²	127.3	91%	0.911	70%	0.7	S	S	*	*			trans	-119.3	126.5	156.2	-82.1	168.3	0	0	0	109.1
1205	K	26.7	Very low	26.2	Very low	193 Å²	193	130.5 Å²	130.5	84%	0.839	71%	0.712	S	S	*	*			trans	-59.8	142.4	-167.8	-68.9	168.9	173	174.5	0	112.9
1206	R	23	Very low	26.2	Very low	147 Å²	147	129.4 Å²	129.4	56%	0.555	71%	0.706	S	S	*	*			trans	-43.4	131.3	164.6	-76.7	176.3	166.7	165.6	0.1	112.1	A494	A494-R1206 PolarHBondContact O-NH1 2.9Å
1207	P	28	Very low	26.3	Very low	127 Å²	127	125.7 Å²	125.7	83%	0.825	70%	0.7	S	S	*	*			trans	-74.5	135.6	149.6	-4.4	22.8	0	0	0	108.8
1208	K	26	Very low	26.4	Very low	168 Å²	168	125 Å²	125	73%	0.73	69%	0.688	S	S	*	*			trans	-65.1	148.2	179.2	-69.2	172.2	174.7	177.3	0	111.4
1209	S	24.6	Very low	26.4	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	70%	0.702	S	S	*	*			trans	-34.1	133.5	165.6	51.9	0	0	0	0	115.1
1210	I	26	Very low	26.3	Very low	150 Å²	150	123.3 Å²	123.3	77%	0.769	70%	0.703	S	S	*	*			trans	-136.4	104.3	145	-57.8	-179.2	0	0	0	107.5	F1212	I1210-F1212 HydrophobicContact CG2-CB 4.4Å
1211	S	23.1	Very low	26.1	Very low	101 Å²	101	123.3 Å²	123.3	71%	0.706	70%	0.704	S	S	*	*			trans	-59.4	122.9	155.6	48.9	0	0	0	0	108.9
1212	F	26.6	Very low	26.2	Very low	155 Å²	155	126.5 Å²	126.5	68%	0.68	71%	0.708	S	S	*	*			trans	-145.6	101.7	165.8	-150.2	-102.3	0	0	0	110.7	I1210 F1215	I1210-F1212 HydrophobicContact CG2-CB 4.4Å; F1212-F1215 HydrophobicContact CE1-CB 4.17Å; F1212-F1215 AromaticContact CE1-CD2 3.8Å; F1212-F1215 HydrophobicContact CE1-CD2 3.8Å; F1212-F1215 HydrophobicContact CE1-CG 4.44Å; F1212-F1215 HydrophobicContact CE2-CD2 4.46Å; F1212-F1215 AromaticContact CZ-CD2 3.45Å; F1212-F1215 HydrophobicContact CZ-CD2 3.45Å; F1212-F1215 VanDerWaalsContact CZ-CD2 3.45Å; F1212-F1215 HydrophobicContact CZ-CE2 4.07Å; F1212-F1215 HydrophobicContact CZ-CG 4.34Å
1213	G	23.8	Very low	26.2	Very low	62 Å²	62	119.3 Å²	119.3	64%	0.639	70%	0.698	S	S	*	*			trans	-83.9	142.6	157.3	0	0	0	0	0	109.5
1214	G	22.9	Very low	26.3	Very low	57 Å²	57	120.9 Å²	120.9	59%	0.588	70%	0.703	S	S	*	*			trans	47.9	102.6	151.9	0	0	0	0	0	118.9
1215	F	27.3	Very low	26.4	Very low	111 Å²	111	118.5 Å²	118.5	49%	0.487	70%	0.696	S	S	.	*			trans	-148.5	107.7	143.6	-91.9	-90.8	0	0	0	108.1	S102 F1212	S102-F1215 WeakPolarHBondContact OG-CE1 3.44Å; S102-F1215 WeakPolarHBondContact OG-CZ 3.45Å; F1212-F1215 HydrophobicContact CE1-CB 4.17Å; F1212-F1215 AromaticContact CE1-CD2 3.8Å; F1212-F1215 HydrophobicContact CE1-CD2 3.8Å; F1212-F1215 HydrophobicContact CE1-CG 4.44Å; F1212-F1215 HydrophobicContact CE2-CD2 4.46Å; F1212-F1215 AromaticContact CZ-CD2 3.45Å; F1212-F1215 HydrophobicContact CZ-CD2 3.45Å; F1212-F1215 VanDerWaalsContact CZ-CD2 3.45Å; F1212-F1215 HydrophobicContact CZ-CE2 4.07Å; F1212-F1215 HydrophobicContact CZ-CG 4.34Å
1216	T	25.3	Very low	26.4	Very low	94 Å²	94	116.5 Å²	116.5	58%	0.577	69%	0.689	S	S	*	*			trans	-91.6	130.1	148	49.1	0	0	0	0	106.3	D273 D274	D273-T1216 VanDerWaalsContact O-CG2 3.27Å; D273-T1216 WeakPolarHBondContact O-CG2 3.46Å; D274-T1216 WeakPolarHBondContact OD1-CA 3.37Å; D274-T1216 VanDerWaalsContact OD1-CB 3.28Å; D274-T1216 WeakPolarHBondContact OD1-CB 3.37Å; D274-T1216 WeakPolarHBondContact OD1-CG2 3.36Å
1217	S	29.1	Very low	26.7	Very low	82 Å²	82	118.6 Å²	118.6	57%	0.573	71%	0.705	S	S	*	*			trans	177.4	119.5	151.5	-171.9	0	0	0	0	111.1
1218	Q	27.8	Very low	26.7	Very low	113 Å²	113	115.9 Å²	115.9	53%	0.528	70%	0.701	S	S	.	*			trans	-47.6	150.7	166.8	-62.6	164.2	-5.7	0	0	114.2
1219	N	29.2	Very low	26.7	Very low	142 Å²	142	111.8 Å²	111.8	76%	0.759	68%	0.683	S	S	*	*				-168.4	124.5	128.6	-94.2	-17.9	0	0	0	110.2
1220	G	26.6	Very low	27	Very low	68 Å²	68	111.3 Å²	111.3	70%	0.701	67%	0.669	S	S	*	*			trans	-101.3	179.5	-169.4	0	0	0	0	0	117.1
1221	S	27.9	Very low	27.2	Very low	117 Å²	117	107.9 Å²	107.9	82%	0.818	66%	0.658	S	S	*	*			trans	75.5	111.2	149.9	-57.7	0	0	0	0	120
1222	T	29	Very low	27.6	Very low	142 Å²	142	108.5 Å²	108.5	87%	0.871	66%	0.663	S	S	*	*				-166.8	115.4	98.9	39.2	0	0	0	0	113.5
1223	A	27.4	Very low	27.6	Very low	82 Å²	82	104.2 Å²	104.2	68%	0.678	66%	0.662	S	S	*	*				42.6	124.3	129.5	0	0	0	0	0	124.3
1224	N	25.5	Very low	27.9	Very low	150 Å²	150	108.6 Å²	108.6	80%	0.802	67%	0.671	S	S	*	*			trans	85.9	109.1	134.1	-61.7	-18.5	0	0	0	121.6
1225	T	29.5	Very low	28.3	Very low	123 Å²	123	110.5 Å²	110.5	76%	0.755	67%	0.668	S	S	*	*				151.9	104	124.1	37.1	0	0	0	0	109.4
1226	E	26.7	Very low	28.3	Very low	151 Å²	151	110.7 Å²	110.7	71%	0.706	68%	0.683	S	S	*	*				71.8	126.3	89.1	-72.9	-164.6	168.9	0	0	116.3
1227	E	28	Very low	28.5	Very low	191 Å²	191	114 Å²	114	89%	0.893	70%	0.698	S	S	*	*			trans	80	115.8	167.5	-47.2	-165.4	160.9	0	0	116.3
1228	G	27.5	Very low	28.4	Very low	71 Å²	71	112.9 Å²	112.9	73%	0.732	70%	0.698	S	S	*	*			cis	122.1	147.8	44.9	0	0	0	0	0	106.7
1229	F	27	Very low	28.3	Very low	81 Å²	81	114 Å²	114	36%	0.355	71%	0.713	S	S	.	*			cis	-177.5	155	-2.1	-157	-30.4	0	0	0	105.1	R649 M684 N723	R649-F1229 VanDerWaalsContact NH2-CD1 3.35Å; R649-F1229 VanDerWaalsContact NH2-CE1 3.25Å; M684-F1229 HydrophobicContact CE-CE2 4.37Å; M684-F1229 HydrophobicContact CE-CZ 4.15Å; N723-F1229 WeakPolarHBondContact OD1-CE1 3.34Å
1230	H	30.2	Very low	28.1	Very low	94 Å²	94	113.2 Å²	113.2	44%	0.435	71%	0.713	S	S	.	*			trans	88.8	105.8	151.8	-59.5	-66.3	0	0	0	118.6	M684 N723	M684-H1230 PolarHBondContact SD-CE1 2.76Å; M684-H1230 PolarHBondContact SD-NE2 3.13Å; M684-H1230 VanDerWaalsContact SD-NE2 3.38Å; N723-H1230 PolarHBondContact OD1-CE1 2.6Å; N723-H1230 VanDerWaalsContact OD1-CE1 3.32Å; N723-H1230 PolarHBondContact OD1-ND1 2.99Å
1231	S	31.5	Very low	28	Very low	78 Å²	78	116.6 Å²	116.6	55%	0.545	71%	0.714	S	S	.	*				77.8	118.3	54	82.7	0	0	0	0	115.7
1232	S	30	Very low	27.8	Very low	114 Å²	114	116.2 Å²	116.2	80%	0.797	71%	0.706	S	S	*	*			trans	-168.3	126.6	142	-72.1	0	0	0	0	105.9
1233	G	28.3	Very low	27.5	Very low	65 Å²	65	117.8 Å²	117.8	67%	0.67	70%	0.696	S	S	*	*			cis	129.6	116.4	18.5	0	0	0	0	0	108.2
1234	N	29.5	Very low	27.4	Very low	154 Å²	154	118.3 Å²	118.3	82%	0.824	68%	0.681	S	S	*	*			trans	148.9	104	154.4	-76.7	-3	0	0	0	107.9
1235	D	30.5	Very low	27.4	Very low	98 Å²	98	117.7 Å²	117.7	52%	0.524	67%	0.667	S	S	.	*				52.3	123.7	75.4	-62.2	-24.5	0	0	0	110.3	A717	A717-D1235 VanDerWaalsContact CB-OD2 3.27Å; A717-D1235 WeakPolarHBondContact CB-OD2 3.31Å
1236	S	28.8	Very low	27.4	Very low	115 Å²	115	117.6 Å²	117.6	80%	0.804	67%	0.671	S	S	*	*			cis	-177.9	168.2	31.4	42.4	0	0	0	0	110.3
1237	D	27.6	Very low	27.4	Very low	164 Å²	164	116.4 Å²	116.4	88%	0.877	67%	0.67	S	S	*	*			trans	107.6	141.7	150	-127.1	-1.4	0	0	0	120.1
1238	G	28	Very low	27.4	Very low	57 Å²	57	110.7 Å²	110.7	59%	0.588	66%	0.663	S	S	*	*			trans	-87.8	-165.6	179.9	0	0	0	0	0	114.6
1239	T	25.9	Very low	27.6	Very low	137 Å²	137	116.4 Å²	116.4	84%	0.84	67%	0.672	S	S	*	*			trans	103.9	140.3	169.3	-37.1	0	0	0	0	116.9
1240	V	25.4	Very low	27.6	Very low	126 Å²	126	120.9 Å²	120.9	76%	0.764	70%	0.695	S	S	*	*			trans	-52.9	171	160.8	-173.3	0	0	0	0	111.5
1241	I	23.5	Very low	27.4	Very low	139 Å²	139	124.5 Å²	124.5	71%	0.713	71%	0.712	S	S	*	*			trans	105.6	126.5	146.8	-39.7	176.2	0	0	0	116.3
1242	T	23.5	Very low	27.3	Very low	108 Å²	108	125.9 Å²	125.9	66%	0.663	73%	0.728	S	S	*	*			trans	-38.5	168.2	152.8	54.9	0	0	0	0	114.2
1243	R	23.9	Very low	27.5	Very low	175 Å²	175	125.8 Å²	125.8	66%	0.66	72%	0.722	S	S	*	*			trans	90.6	106.8	149.9	-73.1	-179.2	174	156.9	10.6	121.4	D1194	D1194-R1243 IonicContact OD2-CZ 2.6Å; D1194-R1243 IonicContact OD2-NE 3.8Å; D1194-R1243 PolarHBondContact OD2-NE 3.15Å; D1194-R1243 IonicContact OD2-NH2 3.75Å
1244	R	23.9	Very low	28.3	Very low	93 Å²	93	131.5 Å²	131.5	35%	0.351	73%	0.732	S	S	.	*				99.1	108.5	115	-66.4	170.8	172.4	-141	-6.1	121.2	E1193 D1194	E1193-R1244 VanDerWaalsContact C-NE 3.3Å; E1193-R1244 HydrophobicContact CB-CG 4.41Å; E1193-R1244 HydrophobicContact CG-CB 4.49Å; E1193-R1244 PolarHBondContact O-NH1 3.07Å; E1193-R1244 IonicContact OE2-NH1 2.66Å; D1194-R1244 VanDerWaalsContact CA-NE 3.26Å; D1194-R1244 HydrophobicContact CB-CG 4.03Å; D1194-R1244 VanDerWaalsContact OD1-CD 3.31Å; D1194-R1244 WeakPolarHBondContact OD1-CD 3.42Å; D1194-R1244 WeakPolarHBondContact OD1-CG 3.27Å; D1194-R1244 IonicContact OD1-CZ 3.85Å; D1194-R1244 IonicContact OD1-NE 2.77Å; D1194-R1244 PolarHBondContact OD1-NE 3.04Å; D1194-R1244 IonicContact OD2-CZ 3.27Å; D1194-R1244 IonicContact OD2-NE 3.31Å; D1194-R1244 PolarHBondContact OD2-NE 3.23Å; D1194-R1244 IonicContact OD2-NH2 2.69Å; D1194-R1244 PolarHBondContact OD2-NH2 3.42Å
1245	R	26.8	Very low	29.7	Very low	138 Å²	138	128.6 Å²	128.6	52%	0.521	72%	0.716	S	S	.	*			trans	82.6	116.7	134.3	-65.7	-177.3	173.6	-177.7	2.2	119.6	E1193 D1194	E1193-R1245 VanDerWaalsContact N-CZ 3.28Å; E1193-R1245 PolarHBondContact O-NH2 3.21Å; D1194-R1245 PolarHBondContact O-NE 3.24Å; D1194-R1245 PolarHBondContact O-NH2 2.87Å
1246	S	28.8	Very low	32.2	Very low	120 Å²	120	126.3 Å²	126.3	84%	0.839	71%	0.708	S	S	*	*				-175.3	145.9	101.4	36	0	0	0	0	112.5
1247	N	27.3	Very low	34.9	Very low	126 Å²	126	122.2 Å²	122.2	67%	0.674	68%	0.678	S	S	*	*			trans	-52.7	137.2	172.3	-76.8	-16.6	0	0	0	112.5	K1196	K1196-N1247 PolarHBondContact NZ-ND2 3.19Å; K1196-N1247 PolarHBondContact NZ-OD1 3.4Å
1248	G	27.7	Very low	37.7	Very low	72 Å²	72	116.7 Å²	116.7	74%	0.742	65%	0.65	S	S	*	*			trans	-172.4	99.1	165.7	0	0	0	0	0	110	E1250	G1248-E1250 PolarHBondContact O-N 3.21Å
1249	M	31.2	Very low	40.5	Very low	190 Å²	190	119 Å²	119	94%	0.936	65%	0.646	S	S	*	*			trans	-67.5	106.7	164.4	178.6	151.4	74.3	0	0	107.3
1250	E	28.2	Very low	43.7	Very low	176 Å²	176	114.5 Å²	114.5	82%	0.822	61%	0.613	S	S	*	*			trans	-164.8	96.9	166.8	-111.4	159.7	-160.9	0	0	111.5	G1248	G1248-E1250 PolarHBondContact O-N 3.21Å
1251	Q	25.2	Very low	46.9	Very low	170 Å²	170	108.5 Å²	108.5	79%	0.794	58%	0.577	S	S	*	*			trans	48.5	92.4	150.5	-63.9	170.2	6.7	0	0	118	T1253	Q1251-T1253 VanDerWaalsContact C-N 3.31Å; Q1251-T1253 PolarHBondContact O-N 3.41Å
1252	A	29.9	Very low	50.1	Low	106 Å²	106	105.4 Å²	105.4	88%	0.876	56%	0.562	S	S	*	*			trans	-59.9	103.9	146.1	0	0	0	0	0	106.6	E1254	A1252-E1254 PolarHBondContact O-N 2.87Å
1253	T	32.7	Very low	53.3	Low	112 Å²	112	103.9 Å²	103.9	69%	0.687	55%	0.549	S	S	*	.			trans	-59.6	109.4	177	49.3	0	0	0	0	107.3	Q1251 N1255	Q1251-T1253 VanDerWaalsContact C-N 3.31Å; Q1251-T1253 PolarHBondContact O-N 3.41Å; T1253-N1255 PolarHBondContact O-N 3.34Å
1254	E	45.4	Very low	56.7	Low	185 Å²	185	95.5 Å²	95.5	86%	0.864	52%	0.518	S	S	*	.			trans	-42.1	116.4	160.4	-89.3	175.1	147.3	0	0	107.3	A1252 S1256	A1252-E1254 PolarHBondContact O-N 2.87Å; E1254-S1256 PolarHBondContact O-N 3.23Å
1255	N	59	Low	60.1	Low	94 Å²	94	91.6 Å²	91.6	50%	0.503	50%	0.504	S	S	.	.			trans	-47.1	120.9	169.7	-75.9	-9.2	0	0	0	106.2	T1253 E1259 R1260	T1253-N1255 PolarHBondContact O-N 3.34Å; N1255-E1259 HydrophobicContact CB-CB 4.32Å; N1255-R1260 HydrophobicContact CB-CG 3.71Å; N1255-R1260 WeakPolarHBondContact O-CD 3.33Å; N1255-R1260 PolarHBondContact O-NE 3.35Å
1256	S	82.8	Confident	63.1	Low	50 Å²	50	88.4 Å²	88.4	35%	0.35	50%	0.503	S	S	.	.			trans	-54.1	151.5	-177.1	62.9	0	0	0	0	109.3	E1254 T1258 E1259 R1260	E1254-S1256 PolarHBondContact O-N 3.23Å; S1256-T1258 PolarHBondContact O-N 2.86Å; S1256-E1259 PolarHBondContact N-OE2 2.84Å; S1256-E1259 PolarHBondContact O-N 3.32Å; S1256-E1259 VanDerWaalsContact OG-CD 3.31Å; S1256-E1259 WeakPolarHBondContact OG-CG 3.31Å; S1256-E1259 PolarHBondContact OG-N 2.83Å; S1256-E1259 PolarHBondContact OG-OE2 3.39Å; S1256-R1260 PolarHBondContact O-N 3.48Å
1257	V	86.7	Confident	66.3	Low	29 Å²	29	84.9 Å²	84.9	18%	0.176	47%	0.474	C	S	.	.	H	α-helix	trans	-47.2	-41.2	174.6	180	0	0	0	0	110.1	R1260 C1261 L1358 D1362 L1364	V1257-R1260 PolarHBondContact O-N 3.29Å; V1257-C1261 WeakPolarHBondContact O-CB 3.29Å; V1257-C1261 PolarHBondContact O-N 3.45Å; V1257-C1261 PolarHBondContact O-SG 2.91Å; V1257-L1358 HydrophobicContact CG1-CD2 3.97Å; V1257-D1362 HydrophobicContact CB-CB 4.38Å; V1257-D1362 HydrophobicContact CG1-CB 3.54Å; V1257-D1362 HydrophobicContact CG2-CB 3.87Å; V1257-L1364 HydrophobicContact CG1-CD2 3.67Å
1258	T	86.5	Confident	69.5	Low	48 Å²	48	78.9 Å²	78.9	29%	0.294	44%	0.442	S	S	.	.	H	α-helix	trans	-59.8	-45.5	176.8	-51.3	0	0	0	0	113.2	S1256 C1261 N1262 F1306	S1256-T1258 PolarHBondContact O-N 2.86Å; T1258-C1261 PolarHBondContact O-N 2.91Å; T1258-N1262 PolarHBondContact O-N 3.44Å; T1258-N1262 PolarHBondContact O-ND2 2.96Å; T1258-F1306 HydrophobicContact CG2-CE1 4.26Å; T1258-F1306 HydrophobicContact CG2-CZ 3.75Å
1259	E	86.8	Confident	72.8	Confident	105 Å²	105	78.7 Å²	78.7	49%	0.491	42%	0.422	S	S	.	.	H	α-helix	trans	-66.8	-38.9	177	-75.3	158.6	156.8	0	0	112.1	N1255 S1256 C1261 N1262 L1263	N1255-E1259 HydrophobicContact CB-CB 4.32Å; S1256-E1259 PolarHBondContact N-OE2 2.84Å; S1256-E1259 PolarHBondContact O-N 3.32Å; S1256-E1259 VanDerWaalsContact OG-CD 3.31Å; S1256-E1259 WeakPolarHBondContact OG-CG 3.31Å; S1256-E1259 PolarHBondContact OG-N 2.83Å; S1256-E1259 PolarHBondContact OG-OE2 3.39Å; E1259-C1261 VanDerWaalsContact C-N 3.33Å; E1259-C1261 PolarHBondContact O-N 3.42Å; E1259-N1262 PolarHBondContact O-N 3.22Å; E1259-L1263 PolarHBondContact O-N 2.96Å
1260	R	92.6	Very high	75.5	Confident	42 Å²	42	73.9 Å²	73.9	16%	0.158	41%	0.407	C	S	.	.	H	α-helix	trans	-65.4	-36.8	175.2	-63.7	-175.1	-65.2	128.4	-1.3	111.6	N1255 S1256 V1257 L1263 L1264 L1356 H1357 L1358 D1362	N1255-R1260 HydrophobicContact CB-CG 3.71Å; N1255-R1260 WeakPolarHBondContact O-CD 3.33Å; N1255-R1260 PolarHBondContact O-NE 3.35Å; S1256-R1260 PolarHBondContact O-N 3.48Å; V1257-R1260 PolarHBondContact O-N 3.29Å; R1260-L1263 PolarHBondContact O-N 2.89Å; R1260-L1264 PolarHBondContact O-N 3.19Å; R1260-L1356 WeakPolarHBondContact CD-O 3.39Å; R1260-L1356 PolarHBondContact NH1-O 3.46Å; R1260-H1357 PolarHBondContact NH1-O 3.38Å; R1260-L1358 HydrophobicContact CB-CD1 4.2Å; R1260-L1358 HydrophobicContact CB-CD2 3.87Å; R1260-L1358 HydrophobicContact CB-CG 4.12Å; R1260-D1362 IonicContact NH2-OD2 3.29Å; R1260-D1362 PolarHBondContact NH2-OD2 2.81Å
1261	C	92.6	Very high	78.6	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-68.1	-39	173.7	-65.6	0	0	0	0	112.9	V1257 T1258 E1259 L1263 L1264 L1265 F1306 F1314 M1317	V1257-C1261 WeakPolarHBondContact O-CB 3.29Å; V1257-C1261 PolarHBondContact O-N 3.45Å; V1257-C1261 PolarHBondContact O-SG 2.91Å; T1258-C1261 PolarHBondContact O-N 2.91Å; E1259-C1261 VanDerWaalsContact C-N 3.33Å; E1259-C1261 PolarHBondContact O-N 3.42Å; C1261-L1263 VanDerWaalsContact C-N 3.33Å; C1261-L1264 WeakPolarHBondContact O-CB 3.07Å; C1261-L1264 PolarHBondContact O-N 3.07Å; C1261-L1265 PolarHBondContact O-N 3.42Å; C1261-F1306 HydrophobicContact CB-CD2 4.35Å; C1261-F1306 HydrophobicContact CB-CE1 4.49Å; C1261-F1306 HydrophobicContact CB-CE2 3.42Å; C1261-F1306 VanDerWaalsContact CB-CE2 3.42Å; C1261-F1306 HydrophobicContact CB-CZ 3.51Å; C1261-F1314 WeakPolarHBondContact SG-CD2 3.49Å; C1261-M1317 HydrophobicContact CB-CE 4.44Å; C1261-M1317 HydrophobicContact CB-SD 4.2Å
1262	N	90.3	Very high	81.7	Confident	75 Å²	75	63.4 Å²	63.4	40%	0.401	37%	0.372	S	S	.	.	H	α-helix	trans	-61.6	-42.9	172.8	-85.1	-36.1	0	0	0	111.7	T1258 E1259 L1265 S1266 F1306	T1258-N1262 PolarHBondContact O-N 3.44Å; T1258-N1262 PolarHBondContact O-ND2 2.96Å; E1259-N1262 PolarHBondContact O-N 3.22Å; N1262-L1265 PolarHBondContact O-N 3.29Å; N1262-S1266 WeakPolarHBondContact O-CB 3.43Å; N1262-S1266 PolarHBondContact O-N 3.31Å; N1262-F1306 WeakPolarHBondContact OD1-CE1 3.45Å
1263	L	90.5	Very high	84.7	Confident	75 Å²	75	59.7 Å²	59.7	39%	0.393	34%	0.338	S	S	.	.	H	α-helix	trans	-62.7	-43.5	175.3	-178.3	55.7	0	0	0	111.3	E1259 R1260 C1261 L1265 S1266 L1267 L1356	E1259-L1263 PolarHBondContact O-N 2.96Å; R1260-L1263 PolarHBondContact O-N 2.89Å; C1261-L1263 VanDerWaalsContact C-N 3.33Å; L1263-L1265 PolarHBondContact O-N 2.91Å; L1263-S1266 PolarHBondContact O-N 3.33Å; L1263-L1267 HydrophobicContact CD1-CD1 4.16Å; L1263-L1267 HydrophobicContact CD1-CG 4.21Å; L1263-L1267 HydrophobicContact CG-CD1 4.01Å; L1263-L1267 WeakPolarHBondContact O-CB 3.17Å; L1263-L1267 VanDerWaalsContact O-CG 3.26Å; L1263-L1267 WeakPolarHBondContact O-CG 3.23Å; L1263-L1267 PolarHBondContact O-N 2.83Å; L1263-L1356 HydrophobicContact CD2-CD2 3.53Å; L1263-L1356 HydrophobicContact CG-CD2 4.07Å
1264	L	95	Very high	87.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-57.3	-49.3	174.6	-179.5	62.8	0	0	0	112	R1260 C1261 S1266 L1267 L1268 F1314 F1349 Q1352 L1353 L1356 L1358	R1260-L1264 PolarHBondContact O-N 3.19Å; C1261-L1264 WeakPolarHBondContact O-CB 3.07Å; C1261-L1264 PolarHBondContact O-N 3.07Å; L1264-S1266 VanDerWaalsContact C-N 3.32Å; L1264-S1266 PolarHBondContact O-N 2.97Å; L1264-L1267 PolarHBondContact O-N 3.15Å; L1264-L1268 HydrophobicContact CD1-CD1 4.47Å; L1264-L1268 HydrophobicContact CD1-CG 4.44Å; L1264-L1268 HydrophobicContact CG-CD1 4.32Å; L1264-L1268 WeakPolarHBondContact O-CG 3.47Å; L1264-L1268 PolarHBondContact O-N 3.11Å; L1264-F1314 HydrophobicContact CD2-CE2 3.73Å; L1264-F1314 HydrophobicContact CD2-CZ 3.55Å; L1264-F1349 HydrophobicContact CD1-CD2 4.11Å; L1264-F1349 HydrophobicContact CD1-CE2 4.41Å; L1264-F1349 HydrophobicContact CD2-CD2 4.47Å; L1264-F1349 HydrophobicContact CD2-CE2 3.96Å; L1264-Q1352 HydrophobicContact CD1-CB 3.57Å; L1264-Q1352 HydrophobicContact CD1-CG 4.5Å; L1264-L1353 HydrophobicContact CD2-CD2 4.04Å; L1264-L1356 HydrophobicContact CB-CD1 3.74Å; L1264-L1356 HydrophobicContact CD1-CD1 4.14Å; L1264-L1358 HydrophobicContact CB-CD1 4.37Å; L1264-L1358 HydrophobicContact CD2-CD1 3.98Å
1265	L	95.2	Very high	90.1	Very high	10 Å²	10	52.2 Å²	52.2	5%	0.052	29%	0.29	C	S	.	.	H	α-helix	trans	-60.9	-40.7	177.6	-76.5	172.4	0	0	0	112.5	C1261 N1262 L1263 L1268 H1269 V1302 A1303 F1306 M1317	C1261-L1265 PolarHBondContact O-N 3.42Å; N1262-L1265 PolarHBondContact O-N 3.29Å; L1263-L1265 PolarHBondContact O-N 2.91Å; L1265-L1268 PolarHBondContact O-N 2.83Å; L1265-H1269 WeakPolarHBondContact O-CB 3.46Å; L1265-H1269 PolarHBondContact O-N 2.55Å; L1265-H1269 PolarHBondContact O-ND1 2.81Å; L1265-V1302 HydrophobicContact CD2-CB 4.49Å; L1265-V1302 HydrophobicContact CD2-CG1 3.89Å; L1265-A1303 HydrophobicContact CD1-CB 4.33Å; L1265-F1306 HydrophobicContact CD1-CB 4.17Å; L1265-F1306 HydrophobicContact CD1-CD1 4.11Å; L1265-F1306 HydrophobicContact CD1-CG 4.16Å; L1265-M1317 HydrophobicContact CD1-CE 3.47Å; L1265-M1317 VanDerWaalsContact CD1-CE 3.47Å; L1265-M1317 HydrophobicContact CD2-CE 3.53Å; L1265-M1317 HydrophobicContact CG-CE 3.31Å
1266	S	91.6	Very high	91.8	Very high	72 Å²	72	49 Å²	49	50%	0.503	27%	0.274	S	S	.	.	H	α-helix	trans	-63.3	-42.6	177.2	-175.3	0	0	0	0	112	N1262 L1263 L1264 H1269 S1270	N1262-S1266 WeakPolarHBondContact O-CB 3.43Å; N1262-S1266 PolarHBondContact O-N 3.31Å; L1263-S1266 PolarHBondContact O-N 3.33Å; L1264-S1266 VanDerWaalsContact C-N 3.32Å; L1264-S1266 PolarHBondContact O-N 2.97Å; S1266-H1269 PolarHBondContact O-N 3.4Å; S1266-S1270 WeakPolarHBondContact O-CB 3.32Å; S1266-S1270 PolarHBondContact O-N 3.17Å; S1266-S1270 VanDerWaalsContact O-N 3.1Å; S1266-S1270 PolarHBondContact O-OG 3Å
1267	L	94.4	Very high	92.5	Very high	45 Å²	45	47.2 Å²	47.2	24%	0.236	26%	0.26	C	S	.	.	H	α-helix	trans	-65.1	-41.5	176.2	-69.7	168	0	0	0	111.6	L1263 L1264 S1270 H1271 F1348 Q1352 L1356	L1263-L1267 HydrophobicContact CD1-CD1 4.16Å; L1263-L1267 HydrophobicContact CD1-CG 4.21Å; L1263-L1267 HydrophobicContact CG-CD1 4.01Å; L1263-L1267 WeakPolarHBondContact O-CB 3.17Å; L1263-L1267 VanDerWaalsContact O-CG 3.26Å; L1263-L1267 WeakPolarHBondContact O-CG 3.23Å; L1263-L1267 PolarHBondContact O-N 2.83Å; L1264-L1267 PolarHBondContact O-N 3.15Å; L1267-S1270 PolarHBondContact O-N 3.22Å; L1267-S1270 PolarHBondContact O-OG 3.16Å; L1267-H1271 PolarHBondContact O-N 2.74Å; L1267-F1348 HydrophobicContact CB-CE1 4.01Å; L1267-F1348 HydrophobicContact CB-CZ 4.12Å; L1267-F1348 WeakPolarHBondContact O-CE1 3.32Å; L1267-Q1352 HydrophobicContact CB-CG 4.49Å; L1267-Q1352 HydrophobicContact CD1-CG 4.17Å; L1267-L1356 HydrophobicContact CD1-CD1 4.39Å
1268	L	96	Very high	92.9	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.6	-42.5	175.6	-67.2	176.2	0	0	0	112.5	L1264 L1265 S1270 H1271 S1274 L1299 I1321 L1345 F1348 F1349	L1264-L1268 HydrophobicContact CD1-CD1 4.47Å; L1264-L1268 HydrophobicContact CD1-CG 4.44Å; L1264-L1268 HydrophobicContact CG-CD1 4.32Å; L1264-L1268 WeakPolarHBondContact O-CG 3.47Å; L1264-L1268 PolarHBondContact O-N 3.11Å; L1265-L1268 PolarHBondContact O-N 2.83Å; L1268-S1270 VanDerWaalsContact C-N 3.27Å; L1268-S1270 PolarHBondContact O-N 3.34Å; L1268-H1271 PolarHBondContact O-N 2.84Å; L1268-S1274 WeakPolarHBondContact O-CB 3.45Å; L1268-S1274 PolarHBondContact O-OG 3.1Å; L1268-L1299 HydrophobicContact CB-CD1 4.29Å; L1268-L1299 HydrophobicContact CB-CD2 4.15Å; L1268-L1299 HydrophobicContact CD1-CD2 4.12Å; L1268-I1321 HydrophobicContact CD1-CD1 4.06Å; L1268-I1321 HydrophobicContact CD1-CG2 4.4Å; L1268-L1345 HydrophobicContact CD2-CD1 3.99Å; L1268-L1345 HydrophobicContact CD2-CG 4.4Å; L1268-F1348 HydrophobicContact CD2-CD1 4.08Å; L1268-F1348 HydrophobicContact CD2-CE1 4.46Å; L1268-F1349 HydrophobicContact CD1-CD2 3.89Å; L1268-F1349 HydrophobicContact CD1-CE2 4.41Å; L1268-F1349 HydrophobicContact CD2-CB 3.86Å; L1268-F1349 HydrophobicContact CD2-CD2 4.16Å; L1268-F1349 HydrophobicContact CD2-CG 4.47Å
1269	H	95.6	Very high	93.3	Very high	68 Å²	68	50 Å²	50	32%	0.315	28%	0.275	S	S	.	.	H	α-helix	trans	-67.1	-25.6	178.1	-80.7	78.1	0	0	0	113.3	L1265 S1266 S1274 L1278	L1265-H1269 WeakPolarHBondContact O-CB 3.46Å; L1265-H1269 PolarHBondContact O-N 2.55Å; L1265-H1269 PolarHBondContact O-ND1 2.81Å; S1266-H1269 PolarHBondContact O-N 3.4Å; H1269-S1274 PolarHBondContact O-OG 3.09Å; H1269-L1278 HydrophobicContact CB-CD2 4.33Å
1270	S	89.2	Confident	93.7	Very high	89 Å²	89	48 Å²	48	62%	0.622	27%	0.272	S	S	*	.	H	α-helix	trans	-94.9	-5.1	-178.9	53.9	0	0	0	0	114	S1266 L1267 L1268	S1266-S1270 WeakPolarHBondContact O-CB 3.32Å; S1266-S1270 PolarHBondContact O-N 3.17Å; S1266-S1270 VanDerWaalsContact O-N 3.1Å; S1266-S1270 PolarHBondContact O-OG 3Å; L1267-S1270 PolarHBondContact O-N 3.22Å; L1267-S1270 PolarHBondContact O-OG 3.16Å; L1268-S1270 VanDerWaalsContact C-N 3.27Å; L1268-S1270 PolarHBondContact O-N 3.34Å
1271	H	93.6	Very high	93.8	Very high	41 Å²	41	48 Å²	48	19%	0.19	28%	0.276	C	S	.	.	S	Bend	trans	-69.5	137.7	176.9	-169.2	-86.1	0	0	0	110.9	L1267 L1268 D1273 S1274 L1345 F1348	L1267-H1271 PolarHBondContact O-N 2.74Å; L1268-H1271 PolarHBondContact O-N 2.84Å; H1271-D1273 VanDerWaalsContact C-N 3.3Å; H1271-D1273 IonicContact CE1-OD2 2.91Å; H1271-D1273 PolarHBondContact CE1-OD2 3Å; H1271-D1273 PolarHBondContact ND1-N 3.37Å; H1271-D1273 VanDerWaalsContact ND1-N 3.18Å; H1271-D1273 PolarHBondContact O-N 3.18Å; H1271-S1274 VanDerWaalsContact O-CB 3.26Å; H1271-S1274 WeakPolarHBondContact O-CB 3.43Å; H1271-S1274 PolarHBondContact O-N 3.32Å; H1271-S1274 PolarHBondContact O-OG 3.44Å; H1271-L1345 HydrophobicContact CB-CD1 3.56Å; H1271-F1348 HydrophobicContact CB-CD1 4.25Å; H1271-F1348 HydrophobicContact CB-CE1 4.28Å; H1271-F1348 AromaticContact CD2-CD1 3.45Å; H1271-F1348 VanDerWaalsContact CD2-CD1 3.45Å; H1271-F1348 WeakPolarHBondContact CD2-CD1 3.34Å; H1271-F1348 AromaticContact CD2-CD2 3.67Å; H1271-F1348 AromaticContact CD2-CE1 3.87Å; H1271-F1348 AromaticContact CD2-CG 3.33Å; H1271-F1348 WeakPolarHBondContact CD2-CG 3.37Å; H1271-F1348 AromaticContact NE2-CG 3.74Å
1272	A	90	Very high	93.7	Very high	86 Å²	86	50.3 Å²	50.3	71%	0.711	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-57.5	-40.2	-175.7	0	0	0	0	0	113.2	S1274	A1272-S1274 PolarHBondContact O-N 3.09Å
1273	D	93.5	Very high	93.7	Very high	28 Å²	28	53.6 Å²	53.6	15%	0.15	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-81.5	9.5	178.5	-66.2	-61.9	0	0	0	114.9	H1271 W1275 C1341 R1344	H1271-D1273 VanDerWaalsContact C-N 3.3Å; H1271-D1273 IonicContact CE1-OD2 2.91Å; H1271-D1273 PolarHBondContact CE1-OD2 3Å; H1271-D1273 PolarHBondContact ND1-N 3.37Å; H1271-D1273 VanDerWaalsContact ND1-N 3.18Å; H1271-D1273 PolarHBondContact O-N 3.18Å; D1273-W1275 VanDerWaalsContact C-N 3.34Å; D1273-C1341 HydrophobicContact CB-CB 4.01Å; D1273-C1341 PolarHBondContact OD1-SG 2.95Å; D1273-C1341 VanDerWaalsContact OD1-SG 3.39Å; D1273-R1344 HydrophobicContact CB-CB 4.33Å; D1273-R1344 IonicContact OD1-CZ 2.67Å; D1273-R1344 VanDerWaalsContact OD1-CZ 3.3Å; D1273-R1344 IonicContact OD1-NE 2.93Å; D1273-R1344 PolarHBondContact OD1-NE 3.47Å; D1273-R1344 VanDerWaalsContact OD1-NE 3.07Å; D1273-R1344 IonicContact OD1-NH2 3.1Å; D1273-R1344 PolarHBondContact OD1-NH2 2.92Å; D1273-R1344 WeakPolarHBondContact OD2-CB 3.22Å; D1273-R1344 WeakPolarHBondContact OD2-CD 3.22Å; D1273-R1344 IonicContact OD2-CZ 2.82Å; D1273-R1344 IonicContact OD2-NE 2.74Å; D1273-R1344 PolarHBondContact OD2-NE 3.02Å; D1273-R1344 IonicContact OD2-NH2 3.97Å
1274	S	95.7	Very high	93.5	Very high	5 Å²	5	59.3 Å²	59.3	4%	0.035	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-80.3	-15	179.5	68.9	0	0	0	0	114.2	L1268 H1269 H1271 A1272 P1276 F1277 L1278	L1268-S1274 WeakPolarHBondContact O-CB 3.45Å; L1268-S1274 PolarHBondContact O-OG 3.1Å; H1269-S1274 PolarHBondContact O-OG 3.09Å; H1271-S1274 VanDerWaalsContact O-CB 3.26Å; H1271-S1274 WeakPolarHBondContact O-CB 3.43Å; H1271-S1274 PolarHBondContact O-N 3.32Å; H1271-S1274 PolarHBondContact O-OG 3.44Å; A1272-S1274 PolarHBondContact O-N 3.09Å; S1274-P1276 VanDerWaalsContact C-N 3.34Å; S1274-P1276 WeakPolarHBondContact O-CD 3.41Å; S1274-P1276 VanDerWaalsContact O-N 3.12Å; S1274-F1277 WeakPolarHBondContact O-CA 3.13Å; S1274-F1277 PolarHBondContact O-N 3.44Å; S1274-L1278 WeakPolarHBondContact O-CG 3.26Å; S1274-L1278 PolarHBondContact O-N 3.37Å
1275	W	94.1	Very high	93	Very high	135 Å²	135	66.2 Å²	66.2	51%	0.511	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-36.2	-170.3	73.2	-95.1	0	0	0	115.7	D1273 F1277 V1338	D1273-W1275 VanDerWaalsContact C-N 3.34Å; W1275-F1277 VanDerWaalsContact C-N 3.28Å; W1275-F1277 PolarHBondContact O-N 2.96Å; W1275-V1338 HydrophobicContact CH2-CG2 4.2Å; W1275-V1338 HydrophobicContact CZ2-CG2 4.5Å
1276	P	94.5	Very high	92.6	Very high	25 Å²	25	66.1 Å²	66.1	16%	0.162	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-18.5	177.2	-13.9	30.7	0	0	0	113.5	S1274 V1338 C1341	S1274-P1276 VanDerWaalsContact C-N 3.34Å; S1274-P1276 WeakPolarHBondContact O-CD 3.41Å; S1274-P1276 VanDerWaalsContact O-N 3.12Å; P1276-V1338 HydrophobicContact CB-CG1 3.7Å; P1276-V1338 HydrophobicContact CB-CG2 4.35Å; P1276-V1338 HydrophobicContact CG-CG1 4.07Å; P1276-V1338 HydrophobicContact CG-CG2 4.3Å; P1276-C1341 HydrophobicContact CG-CB 4.04Å
1277	F	97.5	Very high	92.6	Very high	13 Å²	13	67.2 Å²	67.2	6%	0.057	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-2.6	-169.1	-46	-62.1	0	0	0	113.5	S1274 W1275 T1279 D1298 L1299 I1324 C1328 V1338 C1341 L1345	S1274-F1277 WeakPolarHBondContact O-CA 3.13Å; S1274-F1277 PolarHBondContact O-N 3.44Å; W1275-F1277 VanDerWaalsContact C-N 3.28Å; W1275-F1277 PolarHBondContact O-N 2.96Å; F1277-T1279 VanDerWaalsContact C-N 3.33Å; F1277-T1279 PolarHBondContact O-N 3.31Å; F1277-D1298 WeakPolarHBondContact O-CB 3.07Å; F1277-L1299 HydrophobicContact CB-CD1 4.43Å; F1277-L1299 HydrophobicContact CB-CG 4.45Å; F1277-L1299 WeakPolarHBondContact O-CB 3.29Å; F1277-L1299 PolarHBondContact O-N 3.35Å; F1277-I1324 HydrophobicContact CB-CG2 3.7Å; F1277-I1324 HydrophobicContact CD1-CG2 3.47Å; F1277-I1324 VanDerWaalsContact CD1-CG2 3.47Å; F1277-I1324 HydrophobicContact CE1-CG2 4.34Å; F1277-I1324 HydrophobicContact CG-CG2 3.71Å; F1277-C1328 HydrophobicContact CE1-CB 3.75Å; F1277-C1328 HydrophobicContact CZ-CB 4.27Å; F1277-V1338 HydrophobicContact CE1-CG1 4.34Å; F1277-V1338 HydrophobicContact CZ-CG1 4.38Å; F1277-C1341 HydrophobicContact CE2-CB 4Å; F1277-C1341 HydrophobicContact CZ-CB 4.32Å; F1277-L1345 HydrophobicContact CD2-CD2 3.58Å; F1277-L1345 HydrophobicContact CE2-CD2 4.2Å; F1277-L1345 HydrophobicContact CG-CD2 4.41Å
1278	L	95.3	Very high	92.6	Very high	46 Å²	46	68.1 Å²	68.1	24%	0.241	37%	0.371	C	S	.	.	S	Bend	trans	-63.8	-37.6	-178.4	-69.2	175.1	0	0	0	112.2	H1269 S1274 L1299 S1300	H1269-L1278 HydrophobicContact CB-CD2 4.33Å; S1274-L1278 WeakPolarHBondContact O-CG 3.26Å; S1274-L1278 PolarHBondContact O-N 3.37Å; L1278-L1299 HydrophobicContact CD2-CD1 4.24Å; L1278-S1300 WeakPolarHBondContact O-CB 3.27Å; L1278-S1300 PolarHBondContact O-N 2.93Å; L1278-S1300 VanDerWaalsContact O-N 3.1Å
1279	T	95.4	Very high	92.6	Very high	89 Å²	89	68.8 Å²	68.8	55%	0.546	37%	0.374	S	S	.	.	S	Bend	trans	-136.5	161.8	-174.3	62.1	0	0	0	0	112.2	F1277 V1281	F1277-T1279 VanDerWaalsContact C-N 3.33Å; F1277-T1279 PolarHBondContact O-N 3.31Å; T1279-V1281 PolarHBondContact O-N 2.64Å
1280	P	96.1	Very high	92.5	Very high	65 Å²	65	69.8 Å²	69.8	42%	0.422	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-59.4	135.3	178.8	-18.8	26.8	0	0	0	112.7	S1282 D1298	P1280-S1282 PolarHBondContact O-N 3.09Å; P1280-D1298 WeakPolarHBondContact CD-OD1 3.4Å; P1280-D1298 VanDerWaalsContact CG-OD2 3.3Å; P1280-D1298 WeakPolarHBondContact CG-OD2 3.21Å
1281	V	93.7	Very high	92.7	Very high	41 Å²	41	73.7 Å²	73.7	25%	0.248	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-57.2	120.9	-179	-179.4	0	0	0	0	112	T1279 A1286 Y1289 Y1290	T1279-V1281 PolarHBondContact O-N 2.64Å; V1281-A1286 HydrophobicContact CG1-CB 3.81Å; V1281-Y1289 HydrophobicContact CB-CD1 3.79Å; V1281-Y1289 HydrophobicContact CB-CD2 4.4Å; V1281-Y1289 HydrophobicContact CB-CE1 3.72Å; V1281-Y1289 HydrophobicContact CB-CE2 4.36Å; V1281-Y1289 HydrophobicContact CB-CG 4.14Å; V1281-Y1289 HydrophobicContact CG1-CD1 4Å; V1281-Y1289 HydrophobicContact CG1-CD2 4Å; V1281-Y1289 HydrophobicContact CG1-CE1 4.32Å; V1281-Y1289 HydrophobicContact CG1-CE2 4.34Å; V1281-Y1289 HydrophobicContact CG1-CG 3.82Å; V1281-Y1289 HydrophobicContact CG2-CD1 4.3Å; V1281-Y1289 HydrophobicContact CG2-CD2 4.43Å; V1281-Y1289 HydrophobicContact CG2-CE1 3.77Å; V1281-Y1289 HydrophobicContact CG2-CE2 3.94Å; V1281-Y1290 VanDerWaalsContact O-CE2 3.32Å; V1281-Y1290 WeakPolarHBondContact O-CE2 3.47Å; V1281-Y1290 PolarHBondContact O-OH 2.89Å
1282	S	90.8	Very high	92.8	Very high	49 Å²	49	75.4 Å²	75.4	34%	0.343	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-72	132.5	-178.8	177.6	0	0	0	0	112.5	P1280 K1284 I1285 A1286	P1280-S1282 PolarHBondContact O-N 3.09Å; S1282-K1284 PolarHBondContact O-N 2.76Å; S1282-K1284 WeakPolarHBondContact OG-CB 3.45Å; S1282-K1284 PolarHBondContact OG-N 2.64Å; S1282-I1285 PolarHBondContact O-N 2.9Å; S1282-A1286 PolarHBondContact O-N 3.01Å
1283	K	90.9	Very high	93.1	Very high	144 Å²	144	71.4 Å²	71.4	63%	0.626	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-17.5	169.5	-70.5	-174	-179.6	178.8	0	113.7	P1287 Y1290	K1283-P1287 WeakPolarHBondContact O-CA 3.48Å; K1283-Y1290 HydrophobicContact CD-CD2 4.27Å; K1283-Y1290 HydrophobicContact CD-CE2 4.46Å; K1283-Y1290 HydrophobicContact CG-CD2 3.59Å; K1283-Y1290 HydrophobicContact CG-CE2 3.56Å
1284	K	86.3	Confident	93.1	Very high	194 Å²	194	81 Å²	81	84%	0.843	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-32.8	174.8	-64.1	-177.8	178.2	178.4	0	112.4	S1282	S1282-K1284 PolarHBondContact O-N 2.76Å; S1282-K1284 WeakPolarHBondContact OG-CB 3.45Å; S1282-K1284 PolarHBondContact OG-N 2.64Å
1285	I	82.8	Confident	93.1	Very high	145 Å²	145	84.2 Å²	84.2	74%	0.744	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-42.9	-178	-59.4	173.6	0	0	0	109.6	S1282	S1282-I1285 PolarHBondContact O-N 2.9Å
1286	A	86.7	Confident	93.2	Very high	8 Å²	8	80.3 Å²	80.3	7%	0.066	41%	0.406	C	S	.	.			trans	-131.3	83	-177.4	0	0	0	0	0	110.4	V1281 S1282 D1288 Y1289 Y1331	V1281-A1286 HydrophobicContact CG1-CB 3.81Å; S1282-A1286 PolarHBondContact O-N 3.01Å; A1286-D1288 VanDerWaalsContact C-N 3.26Å; A1286-D1288 PolarHBondContact O-N 3.4Å; A1286-Y1289 HydrophobicContact CB-CG 4.46Å; A1286-Y1289 VanDerWaalsContact O-CB 3.29Å; A1286-Y1289 WeakPolarHBondContact O-CB 3.42Å; A1286-Y1289 PolarHBondContact O-N 2.96Å; A1286-Y1331 HydrophobicContact CB-CE1 4.11Å; A1286-Y1331 WeakPolarHBondContact CB-OH 3.39Å
1287	P	91.9	Very high	93.3	Very high	96 Å²	96	80.6 Å²	80.6	62%	0.623	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-28	-171.8	-24.5	34.5	0	0	0	115	K1283	K1283-P1287 WeakPolarHBondContact O-CA 3.48Å
1288	D	94.5	Very high	93.4	Very high	63 Å²	63	80.3 Å²	80.3	34%	0.337	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-4.1	-179.7	68	-39.5	0	0	0	113.5	A1286 Y1290 K1291 I1292 Y1331	A1286-D1288 VanDerWaalsContact C-N 3.26Å; A1286-D1288 PolarHBondContact O-N 3.4Å; D1288-Y1290 VanDerWaalsContact C-N 3.34Å; D1288-Y1290 PolarHBondContact O-N 2.9Å; D1288-K1291 HydrophobicContact CB-CD 4.32Å; D1288-K1291 WeakPolarHBondContact O-CA 3.46Å; D1288-K1291 VanDerWaalsContact O-CB 3.25Å; D1288-K1291 WeakPolarHBondContact O-CB 3.3Å; D1288-K1291 PolarHBondContact O-N 3.49Å; D1288-I1292 PolarHBondContact O-N 3.43Å; D1288-Y1331 PolarHBondContact OD1-OH 3.11Å
1289	Y	95.8	Very high	93.5	Very high	15 Å²	15	78.2 Å²	78.2	6%	0.059	39%	0.394	C	S	.	.	H	α-helix	trans	-48	-52.6	-178.9	-173.2	-102.5	0	0	0	113.2	V1281 A1286 K1291 I1292 I1293 P1296 Y1331	V1281-Y1289 HydrophobicContact CB-CD1 3.79Å; V1281-Y1289 HydrophobicContact CB-CD2 4.4Å; V1281-Y1289 HydrophobicContact CB-CE1 3.72Å; V1281-Y1289 HydrophobicContact CB-CE2 4.36Å; V1281-Y1289 HydrophobicContact CB-CG 4.14Å; V1281-Y1289 HydrophobicContact CG1-CD1 4Å; V1281-Y1289 HydrophobicContact CG1-CD2 4Å; V1281-Y1289 HydrophobicContact CG1-CE1 4.32Å; V1281-Y1289 HydrophobicContact CG1-CE2 4.34Å; V1281-Y1289 HydrophobicContact CG1-CG 3.82Å; V1281-Y1289 HydrophobicContact CG2-CD1 4.3Å; V1281-Y1289 HydrophobicContact CG2-CD2 4.43Å; V1281-Y1289 HydrophobicContact CG2-CE1 3.77Å; V1281-Y1289 HydrophobicContact CG2-CE2 3.94Å; A1286-Y1289 HydrophobicContact CB-CG 4.46Å; A1286-Y1289 VanDerWaalsContact O-CB 3.29Å; A1286-Y1289 WeakPolarHBondContact O-CB 3.42Å; A1286-Y1289 PolarHBondContact O-N 2.96Å; Y1289-K1291 PolarHBondContact O-N 2.88Å; Y1289-I1292 PolarHBondContact O-N 3.15Å; Y1289-I1292 VanDerWaalsContact O-N 3.07Å; Y1289-I1293 HydrophobicContact CD1-CB 4.28Å; Y1289-I1293 HydrophobicContact CD2-CG1 4.06Å; Y1289-I1293 HydrophobicContact CE1-CB 3.92Å; Y1289-I1293 HydrophobicContact CE1-CG1 4.19Å; Y1289-I1293 HydrophobicContact CE1-CG2 3.99Å; Y1289-I1293 HydrophobicContact CE2-CB 4.27Å; Y1289-I1293 HydrophobicContact CE2-CG1 3.6Å; Y1289-I1293 PolarHBondContact O-N 3.38Å; Y1289-P1296 HydrophobicContact CE1-CB 4.24Å; Y1289-Y1331 VanDerWaalsContact CA-CE2 3.48Å; Y1289-Y1331 AromaticContact CD2-CD1 3.62Å; Y1289-Y1331 HydrophobicContact CD2-CD1 3.62Å; Y1289-Y1331 AromaticContact CD2-CD2 3.63Å; Y1289-Y1331 HydrophobicContact CD2-CD2 3.63Å; Y1289-Y1331 AromaticContact CD2-CE1 3.78Å; Y1289-Y1331 HydrophobicContact CD2-CE1 3.78Å; Y1289-Y1331 AromaticContact CD2-CE2 3.82Å; Y1289-Y1331 HydrophobicContact CD2-CE2 3.82Å; Y1289-Y1331 AromaticContact CD2-CG 3.54Å; Y1289-Y1331 HydrophobicContact CD2-CG 3.54Å; Y1289-Y1331 AromaticContact CD2-CZ 3.89Å; Y1289-Y1331 AromaticContact CE2-CD1 3.94Å; Y1289-Y1331 HydrophobicContact CE2-CD1 3.94Å; Y1289-Y1331 HydrophobicContact CE2-CD2 4.21Å; Y1289-Y1331 AromaticContact CE2-CG 3.77Å; Y1289-Y1331 HydrophobicContact CE2-CG 3.77Å; Y1289-Y1331 HydrophobicContact CG-CE2 4.42Å
1290	Y	95	Very high	93.5	Very high	89 Å²	89	75 Å²	75	35%	0.349	38%	0.375	S	S	.	.	H	α-helix	trans	-74.9	-1.5	-179	-61.5	-79.4	0	0	0	114.3	V1281 K1283 D1288 P1296	V1281-Y1290 VanDerWaalsContact O-CE2 3.32Å; V1281-Y1290 WeakPolarHBondContact O-CE2 3.47Å; V1281-Y1290 PolarHBondContact O-OH 2.89Å; K1283-Y1290 HydrophobicContact CD-CD2 4.27Å; K1283-Y1290 HydrophobicContact CD-CE2 4.46Å; K1283-Y1290 HydrophobicContact CG-CD2 3.59Å; K1283-Y1290 HydrophobicContact CG-CE2 3.56Å; D1288-Y1290 VanDerWaalsContact C-N 3.34Å; D1288-Y1290 PolarHBondContact O-N 2.9Å; Y1290-P1296 HydrophobicContact CD1-CG 4.21Å; Y1290-P1296 HydrophobicContact CE1-CB 3.99Å; Y1290-P1296 HydrophobicContact CE1-CG 3.86Å
1291	K	93.5	Very high	93.5	Very high	171 Å²	171	73.9 Å²	73.9	74%	0.743	37%	0.367	S	S	*	.	H	α-helix	trans	-85.7	-31.9	167.4	-58.3	178.7	-177.7	171.5	0	111	D1288 Y1289	D1288-K1291 HydrophobicContact CB-CD 4.32Å; D1288-K1291 WeakPolarHBondContact O-CA 3.46Å; D1288-K1291 VanDerWaalsContact O-CB 3.25Å; D1288-K1291 WeakPolarHBondContact O-CB 3.3Å; D1288-K1291 PolarHBondContact O-N 3.49Å; Y1289-K1291 PolarHBondContact O-N 2.88Å
1292	I	94.4	Very high	93.7	Very high	77 Å²	77	71.9 Å²	71.9	40%	0.395	36%	0.355	S	S	.	.	H	α-helix	trans	-91.7	-55.3	-179.1	-55.7	-175.4	0	0	0	110.2	D1288 Y1289 R1294 Y1331	D1288-I1292 PolarHBondContact O-N 3.43Å; Y1289-I1292 PolarHBondContact O-N 3.15Å; Y1289-I1292 VanDerWaalsContact O-N 3.07Å; I1292-R1294 PolarHBondContact O-N 2.92Å; I1292-Y1331 HydrophobicContact CB-CD2 4.08Å; I1292-Y1331 HydrophobicContact CB-CE2 4.46Å; I1292-Y1331 HydrophobicContact CD1-CD2 3.92Å; I1292-Y1331 HydrophobicContact CD1-CE2 3.8Å; I1292-Y1331 HydrophobicContact CG1-CD2 4.45Å; I1292-Y1331 HydrophobicContact CG1-CE2 4.42Å; I1292-Y1331 HydrophobicContact CG2-CD2 4.28Å
1293	I	96	Very high	93.9	Very high	2 Å²	2	70.5 Å²	70.5	1%	0.01	35%	0.347	C	S	.	.			trans	-85.5	109.4	-179.3	-58	-53.2	0	0	0	110.3	Y1289 P1296 N1327 L1330 Y1331	Y1289-I1293 HydrophobicContact CD1-CB 4.28Å; Y1289-I1293 HydrophobicContact CD2-CG1 4.06Å; Y1289-I1293 HydrophobicContact CE1-CB 3.92Å; Y1289-I1293 HydrophobicContact CE1-CG1 4.19Å; Y1289-I1293 HydrophobicContact CE1-CG2 3.99Å; Y1289-I1293 HydrophobicContact CE2-CB 4.27Å; Y1289-I1293 HydrophobicContact CE2-CG1 3.6Å; Y1289-I1293 PolarHBondContact O-N 3.38Å; I1293-P1296 HydrophobicContact CG2-CB 4.36Å; I1293-N1327 HydrophobicContact CD1-CB 4.18Å; I1293-N1327 HydrophobicContact CG1-CB 4.5Å; I1293-N1327 HydrophobicContact CG2-CB 4.09Å; I1293-N1327 VanDerWaalsContact CG2-CG 3.49Å; I1293-N1327 WeakPolarHBondContact CG2-OD1 3.3Å; I1293-L1330 HydrophobicContact CD1-CB 3.98Å; I1293-L1330 HydrophobicContact CD1-CD2 3.71Å; I1293-L1330 HydrophobicContact CD1-CG 3.92Å; I1293-Y1331 HydrophobicContact CG1-CD2 4.33Å; I1293-Y1331 HydrophobicContact CG1-CG 4.47Å
1294	R	94.6	Very high	94.1	Very high	229 Å²	229	70.3 Å²	70.3	86%	0.864	35%	0.346	S	S	*	.	S	Bend	trans	-84.5	-28.7	-178	-61.8	-175.6	-179.7	-172.1	1	113.9	I1292 P1296	I1292-R1294 PolarHBondContact O-N 2.92Å; R1294-P1296 VanDerWaalsContact C-CD 3.5Å; R1294-P1296 WeakPolarHBondContact O-CD 3.43Å
1295	S	94.6	Very high	94.5	Very high	73 Å²	73	64 Å²	64	51%	0.51	32%	0.318	S	S	.	.	S	Bend	trans	-124.8	71.1	-177.1	-61.2	0	0	0	0	109.9	N1327	S1295-N1327 PolarHBondContact O-ND2 3.35Å
1296	P	96.6	Very high	95.1	Very high	53 Å²	53	58 Å²	58	34%	0.344	29%	0.287	S	S	.	.			trans	-61.6	142.3	179.7	28.7	-36.7	0	0	0	110.8	Y1289 Y1290 I1293 R1294	Y1289-P1296 HydrophobicContact CE1-CB 4.24Å; Y1290-P1296 HydrophobicContact CD1-CG 4.21Å; Y1290-P1296 HydrophobicContact CE1-CB 3.99Å; Y1290-P1296 HydrophobicContact CE1-CG 3.86Å; I1293-P1296 HydrophobicContact CG2-CB 4.36Å; R1294-P1296 VanDerWaalsContact C-CD 3.5Å; R1294-P1296 WeakPolarHBondContact O-CD 3.43Å
1297	M	97.8	Very high	95.2	Very high	31 Å²	31	63.4 Å²	63.4	15%	0.153	32%	0.315	C	S	.	.			trans	-146.4	151	176	-165.8	51.8	57.9	0	0	109.4	T1301 V1302 D1320 Q1323 I1324	M1297-T1301 HydrophobicContact CE-CG2 4.23Å; M1297-T1301 HydrophobicContact SD-CG2 3.6Å; M1297-V1302 HydrophobicContact CG-CG2 3.95Å; M1297-V1302 HydrophobicContact SD-CG2 3.91Å; M1297-D1320 WeakPolarHBondContact CE-OD2 3.49Å; M1297-D1320 HydrophobicContact CG-CB 4.15Å; M1297-D1320 VanDerWaalsContact CG-O 3.27Å; M1297-D1320 WeakPolarHBondContact CG-O 3.36Å; M1297-D1320 HydrophobicContact SD-CB 4.33Å; M1297-Q1323 HydrophobicContact CB-CB 4.27Å; M1297-Q1323 HydrophobicContact CB-CG 4.2Å; M1297-I1324 HydrophobicContact CB-CG1 3.91Å; M1297-I1324 HydrophobicContact CG-CD1 4.37Å; M1297-I1324 HydrophobicContact CG-CG1 3.76Å
1298	D	97.9	Very high	95.1	Very high	6 Å²	6	63.1 Å²	63.1	3%	0.032	32%	0.315	C	S	.	.			trans	-156.1	160.8	-178.7	65.5	93.3	0	0	0	109.5	F1277 P1280 S1300 T1301 V1302	F1277-D1298 WeakPolarHBondContact O-CB 3.07Å; P1280-D1298 WeakPolarHBondContact CD-OD1 3.4Å; P1280-D1298 VanDerWaalsContact CG-OD2 3.3Å; P1280-D1298 WeakPolarHBondContact CG-OD2 3.21Å; D1298-S1300 VanDerWaalsContact C-N 3.32Å; D1298-S1300 PolarHBondContact O-N 3.3Å; D1298-S1300 WeakPolarHBondContact OD1-CA 3.31Å; D1298-S1300 WeakPolarHBondContact OD1-CB 3.41Å; D1298-S1300 PolarHBondContact OD1-N 3.22Å; D1298-S1300 VanDerWaalsContact OD1-N 3.11Å; D1298-S1300 PolarHBondContact OD1-OG 3.49Å; D1298-T1301 VanDerWaalsContact CG-OG1 3.31Å; D1298-T1301 PolarHBondContact O-N 2.76Å; D1298-T1301 VanDerWaalsContact O-N 3.09Å; D1298-T1301 PolarHBondContact OD1-N 2.82Å; D1298-T1301 PolarHBondContact OD1-OG1 2.83Å; D1298-T1301 VanDerWaalsContact OD2-CB 3.27Å; D1298-T1301 WeakPolarHBondContact OD2-CB 3.32Å; D1298-T1301 PolarHBondContact OD2-OG1 2.78Å; D1298-V1302 WeakPolarHBondContact O-CG2 3.42Å; D1298-V1302 PolarHBondContact O-N 2.8Å
1299	L	97.5	Very high	94.9	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-35.3	-174.3	-69.2	174.1	0	0	0	112.7	L1268 F1277 L1278 T1301 V1302 A1303 I1324 L1345	L1268-L1299 HydrophobicContact CB-CD1 4.29Å; L1268-L1299 HydrophobicContact CB-CD2 4.15Å; L1268-L1299 HydrophobicContact CD1-CD2 4.12Å; F1277-L1299 HydrophobicContact CB-CD1 4.43Å; F1277-L1299 HydrophobicContact CB-CG 4.45Å; F1277-L1299 WeakPolarHBondContact O-CB 3.29Å; F1277-L1299 PolarHBondContact O-N 3.35Å; L1278-L1299 HydrophobicContact CD2-CD1 4.24Å; L1299-T1301 VanDerWaalsContact C-N 3.35Å; L1299-T1301 PolarHBondContact O-N 3.03Å; L1299-V1302 PolarHBondContact O-N 2.9Å; L1299-A1303 WeakPolarHBondContact O-CB 3.35Å; L1299-A1303 PolarHBondContact O-N 3.45Å; L1299-I1324 HydrophobicContact CD2-CD1 3.85Å; L1299-I1324 HydrophobicContact CG-CD1 4.07Å; L1299-L1345 HydrophobicContact CD1-CD2 4.4Å
1300	S	96.1	Very high	94.7	Very high	23 Å²	23	63.7 Å²	63.7	16%	0.161	34%	0.335	C	S	.	.	H	α-helix	trans	-66.9	-35.4	175	81.7	0	0	0	0	112.4	L1278 D1298 K1304	L1278-S1300 WeakPolarHBondContact O-CB 3.27Å; L1278-S1300 PolarHBondContact O-N 2.93Å; L1278-S1300 VanDerWaalsContact O-N 3.1Å; D1298-S1300 VanDerWaalsContact C-N 3.32Å; D1298-S1300 PolarHBondContact O-N 3.3Å; D1298-S1300 WeakPolarHBondContact OD1-CA 3.31Å; D1298-S1300 WeakPolarHBondContact OD1-CB 3.41Å; D1298-S1300 PolarHBondContact OD1-N 3.22Å; D1298-S1300 VanDerWaalsContact OD1-N 3.11Å; D1298-S1300 PolarHBondContact OD1-OG 3.49Å; S1300-K1304 VanDerWaalsContact O-CG 3.3Å; S1300-K1304 WeakPolarHBondContact O-CG 3.5Å; S1300-K1304 PolarHBondContact O-N 3.24Å
1301	T	97	Very high	94.6	Very high	40 Å²	40	59.8 Å²	59.8	25%	0.245	32%	0.319	C	S	.	.	H	α-helix	trans	-70.3	-40.2	174.5	-62.8	0	0	0	0	111.1	M1297 D1298 L1299 K1304 K1305	M1297-T1301 HydrophobicContact CE-CG2 4.23Å; M1297-T1301 HydrophobicContact SD-CG2 3.6Å; D1298-T1301 VanDerWaalsContact CG-OG1 3.31Å; D1298-T1301 PolarHBondContact O-N 2.76Å; D1298-T1301 VanDerWaalsContact O-N 3.09Å; D1298-T1301 PolarHBondContact OD1-N 2.82Å; D1298-T1301 PolarHBondContact OD1-OG1 2.83Å; D1298-T1301 VanDerWaalsContact OD2-CB 3.27Å; D1298-T1301 WeakPolarHBondContact OD2-CB 3.32Å; D1298-T1301 PolarHBondContact OD2-OG1 2.78Å; L1299-T1301 VanDerWaalsContact C-N 3.35Å; L1299-T1301 PolarHBondContact O-N 3.03Å; T1301-K1304 PolarHBondContact O-N 3.4Å; T1301-K1305 HydrophobicContact CG2-CD 4.48Å; T1301-K1305 WeakPolarHBondContact O-CG 3.49Å; T1301-K1305 PolarHBondContact O-N 3.09Å
1302	V	97.3	Very high	94.3	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.6	-46.1	173.5	178.6	0	0	0	0	110.9	L1265 M1297 D1298 L1299 K1304 K1305 F1306 Y1311 M1317 D1320 I1321 I1324	L1265-V1302 HydrophobicContact CD2-CB 4.49Å; L1265-V1302 HydrophobicContact CD2-CG1 3.89Å; M1297-V1302 HydrophobicContact CG-CG2 3.95Å; M1297-V1302 HydrophobicContact SD-CG2 3.91Å; D1298-V1302 WeakPolarHBondContact O-CG2 3.42Å; D1298-V1302 PolarHBondContact O-N 2.8Å; L1299-V1302 PolarHBondContact O-N 2.9Å; V1302-K1304 PolarHBondContact O-N 2.91Å; V1302-K1305 PolarHBondContact O-N 3.04Å; V1302-F1306 WeakPolarHBondContact O-CB 3.32Å; V1302-F1306 PolarHBondContact O-N 3.21Å; V1302-Y1311 HydrophobicContact CG1-CE2 4.25Å; V1302-M1317 HydrophobicContact CG1-CE 4.14Å; V1302-M1317 HydrophobicContact CG1-CG 4Å; V1302-D1320 HydrophobicContact CG2-CB 4.08Å; V1302-I1321 HydrophobicContact CG1-CD1 4.35Å; V1302-I1321 HydrophobicContact CG1-CG1 3.98Å; V1302-I1321 HydrophobicContact CG2-CG1 4.29Å; V1302-I1324 HydrophobicContact CG2-CD1 4.08Å
1303	A	95	Very high	94.2	Very high	20 Å²	20	61 Å²	61	17%	0.165	32%	0.321	C	S	.	.	H	α-helix	trans	-59.2	-46.4	176.7	0	0	0	0	0	111.8	L1265 L1299 K1305 F1306 D1307	L1265-A1303 HydrophobicContact CD1-CB 4.33Å; L1299-A1303 WeakPolarHBondContact O-CB 3.35Å; L1299-A1303 PolarHBondContact O-N 3.45Å; A1303-K1305 PolarHBondContact O-N 3.47Å; A1303-F1306 WeakPolarHBondContact O-CB 3.23Å; A1303-F1306 PolarHBondContact O-N 3.45Å; A1303-D1307 PolarHBondContact O-N 3.38Å
1304	K	94.5	Very high	94	Very high	139 Å²	139	61 Å²	61	60%	0.604	32%	0.32	S	S	*	.	H	α-helix	trans	-61.2	-41	175.6	-74	168.1	-174.9	162.4	0	113.1	S1300 T1301 V1302 S1308	S1300-K1304 VanDerWaalsContact O-CG 3.3Å; S1300-K1304 WeakPolarHBondContact O-CG 3.5Å; S1300-K1304 PolarHBondContact O-N 3.24Å; T1301-K1304 PolarHBondContact O-N 3.4Å; V1302-K1304 PolarHBondContact O-N 2.91Å; K1304-S1308 VanDerWaalsContact O-CB 3.31Å; K1304-S1308 WeakPolarHBondContact O-CB 3.42Å; K1304-S1308 PolarHBondContact O-N 2.79Å; K1304-S1308 PolarHBondContact O-OG 2.97Å
1305	K	95.7	Very high	93.9	Very high	62 Å²	62	50.7 Å²	50.7	27%	0.27	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-39.8	175.5	-77.8	-175.7	68.1	-179	0	111.3	T1301 V1302 A1303 S1308 G1309 A1310 Y1311 D1320	T1301-K1305 HydrophobicContact CG2-CD 4.48Å; T1301-K1305 WeakPolarHBondContact O-CG 3.49Å; T1301-K1305 PolarHBondContact O-N 3.09Å; V1302-K1305 PolarHBondContact O-N 3.04Å; A1303-K1305 PolarHBondContact O-N 3.47Å; K1305-S1308 WeakPolarHBondContact CA-OG 3.29Å; K1305-S1308 PolarHBondContact O-OG 3.18Å; K1305-S1308 VanDerWaalsContact O-OG 3.13Å; K1305-G1309 PolarHBondContact O-N 3.47Å; K1305-A1310 HydrophobicContact CB-CB 4.04Å; K1305-A1310 HydrophobicContact CG-CB 4.31Å; K1305-A1310 VanDerWaalsContact O-CB 3.3Å; K1305-A1310 WeakPolarHBondContact O-CB 3.38Å; K1305-A1310 PolarHBondContact O-N 2.81Å; K1305-Y1311 HydrophobicContact CB-CD2 4.33Å; K1305-Y1311 HydrophobicContact CB-CE1 4.26Å; K1305-Y1311 HydrophobicContact CB-CE2 3.52Å; K1305-Y1311 VanDerWaalsContact CB-CZ 3.48Å; K1305-Y1311 WeakPolarHBondContact CB-OH 3.43Å; K1305-Y1311 HydrophobicContact CD-CE1 4.34Å; K1305-Y1311 WeakPolarHBondContact CD-OH 3.42Å; K1305-D1320 WeakPolarHBondContact CD-OD2 3.09Å; K1305-D1320 WeakPolarHBondContact CE-OD2 3.18Å; K1305-D1320 VanDerWaalsContact NZ-CG 3.35Å; K1305-D1320 IonicContact NZ-OD1 3.25Å; K1305-D1320 PolarHBondContact NZ-OD1 2.86Å; K1305-D1320 IonicContact NZ-OD2 2.87Å; K1305-D1320 PolarHBondContact NZ-OD2 3.02Å
1306	F	94.2	Very high	93.9	Very high	20 Å²	20	50.5 Å²	50.5	9%	0.088	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-50.2	175.5	-178.4	-99	0	0	0	111.9	T1258 C1261 N1262 L1265 V1302 A1303 S1308 G1309 Y1311 M1317 L1364	T1258-F1306 HydrophobicContact CG2-CE1 4.26Å; T1258-F1306 HydrophobicContact CG2-CZ 3.75Å; C1261-F1306 HydrophobicContact CB-CD2 4.35Å; C1261-F1306 HydrophobicContact CB-CE1 4.49Å; C1261-F1306 HydrophobicContact CB-CE2 3.42Å; C1261-F1306 VanDerWaalsContact CB-CE2 3.42Å; C1261-F1306 HydrophobicContact CB-CZ 3.51Å; N1262-F1306 WeakPolarHBondContact OD1-CE1 3.45Å; L1265-F1306 HydrophobicContact CD1-CB 4.17Å; L1265-F1306 HydrophobicContact CD1-CD1 4.11Å; L1265-F1306 HydrophobicContact CD1-CG 4.16Å; V1302-F1306 WeakPolarHBondContact O-CB 3.32Å; V1302-F1306 PolarHBondContact O-N 3.21Å; A1303-F1306 WeakPolarHBondContact O-CB 3.23Å; A1303-F1306 PolarHBondContact O-N 3.45Å; F1306-S1308 VanDerWaalsContact C-N 3.34Å; F1306-S1308 PolarHBondContact O-N 2.93Å; F1306-G1309 PolarHBondContact O-N 3.13Å; F1306-Y1311 HydrophobicContact CB-CD2 4.04Å; F1306-Y1311 HydrophobicContact CB-CE2 4.03Å; F1306-Y1311 HydrophobicContact CD2-CD2 4.31Å; F1306-M1317 HydrophobicContact CD2-CE 4.26Å; F1306-M1317 HydrophobicContact CD2-SD 3.66Å; F1306-M1317 HydrophobicContact CE2-SD 4.13Å; F1306-M1317 HydrophobicContact CG-SD 4.43Å; F1306-L1364 HydrophobicContact CD2-CD1 4.15Å; F1306-L1364 HydrophobicContact CE2-CD1 4.02Å; F1306-L1364 HydrophobicContact CE2-CD2 3.85Å
1307	D	89.6	Confident	93.8	Very high	121 Å²	121	48 Å²	48	65%	0.647	26%	0.26	S	S	*	.	H	α-helix	trans	-65.7	-33.3	-179	-72.8	-22.6	0	0	0	113.5	A1303 G1309	A1303-D1307 PolarHBondContact O-N 3.38Å; D1307-G1309 PolarHBondContact O-N 2.91Å
1308	S	89.8	Confident	93.7	Very high	89 Å²	89	47.2 Å²	47.2	62%	0.622	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-7.6	174.6	59.1	0	0	0	0	113.7	K1304 K1305 F1306	K1304-S1308 VanDerWaalsContact O-CB 3.31Å; K1304-S1308 WeakPolarHBondContact O-CB 3.42Å; K1304-S1308 PolarHBondContact O-N 2.79Å; K1304-S1308 PolarHBondContact O-OG 2.97Å; K1305-S1308 WeakPolarHBondContact CA-OG 3.29Å; K1305-S1308 PolarHBondContact O-OG 3.18Å; K1305-S1308 VanDerWaalsContact O-OG 3.13Å; F1306-S1308 VanDerWaalsContact C-N 3.34Å; F1306-S1308 PolarHBondContact O-N 2.93Å
1309	G	89.1	Confident	93.6	Very high	35 Å²	35	52 Å²	52	36%	0.361	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	28.4	-177.5	0	0	0	0	0	113.7	K1305 F1306 D1307 Y1311	K1305-G1309 PolarHBondContact O-N 3.47Å; F1306-G1309 PolarHBondContact O-N 3.13Å; D1307-G1309 PolarHBondContact O-N 2.91Å; G1309-Y1311 PolarHBondContact O-N 2.86Å
1310	A	91.7	Very high	93.6	Very high	55 Å²	55	53.2 Å²	53.2	46%	0.455	29%	0.289	S	S	.	.			trans	-75.1	-10.7	179.8	0	0	0	0	0	113.9	K1305	K1305-A1310 HydrophobicContact CB-CB 4.04Å; K1305-A1310 HydrophobicContact CG-CB 4.31Å; K1305-A1310 VanDerWaalsContact O-CB 3.3Å; K1305-A1310 WeakPolarHBondContact O-CB 3.38Å; K1305-A1310 PolarHBondContact O-N 2.81Å
1311	Y	92.7	Very high	93.6	Very high	7 Å²	7	52.1 Å²	52.1	3%	0.027	28%	0.282	C	S	.	.			trans	-103.9	121.3	173.2	-54.7	-59.7	0	0	0	110	V1302 K1305 F1306 G1309 E1316 M1317 D1320 L1364	V1302-Y1311 HydrophobicContact CG1-CE2 4.25Å; K1305-Y1311 HydrophobicContact CB-CD2 4.33Å; K1305-Y1311 HydrophobicContact CB-CE1 4.26Å; K1305-Y1311 HydrophobicContact CB-CE2 3.52Å; K1305-Y1311 VanDerWaalsContact CB-CZ 3.48Å; K1305-Y1311 WeakPolarHBondContact CB-OH 3.43Å; K1305-Y1311 HydrophobicContact CD-CE1 4.34Å; K1305-Y1311 WeakPolarHBondContact CD-OH 3.42Å; F1306-Y1311 HydrophobicContact CB-CD2 4.04Å; F1306-Y1311 HydrophobicContact CB-CE2 4.03Å; F1306-Y1311 HydrophobicContact CD2-CD2 4.31Å; G1309-Y1311 PolarHBondContact O-N 2.86Å; Y1311-E1316 WeakPolarHBondContact CA-OE2 3.44Å; Y1311-E1316 HydrophobicContact CD1-CB 3.75Å; Y1311-E1316 HydrophobicContact CG-CB 4.49Å; Y1311-M1317 HydrophobicContact CD1-CB 4.27Å; Y1311-M1317 HydrophobicContact CD2-CB 3.84Å; Y1311-M1317 HydrophobicContact CD2-CG 4.11Å; Y1311-M1317 HydrophobicContact CE1-CB 4.4Å; Y1311-M1317 HydrophobicContact CE2-CB 4Å; Y1311-M1317 HydrophobicContact CE2-CG 3.93Å; Y1311-M1317 HydrophobicContact CG-CB 3.99Å; Y1311-D1320 HydrophobicContact CE1-CB 4.31Å; Y1311-D1320 WeakPolarHBondContact OH-CB 3.27Å; Y1311-D1320 PolarHBondContact OH-OD2 3.03Å; Y1311-L1364 WeakPolarHBondContact O-CB 3.27Å
1312	E	88.4	Confident	93.6	Very high	141 Å²	141	52.6 Å²	52.6	66%	0.659	28%	0.281	S	S	*	.	S	Bend	trans	-80.1	-29.7	172.4	-66.1	-169.5	173.3	0	0	111.6	E1316 L1364	E1312-E1316 PolarHBondContact N-OE2 3.33Å; E1312-L1364 PolarHBondContact O-N 2.94Å
1313	R	91.3	Very high	93.6	Very high	133 Å²	133	55.8 Å²	55.8	50%	0.502	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-134.5	150.1	-177.6	-66	179.8	-175.9	-179.3	1.8	110.9	G1315 E1316 D1362 L1363	R1313-G1315 PolarHBondContact O-N 2.98Å; R1313-E1316 WeakPolarHBondContact O-CB 3.14Å; R1313-E1316 PolarHBondContact O-N 3.48Å; R1313-D1362 CarbonylContact C-O 3.49Å; R1313-D1362 WeakPolarHBondContact CA-O 3.24Å; R1313-L1363 HydrophobicContact CG-CD2 3.99Å
1314	F	92.9	Very high	93.8	Very high	2 Å²	2	55 Å²	55	1%	0.009	29%	0.289	C	S	.	.	H	α-helix	trans	-58.7	-34	175.7	-178.6	-112.4	0	0	0	112.4	C1261 L1264 E1316 M1317 V1318 L1353 L1358 S1359 D1362	C1261-F1314 WeakPolarHBondContact SG-CD2 3.49Å; L1264-F1314 HydrophobicContact CD2-CE2 3.73Å; L1264-F1314 HydrophobicContact CD2-CZ 3.55Å; F1314-E1316 PolarHBondContact O-N 2.87Å; F1314-M1317 HydrophobicContact CD2-CB 4.39Å; F1314-M1317 HydrophobicContact CD2-SD 4.05Å; F1314-M1317 HydrophobicContact CE2-SD 4.02Å; F1314-M1317 WeakPolarHBondContact O-CB 3.43Å; F1314-M1317 PolarHBondContact O-N 2.98Å; F1314-V1318 HydrophobicContact CD1-CG2 3.75Å; F1314-V1318 HydrophobicContact CE1-CG2 3.3Å; F1314-V1318 HydrophobicContact CE2-CG2 4.26Å; F1314-V1318 HydrophobicContact CG-CG2 4.39Å; F1314-V1318 HydrophobicContact CZ-CG2 3.61Å; F1314-V1318 WeakPolarHBondContact O-CG2 3.09Å; F1314-V1318 PolarHBondContact O-N 3.25Å; F1314-L1353 HydrophobicContact CE1-CD2 3.47Å; F1314-L1353 VanDerWaalsContact CE1-CD2 3.47Å; F1314-L1353 HydrophobicContact CZ-CD2 3.39Å; F1314-L1358 HydrophobicContact CD1-CB 3.97Å; F1314-L1358 HydrophobicContact CD2-CD2 4.47Å; F1314-L1358 HydrophobicContact CE1-CB 3.56Å; F1314-L1358 HydrophobicContact CE1-CD1 4.32Å; F1314-L1358 HydrophobicContact CE1-CG 4.4Å; F1314-L1358 HydrophobicContact CE2-CD1 3.98Å; F1314-L1358 HydrophobicContact CG-CD2 4.48Å; F1314-L1358 HydrophobicContact CZ-CB 3.91Å; F1314-L1358 HydrophobicContact CZ-CD1 3.78Å; F1314-L1358 HydrophobicContact CZ-CG 4.32Å; F1314-S1359 WeakPolarHBondContact CD1-O 3.42Å; F1314-D1362 HydrophobicContact CB-CB 4.13Å; F1314-D1362 PolarHBondContact N-O 3.28Å
1315	G	91.7	Very high	93.9	Very high	13 Å²	13	48.5 Å²	48.5	13%	0.134	26%	0.261	C	S	.	.	H	α-helix	trans	-57	-29.6	174.4	0	0	0	0	0	114.6	R1313 N1319 T1360	R1313-G1315 PolarHBondContact O-N 2.98Å; G1315-N1319 PolarHBondContact O-N 3.33Å; G1315-N1319 VanDerWaalsContact O-N 3.1Å; G1315-N1319 PolarHBondContact O-ND2 2.83Å; G1315-N1319 PolarHBondContact O-OD1 3.46Å; G1315-T1360 WeakPolarHBondContact CA-O 3.3Å; G1315-T1360 PolarHBondContact N-O 2.92Å; G1315-T1360 VanDerWaalsContact N-O 3.11Å
1316	E	94.9	Very high	93.9	Very high	68 Å²	68	49.5 Å²	49.5	32%	0.318	27%	0.269	S	S	.	.	H	α-helix	trans	-73.1	-35.8	176	-62	172	178.4	0	0	111.7	Y1311 E1312 R1313 F1314 N1319 D1320	Y1311-E1316 WeakPolarHBondContact CA-OE2 3.44Å; Y1311-E1316 HydrophobicContact CD1-CB 3.75Å; Y1311-E1316 HydrophobicContact CG-CB 4.49Å; E1312-E1316 PolarHBondContact N-OE2 3.33Å; R1313-E1316 WeakPolarHBondContact O-CB 3.14Å; R1313-E1316 PolarHBondContact O-N 3.48Å; F1314-E1316 PolarHBondContact O-N 2.87Å; E1316-N1319 PolarHBondContact O-N 3.37Å; E1316-D1320 PolarHBondContact O-N 2.84Å
1317	M	95.1	Very high	94.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-68.4	-39.9	173.6	-177.3	-179.7	175.4	0	0	111.5	C1261 L1265 V1302 F1306 Y1311 F1314 N1319 D1320 I1321	C1261-M1317 HydrophobicContact CB-CE 4.44Å; C1261-M1317 HydrophobicContact CB-SD 4.2Å; L1265-M1317 HydrophobicContact CD1-CE 3.47Å; L1265-M1317 VanDerWaalsContact CD1-CE 3.47Å; L1265-M1317 HydrophobicContact CD2-CE 3.53Å; L1265-M1317 HydrophobicContact CG-CE 3.31Å; V1302-M1317 HydrophobicContact CG1-CE 4.14Å; V1302-M1317 HydrophobicContact CG1-CG 4Å; F1306-M1317 HydrophobicContact CD2-CE 4.26Å; F1306-M1317 HydrophobicContact CD2-SD 3.66Å; F1306-M1317 HydrophobicContact CE2-SD 4.13Å; F1306-M1317 HydrophobicContact CG-SD 4.43Å; Y1311-M1317 HydrophobicContact CD1-CB 4.27Å; Y1311-M1317 HydrophobicContact CD2-CB 3.84Å; Y1311-M1317 HydrophobicContact CD2-CG 4.11Å; Y1311-M1317 HydrophobicContact CE1-CB 4.4Å; Y1311-M1317 HydrophobicContact CE2-CB 4Å; Y1311-M1317 HydrophobicContact CE2-CG 3.93Å; Y1311-M1317 HydrophobicContact CG-CB 3.99Å; F1314-M1317 HydrophobicContact CD2-CB 4.39Å; F1314-M1317 HydrophobicContact CD2-SD 4.05Å; F1314-M1317 HydrophobicContact CE2-SD 4.02Å; F1314-M1317 WeakPolarHBondContact O-CB 3.43Å; F1314-M1317 PolarHBondContact O-N 2.98Å; M1317-N1319 VanDerWaalsContact C-N 3.32Å; M1317-N1319 PolarHBondContact O-N 2.91Å; M1317-D1320 PolarHBondContact O-N 2.93Å; M1317-I1321 HydrophobicContact CE-CD1 4.26Å; M1317-I1321 HydrophobicContact CG-CD1 4.16Å; M1317-I1321 WeakPolarHBondContact O-CG1 3.14Å; M1317-I1321 PolarHBondContact O-N 3.34Å
1318	V	95.1	Very high	94.4	Very high	15 Å²	15	43.1 Å²	43.1	9%	0.091	24%	0.236	C	C	.	.	H	α-helix	trans	-59.3	-43.5	173.2	173.2	0	0	0	0	110.8	F1314 D1320 I1321 E1322 F1349	F1314-V1318 HydrophobicContact CD1-CG2 3.75Å; F1314-V1318 HydrophobicContact CE1-CG2 3.3Å; F1314-V1318 HydrophobicContact CE2-CG2 4.26Å; F1314-V1318 HydrophobicContact CG-CG2 4.39Å; F1314-V1318 HydrophobicContact CZ-CG2 3.61Å; F1314-V1318 WeakPolarHBondContact O-CG2 3.09Å; F1314-V1318 PolarHBondContact O-N 3.25Å; V1318-D1320 VanDerWaalsContact C-N 3.33Å; V1318-D1320 PolarHBondContact O-N 3.4Å; V1318-I1321 PolarHBondContact O-N 2.95Å; V1318-E1322 HydrophobicContact CG1-CG 4.21Å; V1318-E1322 WeakPolarHBondContact O-CB 3.15Å; V1318-E1322 WeakPolarHBondContact O-CG 3.25Å; V1318-E1322 PolarHBondContact O-N 3.34Å; V1318-F1349 HydrophobicContact CG1-CE1 4.39Å; V1318-F1349 HydrophobicContact CG1-CZ 4.17Å; V1318-F1349 HydrophobicContact CG2-CZ 4.25Å
1319	N	95.9	Very high	94.7	Very high	107 Å²	107	41.2 Å²	41.2	57%	0.572	22%	0.216	S	C	*	.	H	α-helix	trans	-60.2	-41.1	178.4	-69.9	-21.2	0	0	0	112.7	G1315 E1316 M1317 Q1323	G1315-N1319 PolarHBondContact O-N 3.33Å; G1315-N1319 VanDerWaalsContact O-N 3.1Å; G1315-N1319 PolarHBondContact O-ND2 2.83Å; G1315-N1319 PolarHBondContact O-OD1 3.46Å; E1316-N1319 PolarHBondContact O-N 3.37Å; M1317-N1319 VanDerWaalsContact C-N 3.32Å; M1317-N1319 PolarHBondContact O-N 2.91Å; N1319-Q1323 WeakPolarHBondContact O-CB 3.35Å; N1319-Q1323 PolarHBondContact O-N 3.16Å
1320	D	97.6	Very high	95	Very high	27 Å²	27	45.1 Å²	45.1	14%	0.144	23%	0.228	C	C	.	.	H	α-helix	trans	-69.3	-38.6	176.6	-91.5	34.4	0	0	0	111.9	M1297 V1302 K1305 Y1311 E1316 M1317 V1318 Q1323 I1324	M1297-D1320 WeakPolarHBondContact CE-OD2 3.49Å; M1297-D1320 HydrophobicContact CG-CB 4.15Å; M1297-D1320 VanDerWaalsContact CG-O 3.27Å; M1297-D1320 WeakPolarHBondContact CG-O 3.36Å; M1297-D1320 HydrophobicContact SD-CB 4.33Å; V1302-D1320 HydrophobicContact CG2-CB 4.08Å; K1305-D1320 WeakPolarHBondContact CD-OD2 3.09Å; K1305-D1320 WeakPolarHBondContact CE-OD2 3.18Å; K1305-D1320 VanDerWaalsContact NZ-CG 3.35Å; K1305-D1320 IonicContact NZ-OD1 3.25Å; K1305-D1320 PolarHBondContact NZ-OD1 2.86Å; K1305-D1320 IonicContact NZ-OD2 2.87Å; K1305-D1320 PolarHBondContact NZ-OD2 3.02Å; Y1311-D1320 HydrophobicContact CE1-CB 4.31Å; Y1311-D1320 WeakPolarHBondContact OH-CB 3.27Å; Y1311-D1320 PolarHBondContact OH-OD2 3.03Å; E1316-D1320 PolarHBondContact O-N 2.84Å; M1317-D1320 PolarHBondContact O-N 2.93Å; V1318-D1320 VanDerWaalsContact C-N 3.33Å; V1318-D1320 PolarHBondContact O-N 3.4Å; D1320-Q1323 WeakPolarHBondContact O-CB 3.42Å; D1320-Q1323 PolarHBondContact O-N 3.49Å; D1320-I1324 PolarHBondContact O-N 3.04Å
1321	I	97.1	Very high	95.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.2	-44.2	174.2	-66.6	168.8	0	0	0	110.5	L1268 V1302 M1317 V1318 Q1323 I1324 F1325 F1349	L1268-I1321 HydrophobicContact CD1-CD1 4.06Å; L1268-I1321 HydrophobicContact CD1-CG2 4.4Å; V1302-I1321 HydrophobicContact CG1-CD1 4.35Å; V1302-I1321 HydrophobicContact CG1-CG1 3.98Å; V1302-I1321 HydrophobicContact CG2-CG1 4.29Å; M1317-I1321 HydrophobicContact CE-CD1 4.26Å; M1317-I1321 HydrophobicContact CG-CD1 4.16Å; M1317-I1321 WeakPolarHBondContact O-CG1 3.14Å; M1317-I1321 PolarHBondContact O-N 3.34Å; V1318-I1321 PolarHBondContact O-N 2.95Å; I1321-Q1323 VanDerWaalsContact C-N 3.26Å; I1321-Q1323 PolarHBondContact O-N 3.1Å; I1321-I1324 VanDerWaalsContact O-CB 3.26Å; I1321-I1324 WeakPolarHBondContact O-CB 3.29Å; I1321-I1324 PolarHBondContact O-N 3.27Å; I1321-I1324 VanDerWaalsContact O-N 3.11Å; I1321-F1325 HydrophobicContact CG2-CE2 3.7Å; I1321-F1325 HydrophobicContact CG2-CZ 4.17Å; I1321-F1325 WeakPolarHBondContact O-CD2 3.38Å; I1321-F1349 HydrophobicContact CB-CE2 4.3Å; I1321-F1349 HydrophobicContact CB-CZ 4.1Å; I1321-F1349 HydrophobicContact CD1-CE2 3.69Å; I1321-F1349 HydrophobicContact CD1-CZ 4.15Å; I1321-F1349 HydrophobicContact CG2-CD1 4.16Å; I1321-F1349 HydrophobicContact CG2-CD2 3.97Å; I1321-F1349 HydrophobicContact CG2-CE1 3.96Å; I1321-F1349 HydrophobicContact CG2-CE2 3.75Å; I1321-F1349 HydrophobicContact CG2-CG 4.16Å; I1321-F1349 HydrophobicContact CG2-CZ 3.74Å
1322	E	96.4	Very high	95.2	Very high	50 Å²	50	46.7 Å²	46.7	23%	0.234	23%	0.225	C	C	.	.	H	α-helix	trans	-61.7	-33.1	173.2	-73.2	-69.2	164.2	0	0	112.2	V1318 I1324 F1325 N1326 Q1346	V1318-E1322 HydrophobicContact CG1-CG 4.21Å; V1318-E1322 WeakPolarHBondContact O-CB 3.15Å; V1318-E1322 WeakPolarHBondContact O-CG 3.25Å; V1318-E1322 PolarHBondContact O-N 3.34Å; E1322-I1324 VanDerWaalsContact C-N 3.26Å; E1322-I1324 PolarHBondContact O-N 3.15Å; E1322-F1325 PolarHBondContact O-N 3.47Å; E1322-N1326 WeakPolarHBondContact O-CB 3.43Å; E1322-N1326 VanDerWaalsContact O-CG 3.32Å; E1322-N1326 PolarHBondContact O-N 3.37Å; E1322-N1326 PolarHBondContact O-ND2 3.35Å; E1322-Q1346 PolarHBondContact OE2-NE2 2.79Å
1323	Q	97.6	Very high	95.2	Very high	68 Å²	68	47.1 Å²	47.1	32%	0.318	23%	0.227	S	C	.	.	H	α-helix	trans	-63.7	-31.3	175.1	-170.4	65.5	62.2	0	0	112.2	M1297 N1319 D1320 I1321 N1327	M1297-Q1323 HydrophobicContact CB-CB 4.27Å; M1297-Q1323 HydrophobicContact CB-CG 4.2Å; N1319-Q1323 WeakPolarHBondContact O-CB 3.35Å; N1319-Q1323 PolarHBondContact O-N 3.16Å; D1320-Q1323 WeakPolarHBondContact O-CB 3.42Å; D1320-Q1323 PolarHBondContact O-N 3.49Å; I1321-Q1323 VanDerWaalsContact C-N 3.26Å; I1321-Q1323 PolarHBondContact O-N 3.1Å; Q1323-N1327 PolarHBondContact NE2-OD1 2.77Å; Q1323-N1327 VanDerWaalsContact O-CB 3.27Å; Q1323-N1327 WeakPolarHBondContact O-CB 3.43Å; Q1323-N1327 PolarHBondContact O-N 3.25Å; Q1323-N1327 PolarHBondContact O-ND2 3.31Å
1324	I	98.1	Very high	95.1	Very high	3 Å²	3	45 Å²	45	2%	0.015	23%	0.233	C	C	.	.	H	α-helix	trans	-59.6	-51.7	173.5	-60.3	174.6	0	0	0	109.6	F1277 M1297 L1299 V1302 D1320 I1321 E1322 N1327 C1328	F1277-I1324 HydrophobicContact CB-CG2 3.7Å; F1277-I1324 HydrophobicContact CD1-CG2 3.47Å; F1277-I1324 VanDerWaalsContact CD1-CG2 3.47Å; F1277-I1324 HydrophobicContact CE1-CG2 4.34Å; F1277-I1324 HydrophobicContact CG-CG2 3.71Å; M1297-I1324 HydrophobicContact CB-CG1 3.91Å; M1297-I1324 HydrophobicContact CG-CD1 4.37Å; M1297-I1324 HydrophobicContact CG-CG1 3.76Å; L1299-I1324 HydrophobicContact CD2-CD1 3.85Å; L1299-I1324 HydrophobicContact CG-CD1 4.07Å; V1302-I1324 HydrophobicContact CG2-CD1 4.08Å; D1320-I1324 PolarHBondContact O-N 3.04Å; I1321-I1324 VanDerWaalsContact O-CB 3.26Å; I1321-I1324 WeakPolarHBondContact O-CB 3.29Å; I1321-I1324 PolarHBondContact O-N 3.27Å; I1321-I1324 VanDerWaalsContact O-N 3.11Å; E1322-I1324 VanDerWaalsContact C-N 3.26Å; E1322-I1324 PolarHBondContact O-N 3.15Å; I1324-N1327 PolarHBondContact O-N 3.06Å; I1324-C1328 PolarHBondContact O-N 2.97Å
1325	F	97.3	Very high	94.5	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.009	27%	0.266	C	S	.	.	H	α-helix	trans	-66.5	-44.4	-179.4	-53.5	-52	0	0	0	111.8	I1321 E1322 N1327 C1328 Y1329 L1345 Q1346 F1349	I1321-F1325 HydrophobicContact CG2-CE2 3.7Å; I1321-F1325 HydrophobicContact CG2-CZ 4.17Å; I1321-F1325 WeakPolarHBondContact O-CD2 3.38Å; E1322-F1325 PolarHBondContact O-N 3.47Å; F1325-N1327 VanDerWaalsContact C-N 3.33Å; F1325-N1327 PolarHBondContact O-N 2.8Å; F1325-C1328 WeakPolarHBondContact O-CA 3.28Å; F1325-C1328 WeakPolarHBondContact O-CB 3.28Å; F1325-C1328 PolarHBondContact O-N 2.86Å; F1325-C1328 VanDerWaalsContact O-N 3.07Å; F1325-Y1329 HydrophobicContact CB-CE2 3.84Å; F1325-Y1329 WeakPolarHBondContact O-CD2 3.42Å; F1325-Y1329 VanDerWaalsContact O-CG 3.23Å; F1325-Y1329 PolarHBondContact O-N 3.05Å; F1325-L1345 HydrophobicContact CE1-CB 3.93Å; F1325-L1345 HydrophobicContact CE1-CD2 3.94Å; F1325-L1345 HydrophobicContact CE1-CG 3.92Å; F1325-L1345 HydrophobicContact CZ-CB 4.43Å; F1325-L1345 HydrophobicContact CZ-CD2 4.35Å; F1325-L1345 HydrophobicContact CZ-CG 4.1Å; F1325-Q1346 HydrophobicContact CD1-CB 3.95Å; F1325-Q1346 HydrophobicContact CD2-CB 3.76Å; F1325-Q1346 HydrophobicContact CD2-CG 3.58Å; F1325-Q1346 HydrophobicContact CE1-CB 3.99Å; F1325-Q1346 HydrophobicContact CE2-CB 3.79Å; F1325-Q1346 HydrophobicContact CE2-CG 3.81Å; F1325-Q1346 HydrophobicContact CG-CB 3.85Å; F1325-Q1346 HydrophobicContact CG-CG 4.03Å; F1325-Q1346 HydrophobicContact CZ-CB 3.92Å; F1325-Q1346 HydrophobicContact CZ-CG 4.45Å; F1325-F1349 HydrophobicContact CE2-CB 4.41Å; F1325-F1349 HydrophobicContact CE2-CD1 4.09Å; F1325-F1349 HydrophobicContact CE2-CG 4.4Å; F1325-F1349 HydrophobicContact CZ-CB 4.39Å
1326	N	96.5	Very high	94.4	Very high	83 Å²	83	51.4 Å²	51.4	44%	0.444	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-39.4	177.3	-71.9	-44.8	0	0	0	112.7	E1322 C1328 L1330	E1322-N1326 WeakPolarHBondContact O-CB 3.43Å; E1322-N1326 VanDerWaalsContact O-CG 3.32Å; E1322-N1326 PolarHBondContact O-N 3.37Å; E1322-N1326 PolarHBondContact O-ND2 3.35Å; N1326-C1328 VanDerWaalsContact C-N 3.33Å; N1326-L1330 VanDerWaalsContact O-CB 3.22Å; N1326-L1330 WeakPolarHBondContact O-CB 3.19Å; N1326-L1330 PolarHBondContact O-N 3.36Å
1327	N	96.9	Very high	94.1	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-39.4	173.7	-73.6	-21	0	0	0	111.6	I1293 S1295 Q1323 I1324 F1325 L1330 Y1331	I1293-N1327 HydrophobicContact CD1-CB 4.18Å; I1293-N1327 HydrophobicContact CG1-CB 4.5Å; I1293-N1327 HydrophobicContact CG2-CB 4.09Å; I1293-N1327 VanDerWaalsContact CG2-CG 3.49Å; I1293-N1327 WeakPolarHBondContact CG2-OD1 3.3Å; S1295-N1327 PolarHBondContact O-ND2 3.35Å; Q1323-N1327 PolarHBondContact NE2-OD1 2.77Å; Q1323-N1327 VanDerWaalsContact O-CB 3.27Å; Q1323-N1327 WeakPolarHBondContact O-CB 3.43Å; Q1323-N1327 PolarHBondContact O-N 3.25Å; Q1323-N1327 PolarHBondContact O-ND2 3.31Å; I1324-N1327 PolarHBondContact O-N 3.06Å; F1325-N1327 VanDerWaalsContact C-N 3.33Å; F1325-N1327 PolarHBondContact O-N 2.8Å; N1327-L1330 PolarHBondContact O-N 2.97Å; N1327-Y1331 WeakPolarHBondContact O-CB 3.4Å; N1327-Y1331 PolarHBondContact O-N 3.24Å
1328	C	96.5	Very high	94	Very high	4 Å²	4	56.3 Å²	56.3	3%	0.027	30%	0.298	C	S	.	.	H	α-helix	trans	-57.9	-52.1	175.6	-174.7	0	0	0	0	111.1	F1277 I1324 F1325 N1326 L1330 Y1331 N1332 V1338	F1277-C1328 HydrophobicContact CE1-CB 3.75Å; F1277-C1328 HydrophobicContact CZ-CB 4.27Å; I1324-C1328 PolarHBondContact O-N 2.97Å; F1325-C1328 WeakPolarHBondContact O-CA 3.28Å; F1325-C1328 WeakPolarHBondContact O-CB 3.28Å; F1325-C1328 PolarHBondContact O-N 2.86Å; F1325-C1328 VanDerWaalsContact O-N 3.07Å; N1326-C1328 VanDerWaalsContact C-N 3.33Å; C1328-L1330 VanDerWaalsContact C-N 3.3Å; C1328-L1330 PolarHBondContact O-N 3.28Å; C1328-Y1331 PolarHBondContact O-N 3.11Å; C1328-N1332 WeakPolarHBondContact O-CB 3.22Å; C1328-N1332 PolarHBondContact O-N 3.14Å; C1328-N1332 PolarHBondContact O-ND2 3.21Å; C1328-V1338 PolarHBondContact SG-O 2.75Å
1329	Y	96.7	Very high	94	Very high	49 Å²	49	57.9 Å²	57.9	19%	0.192	30%	0.303	C	S	.	.	H	α-helix	trans	-71.4	-24.9	-177.5	-51.5	-35.8	0	0	0	113.5	F1325 Y1339 G1342 E1343 Q1346	F1325-Y1329 HydrophobicContact CB-CE2 3.84Å; F1325-Y1329 WeakPolarHBondContact O-CD2 3.42Å; F1325-Y1329 VanDerWaalsContact O-CG 3.23Å; F1325-Y1329 PolarHBondContact O-N 3.05Å; Y1329-Y1339 HydrophobicContact CD1-CD1 4.01Å; Y1329-Y1339 AromaticContact CD1-CD2 3.72Å; Y1329-Y1339 HydrophobicContact CD1-CD2 3.72Å; Y1329-Y1339 AromaticContact CD1-CE1 3.78Å; Y1329-Y1339 HydrophobicContact CD1-CE1 3.78Å; Y1329-Y1339 AromaticContact CD1-CE2 3.51Å; Y1329-Y1339 HydrophobicContact CD1-CE2 3.51Å; Y1329-Y1339 AromaticContact CD1-CG 3.96Å; Y1329-Y1339 HydrophobicContact CD1-CG 3.96Å; Y1329-Y1339 AromaticContact CD1-CZ 3.51Å; Y1329-Y1339 HydrophobicContact CE1-CD1 4.19Å; Y1329-Y1339 HydrophobicContact CE1-CE1 4.04Å; Y1329-Y1339 HydrophobicContact CE1-CG 4.46Å; Y1329-Y1339 HydrophobicContact CG-CD2 4.46Å; Y1329-Y1339 AromaticContact CG-CE2 3.91Å; Y1329-Y1339 HydrophobicContact CG-CE2 3.91Å; Y1329-Y1339 AromaticContact CG-CZ 3.96Å; Y1329-G1342 PolarHBondContact OH-O 2.93Å; Y1329-E1343 HydrophobicContact CE1-CG 3.96Å; Y1329-E1343 VanDerWaalsContact OH-CA 3.29Å; Y1329-E1343 WeakPolarHBondContact OH-CA 3.38Å; Y1329-E1343 PolarHBondContact OH-N 2.79Å; Y1329-Q1346 PolarHBondContact OH-OE1 2.92Å
1330	L	95.2	Very high	93.8	Very high	117 Å²	117	53.3 Å²	53.3	61%	0.613	28%	0.281	S	S	*	.	H	α-helix	trans	-77.8	-35.1	176.3	-179.5	61.3	0	0	0	112.6	I1293 N1326 N1327 C1328	I1293-L1330 HydrophobicContact CD1-CB 3.98Å; I1293-L1330 HydrophobicContact CD1-CD2 3.71Å; I1293-L1330 HydrophobicContact CD1-CG 3.92Å; N1326-L1330 VanDerWaalsContact O-CB 3.22Å; N1326-L1330 WeakPolarHBondContact O-CB 3.19Å; N1326-L1330 PolarHBondContact O-N 3.36Å; N1327-L1330 PolarHBondContact O-N 2.97Å; C1328-L1330 VanDerWaalsContact C-N 3.3Å; C1328-L1330 PolarHBondContact O-N 3.28Å
1331	Y	95.4	Very high	93.6	Very high	56 Å²	56	52 Å²	52	22%	0.22	28%	0.275	C	S	.	.	H	α-helix	trans	-89.7	-37.7	-176.8	-172.9	-102.9	0	0	0	113	A1286 D1288 Y1289 I1292 I1293 N1327 C1328	A1286-Y1331 HydrophobicContact CB-CE1 4.11Å; A1286-Y1331 WeakPolarHBondContact CB-OH 3.39Å; D1288-Y1331 PolarHBondContact OD1-OH 3.11Å; Y1289-Y1331 VanDerWaalsContact CA-CE2 3.48Å; Y1289-Y1331 AromaticContact CD2-CD1 3.62Å; Y1289-Y1331 HydrophobicContact CD2-CD1 3.62Å; Y1289-Y1331 AromaticContact CD2-CD2 3.63Å; Y1289-Y1331 HydrophobicContact CD2-CD2 3.63Å; Y1289-Y1331 AromaticContact CD2-CE1 3.78Å; Y1289-Y1331 HydrophobicContact CD2-CE1 3.78Å; Y1289-Y1331 AromaticContact CD2-CE2 3.82Å; Y1289-Y1331 HydrophobicContact CD2-CE2 3.82Å; Y1289-Y1331 AromaticContact CD2-CG 3.54Å; Y1289-Y1331 HydrophobicContact CD2-CG 3.54Å; Y1289-Y1331 AromaticContact CD2-CZ 3.89Å; Y1289-Y1331 AromaticContact CE2-CD1 3.94Å; Y1289-Y1331 HydrophobicContact CE2-CD1 3.94Å; Y1289-Y1331 HydrophobicContact CE2-CD2 4.21Å; Y1289-Y1331 AromaticContact CE2-CG 3.77Å; Y1289-Y1331 HydrophobicContact CE2-CG 3.77Å; Y1289-Y1331 HydrophobicContact CG-CE2 4.42Å; I1292-Y1331 HydrophobicContact CB-CD2 4.08Å; I1292-Y1331 HydrophobicContact CB-CE2 4.46Å; I1292-Y1331 HydrophobicContact CD1-CD2 3.92Å; I1292-Y1331 HydrophobicContact CD1-CE2 3.8Å; I1292-Y1331 HydrophobicContact CG1-CD2 4.45Å; I1292-Y1331 HydrophobicContact CG1-CE2 4.42Å; I1292-Y1331 HydrophobicContact CG2-CD2 4.28Å; I1293-Y1331 HydrophobicContact CG1-CD2 4.33Å; I1293-Y1331 HydrophobicContact CG1-CG 4.47Å; N1327-Y1331 WeakPolarHBondContact O-CB 3.4Å; N1327-Y1331 PolarHBondContact O-N 3.24Å; C1328-Y1331 PolarHBondContact O-N 3.11Å
1332	N	92.3	Very high	93.6	Very high	38 Å²	38	52 Å²	52	20%	0.203	28%	0.275	C	S	.	.	S	Bend	trans	-99.9	145.7	-174.9	-54.4	-75.2	0	0	0	111.1	C1328 A1336 Y1339	C1328-N1332 WeakPolarHBondContact O-CB 3.22Å; C1328-N1332 PolarHBondContact O-N 3.14Å; C1328-N1332 PolarHBondContact O-ND2 3.21Å; N1332-A1336 HydrophobicContact CB-CB 4.03Å; N1332-Y1339 HydrophobicContact CB-CD2 4.5Å; N1332-Y1339 WeakPolarHBondContact O-CD2 3.41Å
1333	E	89.5	Confident	93.5	Very high	151 Å²	151	54.7 Å²	54.7	71%	0.706	29%	0.287	S	S	*	.			trans	-69.7	153.6	169.2	-62.3	-172.4	172.5	0	0	110.7	T1335 A1336 Y1339	E1333-T1335 PolarHBondContact O-N 3.47Å; E1333-A1336 VanDerWaalsContact O-CB 3.3Å; E1333-A1336 WeakPolarHBondContact O-CB 3.33Å; E1333-A1336 PolarHBondContact O-N 2.97Å; E1333-Y1339 VanDerWaalsContact O-CB 3.26Å; E1333-Y1339 WeakPolarHBondContact O-CB 3.48Å
1334	S	89.5	Confident	93.5	Very high	89 Å²	89	56.6 Å²	56.6	62%	0.622	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-13.9	-178.2	59.9	0	0	0	0	114.5
1335	T	80.4	Confident	93.4	Very high	116 Å²	116	56.5 Å²	56.5	71%	0.712	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-15.5	175.8	48.6	0	0	0	0	113.1	E1333	E1333-T1335 PolarHBondContact O-N 3.47Å
1336	A	88	Confident	93.4	Very high	33 Å²	33	58.6 Å²	58.6	27%	0.273	30%	0.301	S	S	.	.	S	Bend	trans	-72.2	139.8	-177.5	0	0	0	0	0	111.4	N1332 E1333 V1338 Y1339 G1340	N1332-A1336 HydrophobicContact CB-CB 4.03Å; E1333-A1336 VanDerWaalsContact O-CB 3.3Å; E1333-A1336 WeakPolarHBondContact O-CB 3.33Å; E1333-A1336 PolarHBondContact O-N 2.97Å; A1336-V1338 PolarHBondContact O-N 3.41Å; A1336-Y1339 WeakPolarHBondContact O-CA 3.35Å; A1336-Y1339 VanDerWaalsContact O-CB 3.22Å; A1336-Y1339 WeakPolarHBondContact O-CB 3.45Å; A1336-Y1339 PolarHBondContact O-N 2.74Å; A1336-G1340 PolarHBondContact O-N 3.3Å
1337	E	89.5	Confident	93.3	Very high	134 Å²	134	60.5 Å²	60.5	63%	0.626	31%	0.307	S	S	*	.	H	α-helix	trans	-54.6	-40.9	177.8	-174.9	-177.7	-177.3	0	0	112.1	Y1339 G1340 C1341	E1337-Y1339 VanDerWaalsContact C-N 3.27Å; E1337-Y1339 PolarHBondContact O-N 2.99Å; E1337-G1340 CarbonylContact O-C 3.59Å; E1337-G1340 PolarHBondContact O-N 3.13Å; E1337-G1340 VanDerWaalsContact O-N 3.12Å; E1337-C1341 PolarHBondContact O-N 3.27Å; E1337-C1341 PolarHBondContact O-SG 3.08Å; E1337-C1341 VanDerWaalsContact O-SG 3.39Å
1338	V	92	Very high	93.2	Very high	37 Å²	37	62.2 Å²	62.2	22%	0.224	31%	0.314	C	S	.	.	H	α-helix	trans	-61.4	-35.8	177.4	-179.7	0	0	0	0	111.7	W1275 P1276 F1277 C1328 A1336 C1341 G1342	W1275-V1338 HydrophobicContact CH2-CG2 4.2Å; W1275-V1338 HydrophobicContact CZ2-CG2 4.5Å; P1276-V1338 HydrophobicContact CB-CG1 3.7Å; P1276-V1338 HydrophobicContact CB-CG2 4.35Å; P1276-V1338 HydrophobicContact CG-CG1 4.07Å; P1276-V1338 HydrophobicContact CG-CG2 4.3Å; F1277-V1338 HydrophobicContact CE1-CG1 4.34Å; F1277-V1338 HydrophobicContact CZ-CG1 4.38Å; C1328-V1338 PolarHBondContact SG-O 2.75Å; A1336-V1338 PolarHBondContact O-N 3.41Å; V1338-C1341 PolarHBondContact O-N 3.27Å; V1338-G1342 PolarHBondContact O-N 2.77Å
1339	Y	96.4	Very high	93.2	Very high	47 Å²	47	62 Å²	62	18%	0.184	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-48.9	173.7	-168.9	-72.6	0	0	0	110.3	Y1329 N1332 E1333 A1336 E1337 C1341 G1342 E1343	Y1329-Y1339 HydrophobicContact CD1-CD1 4.01Å; Y1329-Y1339 AromaticContact CD1-CD2 3.72Å; Y1329-Y1339 HydrophobicContact CD1-CD2 3.72Å; Y1329-Y1339 AromaticContact CD1-CE1 3.78Å; Y1329-Y1339 HydrophobicContact CD1-CE1 3.78Å; Y1329-Y1339 AromaticContact CD1-CE2 3.51Å; Y1329-Y1339 HydrophobicContact CD1-CE2 3.51Å; Y1329-Y1339 AromaticContact CD1-CG 3.96Å; Y1329-Y1339 HydrophobicContact CD1-CG 3.96Å; Y1329-Y1339 AromaticContact CD1-CZ 3.51Å; Y1329-Y1339 HydrophobicContact CE1-CD1 4.19Å; Y1329-Y1339 HydrophobicContact CE1-CE1 4.04Å; Y1329-Y1339 HydrophobicContact CE1-CG 4.46Å; Y1329-Y1339 HydrophobicContact CG-CD2 4.46Å; Y1329-Y1339 AromaticContact CG-CE2 3.91Å; Y1329-Y1339 HydrophobicContact CG-CE2 3.91Å; Y1329-Y1339 AromaticContact CG-CZ 3.96Å; N1332-Y1339 HydrophobicContact CB-CD2 4.5Å; N1332-Y1339 WeakPolarHBondContact O-CD2 3.41Å; E1333-Y1339 VanDerWaalsContact O-CB 3.26Å; E1333-Y1339 WeakPolarHBondContact O-CB 3.48Å; A1336-Y1339 WeakPolarHBondContact O-CA 3.35Å; A1336-Y1339 VanDerWaalsContact O-CB 3.22Å; A1336-Y1339 WeakPolarHBondContact O-CB 3.45Å; A1336-Y1339 PolarHBondContact O-N 2.74Å; E1337-Y1339 VanDerWaalsContact C-N 3.27Å; E1337-Y1339 PolarHBondContact O-N 2.99Å; Y1339-C1341 VanDerWaalsContact C-N 3.35Å; Y1339-C1341 PolarHBondContact O-N 3.32Å; Y1339-G1342 WeakPolarHBondContact O-CA 3.34Å; Y1339-G1342 PolarHBondContact O-N 3.41Å; Y1339-E1343 HydrophobicContact CD1-CG 4.16Å; Y1339-E1343 HydrophobicContact CE1-CG 3.98Å; Y1339-E1343 PolarHBondContact O-N 3.3Å; Y1339-E1343 VanDerWaalsContact O-N 3.1Å
1340	G	91	Very high	93	Very high	12 Å²	12	62.5 Å²	62.5	12%	0.124	32%	0.323	C	S	.	.	H	α-helix	trans	-63.5	-35.8	176.9	0	0	0	0	0	113.6	A1336 E1337 G1342 E1343 R1344	A1336-G1340 PolarHBondContact O-N 3.3Å; E1337-G1340 CarbonylContact O-C 3.59Å; E1337-G1340 PolarHBondContact O-N 3.13Å; E1337-G1340 VanDerWaalsContact O-N 3.12Å; G1340-G1342 VanDerWaalsContact C-N 3.28Å; G1340-G1342 PolarHBondContact O-N 3.04Å; G1340-E1343 PolarHBondContact O-N 3.31Å; G1340-R1344 WeakPolarHBondContact O-CG 3.21Å; G1340-R1344 PolarHBondContact O-N 2.93Å; G1340-R1344 VanDerWaalsContact O-N 3.09Å; G1340-R1344 PolarHBondContact O-NH1 2.78Å
1341	C	94.2	Very high	92.8	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-39.9	170.5	-71.5	0	0	0	0	111.3	D1273 P1276 F1277 E1337 V1338 Y1339 R1344 L1345	D1273-C1341 HydrophobicContact CB-CB 4.01Å; D1273-C1341 PolarHBondContact OD1-SG 2.95Å; D1273-C1341 VanDerWaalsContact OD1-SG 3.39Å; P1276-C1341 HydrophobicContact CG-CB 4.04Å; F1277-C1341 HydrophobicContact CE2-CB 4Å; F1277-C1341 HydrophobicContact CZ-CB 4.32Å; E1337-C1341 PolarHBondContact O-N 3.27Å; E1337-C1341 PolarHBondContact O-SG 3.08Å; E1337-C1341 VanDerWaalsContact O-SG 3.39Å; V1338-C1341 PolarHBondContact O-N 3.27Å; Y1339-C1341 VanDerWaalsContact C-N 3.35Å; Y1339-C1341 PolarHBondContact O-N 3.32Å; C1341-R1344 PolarHBondContact SG-NH2 2.92Å; C1341-L1345 VanDerWaalsContact O-CB 3.31Å; C1341-L1345 WeakPolarHBondContact O-CB 3.34Å; C1341-L1345 PolarHBondContact O-N 3.15Å
1342	G	95.8	Very high	92.6	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-57.8	-48.2	174	0	0	0	0	0	112.2	Y1329 V1338 Y1339 G1340 Q1346	Y1329-G1342 PolarHBondContact OH-O 2.93Å; V1338-G1342 PolarHBondContact O-N 2.77Å; Y1339-G1342 WeakPolarHBondContact O-CA 3.34Å; Y1339-G1342 PolarHBondContact O-N 3.41Å; G1340-G1342 VanDerWaalsContact C-N 3.28Å; G1340-G1342 PolarHBondContact O-N 3.04Å; G1342-Q1346 VanDerWaalsContact O-CB 3.25Å; G1342-Q1346 WeakPolarHBondContact O-CB 3.48Å; G1342-Q1346 PolarHBondContact O-N 3.18Å
1343	E	95.7	Very high	92.5	Very high	105 Å²	105	60.4 Å²	60.4	49%	0.491	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-47.8	180	-68	-172	130	0	0	112.3	Y1329 Y1339 G1340 Q1346 Q1347	Y1329-E1343 HydrophobicContact CE1-CG 3.96Å; Y1329-E1343 VanDerWaalsContact OH-CA 3.29Å; Y1329-E1343 WeakPolarHBondContact OH-CA 3.38Å; Y1329-E1343 PolarHBondContact OH-N 2.79Å; Y1339-E1343 HydrophobicContact CD1-CG 4.16Å; Y1339-E1343 HydrophobicContact CE1-CG 3.98Å; Y1339-E1343 PolarHBondContact O-N 3.3Å; Y1339-E1343 VanDerWaalsContact O-N 3.1Å; G1340-E1343 PolarHBondContact O-N 3.31Å; E1343-Q1346 PolarHBondContact O-N 3.36Å; E1343-Q1347 PolarHBondContact O-N 3.41Å
1344	R	96.7	Very high	92.3	Very high	109 Å²	109	58.5 Å²	58.5	41%	0.411	31%	0.31	S	S	.	.	H	α-helix	trans	-65.4	-42.2	-179	-68.7	-172.5	-63.5	-85.4	3.9	111.9	D1273 G1340 C1341 Q1347 F1348	D1273-R1344 HydrophobicContact CB-CB 4.33Å; D1273-R1344 IonicContact OD1-CZ 2.67Å; D1273-R1344 VanDerWaalsContact OD1-CZ 3.3Å; D1273-R1344 IonicContact OD1-NE 2.93Å; D1273-R1344 PolarHBondContact OD1-NE 3.47Å; D1273-R1344 VanDerWaalsContact OD1-NE 3.07Å; D1273-R1344 IonicContact OD1-NH2 3.1Å; D1273-R1344 PolarHBondContact OD1-NH2 2.92Å; D1273-R1344 WeakPolarHBondContact OD2-CB 3.22Å; D1273-R1344 WeakPolarHBondContact OD2-CD 3.22Å; D1273-R1344 IonicContact OD2-CZ 2.82Å; D1273-R1344 IonicContact OD2-NE 2.74Å; D1273-R1344 PolarHBondContact OD2-NE 3.02Å; D1273-R1344 IonicContact OD2-NH2 3.97Å; G1340-R1344 WeakPolarHBondContact O-CG 3.21Å; G1340-R1344 PolarHBondContact O-N 2.93Å; G1340-R1344 VanDerWaalsContact O-N 3.09Å; G1340-R1344 PolarHBondContact O-NH1 2.78Å; C1341-R1344 PolarHBondContact SG-NH2 2.92Å; R1344-Q1347 PolarHBondContact O-N 3.27Å; R1344-F1348 PolarHBondContact O-N 3.12Å
1345	L	96.6	Very high	92	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-69.3	-36.8	177.2	-172.5	66.6	0	0	0	112.2	L1268 H1271 F1277 L1299 F1325 C1341 F1348 F1349	L1268-L1345 HydrophobicContact CD2-CD1 3.99Å; L1268-L1345 HydrophobicContact CD2-CG 4.4Å; H1271-L1345 HydrophobicContact CB-CD1 3.56Å; F1277-L1345 HydrophobicContact CD2-CD2 3.58Å; F1277-L1345 HydrophobicContact CE2-CD2 4.2Å; F1277-L1345 HydrophobicContact CG-CD2 4.41Å; L1299-L1345 HydrophobicContact CD1-CD2 4.4Å; F1325-L1345 HydrophobicContact CE1-CB 3.93Å; F1325-L1345 HydrophobicContact CE1-CD2 3.94Å; F1325-L1345 HydrophobicContact CE1-CG 3.92Å; F1325-L1345 HydrophobicContact CZ-CB 4.43Å; F1325-L1345 HydrophobicContact CZ-CD2 4.35Å; F1325-L1345 HydrophobicContact CZ-CG 4.1Å; C1341-L1345 VanDerWaalsContact O-CB 3.31Å; C1341-L1345 WeakPolarHBondContact O-CB 3.34Å; C1341-L1345 PolarHBondContact O-N 3.15Å; L1345-F1348 HydrophobicContact CD1-CD1 4.4Å; L1345-F1348 PolarHBondContact O-N 3.49Å; L1345-F1349 WeakPolarHBondContact O-CB 3.43Å; L1345-F1349 PolarHBondContact O-N 3.01Å
1346	Q	97.2	Very high	92.4	Very high	46 Å²	46	53.3 Å²	53.3	22%	0.215	28%	0.277	C	S	.	.	H	α-helix	trans	-65.6	-39.3	175.2	-171.6	175.4	27.5	0	0	111.7	E1322 F1325 Y1329 G1342 E1343 F1349 C1350	E1322-Q1346 PolarHBondContact OE2-NE2 2.79Å; F1325-Q1346 HydrophobicContact CD1-CB 3.95Å; F1325-Q1346 HydrophobicContact CD2-CB 3.76Å; F1325-Q1346 HydrophobicContact CD2-CG 3.58Å; F1325-Q1346 HydrophobicContact CE1-CB 3.99Å; F1325-Q1346 HydrophobicContact CE2-CB 3.79Å; F1325-Q1346 HydrophobicContact CE2-CG 3.81Å; F1325-Q1346 HydrophobicContact CG-CB 3.85Å; F1325-Q1346 HydrophobicContact CG-CG 4.03Å; F1325-Q1346 HydrophobicContact CZ-CB 3.92Å; F1325-Q1346 HydrophobicContact CZ-CG 4.45Å; Y1329-Q1346 PolarHBondContact OH-OE1 2.92Å; G1342-Q1346 VanDerWaalsContact O-CB 3.25Å; G1342-Q1346 WeakPolarHBondContact O-CB 3.48Å; G1342-Q1346 PolarHBondContact O-N 3.18Å; E1343-Q1346 PolarHBondContact O-N 3.36Å; Q1346-F1349 WeakPolarHBondContact O-CB 3.25Å; Q1346-F1349 PolarHBondContact O-N 3.33Å; Q1346-C1350 PolarHBondContact O-N 3.46Å; Q1346-C1350 PolarHBondContact O-SG 3.15Å
1347	Q	93.9	Very high	92.4	Very high	123 Å²	123	59.3 Å²	59.3	58%	0.575	30%	0.299	S	S	*	.	H	α-helix	trans	-61.6	-49.9	173.1	-177.4	-179.6	-10.2	0	0	111	E1343 R1344 F1349 C1350 E1351	E1343-Q1347 PolarHBondContact O-N 3.41Å; R1344-Q1347 PolarHBondContact O-N 3.27Å; Q1347-F1349 VanDerWaalsContact C-N 3.3Å; Q1347-F1349 PolarHBondContact O-N 3.31Å; Q1347-C1350 WeakPolarHBondContact O-CB 3.26Å; Q1347-C1350 PolarHBondContact O-N 2.74Å; Q1347-C1350 VanDerWaalsContact O-N 3.13Å; Q1347-E1351 PolarHBondContact NE2-OE1 3.09Å; Q1347-E1351 PolarHBondContact O-N 3.22Å; Q1347-E1351 VanDerWaalsContact O-N 3.11Å
1348	F	95.8	Very high	92.2	Very high	40 Å²	40	53.8 Å²	53.8	18%	0.175	27%	0.274	C	S	.	.	H	α-helix	trans	-58.5	-42.2	177.2	178.5	-104.7	0	0	0	111.9	L1267 L1268 H1271 R1344 L1345 C1350 E1351 Q1352	L1267-F1348 HydrophobicContact CB-CE1 4.01Å; L1267-F1348 HydrophobicContact CB-CZ 4.12Å; L1267-F1348 WeakPolarHBondContact O-CE1 3.32Å; L1268-F1348 HydrophobicContact CD2-CD1 4.08Å; L1268-F1348 HydrophobicContact CD2-CE1 4.46Å; H1271-F1348 HydrophobicContact CB-CD1 4.25Å; H1271-F1348 HydrophobicContact CB-CE1 4.28Å; H1271-F1348 AromaticContact CD2-CD1 3.45Å; H1271-F1348 VanDerWaalsContact CD2-CD1 3.45Å; H1271-F1348 WeakPolarHBondContact CD2-CD1 3.34Å; H1271-F1348 AromaticContact CD2-CD2 3.67Å; H1271-F1348 AromaticContact CD2-CE1 3.87Å; H1271-F1348 AromaticContact CD2-CG 3.33Å; H1271-F1348 WeakPolarHBondContact CD2-CG 3.37Å; H1271-F1348 AromaticContact NE2-CG 3.74Å; R1344-F1348 PolarHBondContact O-N 3.12Å; L1345-F1348 HydrophobicContact CD1-CD1 4.4Å; L1345-F1348 PolarHBondContact O-N 3.49Å; F1348-C1350 PolarHBondContact O-N 3.4Å; F1348-E1351 PolarHBondContact O-N 2.75Å; F1348-Q1352 HydrophobicContact CD1-CG 4.16Å; F1348-Q1352 HydrophobicContact CD2-CG 4.46Å; F1348-Q1352 HydrophobicContact CE1-CG 3.74Å; F1348-Q1352 HydrophobicContact CE2-CG 4.08Å; F1348-Q1352 VanDerWaalsContact CE2-NE2 3.28Å; F1348-Q1352 HydrophobicContact CZ-CG 3.7Å; F1348-Q1352 WeakPolarHBondContact O-CG 3.47Å; F1348-Q1352 PolarHBondContact O-N 3.33Å
1349	F	96.2	Very high	91.9	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-55.3	-48	173.8	171.1	-116.7	0	0	0	112.1	L1264 L1268 V1318 I1321 F1325 L1345 Q1346 Q1347 E1351 Q1352 L1353	L1264-F1349 HydrophobicContact CD1-CD2 4.11Å; L1264-F1349 HydrophobicContact CD1-CE2 4.41Å; L1264-F1349 HydrophobicContact CD2-CD2 4.47Å; L1264-F1349 HydrophobicContact CD2-CE2 3.96Å; L1268-F1349 HydrophobicContact CD1-CD2 3.89Å; L1268-F1349 HydrophobicContact CD1-CE2 4.41Å; L1268-F1349 HydrophobicContact CD2-CB 3.86Å; L1268-F1349 HydrophobicContact CD2-CD2 4.16Å; L1268-F1349 HydrophobicContact CD2-CG 4.47Å; V1318-F1349 HydrophobicContact CG1-CE1 4.39Å; V1318-F1349 HydrophobicContact CG1-CZ 4.17Å; V1318-F1349 HydrophobicContact CG2-CZ 4.25Å; I1321-F1349 HydrophobicContact CB-CE2 4.3Å; I1321-F1349 HydrophobicContact CB-CZ 4.1Å; I1321-F1349 HydrophobicContact CD1-CE2 3.69Å; I1321-F1349 HydrophobicContact CD1-CZ 4.15Å; I1321-F1349 HydrophobicContact CG2-CD1 4.16Å; I1321-F1349 HydrophobicContact CG2-CD2 3.97Å; I1321-F1349 HydrophobicContact CG2-CE1 3.96Å; I1321-F1349 HydrophobicContact CG2-CE2 3.75Å; I1321-F1349 HydrophobicContact CG2-CG 4.16Å; I1321-F1349 HydrophobicContact CG2-CZ 3.74Å; F1325-F1349 HydrophobicContact CE2-CB 4.41Å; F1325-F1349 HydrophobicContact CE2-CD1 4.09Å; F1325-F1349 HydrophobicContact CE2-CG 4.4Å; F1325-F1349 HydrophobicContact CZ-CB 4.39Å; L1345-F1349 WeakPolarHBondContact O-CB 3.43Å; L1345-F1349 PolarHBondContact O-N 3.01Å; Q1346-F1349 WeakPolarHBondContact O-CB 3.25Å; Q1346-F1349 PolarHBondContact O-N 3.33Å; Q1347-F1349 VanDerWaalsContact C-N 3.3Å; Q1347-F1349 PolarHBondContact O-N 3.31Å; F1349-E1351 VanDerWaalsContact C-N 3.33Å; F1349-E1351 PolarHBondContact O-N 3.47Å; F1349-Q1352 PolarHBondContact O-N 3.14Å; F1349-L1353 HydrophobicContact CD1-CD1 4.32Å; F1349-L1353 HydrophobicContact CD2-CG 4.41Å; F1349-L1353 HydrophobicContact CE1-CD1 3.82Å; F1349-L1353 HydrophobicContact CE1-CG 4.45Å; F1349-L1353 HydrophobicContact CE2-CD1 4.3Å; F1349-L1353 HydrophobicContact CE2-CD2 4.01Å; F1349-L1353 HydrophobicContact CE2-CG 4.11Å; F1349-L1353 HydrophobicContact CZ-CD1 3.82Å; F1349-L1353 HydrophobicContact CZ-CD2 4.13Å; F1349-L1353 HydrophobicContact CZ-CG 4.13Å; F1349-L1353 WeakPolarHBondContact O-CG 3.47Å; F1349-L1353 PolarHBondContact O-N 3.33Å
1350	C	92.4	Very high	91.4	Very high	59 Å²	59	56.3 Å²	56.3	40%	0.399	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-38.3	178.3	-67.4	0	0	0	0	112.9	Q1346 Q1347 F1348 T1354	Q1346-C1350 PolarHBondContact O-N 3.46Å; Q1346-C1350 PolarHBondContact O-SG 3.15Å; Q1347-C1350 WeakPolarHBondContact O-CB 3.26Å; Q1347-C1350 PolarHBondContact O-N 2.74Å; Q1347-C1350 VanDerWaalsContact O-N 3.13Å; F1348-C1350 PolarHBondContact O-N 3.4Å; C1350-T1354 PolarHBondContact O-N 2.85Å; C1350-T1354 PolarHBondContact O-OG1 2.84Å
1351	E	90	Very high	91.1	Very high	100 Å²	100	60.4 Å²	60.4	47%	0.467	32%	0.319	S	S	.	.	H	α-helix	trans	-66.1	-42.8	175.8	-68.7	174.1	-171.6	0	0	111.5	Q1347 F1348 F1349 L1353 T1354 S1355	Q1347-E1351 PolarHBondContact NE2-OE1 3.09Å; Q1347-E1351 PolarHBondContact O-N 3.22Å; Q1347-E1351 VanDerWaalsContact O-N 3.11Å; F1348-E1351 PolarHBondContact O-N 2.75Å; F1349-E1351 VanDerWaalsContact C-N 3.33Å; F1349-E1351 PolarHBondContact O-N 3.47Å; E1351-L1353 PolarHBondContact O-N 2.83Å; E1351-T1354 PolarHBondContact O-N 3.42Å; E1351-S1355 PolarHBondContact O-N 3.18Å
1352	Q	92.7	Very high	90.7	Very high	30 Å²	30	62 Å²	62	14%	0.14	33%	0.327	C	S	.	.	H	α-helix	trans	-67.5	-34.8	177.9	-63.6	-41.8	-53.3	0	0	112.8	L1264 L1267 F1348 F1349 T1354 S1355 L1356	L1264-Q1352 HydrophobicContact CD1-CB 3.57Å; L1264-Q1352 HydrophobicContact CD1-CG 4.5Å; L1267-Q1352 HydrophobicContact CB-CG 4.49Å; L1267-Q1352 HydrophobicContact CD1-CG 4.17Å; F1348-Q1352 HydrophobicContact CD1-CG 4.16Å; F1348-Q1352 HydrophobicContact CD2-CG 4.46Å; F1348-Q1352 HydrophobicContact CE1-CG 3.74Å; F1348-Q1352 HydrophobicContact CE2-CG 4.08Å; F1348-Q1352 VanDerWaalsContact CE2-NE2 3.28Å; F1348-Q1352 HydrophobicContact CZ-CG 3.7Å; F1348-Q1352 WeakPolarHBondContact O-CG 3.47Å; F1348-Q1352 PolarHBondContact O-N 3.33Å; F1349-Q1352 PolarHBondContact O-N 3.14Å; Q1352-T1354 VanDerWaalsContact C-N 3.26Å; Q1352-T1354 PolarHBondContact O-N 3.31Å; Q1352-S1355 PolarHBondContact O-N 2.98Å; Q1352-L1356 HydrophobicContact CB-CD1 4.44Å; Q1352-L1356 VanDerWaalsContact O-CB 3.26Å; Q1352-L1356 WeakPolarHBondContact O-CB 3.36Å; Q1352-L1356 VanDerWaalsContact O-CG 3.28Å; Q1352-L1356 WeakPolarHBondContact O-CG 3.47Å; Q1352-L1356 PolarHBondContact O-N 2.99Å
1353	L	89.2	Confident	90.2	Very high	36 Å²	36	67.4 Å²	67.4	19%	0.188	36%	0.356	C	S	.	.	H	α-helix	trans	-55.9	-43.5	172.6	-73.2	-178.9	0	0	0	111.8	L1264 F1314 F1349 E1351 H1357 L1358	L1264-L1353 HydrophobicContact CD2-CD2 4.04Å; F1314-L1353 HydrophobicContact CE1-CD2 3.47Å; F1314-L1353 VanDerWaalsContact CE1-CD2 3.47Å; F1314-L1353 HydrophobicContact CZ-CD2 3.39Å; F1349-L1353 HydrophobicContact CD1-CD1 4.32Å; F1349-L1353 HydrophobicContact CD2-CG 4.41Å; F1349-L1353 HydrophobicContact CE1-CD1 3.82Å; F1349-L1353 HydrophobicContact CE1-CG 4.45Å; F1349-L1353 HydrophobicContact CE2-CD1 4.3Å; F1349-L1353 HydrophobicContact CE2-CD2 4.01Å; F1349-L1353 HydrophobicContact CE2-CG 4.11Å; F1349-L1353 HydrophobicContact CZ-CD1 3.82Å; F1349-L1353 HydrophobicContact CZ-CD2 4.13Å; F1349-L1353 HydrophobicContact CZ-CG 4.13Å; F1349-L1353 WeakPolarHBondContact O-CG 3.47Å; F1349-L1353 PolarHBondContact O-N 3.33Å; E1351-L1353 PolarHBondContact O-N 2.83Å; L1353-H1357 PolarHBondContact O-N 2.84Å; L1353-L1358 HydrophobicContact CD2-CB 4.43Å; L1353-L1358 PolarHBondContact O-N 3.42Å
1354	T	84.6	Confident	89.5	Confident	111 Å²	111	62.9 Å²	62.9	68%	0.681	34%	0.335	S	S	*	.	H	α-helix	trans	-70	-47	179.7	-53.4	0	0	0	0	111.1	C1350 E1351 Q1352 L1356 H1357	C1350-T1354 PolarHBondContact O-N 2.85Å; C1350-T1354 PolarHBondContact O-OG1 2.84Å; E1351-T1354 PolarHBondContact O-N 3.42Å; Q1352-T1354 VanDerWaalsContact C-N 3.26Å; Q1352-T1354 PolarHBondContact O-N 3.31Å; T1354-L1356 PolarHBondContact O-N 3.21Å; T1354-H1357 PolarHBondContact O-N 3.07Å
1355	S	84.3	Confident	87.9	Confident	76 Å²	76	66.2 Å²	66.2	53%	0.531	35%	0.353	S	S	.	.	H	α-helix	trans	-61.3	-42.5	179.6	-178	0	0	0	0	112.6	E1351 Q1352 H1357	E1351-S1355 PolarHBondContact O-N 3.18Å; Q1352-S1355 PolarHBondContact O-N 2.98Å; S1355-H1357 VanDerWaalsContact C-N 3.28Å; S1355-H1357 PolarHBondContact O-CE1 3.36Å; S1355-H1357 PolarHBondContact O-N 2.77Å; S1355-H1357 PolarHBondContact O-ND1 2.89Å
1356	L	88.8	Confident	85.8	Confident	20 Å²	20	70.5 Å²	70.5	11%	0.105	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-0.6	-178.2	-62.3	174.2	0	0	0	113.3	R1260 L1263 L1264 L1267 Q1352 T1354 L1358	R1260-L1356 WeakPolarHBondContact CD-O 3.39Å; R1260-L1356 PolarHBondContact NH1-O 3.46Å; L1263-L1356 HydrophobicContact CD2-CD2 3.53Å; L1263-L1356 HydrophobicContact CG-CD2 4.07Å; L1264-L1356 HydrophobicContact CB-CD1 3.74Å; L1264-L1356 HydrophobicContact CD1-CD1 4.14Å; L1267-L1356 HydrophobicContact CD1-CD1 4.39Å; Q1352-L1356 HydrophobicContact CB-CD1 4.44Å; Q1352-L1356 VanDerWaalsContact O-CB 3.26Å; Q1352-L1356 WeakPolarHBondContact O-CB 3.36Å; Q1352-L1356 VanDerWaalsContact O-CG 3.28Å; Q1352-L1356 WeakPolarHBondContact O-CG 3.47Å; Q1352-L1356 PolarHBondContact O-N 2.99Å; T1354-L1356 PolarHBondContact O-N 3.21Å; L1356-L1358 HydrophobicContact CB-CD1 3.95Å; L1356-L1358 HydrophobicContact CB-CG 4.18Å; L1356-L1358 HydrophobicContact CD1-CD1 4.28Å; L1356-L1358 PolarHBondContact O-N 3.05Å
1357	H	87.1	Confident	83.1	Confident	159 Å²	159	73.5 Å²	73.5	74%	0.736	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	32.7	179.8	-58.4	75.7	0	0	0	113.9	R1260 L1353 T1354 S1355	R1260-H1357 PolarHBondContact NH1-O 3.38Å; L1353-H1357 PolarHBondContact O-N 2.84Å; T1354-H1357 PolarHBondContact O-N 3.07Å; S1355-H1357 VanDerWaalsContact C-N 3.28Å; S1355-H1357 PolarHBondContact O-CE1 3.36Å; S1355-H1357 PolarHBondContact O-N 2.77Å; S1355-H1357 PolarHBondContact O-ND1 2.89Å
1358	L	86.4	Confident	80.5	Confident	18 Å²	18	77.1 Å²	77.1	9%	0.094	42%	0.42	C	S	.	.			trans	-85	128.4	-178.2	-76.4	163.4	0	0	0	110.3	V1257 R1260 L1264 F1314 L1353 L1356	V1257-L1358 HydrophobicContact CG1-CD2 3.97Å; R1260-L1358 HydrophobicContact CB-CD1 4.2Å; R1260-L1358 HydrophobicContact CB-CD2 3.87Å; R1260-L1358 HydrophobicContact CB-CG 4.12Å; L1264-L1358 HydrophobicContact CB-CD1 4.37Å; L1264-L1358 HydrophobicContact CD2-CD1 3.98Å; F1314-L1358 HydrophobicContact CD1-CB 3.97Å; F1314-L1358 HydrophobicContact CD2-CD2 4.47Å; F1314-L1358 HydrophobicContact CE1-CB 3.56Å; F1314-L1358 HydrophobicContact CE1-CD1 4.32Å; F1314-L1358 HydrophobicContact CE1-CG 4.4Å; F1314-L1358 HydrophobicContact CE2-CD1 3.98Å; F1314-L1358 HydrophobicContact CG-CD2 4.48Å; F1314-L1358 HydrophobicContact CZ-CB 3.91Å; F1314-L1358 HydrophobicContact CZ-CD1 3.78Å; F1314-L1358 HydrophobicContact CZ-CG 4.32Å; L1353-L1358 HydrophobicContact CD2-CB 4.43Å; L1353-L1358 PolarHBondContact O-N 3.42Å; L1356-L1358 HydrophobicContact CB-CD1 3.95Å; L1356-L1358 HydrophobicContact CB-CG 4.18Å; L1356-L1358 HydrophobicContact CD1-CD1 4.28Å; L1356-L1358 PolarHBondContact O-N 3.05Å
1359	S	84.6	Confident	77.7	Confident	49 Å²	49	86.3 Å²	86.3	34%	0.343	45%	0.454	S	S	.	.			trans	-107.1	145.4	176.3	177.1	0	0	0	0	111	F1314 T1361 D1362	F1314-S1359 WeakPolarHBondContact CD1-O 3.42Å; S1359-T1361 PolarHBondContact O-N 3.05Å; S1359-T1361 PolarHBondContact OG-N 3.35Å; S1359-T1361 PolarHBondContact OG-OG1 3.46Å; S1359-D1362 PolarHBondContact N-OD2 2.89Å; S1359-D1362 VanDerWaalsContact O-CB 3.28Å; S1359-D1362 WeakPolarHBondContact O-CB 3.29Å; S1359-D1362 PolarHBondContact O-N 3.48Å
1360	T	85.4	Confident	74.7	Confident	88 Å²	88	97.6 Å²	97.6	54%	0.54	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.5	175.2	55	0	0	0	0	112.9	G1315	G1315-T1360 WeakPolarHBondContact CA-O 3.3Å; G1315-T1360 PolarHBondContact N-O 2.92Å; G1315-T1360 VanDerWaalsContact N-O 3.11Å
1361	T	84.5	Confident	71.9	Confident	99 Å²	99	106.5 Å²	106.5	61%	0.607	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-9.7	176.4	58.1	0	0	0	0	114.5	S1359 L1363	S1359-T1361 PolarHBondContact O-N 3.05Å; S1359-T1361 PolarHBondContact OG-N 3.35Å; S1359-T1361 PolarHBondContact OG-OG1 3.46Å; T1361-L1363 PolarHBondContact O-N 3.22Å
1362	D	87	Confident	69.3	Low	32 Å²	32	107.6 Å²	107.6	17%	0.171	54%	0.536	C	S	.	.			trans	-66.6	129.7	-175.2	-70.6	-13.9	0	0	0	111.2	V1257 R1260 R1313 F1314 S1359	V1257-D1362 HydrophobicContact CB-CB 4.38Å; V1257-D1362 HydrophobicContact CG1-CB 3.54Å; V1257-D1362 HydrophobicContact CG2-CB 3.87Å; R1260-D1362 IonicContact NH2-OD2 3.29Å; R1260-D1362 PolarHBondContact NH2-OD2 2.81Å; R1313-D1362 CarbonylContact C-O 3.49Å; R1313-D1362 WeakPolarHBondContact CA-O 3.24Å; F1314-D1362 HydrophobicContact CB-CB 4.13Å; F1314-D1362 PolarHBondContact N-O 3.28Å; S1359-D1362 PolarHBondContact N-OD2 2.89Å; S1359-D1362 VanDerWaalsContact O-CB 3.28Å; S1359-D1362 WeakPolarHBondContact O-CB 3.29Å; S1359-D1362 PolarHBondContact O-N 3.48Å
1363	L	84.6	Confident	66.5	Low	114 Å²	114	112.5 Å²	112.5	60%	0.597	57%	0.567	S	S	*	*	B	Isolated β-bridge	trans	-82	126.4	180	-75.2	164.5	0	0	0	111	R1313 T1361	R1313-L1363 HydrophobicContact CG-CD2 3.99Å; T1361-L1363 PolarHBondContact O-N 3.22Å
1364	L	80.6	Confident	64	Low	11 Å²	11	119.2 Å²	119.2	6%	0.058	60%	0.603	C	S	.	*			trans	-89.9	105.4	172.3	-66.1	176.4	0	0	0	108.1	V1257 F1306 Y1311 E1312 P1366	V1257-L1364 HydrophobicContact CG1-CD2 3.67Å; F1306-L1364 HydrophobicContact CD2-CD1 4.15Å; F1306-L1364 HydrophobicContact CE2-CD1 4.02Å; F1306-L1364 HydrophobicContact CE2-CD2 3.85Å; Y1311-L1364 WeakPolarHBondContact O-CB 3.27Å; E1312-L1364 PolarHBondContact O-N 2.94Å; L1364-P1366 WeakPolarHBondContact O-CD 3.33Å
1365	K	63.9	Low	61.6	Low	179 Å²	179	125.9 Å²	125.9	78%	0.778	62%	0.615	S	S	*	*			trans	-67.9	122.6	179.7	-74.2	-179	-178.4	171.1	0	109.1	S1367	K1365-S1367 PolarHBondContact O-N 2.82Å
1366	P	51.6	Low	58.9	Low	91 Å²	91	131.3 Å²	131.3	59%	0.591	65%	0.654	S	S	*	*			trans	-62.2	131.4	174	23	-30.9	0	0	0	109.2	L1364 K1368	L1364-P1366 WeakPolarHBondContact O-CD 3.33Å; P1366-K1368 PolarHBondContact O-N 3.27Å
1367	S	41.2	Very low	57.4	Low	109 Å²	109	136.9 Å²	136.9	76%	0.762	68%	0.681	S	S	*	*			trans	-61.7	95.6	175.7	-170.1	0	0	0	0	109.2	K1365 R1369	K1365-S1367 PolarHBondContact O-N 2.82Å; S1367-R1369 PolarHBondContact O-N 3.12Å
1368	K	39.1	Very low	55.9	Low	198 Å²	198	135.7 Å²	135.7	86%	0.861	68%	0.678	S	S	*	*			trans	-67.6	81.5	174.6	-74.8	-175.3	179.6	177.7	0	109.5	P1366 R1370	P1366-K1368 PolarHBondContact O-N 3.27Å; K1368-R1370 PolarHBondContact O-N 2.98Å
1369	R	38.4	Very low	54.2	Low	233 Å²	233	142.3 Å²	142.3	88%	0.879	71%	0.711	S	S	*	*			trans	-67.9	111.2	153.5	-86.7	-172.4	173.1	-172.1	0.7	107.6	S1367 R1371	S1367-R1369 PolarHBondContact O-N 3.12Å; R1369-R1371 PolarHBondContact O-N 3.24Å
1370	R	32.8	Very low	52.4	Low	237 Å²	237	147.8 Å²	147.8	89%	0.894	73%	0.732	S	S	*	*			trans	-42.7	109.6	174.8	-82.9	177.7	168.2	-175.1	-3.1	111	K1368 T1372	K1368-R1370 PolarHBondContact O-N 2.98Å; R1370-T1372 PolarHBondContact O-N 3.22Å
1371	R	33	Very low	50.3	Low	246 Å²	246	151.5 Å²	151.5	93%	0.928	74%	0.744	S	S	*	*			trans	-85.3	89.7	162.7	-149	174.7	-174.8	170.7	1.1	107.3	R1369 T1373	R1369-R1371 PolarHBondContact O-N 3.24Å; R1371-T1373 PolarHBondContact O-N 3.09Å
1372	T	36.2	Very low	48.1	Very low	124 Å²	124	155 Å²	155	76%	0.761	75%	0.753	S	S	*	*			trans	-70.5	118.7	164.3	25.9	0	0	0	0	108.5	R1370	R1370-T1372 PolarHBondContact O-N 3.22Å
1373	T	33.8	Very low	45.3	Very low	132 Å²	132	163.8 Å²	163.8	81%	0.81	80%	0.795	S	S	*	*			trans	-50.9	127.2	171.2	44.9	0	0	0	0	112.8	R1371	R1371-T1373 PolarHBondContact O-N 3.09Å
1374	L	36.3	Very low	42.3	Very low	178 Å²	178	167.6 Å²	167.6	93%	0.932	81%	0.81	S	S	*	*			trans	-145.5	128	152.7	-102.6	151	0	0	0	108.2
1375	R	34.1	Very low	39.1	Very low	250 Å²	250	180.7 Å²	180.7	94%	0.943	87%	0.873	S	S	*	*			trans	-67.5	124.8	-173.7	-71.1	169.4	165.7	179.7	-5.7	112.2
1376	S	28.4	Very low	36.8	Very low	191 Å²	191	180.8 Å²	180.8	100%	1.336	88%	0.882	S	S	*	*			trans	-178.7	0	131.7	57.1	0	0	0	0	108.4

Retrieved 1,376 of 1,376 residues in 3330.3 ms (Link to these results)

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