A0A077YZE6_TRITR Loading...

Anion exchange protein

AlphaFold DB , UniProt , Accession A0A077YZE6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 869 aa.

						>A0A077YZE6_TRITR|A0A077YZE6
MLLLGLLAEKPVDQVRFLLDSVAPEVSNAIEEPRDADWAPIFCELLELHEQTDNKGFIWREKARWVKYEETVGISGERWSKPHISLLAYQSIMTLRKLLADGLLLTDCEPRDFAELVGKDQFSDRSCKTEYVSVKPRLGNLVDGFIRRQYIEYAMADQLEHLLLSPKHYMKESLERLKKVLSFTIKDKKKSSDKSIASTPSSETPLSDLKISVAQSFKRKLQERTVVAVILVGCTDLVKAMGSAFVRLRADQAIPALSQINLPIRYVFLLLAPKDCTVDLASVGRCLASILIDSASSKCLTDSITGKQLSNVVDDFITRSRIIPPNKIPEDMYLEVSKIDSQDAVADDLQKATPEETSHFNLEGLLYTGRLFGGLFDDVKRILPRYLSDITDAFTSFSSSSQITAATLFLFLTNLANIIIFGAVMSHSLDNQMGIMECIISGCVSGVLFGLLSGQPLNILSATGPVLIFESIFYRVCESHGIDFLAARGWLCMWTAVIIILLVAFDTSFLVAFITRFTEELFATLIAVIFVVEAIQGMANIYKEHPIVTDPQMLFDEPPCHCVTNSSNSSSMFLWDNFTAKDCELDGGTVHGLRCHFYPDIFLFSLLLFLLAYLIMYSLKKFRTSAFFPDKVRETLANFAPLFSIVIATVVSELVGLKVPKLILPSTFRPSIDRPWIVNWLNIKAWWIYVVTFFPALLLTILLVMDQQITAVIVNRPENLLKKGFGYHLDLLVVSILTIICGVFGLPIFVAATMLSISHIESLKVVSECKAPGEKPAFIGIREQRVSALAAHLLIGLSLLLTPVLQMIPLPALLGVFLHMGLSCLFEQQLLVMVVIRKLLDRVFSRLDLQALDDLLPLWNQLKGCKAKR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	36.1	Very low	206 Å²	206	143.4 Å²	143.4	100%	1.015	78%	0.78	S	S	*	*				0	-67	0	-71.4	-72.1	-122.9	0	0	110.7	L3 L4	M1-L3 PolarHBondContact O-N 3.21Å; M1-L4 PolarHBondContact O-N 2.86Å
2	L	38.5	Very low	36.1	Very low	163 Å²	163	141.5 Å²	141.5	85%	0.853	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-33.2	179.8	-100.9	135.3	0	0	0	115.6
3	L	37.6	Very low	36.1	Very low	149 Å²	149	141.3 Å²	141.3	78%	0.78	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-20.5	175.6	-102.4	113.3	0	0	0	114.3	M1 G5	M1-L3 PolarHBondContact O-N 3.21Å; L3-G5 VanDerWaalsContact C-N 3.3Å
4	L	37.7	Very low	35.7	Very low	141 Å²	141	144.7 Å²	144.7	74%	0.738	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-12.5	177.5	-85.7	155.4	0	0	0	112.3	M1	M1-L4 PolarHBondContact O-N 2.86Å
5	G	40.6	Very low	35.3	Very low	61 Å²	61	144.9 Å²	144.9	63%	0.629	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-13	175.5	0	0	0	0	0	114.8	L3	L3-G5 VanDerWaalsContact C-N 3.3Å
6	L	38.8	Very low	34.9	Very low	154 Å²	154	149.7 Å²	149.7	81%	0.806	79%	0.792	S	S	*	*	S	Bend	trans	-100.3	-9.2	-175.5	-81.4	162.1	0	0	0	114.3
7	L	37.8	Very low	34.6	Very low	158 Å²	158	152.8 Å²	152.8	83%	0.827	80%	0.798	S	S	*	*	S	Bend	trans	-118.6	7.2	-179.3	-74.1	169.8	0	0	0	114	E9	L7-E9 PolarHBondContact O-N 3.47Å
8	A	37	Very low	34.2	Very low	73 Å²	73	153.3 Å²	153.3	60%	0.603	80%	0.801	S	S	*	*	S	Bend	trans	-95.9	91	173.8	0	0	0	0	0	110.5
9	E	32.8	Very low	34.1	Very low	172 Å²	172	153.7 Å²	153.7	80%	0.804	80%	0.803	S	S	*	*			trans	60.5	99.1	143.1	-69.9	177.7	157.1	0	0	119.7	L7	L7-E9 PolarHBondContact O-N 3.47Å
10	K	27.9	Very low	34	Very low	197 Å²	197	154.1 Å²	154.1	86%	0.857	81%	0.805	S	S	*	*				-66.3	132.8	117.4	-74.9	-179.3	175.1	179.4	0	107
11	P	31.7	Very low	33.9	Very low	103 Å²	103	151.5 Å²	151.5	67%	0.669	80%	0.801	S	S	*	*				-132.4	126.4	92.6	33.5	-21.5	0	0	0	112.9	D13	P11-D13 PolarHBondContact O-N 3.19Å
12	V	36	Very low	33.4	Very low	121 Å²	121	148.4 Å²	148.4	73%	0.733	79%	0.793	S	S	*	*			trans	-52	110.1	143.9	174.1	0	0	0	0	106.1
13	D	35.3	Very low	33.1	Very low	139 Å²	139	145 Å²	145	74%	0.743	79%	0.788	S	S	*	*			trans	179.9	6	151.7	-90.9	-15.5	0	0	0	116.7	P11	P11-D13 PolarHBondContact O-N 3.19Å
14	Q	30.3	Very low	32.8	Very low	189 Å²	189	143.6 Å²	143.6	88%	0.883	79%	0.788	S	S	*	*	S	Bend	trans	-107.9	7.9	179.7	-82.6	-168.8	-10.5	0	0	118.1
15	V	30.1	Very low	32.1	Very low	148 Å²	148	146.4 Å²	146.4	90%	0.897	80%	0.797	S	S	*	*	S	Bend	trans	-104.4	8.3	174.5	-169.8	0	0	0	0	112.9
16	R	29.8	Very low	31.6	Very low	221 Å²	221	149.8 Å²	149.8	83%	0.834	81%	0.805	S	S	*	*	S	Bend	trans	-96.5	9.3	178.2	-123	176.9	-174.7	175.1	-0	115.6
17	F	28.7	Very low	31.1	Very low	202 Å²	202	147.5 Å²	147.5	89%	0.886	80%	0.802	S	S	*	*	S	Bend	trans	-105.9	13	-175	-126.6	-85.2	0	0	0	116.1
18	L	28.7	Very low	30.5	Very low	163 Å²	163	147.9 Å²	147.9	85%	0.853	81%	0.805	S	S	*	*	S	Bend	trans	-122.3	9.7	178.3	-83.8	168.4	0	0	0	115.3
19	L	31	Very low	30.2	Very low	161 Å²	161	148.5 Å²	148.5	84%	0.843	81%	0.811	S	S	*	*	S	Bend	trans	-116.9	0.2	178.6	-80	167.5	0	0	0	116.2
20	D	33.1	Very low	30	Very low	160 Å²	160	148.4 Å²	148.4	86%	0.856	81%	0.814	S	S	*	*			trans	-109.9	20.1	-177.6	-81.6	-12.3	0	0	0	115.7
21	S	30.6	Very low	29.9	Very low	101 Å²	101	146.6 Å²	146.6	71%	0.706	81%	0.808	S	S	*	*	S	Bend	trans	-100.9	96.1	170.5	68.5	0	0	0	0	112.5
22	V	28.4	Very low	29.6	Very low	141 Å²	141	149.8 Å²	149.8	86%	0.855	81%	0.814	S	S	*	*	S	Bend	trans	89	94.6	148.1	-166.8	0	0	0	0	118
23	A	32.1	Very low	29.3	Very low	91 Å²	91	148.9 Å²	148.9	75%	0.752	81%	0.811	S	S	*	*				-176.5	150.6	115.2	0	0	0	0	0	110.6
24	P	30.9	Very low	29.2	Very low	119 Å²	119	152.6 Å²	152.6	77%	0.773	82%	0.815	S	S	*	*			trans	-87.7	153.2	-143.9	34	-34.7	0	0	0	115.3	V26	P24-V26 PolarHBondContact O-N 3.09Å; P24-V26 VanDerWaalsContact O-N 3.15Å
25	E	22.9	Very low	29.4	Very low	200 Å²	200	150.7 Å²	150.7	94%	0.935	81%	0.811	S	S	*	*			trans	-40.6	105.6	170.7	-62.7	171.6	159.4	0	0	112.9
26	V	30.5	Very low	29.9	Very low	132 Å²	132	147.4 Å²	147.4	80%	0.8	80%	0.799	S	S	*	*			trans	-102.6	112.8	157	179.9	0	0	0	0	106.8	P24 N28	P24-V26 PolarHBondContact O-N 3.09Å; P24-V26 VanDerWaalsContact O-N 3.15Å; V26-N28 PolarHBondContact O-N 3.27Å
27	S	28.2	Very low	30.6	Very low	106 Å²	106	142.4 Å²	142.4	74%	0.741	79%	0.789	S	S	*	*			trans	-35.1	125.3	179.7	51.7	0	0	0	0	115.5	A29	S27-A29 PolarHBondContact O-N 3.41Å; S27-A29 VanDerWaalsContact O-N 3.17Å
28	N	24.6	Very low	32.1	Very low	166 Å²	166	142.7 Å²	142.7	89%	0.888	78%	0.784	S	S	*	*			trans	-22.1	101.3	160.1	-61.3	-26.4	0	0	0	115.4	V26	V26-N28 PolarHBondContact O-N 3.27Å
29	A	29.6	Very low	34	Very low	87 Å²	87	136 Å²	136	72%	0.719	75%	0.752	S	S	*	*			trans	-118.8	116.4	143.1	0	0	0	0	0	106	S27 E31	S27-A29 PolarHBondContact O-N 3.41Å; S27-A29 VanDerWaalsContact O-N 3.17Å; A29-E31 PolarHBondContact O-N 3.2Å
30	I	28.8	Very low	36.3	Very low	170 Å²	170	129.5 Å²	129.5	87%	0.872	72%	0.72	S	S	*	*			trans	-66.9	86.2	177.2	-60.9	163.2	0	0	0	106.5
31	E	25.5	Very low	38.8	Very low	158 Å²	158	122.6 Å²	122.6	74%	0.738	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-85.7	116.9	160.6	-78.5	-171.3	173.6	0	0	106.7	A29	A29-E31 PolarHBondContact O-N 3.2Å
32	E	26.7	Very low	41.6	Very low	170 Å²	170	117.8 Å²	117.8	79%	0.794	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-47.4	138.2	172.9	-67.9	177.1	157	0	0	110.2	R34	E32-R34 PolarHBondContact O-N 3.2Å; E32-R34 VanDerWaalsContact O-N 3.16Å
33	P	29.9	Very low	44.6	Very low	103 Å²	103	111.1 Å²	111.1	67%	0.669	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-57	126.5	177.5	24.9	-32.1	0	0	0	108.1	D35	P33-D35 PolarHBondContact O-N 3.24Å
34	R	33.2	Very low	47.4	Very low	217 Å²	217	106.8 Å²	106.8	82%	0.819	57%	0.573	S	S	*	*			trans	-65.2	80.5	173.8	-66.3	-178	-164.5	170.5	6.7	108.9	E32 A36	E32-R34 PolarHBondContact O-N 3.2Å; E32-R34 VanDerWaalsContact O-N 3.16Å; R34-A36 HydrophobicContact CB-CB 4.42Å; R34-A36 PolarHBondContact O-N 2.93Å
35	D	34.2	Very low	50.4	Low	148 Å²	148	101.1 Å²	101.1	79%	0.791	54%	0.536	S	S	*	.			trans	-71.3	48.7	158.1	-73.5	-27.7	0	0	0	109	P33 D37	P33-D35 PolarHBondContact O-N 3.24Å; D35-D37 PolarHBondContact O-N 3.4Å
36	A	40.7	Very low	53.7	Low	80 Å²	80	91.6 Å²	91.6	66%	0.661	49%	0.491	S	S	*	.			trans	-72.1	96.1	174.8	0	0	0	0	0	107.4	R34 W38	R34-A36 HydrophobicContact CB-CB 4.42Å; R34-A36 PolarHBondContact O-N 2.93Å; A36-W38 PolarHBondContact O-N 3.17Å; A36-W38 VanDerWaalsContact O-N 3.12Å
37	D	43.5	Very low	56.6	Low	116 Å²	116	87.5 Å²	87.5	62%	0.62	46%	0.464	S	S	*	.			trans	-24.6	113.9	159.6	-72.9	-34.3	0	0	0	110.9	D35 A39 R224	D35-D37 PolarHBondContact O-N 3.4Å; D37-A39 PolarHBondContact O-N 3.1Å; D37-R224 IonicContact OD2-NH1 3.58Å; D37-R224 PolarHBondContact OD2-NH1 3.47Å
38	W	60.7	Low	59.5	Low	208 Å²	208	83.2 Å²	83.2	79%	0.788	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-60.8	127	-175.5	44.6	-90	0	0	0	110.5	A36	A36-W38 PolarHBondContact O-N 3.17Å; A36-W38 VanDerWaalsContact O-N 3.12Å
39	A	69.4	Low	62.4	Low	21 Å²	21	78.5 Å²	78.5	17%	0.174	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-84.3	127.2	174.5	0	0	0	0	0	110	D37 R224 V226	D37-A39 PolarHBondContact O-N 3.1Å; A39-R224 WeakPolarHBondContact CB-O 3.16Å; A39-V226 HydrophobicContact CB-CB 4.32Å; A39-V226 HydrophobicContact CB-CG1 3.64Å; A39-V226 HydrophobicContact CB-CG2 3.89Å
40	P	79.1	Confident	64.9	Low	26 Å²	26	79.3 Å²	79.3	17%	0.169	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-61.5	141.5	172.9	22.2	-29.4	0	0	0	110.7	Q222 T225 V226	P40-Q222 HydrophobicContact CB-CB 4.36Å; P40-Q222 VanDerWaalsContact CB-OE1 3.24Å; P40-Q222 HydrophobicContact CG-CB 3.53Å; P40-Q222 HydrophobicContact CG-CG 4.41Å; P40-T225 CarbonylContact O-C 3.6Å; P40-T225 WeakPolarHBondContact O-CA 3.45Å; P40-T225 WeakPolarHBondContact O-CG2 3.39Å; P40-V226 PolarHBondContact O-N 2.73Å
41	I	86	Confident	67	Low	15 Å²	15	74.2 Å²	74.2	8%	0.077	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.6	-174.8	-51.5	-166.7	0	0	0	111	V226 A228 Y266 S297	I41-V226 CarbonylContact C-O 3.6Å; I41-V226 WeakPolarHBondContact CA-O 3.31Å; I41-V226 HydrophobicContact CB-CG2 4.42Å; I41-V226 HydrophobicContact CG1-CG2 3.81Å; I41-A228 HydrophobicContact CG2-CB 3.77Å; I41-Y266 HydrophobicContact CD1-CD2 4.11Å; I41-Y266 HydrophobicContact CD1-CE2 3.65Å; I41-S297 WeakPolarHBondContact CD1-OG 3.46Å
42	F	88.7	Confident	69	Low	0 Å²	0	73 Å²	73	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.5	167.5	174.5	-118.9	0	0	0	109.7	E44 R64 W65 V66 F217 L221 T225 V226 V227 A228 I260	F42-E44 HydrophobicContact CD1-CG 4.09Å; F42-E44 HydrophobicContact CE1-CG 3.39Å; F42-E44 VanDerWaalsContact CE1-OE1 3.25Å; F42-E44 WeakPolarHBondContact CE1-OE1 3.1Å; F42-E44 HydrophobicContact CZ-CG 3.78Å; F42-R64 HydrophobicContact CE2-CB 4Å; F42-R64 HydrophobicContact CE2-CG 4.33Å; F42-R64 HydrophobicContact CZ-CB 4.1Å; F42-W65 CarbonylContact C-O 3.58Å; F42-W65 WeakPolarHBondContact CA-O 3.37Å; F42-W65 WeakPolarHBondContact CD2-O 3.35Å; F42-V66 HydrophobicContact CD2-CG2 3.74Å; F42-V66 HydrophobicContact CE2-CG2 3.91Å; F42-F217 HydrophobicContact CE1-CE1 4.42Å; F42-F217 AromaticContact CE2-CE1 3.94Å; F42-F217 HydrophobicContact CE2-CE1 3.94Å; F42-F217 AromaticContact CE2-CZ 3.82Å; F42-F217 HydrophobicContact CE2-CZ 3.82Å; F42-F217 AromaticContact CZ-CE1 3.86Å; F42-F217 HydrophobicContact CZ-CE1 3.86Å; F42-F217 HydrophobicContact CZ-CZ 4.07Å; F42-L221 HydrophobicContact CB-CD2 4.38Å; F42-L221 HydrophobicContact CD2-CD2 4.16Å; F42-L221 HydrophobicContact CG-CD2 4.34Å; F42-T225 HydrophobicContact CB-CG2 3.62Å; F42-V226 PolarHBondContact N-O 3.01Å; F42-V227 HydrophobicContact CB-CG2 4.5Å; F42-V227 HydrophobicContact CD1-CG1 4.19Å; F42-V227 HydrophobicContact CD1-CG2 4.06Å; F42-V227 CarbonylContact O-C 3.56Å; F42-V227 VanDerWaalsContact O-CA 3.29Å; F42-V227 WeakPolarHBondContact O-CA 3.38Å; F42-A228 PolarHBondContact O-N 3.14Å; F42-I260 HydrophobicContact CD1-CD1 4.48Å; F42-I260 HydrophobicContact CE1-CD1 3.83Å; F42-I260 HydrophobicContact CZ-CD1 4.29Å
43	C	91.4	Very high	70.7	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	133.1	179.1	-57.6	0	0	0	0	111.4	R64 W65 A228 I230 A288	C43-R64 CarbonylContact O-C 3.54Å; C43-R64 VanDerWaalsContact O-CA 3.24Å; C43-R64 WeakPolarHBondContact O-CA 3.2Å; C43-W65 HydrophobicContact CB-CB 4.13Å; C43-W65 HydrophobicContact CB-CE3 4.04Å; C43-W65 PolarHBondContact N-O 3.29Å; C43-W65 PolarHBondContact O-N 3.14Å; C43-A228 CarbonylContact C-O 3.21Å; C43-A228 VanDerWaalsContact CA-O 3.3Å; C43-A228 WeakPolarHBondContact CA-O 3.17Å; C43-I230 HydrophobicContact CB-CD1 4.46Å; C43-A288 HydrophobicContact CB-CB 4.03Å
44	E	91.5	Very high	72.1	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.8	171	-65.1	-178.8	-179.5	0	0	109.3	F42 L46 A228 I230 S258 Q259	F42-E44 HydrophobicContact CD1-CG 4.09Å; F42-E44 HydrophobicContact CE1-CG 3.39Å; F42-E44 VanDerWaalsContact CE1-OE1 3.25Å; F42-E44 WeakPolarHBondContact CE1-OE1 3.1Å; F42-E44 HydrophobicContact CZ-CG 3.78Å; E44-L46 HydrophobicContact CB-CD1 4.38Å; E44-A228 PolarHBondContact N-O 3.31Å; E44-I230 PolarHBondContact O-N 2.88Å; E44-S258 VanDerWaalsContact OE2-CA 3.24Å; E44-S258 WeakPolarHBondContact OE2-CA 3.31Å; E44-Q259 VanDerWaalsContact OE1-CB 3.27Å; E44-Q259 WeakPolarHBondContact OE1-CB 3.46Å; E44-Q259 PolarHBondContact OE1-N 3.4Å; E44-Q259 PolarHBondContact OE2-N 2.9Å
45	L	93	Very high	73.6	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.5	172	173.9	67.6	0	0	0	109.9	K62 A63 W65 I230 V232 R285	L45-K62 PolarHBondContact O-N 3.11Å; L45-A63 HydrophobicContact CB-CB 4.44Å; L45-A63 WeakPolarHBondContact CB-O 3.27Å; L45-A63 HydrophobicContact CD2-CB 4.32Å; L45-A63 PolarHBondContact N-O 2.72Å; L45-A63 PolarHBondContact O-N 2.85Å; L45-W65 HydrophobicContact CB-CH2 3.89Å; L45-W65 HydrophobicContact CB-CZ3 3.48Å; L45-W65 VanDerWaalsContact CB-CZ3 3.48Å; L45-W65 HydrophobicContact CD2-CH2 3.87Å; L45-W65 HydrophobicContact CD2-CZ3 4.35Å; L45-I230 WeakPolarHBondContact CA-O 3.41Å; L45-I230 HydrophobicContact CD1-CB 4.04Å; L45-I230 HydrophobicContact CD1-CG2 3.5Å; L45-V232 HydrophobicContact CD1-CB 4.18Å; L45-V232 HydrophobicContact CD1-CG2 3.58Å; L45-R285 HydrophobicContact CD2-CG 4.3Å
46	L	92.6	Very high	75.6	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.6	172	-56.9	99.6	0	0	0	110.9	E44 W59 R60 K167 Y169 V229 I230 L231 V232	E44-L46 HydrophobicContact CB-CD1 4.38Å; L46-W59 HydrophobicContact CB-CB 4.27Å; L46-W59 HydrophobicContact CB-CE3 4.07Å; L46-W59 HydrophobicContact CD2-CB 4.03Å; L46-R60 CarbonylContact C-O 3.53Å; L46-R60 VanDerWaalsContact CA-O 3.28Å; L46-R60 WeakPolarHBondContact CA-O 3.24Å; L46-K167 HydrophobicContact CD2-CB 4.07Å; L46-K167 HydrophobicContact CD2-CD 4.1Å; L46-K167 HydrophobicContact CD2-CG 4.35Å; L46-Y169 HydrophobicContact CD2-CD1 4.48Å; L46-Y169 HydrophobicContact CD2-CE1 3.78Å; L46-V229 HydrophobicContact CD1-CG1 3.67Å; L46-I230 PolarHBondContact N-O 3.05Å; L46-L231 HydrophobicContact CB-CD2 3.9Å; L46-L231 HydrophobicContact CD1-CD2 3.73Å; L46-L231 HydrophobicContact CG-CD2 4.31Å; L46-V232 PolarHBondContact O-N 3.38Å
47	E	90.7	Very high	77.6	Confident	47 Å²	47	63.4 Å²	63.4	22%	0.22	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	137.1	174.5	-175.2	168.9	-131.1	0	0	110.6	H49 R60 K62 V232	E47-H49 PolarHBondContact O-CD2 2.82Å; E47-H49 IonicContact OE2-CE1 2.79Å; E47-H49 IonicContact OE2-NE2 2.64Å; E47-R60 PolarHBondContact N-O 3.34Å; E47-R60 PolarHBondContact O-N 2.92Å; E47-K62 HydrophobicContact CB-CB 4.31Å; E47-K62 HydrophobicContact CB-CD 4.17Å; E47-K62 IonicContact OE1-NZ 2.61Å; E47-K62 PolarHBondContact OE1-NZ 3.21Å; E47-K62 VanDerWaalsContact OE2-CD 3.27Å; E47-K62 WeakPolarHBondContact OE2-CD 3.4Å; E47-K62 WeakPolarHBondContact OE2-CE 3.31Å; E47-K62 IonicContact OE2-NZ 3.18Å; E47-K62 PolarHBondContact OE2-NZ 3Å; E47-V232 CarbonylContact C-O 3.6Å; E47-V232 VanDerWaalsContact CA-O 3.24Å; E47-V232 WeakPolarHBondContact CA-O 3.33Å
48	L	90.3	Very high	79.6	Confident	15 Å²	15	58.6 Å²	58.6	8%	0.079	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	123.2	175.2	-167.8	76.2	0	0	0	110.7	F57 W59 L162 V232 T235	L48-F57 HydrophobicContact CD1-CB 3.82Å; L48-F57 HydrophobicContact CD1-CD1 4.34Å; L48-F57 HydrophobicContact CD1-CG 4.4Å; L48-F57 HydrophobicContact CD2-CD1 3.73Å; L48-F57 HydrophobicContact CD2-CE1 4.22Å; L48-F57 HydrophobicContact CD2-CG 4.35Å; L48-F57 HydrophobicContact CG-CB 4.34Å; L48-F57 HydrophobicContact CG-CD1 3.94Å; L48-F57 HydrophobicContact CG-CG 4.49Å; L48-W59 HydrophobicContact CB-CE3 4.03Å; L48-W59 HydrophobicContact CB-CH2 4.02Å; L48-W59 HydrophobicContact CB-CZ3 3.77Å; L48-W59 HydrophobicContact CD1-CD2 3.78Å; L48-W59 HydrophobicContact CD1-CE3 4.15Å; L48-W59 HydrophobicContact CD1-CG 4.27Å; L48-W59 HydrophobicContact CD1-CH2 4.1Å; L48-W59 HydrophobicContact CD1-CZ2 3.73Å; L48-W59 HydrophobicContact CD1-CZ3 4.3Å; L48-L162 HydrophobicContact CD1-CD2 3.98Å; L48-L162 HydrophobicContact CD1-CG 4.37Å; L48-L162 HydrophobicContact CD2-CD1 4.01Å; L48-L162 HydrophobicContact CD2-CD2 3.88Å; L48-L162 HydrophobicContact CD2-CG 4.19Å; L48-V232 PolarHBondContact N-O 3.21Å; L48-T235 HydrophobicContact CD2-CG2 3.3Å
49	H	85.5	Confident	80.9	Confident	67 Å²	67	48.7 Å²	48.7	31%	0.31	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.9	172.1	-71.5	-92.9	0	0	0	111.2	E47 F57 I58	E47-H49 PolarHBondContact O-CD2 2.82Å; E47-H49 IonicContact OE2-CE1 2.79Å; E47-H49 IonicContact OE2-NE2 2.64Å; H49-F57 WeakPolarHBondContact O-CA 3.38Å; H49-I58 PolarHBondContact N-O 2.86Å; H49-I58 PolarHBondContact O-N 3.03Å
50	E	81	Confident	81.8	Confident	105 Å²	105	53.6 Å²	53.6	49%	0.491	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124.8	169.6	-165.9	172.3	173.9	0	0	109.2	F57 K274	E50-F57 HydrophobicContact CB-CD1 4.31Å; E50-F57 HydrophobicContact CB-CE1 4.13Å; E50-F57 HydrophobicContact CG-CD1 4.47Å; E50-F57 HydrophobicContact CG-CE1 4.08Å; E50-K274 WeakPolarHBondContact OE2-CE 3.35Å; E50-K274 IonicContact OE2-NZ 3.48Å; E50-K274 PolarHBondContact OE2-NZ 3.29Å
51	Q	73.8	Confident	82.1	Confident	62 Å²	62	52.9 Å²	52.9	29%	0.29	26%	0.262	S	S	.	.			trans	-80.5	122.4	177.9	-171.2	178.9	3.3	0	0	109.8	D53 G56 I58	Q51-D53 PolarHBondContact O-N 3.01Å; Q51-G56 WeakPolarHBondContact CB-O 3.43Å; Q51-G56 PolarHBondContact N-O 2.96Å; Q51-I58 HydrophobicContact CB-CD1 4.35Å
52	T	67.3	Low	82.2	Confident	133 Å²	133	54.5 Å²	54.5	82%	0.816	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-33.2	-179.9	50.4	0	0	0	0	113.4
53	D	63	Low	82.3	Confident	128 Å²	128	54.5 Å²	54.5	68%	0.684	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-30.7	-166	-58	-9.1	0	0	0	113.6	Q51	Q51-D53 PolarHBondContact O-N 3.01Å
54	N	59.1	Low	82.2	Confident	126 Å²	126	55.3 Å²	55.3	67%	0.674	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.6	8.4	-167.9	-85.9	-3.7	0	0	0	115.4	G56	N54-G56 PolarHBondContact O-N 3.38Å
55	K	64.5	Low	82.1	Confident	195 Å²	195	55.3 Å²	55.3	85%	0.848	27%	0.272	S	S	*	.	S	Bend	trans	49.9	28	-173.3	-65.1	-175.2	175.3	-177.8	0	113.6
56	G	76.5	Confident	81.5	Confident	21 Å²	21	56.8 Å²	56.8	22%	0.216	28%	0.281	C	S	.	.			trans	-106.5	154.8	179.7	0	0	0	0	0	111.3	Q51 N54	Q51-G56 WeakPolarHBondContact CB-O 3.43Å; Q51-G56 PolarHBondContact N-O 2.96Å; N54-G56 PolarHBondContact O-N 3.38Å
57	F	82.8	Confident	80.7	Confident	47 Å²	47	61.8 Å²	61.8	21%	0.206	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	147.4	171	-65.5	-81.1	0	0	0	110.6	L48 H49 E50 L162 S165	L48-F57 HydrophobicContact CD1-CB 3.82Å; L48-F57 HydrophobicContact CD1-CD1 4.34Å; L48-F57 HydrophobicContact CD1-CG 4.4Å; L48-F57 HydrophobicContact CD2-CD1 3.73Å; L48-F57 HydrophobicContact CD2-CE1 4.22Å; L48-F57 HydrophobicContact CD2-CG 4.35Å; L48-F57 HydrophobicContact CG-CB 4.34Å; L48-F57 HydrophobicContact CG-CD1 3.94Å; L48-F57 HydrophobicContact CG-CG 4.49Å; H49-F57 WeakPolarHBondContact O-CA 3.38Å; E50-F57 HydrophobicContact CB-CD1 4.31Å; E50-F57 HydrophobicContact CB-CE1 4.13Å; E50-F57 HydrophobicContact CG-CD1 4.47Å; E50-F57 HydrophobicContact CG-CE1 4.08Å; F57-L162 HydrophobicContact CB-CG 4.4Å; F57-L162 HydrophobicContact CD1-CD1 4.45Å; F57-L162 HydrophobicContact CD2-CD1 3.92Å; F57-L162 HydrophobicContact CD2-CG 4.14Å; F57-L162 HydrophobicContact CE2-CD1 4.01Å; F57-L162 HydrophobicContact CG-CD1 4.15Å; F57-L162 HydrophobicContact CG-CG 4.21Å; F57-L162 HydrophobicContact CZ-CD1 4.32Å; F57-S165 VanDerWaalsContact O-CB 3.3Å; F57-S165 WeakPolarHBondContact O-CB 3.34Å
58	I	85.5	Confident	80.3	Confident	15 Å²	15	61.2 Å²	61.2	8%	0.077	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	129.9	176.9	-62.4	178.7	0	0	0	108.5	H49 Q51 R60 P166 H168	H49-I58 PolarHBondContact N-O 2.86Å; H49-I58 PolarHBondContact O-N 3.03Å; Q51-I58 HydrophobicContact CB-CD1 4.35Å; I58-R60 HydrophobicContact CG2-CG 4.2Å; I58-P166 HydrophobicContact CG1-CG 4.33Å; I58-H168 HydrophobicContact CG2-CB 3.96Å; I58-H168 WeakPolarHBondContact CG2-CD2 3.5Å
59	W	87.6	Confident	80	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	123.9	169.5	-67.5	100	0	0	0	109.5	L46 L48 L162 L163 S165 P166 K167 H168 L231 V232 L269 L271	L46-W59 HydrophobicContact CB-CB 4.27Å; L46-W59 HydrophobicContact CB-CE3 4.07Å; L46-W59 HydrophobicContact CD2-CB 4.03Å; L48-W59 HydrophobicContact CB-CE3 4.03Å; L48-W59 HydrophobicContact CB-CH2 4.02Å; L48-W59 HydrophobicContact CB-CZ3 3.77Å; L48-W59 HydrophobicContact CD1-CD2 3.78Å; L48-W59 HydrophobicContact CD1-CE3 4.15Å; L48-W59 HydrophobicContact CD1-CG 4.27Å; L48-W59 HydrophobicContact CD1-CH2 4.1Å; L48-W59 HydrophobicContact CD1-CZ2 3.73Å; L48-W59 HydrophobicContact CD1-CZ3 4.3Å; W59-L162 HydrophobicContact CZ2-CD2 4.03Å; W59-L162 PolarHBondContact NE1-O 3.4Å; W59-L163 HydrophobicContact CZ2-CD2 4.32Å; W59-S165 PolarHBondContact NE1-OG 3.15Å; W59-S165 VanDerWaalsContact NE1-OG 3.15Å; W59-P166 PolarHBondContact N-O 3.16Å; W59-P166 VanDerWaalsContact N-O 3.14Å; W59-K167 HydrophobicContact CB-CB 4.28Å; W59-K167 HydrophobicContact CB-CG 3.94Å; W59-K167 HydrophobicContact CG-CG 4.3Å; W59-K167 CarbonylContact O-C 3.6Å; W59-H168 PolarHBondContact O-N 3.36Å; W59-L231 HydrophobicContact CD2-CD2 4.18Å; W59-L231 HydrophobicContact CE3-CB 4.39Å; W59-L231 HydrophobicContact CE3-CD2 4.06Å; W59-L231 HydrophobicContact CH2-CB 3.78Å; W59-L231 HydrophobicContact CZ2-CB 4.32Å; W59-L231 HydrophobicContact CZ3-CB 3.81Å; W59-L231 HydrophobicContact CZ3-CD2 4.33Å; W59-V232 WeakPolarHBondContact CZ3-O 3.41Å; W59-L269 HydrophobicContact CH2-CD1 4.26Å; W59-L269 HydrophobicContact CZ2-CD1 4.5Å; W59-L271 HydrophobicContact CH2-CD2 4.28Å
60	R	87.1	Confident	80.1	Confident	123 Å²	123	58.2 Å²	58.2	46%	0.464	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135.7	174.4	-63.3	-173.9	178.7	174	-0.4	110.3	L46 E47 I58 K62 H168	L46-R60 CarbonylContact C-O 3.53Å; L46-R60 VanDerWaalsContact CA-O 3.28Å; L46-R60 WeakPolarHBondContact CA-O 3.24Å; E47-R60 PolarHBondContact N-O 3.34Å; E47-R60 PolarHBondContact O-N 2.92Å; I58-R60 HydrophobicContact CG2-CG 4.2Å; R60-K62 PolarHBondContact O-N 3.07Å; R60-H168 WeakPolarHBondContact CA-O 3.41Å; R60-H168 HydrophobicContact CG-CB 4.4Å
61	E	86.5	Confident	80.3	Confident	11 Å²	11	54.7 Å²	54.7	5%	0.051	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	124	171.8	-165	-177.8	-175.9	0	0	110	V72 W79 H168 Y169 M170	E61-V72 WeakPolarHBondContact O-CG2 3.41Å; E61-W79 VanDerWaalsContact CD-CH2 3.41Å; E61-W79 VanDerWaalsContact CD-CZ2 3.47Å; E61-W79 HydrophobicContact CG-CH2 3.82Å; E61-W79 HydrophobicContact CG-CZ2 4.32Å; E61-W79 WeakPolarHBondContact OE1-CH2 3.26Å; E61-W79 VanDerWaalsContact OE1-CZ2 3.29Å; E61-W79 WeakPolarHBondContact OE1-CZ2 3.47Å; E61-H168 PolarHBondContact N-O 3.04Å; E61-H168 VanDerWaalsContact N-O 3.17Å; E61-Y169 HydrophobicContact CB-CD1 4.21Å; E61-Y169 HydrophobicContact CG-CD1 4.41Å; E61-M170 PolarHBondContact OE2-N 3.25Å
62	K	88.4	Confident	80.7	Confident	50 Å²	50	53.5 Å²	53.5	22%	0.217	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-43.2	-178.1	-174.9	174.7	-165.6	153.3	0	111.9	L45 E47 R60 V72 A281	L45-K62 PolarHBondContact O-N 3.11Å; E47-K62 HydrophobicContact CB-CB 4.31Å; E47-K62 HydrophobicContact CB-CD 4.17Å; E47-K62 IonicContact OE1-NZ 2.61Å; E47-K62 PolarHBondContact OE1-NZ 3.21Å; E47-K62 VanDerWaalsContact OE2-CD 3.27Å; E47-K62 WeakPolarHBondContact OE2-CD 3.4Å; E47-K62 WeakPolarHBondContact OE2-CE 3.31Å; E47-K62 IonicContact OE2-NZ 3.18Å; E47-K62 PolarHBondContact OE2-NZ 3Å; R60-K62 PolarHBondContact O-N 3.07Å; K62-V72 PolarHBondContact O-N 3.27Å; K62-A281 HydrophobicContact CD-CB 3.75Å
63	A	90.3	Very high	81	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	157.7	-178.1	0	0	0	0	0	110.5	L45 W65 E69 E70 T71	L45-A63 HydrophobicContact CB-CB 4.44Å; L45-A63 WeakPolarHBondContact CB-O 3.27Å; L45-A63 HydrophobicContact CD2-CB 4.32Å; L45-A63 PolarHBondContact N-O 2.72Å; L45-A63 PolarHBondContact O-N 2.85Å; A63-W65 HydrophobicContact CB-CH2 3.42Å; A63-W65 VanDerWaalsContact CB-CH2 3.42Å; A63-W65 HydrophobicContact CB-CZ2 4.16Å; A63-W65 HydrophobicContact CB-CZ3 3.68Å; A63-E69 HydrophobicContact CB-CG 4.35Å; A63-E70 CarbonylContact C-O 3.6Å; A63-E70 VanDerWaalsContact CA-O 3.25Å; A63-E70 WeakPolarHBondContact CA-O 3.4Å; A63-T71 HydrophobicContact CB-CG2 4.12Å
64	R	90.3	Very high	81.3	Confident	16 Å²	16	51.5 Å²	51.5	6%	0.06	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	158.1	175.3	68.5	-178.1	-175.7	-166	-4.6	110.9	F42 C43 E70 W79	F42-R64 HydrophobicContact CE2-CB 4Å; F42-R64 HydrophobicContact CE2-CG 4.33Å; F42-R64 HydrophobicContact CZ-CB 4.1Å; C43-R64 CarbonylContact O-C 3.54Å; C43-R64 VanDerWaalsContact O-CA 3.24Å; C43-R64 WeakPolarHBondContact O-CA 3.2Å; R64-E70 HydrophobicContact CG-CB 4.08Å; R64-E70 IonicContact CZ-OE2 3.29Å; R64-E70 PolarHBondContact N-O 3.32Å; R64-E70 IonicContact NE-OE2 3.54Å; R64-E70 PolarHBondContact NE-OE2 3Å; R64-E70 IonicContact NH2-OE2 2.69Å; R64-E70 PolarHBondContact NH2-OE2 3.02Å; R64-E70 PolarHBondContact O-N 2.89Å; R64-W79 HydrophobicContact CB-CH2 4.26Å; R64-W79 HydrophobicContact CB-CZ3 4.46Å; R64-W79 HydrophobicContact CG-CE3 4.35Å; R64-W79 HydrophobicContact CG-CH2 3.85Å; R64-W79 HydrophobicContact CG-CZ2 4.44Å; R64-W79 HydrophobicContact CG-CZ3 3.81Å; R64-W79 VanDerWaalsContact CZ-CE2 3.5Å
65	W	89.1	Confident	81.4	Confident	1 Å²	1	49.9 Å²	49.9	0%	0.004	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	125.2	178.7	-61.9	-109.7	0	0	0	112.1	F42 C43 L45 A63 Y68 E69 S85 R285 A288 I292	F42-W65 CarbonylContact C-O 3.58Å; F42-W65 WeakPolarHBondContact CA-O 3.37Å; F42-W65 WeakPolarHBondContact CD2-O 3.35Å; C43-W65 HydrophobicContact CB-CB 4.13Å; C43-W65 HydrophobicContact CB-CE3 4.04Å; C43-W65 PolarHBondContact N-O 3.29Å; C43-W65 PolarHBondContact O-N 3.14Å; L45-W65 HydrophobicContact CB-CH2 3.89Å; L45-W65 HydrophobicContact CB-CZ3 3.48Å; L45-W65 VanDerWaalsContact CB-CZ3 3.48Å; L45-W65 HydrophobicContact CD2-CH2 3.87Å; L45-W65 HydrophobicContact CD2-CZ3 4.35Å; A63-W65 HydrophobicContact CB-CH2 3.42Å; A63-W65 VanDerWaalsContact CB-CH2 3.42Å; A63-W65 HydrophobicContact CB-CZ2 4.16Å; A63-W65 HydrophobicContact CB-CZ3 3.68Å; W65-Y68 WeakPolarHBondContact CA-O 3.22Å; W65-E69 HydrophobicContact CD2-CG 4.45Å; W65-E69 HydrophobicContact CH2-CG 4.48Å; W65-E69 HydrophobicContact CZ2-CB 4.43Å; W65-E69 VanDerWaalsContact CZ2-CD 3.48Å; W65-E69 HydrophobicContact CZ2-CG 3.69Å; W65-S85 PolarHBondContact NE1-OG 2.95Å; W65-R285 HydrophobicContact CH2-CB 4.33Å; W65-R285 HydrophobicContact CH2-CG 3.86Å; W65-R285 HydrophobicContact CZ2-CB 3.88Å; W65-R285 HydrophobicContact CZ2-CG 3.67Å; W65-A288 HydrophobicContact CD2-CB 3.47Å; W65-A288 VanDerWaalsContact CD2-CB 3.47Å; W65-A288 HydrophobicContact CE3-CB 3.52Å; W65-A288 HydrophobicContact CG-CB 4.11Å; W65-A288 HydrophobicContact CH2-CB 3.97Å; W65-A288 HydrophobicContact CZ2-CB 3.88Å; W65-A288 HydrophobicContact CZ3-CB 3.8Å; W65-I292 HydrophobicContact CB-CD1 3.19Å; W65-I292 HydrophobicContact CB-CG1 3.97Å; W65-I292 HydrophobicContact CG-CD1 3.39Å
66	V	79.7	Confident	81.4	Confident	31 Å²	31	42.4 Å²	42.4	19%	0.188	23%	0.234	C	C	.	.	S	Bend	trans	-100.1	-42.8	165.2	-177.7	0	0	0	0	110	F42 F217 L221 A771	F42-V66 HydrophobicContact CD2-CG2 3.74Å; F42-V66 HydrophobicContact CE2-CG2 3.91Å; V66-F217 HydrophobicContact CG2-CZ 3.94Å; V66-L221 HydrophobicContact CB-CD2 4.4Å; V66-L221 HydrophobicContact CG1-CD2 3.79Å; V66-L221 HydrophobicContact CG2-CD2 3.77Å; V66-A771 HydrophobicContact CG1-CB 4.1Å
67	K	75.6	Confident	80.9	Confident	105 Å²	105	46.3 Å²	46.3	46%	0.457	25%	0.246	S	C	.	.	S	Bend	trans	-151	-43.9	172.2	-175.3	174.4	178.1	175.8	0	109	E774	K67-E774 WeakPolarHBondContact CD-OE1 3.32Å; K67-E774 WeakPolarHBondContact CE-OE1 3.35Å; K67-E774 IonicContact NZ-OE1 2.82Å; K67-E774 PolarHBondContact NZ-OE1 3.01Å
68	Y	82.3	Confident	80.4	Confident	34 Å²	34	53.6 Å²	53.6	13%	0.133	27%	0.273	C	S	.	.	S	Bend	trans	-104.9	161.3	170.2	-59.6	-69.6	0	0	0	111.1	W65 H83 I84 V336 E774	W65-Y68 WeakPolarHBondContact CA-O 3.22Å; Y68-H83 WeakPolarHBondContact CB-O 3.44Å; Y68-I84 HydrophobicContact CD1-CG1 4.05Å; Y68-I84 HydrophobicContact CE1-CG1 4.03Å; Y68-V336 HydrophobicContact CD1-CG2 4.31Å; Y68-V336 HydrophobicContact CD2-CG2 4.14Å; Y68-V336 HydrophobicContact CE1-CG2 4.23Å; Y68-V336 HydrophobicContact CE2-CG1 3.92Å; Y68-V336 HydrophobicContact CE2-CG2 4.06Å; Y68-V336 HydrophobicContact CG-CG2 4.27Å; Y68-E774 HydrophobicContact CE2-CG 4.06Å
69	E	85.2	Confident	80	Confident	4 Å²	4	54 Å²	54	2%	0.019	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	133.3	176.6	-172.1	172.2	171.4	0	0	110.8	A63 W65 T71 P82 H83 S85 R285	A63-E69 HydrophobicContact CB-CG 4.35Å; W65-E69 HydrophobicContact CD2-CG 4.45Å; W65-E69 HydrophobicContact CH2-CG 4.48Å; W65-E69 HydrophobicContact CZ2-CB 4.43Å; W65-E69 VanDerWaalsContact CZ2-CD 3.48Å; W65-E69 HydrophobicContact CZ2-CG 3.69Å; E69-T71 HydrophobicContact CG-CG2 3.98Å; E69-T71 VanDerWaalsContact OE1-CG2 3.23Å; E69-T71 WeakPolarHBondContact OE1-CG2 3.49Å; E69-P82 WeakPolarHBondContact O-CA 3.37Å; E69-H83 PolarHBondContact N-O 3.45Å; E69-H83 PolarHBondContact O-CE1 3.5Å; E69-H83 VanDerWaalsContact O-CE1 3.31Å; E69-H83 PolarHBondContact O-N 3.39Å; E69-H83 PolarHBondContact O-ND1 3.28Å; E69-S85 WeakPolarHBondContact CB-OG 3.44Å; E69-S85 WeakPolarHBondContact OE2-CA 3.4Å; E69-S85 VanDerWaalsContact OE2-CB 3.28Å; E69-S85 WeakPolarHBondContact OE2-CB 3.31Å; E69-S85 PolarHBondContact OE2-OG 3.5Å; E69-R285 VanDerWaalsContact OE1-CD 3.25Å; E69-R285 WeakPolarHBondContact OE1-CD 3.29Å; E69-R285 IonicContact OE1-CZ 3.33Å; E69-R285 IonicContact OE1-NE 3.62Å; E69-R285 PolarHBondContact OE1-NE 3.29Å
70	E	86.1	Confident	79.4	Confident	15 Å²	15	55.6 Å²	55.6	7%	0.07	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.7	162.1	-67.2	-178.7	153.7	0	0	107.8	A63 R64 W79 P82 P772	A63-E70 CarbonylContact C-O 3.6Å; A63-E70 VanDerWaalsContact CA-O 3.25Å; A63-E70 WeakPolarHBondContact CA-O 3.4Å; R64-E70 HydrophobicContact CG-CB 4.08Å; R64-E70 IonicContact CZ-OE2 3.29Å; R64-E70 PolarHBondContact N-O 3.32Å; R64-E70 IonicContact NE-OE2 3.54Å; R64-E70 PolarHBondContact NE-OE2 3Å; R64-E70 IonicContact NH2-OE2 2.69Å; R64-E70 PolarHBondContact NH2-OE2 3.02Å; R64-E70 PolarHBondContact O-N 2.89Å; E70-W79 HydrophobicContact CB-CE3 3.88Å; E70-W79 HydrophobicContact CB-CZ3 4.45Å; E70-W79 WeakPolarHBondContact O-CZ3 3.44Å; E70-P82 HydrophobicContact CG-CB 4.18Å; E70-P772 WeakPolarHBondContact OE1-CB 3.48Å; E70-P772 WeakPolarHBondContact OE1-CG 3.02Å
71	T	85.1	Confident	78.8	Confident	31 Å²	31	56.5 Å²	56.5	19%	0.19	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	148.4	178	54.1	0	0	0	0	110.6	A63 E69 G73 W79 S80	A63-T71 HydrophobicContact CB-CG2 4.12Å; E69-T71 HydrophobicContact CG-CG2 3.98Å; E69-T71 VanDerWaalsContact OE1-CG2 3.23Å; E69-T71 WeakPolarHBondContact OE1-CG2 3.49Å; T71-G73 PolarHBondContact O-N 3.36Å; T71-W79 CarbonylContact O-C 3.52Å; T71-S80 PolarHBondContact N-OG 3.16Å; T71-S80 WeakPolarHBondContact O-CB 3.13Å; T71-S80 PolarHBondContact O-N 3.04Å; T71-S80 WeakPolarHBondContact OG1-CB 3.07Å; T71-S80 PolarHBondContact OG1-OG 3.39Å
72	V	83	Confident	78.5	Confident	37 Å²	37	57.1 Å²	57.1	22%	0.224	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-71.5	122.6	170.4	173.5	0	0	0	0	108.5	E61 K62 W79 M170	E61-V72 WeakPolarHBondContact O-CG2 3.41Å; K62-V72 PolarHBondContact O-N 3.27Å; V72-W79 HydrophobicContact CG2-CD2 4.47Å; V72-W79 HydrophobicContact CG2-CE3 3.94Å; V72-W79 HydrophobicContact CG2-CH2 3.54Å; V72-W79 HydrophobicContact CG2-CZ2 4.09Å; V72-W79 HydrophobicContact CG2-CZ3 3.44Å; V72-W79 VanDerWaalsContact CG2-CZ3 3.44Å; V72-M170 HydrophobicContact CB-CE 4.03Å; V72-M170 HydrophobicContact CG1-CE 3.51Å; V72-M170 HydrophobicContact CG2-CE 3.77Å
73	G	73.7	Confident	77.9	Confident	32 Å²	32	56.5 Å²	56.5	33%	0.33	29%	0.294	S	S	.	.			trans	-62.4	162.9	177.9	0	0	0	0	0	112.6	T71 S75 G76 R78	T71-G73 PolarHBondContact O-N 3.36Å; G73-S75 PolarHBondContact O-N 3.49Å; G73-G76 PolarHBondContact O-N 3.19Å; G73-R78 PolarHBondContact N-O 3.47Å
74	I	68.3	Low	77.3	Confident	188 Å²	188	59.9 Å²	59.9	96%	0.964	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-34.4	-175.4	-58.7	164.7	0	0	0	112.6	G76	I74-G76 VanDerWaalsContact C-N 3.25Å; I74-G76 PolarHBondContact O-N 3.11Å
75	S	61.4	Low	77	Confident	91 Å²	91	60 Å²	60	64%	0.636	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-10.8	178.4	-173.9	0	0	0	0	114.1	G73 E77	G73-S75 PolarHBondContact O-N 3.49Å; S75-E77 PolarHBondContact O-N 3.48Å
76	G	64.7	Low	76.7	Confident	39 Å²	39	65.2 Å²	65.2	40%	0.402	34%	0.342	S	S	.	.	S	Bend	trans	70.6	0.5	-174.2	0	0	0	0	0	115.2	G73 I74 M170	G73-G76 PolarHBondContact O-N 3.19Å; I74-G76 VanDerWaalsContact C-N 3.25Å; I74-G76 PolarHBondContact O-N 3.11Å; G76-M170 WeakPolarHBondContact O-CE 3.4Å
77	E	65.5	Low	77.1	Confident	103 Å²	103	66.4 Å²	66.4	48%	0.481	35%	0.347	S	S	.	.	S	Bend	trans	-103.3	-16.1	-170.3	-66.8	-169.9	161.7	0	0	114.6	S75 R176	S75-E77 PolarHBondContact O-N 3.48Å; E77-R176 IonicContact OE1-CZ 2.66Å; E77-R176 VanDerWaalsContact OE1-CZ 3.31Å; E77-R176 IonicContact OE1-NE 2.75Å; E77-R176 PolarHBondContact OE1-NE 2.82Å; E77-R176 IonicContact OE1-NH2 3.85Å; E77-R176 PolarHBondContact OE1-NH2 3.26Å; E77-R176 IonicContact OE2-CZ 3.39Å; E77-R176 IonicContact OE2-NH2 3.76Å; E77-R176 PolarHBondContact OE2-NH2 3Å
78	R	72.3	Confident	77.5	Confident	200 Å²	200	63.5 Å²	63.5	76%	0.755	34%	0.343	S	S	*	.			trans	-140.8	136.8	-173.9	-163	-173.5	176.6	-175.2	0.3	111.3	G73 M170	G73-R78 PolarHBondContact N-O 3.47Å; R78-M170 VanDerWaalsContact C-CE 3.45Å
79	W	78.6	Confident	77.7	Confident	22 Å²	22	68.6 Å²	68.6	8%	0.083	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-67.4	142.9	166.1	-69.4	104.6	0	0	0	111.4	E61 R64 E70 T71 V72 M170	E61-W79 VanDerWaalsContact CD-CH2 3.41Å; E61-W79 VanDerWaalsContact CD-CZ2 3.47Å; E61-W79 HydrophobicContact CG-CH2 3.82Å; E61-W79 HydrophobicContact CG-CZ2 4.32Å; E61-W79 WeakPolarHBondContact OE1-CH2 3.26Å; E61-W79 VanDerWaalsContact OE1-CZ2 3.29Å; E61-W79 WeakPolarHBondContact OE1-CZ2 3.47Å; R64-W79 HydrophobicContact CB-CH2 4.26Å; R64-W79 HydrophobicContact CB-CZ3 4.46Å; R64-W79 HydrophobicContact CG-CE3 4.35Å; R64-W79 HydrophobicContact CG-CH2 3.85Å; R64-W79 HydrophobicContact CG-CZ2 4.44Å; R64-W79 HydrophobicContact CG-CZ3 3.81Å; R64-W79 VanDerWaalsContact CZ-CE2 3.5Å; E70-W79 HydrophobicContact CB-CE3 3.88Å; E70-W79 HydrophobicContact CB-CZ3 4.45Å; E70-W79 WeakPolarHBondContact O-CZ3 3.44Å; T71-W79 CarbonylContact O-C 3.52Å; V72-W79 HydrophobicContact CG2-CD2 4.47Å; V72-W79 HydrophobicContact CG2-CE3 3.94Å; V72-W79 HydrophobicContact CG2-CH2 3.54Å; V72-W79 HydrophobicContact CG2-CZ2 4.09Å; V72-W79 HydrophobicContact CG2-CZ3 3.44Å; V72-W79 VanDerWaalsContact CG2-CZ3 3.44Å; W79-M170 VanDerWaalsContact CD1-SD 3.51Å; W79-M170 HydrophobicContact CD2-CE 4.31Å; W79-M170 HydrophobicContact CD2-SD 4.33Å; W79-M170 HydrophobicContact CG-CE 4.39Å; W79-M170 HydrophobicContact CG-SD 4.1Å; W79-M170 HydrophobicContact CZ2-CB 4.31Å; W79-M170 PolarHBondContact NE1-SD 3.37Å; W79-M170 VanDerWaalsContact NE1-SD 3.38Å
80	S	74.1	Confident	77.9	Confident	34 Å²	34	76 Å²	76	24%	0.238	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-62.9	166	167.6	75.4	0	0	0	0	110.4	T71 H83	T71-S80 PolarHBondContact N-OG 3.16Å; T71-S80 WeakPolarHBondContact O-CB 3.13Å; T71-S80 PolarHBondContact O-N 3.04Å; T71-S80 WeakPolarHBondContact OG1-CB 3.07Å; T71-S80 PolarHBondContact OG1-OG 3.39Å; S80-H83 PolarHBondContact OG-CE1 3.34Å; S80-H83 PolarHBondContact OG-ND1 3.49Å
81	K	75.5	Confident	78.2	Confident	142 Å²	142	75.7 Å²	75.7	62%	0.617	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-61.1	149.5	162.2	-68.6	-177.5	179.5	176.7	0	109.2	H83 E335	K81-H83 PolarHBondContact O-N 3.19Å; K81-H83 PolarHBondContact O-ND1 2.95Å; K81-E335 IonicContact NZ-OE1 3.76Å; K81-E335 PolarHBondContact NZ-OE1 2.96Å
82	P	78.7	Confident	78.5	Confident	25 Å²	25	74.7 Å²	74.7	16%	0.162	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-60.4	131.4	171.6	25.6	-34.4	0	0	0	109.7	E69 E70 P772 G773	E69-P82 WeakPolarHBondContact O-CA 3.37Å; E70-P82 HydrophobicContact CG-CB 4.18Å; P82-P772 HydrophobicContact CB-CB 4.42Å; P82-P772 VanDerWaalsContact CB-O 3.3Å; P82-P772 WeakPolarHBondContact CB-O 3.2Å; P82-P772 HydrophobicContact CG-CB 4.21Å; P82-P772 WeakPolarHBondContact CG-O 3.29Å; P82-G773 VanDerWaalsContact CG-CA 3.42Å
83	H	75.9	Confident	78.9	Confident	36 Å²	36	75.2 Å²	75.2	17%	0.167	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-143.7	162	-179.2	56.8	-73.4	0	0	0	111	Y68 E69 S80 K81	Y68-H83 WeakPolarHBondContact CB-O 3.44Å; E69-H83 PolarHBondContact N-O 3.45Å; E69-H83 PolarHBondContact O-CE1 3.5Å; E69-H83 VanDerWaalsContact O-CE1 3.31Å; E69-H83 PolarHBondContact O-N 3.39Å; E69-H83 PolarHBondContact O-ND1 3.28Å; S80-H83 PolarHBondContact OG-CE1 3.34Å; S80-H83 PolarHBondContact OG-ND1 3.49Å; K81-H83 PolarHBondContact O-N 3.19Å; K81-H83 PolarHBondContact O-ND1 2.95Å
84	I	78.8	Confident	79.8	Confident	71 Å²	71	75.2 Å²	75.2	36%	0.364	39%	0.385	S	S	.	.			trans	-69.2	135.5	174.4	-64.6	175.7	0	0	0	109.3	Y68 L86 I339	Y68-I84 HydrophobicContact CD1-CG1 4.05Å; Y68-I84 HydrophobicContact CE1-CG1 4.03Å; I84-L86 PolarHBondContact O-N 3.29Å; I84-I339 HydrophobicContact CD1-CD1 3.21Å; I84-I339 HydrophobicContact CG1-CD1 4.45Å
85	S	83.5	Confident	81	Confident	19 Å²	19	66.3 Å²	66.3	13%	0.133	34%	0.339	C	S	.	.			trans	-64.9	121.3	173.1	-69.9	0	0	0	0	111.8	W65 E69 L87 S289	W65-S85 PolarHBondContact NE1-OG 2.95Å; E69-S85 WeakPolarHBondContact CB-OG 3.44Å; E69-S85 WeakPolarHBondContact OE2-CA 3.4Å; E69-S85 VanDerWaalsContact OE2-CB 3.28Å; E69-S85 WeakPolarHBondContact OE2-CB 3.31Å; E69-S85 PolarHBondContact OE2-OG 3.5Å; S85-L87 PolarHBondContact O-N 3Å; S85-S289 WeakPolarHBondContact CB-OG 3.26Å
86	L	82.8	Confident	82.5	Confident	110 Å²	110	66.1 Å²	66.1	58%	0.576	33%	0.325	S	S	*	.			trans	-82.1	111.7	169.8	-58.5	-179.2	0	0	0	108.8	I84 M332	I84-L86 PolarHBondContact O-N 3.29Å; L86-M332 HydrophobicContact CD1-CE 4.34Å; L86-M332 HydrophobicContact CD2-CE 3.38Å
87	L	87.8	Confident	83.8	Confident	56 Å²	56	71 Å²	71	29%	0.293	34%	0.335	S	S	.	.			trans	-97.8	121.7	-178.4	-56.9	-175	0	0	0	110.5	S85 R285 C286 F316	S85-L87 PolarHBondContact O-N 3Å; L87-R285 HydrophobicContact CD2-CB 4.4Å; L87-C286 HydrophobicContact CD2-CB 4.4Å; L87-F316 HydrophobicContact CD1-CE1 3.8Å; L87-F316 HydrophobicContact CD1-CZ 3.98Å
88	A	85.1	Confident	84.9	Confident	45 Å²	45	67 Å²	67	37%	0.372	32%	0.316	S	S	.	.			trans	-77.4	130.2	172.2	0	0	0	0	0	110.4	Q90 S91 I92	A88-Q90 PolarHBondContact O-N 3.43Å; A88-S91 WeakPolarHBondContact O-CB 3.46Å; A88-S91 PolarHBondContact O-N 3.37Å; A88-I92 PolarHBondContact O-N 3.5Å; A88-I92 VanDerWaalsContact O-N 3.1Å
89	Y	86.8	Confident	85.7	Confident	140 Å²	140	57.8 Å²	57.8	55%	0.549	28%	0.282	S	S	.	.	H	α-helix	trans	-59.7	-32.4	179.4	-179.8	-98	0	0	0	113.2	I92 M93	Y89-I92 HydrophobicContact CD2-CG2 4.27Å; Y89-I92 VanDerWaalsContact O-CG2 3.3Å; Y89-I92 WeakPolarHBondContact O-CG2 3.43Å; Y89-M93 HydrophobicContact CD1-CG 4.27Å; Y89-M93 HydrophobicContact CD2-CE 4.36Å; Y89-M93 HydrophobicContact CE1-CE 4.46Å; Y89-M93 HydrophobicContact CE1-CG 3.84Å; Y89-M93 HydrophobicContact CE2-CE 3.46Å; Y89-M93 VanDerWaalsContact CE2-CE 3.46Å; Y89-M93 HydrophobicContact CE2-CG 4.26Å; Y89-M93 WeakPolarHBondContact O-CG 3.48Å; Y89-M93 PolarHBondContact O-N 3Å; Y89-M93 VanDerWaalsContact O-N 3.16Å; Y89-M93 WeakPolarHBondContact OH-CE 3.4Å
90	Q	88.8	Confident	86.2	Confident	161 Å²	161	58.4 Å²	58.4	75%	0.752	29%	0.292	S	S	*	.	H	α-helix	trans	-67.3	-38.5	175.1	-69.2	-179.3	-18.5	0	0	111.9	A88 M93 T94	A88-Q90 PolarHBondContact O-N 3.43Å; Q90-M93 PolarHBondContact O-N 3.37Å; Q90-T94 WeakPolarHBondContact O-CB 3.21Å; Q90-T94 PolarHBondContact O-N 2.94Å; Q90-T94 PolarHBondContact O-OG1 3.42Å
91	S	91.1	Very high	86.8	Confident	7 Å²	7	61.8 Å²	61.8	5%	0.049	31%	0.307	C	S	.	.	H	α-helix	trans	-67.6	-39.3	178.5	-59	0	0	0	0	111.7	A88 T94 L95 S282	A88-S91 WeakPolarHBondContact O-CB 3.46Å; A88-S91 PolarHBondContact O-N 3.37Å; S91-T94 PolarHBondContact O-N 3.26Å; S91-L95 WeakPolarHBondContact O-CB 3.37Å; S91-L95 PolarHBondContact O-N 2.92Å; S91-S282 WeakPolarHBondContact OG-CB 3.49Å
92	I	91.4	Very high	87.2	Confident	10 Å²	10	55.4 Å²	55.4	5%	0.051	28%	0.281	C	S	.	.	H	α-helix	trans	-68.2	-39.2	177.3	-154.4	162.2	0	0	0	112.1	A88 Y89 T94 L95 R96 V313 F316 I317	A88-I92 PolarHBondContact O-N 3.5Å; A88-I92 VanDerWaalsContact O-N 3.1Å; Y89-I92 HydrophobicContact CD2-CG2 4.27Å; Y89-I92 VanDerWaalsContact O-CG2 3.3Å; Y89-I92 WeakPolarHBondContact O-CG2 3.43Å; I92-T94 VanDerWaalsContact C-N 3.32Å; I92-T94 PolarHBondContact O-N 2.66Å; I92-L95 WeakPolarHBondContact O-CB 3.35Å; I92-L95 PolarHBondContact O-N 3.3Å; I92-R96 PolarHBondContact O-N 3.2Å; I92-V313 HydrophobicContact CD1-CG1 4.38Å; I92-V313 HydrophobicContact CG1-CG1 3.77Å; I92-F316 HydrophobicContact CD1-CD1 3.83Å; I92-F316 HydrophobicContact CD1-CE1 3.95Å; I92-I317 HydrophobicContact CD1-CD1 4.13Å; I92-I317 HydrophobicContact CD1-CG1 3.64Å; I92-I317 HydrophobicContact CG1-CD1 4.15Å; I92-I317 HydrophobicContact CG1-CG1 4.22Å; I92-I317 HydrophobicContact CG2-CD1 4.05Å; I92-I317 HydrophobicContact CG2-CG1 4.41Å
93	M	92.4	Very high	87.5	Confident	48 Å²	48	54.8 Å²	54.8	24%	0.236	28%	0.277	C	S	.	.	H	α-helix	trans	-67.7	-34.3	175.2	-71	-64.5	150.5	0	0	112.2	Y89 Q90 K97 I317	Y89-M93 HydrophobicContact CD1-CG 4.27Å; Y89-M93 HydrophobicContact CD2-CE 4.36Å; Y89-M93 HydrophobicContact CE1-CE 4.46Å; Y89-M93 HydrophobicContact CE1-CG 3.84Å; Y89-M93 HydrophobicContact CE2-CE 3.46Å; Y89-M93 VanDerWaalsContact CE2-CE 3.46Å; Y89-M93 HydrophobicContact CE2-CG 4.26Å; Y89-M93 WeakPolarHBondContact O-CG 3.48Å; Y89-M93 PolarHBondContact O-N 3Å; Y89-M93 VanDerWaalsContact O-N 3.16Å; Y89-M93 WeakPolarHBondContact OH-CE 3.4Å; Q90-M93 PolarHBondContact O-N 3.37Å; M93-K97 WeakPolarHBondContact O-CG 3.33Å; M93-K97 PolarHBondContact O-N 3.38Å; M93-I317 HydrophobicContact CE-CD1 3.59Å
94	T	92.3	Very high	87.8	Confident	33 Å²	33	53.8 Å²	53.8	20%	0.202	27%	0.272	C	S	.	.	H	α-helix	trans	-66.9	-46	172.9	-55.2	0	0	0	0	110.6	Q90 S91 I92 R96 K97 L98 M241 V278 V283	Q90-T94 WeakPolarHBondContact O-CB 3.21Å; Q90-T94 PolarHBondContact O-N 2.94Å; Q90-T94 PolarHBondContact O-OG1 3.42Å; S91-T94 PolarHBondContact O-N 3.26Å; I92-T94 VanDerWaalsContact C-N 3.32Å; I92-T94 PolarHBondContact O-N 2.66Å; T94-R96 VanDerWaalsContact C-N 3.31Å; T94-R96 PolarHBondContact O-N 2.8Å; T94-K97 PolarHBondContact O-N 2.9Å; T94-L98 HydrophobicContact CG2-CD1 3.96Å; T94-L98 HydrophobicContact CG2-CG 4.36Å; T94-L98 WeakPolarHBondContact O-CB 3.39Å; T94-L98 VanDerWaalsContact O-CG 3.28Å; T94-L98 WeakPolarHBondContact O-CG 3.45Å; T94-L98 PolarHBondContact O-N 2.91Å; T94-M241 HydrophobicContact CG2-SD 4Å; T94-V278 HydrophobicContact CG2-CG1 4.42Å; T94-V283 HydrophobicContact CG2-CG2 4.33Å
95	L	92.8	Very high	88	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-56.8	-44.5	174.5	-178.5	63.2	0	0	0	111.6	S91 I92 K97 L98 L99 F268 V283 C286 L287 I290	S91-L95 WeakPolarHBondContact O-CB 3.37Å; S91-L95 PolarHBondContact O-N 2.92Å; I92-L95 WeakPolarHBondContact O-CB 3.35Å; I92-L95 PolarHBondContact O-N 3.3Å; L95-K97 VanDerWaalsContact C-N 3.34Å; L95-K97 PolarHBondContact O-N 2.9Å; L95-L98 PolarHBondContact O-N 3.41Å; L95-L98 VanDerWaalsContact O-N 3.16Å; L95-L99 HydrophobicContact CD1-CD1 4.08Å; L95-L99 HydrophobicContact CD1-CG 4.05Å; L95-L99 HydrophobicContact CG-CD1 3.94Å; L95-L99 HydrophobicContact CG-CG 4.31Å; L95-L99 WeakPolarHBondContact O-CG 3.44Å; L95-L99 PolarHBondContact O-N 3.27Å; L95-F268 HydrophobicContact CD1-CZ 4Å; L95-V283 HydrophobicContact CB-CG1 4.03Å; L95-V283 HydrophobicContact CD1-CG1 4.11Å; L95-C286 HydrophobicContact CD2-CB 3.82Å; L95-L287 HydrophobicContact CD1-CB 4.07Å; L95-L287 HydrophobicContact CD1-CD1 4.35Å; L95-L287 HydrophobicContact CD2-CB 3.83Å; L95-L287 HydrophobicContact CD2-CD1 4.29Å; L95-I290 HydrophobicContact CD2-CD1 3.8Å
96	R	93.4	Very high	87.8	Confident	88 Å²	88	49.7 Å²	49.7	33%	0.332	25%	0.25	S	S	.	.	H	α-helix	trans	-56.7	-46.7	178.2	-166.7	-177.4	93.1	104.4	6.2	112.1	I92 T94 A100 V313 D314	I92-R96 PolarHBondContact O-N 3.2Å; T94-R96 VanDerWaalsContact C-N 3.31Å; T94-R96 PolarHBondContact O-N 2.8Å; R96-A100 PolarHBondContact O-N 2.83Å; R96-A100 VanDerWaalsContact O-N 3.14Å; R96-V313 HydrophobicContact CB-CB 4.39Å; R96-V313 HydrophobicContact CB-CG1 4.08Å; R96-V313 HydrophobicContact CG-CB 4.22Å; R96-V313 HydrophobicContact CG-CG1 4.34Å; R96-D314 WeakPolarHBondContact CD-OD1 3.11Å; R96-D314 IonicContact CZ-OD1 2.95Å; R96-D314 IonicContact CZ-OD2 3.55Å; R96-D314 IonicContact NE-OD1 2.72Å; R96-D314 IonicContact NH1-OD1 2.85Å; R96-D314 PolarHBondContact NH1-OD1 2.96Å; R96-D314 IonicContact NH1-OD2 3.31Å; R96-D314 PolarHBondContact NH1-OD2 2.7Å
97	K	91.7	Very high	87.4	Confident	142 Å²	142	46.8 Å²	46.8	62%	0.617	24%	0.235	S	C	*	.	H	α-helix	trans	-64.4	-43.7	176.3	-69.5	178.1	-178.9	-178.7	0	111.4	M93 T94 L95 L99 A100 D101	M93-K97 WeakPolarHBondContact O-CG 3.33Å; M93-K97 PolarHBondContact O-N 3.38Å; T94-K97 PolarHBondContact O-N 2.9Å; L95-K97 VanDerWaalsContact C-N 3.34Å; L95-K97 PolarHBondContact O-N 2.9Å; K97-L99 VanDerWaalsContact C-N 3.35Å; K97-L99 PolarHBondContact O-N 3.42Å; K97-A100 PolarHBondContact O-N 3.47Å; K97-D101 WeakPolarHBondContact O-CB 3.36Å; K97-D101 PolarHBondContact O-N 3.43Å
98	L	90.2	Very high	86.8	Confident	17 Å²	17	44.2 Å²	44.2	9%	0.089	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-37.9	179	-72.1	170.5	0	0	0	112.7	T94 L95 G102 M241 S243 L270 V283	T94-L98 HydrophobicContact CG2-CD1 3.96Å; T94-L98 HydrophobicContact CG2-CG 4.36Å; T94-L98 WeakPolarHBondContact O-CB 3.39Å; T94-L98 VanDerWaalsContact O-CG 3.28Å; T94-L98 WeakPolarHBondContact O-CG 3.45Å; T94-L98 PolarHBondContact O-N 2.91Å; L95-L98 PolarHBondContact O-N 3.41Å; L95-L98 VanDerWaalsContact O-N 3.16Å; L98-G102 WeakPolarHBondContact O-CA 3.35Å; L98-G102 PolarHBondContact O-N 3.4Å; L98-M241 HydrophobicContact CD1-SD 3.78Å; L98-M241 HydrophobicContact CD2-CG 3.85Å; L98-M241 HydrophobicContact CD2-SD 3.77Å; L98-M241 HydrophobicContact CG-SD 4.18Å; L98-S243 PolarHBondContact O-OG 3.37Å; L98-L270 HydrophobicContact CD1-CD1 3.62Å; L98-L270 HydrophobicContact CD1-CD2 4.21Å; L98-L270 HydrophobicContact CD2-CD1 4.25Å; L98-V283 HydrophobicContact CD1-CG1 4.04Å
99	L	89.1	Confident	86.5	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-73.4	-32.9	176.9	-70.2	174.5	0	0	0	112.6	L95 K97 F245 F268 L287 L309 V313	L95-L99 HydrophobicContact CD1-CD1 4.08Å; L95-L99 HydrophobicContact CD1-CG 4.05Å; L95-L99 HydrophobicContact CG-CD1 3.94Å; L95-L99 HydrophobicContact CG-CG 4.31Å; L95-L99 WeakPolarHBondContact O-CG 3.44Å; L95-L99 PolarHBondContact O-N 3.27Å; K97-L99 VanDerWaalsContact C-N 3.35Å; K97-L99 PolarHBondContact O-N 3.42Å; L99-F245 HydrophobicContact CD2-CB 4.24Å; L99-F245 HydrophobicContact CD2-CD2 4.39Å; L99-F245 HydrophobicContact CD2-CG 4.43Å; L99-F268 HydrophobicContact CD2-CE2 4.01Å; L99-L287 HydrophobicContact CD1-CD1 4.45Å; L99-L309 HydrophobicContact CB-CB 4.02Å; L99-L309 HydrophobicContact CD2-CD1 4.46Å; L99-V313 HydrophobicContact CD1-CG2 3.64Å
100	A	88.3	Confident	86	Confident	34 Å²	34	39 Å²	39	28%	0.281	20%	0.195	S	C	.	.	H	α-helix	trans	-70.1	-46.5	175	0	0	0	0	0	112.3	R96 K97	R96-A100 PolarHBondContact O-N 2.83Å; R96-A100 VanDerWaalsContact O-N 3.14Å; K97-A100 PolarHBondContact O-N 3.47Å
101	D	86.7	Confident	85.3	Confident	106 Å²	106	39.6 Å²	39.6	57%	0.567	19%	0.19	S	C	*	.	H	α-helix	trans	-98	-0.9	-174.3	-64.2	-26.9	0	0	0	113	K97 R148 Y150	K97-D101 WeakPolarHBondContact O-CB 3.36Å; K97-D101 PolarHBondContact O-N 3.43Å; D101-R148 PolarHBondContact O-NH1 3.32Å; D101-R148 PolarHBondContact O-NH2 2.97Å; D101-Y150 PolarHBondContact O-OH 2.73Å
102	G	83	Confident	84.7	Confident	7 Å²	7	42.5 Å²	42.5	7%	0.072	21%	0.205	C	C	.	.	S	Bend	trans	-81.7	175.1	-173.8	0	0	0	0	0	114.4	L98 R148	L98-G102 WeakPolarHBondContact O-CA 3.35Å; L98-G102 PolarHBondContact O-N 3.4Å; G102-R148 PolarHBondContact O-NH2 2.9Å
103	L	84.8	Confident	84.2	Confident	12 Å²	12	42.5 Å²	42.5	6%	0.063	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.4	169.7	173.1	64.5	0	0	0	109.7	L105 L138 L141 F145 S243 A244 F245	L103-L105 HydrophobicContact CD1-CD2 4.1Å; L103-L105 HydrophobicContact CD1-CG 4.42Å; L103-L105 HydrophobicContact CD2-CD1 4.4Å; L103-L105 HydrophobicContact CD2-CG 4.31Å; L103-L105 HydrophobicContact CG-CD2 4.4Å; L103-L105 HydrophobicContact CG-CG 4.2Å; L103-L138 HydrophobicContact CD1-CD2 3.36Å; L103-L141 HydrophobicContact CD2-CD2 4.42Å; L103-F145 HydrophobicContact CD2-CD2 4.45Å; L103-S243 WeakPolarHBondContact CB-O 3.33Å; L103-S243 PolarHBondContact N-O 2.91Å; L103-A244 HydrophobicContact CB-CB 3.88Å; L103-A244 HydrophobicContact CD2-CB 3.81Å; L103-A244 HydrophobicContact CG-CB 4.1Å; L103-A244 CarbonylContact O-C 3.58Å; L103-A244 VanDerWaalsContact O-CA 3.26Å; L103-A244 WeakPolarHBondContact O-CA 3.4Å; L103-F245 PolarHBondContact O-N 2.92Å
104	L	83.6	Confident	83.5	Confident	15 Å²	15	40.9 Å²	40.9	8%	0.079	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	115.7	175.2	178.2	54.8	0	0	0	109.7	T106 F245 I304 L309	L104-T106 HydrophobicContact CD1-CG2 3.87Å; L104-T106 HydrophobicContact CD2-CG2 4.23Å; L104-T106 HydrophobicContact CG-CG2 3.86Å; L104-F245 HydrophobicContact CD1-CB 4.43Å; L104-F245 HydrophobicContact CD1-CD1 3.65Å; L104-F245 HydrophobicContact CD1-CE1 4.49Å; L104-I304 WeakPolarHBondContact CD2-O 3.19Å; L104-L309 HydrophobicContact CD1-CD1 3.74Å; L104-L309 HydrophobicContact CD2-CD1 3.9Å; L104-L309 HydrophobicContact CG-CD1 4.35Å
105	L	81.9	Confident	82.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	107	173.7	-63.7	-177.5	0	0	0	108.7	L103 T129 L138 L141 F245 V246 R247	L103-L105 HydrophobicContact CD1-CD2 4.1Å; L103-L105 HydrophobicContact CD1-CG 4.42Å; L103-L105 HydrophobicContact CD2-CD1 4.4Å; L103-L105 HydrophobicContact CD2-CG 4.31Å; L103-L105 HydrophobicContact CG-CD2 4.4Å; L103-L105 HydrophobicContact CG-CG 4.2Å; L105-T129 HydrophobicContact CD2-CG2 3.73Å; L105-L138 HydrophobicContact CD2-CD2 3.9Å; L105-L141 HydrophobicContact CD1-CD2 3.99Å; L105-L141 HydrophobicContact CD1-CG 4.34Å; L105-F245 PolarHBondContact N-O 3.42Å; L105-V246 HydrophobicContact CB-CB 4.39Å; L105-V246 HydrophobicContact CB-CG1 4.13Å; L105-V246 HydrophobicContact CB-CG2 4.19Å; L105-V246 HydrophobicContact CD1-CG2 4Å; L105-V246 HydrophobicContact CG-CG2 4.46Å; L105-V246 WeakPolarHBondContact O-CA 3.42Å; L105-R247 PolarHBondContact O-N 3.41Å
106	T	80.1	Confident	82.2	Confident	5 Å²	5	39.9 Å²	39.9	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	144.9	178.5	60.2	0	0	0	0	111.8	L104 C108 K128	L104-T106 HydrophobicContact CD1-CG2 3.87Å; L104-T106 HydrophobicContact CD2-CG2 4.23Å; L104-T106 HydrophobicContact CG-CG2 3.86Å; T106-C108 VanDerWaalsContact C-N 3.35Å; T106-C108 PolarHBondContact O-N 3.22Å; T106-K128 PolarHBondContact N-O 3.08Å; T106-K128 PolarHBondContact O-N 3.09Å; T106-K128 VanDerWaalsContact O-N 3.11Å; T106-K128 PolarHBondContact OG1-O 3.21Å
107	D	74.1	Confident	81.4	Confident	49 Å²	49	35.7 Å²	35.7	26%	0.262	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	57.2	41.1	173.2	-53.4	-21.5	0	0	0	114	R247 R249	D107-R247 PolarHBondContact N-O 2.93Å; D107-R247 IonicContact OD1-CZ 3.31Å; D107-R247 IonicContact OD1-NE 2.68Å; D107-R247 IonicContact OD1-NH2 2.95Å; D107-R247 PolarHBondContact OD1-NH2 3.19Å; D107-R247 IonicContact OD2-NH2 3.52Å; D107-R249 HydrophobicContact CB-CB 4.09Å; D107-R249 HydrophobicContact CB-CG 4.27Å
108	C	76.1	Confident	80.4	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.007	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	146.8	175	-68.2	0	0	0	0	112.3	T106 P110 C127 V246 R247 L248 R249	T106-C108 VanDerWaalsContact C-N 3.35Å; T106-C108 PolarHBondContact O-N 3.22Å; C108-P110 VanDerWaalsContact C-CD 3.49Å; C108-C127 WeakPolarHBondContact CA-SG 3.39Å; C108-C127 HydrophobicContact CB-CB 4.43Å; C108-C127 WeakPolarHBondContact CB-SG 3.45Å; C108-C127 WeakPolarHBondContact SG-CB 3.31Å; C108-C127 CovalentContact SG-SG 2.06Å; C108-C127 PolarHBondContact SG-SG 3.37Å; C108-V246 HydrophobicContact CB-CG1 4.48Å; C108-R247 PolarHBondContact N-O 3.3Å; C108-L248 HydrophobicContact CB-CD2 4.19Å; C108-L248 CarbonylContact O-C 3.4Å; C108-L248 VanDerWaalsContact O-CA 3.25Å; C108-L248 WeakPolarHBondContact O-CA 3.37Å; C108-R249 PolarHBondContact O-N 3.24Å
109	E	78	Confident	78.9	Confident	77 Å²	77	35.2 Å²	35.2	36%	0.36	18%	0.177	S	C	.	.			trans	-131.6	65.9	177.4	-164.9	-171.3	162.3	0	0	110.8	R125	E109-R125 IonicContact OE1-NH1 3.44Å
110	P	76.2	Confident	77.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.199	C	C	.	.			trans	-74.2	137.5	177.7	31.1	-35.2	0	0	0	111.3	C108 E115 L116 L248 Q252 I254	C108-P110 VanDerWaalsContact C-CD 3.49Å; P110-E115 HydrophobicContact CB-CB 4.34Å; P110-L116 HydrophobicContact CB-CB 3.91Å; P110-L116 HydrophobicContact CG-CB 4.07Å; P110-L116 HydrophobicContact CG-CD1 4.26Å; P110-L248 HydrophobicContact CG-CD2 3.84Å; P110-Q252 VanDerWaalsContact O-CD 3.29Å; P110-Q252 PolarHBondContact O-NE2 2.94Å; P110-Q252 PolarHBondContact O-OE1 3.02Å; P110-I254 HydrophobicContact CG-CD1 4.26Å
111	R	74.3	Confident	75.3	Confident	173 Å²	173	46.6 Å²	46.6	65%	0.653	23%	0.228	S	C	*	.	S	Bend	trans	-71.9	-33.6	173.7	-71.8	172.2	-88.9	-159.9	-14.9	112.6	E115 S123	R111-E115 VanDerWaalsContact CB-OE2 3.26Å; R111-E115 WeakPolarHBondContact CB-OE2 3.23Å; R111-E115 IonicContact CZ-OE1 4Å; R111-E115 PolarHBondContact N-OE2 2.84Å; R111-E115 IonicContact NE-OE1 3.71Å; R111-E115 IonicContact NE-OE2 3.02Å; R111-E115 PolarHBondContact NE-OE2 3.03Å; R111-E115 IonicContact NH2-OE1 3.15Å; R111-E115 PolarHBondContact NH2-OE1 3.15Å; R111-S123 PolarHBondContact NH2-OG 2.96Å; R111-S123 VanDerWaalsContact NH2-OG 3.12Å
112	D	78.3	Confident	73.1	Confident	68 Å²	68	43.7 Å²	43.7	36%	0.364	21%	0.21	S	C	.	.	S	Bend	trans	-142.9	161.8	180	-163.4	11.3	0	0	0	110.9	A114 E115 L116	D112-A114 PolarHBondContact O-N 3.28Å; D112-E115 WeakPolarHBondContact O-CB 3.35Å; D112-E115 PolarHBondContact O-N 3.43Å; D112-E115 VanDerWaalsContact O-N 3.09Å; D112-L116 PolarHBondContact O-N 3.33Å
113	F	80.2	Confident	71.2	Confident	9 Å²	9	46.3 Å²	46.3	4%	0.039	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-30.5	178.4	-173.9	-118.9	0	0	0	111.8	E115 L116 V117 L163 L164 K167 L231 I254 L257	F113-E115 PolarHBondContact O-N 2.87Å; F113-L116 HydrophobicContact CD2-CD2 4.35Å; F113-L116 HydrophobicContact CE2-CD2 4.46Å; F113-L116 PolarHBondContact O-N 3.13Å; F113-V117 HydrophobicContact CD1-CG2 4.11Å; F113-V117 HydrophobicContact CD2-CG2 4.48Å; F113-V117 HydrophobicContact CE1-CG2 3.72Å; F113-V117 HydrophobicContact CE2-CG2 4.15Å; F113-V117 HydrophobicContact CG-CG2 4.48Å; F113-V117 HydrophobicContact CZ-CG2 3.75Å; F113-V117 WeakPolarHBondContact O-CG2 3.4Å; F113-V117 PolarHBondContact O-N 3.27Å; F113-L163 WeakPolarHBondContact CE1-O 3.49Å; F113-L164 HydrophobicContact CD1-CD2 4.03Å; F113-L164 HydrophobicContact CE1-CD2 4.48Å; F113-K167 VanDerWaalsContact CE1-NZ 3.33Å; F113-L231 HydrophobicContact CE2-CD1 4.47Å; F113-L231 HydrophobicContact CZ-CD1 3.96Å; F113-I254 HydrophobicContact CB-CG2 3.77Å; F113-I254 VanDerWaalsContact N-CG2 3.33Å; F113-L257 HydrophobicContact CD1-CD1 4.37Å; F113-L257 HydrophobicContact CD2-CD1 3.62Å; F113-L257 HydrophobicContact CD2-CD2 3.63Å; F113-L257 HydrophobicContact CD2-CG 4.14Å; F113-L257 HydrophobicContact CE1-CD1 4.31Å; F113-L257 HydrophobicContact CE2-CD1 3.54Å; F113-L257 HydrophobicContact CE2-CD2 4.07Å; F113-L257 HydrophobicContact CE2-CG 4.44Å; F113-L257 HydrophobicContact CG-CD1 4.04Å; F113-L257 HydrophobicContact CG-CD2 4.39Å; F113-L257 HydrophobicContact CZ-CD1 3.91Å
114	A	79.4	Confident	69.2	Low	14 Å²	14	52.1 Å²	52.1	12%	0.116	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-35.8	175	0	0	0	0	0	113.7	D112 V117 G118 K119 L164	D112-A114 PolarHBondContact O-N 3.28Å; A114-V117 PolarHBondContact O-N 3.46Å; A114-G118 PolarHBondContact O-N 3.04Å; A114-K119 HydrophobicContact CB-CB 4.41Å; A114-K119 PolarHBondContact O-N 3.38Å; A114-L164 HydrophobicContact CB-CD2 4.04Å
115	E	77.8	Confident	67.3	Low	13 Å²	13	59.3 Å²	59.3	6%	0.061	28%	0.284	C	S	.	.	H	α-helix	trans	-67.8	-38.6	174.6	-172.4	171.2	-158.8	0	0	110.5	P110 R111 D112 F113 F122 N140	P110-E115 HydrophobicContact CB-CB 4.34Å; R111-E115 VanDerWaalsContact CB-OE2 3.26Å; R111-E115 WeakPolarHBondContact CB-OE2 3.23Å; R111-E115 IonicContact CZ-OE1 4Å; R111-E115 PolarHBondContact N-OE2 2.84Å; R111-E115 IonicContact NE-OE1 3.71Å; R111-E115 IonicContact NE-OE2 3.02Å; R111-E115 PolarHBondContact NE-OE2 3.03Å; R111-E115 IonicContact NH2-OE1 3.15Å; R111-E115 PolarHBondContact NH2-OE1 3.15Å; D112-E115 WeakPolarHBondContact O-CB 3.35Å; D112-E115 PolarHBondContact O-N 3.43Å; D112-E115 VanDerWaalsContact O-N 3.09Å; F113-E115 PolarHBondContact O-N 2.87Å; E115-F122 HydrophobicContact CG-CD2 3.66Å; E115-F122 HydrophobicContact CG-CE2 3.84Å; E115-N140 PolarHBondContact O-OD1 3.45Å
116	L	79.6	Confident	65.7	Low	0 Å²	0	64 Å²	64	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-38.8	176.2	-175.2	63.2	0	0	0	113	P110 D112 F113 L141 V246 V267	P110-L116 HydrophobicContact CB-CB 3.91Å; P110-L116 HydrophobicContact CG-CB 4.07Å; P110-L116 HydrophobicContact CG-CD1 4.26Å; D112-L116 PolarHBondContact O-N 3.33Å; F113-L116 HydrophobicContact CD2-CD2 4.35Å; F113-L116 HydrophobicContact CE2-CD2 4.46Å; F113-L116 PolarHBondContact O-N 3.13Å; L116-L141 HydrophobicContact CD2-CD1 4.29Å; L116-L141 HydrophobicContact CG-CD1 3.92Å; L116-L141 HydrophobicContact CG-CG 4.28Å; L116-L141 WeakPolarHBondContact O-CG 3.31Å; L116-L141 PolarHBondContact O-N 2.82Å; L116-V246 HydrophobicContact CD1-CG1 3.89Å; L116-V246 HydrophobicContact CD2-CG1 4.3Å; L116-V267 HydrophobicContact CD2-CG2 4.4Å
117	V	77.3	Confident	64	Low	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-68.1	-45.4	177.4	169.6	0	0	0	0	110.7	F113 A114 L141 V142 E160 L163 L164	F113-V117 HydrophobicContact CD1-CG2 4.11Å; F113-V117 HydrophobicContact CD2-CG2 4.48Å; F113-V117 HydrophobicContact CE1-CG2 3.72Å; F113-V117 HydrophobicContact CE2-CG2 4.15Å; F113-V117 HydrophobicContact CG-CG2 4.48Å; F113-V117 HydrophobicContact CZ-CG2 3.75Å; F113-V117 WeakPolarHBondContact O-CG2 3.4Å; F113-V117 PolarHBondContact O-N 3.27Å; A114-V117 PolarHBondContact O-N 3.46Å; V117-L141 HydrophobicContact CG2-CD1 4.41Å; V117-V142 HydrophobicContact CG1-CG2 3.98Å; V117-V142 WeakPolarHBondContact O-CG2 3.31Å; V117-V142 PolarHBondContact O-N 2.98Å; V117-E160 HydrophobicContact CG1-CB 4.36Å; V117-E160 HydrophobicContact CG1-CG 4.11Å; V117-L163 HydrophobicContact CG1-CB 3.99Å; V117-L163 HydrophobicContact CG1-CD1 3.96Å; V117-L163 HydrophobicContact CG2-CB 3.83Å; V117-L163 HydrophobicContact CG2-CD1 4.21Å; V117-L164 HydrophobicContact CG1-CG 4.44Å; V117-L164 HydrophobicContact CG2-CD2 4.45Å
118	G	69.2	Low	62.8	Low	14 Å²	14	68.6 Å²	68.6	14%	0.144	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	128.8	14.3	170.4	0	0	0	0	0	117	A114 N140	A114-G118 PolarHBondContact O-N 3.04Å; G118-N140 VanDerWaalsContact CA-CB 3.48Å; G118-N140 WeakPolarHBondContact CA-ND2 3.49Å
119	K	58.8	Low	61.4	Low	135 Å²	135	71.3 Å²	71.3	59%	0.587	35%	0.352	S	S	*	.	S	Bend	trans	-72.5	-29.9	-177.7	-170	173.5	178.5	179.4	0	113.3	A114 L164	A114-K119 HydrophobicContact CB-CB 4.41Å; A114-K119 PolarHBondContact O-N 3.38Å; K119-L164 HydrophobicContact CB-CD1 4.33Å; K119-L164 HydrophobicContact CD-CD1 3.56Å
120	D	53.5	Low	59.7	Low	91 Å²	91	71.7 Å²	71.7	49%	0.487	35%	0.354	S	S	.	.	S	Bend	trans	-103.3	143.6	177	-69.2	-35.2	0	0	0	110.8	F122	D120-F122 PolarHBondContact O-N 3.11Å; D120-F122 VanDerWaalsContact O-N 3.09Å
121	Q	48.1	Very low	57.6	Low	190 Å²	190	80.8 Å²	80.8	89%	0.888	39%	0.39	S	S	*	.			trans	-61.9	114.6	175.9	-72	-174.3	5.5	0	0	109.9	S123	Q121-S123 PolarHBondContact O-N 2.98Å
122	F	41.8	Very low	55.6	Low	44 Å²	44	79.5 Å²	79.5	19%	0.193	40%	0.401	C	S	.	.			trans	-59.9	107.7	174.8	-140.8	-106.4	0	0	0	109.1	E115 D120 D124 R125 N140	E115-F122 HydrophobicContact CG-CD2 3.66Å; E115-F122 HydrophobicContact CG-CE2 3.84Å; D120-F122 PolarHBondContact O-N 3.11Å; D120-F122 VanDerWaalsContact O-N 3.09Å; F122-D124 PolarHBondContact O-N 3.42Å; F122-R125 WeakPolarHBondContact CE1-O 3.34Å; F122-N140 VanDerWaalsContact CD2-OD1 3.25Å; F122-N140 WeakPolarHBondContact CD2-OD1 3.13Å
123	S	42.3	Very low	53.2	Low	63 Å²	63	81 Å²	81	44%	0.441	42%	0.417	S	S	.	.			trans	-77.5	92.9	-179.2	73.9	0	0	0	0	110	R111 Q121 R125	R111-S123 PolarHBondContact NH2-OG 2.96Å; R111-S123 VanDerWaalsContact NH2-OG 3.12Å; Q121-S123 PolarHBondContact O-N 2.98Å; S123-R125 PolarHBondContact O-N 3.26Å
124	D	42.6	Very low	51.2	Low	133 Å²	133	87.5 Å²	87.5	71%	0.711	46%	0.457	S	S	*	.	S	Bend	trans	42.7	6.1	163.3	-93.9	-23.1	0	0	0	120.1	F122 S126 R137	F122-D124 PolarHBondContact O-N 3.42Å; D124-S126 PolarHBondContact O-N 3.47Å; D124-R137 IonicContact OD1-CZ 3.95Å; D124-R137 IonicContact OD1-NH2 2.86Å; D124-R137 PolarHBondContact OD1-NH2 3.42Å
125	R	44.8	Very low	48.9	Very low	166 Å²	166	95.5 Å²	95.5	63%	0.626	49%	0.489	S	S	*	.			trans	-93.4	89.4	177.5	-72.9	-172.8	-178.5	-173.5	2.2	109.6	E109 F122 S123 C127	E109-R125 IonicContact OE1-NH1 3.44Å; F122-R125 WeakPolarHBondContact CE1-O 3.34Å; S123-R125 PolarHBondContact O-N 3.26Å; R125-C127 PolarHBondContact O-N 2.71Å
126	S	46.7	Very low	46.9	Very low	100 Å²	100	100.2 Å²	100.2	70%	0.699	52%	0.521	S	S	*	.			trans	-45.8	123.6	-175.9	-162.4	0	0	0	0	115.8	D124	D124-S126 PolarHBondContact O-N 3.47Å
127	C	45.8	Very low	45	Very low	12 Å²	12	108.9 Å²	108.9	8%	0.081	55%	0.553	C	S	.	*			trans	-75.4	146.5	149.2	-65	0	0	0	0	108.7	C108 R125	C108-C127 WeakPolarHBondContact CA-SG 3.39Å; C108-C127 HydrophobicContact CB-CB 4.43Å; C108-C127 WeakPolarHBondContact CB-SG 3.45Å; C108-C127 WeakPolarHBondContact SG-CB 3.31Å; C108-C127 CovalentContact SG-SG 2.06Å; C108-C127 PolarHBondContact SG-SG 3.37Å; R125-C127 PolarHBondContact O-N 2.71Å
128	K	48.7	Very low	43.5	Very low	138 Å²	138	110 Å²	110	60%	0.6	56%	0.559	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.1	130.1	170.4	-73	179.3	-178.8	173.7	0	108.7	T106	T106-K128 PolarHBondContact N-O 3.08Å; T106-K128 PolarHBondContact O-N 3.09Å; T106-K128 VanDerWaalsContact O-N 3.11Å; T106-K128 PolarHBondContact OG1-O 3.21Å
129	T	46.2	Very low	43.1	Very low	57 Å²	57	110 Å²	110	35%	0.35	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124	147.2	177.6	47.3	0	0	0	0	111.4	L105 Y131 L138	L105-T129 HydrophobicContact CD2-CG2 3.73Å; T129-Y131 PolarHBondContact O-N 3.07Å; T129-Y131 VanDerWaalsContact O-N 3.12Å; T129-L138 HydrophobicContact CG2-CB 3.95Å; T129-L138 HydrophobicContact CG2-CD2 3.94Å
130	E	42.2	Very low	43.9	Very low	85 Å²	85	104.8 Å²	104.8	40%	0.397	54%	0.538	S	S	.	.	S	Bend	trans	-79	90	174	-175.4	172.3	-148.6	0	0	109.4	T305 G306	E130-T305 WeakPolarHBondContact OE1-CB 3.3Å; E130-T305 WeakPolarHBondContact OE1-CG2 3.41Å; E130-T305 PolarHBondContact OE1-OG1 3Å; E130-T305 VanDerWaalsContact OE2-CA 3.23Å; E130-T305 WeakPolarHBondContact OE2-CA 3.4Å; E130-G306 PolarHBondContact OE2-N 2.8Å
131	Y	33	Very low	45.1	Very low	191 Å²	191	100.6 Å²	100.6	75%	0.749	52%	0.516	S	S	*	.			trans	-165.2	116	145.5	-92.9	-69.9	0	0	0	110	T129 S133	T129-Y131 PolarHBondContact O-N 3.07Å; T129-Y131 VanDerWaalsContact O-N 3.12Å; Y131-S133 PolarHBondContact O-N 3.43Å
132	V	31.5	Very low	46.6	Very low	147 Å²	147	91.8 Å²	91.8	89%	0.891	48%	0.475	S	S	*	.			trans	-84.1	87.7	166.4	176.6	0	0	0	0	108
133	S	28.8	Very low	48.2	Very low	99 Å²	99	91.9 Å²	91.9	69%	0.692	48%	0.478	S	S	*	.	S	Bend	trans	-171.6	103.7	153.5	-94.5	0	0	0	0	112.9	Y131 K135	Y131-S133 PolarHBondContact O-N 3.43Å; S133-K135 PolarHBondContact O-N 3.14Å
134	V	37.9	Very low	49.9	Very low	145 Å²	145	89 Å²	89	88%	0.879	46%	0.457	S	S	*	.	S	Bend	trans	62.4	2.7	141.3	-164.9	0	0	0	0	120.4
135	K	29.9	Very low	51.7	Low	183 Å²	183	82.6 Å²	82.6	80%	0.796	42%	0.423	S	S	*	.			trans	-137.4	119.1	164.4	-72.1	-173.5	179.2	177.7	0	112.5	S133	S133-K135 PolarHBondContact O-N 3.14Å
136	P	35.5	Very low	53.2	Low	111 Å²	111	76.4 Å²	76.4	72%	0.721	40%	0.402	S	S	*	.			trans	-80.9	157	-170.5	36.2	-35.3	0	0	0	111.3
137	R	40.3	Very low	54.4	Low	182 Å²	182	77.7 Å²	77.7	69%	0.687	39%	0.392	S	S	*	.			trans	77.4	91.5	165.5	-55.7	171.9	176.6	172.4	-11.7	115.2	D124 R147	D124-R137 IonicContact OD1-CZ 3.95Å; D124-R137 IonicContact OD1-NH2 2.86Å; D124-R137 PolarHBondContact OD1-NH2 3.42Å; R137-R147 PolarHBondContact O-NH2 2.9Å
138	L	46.7	Very low	56	Low	23 Å²	23	81.3 Å²	81.3	12%	0.12	40%	0.404	C	S	.	.			trans	-90.6	107.6	149.1	-159.9	78.5	0	0	0	105.6	L103 L105 T129 D143 R147	L103-L138 HydrophobicContact CD1-CD2 3.36Å; L105-L138 HydrophobicContact CD2-CD2 3.9Å; T129-L138 HydrophobicContact CG2-CB 3.95Å; T129-L138 HydrophobicContact CG2-CD2 3.94Å; L138-D143 HydrophobicContact CD1-CB 4.48Å; L138-R147 HydrophobicContact CD1-CG 4.36Å
139	G	60.6	Low	57.3	Low	16 Å²	16	82.3 Å²	82.3	17%	0.165	41%	0.41	C	S	.	.			trans	-86.3	-44.4	-176.3	0	0	0	0	0	112.8
140	N	75.2	Confident	58.9	Low	25 Å²	25	80.9 Å²	80.9	13%	0.134	40%	0.399	C	S	.	.	S	Bend	trans	-136.1	162.5	-156.6	-54.9	-21	0	0	0	111.8	E115 G118 F122 V142 D143 G144	E115-N140 PolarHBondContact O-OD1 3.45Å; G118-N140 VanDerWaalsContact CA-CB 3.48Å; G118-N140 WeakPolarHBondContact CA-ND2 3.49Å; F122-N140 VanDerWaalsContact CD2-OD1 3.25Å; F122-N140 WeakPolarHBondContact CD2-OD1 3.13Å; N140-V142 VanDerWaalsContact C-N 3.35Å; N140-V142 PolarHBondContact O-N 3.25Å; N140-D143 PolarHBondContact O-N 3.44Å; N140-G144 PolarHBondContact O-N 2.9Å; N140-G144 VanDerWaalsContact O-N 3.17Å
141	L	79.2	Confident	60.6	Low	2 Å²	2	77.1 Å²	77.1	1%	0.01	38%	0.381	C	S	.	.	H	α-helix	trans	-55.3	-47.7	177.2	-76.2	168.1	0	0	0	111.9	L103 L105 L116 V117 D143 G144 F145 A244 V246	L103-L141 HydrophobicContact CD2-CD2 4.42Å; L105-L141 HydrophobicContact CD1-CD2 3.99Å; L105-L141 HydrophobicContact CD1-CG 4.34Å; L116-L141 HydrophobicContact CD2-CD1 4.29Å; L116-L141 HydrophobicContact CG-CD1 3.92Å; L116-L141 HydrophobicContact CG-CG 4.28Å; L116-L141 WeakPolarHBondContact O-CG 3.31Å; L116-L141 PolarHBondContact O-N 2.82Å; V117-L141 HydrophobicContact CG2-CD1 4.41Å; L141-D143 PolarHBondContact O-N 3.15Å; L141-G144 WeakPolarHBondContact O-CA 3.5Å; L141-G144 PolarHBondContact O-N 3.2Å; L141-G144 VanDerWaalsContact O-N 3.14Å; L141-F145 WeakPolarHBondContact O-CD2 3.39Å; L141-F145 PolarHBondContact O-N 2.84Å; L141-A244 HydrophobicContact CD2-CB 3.66Å; L141-V246 HydrophobicContact CD2-CG2 3.77Å
142	V	78.2	Confident	62.8	Low	6 Å²	6	72.3 Å²	72.3	4%	0.036	37%	0.366	C	S	.	.	H	α-helix	trans	-63.6	-44.8	-175.3	173.7	0	0	0	0	112.2	V117 N140 G144 F145 I146 A156 L159 E160 L163	V117-V142 HydrophobicContact CG1-CG2 3.98Å; V117-V142 WeakPolarHBondContact O-CG2 3.31Å; V117-V142 PolarHBondContact O-N 2.98Å; N140-V142 VanDerWaalsContact C-N 3.35Å; N140-V142 PolarHBondContact O-N 3.25Å; V142-G144 VanDerWaalsContact C-N 3.26Å; V142-G144 PolarHBondContact O-N 2.93Å; V142-F145 PolarHBondContact O-N 3.19Å; V142-F145 VanDerWaalsContact O-N 3.14Å; V142-I146 HydrophobicContact CG1-CD1 3.85Å; V142-I146 HydrophobicContact CG1-CG1 4.48Å; V142-I146 VanDerWaalsContact O-CG1 3.31Å; V142-I146 WeakPolarHBondContact O-CG1 3.43Å; V142-I146 PolarHBondContact O-N 3.16Å; V142-A156 HydrophobicContact CG1-CB 4.06Å; V142-L159 HydrophobicContact CB-CD2 4.38Å; V142-L159 HydrophobicContact CG1-CD2 4.37Å; V142-L159 HydrophobicContact CG2-CD2 3.91Å; V142-L159 HydrophobicContact CG2-CG 4.35Å; V142-E160 HydrophobicContact CB-CG 4.39Å; V142-E160 HydrophobicContact CG1-CG 4.32Å; V142-E160 HydrophobicContact CG2-CG 3.54Å; V142-L163 HydrophobicContact CG2-CD1 4.42Å
143	D	76.3	Confident	64.8	Low	46 Å²	46	74.6 Å²	74.6	25%	0.246	36%	0.36	C	S	.	.	H	α-helix	trans	-59.7	-39.3	174.9	-176	29	0	0	0	111	L138 N140 L141 I146 R147	L138-D143 HydrophobicContact CD1-CB 4.48Å; N140-D143 PolarHBondContact O-N 3.44Å; L141-D143 PolarHBondContact O-N 3.15Å; D143-I146 PolarHBondContact O-N 3.02Å; D143-R147 WeakPolarHBondContact O-CB 3.48Å; D143-R147 WeakPolarHBondContact O-CG 3.26Å; D143-R147 PolarHBondContact O-N 3.41Å; D143-R147 IonicContact OD1-CZ 2.97Å; D143-R147 IonicContact OD1-NE 3.98Å; D143-R147 PolarHBondContact OD1-NE 3.37Å; D143-R147 IonicContact OD1-NH2 2.7Å; D143-R147 IonicContact OD2-CZ 3.37Å; D143-R147 IonicContact OD2-NE 2.87Å; D143-R147 PolarHBondContact OD2-NE 3.46Å; D143-R147 IonicContact OD2-NH2 3.73Å; D143-R147 PolarHBondContact OD2-NH2 3.14Å
144	G	77.7	Confident	67.1	Low	1 Å²	1	74 Å²	74	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-59.4	-45.2	172.7	0	0	0	0	0	114	N140 L141 V142 R148	N140-G144 PolarHBondContact O-N 2.9Å; N140-G144 VanDerWaalsContact O-N 3.17Å; L141-G144 WeakPolarHBondContact O-CA 3.5Å; L141-G144 PolarHBondContact O-N 3.2Å; L141-G144 VanDerWaalsContact O-N 3.14Å; V142-G144 VanDerWaalsContact C-N 3.26Å; V142-G144 PolarHBondContact O-N 2.93Å; G144-R148 WeakPolarHBondContact O-CB 3.34Å; G144-R148 PolarHBondContact O-N 3.26Å; G144-R148 VanDerWaalsContact O-N 3.15Å
145	F	80.5	Confident	69	Low	0 Å²	0	70 Å²	70	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-67.8	-36.4	178	-86.9	-105.3	0	0	0	112.7	L103 L141 V142 Q149 Y150 I151 L159 A244 L269 L271	L103-F145 HydrophobicContact CD2-CD2 4.45Å; L141-F145 WeakPolarHBondContact O-CD2 3.39Å; L141-F145 PolarHBondContact O-N 2.84Å; V142-F145 PolarHBondContact O-N 3.19Å; V142-F145 VanDerWaalsContact O-N 3.14Å; F145-Q149 PolarHBondContact O-N 2.79Å; F145-Y150 HydrophobicContact CB-CD2 4.49Å; F145-Y150 AromaticContact CD1-CD2 3.76Å; F145-Y150 HydrophobicContact CD1-CD2 3.76Å; F145-Y150 HydrophobicContact CD1-CG 4.25Å; F145-Y150 HydrophobicContact CE1-CD2 4.22Å; F145-Y150 HydrophobicContact CG-CD2 4.18Å; F145-Y150 PolarHBondContact O-N 2.79Å; F145-I151 HydrophobicContact CB-CD1 4.03Å; F145-I151 HydrophobicContact CD1-CD1 4.09Å; F145-I151 HydrophobicContact CG-CD1 4.41Å; F145-L159 HydrophobicContact CB-CD2 4.12Å; F145-L159 HydrophobicContact CG-CD2 4.32Å; F145-A244 HydrophobicContact CE2-CB 3.7Å; F145-A244 HydrophobicContact CZ-CB 4.27Å; F145-L269 HydrophobicContact CE2-CD2 3.7Å; F145-L269 HydrophobicContact CE2-CG 4.44Å; F145-L269 HydrophobicContact CZ-CD2 3.78Å; F145-L269 HydrophobicContact CZ-CG 4.12Å; F145-L271 HydrophobicContact CE1-CB 4.45Å; F145-L271 HydrophobicContact CE1-CD1 4.19Å; F145-L271 HydrophobicContact CZ-CD1 4.5Å
146	I	76.9	Confident	71.2	Confident	36 Å²	36	61.8 Å²	61.8	19%	0.185	30%	0.299	C	S	.	.	H	α-helix	trans	-66.8	-48.5	176	-65.9	165.5	0	0	0	110.5	V142 D143 R148 Q149 Y153 A156	V142-I146 HydrophobicContact CG1-CD1 3.85Å; V142-I146 HydrophobicContact CG1-CG1 4.48Å; V142-I146 VanDerWaalsContact O-CG1 3.31Å; V142-I146 WeakPolarHBondContact O-CG1 3.43Å; V142-I146 PolarHBondContact O-N 3.16Å; D143-I146 PolarHBondContact O-N 3.02Å; I146-R148 VanDerWaalsContact C-N 3.32Å; I146-R148 PolarHBondContact O-N 2.92Å; I146-Q149 WeakPolarHBondContact O-CA 3.34Å; I146-Q149 PolarHBondContact O-N 2.8Å; I146-Y153 HydrophobicContact CD1-CD2 4.39Å; I146-Y153 HydrophobicContact CG2-CD2 4.27Å; I146-A156 HydrophobicContact CD1-CB 3.74Å
147	R	72.1	Confident	73.2	Confident	127 Å²	127	62.3 Å²	62.3	48%	0.479	30%	0.296	S	S	.	.	H	α-helix	trans	-66.4	-32.5	-177.3	-71.1	-169.9	-160	-169.2	6.6	113.5	R137 L138 D143 Q149	R137-R147 PolarHBondContact O-NH2 2.9Å; L138-R147 HydrophobicContact CD1-CG 4.36Å; D143-R147 WeakPolarHBondContact O-CB 3.48Å; D143-R147 WeakPolarHBondContact O-CG 3.26Å; D143-R147 PolarHBondContact O-N 3.41Å; D143-R147 IonicContact OD1-CZ 2.97Å; D143-R147 IonicContact OD1-NE 3.98Å; D143-R147 PolarHBondContact OD1-NE 3.37Å; D143-R147 IonicContact OD1-NH2 2.7Å; D143-R147 IonicContact OD2-CZ 3.37Å; D143-R147 IonicContact OD2-NE 2.87Å; D143-R147 PolarHBondContact OD2-NE 3.46Å; D143-R147 IonicContact OD2-NH2 3.73Å; D143-R147 PolarHBondContact OD2-NH2 3.14Å; R147-Q149 PolarHBondContact O-N 3.46Å
148	R	77.8	Confident	75.1	Confident	87 Å²	87	58.8 Å²	58.8	33%	0.328	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-0.4	171.4	-76.2	-91.6	-171.3	173.9	6.5	113.2	D101 G102 G144 I146 Y150	D101-R148 PolarHBondContact O-NH1 3.32Å; D101-R148 PolarHBondContact O-NH2 2.97Å; G102-R148 PolarHBondContact O-NH2 2.9Å; G144-R148 WeakPolarHBondContact O-CB 3.34Å; G144-R148 PolarHBondContact O-N 3.26Å; G144-R148 VanDerWaalsContact O-N 3.15Å; I146-R148 VanDerWaalsContact C-N 3.32Å; I146-R148 PolarHBondContact O-N 2.92Å; R148-Y150 HydrophobicContact CB-CD2 3.51Å; R148-Y150 HydrophobicContact CB-CE1 4.41Å; R148-Y150 HydrophobicContact CB-CE2 3.31Å; R148-Y150 HydrophobicContact CB-CG 4.13Å; R148-Y150 HydrophobicContact CG-CD2 4.38Å; R148-Y150 HydrophobicContact CG-CE2 3.78Å; R148-Y150 PolarHBondContact O-N 2.81Å
149	Q	76.3	Confident	76.7	Confident	159 Å²	159	57.7 Å²	57.7	74%	0.743	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	24.2	-178.2	-56.4	-179.9	-8.2	0	0	114.2	F145 I146 R147 I151	F145-Q149 PolarHBondContact O-N 2.79Å; I146-Q149 WeakPolarHBondContact O-CA 3.34Å; I146-Q149 PolarHBondContact O-N 2.8Å; R147-Q149 PolarHBondContact O-N 3.46Å; Q149-I151 PolarHBondContact O-N 3.25Å
150	Y	79.4	Confident	77.7	Confident	27 Å²	27	58.9 Å²	58.9	11%	0.106	28%	0.283	C	S	.	.	S	Bend	trans	-68.6	-30.2	173	-62.2	-46.6	0	0	0	111.2	D101 F145 R148 V238 K239	D101-Y150 PolarHBondContact O-OH 2.73Å; F145-Y150 HydrophobicContact CB-CD2 4.49Å; F145-Y150 AromaticContact CD1-CD2 3.76Å; F145-Y150 HydrophobicContact CD1-CD2 3.76Å; F145-Y150 HydrophobicContact CD1-CG 4.25Å; F145-Y150 HydrophobicContact CE1-CD2 4.22Å; F145-Y150 HydrophobicContact CG-CD2 4.18Å; F145-Y150 PolarHBondContact O-N 2.79Å; R148-Y150 HydrophobicContact CB-CD2 3.51Å; R148-Y150 HydrophobicContact CB-CE1 4.41Å; R148-Y150 HydrophobicContact CB-CE2 3.31Å; R148-Y150 HydrophobicContact CB-CG 4.13Å; R148-Y150 HydrophobicContact CG-CD2 4.38Å; R148-Y150 HydrophobicContact CG-CE2 3.78Å; R148-Y150 PolarHBondContact O-N 2.81Å; Y150-V238 WeakPolarHBondContact O-CA 3.32Å; Y150-V238 VanDerWaalsContact O-CG1 3.3Å; Y150-V238 WeakPolarHBondContact O-CG1 3.47Å; Y150-K239 PolarHBondContact O-N 2.76Å
151	I	78.2	Confident	78	Confident	6 Å²	6	64.2 Å²	64.2	3%	0.031	31%	0.307	C	S	.	.	S	Bend	trans	-134.7	147.2	-174.3	-59.8	174.5	0	0	0	109.5	F145 Q149 M155 L159 V238	F145-I151 HydrophobicContact CB-CD1 4.03Å; F145-I151 HydrophobicContact CD1-CD1 4.09Å; F145-I151 HydrophobicContact CG-CD1 4.41Å; Q149-I151 PolarHBondContact O-N 3.25Å; I151-M155 HydrophobicContact CG2-CB 3.72Å; I151-L159 HydrophobicContact CD1-CB 4.03Å; I151-L159 HydrophobicContact CD1-CD1 3.74Å; I151-L159 HydrophobicContact CD1-CD2 3.2Å; I151-L159 HydrophobicContact CD1-CG 3.8Å; I151-V238 HydrophobicContact CD1-CG2 3.96Å; I151-V238 HydrophobicContact CG1-CB 4.36Å; I151-V238 HydrophobicContact CG1-CG1 4.22Å; I151-V238 HydrophobicContact CG1-CG2 3.91Å
152	E	78.8	Confident	78.2	Confident	91 Å²	91	64.2 Å²	64.2	43%	0.425	31%	0.307	S	S	.	.			trans	-75.9	143.7	171.2	-63	-172.1	165.3	0	0	111.2	A154 M155 K239	E152-A154 PolarHBondContact O-N 2.88Å; E152-M155 PolarHBondContact O-N 3.1Å; E152-K239 WeakPolarHBondContact OE1-CE 3.47Å; E152-K239 IonicContact OE1-NZ 3.98Å; E152-K239 PolarHBondContact OE1-NZ 2.98Å
153	Y	74.5	Confident	78.4	Confident	194 Å²	194	64 Å²	64	76%	0.761	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-52.3	-33.3	179.4	-173.2	-93.3	0	0	0	113.3	I146 M155 A156	I146-Y153 HydrophobicContact CD1-CD2 4.39Å; I146-Y153 HydrophobicContact CG2-CD2 4.27Å; Y153-M155 PolarHBondContact O-N 3.4Å; Y153-A156 WeakPolarHBondContact O-CB 3.38Å; Y153-A156 PolarHBondContact O-N 3.38Å
154	A	76.2	Confident	78.6	Confident	86 Å²	86	64.5 Å²	64.5	71%	0.711	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-67	-18.7	178	0	0	0	0	0	114.7	E152	E152-A154 PolarHBondContact O-N 2.88Å
155	M	78.9	Confident	78.7	Confident	62 Å²	62	64.7 Å²	64.7	31%	0.305	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-101.5	5.7	-178.9	-67	-178.7	172.2	0	0	112.9	I151 E152 Y153 D157 Q158 L159 L237	I151-M155 HydrophobicContact CG2-CB 3.72Å; E152-M155 PolarHBondContact O-N 3.1Å; Y153-M155 PolarHBondContact O-N 3.4Å; M155-D157 PolarHBondContact O-N 3.3Å; M155-Q158 PolarHBondContact O-N 3.15Å; M155-L159 PolarHBondContact O-N 2.94Å; M155-L159 VanDerWaalsContact O-N 3.08Å; M155-L237 HydrophobicContact SD-CD2 4.41Å
156	A	75.8	Confident	78.4	Confident	10 Å²	10	68.4 Å²	68.4	8%	0.083	33%	0.333	C	S	.	.	H	α-helix	trans	-56.3	-50	-178.5	0	0	0	0	0	112.5	V142 I146 Y153 Q158 L159 E160	V142-A156 HydrophobicContact CG1-CB 4.06Å; I146-A156 HydrophobicContact CD1-CB 3.74Å; Y153-A156 WeakPolarHBondContact O-CB 3.38Å; Y153-A156 PolarHBondContact O-N 3.38Å; A156-Q158 PolarHBondContact O-N 3.1Å; A156-L159 WeakPolarHBondContact O-CB 3.29Å; A156-L159 PolarHBondContact O-N 3.31Å; A156-L159 VanDerWaalsContact O-N 3.11Å; A156-E160 PolarHBondContact O-N 3.48Å
157	D	78.1	Confident	78.5	Confident	123 Å²	123	68.4 Å²	68.4	66%	0.658	33%	0.332	S	S	*	.	H	α-helix	trans	-61.7	-33.7	-179.8	-60.3	-12.3	0	0	0	112.3	M155 E160 H161	M155-D157 PolarHBondContact O-N 3.3Å; D157-E160 PolarHBondContact O-N 3.32Å; D157-H161 PolarHBondContact O-N 2.87Å
158	Q	79.2	Confident	78.3	Confident	107 Å²	107	66.8 Å²	66.8	50%	0.5	33%	0.33	S	S	.	.	H	α-helix	trans	-71.1	-37.7	177.7	-66.2	-177.6	-29.8	0	0	111.4	M155 A156 L162 L237	M155-Q158 PolarHBondContact O-N 3.15Å; A156-Q158 PolarHBondContact O-N 3.1Å; Q158-L162 WeakPolarHBondContact O-CB 3.49Å; Q158-L162 PolarHBondContact O-N 2.92Å; Q158-L237 HydrophobicContact CB-CD1 4.12Å; Q158-L237 HydrophobicContact CB-CD2 3.87Å; Q158-L237 VanDerWaalsContact OE1-CD2 3.25Å
159	L	81.3	Confident	77.7	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-64.7	-44.5	172.7	-179.8	68.4	0	0	0	111	V142 F145 I151 M155 A156 H161 L162 L163 L271	V142-L159 HydrophobicContact CB-CD2 4.38Å; V142-L159 HydrophobicContact CG1-CD2 4.37Å; V142-L159 HydrophobicContact CG2-CD2 3.91Å; V142-L159 HydrophobicContact CG2-CG 4.35Å; F145-L159 HydrophobicContact CB-CD2 4.12Å; F145-L159 HydrophobicContact CG-CD2 4.32Å; I151-L159 HydrophobicContact CD1-CB 4.03Å; I151-L159 HydrophobicContact CD1-CD1 3.74Å; I151-L159 HydrophobicContact CD1-CD2 3.2Å; I151-L159 HydrophobicContact CD1-CG 3.8Å; M155-L159 PolarHBondContact O-N 2.94Å; M155-L159 VanDerWaalsContact O-N 3.08Å; A156-L159 WeakPolarHBondContact O-CB 3.29Å; A156-L159 PolarHBondContact O-N 3.31Å; A156-L159 VanDerWaalsContact O-N 3.11Å; L159-H161 VanDerWaalsContact C-N 3.34Å; L159-H161 PolarHBondContact O-N 3.4Å; L159-L162 WeakPolarHBondContact O-CB 3.41Å; L159-L162 PolarHBondContact O-N 3.47Å; L159-L162 VanDerWaalsContact O-N 3.14Å; L159-L163 HydrophobicContact CD1-CD1 4.27Å; L159-L163 HydrophobicContact CD1-CG 4.17Å; L159-L163 HydrophobicContact CD2-CD1 4.37Å; L159-L163 HydrophobicContact CG-CD1 4.03Å; L159-L163 HydrophobicContact CG-CG 4.29Å; L159-L163 WeakPolarHBondContact O-CG 3.25Å; L159-L163 PolarHBondContact O-N 3.34Å; L159-L271 HydrophobicContact CD1-CD1 3.56Å
160	E	81.6	Confident	76.8	Confident	41 Å²	41	58 Å²	58	19%	0.192	29%	0.291	C	S	.	.	H	α-helix	trans	-56	-49	176.5	-77.2	-176	-171	0	0	111.7	V117 V142 A156 D157 L162 L163 L164	V117-E160 HydrophobicContact CG1-CB 4.36Å; V117-E160 HydrophobicContact CG1-CG 4.11Å; V142-E160 HydrophobicContact CB-CG 4.39Å; V142-E160 HydrophobicContact CG1-CG 4.32Å; V142-E160 HydrophobicContact CG2-CG 3.54Å; A156-E160 PolarHBondContact O-N 3.48Å; D157-E160 PolarHBondContact O-N 3.32Å; E160-L162 VanDerWaalsContact C-N 3.3Å; E160-L162 PolarHBondContact O-N 2.85Å; E160-L163 PolarHBondContact O-N 3.1Å; E160-L164 WeakPolarHBondContact O-CB 3.3Å; E160-L164 WeakPolarHBondContact O-CG 3.09Å; E160-L164 PolarHBondContact O-N 3.33Å
161	H	81.3	Confident	75.6	Confident	137 Å²	137	62.2 Å²	62.2	63%	0.634	31%	0.31	S	S	*	.	H	α-helix	trans	-62.2	-37.1	177	-176.3	-85.2	0	0	0	112.3	D157 L159 S165	D157-H161 PolarHBondContact O-N 2.87Å; L159-H161 VanDerWaalsContact C-N 3.34Å; L159-H161 PolarHBondContact O-N 3.4Å; H161-S165 PolarHBondContact O-N 2.97Å; H161-S165 VanDerWaalsContact O-N 3.13Å
162	L	83.6	Confident	73.9	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-67.3	-46	177.4	-173.9	156.5	0	0	0	112	L48 F57 W59 Q158 L159 E160 L164 S165 T235 L237	L48-L162 HydrophobicContact CD1-CD2 3.98Å; L48-L162 HydrophobicContact CD1-CG 4.37Å; L48-L162 HydrophobicContact CD2-CD1 4.01Å; L48-L162 HydrophobicContact CD2-CD2 3.88Å; L48-L162 HydrophobicContact CD2-CG 4.19Å; F57-L162 HydrophobicContact CB-CG 4.4Å; F57-L162 HydrophobicContact CD1-CD1 4.45Å; F57-L162 HydrophobicContact CD2-CD1 3.92Å; F57-L162 HydrophobicContact CD2-CG 4.14Å; F57-L162 HydrophobicContact CE2-CD1 4.01Å; F57-L162 HydrophobicContact CG-CD1 4.15Å; F57-L162 HydrophobicContact CG-CG 4.21Å; F57-L162 HydrophobicContact CZ-CD1 4.32Å; W59-L162 HydrophobicContact CZ2-CD2 4.03Å; W59-L162 PolarHBondContact NE1-O 3.4Å; Q158-L162 WeakPolarHBondContact O-CB 3.49Å; Q158-L162 PolarHBondContact O-N 2.92Å; L159-L162 WeakPolarHBondContact O-CB 3.41Å; L159-L162 PolarHBondContact O-N 3.47Å; L159-L162 VanDerWaalsContact O-N 3.14Å; E160-L162 VanDerWaalsContact C-N 3.3Å; E160-L162 PolarHBondContact O-N 2.85Å; L162-L164 VanDerWaalsContact C-N 3.32Å; L162-L164 PolarHBondContact O-N 3.47Å; L162-S165 WeakPolarHBondContact O-CB 3.43Å; L162-S165 PolarHBondContact O-N 3.34Å; L162-S165 VanDerWaalsContact O-N 3.16Å; L162-S165 PolarHBondContact O-OG 3.39Å; L162-T235 HydrophobicContact CD1-CG2 3.47Å; L162-T235 VanDerWaalsContact CD1-CG2 3.47Å; L162-T235 HydrophobicContact CD2-CG2 4.42Å; L162-L237 HydrophobicContact CB-CD1 4.34Å; L162-L237 HydrophobicContact CD1-CD1 3.59Å
163	L	81.6	Confident	72.3	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-64.8	-39.5	178.6	-67	178	0	0	0	111.1	W59 F113 V117 V142 L159 E160 S165 L269 L271	W59-L163 HydrophobicContact CZ2-CD2 4.32Å; F113-L163 WeakPolarHBondContact CE1-O 3.49Å; V117-L163 HydrophobicContact CG1-CB 3.99Å; V117-L163 HydrophobicContact CG1-CD1 3.96Å; V117-L163 HydrophobicContact CG2-CB 3.83Å; V117-L163 HydrophobicContact CG2-CD1 4.21Å; V142-L163 HydrophobicContact CG2-CD1 4.42Å; L159-L163 HydrophobicContact CD1-CD1 4.27Å; L159-L163 HydrophobicContact CD1-CG 4.17Å; L159-L163 HydrophobicContact CD2-CD1 4.37Å; L159-L163 HydrophobicContact CG-CD1 4.03Å; L159-L163 HydrophobicContact CG-CG 4.29Å; L159-L163 WeakPolarHBondContact O-CG 3.25Å; L159-L163 PolarHBondContact O-N 3.34Å; E160-L163 PolarHBondContact O-N 3.1Å; L163-S165 PolarHBondContact O-N 3.33Å; L163-L269 HydrophobicContact CD1-CD2 3.99Å; L163-L269 HydrophobicContact CD2-CD1 3.57Å; L163-L269 HydrophobicContact CD2-CD2 3.55Å; L163-L269 HydrophobicContact CD2-CG 4.22Å; L163-L269 HydrophobicContact CG-CD2 4.45Å; L163-L271 HydrophobicContact CD2-CD1 4.46Å
164	L	81.1	Confident	70.7	Confident	56 Å²	56	56.8 Å²	56.8	29%	0.293	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	2.6	176.2	-67.7	172.4	0	0	0	114.6	F113 A114 V117 K119 E160 L162	F113-L164 HydrophobicContact CD1-CD2 4.03Å; F113-L164 HydrophobicContact CE1-CD2 4.48Å; A114-L164 HydrophobicContact CB-CD2 4.04Å; V117-L164 HydrophobicContact CG1-CG 4.44Å; V117-L164 HydrophobicContact CG2-CD2 4.45Å; K119-L164 HydrophobicContact CB-CD1 4.33Å; K119-L164 HydrophobicContact CD-CD1 3.56Å; E160-L164 WeakPolarHBondContact O-CB 3.3Å; E160-L164 WeakPolarHBondContact O-CG 3.09Å; E160-L164 PolarHBondContact O-N 3.33Å; L162-L164 VanDerWaalsContact C-N 3.32Å; L162-L164 PolarHBondContact O-N 3.47Å
165	S	79	Confident	69.2	Low	6 Å²	6	59 Å²	59	4%	0.042	30%	0.295	C	S	.	.	S	Bend	trans	-60.6	151.9	179.1	67.8	0	0	0	0	112.3	F57 W59 H161 L162 L163 K167	F57-S165 VanDerWaalsContact O-CB 3.3Å; F57-S165 WeakPolarHBondContact O-CB 3.34Å; W59-S165 PolarHBondContact NE1-OG 3.15Å; W59-S165 VanDerWaalsContact NE1-OG 3.15Å; H161-S165 PolarHBondContact O-N 2.97Å; H161-S165 VanDerWaalsContact O-N 3.13Å; L162-S165 WeakPolarHBondContact O-CB 3.43Å; L162-S165 PolarHBondContact O-N 3.34Å; L162-S165 VanDerWaalsContact O-N 3.16Å; L162-S165 PolarHBondContact O-OG 3.39Å; L163-S165 PolarHBondContact O-N 3.33Å; S165-K167 PolarHBondContact O-N 3.38Å
166	P	75.6	Confident	67.5	Low	78 Å²	78	63.8 Å²	63.8	51%	0.506	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-61.9	135.8	-173.8	23.6	-33.7	0	0	0	111.6	I58 W59	I58-P166 HydrophobicContact CG1-CG 4.33Å; W59-P166 PolarHBondContact N-O 3.16Å; W59-P166 VanDerWaalsContact N-O 3.14Å
167	K	77.4	Confident	65.8	Low	35 Å²	35	66.7 Å²	66.7	15%	0.152	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	117.2	176.2	-53.1	-168.7	174.2	73.5	0	110	L46 W59 F113 S165 Y169 L257	L46-K167 HydrophobicContact CD2-CB 4.07Å; L46-K167 HydrophobicContact CD2-CD 4.1Å; L46-K167 HydrophobicContact CD2-CG 4.35Å; W59-K167 HydrophobicContact CB-CB 4.28Å; W59-K167 HydrophobicContact CB-CG 3.94Å; W59-K167 HydrophobicContact CG-CG 4.3Å; W59-K167 CarbonylContact O-C 3.6Å; F113-K167 VanDerWaalsContact CE1-NZ 3.33Å; S165-K167 PolarHBondContact O-N 3.38Å; K167-Y169 HydrophobicContact CB-CE2 3.81Å; K167-Y169 WeakPolarHBondContact CD-OH 3.32Å; K167-L257 HydrophobicContact CD-CD1 4.39Å
168	H	69.5	Low	64.1	Low	93 Å²	93	65.4 Å²	65.4	43%	0.431	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	103.7	177	-88.9	-102	0	0	0	110.2	I58 W59 R60 E61	I58-H168 HydrophobicContact CG2-CB 3.96Å; I58-H168 WeakPolarHBondContact CG2-CD2 3.5Å; W59-H168 PolarHBondContact O-N 3.36Å; R60-H168 WeakPolarHBondContact CA-O 3.41Å; R60-H168 HydrophobicContact CG-CB 4.4Å; E61-H168 PolarHBondContact N-O 3.04Å; E61-H168 VanDerWaalsContact N-O 3.17Å
169	Y	65.1	Low	62.6	Low	41 Å²	41	67.4 Å²	67.4	16%	0.161	32%	0.319	C	S	.	.			trans	-86	156.1	168.9	-54.6	-78.6	0	0	0	110.9	L46 E61 K167 K171 L257 S258 Q259	L46-Y169 HydrophobicContact CD2-CD1 4.48Å; L46-Y169 HydrophobicContact CD2-CE1 3.78Å; E61-Y169 HydrophobicContact CB-CD1 4.21Å; E61-Y169 HydrophobicContact CG-CD1 4.41Å; K167-Y169 HydrophobicContact CB-CE2 3.81Å; K167-Y169 WeakPolarHBondContact CD-OH 3.32Å; Y169-K171 PolarHBondContact O-N 3.26Å; Y169-L257 PolarHBondContact OH-O 3.23Å; Y169-S258 VanDerWaalsContact CZ-C 3.46Å; Y169-S258 VanDerWaalsContact OH-C 3.31Å; Y169-S258 WeakPolarHBondContact OH-CA 3.42Å; Y169-S258 PolarHBondContact OH-N 3.46Å; Y169-Q259 HydrophobicContact CD1-CB 3.43Å; Y169-Q259 VanDerWaalsContact CD1-CB 3.43Å; Y169-Q259 HydrophobicContact CD1-CG 3.9Å; Y169-Q259 HydrophobicContact CD2-CB 4.38Å; Y169-Q259 HydrophobicContact CD2-CG 4.49Å; Y169-Q259 HydrophobicContact CE1-CB 3.77Å; Y169-Q259 VanDerWaalsContact CE1-N 3.35Å; Y169-Q259 HydrophobicContact CG-CB 3.77Å; Y169-Q259 HydrophobicContact CG-CG 3.79Å
170	M	57.2	Low	61	Low	21 Å²	21	71.6 Å²	71.6	10%	0.103	35%	0.345	C	S	.	.			trans	-59.5	105.8	173.2	-174.2	-174.5	-77.8	0	0	109.3	E61 V72 G76 R78 W79 E172	E61-M170 PolarHBondContact OE2-N 3.25Å; V72-M170 HydrophobicContact CB-CE 4.03Å; V72-M170 HydrophobicContact CG1-CE 3.51Å; V72-M170 HydrophobicContact CG2-CE 3.77Å; G76-M170 WeakPolarHBondContact O-CE 3.4Å; R78-M170 VanDerWaalsContact C-CE 3.45Å; W79-M170 VanDerWaalsContact CD1-SD 3.51Å; W79-M170 HydrophobicContact CD2-CE 4.31Å; W79-M170 HydrophobicContact CD2-SD 4.33Å; W79-M170 HydrophobicContact CG-CE 4.39Å; W79-M170 HydrophobicContact CG-SD 4.1Å; W79-M170 HydrophobicContact CZ2-CB 4.31Å; W79-M170 PolarHBondContact NE1-SD 3.37Å; W79-M170 VanDerWaalsContact NE1-SD 3.38Å; M170-E172 HydrophobicContact CG-CG 4.48Å; M170-E172 PolarHBondContact O-N 2.89Å; M170-E172 HydrophobicContact SD-CG 4.25Å
171	K	53	Low	59.2	Low	116 Å²	116	74.1 Å²	74.1	50%	0.504	36%	0.359	S	S	.	.			trans	-83.5	88.7	168.4	-74.5	176.4	-175.2	158.9	0	107.3	Y169 S173 L174	Y169-K171 PolarHBondContact O-N 3.26Å; K171-S173 PolarHBondContact O-N 3.27Å; K171-L174 HydrophobicContact CB-CB 4.34Å; K171-L174 HydrophobicContact CD-CD2 4.31Å
172	E	43.5	Very low	57.6	Low	97 Å²	97	70.2 Å²	70.2	45%	0.453	35%	0.347	S	S	.	.	S	Bend	trans	-50	121.1	169.6	-77.5	-178.1	165.1	0	0	108.9	M170 L174	M170-E172 HydrophobicContact CG-CG 4.48Å; M170-E172 PolarHBondContact O-N 2.89Å; M170-E172 HydrophobicContact SD-CG 4.25Å; E172-L174 VanDerWaalsContact C-N 3.29Å; E172-L174 PolarHBondContact O-N 3Å
173	S	44.6	Very low	55.9	Low	68 Å²	68	77.4 Å²	77.4	48%	0.476	38%	0.378	S	S	.	.	S	Bend	trans	64.3	-8.6	166.9	73.5	0	0	0	0	120.5	K171 E175 L177	K171-S173 PolarHBondContact O-N 3.27Å; S173-E175 PolarHBondContact O-N 3.39Å; S173-L177 VanDerWaalsContact O-CB 3.3Å; S173-L177 WeakPolarHBondContact O-CB 3.31Å; S173-L177 PolarHBondContact O-N 3.39Å
174	L	41.3	Very low	54.3	Low	12 Å²	12	81.4 Å²	81.4	6%	0.063	40%	0.403	C	S	.	.	H	α-helix	trans	-67.6	-37.1	-170.1	-158	77.1	0	0	0	114.3	K171 E172 K178 L206 L209 K210	K171-L174 HydrophobicContact CB-CB 4.34Å; K171-L174 HydrophobicContact CD-CD2 4.31Å; E172-L174 VanDerWaalsContact C-N 3.29Å; E172-L174 PolarHBondContact O-N 3Å; L174-K178 VanDerWaalsContact O-CB 3.29Å; L174-K178 WeakPolarHBondContact O-CB 3.42Å; L174-K178 VanDerWaalsContact O-CG 3.22Å; L174-K178 WeakPolarHBondContact O-CG 3.44Å; L174-K178 PolarHBondContact O-N 3.44Å; L174-L206 HydrophobicContact CD1-CD1 3.81Å; L174-L206 HydrophobicContact CD2-CD1 4.06Å; L174-L206 HydrophobicContact CD2-CG 4.38Å; L174-L206 HydrophobicContact CG-CD1 3.99Å; L174-L209 HydrophobicContact CD1-CD2 4.09Å; L174-K210 HydrophobicContact CD2-CG 4.17Å
175	E	43.8	Very low	52.7	Low	133 Å²	133	83.6 Å²	83.6	62%	0.621	41%	0.414	S	S	*	.	H	α-helix	trans	-81.3	-32.5	-177.1	-74.8	-170.6	-180	0	0	113.9	S173 K178 K179	S173-E175 PolarHBondContact O-N 3.39Å; E175-K178 PolarHBondContact O-N 3.3Å; E175-K179 WeakPolarHBondContact O-CB 3.49Å; E175-K179 PolarHBondContact O-N 3.25Å
176	R	43.5	Very low	50.6	Low	162 Å²	162	91.3 Å²	91.3	61%	0.611	45%	0.447	S	S	*	.	H	α-helix	trans	-71.7	-40.1	169.6	-71.8	-171	-169.4	-168.1	4.9	110.9	E77 K179 V180	E77-R176 IonicContact OE1-CZ 2.66Å; E77-R176 VanDerWaalsContact OE1-CZ 3.31Å; E77-R176 IonicContact OE1-NE 2.75Å; E77-R176 PolarHBondContact OE1-NE 2.82Å; E77-R176 IonicContact OE1-NH2 3.85Å; E77-R176 PolarHBondContact OE1-NH2 3.26Å; E77-R176 IonicContact OE2-CZ 3.39Å; E77-R176 IonicContact OE2-NH2 3.76Å; E77-R176 PolarHBondContact OE2-NH2 3Å; R176-K179 CarbonylContact O-C 2.9Å; R176-K179 PolarHBondContact O-N 3.02Å; R176-V180 WeakPolarHBondContact O-CB 3.47Å; R176-V180 VanDerWaalsContact O-CG2 3.24Å; R176-V180 WeakPolarHBondContact O-CG2 3.43Å; R176-V180 PolarHBondContact O-N 3.48Å
177	L	40.5	Very low	48.7	Very low	71 Å²	71	94 Å²	94	37%	0.372	46%	0.457	S	S	.	.	H	α-helix	trans	-63.3	-40.8	171	-86.1	163.3	0	0	0	111.4	S173 K179 V180 L181 L209	S173-L177 VanDerWaalsContact O-CB 3.3Å; S173-L177 WeakPolarHBondContact O-CB 3.31Å; S173-L177 PolarHBondContact O-N 3.39Å; L177-K179 VanDerWaalsContact C-N 3.34Å; L177-K179 PolarHBondContact O-N 2.87Å; L177-V180 PolarHBondContact O-N 3.48Å; L177-L181 HydrophobicContact CB-CD1 4.39Å; L177-L181 WeakPolarHBondContact O-CA 3.43Å; L177-L181 WeakPolarHBondContact O-CB 3.49Å; L177-L181 WeakPolarHBondContact O-CD1 3.36Å; L177-L181 WeakPolarHBondContact O-CG 3.23Å; L177-L181 PolarHBondContact O-N 3.47Å; L177-L209 HydrophobicContact CD1-CD2 4.21Å
178	K	43	Very low	46.6	Very low	96 Å²	96	100.7 Å²	100.7	42%	0.417	49%	0.486	S	S	.	.	H	α-helix	trans	-58.1	-43.6	170.5	-83.4	-179.8	177.2	-165.2	0	111.9	L174 E175 S182 L206	L174-K178 VanDerWaalsContact O-CB 3.29Å; L174-K178 WeakPolarHBondContact O-CB 3.42Å; L174-K178 VanDerWaalsContact O-CG 3.22Å; L174-K178 WeakPolarHBondContact O-CG 3.44Å; L174-K178 PolarHBondContact O-N 3.44Å; E175-K178 PolarHBondContact O-N 3.3Å; K178-S182 WeakPolarHBondContact O-CA 3.14Å; K178-S182 WeakPolarHBondContact O-CB 3.46Å; K178-S182 PolarHBondContact O-N 3.39Å; K178-S182 PolarHBondContact O-OG 3Å; K178-L206 HydrophobicContact CD-CD1 4.38Å; K178-L206 VanDerWaalsContact CE-CD1 3.41Å; K178-L206 HydrophobicContact CG-CD1 4.12Å
179	K	46.7	Very low	44.8	Very low	148 Å²	148	105 Å²	105	64%	0.643	50%	0.504	S	S	*	.	H	α-helix	trans	-65.5	-47.6	176.3	-86.2	-180	178.3	173.9	0	111.6	E175 R176 L177 S182 F183	E175-K179 WeakPolarHBondContact O-CB 3.49Å; E175-K179 PolarHBondContact O-N 3.25Å; R176-K179 CarbonylContact O-C 2.9Å; R176-K179 PolarHBondContact O-N 3.02Å; L177-K179 VanDerWaalsContact C-N 3.34Å; L177-K179 PolarHBondContact O-N 2.87Å; K179-S182 WeakPolarHBondContact CA-OG 3.16Å; K179-S182 PolarHBondContact O-N 2.85Å; K179-S182 PolarHBondContact O-OG 2.81Å; K179-F183 WeakPolarHBondContact O-CB 3.2Å; K179-F183 WeakPolarHBondContact O-CD2 3.34Å; K179-F183 PolarHBondContact O-N 2.92Å
180	V	48.4	Very low	43.2	Very low	90 Å²	90	113 Å²	113	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-61.6	-50.2	177.8	172.9	0	0	0	0	110.7	R176 L177 S182 F183 T184	R176-V180 WeakPolarHBondContact O-CB 3.47Å; R176-V180 VanDerWaalsContact O-CG2 3.24Å; R176-V180 WeakPolarHBondContact O-CG2 3.43Å; R176-V180 PolarHBondContact O-N 3.48Å; L177-V180 PolarHBondContact O-N 3.48Å; V180-S182 VanDerWaalsContact C-N 3.35Å; V180-S182 PolarHBondContact O-N 3.33Å; V180-F183 WeakPolarHBondContact O-CB 3.48Å; V180-F183 PolarHBondContact O-N 3.39Å; V180-T184 PolarHBondContact O-N 3.31Å; V180-T184 PolarHBondContact O-OG1 2.97Å
181	L	44.5	Very low	41.8	Very low	94 Å²	94	116.3 Å²	116.3	49%	0.492	56%	0.564	S	S	.	*	H	α-helix	trans	-61.4	-39.5	174.3	-81.1	153	0	0	0	111.7	L177 F183 T184 I185	L177-L181 HydrophobicContact CB-CD1 4.39Å; L177-L181 WeakPolarHBondContact O-CA 3.43Å; L177-L181 WeakPolarHBondContact O-CB 3.49Å; L177-L181 WeakPolarHBondContact O-CD1 3.36Å; L177-L181 WeakPolarHBondContact O-CG 3.23Å; L177-L181 PolarHBondContact O-N 3.47Å; L181-F183 VanDerWaalsContact C-N 3.33Å; L181-T184 WeakPolarHBondContact CA-OG1 3.28Å; L181-T184 PolarHBondContact O-N 3.27Å; L181-I185 WeakPolarHBondContact O-CB 3.16Å; L181-I185 WeakPolarHBondContact O-CD1 3.48Å; L181-I185 WeakPolarHBondContact O-CG1 3.26Å; L181-I185 PolarHBondContact O-N 3.12Å
182	S	47.6	Very low	40.6	Very low	55 Å²	55	116 Å²	116	39%	0.385	58%	0.577	S	S	.	*	H	α-helix	trans	-69	-31.8	176.6	72.7	0	0	0	0	112.6	K178 K179 V180 K186	K178-S182 WeakPolarHBondContact O-CA 3.14Å; K178-S182 WeakPolarHBondContact O-CB 3.46Å; K178-S182 PolarHBondContact O-N 3.39Å; K178-S182 PolarHBondContact O-OG 3Å; K179-S182 WeakPolarHBondContact CA-OG 3.16Å; K179-S182 PolarHBondContact O-N 2.85Å; K179-S182 PolarHBondContact O-OG 2.81Å; V180-S182 VanDerWaalsContact C-N 3.35Å; V180-S182 PolarHBondContact O-N 3.33Å; S182-K186 WeakPolarHBondContact O-CB 3.25Å; S182-K186 PolarHBondContact O-N 3.03Å
183	F	47.3	Very low	39.8	Very low	152 Å²	152	118.8 Å²	118.8	67%	0.667	60%	0.595	S	S	*	*	H	α-helix	trans	-66.2	-44.4	168.8	-101.1	-84.2	0	0	0	110.3	K179 V180 L181 I185 K186 D187	K179-F183 WeakPolarHBondContact O-CB 3.2Å; K179-F183 WeakPolarHBondContact O-CD2 3.34Å; K179-F183 PolarHBondContact O-N 2.92Å; V180-F183 WeakPolarHBondContact O-CB 3.48Å; V180-F183 PolarHBondContact O-N 3.39Å; L181-F183 VanDerWaalsContact C-N 3.33Å; F183-I185 VanDerWaalsContact C-N 3.3Å; F183-I185 PolarHBondContact O-N 3.16Å; F183-K186 PolarHBondContact O-N 3.28Å; F183-D187 PolarHBondContact O-N 3.46Å
184	T	47.2	Very low	39	Very low	86 Å²	86	125.3 Å²	125.3	53%	0.528	61%	0.614	S	S	.	*	H	α-helix	trans	-66.4	-31.6	177.5	-11.2	0	0	0	0	112.7	V180 L181	V180-T184 PolarHBondContact O-N 3.31Å; V180-T184 PolarHBondContact O-OG1 2.97Å; L181-T184 WeakPolarHBondContact CA-OG1 3.28Å; L181-T184 PolarHBondContact O-N 3.27Å
185	I	46.9	Very low	38.2	Very low	101 Å²	101	129.9 Å²	129.9	52%	0.518	65%	0.648	S	S	.	*	H	α-helix	trans	-81.5	-34.2	179.4	-67.4	163.9	0	0	0	111.5	L181 F183 D187 K188	L181-I185 WeakPolarHBondContact O-CB 3.16Å; L181-I185 WeakPolarHBondContact O-CD1 3.48Å; L181-I185 WeakPolarHBondContact O-CG1 3.26Å; L181-I185 PolarHBondContact O-N 3.12Å; F183-I185 VanDerWaalsContact C-N 3.3Å; F183-I185 PolarHBondContact O-N 3.16Å; I185-D187 VanDerWaalsContact C-N 3.33Å; I185-D187 PolarHBondContact O-N 3.35Å; I185-K188 PolarHBondContact O-N 3.14Å
186	K	36.4	Very low	37.4	Very low	169 Å²	169	131.5 Å²	131.5	74%	0.735	66%	0.659	S	S	*	*	H	α-helix	trans	-65.7	-35.4	175.6	-92.7	-175.2	173.5	-179.2	0	112.3	S182 F183 K188 K189	S182-K186 WeakPolarHBondContact O-CB 3.25Å; S182-K186 PolarHBondContact O-N 3.03Å; F183-K186 PolarHBondContact O-N 3.28Å; K186-K188 VanDerWaalsContact C-N 3.31Å; K186-K188 PolarHBondContact O-N 3.21Å; K186-K189 PolarHBondContact O-N 3.03Å
187	D	35.1	Very low	36.6	Very low	134 Å²	134	128.6 Å²	128.6	72%	0.717	67%	0.67	S	S	*	*	H	α-helix	trans	-73.3	-20.7	177.6	-77.6	-21.8	0	0	0	113.7	F183 I185	F183-D187 PolarHBondContact O-N 3.46Å; I185-D187 VanDerWaalsContact C-N 3.33Å; I185-D187 PolarHBondContact O-N 3.35Å
188	K	34.2	Very low	36	Very low	175 Å²	175	130 Å²	130	76%	0.761	69%	0.685	S	S	*	*	H	α-helix	trans	-86.6	-9.8	175.5	-89.1	-169.5	174.1	-176.5	0	115.3	I185 K186 K190	I185-K188 PolarHBondContact O-N 3.14Å; K186-K188 VanDerWaalsContact C-N 3.31Å; K186-K188 PolarHBondContact O-N 3.21Å; K188-K190 PolarHBondContact O-N 3.48Å
189	K	31.4	Very low	35.1	Very low	185 Å²	185	132.2 Å²	132.2	80%	0.804	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	11.9	-179.5	-97.6	-172.7	176.9	-176.8	0	115.3	K186	K186-K189 PolarHBondContact O-N 3.03Å
190	K	30.5	Very low	34.2	Very low	208 Å²	208	130 Å²	130	90%	0.904	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	6.7	174.4	-95.5	-173.1	177.8	-179.2	0	116	K188	K188-K190 PolarHBondContact O-N 3.48Å
191	S	28.4	Very low	33.1	Very low	91 Å²	91	131.1 Å²	131.1	64%	0.636	72%	0.72	S	S	*	*	S	Bend	trans	-128	116.4	173.4	72	0	0	0	0	113.9
192	S	27.6	Very low	32.4	Very low	109 Å²	109	132 Å²	132	76%	0.762	73%	0.733	S	S	*	*			trans	66.5	106.6	150.1	67.8	0	0	0	0	119.9
193	D	25.8	Very low	31.7	Very low	155 Å²	155	137.1 Å²	137.1	83%	0.829	75%	0.751	S	S	*	*			trans	-18.7	123.8	137	-58.1	-47.2	0	0	0	115.5
194	K	28.4	Very low	31.3	Very low	205 Å²	205	134.4 Å²	134.4	89%	0.891	75%	0.747	S	S	*	*				-177.3	131.4	122.5	-97.4	165.8	-174.6	-179.8	0	110.4
195	S	24.3	Very low	30.8	Very low	109 Å²	109	135.2 Å²	135.2	76%	0.762	75%	0.754	S	S	*	*			trans	-37	130.5	170.3	52.2	0	0	0	0	115.5
196	I	28.4	Very low	30.1	Very low	167 Å²	167	132.8 Å²	132.8	86%	0.856	74%	0.742	S	S	*	*			trans	-148.6	124.5	131.6	-87.9	143.8	0	0	0	106.3	S198	I196-S198 PolarHBondContact O-N 3.49Å
197	A	25	Very low	30.3	Very low	101 Å²	101	127.1 Å²	127.1	84%	0.835	72%	0.724	S	S	*	*			trans	-72.1	114.2	179.5	0	0	0	0	0	110.9
198	S	28.1	Very low	30.7	Very low	100 Å²	100	125.9 Å²	125.9	70%	0.699	72%	0.717	S	S	*	*			trans	172.1	95.7	143.3	55.8	0	0	0	0	105.8	I196 P200	I196-S198 PolarHBondContact O-N 3.49Å; S198-P200 WeakPolarHBondContact O-CD 3.09Å
199	T	24.8	Very low	31.2	Very low	143 Å²	143	121.3 Å²	121.3	88%	0.877	70%	0.7	S	S	*	*			trans	-83.6	98.9	171	-5.5	0	0	0	0	107.1	S201	T199-S201 PolarHBondContact O-N 2.99Å
200	P	27.9	Very low	31.7	Very low	102 Å²	102	117.6 Å²	117.6	66%	0.662	68%	0.684	S	S	*	*			trans	-65.1	123.4	158.1	27.6	-30.6	0	0	0	106.6	S198 S202	S198-P200 WeakPolarHBondContact O-CD 3.09Å; P200-S202 PolarHBondContact O-N 3.07Å; P200-S202 VanDerWaalsContact O-N 3.08Å
201	S	25.7	Very low	32.5	Very low	113 Å²	113	111.5 Å²	111.5	79%	0.79	66%	0.661	S	S	*	*			trans	-40.7	115.6	169.3	44.8	0	0	0	0	110	T199 E203	T199-S201 PolarHBondContact O-N 2.99Å; S201-E203 PolarHBondContact O-N 3.39Å; S201-E203 VanDerWaalsContact O-N 3.12Å
202	S	29.6	Very low	33.6	Very low	111 Å²	111	109.9 Å²	109.9	78%	0.776	65%	0.649	S	S	*	*	S	Bend	trans	-76	90.1	-166	53.3	0	0	0	0	112.5	P200	P200-S202 PolarHBondContact O-N 3.07Å; P200-S202 VanDerWaalsContact O-N 3.08Å
203	E	32.1	Very low	34.7	Very low	163 Å²	163	107.2 Å²	107.2	76%	0.762	63%	0.628	S	S	*	*			trans	-141.7	-2.4	162	-72.3	-159.6	153.4	0	0	115.4	S201 L206	S201-E203 PolarHBondContact O-N 3.39Å; S201-E203 VanDerWaalsContact O-N 3.12Å; E203-L206 PolarHBondContact O-N 3.27Å
204	T	38.7	Very low	36.1	Very low	95 Å²	95	101.8 Å²	101.8	58%	0.583	61%	0.605	S	S	*	*	H	α-helix	trans	-68.9	-36	-168.8	41.2	0	0	0	0	118.6	L206 S207	T204-L206 PolarHBondContact O-N 3.47Å; T204-S207 PolarHBondContact O-OG 3.39Å
205	P	38.4	Very low	37.4	Very low	103 Å²	103	96.7 Å²	96.7	67%	0.669	58%	0.584	S	S	*	*	H	α-helix	trans	-72.9	-16.3	-179.3	26.3	-32	0	0	0	113.2
206	L	31.2	Very low	39.1	Very low	51 Å²	51	94.3 Å²	94.3	27%	0.267	57%	0.568	S	S	.	*	H	α-helix	trans	-86.1	-27.5	-176.1	-166	75	0	0	0	112.7	L174 K178 E203 T204	L174-L206 HydrophobicContact CD1-CD1 3.81Å; L174-L206 HydrophobicContact CD2-CD1 4.06Å; L174-L206 HydrophobicContact CD2-CG 4.38Å; L174-L206 HydrophobicContact CG-CD1 3.99Å; K178-L206 HydrophobicContact CD-CD1 4.38Å; K178-L206 VanDerWaalsContact CE-CD1 3.41Å; K178-L206 HydrophobicContact CG-CD1 4.12Å; E203-L206 PolarHBondContact O-N 3.27Å; T204-L206 PolarHBondContact O-N 3.47Å
207	S	40.9	Very low	40.9	Very low	50 Å²	50	87.1 Å²	87.1	35%	0.35	53%	0.53	S	S	.	.	H	α-helix	trans	-70.4	-41.7	174.4	43.4	0	0	0	0	111.5	T204 L209 K210 I211	T204-S207 PolarHBondContact O-OG 3.39Å; S207-L209 VanDerWaalsContact C-N 3.33Å; S207-L209 PolarHBondContact O-N 3.27Å; S207-K210 PolarHBondContact O-N 2.91Å; S207-I211 WeakPolarHBondContact O-CD1 3.26Å; S207-I211 VanDerWaalsContact O-CG1 3.25Å; S207-I211 WeakPolarHBondContact O-CG1 3.28Å; S207-I211 PolarHBondContact O-N 2.73Å; S207-I211 VanDerWaalsContact O-N 3.09Å
208	D	44.2	Very low	42.7	Very low	108 Å²	108	87.7 Å²	87.7	58%	0.578	51%	0.514	S	S	*	.	H	α-helix	trans	-65.1	-35.2	-173.8	-64.4	-10.6	0	0	0	112.6	I211 S212	D208-I211 PolarHBondContact O-N 2.94Å; D208-S212 PolarHBondContact O-N 3.46Å; D208-S212 VanDerWaalsContact O-N 3.1Å
209	L	43.4	Very low	44.4	Very low	78 Å²	78	92.1 Å²	92.1	41%	0.408	52%	0.515	S	S	.	.	H	α-helix	trans	-75.2	-36.8	178.4	-153.2	86.1	0	0	0	113	L174 L177 S207 I211 S212 V213	L174-L209 HydrophobicContact CD1-CD2 4.09Å; L177-L209 HydrophobicContact CD1-CD2 4.21Å; S207-L209 VanDerWaalsContact C-N 3.33Å; S207-L209 PolarHBondContact O-N 3.27Å; L209-I211 PolarHBondContact O-N 3.36Å; L209-S212 PolarHBondContact O-N 3.4Å; L209-S212 PolarHBondContact O-OG 2.74Å; L209-V213 PolarHBondContact O-N 2.89Å
210	K	42.2	Very low	46.3	Very low	107 Å²	107	89.8 Å²	89.8	47%	0.465	49%	0.493	S	S	.	.	H	α-helix	trans	-61	-40.3	172.3	-74.3	178.8	-178.1	175.5	0	110.6	L174 S207 A214	L174-K210 HydrophobicContact CD2-CG 4.17Å; S207-K210 PolarHBondContact O-N 2.91Å; K210-A214 WeakPolarHBondContact O-CB 3.44Å; K210-A214 PolarHBondContact O-N 3.47Å
211	I	48.5	Very low	48.3	Very low	81 Å²	81	85.3 Å²	85.3	42%	0.415	46%	0.463	S	S	.	.	H	α-helix	trans	-64.2	-40.8	177.7	-67.9	164.9	0	0	0	110.1	S207 D208 L209 Q215	S207-I211 WeakPolarHBondContact O-CD1 3.26Å; S207-I211 VanDerWaalsContact O-CG1 3.25Å; S207-I211 WeakPolarHBondContact O-CG1 3.28Å; S207-I211 PolarHBondContact O-N 2.73Å; S207-I211 VanDerWaalsContact O-N 3.09Å; D208-I211 PolarHBondContact O-N 2.94Å; L209-I211 PolarHBondContact O-N 3.36Å; I211-Q215 VanDerWaalsContact CG2-CD 3.45Å; I211-Q215 HydrophobicContact CG2-CG 4.12Å; I211-Q215 WeakPolarHBondContact O-CB 3.43Å; I211-Q215 WeakPolarHBondContact O-CG 3.18Å; I211-Q215 PolarHBondContact O-N 3.04Å
212	S	50.9	Low	50.3	Low	57 Å²	57	84.6 Å²	84.6	40%	0.399	45%	0.448	S	S	.	.	H	α-helix	trans	-68.5	-38.6	-177.4	91.6	0	0	0	0	114.4	D208 L209 Q215 S216	D208-S212 PolarHBondContact O-N 3.46Å; D208-S212 VanDerWaalsContact O-N 3.1Å; L209-S212 PolarHBondContact O-N 3.4Å; L209-S212 PolarHBondContact O-OG 2.74Å; S212-Q215 PolarHBondContact O-N 3.28Å; S212-S216 WeakPolarHBondContact O-CB 3.13Å; S212-S216 PolarHBondContact O-N 2.63Å
213	V	51.2	Low	52	Low	53 Å²	53	86.9 Å²	86.9	32%	0.321	45%	0.446	S	S	.	.	H	α-helix	trans	-74.1	-42.9	178.3	179.3	0	0	0	0	111.1	L209 Q215 S216 F217	L209-V213 PolarHBondContact O-N 2.89Å; V213-Q215 PolarHBondContact O-N 2.69Å; V213-S216 PolarHBondContact O-N 3.14Å; V213-S216 VanDerWaalsContact O-N 3.16Å; V213-S216 PolarHBondContact O-OG 2.76Å; V213-F217 PolarHBondContact O-N 2.91Å; V213-F217 VanDerWaalsContact O-N 3.11Å
214	A	53.9	Low	54	Low	41 Å²	41	87.3 Å²	87.3	34%	0.339	44%	0.44	S	S	.	.	H	α-helix	trans	-61.7	-37.2	172.7	0	0	0	0	0	111.3	K210 K218	K210-A214 WeakPolarHBondContact O-CB 3.44Å; K210-A214 PolarHBondContact O-N 3.47Å; A214-K218 VanDerWaalsContact O-CB 3.32Å; A214-K218 WeakPolarHBondContact O-CB 3.33Å; A214-K218 PolarHBondContact O-N 3.06Å
215	Q	56.1	Low	56	Low	97 Å²	97	83.1 Å²	83.1	45%	0.453	42%	0.415	S	S	.	.	H	α-helix	trans	-68.1	-35.6	173.6	-77.9	172.8	-4.9	0	0	113	I211 S212 V213 K218 R219	I211-Q215 VanDerWaalsContact CG2-CD 3.45Å; I211-Q215 HydrophobicContact CG2-CG 4.12Å; I211-Q215 WeakPolarHBondContact O-CB 3.43Å; I211-Q215 WeakPolarHBondContact O-CG 3.18Å; I211-Q215 PolarHBondContact O-N 3.04Å; S212-Q215 PolarHBondContact O-N 3.28Å; V213-Q215 PolarHBondContact O-N 2.69Å; Q215-K218 PolarHBondContact O-N 2.83Å; Q215-R219 WeakPolarHBondContact O-CG 3.37Å; Q215-R219 PolarHBondContact O-N 3.34Å
216	S	60.1	Low	58.3	Low	59 Å²	59	78.3 Å²	78.3	41%	0.413	38%	0.384	S	S	.	.	H	α-helix	trans	-68.5	-38.4	179.2	76.8	0	0	0	0	111.5	S212 V213	S212-S216 WeakPolarHBondContact O-CB 3.13Å; S212-S216 PolarHBondContact O-N 2.63Å; V213-S216 PolarHBondContact O-N 3.14Å; V213-S216 VanDerWaalsContact O-N 3.16Å; V213-S216 PolarHBondContact O-OG 2.76Å
217	F	66.6	Low	61.1	Low	17 Å²	17	75.9 Å²	75.9	8%	0.075	37%	0.371	C	S	.	.	H	α-helix	trans	-72.9	-38.1	172.1	-173.3	-92.7	0	0	0	112.2	F42 V66 V213 R219 K220 L221 I260	F42-F217 HydrophobicContact CE1-CE1 4.42Å; F42-F217 AromaticContact CE2-CE1 3.94Å; F42-F217 HydrophobicContact CE2-CE1 3.94Å; F42-F217 AromaticContact CE2-CZ 3.82Å; F42-F217 HydrophobicContact CE2-CZ 3.82Å; F42-F217 AromaticContact CZ-CE1 3.86Å; F42-F217 HydrophobicContact CZ-CE1 3.86Å; F42-F217 HydrophobicContact CZ-CZ 4.07Å; V66-F217 HydrophobicContact CG2-CZ 3.94Å; V213-F217 PolarHBondContact O-N 2.91Å; V213-F217 VanDerWaalsContact O-N 3.11Å; F217-R219 PolarHBondContact O-N 2.93Å; F217-R219 VanDerWaalsContact O-N 3.12Å; F217-K220 HydrophobicContact CD2-CD 4.15Å; F217-K220 WeakPolarHBondContact O-CA 3.44Å; F217-K220 VanDerWaalsContact O-CB 3.25Å; F217-K220 WeakPolarHBondContact O-CB 3.19Å; F217-K220 PolarHBondContact O-N 3.5Å; F217-L221 HydrophobicContact CD1-CD1 4.17Å; F217-L221 HydrophobicContact CD1-CG 4.42Å; F217-L221 HydrophobicContact CE1-CD1 3.89Å; F217-L221 HydrophobicContact CE1-CD2 4.14Å; F217-L221 HydrophobicContact CE1-CG 4.06Å; F217-L221 HydrophobicContact CZ-CD2 4.46Å; F217-I260 HydrophobicContact CD1-CD1 3.27Å; F217-I260 HydrophobicContact CD1-CG1 4.37Å; F217-I260 HydrophobicContact CE1-CD1 3.43Å; F217-I260 VanDerWaalsContact CE1-CD1 3.43Å; F217-I260 HydrophobicContact CG-CD1 4.47Å
218	K	63	Low	63.4	Low	112 Å²	112	73.5 Å²	73.5	49%	0.487	35%	0.354	S	S	.	.	H	α-helix	trans	-55.8	-31.2	174.1	-174.5	174.4	178.8	173.3	0	112.7	A214 Q215 K220 L221	A214-K218 VanDerWaalsContact O-CB 3.32Å; A214-K218 WeakPolarHBondContact O-CB 3.33Å; A214-K218 PolarHBondContact O-N 3.06Å; Q215-K218 PolarHBondContact O-N 2.83Å; K218-K220 VanDerWaalsContact C-N 3.29Å; K218-K220 PolarHBondContact O-N 3.47Å; K218-L221 PolarHBondContact O-N 2.98Å
219	R	62.1	Low	65.7	Low	193 Å²	193	68.4 Å²	68.4	73%	0.728	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-24	173.9	-69.8	173.1	-172.2	177.3	4.2	113.9	Q215 F217 L221	Q215-R219 WeakPolarHBondContact O-CG 3.37Å; Q215-R219 PolarHBondContact O-N 3.34Å; F217-R219 PolarHBondContact O-N 2.93Å; F217-R219 VanDerWaalsContact O-N 3.12Å; R219-L221 VanDerWaalsContact C-N 3.27Å
220	K	65.5	Low	68.1	Low	94 Å²	94	64.7 Å²	64.7	41%	0.409	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-8.7	174.6	-63.3	-176.2	-178.6	-179.2	0	112.8	F217 K218 K770	F217-K220 HydrophobicContact CD2-CD 4.15Å; F217-K220 WeakPolarHBondContact O-CA 3.44Å; F217-K220 VanDerWaalsContact O-CB 3.25Å; F217-K220 WeakPolarHBondContact O-CB 3.19Å; F217-K220 PolarHBondContact O-N 3.5Å; K218-K220 VanDerWaalsContact C-N 3.29Å; K218-K220 PolarHBondContact O-N 3.47Å; K220-K770 CarbonylContact C-O 3.58Å; K220-K770 WeakPolarHBondContact CA-O 3.08Å; K220-K770 WeakPolarHBondContact CB-O 3.2Å; K220-K770 CarbonylContact O-C 3.52Å; K220-K770 WeakPolarHBondContact O-CA 3.37Å; K220-K770 VanDerWaalsContact O-CB 3.3Å; K220-K770 WeakPolarHBondContact O-CB 3.33Å
221	L	70	Confident	70.6	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.042	29%	0.286	C	S	.	.	S	Bend	trans	-94.5	145.7	176.8	-64	172.6	0	0	0	109.7	F42 V66 F217 K218 R219 T225 I260 L262	F42-L221 HydrophobicContact CB-CD2 4.38Å; F42-L221 HydrophobicContact CD2-CD2 4.16Å; F42-L221 HydrophobicContact CG-CD2 4.34Å; V66-L221 HydrophobicContact CB-CD2 4.4Å; V66-L221 HydrophobicContact CG1-CD2 3.79Å; V66-L221 HydrophobicContact CG2-CD2 3.77Å; F217-L221 HydrophobicContact CD1-CD1 4.17Å; F217-L221 HydrophobicContact CD1-CG 4.42Å; F217-L221 HydrophobicContact CE1-CD1 3.89Å; F217-L221 HydrophobicContact CE1-CD2 4.14Å; F217-L221 HydrophobicContact CE1-CG 4.06Å; F217-L221 HydrophobicContact CZ-CD2 4.46Å; K218-L221 PolarHBondContact O-N 2.98Å; R219-L221 VanDerWaalsContact C-N 3.27Å; L221-T225 HydrophobicContact CB-CG2 4.47Å; L221-T225 HydrophobicContact CD1-CG2 4.49Å; L221-T225 HydrophobicContact CD2-CG2 4.32Å; L221-I260 HydrophobicContact CD1-CD1 4.17Å; L221-L262 HydrophobicContact CD1-CD1 3.38Å
222	Q	67	Low	72.7	Confident	99 Å²	99	55.9 Å²	55.9	46%	0.463	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-62	156.9	173.6	-75.4	-179.5	-16.6	0	0	110.6	P40 T225 K770	P40-Q222 HydrophobicContact CB-CB 4.36Å; P40-Q222 VanDerWaalsContact CB-OE1 3.24Å; P40-Q222 HydrophobicContact CG-CB 3.53Å; P40-Q222 HydrophobicContact CG-CG 4.41Å; Q222-T225 PolarHBondContact N-OG1 3.09Å; Q222-T225 PolarHBondContact O-N 3.28Å; Q222-T225 PolarHBondContact O-OG1 2.99Å; Q222-K770 HydrophobicContact CG-CD 4.2Å
223	E	65.6	Low	74.6	Confident	158 Å²	158	53.3 Å²	53.3	74%	0.738	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	140.2	174.9	-76.7	162.2	-135	0	0	108.8	K770	E223-K770 IonicContact OE1-NZ 2.88Å; E223-K770 PolarHBondContact OE1-NZ 2.78Å
224	R	73.9	Confident	76.4	Confident	172 Å²	172	53.2 Å²	53.2	65%	0.649	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.3	19.9	-171.4	-53.4	179.3	173.2	167.7	-1.6	116.1	D37 A39 V226	D37-R224 IonicContact OD2-NH1 3.58Å; D37-R224 PolarHBondContact OD2-NH1 3.47Å; A39-R224 WeakPolarHBondContact CB-O 3.16Å; R224-V226 PolarHBondContact O-N 3.32Å
225	T	81.2	Confident	78	Confident	8 Å²	8	51.3 Å²	51.3	5%	0.049	23%	0.234	C	C	.	.			trans	-57.7	129.9	172.5	-63.3	0	0	0	0	112.4	P40 F42 L221 Q222	P40-T225 CarbonylContact O-C 3.6Å; P40-T225 WeakPolarHBondContact O-CA 3.45Å; P40-T225 WeakPolarHBondContact O-CG2 3.39Å; F42-T225 HydrophobicContact CB-CG2 3.62Å; L221-T225 HydrophobicContact CB-CG2 4.47Å; L221-T225 HydrophobicContact CD1-CG2 4.49Å; L221-T225 HydrophobicContact CD2-CG2 4.32Å; Q222-T225 PolarHBondContact N-OG1 3.09Å; Q222-T225 PolarHBondContact O-N 3.28Å; Q222-T225 PolarHBondContact O-OG1 2.99Å
226	V	87.1	Confident	79.4	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.012	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	154	171.8	-67.8	0	0	0	0	110.7	A39 P40 I41 F42 R224 D251 P263 R265	A39-V226 HydrophobicContact CB-CB 4.32Å; A39-V226 HydrophobicContact CB-CG1 3.64Å; A39-V226 HydrophobicContact CB-CG2 3.89Å; P40-V226 PolarHBondContact O-N 2.73Å; I41-V226 CarbonylContact C-O 3.6Å; I41-V226 WeakPolarHBondContact CA-O 3.31Å; I41-V226 HydrophobicContact CB-CG2 4.42Å; I41-V226 HydrophobicContact CG1-CG2 3.81Å; F42-V226 PolarHBondContact N-O 3.01Å; R224-V226 PolarHBondContact O-N 3.32Å; V226-D251 HydrophobicContact CG1-CB 4.26Å; V226-D251 WeakPolarHBondContact CG1-OD2 3.49Å; V226-P263 CarbonylContact C-O 3.3Å; V226-P263 WeakPolarHBondContact CA-O 3.31Å; V226-P263 HydrophobicContact CG1-CG 4.41Å; V226-R265 HydrophobicContact CB-CB 4.25Å; V226-R265 HydrophobicContact CG2-CB 4.46Å
227	V	88.8	Confident	80.5	Confident	0 Å²	0	50 Å²	50	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.9	-176.6	-177.2	0	0	0	0	111.5	F42 V229 L262 P263 I264 R265	F42-V227 HydrophobicContact CB-CG2 4.5Å; F42-V227 HydrophobicContact CD1-CG1 4.19Å; F42-V227 HydrophobicContact CD1-CG2 4.06Å; F42-V227 CarbonylContact O-C 3.56Å; F42-V227 VanDerWaalsContact O-CA 3.29Å; F42-V227 WeakPolarHBondContact O-CA 3.38Å; V227-V229 HydrophobicContact CG1-CG2 3.9Å; V227-L262 HydrophobicContact CG2-CB 3.45Å; V227-L262 VanDerWaalsContact CG2-CB 3.45Å; V227-L262 HydrophobicContact CG2-CD1 4.07Å; V227-L262 HydrophobicContact CG2-CG 4.42Å; V227-P263 PolarHBondContact N-O 2.92Å; V227-I264 HydrophobicContact CB-CG1 4.06Å; V227-I264 HydrophobicContact CG1-CG1 4.38Å; V227-I264 CarbonylContact O-C 3.46Å; V227-I264 WeakPolarHBondContact O-CA 3.39Å; V227-R265 PolarHBondContact O-N 3.08Å
228	A	91.1	Very high	81.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124.3	166.7	0	0	0	0	0	109.6	I41 F42 C43 E44 Y266 L291	I41-A228 HydrophobicContact CG2-CB 3.77Å; F42-A228 PolarHBondContact O-N 3.14Å; C43-A228 CarbonylContact C-O 3.21Å; C43-A228 VanDerWaalsContact CA-O 3.3Å; C43-A228 WeakPolarHBondContact CA-O 3.17Å; E44-A228 PolarHBondContact N-O 3.31Å; A228-Y266 CarbonylContact C-O 3.57Å; A228-Y266 VanDerWaalsContact CA-O 3.32Å; A228-Y266 WeakPolarHBondContact CA-O 3.16Å; A228-Y266 HydrophobicContact CB-CD2 4.37Å; A228-L291 HydrophobicContact CB-CD1 3.85Å
229	V	92.2	Very high	82.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.8	-179.5	-178.3	0	0	0	0	109.6	L46 V227 L231 L257 I264 Y266 V267 F268	L46-V229 HydrophobicContact CD1-CG1 3.67Å; V227-V229 HydrophobicContact CG1-CG2 3.9Å; V229-L231 HydrophobicContact CG1-CD2 3.97Å; V229-L231 HydrophobicContact CG1-CG 4.23Å; V229-L257 HydrophobicContact CB-CG 4.4Å; V229-L257 HydrophobicContact CG1-CD1 4.05Å; V229-L257 HydrophobicContact CG1-CG 4.26Å; V229-L257 HydrophobicContact CG2-CG 4.17Å; V229-I264 HydrophobicContact CG2-CD1 4.14Å; V229-I264 HydrophobicContact CG2-CG2 4.48Å; V229-Y266 PolarHBondContact N-O 2.61Å; V229-V267 CarbonylContact O-C 3.55Å; V229-V267 WeakPolarHBondContact O-CA 3.43Å; V229-F268 PolarHBondContact O-N 2.79Å
230	I	94.2	Very high	83.6	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	112.6	-176.7	-58.5	173.7	0	0	0	107.5	C43 E44 L45 L46 V232 F268 L287 A288 L291	C43-I230 HydrophobicContact CB-CD1 4.46Å; E44-I230 PolarHBondContact O-N 2.88Å; L45-I230 WeakPolarHBondContact CA-O 3.41Å; L45-I230 HydrophobicContact CD1-CB 4.04Å; L45-I230 HydrophobicContact CD1-CG2 3.5Å; L46-I230 PolarHBondContact N-O 3.05Å; I230-V232 HydrophobicContact CG2-CG2 3.98Å; I230-F268 CarbonylContact C-O 3.45Å; I230-F268 HydrophobicContact CG1-CB 4.42Å; I230-F268 HydrophobicContact CG2-CD1 3.98Å; I230-L287 HydrophobicContact CD1-CB 4.46Å; I230-L287 HydrophobicContact CD1-CD2 4.44Å; I230-L287 HydrophobicContact CD1-CG 4.45Å; I230-L287 HydrophobicContact CG1-CD2 4.46Å; I230-A288 HydrophobicContact CD1-CB 3.66Å; I230-L291 HydrophobicContact CD1-CD1 4.31Å
231	L	93.3	Very high	84.7	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119	-179.3	-59.9	179.2	0	0	0	109.1	L46 W59 F113 V229 F268 L269 L270	L46-L231 HydrophobicContact CB-CD2 3.9Å; L46-L231 HydrophobicContact CD1-CD2 3.73Å; L46-L231 HydrophobicContact CG-CD2 4.31Å; W59-L231 HydrophobicContact CD2-CD2 4.18Å; W59-L231 HydrophobicContact CE3-CB 4.39Å; W59-L231 HydrophobicContact CE3-CD2 4.06Å; W59-L231 HydrophobicContact CH2-CB 3.78Å; W59-L231 HydrophobicContact CZ2-CB 4.32Å; W59-L231 HydrophobicContact CZ3-CB 3.81Å; W59-L231 HydrophobicContact CZ3-CD2 4.33Å; F113-L231 HydrophobicContact CE2-CD1 4.47Å; F113-L231 HydrophobicContact CZ-CD1 3.96Å; V229-L231 HydrophobicContact CG1-CD2 3.97Å; V229-L231 HydrophobicContact CG1-CG 4.23Å; L231-F268 PolarHBondContact N-O 2.72Å; L231-L269 HydrophobicContact CB-CD1 3.75Å; L231-L269 HydrophobicContact CD1-CD1 4.32Å; L231-L269 CarbonylContact O-C 3.52Å; L231-L269 WeakPolarHBondContact O-CA 3.49Å; L231-L270 PolarHBondContact O-N 3.46Å
232	V	93.2	Very high	85.5	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.2	-177.7	178.9	0	0	0	0	111.5	L45 L46 E47 L48 W59 I230 L270 L280	L45-V232 HydrophobicContact CD1-CB 4.18Å; L45-V232 HydrophobicContact CD1-CG2 3.58Å; L46-V232 PolarHBondContact O-N 3.38Å; E47-V232 CarbonylContact C-O 3.6Å; E47-V232 VanDerWaalsContact CA-O 3.24Å; E47-V232 WeakPolarHBondContact CA-O 3.33Å; L48-V232 PolarHBondContact N-O 3.21Å; W59-V232 WeakPolarHBondContact CZ3-O 3.41Å; I230-V232 HydrophobicContact CG2-CG2 3.98Å; V232-L270 CarbonylContact C-O 3.52Å; V232-L270 WeakPolarHBondContact CA-O 3.15Å; V232-L270 HydrophobicContact CG1-CD2 4.38Å; V232-L270 HydrophobicContact CG2-CB 4.26Å; V232-L280 HydrophobicContact CG1-CB 3.18Å; V232-L280 HydrophobicContact CG1-CD1 4.09Å; V232-L280 HydrophobicContact CG1-CG 4.27Å
233	G	91.3	Very high	86.6	Confident	2 Å²	2	36.2 Å²	36.2	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	154.5	179.3	0	0	0	0	0	115.9	L270 L271 A272 L280	G233-L270 PolarHBondContact N-O 2.85Å; G233-L271 WeakPolarHBondContact O-CA 3.45Å; G233-A272 PolarHBondContact O-N 2.89Å; G233-L280 WeakPolarHBondContact O-CD1 3.5Å
234	C	89.3	Confident	87.7	Confident	52 Å²	52	28.7 Å²	28.7	35%	0.351	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.6	168.4	-65	0	0	0	0	110.1	A272 K274 L280	C234-A272 CarbonylContact C-O 3.55Å; C234-A272 VanDerWaalsContact CA-O 3.27Å; C234-A272 WeakPolarHBondContact CA-O 3.44Å; C234-K274 HydrophobicContact CB-CG 4.45Å; C234-L280 WeakPolarHBondContact SG-CD1 3.49Å
235	T	87.3	Confident	88.5	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.115	C	C	.	.			trans	-146	146.3	-176.7	70.3	0	0	0	0	110.9	L48 L162 L237 V238 L271 A272 P273	L48-T235 HydrophobicContact CD2-CG2 3.3Å; L162-T235 HydrophobicContact CD1-CG2 3.47Å; L162-T235 VanDerWaalsContact CD1-CG2 3.47Å; L162-T235 HydrophobicContact CD2-CG2 4.42Å; T235-L237 PolarHBondContact O-N 3.19Å; T235-V238 WeakPolarHBondContact OG1-CG2 3.41Å; T235-L271 HydrophobicContact CG2-CD2 4.2Å; T235-A272 PolarHBondContact N-O 3.46Å; T235-P273 WeakPolarHBondContact O-CA 3.46Å
236	D	84.4	Confident	88.8	Confident	106 Å²	106	20.4 Å²	20.4	57%	0.567	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-7.6	174.3	-59.3	-39.8	0	0	0	113.2	V238 K274	D236-V238 VanDerWaalsContact C-N 3.28Å; D236-V238 PolarHBondContact O-N 3.14Å; D236-K274 WeakPolarHBondContact OD1-CB 3.43Å; D236-K274 WeakPolarHBondContact OD1-CD 3.34Å; D236-K274 WeakPolarHBondContact OD1-CG 3.31Å; D236-K274 WeakPolarHBondContact OD2-CD 3.33Å; D236-K274 WeakPolarHBondContact OD2-CE 3.18Å; D236-K274 IonicContact OD2-NZ 2.81Å; D236-K274 PolarHBondContact OD2-NZ 3.01Å
237	L	83.6	Confident	88.8	Confident	24 Å²	24	21.4 Å²	21.4	13%	0.126	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-20.8	-177.8	-62.1	178.5	0	0	0	113.5	M155 Q158 L162 T235	M155-L237 HydrophobicContact SD-CD2 4.41Å; Q158-L237 HydrophobicContact CB-CD1 4.12Å; Q158-L237 HydrophobicContact CB-CD2 3.87Å; Q158-L237 VanDerWaalsContact OE1-CD2 3.25Å; L162-L237 HydrophobicContact CB-CD1 4.34Å; L162-L237 HydrophobicContact CD1-CD1 3.59Å; T235-L237 PolarHBondContact O-N 3.19Å
238	V	85.4	Confident	88.7	Confident	4 Å²	4	21.7 Å²	21.7	2%	0.024	12%	0.118	C	C	.	.			trans	-112.6	129.2	-169.7	-167.3	0	0	0	0	109.5	Y150 I151 T235 D236 A240 L271	Y150-V238 WeakPolarHBondContact O-CA 3.32Å; Y150-V238 VanDerWaalsContact O-CG1 3.3Å; Y150-V238 WeakPolarHBondContact O-CG1 3.47Å; I151-V238 HydrophobicContact CD1-CG2 3.96Å; I151-V238 HydrophobicContact CG1-CB 4.36Å; I151-V238 HydrophobicContact CG1-CG1 4.22Å; I151-V238 HydrophobicContact CG1-CG2 3.91Å; T235-V238 WeakPolarHBondContact OG1-CG2 3.41Å; D236-V238 VanDerWaalsContact C-N 3.28Å; D236-V238 PolarHBondContact O-N 3.14Å; V238-A240 WeakPolarHBondContact CG1-O 3.25Å; V238-L271 HydrophobicContact CG2-CB 3.98Å; V238-L271 HydrophobicContact CG2-CD1 4.29Å
239	K	84.8	Confident	88.1	Confident	135 Å²	135	30.2 Å²	30.2	59%	0.587	15%	0.15	S	C	*	.	S	Bend	trans	-74.2	-31.8	-178.2	-70.3	-177.3	173.5	177.3	0	113.8	Y150 E152	Y150-K239 PolarHBondContact O-N 2.76Å; E152-K239 WeakPolarHBondContact OE1-CE 3.47Å; E152-K239 IonicContact OE1-NZ 3.98Å; E152-K239 PolarHBondContact OE1-NZ 2.98Å
240	A	86.2	Confident	87.6	Confident	49 Å²	49	32.6 Å²	32.6	41%	0.405	17%	0.169	S	C	.	.	S	Bend	trans	-145.2	157.6	-175.9	0	0	0	0	0	110	V238 G242	V238-A240 WeakPolarHBondContact CG1-O 3.25Å; A240-G242 PolarHBondContact O-N 3.07Å; A240-G242 VanDerWaalsContact O-N 3.09Å
241	M	88.3	Confident	87	Confident	43 Å²	43	36.1 Å²	36.1	21%	0.212	19%	0.188	C	C	.	.			trans	-58	118.1	178.4	-169.7	-177.3	-66.3	0	0	110.9	T94 L98 L270 L271 A272 C276 V278 L280	T94-M241 HydrophobicContact CG2-SD 4Å; L98-M241 HydrophobicContact CD1-SD 3.78Å; L98-M241 HydrophobicContact CD2-CG 3.85Å; L98-M241 HydrophobicContact CD2-SD 3.77Å; L98-M241 HydrophobicContact CG-SD 4.18Å; M241-L270 HydrophobicContact CG-CD1 3.8Å; M241-L270 HydrophobicContact SD-CD1 4.22Å; M241-L271 WeakPolarHBondContact CA-O 3.45Å; M241-A272 HydrophobicContact CB-CB 4.36Å; M241-A272 HydrophobicContact CE-CB 4.23Å; M241-A272 HydrophobicContact CG-CB 4.1Å; M241-C276 WeakPolarHBondContact CE-SG 3.34Å; M241-V278 HydrophobicContact CE-CB 4.22Å; M241-V278 HydrophobicContact CE-CG2 4.24Å; M241-L280 HydrophobicContact CE-CD2 3.83Å; M241-L280 HydrophobicContact SD-CD2 4.44Å
242	G	87.1	Confident	86.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.6	-179.6	0	0	0	0	0	110.4	A240 L271	A240-G242 PolarHBondContact O-N 3.07Å; A240-G242 VanDerWaalsContact O-N 3.09Å; G242-L271 PolarHBondContact N-O 3.09Å; G242-L271 PolarHBondContact O-N 2.97Å
243	S	90	Very high	85.8	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.014	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.5	174.2	74.6	0	0	0	0	111.6	L98 L103 L269	L98-S243 PolarHBondContact O-OG 3.37Å; L103-S243 WeakPolarHBondContact CB-O 3.33Å; L103-S243 PolarHBondContact N-O 2.91Å; S243-L269 CarbonylContact C-O 3.51Å; S243-L269 VanDerWaalsContact CA-O 3.22Å; S243-L269 WeakPolarHBondContact CA-O 3.49Å
244	A	88.8	Confident	85.2	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	123.5	171.2	0	0	0	0	0	110.3	L103 L141 F145 F268 L269	L103-A244 HydrophobicContact CB-CB 3.88Å; L103-A244 HydrophobicContact CD2-CB 3.81Å; L103-A244 HydrophobicContact CG-CB 4.1Å; L103-A244 CarbonylContact O-C 3.58Å; L103-A244 VanDerWaalsContact O-CA 3.26Å; L103-A244 WeakPolarHBondContact O-CA 3.4Å; L141-A244 HydrophobicContact CD2-CB 3.66Å; F145-A244 HydrophobicContact CE2-CB 3.7Å; F145-A244 HydrophobicContact CZ-CB 4.27Å; A244-F268 CarbonylContact O-C 3.6Å; A244-F268 WeakPolarHBondContact O-CA 3.39Å; A244-F268 WeakPolarHBondContact O-CD2 3.35Å; A244-L269 HydrophobicContact CB-CB 4.37Å; A244-L269 PolarHBondContact N-O 2.92Å; A244-L269 PolarHBondContact O-N 3.38Å
245	F	90.2	Very high	84.4	Confident	5 Å²	5	42.1 Å²	42.1	2%	0.022	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	120.1	170.9	-176	-98.1	0	0	0	109	L99 L103 L104 L105 R247 Y266 F268 L309	L99-F245 HydrophobicContact CD2-CB 4.24Å; L99-F245 HydrophobicContact CD2-CD2 4.39Å; L99-F245 HydrophobicContact CD2-CG 4.43Å; L103-F245 PolarHBondContact O-N 2.92Å; L104-F245 HydrophobicContact CD1-CB 4.43Å; L104-F245 HydrophobicContact CD1-CD1 3.65Å; L104-F245 HydrophobicContact CD1-CE1 4.49Å; L105-F245 PolarHBondContact N-O 3.42Å; F245-R247 HydrophobicContact CE1-CB 4.44Å; F245-Y266 HydrophobicContact CE1-CD1 4.22Å; F245-Y266 HydrophobicContact CE1-CE1 4.48Å; F245-Y266 HydrophobicContact CE2-CD1 4.21Å; F245-Y266 AromaticContact CZ-CD1 3.54Å; F245-Y266 HydrophobicContact CZ-CD1 3.54Å; F245-Y266 AromaticContact CZ-CE1 3.94Å; F245-Y266 HydrophobicContact CZ-CE1 3.94Å; F245-Y266 HydrophobicContact CZ-CG 4.44Å; F245-F268 HydrophobicContact CB-CD2 4.1Å; F245-F268 AromaticContact CD2-CD2 3.98Å; F245-F268 HydrophobicContact CD2-CD2 3.98Å; F245-L309 HydrophobicContact CD1-CD1 4.05Å; F245-L309 HydrophobicContact CD1-CD2 4.34Å; F245-L309 HydrophobicContact CE1-CD2 4.1Å
246	V	88	Confident	83.6	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.8	-179	-173.1	0	0	0	0	109	L105 C108 L116 L141 L248 Y266 V267	L105-V246 HydrophobicContact CB-CB 4.39Å; L105-V246 HydrophobicContact CB-CG1 4.13Å; L105-V246 HydrophobicContact CB-CG2 4.19Å; L105-V246 HydrophobicContact CD1-CG2 4Å; L105-V246 HydrophobicContact CG-CG2 4.46Å; L105-V246 WeakPolarHBondContact O-CA 3.42Å; C108-V246 HydrophobicContact CB-CG1 4.48Å; L116-V246 HydrophobicContact CD1-CG1 3.89Å; L116-V246 HydrophobicContact CD2-CG1 4.3Å; L141-V246 HydrophobicContact CD2-CG2 3.77Å; V246-L248 HydrophobicContact CG1-CD2 4.19Å; V246-Y266 WeakPolarHBondContact O-CA 3.33Å; V246-V267 WeakPolarHBondContact CA-O 3.44Å; V246-V267 HydrophobicContact CB-CB 4.11Å; V246-V267 WeakPolarHBondContact CB-O 3.31Å; V246-V267 PolarHBondContact N-O 3.02Å; V246-V267 PolarHBondContact O-N 2.88Å
247	R	87.8	Confident	83.3	Confident	22 Å²	22	40.8 Å²	40.8	8%	0.083	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.3	168.5	-173.5	-178.7	76.6	-149.8	-0.9	109.6	L105 D107 C108 F245 Y266 T301 S303	L105-R247 PolarHBondContact O-N 3.41Å; D107-R247 PolarHBondContact N-O 2.93Å; D107-R247 IonicContact OD1-CZ 3.31Å; D107-R247 IonicContact OD1-NE 2.68Å; D107-R247 IonicContact OD1-NH2 2.95Å; D107-R247 PolarHBondContact OD1-NH2 3.19Å; D107-R247 IonicContact OD2-NH2 3.52Å; C108-R247 PolarHBondContact N-O 3.3Å; F245-R247 HydrophobicContact CE1-CB 4.44Å; R247-Y266 HydrophobicContact CB-CD1 4.31Å; R247-Y266 HydrophobicContact CB-CE1 4.28Å; R247-Y266 HydrophobicContact CG-CD1 4.13Å; R247-Y266 HydrophobicContact CG-CE1 3.72Å; R247-T301 PolarHBondContact NH1-O 3.12Å; R247-S303 PolarHBondContact NH1-O 2.97Å
248	L	85.8	Confident	83	Confident	6 Å²	6	39.9 Å²	39.9	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	145.9	176	-58.5	-178.2	0	0	0	110.9	C108 P110 V246 Q252 I254 I264 R265	C108-L248 HydrophobicContact CB-CD2 4.19Å; C108-L248 CarbonylContact O-C 3.4Å; C108-L248 VanDerWaalsContact O-CA 3.25Å; C108-L248 WeakPolarHBondContact O-CA 3.37Å; P110-L248 HydrophobicContact CG-CD2 3.84Å; V246-L248 HydrophobicContact CG1-CD2 4.19Å; L248-Q252 HydrophobicContact CD1-CG 3.95Å; L248-I254 HydrophobicContact CD1-CD1 4.01Å; L248-I264 HydrophobicContact CD1-CB 4.38Å; L248-I264 HydrophobicContact CD1-CG2 4.22Å; L248-I264 WeakPolarHBondContact CD1-O 3.28Å; L248-R265 PolarHBondContact N-O 3.18Å
249	R	79.8	Confident	82.4	Confident	180 Å²	180	42.2 Å²	42.2	68%	0.679	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	-37.7	179.5	-174.4	177.1	178.8	-179.5	-0.1	112.3	D107 C108	D107-R249 HydrophobicContact CB-CB 4.09Å; D107-R249 HydrophobicContact CB-CG 4.27Å; C108-R249 PolarHBondContact O-N 3.24Å
250	A	80.5	Confident	81.8	Confident	49 Å²	49	36.1 Å²	36.1	41%	0.405	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	145.9	178.5	0	0	0	0	0	109.4	Q252	A250-Q252 PolarHBondContact O-N 3.05Å
251	D	82.4	Confident	81.3	Confident	76 Å²	76	39.9 Å²	39.9	41%	0.406	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	110.2	176.3	-65.8	-24.2	0	0	0	108.8	V226 P263 R265	V226-D251 HydrophobicContact CG1-CB 4.26Å; V226-D251 WeakPolarHBondContact CG1-OD2 3.49Å; D251-P263 HydrophobicContact CB-CB 3.91Å; D251-R265 WeakPolarHBondContact OD1-CB 3.49Å; D251-R265 WeakPolarHBondContact OD1-CD 3.16Å; D251-R265 WeakPolarHBondContact OD1-CG 3.1Å
252	Q	82.7	Confident	81	Confident	39 Å²	39	38.7 Å²	38.7	18%	0.182	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.7	-171.9	59.8	176	12.9	0	0	112.2	P110 L248 A250 I254 P263 I264	P110-Q252 VanDerWaalsContact O-CD 3.29Å; P110-Q252 PolarHBondContact O-NE2 2.94Å; P110-Q252 PolarHBondContact O-OE1 3.02Å; L248-Q252 HydrophobicContact CD1-CG 3.95Å; A250-Q252 PolarHBondContact O-N 3.05Å; Q252-I254 HydrophobicContact CG-CG1 4.38Å; Q252-I254 PolarHBondContact O-N 3.45Å; Q252-P263 WeakPolarHBondContact O-CA 3.38Å; Q252-I264 PolarHBondContact N-O 3.46Å; Q252-I264 PolarHBondContact O-N 3.29Å
253	A	78.9	Confident	80.9	Confident	64 Å²	64	40.5 Å²	40.5	53%	0.529	23%	0.232	S	C	.	.			trans	-81.6	108.7	177.9	0	0	0	0	0	109.8	P255	A253-P255 WeakPolarHBondContact O-CD 3.2Å
254	I	78.9	Confident	80.8	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.015	23%	0.231	C	C	.	.			trans	-92.1	113.8	172.9	-55.3	176.6	0	0	0	108.2	P110 F113 L248 Q252 L257 I264	P110-I254 HydrophobicContact CG-CD1 4.26Å; F113-I254 HydrophobicContact CB-CG2 3.77Å; F113-I254 VanDerWaalsContact N-CG2 3.33Å; L248-I254 HydrophobicContact CD1-CD1 4.01Å; Q252-I254 HydrophobicContact CG-CG1 4.38Å; Q252-I254 PolarHBondContact O-N 3.45Å; I254-L257 HydrophobicContact CB-CB 4.23Å; I254-L257 HydrophobicContact CB-CD2 4.36Å; I254-L257 HydrophobicContact CD1-CD2 4.06Å; I254-L257 HydrophobicContact CG2-CB 4.02Å; I254-L257 HydrophobicContact CG2-CD2 4.33Å; I254-I264 HydrophobicContact CB-CD1 4.01Å; I254-I264 HydrophobicContact CG1-CD1 4.46Å
255	P	71.9	Confident	80.7	Confident	76 Å²	76	43.2 Å²	43.2	49%	0.494	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	145.1	179.2	-21	32.8	0	0	0	111.9	A253 L257	A253-P255 WeakPolarHBondContact O-CD 3.2Å; P255-L257 PolarHBondContact O-N 2.88Å
256	A	70.8	Confident	80.8	Confident	78 Å²	78	43.1 Å²	43.1	65%	0.645	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.8	-5.5	176.3	0	0	0	0	0	117.7
257	L	76.7	Confident	80.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-33.2	178.5	-176.7	56.5	0	0	0	113.6	F113 K167 Y169 V229 I254 P255 I264 V267	F113-L257 HydrophobicContact CD1-CD1 4.37Å; F113-L257 HydrophobicContact CD2-CD1 3.62Å; F113-L257 HydrophobicContact CD2-CD2 3.63Å; F113-L257 HydrophobicContact CD2-CG 4.14Å; F113-L257 HydrophobicContact CE1-CD1 4.31Å; F113-L257 HydrophobicContact CE2-CD1 3.54Å; F113-L257 HydrophobicContact CE2-CD2 4.07Å; F113-L257 HydrophobicContact CE2-CG 4.44Å; F113-L257 HydrophobicContact CG-CD1 4.04Å; F113-L257 HydrophobicContact CG-CD2 4.39Å; F113-L257 HydrophobicContact CZ-CD1 3.91Å; K167-L257 HydrophobicContact CD-CD1 4.39Å; Y169-L257 PolarHBondContact OH-O 3.23Å; V229-L257 HydrophobicContact CB-CG 4.4Å; V229-L257 HydrophobicContact CG1-CD1 4.05Å; V229-L257 HydrophobicContact CG1-CG 4.26Å; V229-L257 HydrophobicContact CG2-CG 4.17Å; I254-L257 HydrophobicContact CB-CB 4.23Å; I254-L257 HydrophobicContact CB-CD2 4.36Å; I254-L257 HydrophobicContact CD1-CD2 4.06Å; I254-L257 HydrophobicContact CG2-CB 4.02Å; I254-L257 HydrophobicContact CG2-CD2 4.33Å; P255-L257 PolarHBondContact O-N 2.88Å; L257-I264 HydrophobicContact CB-CD1 3.82Å; L257-I264 HydrophobicContact CD2-CD1 3.68Å; L257-I264 HydrophobicContact CG-CD1 3.84Å; L257-V267 HydrophobicContact CD2-CG2 3.88Å
258	S	77.3	Confident	81.1	Confident	6 Å²	6	42.3 Å²	42.3	4%	0.042	24%	0.238	C	C	.	.	S	Bend	trans	-115.2	160.1	176.2	53.6	0	0	0	0	111.6	E44 Y169 I260	E44-S258 VanDerWaalsContact OE2-CA 3.24Å; E44-S258 WeakPolarHBondContact OE2-CA 3.31Å; Y169-S258 VanDerWaalsContact CZ-C 3.46Å; Y169-S258 VanDerWaalsContact OH-C 3.31Å; Y169-S258 WeakPolarHBondContact OH-CA 3.42Å; Y169-S258 PolarHBondContact OH-N 3.46Å; S258-I260 PolarHBondContact O-N 2.9Å; S258-I260 PolarHBondContact OG-O 2.99Å
259	Q	72.8	Confident	81.4	Confident	52 Å²	52	42.1 Å²	42.1	24%	0.243	24%	0.237	C	C	.	.	S	Bend	trans	-62.2	-36.3	174.8	-172.7	-179.9	39.5	0	0	111.3	E44 Y169	E44-Q259 VanDerWaalsContact OE1-CB 3.27Å; E44-Q259 WeakPolarHBondContact OE1-CB 3.46Å; E44-Q259 PolarHBondContact OE1-N 3.4Å; E44-Q259 PolarHBondContact OE2-N 2.9Å; Y169-Q259 HydrophobicContact CD1-CB 3.43Å; Y169-Q259 VanDerWaalsContact CD1-CB 3.43Å; Y169-Q259 HydrophobicContact CD1-CG 3.9Å; Y169-Q259 HydrophobicContact CD2-CB 4.38Å; Y169-Q259 HydrophobicContact CD2-CG 4.49Å; Y169-Q259 HydrophobicContact CE1-CB 3.77Å; Y169-Q259 VanDerWaalsContact CE1-N 3.35Å; Y169-Q259 HydrophobicContact CG-CB 3.77Å; Y169-Q259 HydrophobicContact CG-CG 3.79Å
260	I	73.6	Confident	82	Confident	8 Å²	8	33.5 Å²	33.5	4%	0.041	21%	0.205	C	C	.	.	S	Bend	trans	-116.7	137.4	-172.6	-52	154.1	0	0	0	108.8	F42 F217 L221 S258 L262	F42-I260 HydrophobicContact CD1-CD1 4.48Å; F42-I260 HydrophobicContact CE1-CD1 3.83Å; F42-I260 HydrophobicContact CZ-CD1 4.29Å; F217-I260 HydrophobicContact CD1-CD1 3.27Å; F217-I260 HydrophobicContact CD1-CG1 4.37Å; F217-I260 HydrophobicContact CE1-CD1 3.43Å; F217-I260 VanDerWaalsContact CE1-CD1 3.43Å; F217-I260 HydrophobicContact CG-CD1 4.47Å; L221-I260 HydrophobicContact CD1-CD1 4.17Å; S258-I260 PolarHBondContact O-N 2.9Å; S258-I260 PolarHBondContact OG-O 2.99Å; I260-L262 HydrophobicContact CB-CD1 4.42Å; I260-L262 HydrophobicContact CB-CG 4.46Å; I260-L262 HydrophobicContact CG2-CD1 3.99Å; I260-L262 HydrophobicContact CG2-CG 3.82Å; I260-L262 PolarHBondContact O-N 3.41Å
261	N	74.9	Confident	82.6	Confident	127 Å²	127	31.2 Å²	31.2	68%	0.679	19%	0.185	S	C	*	.			trans	-71.5	75.7	173.2	-69.9	-1.4	0	0	0	110.8
262	L	82	Confident	83	Confident	18 Å²	18	27.6 Å²	27.6	9%	0.094	17%	0.166	C	C	.	.			trans	-120.5	157.8	172.6	-76.6	174.8	0	0	0	109.3	L221 V227 I260 I264	L221-L262 HydrophobicContact CD1-CD1 3.38Å; V227-L262 HydrophobicContact CG2-CB 3.45Å; V227-L262 VanDerWaalsContact CG2-CB 3.45Å; V227-L262 HydrophobicContact CG2-CD1 4.07Å; V227-L262 HydrophobicContact CG2-CG 4.42Å; I260-L262 HydrophobicContact CB-CD1 4.42Å; I260-L262 HydrophobicContact CB-CG 4.46Å; I260-L262 HydrophobicContact CG2-CD1 3.99Å; I260-L262 HydrophobicContact CG2-CG 3.82Å; I260-L262 PolarHBondContact O-N 3.41Å; L262-I264 PolarHBondContact O-N 3.35Å
263	P	85.8	Confident	83.4	Confident	39 Å²	39	27.1 Å²	27.1	25%	0.253	17%	0.166	S	C	.	.			trans	-69	128.7	179.2	29.9	-34.7	0	0	0	110.5	V226 V227 D251 Q252	V226-P263 CarbonylContact C-O 3.3Å; V226-P263 WeakPolarHBondContact CA-O 3.31Å; V226-P263 HydrophobicContact CG1-CG 4.41Å; V227-P263 PolarHBondContact N-O 2.92Å; D251-P263 HydrophobicContact CB-CB 3.91Å; Q252-P263 WeakPolarHBondContact O-CA 3.38Å
264	I	87.6	Confident	83.7	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	142.5	177.4	-58.7	176.5	0	0	0	108.2	V227 V229 L248 Q252 I254 L257 L262 V267	V227-I264 HydrophobicContact CB-CG1 4.06Å; V227-I264 HydrophobicContact CG1-CG1 4.38Å; V227-I264 CarbonylContact O-C 3.46Å; V227-I264 WeakPolarHBondContact O-CA 3.39Å; V229-I264 HydrophobicContact CG2-CD1 4.14Å; V229-I264 HydrophobicContact CG2-CG2 4.48Å; L248-I264 HydrophobicContact CD1-CB 4.38Å; L248-I264 HydrophobicContact CD1-CG2 4.22Å; L248-I264 WeakPolarHBondContact CD1-O 3.28Å; Q252-I264 PolarHBondContact N-O 3.46Å; Q252-I264 PolarHBondContact O-N 3.29Å; I254-I264 HydrophobicContact CB-CD1 4.01Å; I254-I264 HydrophobicContact CG1-CD1 4.46Å; L257-I264 HydrophobicContact CB-CD1 3.82Å; L257-I264 HydrophobicContact CD2-CD1 3.68Å; L257-I264 HydrophobicContact CG-CD1 3.84Å; L262-I264 PolarHBondContact O-N 3.35Å; I264-V267 HydrophobicContact CG2-CG2 3.94Å
265	R	87.7	Confident	83.9	Confident	59 Å²	59	35.3 Å²	35.3	22%	0.223	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	-37.5	176.8	-174.1	171.9	176	152.5	-9	113.1	V226 V227 L248 D251 T301	V226-R265 HydrophobicContact CB-CB 4.25Å; V226-R265 HydrophobicContact CG2-CB 4.46Å; V227-R265 PolarHBondContact O-N 3.08Å; L248-R265 PolarHBondContact N-O 3.18Å; D251-R265 WeakPolarHBondContact OD1-CB 3.49Å; D251-R265 WeakPolarHBondContact OD1-CD 3.16Å; D251-R265 WeakPolarHBondContact OD1-CG 3.1Å; R265-T301 PolarHBondContact NH2-OG1 3.14Å
266	Y	90.5	Very high	84.4	Confident	3 Å²	3	33.3 Å²	33.3	1%	0.012	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.4	-177.2	-58.9	-73.9	0	0	0	110.9	I41 A228 V229 F245 V246 R247 L291 T301	I41-Y266 HydrophobicContact CD1-CD2 4.11Å; I41-Y266 HydrophobicContact CD1-CE2 3.65Å; A228-Y266 CarbonylContact C-O 3.57Å; A228-Y266 VanDerWaalsContact CA-O 3.32Å; A228-Y266 WeakPolarHBondContact CA-O 3.16Å; A228-Y266 HydrophobicContact CB-CD2 4.37Å; V229-Y266 PolarHBondContact N-O 2.61Å; F245-Y266 HydrophobicContact CE1-CD1 4.22Å; F245-Y266 HydrophobicContact CE1-CE1 4.48Å; F245-Y266 HydrophobicContact CE2-CD1 4.21Å; F245-Y266 AromaticContact CZ-CD1 3.54Å; F245-Y266 HydrophobicContact CZ-CD1 3.54Å; F245-Y266 AromaticContact CZ-CE1 3.94Å; F245-Y266 HydrophobicContact CZ-CE1 3.94Å; F245-Y266 HydrophobicContact CZ-CG 4.44Å; V246-Y266 WeakPolarHBondContact O-CA 3.33Å; R247-Y266 HydrophobicContact CB-CD1 4.31Å; R247-Y266 HydrophobicContact CB-CE1 4.28Å; R247-Y266 HydrophobicContact CG-CD1 4.13Å; R247-Y266 HydrophobicContact CG-CE1 3.72Å; Y266-L291 HydrophobicContact CD2-CD2 3.92Å; Y266-L291 HydrophobicContact CE2-CD2 4.23Å; Y266-L291 HydrophobicContact CG-CD2 4.12Å; Y266-T301 PolarHBondContact OH-OG1 3.46Å
267	V	90.1	Very high	85	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	123.7	169	-176.7	0	0	0	0	107.9	L116 V229 V246 L257 I264	L116-V267 HydrophobicContact CD2-CG2 4.4Å; V229-V267 CarbonylContact O-C 3.55Å; V229-V267 WeakPolarHBondContact O-CA 3.43Å; V246-V267 WeakPolarHBondContact CA-O 3.44Å; V246-V267 HydrophobicContact CB-CB 4.11Å; V246-V267 WeakPolarHBondContact CB-O 3.31Å; V246-V267 PolarHBondContact N-O 3.02Å; V246-V267 PolarHBondContact O-N 2.88Å; L257-V267 HydrophobicContact CD2-CG2 3.88Å; I264-V267 HydrophobicContact CG2-CG2 3.94Å
268	F	92.8	Very high	85.4	Confident	3 Å²	3	38.5 Å²	38.5	1%	0.013	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	132	173.9	-176.5	-105.4	0	0	0	109.6	L95 L99 V229 I230 L231 A244 F245 L270 L287	L95-F268 HydrophobicContact CD1-CZ 4Å; L99-F268 HydrophobicContact CD2-CE2 4.01Å; V229-F268 PolarHBondContact O-N 2.79Å; I230-F268 CarbonylContact C-O 3.45Å; I230-F268 HydrophobicContact CG1-CB 4.42Å; I230-F268 HydrophobicContact CG2-CD1 3.98Å; L231-F268 PolarHBondContact N-O 2.72Å; A244-F268 CarbonylContact O-C 3.6Å; A244-F268 WeakPolarHBondContact O-CA 3.39Å; A244-F268 WeakPolarHBondContact O-CD2 3.35Å; F245-F268 HydrophobicContact CB-CD2 4.1Å; F245-F268 AromaticContact CD2-CD2 3.98Å; F245-F268 HydrophobicContact CD2-CD2 3.98Å; F268-L270 HydrophobicContact CD1-CB 4.37Å; F268-L270 HydrophobicContact CE1-CB 3.71Å; F268-L270 HydrophobicContact CE1-CD2 4.36Å; F268-L270 HydrophobicContact CZ-CB 4.31Å; F268-L287 HydrophobicContact CB-CD2 3.44Å; F268-L287 VanDerWaalsContact CB-CD2 3.44Å; F268-L287 HydrophobicContact CD1-CD2 3.38Å; F268-L287 HydrophobicContact CD2-CD2 3.49Å; F268-L287 VanDerWaalsContact CD2-CD2 3.49Å; F268-L287 HydrophobicContact CE1-CD2 3.85Å; F268-L287 HydrophobicContact CE2-CD2 3.97Å; F268-L287 HydrophobicContact CG-CD2 3.13Å; F268-L287 HydrophobicContact CZ-CD2 4.12Å
269	L	92.3	Very high	85.8	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	126.4	176.7	174.9	65.8	0	0	0	109	W59 F145 L163 L231 S243 A244 L271	W59-L269 HydrophobicContact CH2-CD1 4.26Å; W59-L269 HydrophobicContact CZ2-CD1 4.5Å; F145-L269 HydrophobicContact CE2-CD2 3.7Å; F145-L269 HydrophobicContact CE2-CG 4.44Å; F145-L269 HydrophobicContact CZ-CD2 3.78Å; F145-L269 HydrophobicContact CZ-CG 4.12Å; L163-L269 HydrophobicContact CD1-CD2 3.99Å; L163-L269 HydrophobicContact CD2-CD1 3.57Å; L163-L269 HydrophobicContact CD2-CD2 3.55Å; L163-L269 HydrophobicContact CD2-CG 4.22Å; L163-L269 HydrophobicContact CG-CD2 4.45Å; L231-L269 HydrophobicContact CB-CD1 3.75Å; L231-L269 HydrophobicContact CD1-CD1 4.32Å; L231-L269 CarbonylContact O-C 3.52Å; L231-L269 WeakPolarHBondContact O-CA 3.49Å; S243-L269 CarbonylContact C-O 3.51Å; S243-L269 VanDerWaalsContact CA-O 3.22Å; S243-L269 WeakPolarHBondContact CA-O 3.49Å; A244-L269 HydrophobicContact CB-CB 4.37Å; A244-L269 PolarHBondContact N-O 2.92Å; A244-L269 PolarHBondContact O-N 3.38Å; L269-L271 HydrophobicContact CD1-CD1 4.33Å; L269-L271 HydrophobicContact CD1-CD2 4.16Å; L269-L271 HydrophobicContact CD1-CG 4Å; L269-L271 HydrophobicContact CD2-CD1 4.39Å; L269-L271 HydrophobicContact CG-CD1 4.46Å; L269-L271 HydrophobicContact CG-CG 4.27Å
270	L	93	Very high	86.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	118	175.8	175.4	60.2	0	0	0	109.5	L98 L231 V232 G233 M241 F268 L280 V283	L98-L270 HydrophobicContact CD1-CD1 3.62Å; L98-L270 HydrophobicContact CD1-CD2 4.21Å; L98-L270 HydrophobicContact CD2-CD1 4.25Å; L231-L270 PolarHBondContact O-N 3.46Å; V232-L270 CarbonylContact C-O 3.52Å; V232-L270 WeakPolarHBondContact CA-O 3.15Å; V232-L270 HydrophobicContact CG1-CD2 4.38Å; V232-L270 HydrophobicContact CG2-CB 4.26Å; G233-L270 PolarHBondContact N-O 2.85Å; M241-L270 HydrophobicContact CG-CD1 3.8Å; M241-L270 HydrophobicContact SD-CD1 4.22Å; F268-L270 HydrophobicContact CD1-CB 4.37Å; F268-L270 HydrophobicContact CE1-CB 3.71Å; F268-L270 HydrophobicContact CE1-CD2 4.36Å; F268-L270 HydrophobicContact CZ-CB 4.31Å; L270-L280 HydrophobicContact CD2-CB 4.36Å; L270-L280 HydrophobicContact CD2-CD2 4.11Å; L270-L280 HydrophobicContact CG-CD2 4.39Å; L270-V283 HydrophobicContact CD2-CB 3.98Å; L270-V283 HydrophobicContact CD2-CG1 3.71Å
271	L	92.4	Very high	87.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	134.1	176.8	-61.8	174.1	0	0	0	109.6	W59 F145 L159 L163 G233 T235 V238 M241 G242 L269	W59-L271 HydrophobicContact CH2-CD2 4.28Å; F145-L271 HydrophobicContact CE1-CB 4.45Å; F145-L271 HydrophobicContact CE1-CD1 4.19Å; F145-L271 HydrophobicContact CZ-CD1 4.5Å; L159-L271 HydrophobicContact CD1-CD1 3.56Å; L163-L271 HydrophobicContact CD2-CD1 4.46Å; G233-L271 WeakPolarHBondContact O-CA 3.45Å; T235-L271 HydrophobicContact CG2-CD2 4.2Å; V238-L271 HydrophobicContact CG2-CB 3.98Å; V238-L271 HydrophobicContact CG2-CD1 4.29Å; M241-L271 WeakPolarHBondContact CA-O 3.45Å; G242-L271 PolarHBondContact N-O 3.09Å; G242-L271 PolarHBondContact O-N 2.97Å; L269-L271 HydrophobicContact CD1-CD1 4.33Å; L269-L271 HydrophobicContact CD1-CD2 4.16Å; L269-L271 HydrophobicContact CD1-CG 4Å; L269-L271 HydrophobicContact CD2-CD1 4.39Å; L269-L271 HydrophobicContact CG-CD1 4.46Å; L269-L271 HydrophobicContact CG-CG 4.27Å
272	A	91.5	Very high	88.1	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	157	175.4	0	0	0	0	0	111.3	G233 C234 T235 M241 C276 L280	G233-A272 PolarHBondContact O-N 2.89Å; C234-A272 CarbonylContact C-O 3.55Å; C234-A272 VanDerWaalsContact CA-O 3.27Å; C234-A272 WeakPolarHBondContact CA-O 3.44Å; T235-A272 PolarHBondContact N-O 3.46Å; M241-A272 HydrophobicContact CB-CB 4.36Å; M241-A272 HydrophobicContact CE-CB 4.23Å; M241-A272 HydrophobicContact CG-CB 4.1Å; A272-C276 HydrophobicContact CB-CB 3.96Å; A272-L280 HydrophobicContact CB-CD1 3.73Å; A272-L280 HydrophobicContact CB-CD2 3.79Å; A272-L280 HydrophobicContact CB-CG 4.32Å
273	P	90.2	Very high	88.6	Confident	29 Å²	29	33.3 Å²	33.3	19%	0.188	18%	0.184	C	C	.	.			trans	-63.2	154.7	169.8	25.8	-33.7	0	0	0	111.5	T235 D275 C276	T235-P273 WeakPolarHBondContact O-CA 3.46Å; P273-D275 PolarHBondContact O-N 3.32Å; P273-D275 VanDerWaalsContact O-N 3.15Å; P273-C276 VanDerWaalsContact O-CB 3.24Å; P273-C276 WeakPolarHBondContact O-CB 3.44Å; P273-C276 PolarHBondContact O-N 3.3Å
274	K	84.7	Confident	89	Confident	86 Å²	86	31.5 Å²	31.5	37%	0.374	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.1	176.9	-74.3	-170.9	-174.9	161.3	0	113.7	E50 C234 D236 C276	E50-K274 WeakPolarHBondContact OE2-CE 3.35Å; E50-K274 IonicContact OE2-NZ 3.48Å; E50-K274 PolarHBondContact OE2-NZ 3.29Å; C234-K274 HydrophobicContact CB-CG 4.45Å; D236-K274 WeakPolarHBondContact OD1-CB 3.43Å; D236-K274 WeakPolarHBondContact OD1-CD 3.34Å; D236-K274 WeakPolarHBondContact OD1-CG 3.31Å; D236-K274 WeakPolarHBondContact OD2-CD 3.33Å; D236-K274 WeakPolarHBondContact OD2-CE 3.18Å; D236-K274 IonicContact OD2-NZ 2.81Å; D236-K274 PolarHBondContact OD2-NZ 3.01Å; K274-C276 PolarHBondContact O-N 3.47Å
275	D	84	Confident	89.2	Confident	153 Å²	153	33.5 Å²	33.5	82%	0.818	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-1.4	176.7	-60.8	-30	0	0	0	113.9	P273 T277	P273-D275 PolarHBondContact O-N 3.32Å; P273-D275 VanDerWaalsContact O-N 3.15Å; D275-T277 PolarHBondContact O-N 3.37Å
276	C	82.7	Confident	89.4	Confident	34 Å²	34	30.7 Å²	30.7	23%	0.23	17%	0.169	C	C	.	.			trans	-72	127.1	-177.5	-164.8	0	0	0	0	112.2	M241 A272 P273 K274	M241-C276 WeakPolarHBondContact CE-SG 3.34Å; A272-C276 HydrophobicContact CB-CB 3.96Å; P273-C276 VanDerWaalsContact O-CB 3.24Å; P273-C276 WeakPolarHBondContact O-CB 3.44Å; P273-C276 PolarHBondContact O-N 3.3Å; K274-C276 PolarHBondContact O-N 3.47Å
277	T	82	Confident	89.5	Confident	142 Å²	142	30.6 Å²	30.6	87%	0.871	17%	0.168	S	C	*	.			trans	-86.5	-6.6	175.7	55.9	0	0	0	0	113.8	D275	D275-T277 PolarHBondContact O-N 3.37Å
278	V	85.1	Confident	89.7	Confident	46 Å²	46	30.5 Å²	30.5	28%	0.279	17%	0.168	S	C	.	.	S	Bend	trans	-81.4	132.3	-176.8	-177.1	0	0	0	0	109.6	T94 M241 L280 V283	T94-V278 HydrophobicContact CG2-CG1 4.42Å; M241-V278 HydrophobicContact CE-CB 4.22Å; M241-V278 HydrophobicContact CE-CG2 4.24Å; V278-L280 PolarHBondContact O-N 3.48Å; V278-V283 HydrophobicContact CG1-CG2 3.98Å
279	D	86.4	Confident	89.5	Confident	77 Å²	77	31.2 Å²	31.2	41%	0.412	17%	0.173	S	C	.	.			trans	-69.8	93.6	169.9	-179.2	10.7	0	0	0	110.2	A281 S282 V283 R285	D279-A281 PolarHBondContact O-N 2.83Å; D279-A281 WeakPolarHBondContact OD1-CB 3.21Å; D279-A281 PolarHBondContact OD1-N 3.12Å; D279-A281 VanDerWaalsContact OD1-N 3.17Å; D279-S282 PolarHBondContact O-N 3.38Å; D279-S282 PolarHBondContact OD1-N 2.98Å; D279-S282 VanDerWaalsContact OD2-CB 3.26Å; D279-S282 WeakPolarHBondContact OD2-CB 3.34Å; D279-S282 PolarHBondContact OD2-OG 2.73Å; D279-V283 PolarHBondContact O-N 3.13Å; D279-R285 IonicContact OD2-NH1 2.7Å
280	L	89.5	Confident	89.5	Confident	7 Å²	7	31.2 Å²	31.2	4%	0.037	17%	0.173	C	C	.	.	H	α-helix	trans	-62.6	-33.2	-178.7	-55.6	177.6	0	0	0	112	V232 G233 C234 M241 L270 A272 V278 S282 V283 G284	V232-L280 HydrophobicContact CG1-CB 3.18Å; V232-L280 HydrophobicContact CG1-CD1 4.09Å; V232-L280 HydrophobicContact CG1-CG 4.27Å; G233-L280 WeakPolarHBondContact O-CD1 3.5Å; C234-L280 WeakPolarHBondContact SG-CD1 3.49Å; M241-L280 HydrophobicContact CE-CD2 3.83Å; M241-L280 HydrophobicContact SD-CD2 4.44Å; L270-L280 HydrophobicContact CD2-CB 4.36Å; L270-L280 HydrophobicContact CD2-CD2 4.11Å; L270-L280 HydrophobicContact CG-CD2 4.39Å; A272-L280 HydrophobicContact CB-CD1 3.73Å; A272-L280 HydrophobicContact CB-CD2 3.79Å; A272-L280 HydrophobicContact CB-CG 4.32Å; V278-L280 PolarHBondContact O-N 3.48Å; L280-S282 VanDerWaalsContact C-N 3.28Å; L280-S282 PolarHBondContact O-N 3.17Å; L280-V283 WeakPolarHBondContact O-CB 3.35Å; L280-V283 PolarHBondContact O-N 3.4Å; L280-V283 VanDerWaalsContact O-N 3.11Å; L280-G284 PolarHBondContact O-N 3.3Å
281	A	90.2	Very high	89.4	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-62.5	-41.8	178.2	0	0	0	0	0	110.2	K62 D279 V283 G284 R285	K62-A281 HydrophobicContact CD-CB 3.75Å; D279-A281 PolarHBondContact O-N 2.83Å; D279-A281 WeakPolarHBondContact OD1-CB 3.21Å; D279-A281 PolarHBondContact OD1-N 3.12Å; D279-A281 VanDerWaalsContact OD1-N 3.17Å; A281-V283 VanDerWaalsContact C-N 3.31Å; A281-V283 PolarHBondContact O-N 3.13Å; A281-G284 CarbonylContact O-C 3.58Å; A281-G284 WeakPolarHBondContact O-CA 3.13Å; A281-G284 PolarHBondContact O-N 2.85Å; A281-G284 VanDerWaalsContact O-N 3.12Å; A281-R285 WeakPolarHBondContact O-CG 3.23Å; A281-R285 PolarHBondContact O-N 3.28Å
282	S	89.9	Confident	89.1	Confident	17 Å²	17	33.3 Å²	33.3	12%	0.119	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-30.4	174.1	-70.7	0	0	0	0	113.6	S91 D279 L280 R285 C286	S91-S282 WeakPolarHBondContact OG-CB 3.49Å; D279-S282 PolarHBondContact O-N 3.38Å; D279-S282 PolarHBondContact OD1-N 2.98Å; D279-S282 VanDerWaalsContact OD2-CB 3.26Å; D279-S282 WeakPolarHBondContact OD2-CB 3.34Å; D279-S282 PolarHBondContact OD2-OG 2.73Å; L280-S282 VanDerWaalsContact C-N 3.28Å; L280-S282 PolarHBondContact O-N 3.17Å; S282-R285 PolarHBondContact O-N 3.3Å; S282-R285 PolarHBondContact OG-NH1 3.43Å; S282-R285 VanDerWaalsContact OG-NH1 3.15Å; S282-C286 PolarHBondContact O-N 2.81Å; S282-C286 PolarHBondContact O-SG 3Å
283	V	92.7	Very high	88.8	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.7	-44.9	169.5	179.8	0	0	0	0	110.6	T94 L95 L98 L270 V278 D279 L280 A281 R285 C286 L287	T94-V283 HydrophobicContact CG2-CG2 4.33Å; L95-V283 HydrophobicContact CB-CG1 4.03Å; L95-V283 HydrophobicContact CD1-CG1 4.11Å; L98-V283 HydrophobicContact CD1-CG1 4.04Å; L270-V283 HydrophobicContact CD2-CB 3.98Å; L270-V283 HydrophobicContact CD2-CG1 3.71Å; V278-V283 HydrophobicContact CG1-CG2 3.98Å; D279-V283 PolarHBondContact O-N 3.13Å; L280-V283 WeakPolarHBondContact O-CB 3.35Å; L280-V283 PolarHBondContact O-N 3.4Å; L280-V283 VanDerWaalsContact O-N 3.11Å; A281-V283 VanDerWaalsContact C-N 3.31Å; A281-V283 PolarHBondContact O-N 3.13Å; V283-R285 VanDerWaalsContact C-N 3.35Å; V283-R285 PolarHBondContact O-N 2.93Å; V283-C286 WeakPolarHBondContact O-CB 3.25Å; V283-C286 PolarHBondContact O-N 2.88Å; V283-L287 PolarHBondContact O-N 3.41Å
284	G	93	Very high	88.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.3	-41.7	173.5	0	0	0	0	0	113	L280 A281 C286 L287 A288	L280-G284 PolarHBondContact O-N 3.3Å; A281-G284 CarbonylContact O-C 3.58Å; A281-G284 WeakPolarHBondContact O-CA 3.13Å; A281-G284 PolarHBondContact O-N 2.85Å; A281-G284 VanDerWaalsContact O-N 3.12Å; G284-C286 PolarHBondContact O-N 2.93Å; G284-L287 PolarHBondContact O-N 2.96Å; G284-A288 PolarHBondContact O-N 3.06Å
285	R	92.1	Very high	87.9	Confident	43 Å²	43	36.2 Å²	36.2	16%	0.162	21%	0.214	C	C	.	.	H	α-helix	trans	-59.8	-42.7	173.8	-63.7	-171.9	177.6	101.6	0.5	112.3	L45 W65 E69 L87 D279 A281 S282 V283 L287 A288 S289	L45-R285 HydrophobicContact CD2-CG 4.3Å; W65-R285 HydrophobicContact CH2-CB 4.33Å; W65-R285 HydrophobicContact CH2-CG 3.86Å; W65-R285 HydrophobicContact CZ2-CB 3.88Å; W65-R285 HydrophobicContact CZ2-CG 3.67Å; E69-R285 VanDerWaalsContact OE1-CD 3.25Å; E69-R285 WeakPolarHBondContact OE1-CD 3.29Å; E69-R285 IonicContact OE1-CZ 3.33Å; E69-R285 IonicContact OE1-NE 3.62Å; E69-R285 PolarHBondContact OE1-NE 3.29Å; L87-R285 HydrophobicContact CD2-CB 4.4Å; D279-R285 IonicContact OD2-NH1 2.7Å; A281-R285 WeakPolarHBondContact O-CG 3.23Å; A281-R285 PolarHBondContact O-N 3.28Å; S282-R285 PolarHBondContact O-N 3.3Å; S282-R285 PolarHBondContact OG-NH1 3.43Å; S282-R285 VanDerWaalsContact OG-NH1 3.15Å; V283-R285 VanDerWaalsContact C-N 3.35Å; V283-R285 PolarHBondContact O-N 2.93Å; R285-L287 VanDerWaalsContact C-N 3.29Å; R285-L287 PolarHBondContact O-N 3.48Å; R285-A288 PolarHBondContact O-N 3.31Å; R285-S289 PolarHBondContact O-N 2.84Å; R285-S289 PolarHBondContact O-OG 3.11Å
286	C	92.7	Very high	87.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-43.5	177	-65.9	0	0	0	0	111.3	L87 L95 S282 V283 G284 S289 I290	L87-C286 HydrophobicContact CD2-CB 4.4Å; L95-C286 HydrophobicContact CD2-CB 3.82Å; S282-C286 PolarHBondContact O-N 2.81Å; S282-C286 PolarHBondContact O-SG 3Å; V283-C286 WeakPolarHBondContact O-CB 3.25Å; V283-C286 PolarHBondContact O-N 2.88Å; G284-C286 PolarHBondContact O-N 2.93Å; C286-S289 PolarHBondContact O-N 3.47Å; C286-I290 VanDerWaalsContact O-CG1 3.27Å; C286-I290 WeakPolarHBondContact O-CG1 3.49Å; C286-I290 PolarHBondContact O-N 2.9Å; C286-I290 VanDerWaalsContact O-N 3.15Å
287	L	93.2	Very high	87.8	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.2	-42.2	178	-176.9	65.3	0	0	0	112	L95 L99 I230 F268 V283 G284 R285 S289 I290 L291	L95-L287 HydrophobicContact CD1-CB 4.07Å; L95-L287 HydrophobicContact CD1-CD1 4.35Å; L95-L287 HydrophobicContact CD2-CB 3.83Å; L95-L287 HydrophobicContact CD2-CD1 4.29Å; L99-L287 HydrophobicContact CD1-CD1 4.45Å; I230-L287 HydrophobicContact CD1-CB 4.46Å; I230-L287 HydrophobicContact CD1-CD2 4.44Å; I230-L287 HydrophobicContact CD1-CG 4.45Å; I230-L287 HydrophobicContact CG1-CD2 4.46Å; F268-L287 HydrophobicContact CB-CD2 3.44Å; F268-L287 VanDerWaalsContact CB-CD2 3.44Å; F268-L287 HydrophobicContact CD1-CD2 3.38Å; F268-L287 HydrophobicContact CD2-CD2 3.49Å; F268-L287 VanDerWaalsContact CD2-CD2 3.49Å; F268-L287 HydrophobicContact CE1-CD2 3.85Å; F268-L287 HydrophobicContact CE2-CD2 3.97Å; F268-L287 HydrophobicContact CG-CD2 3.13Å; F268-L287 HydrophobicContact CZ-CD2 4.12Å; V283-L287 PolarHBondContact O-N 3.41Å; G284-L287 PolarHBondContact O-N 2.96Å; R285-L287 VanDerWaalsContact C-N 3.29Å; R285-L287 PolarHBondContact O-N 3.48Å; L287-S289 VanDerWaalsContact C-N 3.32Å; L287-S289 PolarHBondContact O-N 3.45Å; L287-I290 PolarHBondContact O-N 3.39Å; L287-L291 HydrophobicContact CD1-CD1 4.49Å; L287-L291 HydrophobicContact CG-CD1 4Å; L287-L291 WeakPolarHBondContact O-CG 3.36Å; L287-L291 PolarHBondContact O-N 3.39Å
288	A	92.5	Very high	87.6	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.4	-46.2	176	0	0	0	0	0	111.3	C43 W65 I230 G284 R285 I290 L291 I292	C43-A288 HydrophobicContact CB-CB 4.03Å; W65-A288 HydrophobicContact CD2-CB 3.47Å; W65-A288 VanDerWaalsContact CD2-CB 3.47Å; W65-A288 HydrophobicContact CE3-CB 3.52Å; W65-A288 HydrophobicContact CG-CB 4.11Å; W65-A288 HydrophobicContact CH2-CB 3.97Å; W65-A288 HydrophobicContact CZ2-CB 3.88Å; W65-A288 HydrophobicContact CZ3-CB 3.8Å; I230-A288 HydrophobicContact CD1-CB 3.66Å; G284-A288 PolarHBondContact O-N 3.06Å; R285-A288 PolarHBondContact O-N 3.31Å; A288-I290 VanDerWaalsContact C-N 3.32Å; A288-I290 PolarHBondContact O-N 2.94Å; A288-L291 PolarHBondContact O-N 3.13Å; A288-I292 WeakPolarHBondContact O-CD1 3.4Å; A288-I292 WeakPolarHBondContact O-CG1 3.46Å; A288-I292 PolarHBondContact O-N 2.81Å; A288-I292 VanDerWaalsContact O-N 3.07Å
289	S	90.3	Very high	87.5	Confident	19 Å²	19	28.5 Å²	28.5	13%	0.133	16%	0.161	C	C	.	.	H	α-helix	trans	-60.6	-37.6	176.6	-64.6	0	0	0	0	113.6	S85 R285 C286 L287 D293	S85-S289 WeakPolarHBondContact CB-OG 3.26Å; R285-S289 PolarHBondContact O-N 2.84Å; R285-S289 PolarHBondContact O-OG 3.11Å; C286-S289 PolarHBondContact O-N 3.47Å; L287-S289 VanDerWaalsContact C-N 3.32Å; L287-S289 PolarHBondContact O-N 3.45Å; S289-D293 PolarHBondContact O-N 2.94Å
290	I	91.4	Very high	87.3	Confident	2 Å²	2	25 Å²	25	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-70.1	-37	176.4	-66.1	167.8	0	0	0	111.1	L95 C286 L287 A288 D293 S296 L300 V312 V313 F316	L95-I290 HydrophobicContact CD2-CD1 3.8Å; C286-I290 VanDerWaalsContact O-CG1 3.27Å; C286-I290 WeakPolarHBondContact O-CG1 3.49Å; C286-I290 PolarHBondContact O-N 2.9Å; C286-I290 VanDerWaalsContact O-N 3.15Å; L287-I290 PolarHBondContact O-N 3.39Å; A288-I290 VanDerWaalsContact C-N 3.32Å; A288-I290 PolarHBondContact O-N 2.94Å; I290-D293 PolarHBondContact O-N 3.23Å; I290-S296 WeakPolarHBondContact O-CB 3.01Å; I290-L300 HydrophobicContact CG2-CD1 4.16Å; I290-V312 HydrophobicContact CG2-CG1 4.3Å; I290-V313 HydrophobicContact CD1-CB 4.48Å; I290-V313 HydrophobicContact CD1-CG1 4.19Å; I290-V313 HydrophobicContact CD1-CG2 4.08Å; I290-F316 HydrophobicContact CD1-CD1 4.31Å; I290-F316 HydrophobicContact CD1-CG 4.49Å; I290-F316 HydrophobicContact CG1-CB 4.26Å; I290-F316 HydrophobicContact CG1-CD1 3.77Å; I290-F316 HydrophobicContact CG1-CD2 3.98Å; I290-F316 HydrophobicContact CG1-CE1 4.04Å; I290-F316 HydrophobicContact CG1-CE2 4.24Å; I290-F316 HydrophobicContact CG1-CG 3.73Å; I290-F316 HydrophobicContact CG1-CZ 4.27Å
291	L	90.2	Very high	86.8	Confident	3 Å²	3	26.5 Å²	26.5	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-69.4	-32.9	178.8	-77	164.7	0	0	0	113.2	A228 I230 Y266 L287 A288 S297 L300	A228-L291 HydrophobicContact CB-CD1 3.85Å; I230-L291 HydrophobicContact CD1-CD1 4.31Å; Y266-L291 HydrophobicContact CD2-CD2 3.92Å; Y266-L291 HydrophobicContact CE2-CD2 4.23Å; Y266-L291 HydrophobicContact CG-CD2 4.12Å; L287-L291 HydrophobicContact CD1-CD1 4.49Å; L287-L291 HydrophobicContact CG-CD1 4Å; L287-L291 WeakPolarHBondContact O-CG 3.36Å; L287-L291 PolarHBondContact O-N 3.39Å; A288-L291 PolarHBondContact O-N 3.13Å; L291-S297 WeakPolarHBondContact O-CB 3.46Å; L291-L300 HydrophobicContact CD2-CD1 3.5Å; L291-L300 VanDerWaalsContact CD2-CD1 3.5Å; L291-L300 HydrophobicContact CG-CD1 4.13Å
292	I	86.5	Confident	86.3	Confident	41 Å²	41	31.4 Å²	31.4	21%	0.21	18%	0.178	C	C	.	.	H	α-helix	trans	-73.4	-32.8	177	-62.6	151.2	0	0	0	111.1	W65 A288 S294	W65-I292 HydrophobicContact CB-CD1 3.19Å; W65-I292 HydrophobicContact CB-CG1 3.97Å; W65-I292 HydrophobicContact CG-CD1 3.39Å; A288-I292 WeakPolarHBondContact O-CD1 3.4Å; A288-I292 WeakPolarHBondContact O-CG1 3.46Å; A288-I292 PolarHBondContact O-N 2.81Å; A288-I292 VanDerWaalsContact O-N 3.07Å; I292-S294 PolarHBondContact O-N 3.4Å; I292-S294 VanDerWaalsContact O-N 3.07Å
293	D	85.4	Confident	85.8	Confident	47 Å²	47	30.7 Å²	30.7	25%	0.251	17%	0.174	S	C	.	.	S	Bend	trans	-62.9	113.9	176.9	176.1	42.9	0	0	0	110.1	S289 I290 A295 S296 S297 F316	S289-D293 PolarHBondContact O-N 2.94Å; I290-D293 PolarHBondContact O-N 3.23Å; D293-A295 PolarHBondContact O-N 3.5Å; D293-A295 VanDerWaalsContact O-N 3.16Å; D293-S296 PolarHBondContact O-N 2.67Å; D293-S296 VanDerWaalsContact OD2-CB 3.23Å; D293-S296 WeakPolarHBondContact OD2-CB 3.5Å; D293-S296 PolarHBondContact OD2-N 3.14Å; D293-S296 PolarHBondContact OD2-OG 3.04Å; D293-S297 WeakPolarHBondContact O-CB 3.3Å; D293-S297 PolarHBondContact O-N 3.2Å; D293-F316 HydrophobicContact CB-CD2 4.23Å; D293-F316 HydrophobicContact CB-CE2 4.14Å
294	S	78.4	Confident	85.1	Confident	97 Å²	97	35.7 Å²	35.7	68%	0.678	20%	0.199	S	C	*	.	H	α-helix	trans	-55.5	-36.5	-175.4	61.4	0	0	0	0	112.9	I292 K298	I292-S294 PolarHBondContact O-N 3.4Å; I292-S294 VanDerWaalsContact O-N 3.07Å; S294-K298 PolarHBondContact O-N 2.96Å
295	A	78.7	Confident	84.7	Confident	32 Å²	32	37.5 Å²	37.5	26%	0.264	21%	0.21	S	C	.	.	H	α-helix	trans	-78.9	-41.5	-177.4	0	0	0	0	0	112.2	D293 K298 C299	D293-A295 PolarHBondContact O-N 3.5Å; D293-A295 VanDerWaalsContact O-N 3.16Å; A295-K298 WeakPolarHBondContact O-CB 3.42Å; A295-K298 PolarHBondContact O-N 3.12Å; A295-C299 PolarHBondContact O-N 2.91Å
296	S	82.4	Confident	84.2	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-38.5	174.3	-59.1	0	0	0	0	111.8	I290 D293 K298 C299 L300 V312	I290-S296 WeakPolarHBondContact O-CB 3.01Å; D293-S296 PolarHBondContact O-N 2.67Å; D293-S296 VanDerWaalsContact OD2-CB 3.23Å; D293-S296 WeakPolarHBondContact OD2-CB 3.5Å; D293-S296 PolarHBondContact OD2-N 3.14Å; D293-S296 PolarHBondContact OD2-OG 3.04Å; S296-K298 VanDerWaalsContact C-N 3.29Å; S296-K298 PolarHBondContact O-N 2.93Å; S296-C299 PolarHBondContact O-N 2.66Å; S296-C299 VanDerWaalsContact O-N 3.13Å; S296-L300 WeakPolarHBondContact O-CG 3.35Å; S296-L300 PolarHBondContact O-N 3.2Å; S296-V312 WeakPolarHBondContact O-CG1 3.37Å
297	S	81.1	Confident	83.9	Confident	17 Å²	17	43.3 Å²	43.3	12%	0.119	24%	0.238	C	C	.	.	H	α-helix	trans	-60.5	-35.6	176	-174.7	0	0	0	0	113.3	I41 L291 D293 L300 T301	I41-S297 WeakPolarHBondContact CD1-OG 3.46Å; L291-S297 WeakPolarHBondContact O-CB 3.46Å; D293-S297 WeakPolarHBondContact O-CB 3.3Å; D293-S297 PolarHBondContact O-N 3.2Å; S297-L300 PolarHBondContact O-N 3.39Å; S297-T301 PolarHBondContact O-N 2.95Å; S297-T301 PolarHBondContact O-OG1 3.39Å; S297-T301 VanDerWaalsContact O-OG1 3.11Å
298	K	78.7	Confident	83.7	Confident	146 Å²	146	47.3 Å²	47.3	64%	0.635	26%	0.257	S	S	*	.	H	α-helix	trans	-60.6	-51.5	171.2	-175.1	179.4	179.1	178.8	0	110.8	S294 A295 S296 L300 T301 D302	S294-K298 PolarHBondContact O-N 2.96Å; A295-K298 WeakPolarHBondContact O-CB 3.42Å; A295-K298 PolarHBondContact O-N 3.12Å; S296-K298 VanDerWaalsContact C-N 3.29Å; S296-K298 PolarHBondContact O-N 2.93Å; K298-L300 VanDerWaalsContact C-N 3.28Å; K298-L300 PolarHBondContact O-N 3.31Å; K298-T301 WeakPolarHBondContact O-CB 3.4Å; K298-T301 PolarHBondContact O-N 3.17Å; K298-D302 PolarHBondContact O-N 3.48Å; K298-D302 VanDerWaalsContact O-N 3.17Å
299	C	82.2	Confident	83.4	Confident	46 Å²	46	47.3 Å²	47.3	31%	0.311	26%	0.257	S	S	.	.	H	α-helix	trans	-63.2	-33.3	179	-59.4	0	0	0	0	112.6	A295 S296 T301 D302 S303 V312	A295-C299 PolarHBondContact O-N 2.91Å; S296-C299 PolarHBondContact O-N 2.66Å; S296-C299 VanDerWaalsContact O-N 3.13Å; C299-T301 VanDerWaalsContact C-N 3.35Å; C299-D302 PolarHBondContact O-N 2.97Å; C299-S303 WeakPolarHBondContact O-CB 3.2Å; C299-S303 PolarHBondContact O-N 2.9Å; C299-V312 HydrophobicContact CB-CB 4.35Å; C299-V312 HydrophobicContact CB-CG1 4.02Å; C299-V312 HydrophobicContact CB-CG2 3.49Å; C299-V312 VanDerWaalsContact CB-CG2 3.49Å
300	L	82.9	Confident	83.4	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-64.9	-37.6	173.2	-70.6	176	0	0	0	112.2	I290 L291 S296 S297 K298 D302 S303 L309 V312	I290-L300 HydrophobicContact CG2-CD1 4.16Å; L291-L300 HydrophobicContact CD2-CD1 3.5Å; L291-L300 VanDerWaalsContact CD2-CD1 3.5Å; L291-L300 HydrophobicContact CG-CD1 4.13Å; S296-L300 WeakPolarHBondContact O-CG 3.35Å; S296-L300 PolarHBondContact O-N 3.2Å; S297-L300 PolarHBondContact O-N 3.39Å; K298-L300 VanDerWaalsContact C-N 3.28Å; K298-L300 PolarHBondContact O-N 3.31Å; L300-D302 VanDerWaalsContact C-N 3.31Å; L300-D302 PolarHBondContact O-N 3.37Å; L300-S303 PolarHBondContact O-N 2.89Å; L300-S303 PolarHBondContact O-OG 3.02Å; L300-L309 HydrophobicContact CD2-CD2 3.4Å; L300-V312 HydrophobicContact CD2-CB 4.25Å; L300-V312 HydrophobicContact CD2-CG1 4.13Å; L300-V312 HydrophobicContact CD2-CG2 4.27Å; L300-V312 HydrophobicContact CG-CG1 4.08Å
301	T	78.4	Confident	83.4	Confident	40 Å²	40	51 Å²	51	25%	0.245	28%	0.276	C	S	.	.	H	α-helix	trans	-64.7	-37.4	175.5	-61.1	0	0	0	0	111.7	R247 R265 Y266 S297 K298 C299	R247-T301 PolarHBondContact NH1-O 3.12Å; R265-T301 PolarHBondContact NH2-OG1 3.14Å; Y266-T301 PolarHBondContact OH-OG1 3.46Å; S297-T301 PolarHBondContact O-N 2.95Å; S297-T301 PolarHBondContact O-OG1 3.39Å; S297-T301 VanDerWaalsContact O-OG1 3.11Å; K298-T301 WeakPolarHBondContact O-CB 3.4Å; K298-T301 PolarHBondContact O-N 3.17Å; C299-T301 VanDerWaalsContact C-N 3.35Å
302	D	79.1	Confident	83.4	Confident	103 Å²	103	51 Å²	51	55%	0.551	28%	0.276	S	S	*	.	H	α-helix	trans	-84.2	-15.8	-177.9	-62.4	-23.6	0	0	0	112.7	K298 C299 L300	K298-D302 PolarHBondContact O-N 3.48Å; K298-D302 VanDerWaalsContact O-N 3.17Å; C299-D302 PolarHBondContact O-N 2.97Å; L300-D302 VanDerWaalsContact C-N 3.31Å; L300-D302 PolarHBondContact O-N 3.37Å
303	S	80.4	Confident	83.6	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.021	27%	0.267	C	S	.	.			trans	-69.6	131.6	-177.6	69.6	0	0	0	0	113	R247 C299 L300 L309	R247-S303 PolarHBondContact NH1-O 2.97Å; C299-S303 WeakPolarHBondContact O-CB 3.2Å; C299-S303 PolarHBondContact O-N 2.9Å; L300-S303 PolarHBondContact O-N 2.89Å; L300-S303 PolarHBondContact O-OG 3.02Å; S303-L309 WeakPolarHBondContact OG-CD2 3.35Å
304	I	78.6	Confident	83.9	Confident	104 Å²	104	49.2 Å²	49.2	53%	0.533	27%	0.267	S	S	.	.			trans	-116.7	-25.8	176.9	-56.7	171.1	0	0	0	110.5	L104	L104-I304 WeakPolarHBondContact CD2-O 3.19Å
305	T	82.8	Confident	84.4	Confident	39 Å²	39	48 Å²	48	24%	0.239	25%	0.253	C	S	.	.	S	Bend	trans	-112.9	145.5	-173.4	-77.2	0	0	0	0	111.9	E130 K307 Q308 L309	E130-T305 WeakPolarHBondContact OE1-CB 3.3Å; E130-T305 WeakPolarHBondContact OE1-CG2 3.41Å; E130-T305 PolarHBondContact OE1-OG1 3Å; E130-T305 VanDerWaalsContact OE2-CA 3.23Å; E130-T305 WeakPolarHBondContact OE2-CA 3.4Å; T305-K307 VanDerWaalsContact C-N 3.26Å; T305-K307 HydrophobicContact CG2-CB 3.84Å; T305-K307 HydrophobicContact CG2-CG 4.29Å; T305-K307 PolarHBondContact O-N 2.86Å; T305-Q308 VanDerWaalsContact N-OE1 3.12Å; T305-Q308 WeakPolarHBondContact O-CA 3.45Å; T305-Q308 WeakPolarHBondContact O-CB 3Å; T305-Q308 PolarHBondContact O-N 3.34Å; T305-L309 PolarHBondContact O-N 3.49Å; T305-L309 VanDerWaalsContact O-N 3.14Å
306	G	82.8	Confident	84.9	Confident	5 Å²	5	47.8 Å²	47.8	5%	0.052	25%	0.246	C	C	.	.	H	α-helix	trans	-55.4	-36.5	175.5	0	0	0	0	0	113.9	E130 Q308 L309 S310	E130-G306 PolarHBondContact OE2-N 2.8Å; G306-Q308 VanDerWaalsContact C-N 3.34Å; G306-Q308 PolarHBondContact O-N 3.14Å; G306-L309 WeakPolarHBondContact O-CB 2.97Å; G306-L309 PolarHBondContact O-N 3.3Å; G306-S310 PolarHBondContact O-N 2.85Å
307	K	86.7	Confident	85.2	Confident	159 Å²	159	49.1 Å²	49.1	69%	0.691	25%	0.253	S	S	*	.	H	α-helix	trans	-66	-33.1	173.3	-61.7	-179.1	179.8	176.5	0	113.3	T305 S310 N311	T305-K307 VanDerWaalsContact C-N 3.26Å; T305-K307 HydrophobicContact CG2-CB 3.84Å; T305-K307 HydrophobicContact CG2-CG 4.29Å; T305-K307 PolarHBondContact O-N 2.86Å; K307-S310 WeakPolarHBondContact CA-OG 3.39Å; K307-S310 PolarHBondContact O-N 2.87Å; K307-S310 PolarHBondContact O-OG 3.31Å; K307-N311 PolarHBondContact O-N 3.45Å; K307-N311 VanDerWaalsContact O-N 3.09Å; K307-N311 PolarHBondContact O-OD1 3.08Å
308	Q	87.9	Confident	85.5	Confident	84 Å²	84	53.6 Å²	53.6	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-68.5	-40.5	175.5	-68.6	174.5	-31.7	0	0	109.9	T305 G306 S310 N311 V312	T305-Q308 VanDerWaalsContact N-OE1 3.12Å; T305-Q308 WeakPolarHBondContact O-CA 3.45Å; T305-Q308 WeakPolarHBondContact O-CB 3Å; T305-Q308 PolarHBondContact O-N 3.34Å; G306-Q308 VanDerWaalsContact C-N 3.34Å; G306-Q308 PolarHBondContact O-N 3.14Å; Q308-S310 VanDerWaalsContact C-N 3.34Å; Q308-S310 PolarHBondContact O-N 3.11Å; Q308-N311 WeakPolarHBondContact O-CB 3.37Å; Q308-N311 PolarHBondContact O-N 3.05Å; Q308-N311 VanDerWaalsContact O-N 3.16Å; Q308-V312 WeakPolarHBondContact O-CG2 3.42Å; Q308-V312 PolarHBondContact O-N 3Å; Q308-V312 VanDerWaalsContact O-N 3.11Å
309	L	87.4	Confident	85.7	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-59.2	-42.8	173.2	-70.3	172	0	0	0	112.2	L99 L104 F245 L300 S303 T305 G306 N311 V312 V313	L99-L309 HydrophobicContact CB-CB 4.02Å; L99-L309 HydrophobicContact CD2-CD1 4.46Å; L104-L309 HydrophobicContact CD1-CD1 3.74Å; L104-L309 HydrophobicContact CD2-CD1 3.9Å; L104-L309 HydrophobicContact CG-CD1 4.35Å; F245-L309 HydrophobicContact CD1-CD1 4.05Å; F245-L309 HydrophobicContact CD1-CD2 4.34Å; F245-L309 HydrophobicContact CE1-CD2 4.1Å; L300-L309 HydrophobicContact CD2-CD2 3.4Å; S303-L309 WeakPolarHBondContact OG-CD2 3.35Å; T305-L309 PolarHBondContact O-N 3.49Å; T305-L309 VanDerWaalsContact O-N 3.14Å; G306-L309 WeakPolarHBondContact O-CB 2.97Å; G306-L309 PolarHBondContact O-N 3.3Å; L309-N311 VanDerWaalsContact C-N 3.3Å; L309-N311 PolarHBondContact O-N 3.32Å; L309-V312 WeakPolarHBondContact O-CB 3.43Å; L309-V312 PolarHBondContact O-N 2.97Å; L309-V313 PolarHBondContact O-N 3.43Å
310	S	89.6	Confident	85.7	Confident	10 Å²	10	53.6 Å²	53.6	7%	0.07	28%	0.276	C	S	.	.	H	α-helix	trans	-64.6	-35	176.1	60.3	0	0	0	0	113	G306 K307 Q308 V312 V313 D314	G306-S310 PolarHBondContact O-N 2.85Å; K307-S310 WeakPolarHBondContact CA-OG 3.39Å; K307-S310 PolarHBondContact O-N 2.87Å; K307-S310 PolarHBondContact O-OG 3.31Å; Q308-S310 VanDerWaalsContact C-N 3.34Å; Q308-S310 PolarHBondContact O-N 3.11Å; S310-V312 VanDerWaalsContact C-N 3.29Å; S310-V312 PolarHBondContact O-N 3.22Å; S310-V313 WeakPolarHBondContact O-CB 3.22Å; S310-V313 PolarHBondContact O-N 3.13Å; S310-D314 PolarHBondContact O-N 2.97Å; S310-D314 VanDerWaalsContact O-N 3.08Å
311	N	90.6	Very high	85.5	Confident	87 Å²	87	63.5 Å²	63.5	47%	0.465	31%	0.313	S	S	.	.	H	α-helix	trans	-65.5	-34	175.6	-66.9	-7	0	0	0	111.5	K307 Q308 L309 V313 D314 D315	K307-N311 PolarHBondContact O-N 3.45Å; K307-N311 VanDerWaalsContact O-N 3.09Å; K307-N311 PolarHBondContact O-OD1 3.08Å; Q308-N311 WeakPolarHBondContact O-CB 3.37Å; Q308-N311 PolarHBondContact O-N 3.05Å; Q308-N311 VanDerWaalsContact O-N 3.16Å; L309-N311 VanDerWaalsContact C-N 3.3Å; L309-N311 PolarHBondContact O-N 3.32Å; N311-V313 VanDerWaalsContact C-N 3.28Å; N311-V313 PolarHBondContact O-N 2.99Å; N311-D314 PolarHBondContact O-N 3.49Å; N311-D314 VanDerWaalsContact O-N 3.15Å; N311-D315 PolarHBondContact O-N 3.03Å
312	V	90.4	Very high	85.5	Confident	5 Å²	5	67.8 Å²	67.8	3%	0.03	33%	0.333	C	S	.	.	H	α-helix	trans	-61.4	-39.4	173.5	-175.3	0	0	0	0	111.4	I290 S296 C299 L300 Q308 L309 S310 D314 D315 F316	I290-V312 HydrophobicContact CG2-CG1 4.3Å; S296-V312 WeakPolarHBondContact O-CG1 3.37Å; C299-V312 HydrophobicContact CB-CB 4.35Å; C299-V312 HydrophobicContact CB-CG1 4.02Å; C299-V312 HydrophobicContact CB-CG2 3.49Å; C299-V312 VanDerWaalsContact CB-CG2 3.49Å; L300-V312 HydrophobicContact CD2-CB 4.25Å; L300-V312 HydrophobicContact CD2-CG1 4.13Å; L300-V312 HydrophobicContact CD2-CG2 4.27Å; L300-V312 HydrophobicContact CG-CG1 4.08Å; Q308-V312 WeakPolarHBondContact O-CG2 3.42Å; Q308-V312 PolarHBondContact O-N 3Å; Q308-V312 VanDerWaalsContact O-N 3.11Å; L309-V312 WeakPolarHBondContact O-CB 3.43Å; L309-V312 PolarHBondContact O-N 2.97Å; S310-V312 VanDerWaalsContact C-N 3.29Å; S310-V312 PolarHBondContact O-N 3.22Å; V312-D314 VanDerWaalsContact C-N 3.33Å; V312-D315 PolarHBondContact O-N 3.04Å; V312-F316 WeakPolarHBondContact O-CB 3.36Å; V312-F316 PolarHBondContact O-N 2.88Å
313	V	91.5	Very high	85.2	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.006	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-41.4	175	-175.4	0	0	0	0	110.8	I92 R96 L99 I290 L309 S310 N311 F316 I317	I92-V313 HydrophobicContact CD1-CG1 4.38Å; I92-V313 HydrophobicContact CG1-CG1 3.77Å; R96-V313 HydrophobicContact CB-CB 4.39Å; R96-V313 HydrophobicContact CB-CG1 4.08Å; R96-V313 HydrophobicContact CG-CB 4.22Å; R96-V313 HydrophobicContact CG-CG1 4.34Å; L99-V313 HydrophobicContact CD1-CG2 3.64Å; I290-V313 HydrophobicContact CD1-CB 4.48Å; I290-V313 HydrophobicContact CD1-CG1 4.19Å; I290-V313 HydrophobicContact CD1-CG2 4.08Å; L309-V313 PolarHBondContact O-N 3.43Å; S310-V313 WeakPolarHBondContact O-CB 3.22Å; S310-V313 PolarHBondContact O-N 3.13Å; N311-V313 VanDerWaalsContact C-N 3.28Å; N311-V313 PolarHBondContact O-N 2.99Å; V313-F316 PolarHBondContact O-N 3.49Å; V313-I317 HydrophobicContact CG1-CD1 3.95Å; V313-I317 HydrophobicContact CG1-CG1 4.49Å; V313-I317 VanDerWaalsContact O-CG1 3.25Å; V313-I317 WeakPolarHBondContact O-CG1 2.95Å; V313-I317 PolarHBondContact O-N 3.16Å
314	D	90.8	Very high	85	Confident	49 Å²	49	70.5 Å²	70.5	26%	0.262	35%	0.35	S	S	.	.	H	α-helix	trans	-63	-45.6	176.9	-69.2	-36.9	0	0	0	111.1	R96 S310 N311 V312 F316 I317 T318	R96-D314 WeakPolarHBondContact CD-OD1 3.11Å; R96-D314 IonicContact CZ-OD1 2.95Å; R96-D314 IonicContact CZ-OD2 3.55Å; R96-D314 IonicContact NE-OD1 2.72Å; R96-D314 IonicContact NH1-OD1 2.85Å; R96-D314 PolarHBondContact NH1-OD1 2.96Å; R96-D314 IonicContact NH1-OD2 3.31Å; R96-D314 PolarHBondContact NH1-OD2 2.7Å; S310-D314 PolarHBondContact O-N 2.97Å; S310-D314 VanDerWaalsContact O-N 3.08Å; N311-D314 PolarHBondContact O-N 3.49Å; N311-D314 VanDerWaalsContact O-N 3.15Å; V312-D314 VanDerWaalsContact C-N 3.33Å; D314-F316 VanDerWaalsContact C-N 3.33Å; D314-F316 PolarHBondContact O-N 3.18Å; D314-I317 WeakPolarHBondContact O-CB 3.43Å; D314-I317 PolarHBondContact O-N 2.01Å; D314-I317 VanDerWaalsContact O-N 3.12Å; D314-T318 WeakPolarHBondContact O-CG2 3.48Å; D314-T318 PolarHBondContact O-N 3.49Å
315	D	88.8	Confident	84.6	Confident	71 Å²	71	70.3 Å²	70.3	38%	0.38	36%	0.355	S	S	.	.	H	α-helix	trans	-59	-43.3	175.2	-75	-13.2	0	0	0	111.6	N311 V312 I317 T318 R319	N311-D315 PolarHBondContact O-N 3.03Å; V312-D315 PolarHBondContact O-N 3.04Å; D315-I317 PolarHBondContact O-N 2.97Å; D315-T318 PolarHBondContact O-N 3.29Å; D315-T318 PolarHBondContact O-OG1 3.41Å; D315-R319 PolarHBondContact O-N 3.3Å
316	F	90.1	Very high	84.1	Confident	27 Å²	27	76.1 Å²	76.1	12%	0.118	39%	0.385	C	S	.	.	H	α-helix	trans	-61	-44	174.6	178.2	-93.9	0	0	0	111.6	L87 I92 I290 D293 V312 V313 D314 T318 R319 S320	L87-F316 HydrophobicContact CD1-CE1 3.8Å; L87-F316 HydrophobicContact CD1-CZ 3.98Å; I92-F316 HydrophobicContact CD1-CD1 3.83Å; I92-F316 HydrophobicContact CD1-CE1 3.95Å; I290-F316 HydrophobicContact CD1-CD1 4.31Å; I290-F316 HydrophobicContact CD1-CG 4.49Å; I290-F316 HydrophobicContact CG1-CB 4.26Å; I290-F316 HydrophobicContact CG1-CD1 3.77Å; I290-F316 HydrophobicContact CG1-CD2 3.98Å; I290-F316 HydrophobicContact CG1-CE1 4.04Å; I290-F316 HydrophobicContact CG1-CE2 4.24Å; I290-F316 HydrophobicContact CG1-CG 3.73Å; I290-F316 HydrophobicContact CG1-CZ 4.27Å; D293-F316 HydrophobicContact CB-CD2 4.23Å; D293-F316 HydrophobicContact CB-CE2 4.14Å; V312-F316 WeakPolarHBondContact O-CB 3.36Å; V312-F316 PolarHBondContact O-N 2.88Å; V313-F316 PolarHBondContact O-N 3.49Å; D314-F316 VanDerWaalsContact C-N 3.33Å; D314-F316 PolarHBondContact O-N 3.18Å; F316-T318 VanDerWaalsContact C-N 3.33Å; F316-T318 PolarHBondContact O-N 3.22Å; F316-R319 PolarHBondContact O-N 3.34Å; F316-S320 WeakPolarHBondContact O-CB 3.48Å; F316-S320 PolarHBondContact O-N 2.95Å
317	I	88.9	Confident	82.9	Confident	32 Å²	32	83.5 Å²	83.5	16%	0.164	42%	0.416	C	S	.	.	H	α-helix	trans	-61.2	-41.7	177.4	-69.6	162.9	0	0	0	110.9	I92 M93 V313 D314 D315 R319 S320	I92-I317 HydrophobicContact CD1-CD1 4.13Å; I92-I317 HydrophobicContact CD1-CG1 3.64Å; I92-I317 HydrophobicContact CG1-CD1 4.15Å; I92-I317 HydrophobicContact CG1-CG1 4.22Å; I92-I317 HydrophobicContact CG2-CD1 4.05Å; I92-I317 HydrophobicContact CG2-CG1 4.41Å; M93-I317 HydrophobicContact CE-CD1 3.59Å; V313-I317 HydrophobicContact CG1-CD1 3.95Å; V313-I317 HydrophobicContact CG1-CG1 4.49Å; V313-I317 VanDerWaalsContact O-CG1 3.25Å; V313-I317 WeakPolarHBondContact O-CG1 2.95Å; V313-I317 PolarHBondContact O-N 3.16Å; D314-I317 WeakPolarHBondContact O-CB 3.43Å; D314-I317 PolarHBondContact O-N 2.01Å; D314-I317 VanDerWaalsContact O-N 3.12Å; D315-I317 PolarHBondContact O-N 2.97Å; I317-R319 PolarHBondContact O-N 3.15Å; I317-S320 WeakPolarHBondContact CA-OG 3.49Å; I317-S320 PolarHBondContact O-N 3.38Å; I317-S320 VanDerWaalsContact O-N 3.14Å; I317-S320 PolarHBondContact O-OG 3.4Å
318	T	86.9	Confident	81.4	Confident	111 Å²	111	80.3 Å²	80.3	68%	0.681	41%	0.405	S	S	*	.	H	α-helix	trans	-61.3	-27.6	178.7	65.8	0	0	0	0	113.5	D314 D315 F316	D314-T318 WeakPolarHBondContact O-CG2 3.48Å; D314-T318 PolarHBondContact O-N 3.49Å; D315-T318 PolarHBondContact O-N 3.29Å; D315-T318 PolarHBondContact O-OG1 3.41Å; F316-T318 VanDerWaalsContact C-N 3.33Å; F316-T318 PolarHBondContact O-N 3.22Å
319	R	82	Confident	79.7	Confident	146 Å²	146	79.2 Å²	79.2	55%	0.551	41%	0.406	S	S	*	.	H	α-helix	trans	-92.1	-21.3	177.9	-62.5	177	-171.2	175.9	4.1	112.9	D315 F316 I317	D315-R319 PolarHBondContact O-N 3.3Å; F316-R319 PolarHBondContact O-N 3.34Å; I317-R319 PolarHBondContact O-N 3.15Å
320	S	83.7	Confident	78	Confident	46 Å²	46	88.6 Å²	88.6	32%	0.322	45%	0.449	S	S	.	.	S	Bend	trans	-71.3	144.6	178.4	76.7	0	0	0	0	111.9	F316 I317	F316-S320 WeakPolarHBondContact O-CB 3.48Å; F316-S320 PolarHBondContact O-N 2.95Å; I317-S320 WeakPolarHBondContact CA-OG 3.49Å; I317-S320 PolarHBondContact O-N 3.38Å; I317-S320 VanDerWaalsContact O-N 3.14Å; I317-S320 PolarHBondContact O-OG 3.4Å
321	R	78.8	Confident	76	Confident	210 Å²	210	91.6 Å²	91.6	79%	0.792	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-102.8	125.1	174	-64.3	-176.5	-177.4	177.8	4	109.4
322	I	77.8	Confident	73.9	Confident	130 Å²	130	88.7 Å²	88.7	67%	0.667	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-92.2	123.6	-179.8	-57.2	173.1	0	0	0	109.1
323	I	72.6	Confident	72	Confident	97 Å²	97	97.7 Å²	97.7	50%	0.497	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-97.4	128.6	177.2	-58.5	175.7	0	0	0	108.9	M332	I323-M332 HydrophobicContact CD1-SD 3.98Å
324	P	75.7	Confident	69.9	Low	66 Å²	66	99.8 Å²	99.8	43%	0.429	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-70.2	145.1	176.1	28	-32.8	0	0	0	111.1	N326 K327	P324-N326 VanDerWaalsContact C-N 3.3Å; P324-N326 PolarHBondContact O-N 2.73Å; P324-K327 HydrophobicContact CG-CB 4.14Å; P324-K327 HydrophobicContact CG-CD 4.04Å; P324-K327 HydrophobicContact CG-CG 4.15Å; P324-K327 PolarHBondContact O-N 2.81Å; P324-K327 VanDerWaalsContact O-N 3.09Å
325	P	70.8	Confident	67.7	Low	100 Å²	100	102.2 Å²	102.2	65%	0.649	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-62.3	-32.8	-170.3	23.9	-34.6	0	0	0	113.9	K327 I328	P325-K327 PolarHBondContact O-N 3.46Å; P325-I328 WeakPolarHBondContact O-CD1 3.25Å; P325-I328 WeakPolarHBondContact O-CG1 3.28Å; P325-I328 PolarHBondContact O-N 3.31Å
326	N	71.9	Confident	65.8	Low	162 Å²	162	99.1 Å²	99.1	87%	0.866	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-77.7	-3.9	-178.7	-67.8	-5	0	0	0	113.9	P324	P324-N326 VanDerWaalsContact C-N 3.3Å; P324-N326 PolarHBondContact O-N 2.73Å
327	K	58.2	Low	63.9	Low	160 Å²	160	100.4 Å²	100.4	70%	0.696	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-112.7	17.9	176.2	-67.4	-170.1	176.1	-176.4	0	112.4	P324 P325 P329	P324-K327 HydrophobicContact CG-CB 4.14Å; P324-K327 HydrophobicContact CG-CD 4.04Å; P324-K327 HydrophobicContact CG-CG 4.15Å; P324-K327 PolarHBondContact O-N 2.81Å; P324-K327 VanDerWaalsContact O-N 3.09Å; P325-K327 PolarHBondContact O-N 3.46Å; K327-P329 WeakPolarHBondContact O-CD 3.01Å
328	I	56	Low	61.6	Low	92 Å²	92	104.2 Å²	104.2	47%	0.472	52%	0.515	S	S	.	.			trans	-75	103.8	171.8	-61.4	169.2	0	0	0	106.1	P325 M332	P325-I328 WeakPolarHBondContact O-CD1 3.25Å; P325-I328 WeakPolarHBondContact O-CG1 3.28Å; P325-I328 PolarHBondContact O-N 3.31Å; I328-M332 HydrophobicContact CB-CE 4.49Å; I328-M332 HydrophobicContact CB-SD 4.3Å; I328-M332 HydrophobicContact CG1-CE 4.11Å; I328-M332 HydrophobicContact CG1-SD 4.26Å; I328-M332 HydrophobicContact CG2-CB 3.79Å; I328-M332 HydrophobicContact CG2-CE 3.84Å; I328-M332 HydrophobicContact CG2-CG 4.43Å; I328-M332 HydrophobicContact CG2-SD 3.86Å
329	P	51.1	Low	59.8	Low	61 Å²	61	100 Å²	100	40%	0.396	49%	0.488	S	S	.	.			trans	-69.1	148.8	175.7	38.3	-41.1	0	0	0	108.4	K327 D331 M332	K327-P329 WeakPolarHBondContact O-CD 3.01Å; P329-D331 WeakPolarHBondContact CB-OD1 3.18Å; P329-D331 WeakPolarHBondContact CG-OD1 3.44Å; P329-D331 PolarHBondContact O-N 2.95Å; P329-M332 HydrophobicContact CG-CB 4.1Å; P329-M332 WeakPolarHBondContact O-CB 3.22Å; P329-M332 PolarHBondContact O-N 3.36Å
330	E	52.5	Low	58	Low	198 Å²	198	95.6 Å²	95.6	93%	0.925	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-59.6	-19.3	-177.5	-73	-178.2	155.5	0	0	112.7	M332	E330-M332 VanDerWaalsContact C-N 3.3Å
331	D	47.1	Very low	56.1	Low	72 Å²	72	97.5 Å²	97.5	39%	0.385	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-86.9	12.4	172.3	68.4	-25.8	0	0	0	113.9	P329 Y333 L334 K338	P329-D331 WeakPolarHBondContact CB-OD1 3.18Å; P329-D331 WeakPolarHBondContact CG-OD1 3.44Å; P329-D331 PolarHBondContact O-N 2.95Å; D331-Y333 CarbonylContact O-C 3.55Å; D331-Y333 PolarHBondContact O-N 2.97Å; D331-Y333 VanDerWaalsContact O-O 3.14Å; D331-L334 VanDerWaalsContact O-CA 3.29Å; D331-L334 WeakPolarHBondContact O-CA 3.42Å; D331-L334 PolarHBondContact O-N 2.96Å; D331-L334 VanDerWaalsContact O-N 3.08Å; D331-K338 IonicContact OD2-NZ 3.88Å; D331-K338 PolarHBondContact OD2-NZ 3.35Å
332	M	47.4	Very low	54.2	Low	27 Å²	27	94.1 Å²	94.1	13%	0.133	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-77.3	2.7	172.5	-147.3	179.8	88.1	0	0	114.2	L86 I323 I328 P329 E330 L334	L86-M332 HydrophobicContact CD1-CE 4.34Å; L86-M332 HydrophobicContact CD2-CE 3.38Å; I323-M332 HydrophobicContact CD1-SD 3.98Å; I328-M332 HydrophobicContact CB-CE 4.49Å; I328-M332 HydrophobicContact CB-SD 4.3Å; I328-M332 HydrophobicContact CG1-CE 4.11Å; I328-M332 HydrophobicContact CG1-SD 4.26Å; I328-M332 HydrophobicContact CG2-CB 3.79Å; I328-M332 HydrophobicContact CG2-CE 3.84Å; I328-M332 HydrophobicContact CG2-CG 4.43Å; I328-M332 HydrophobicContact CG2-SD 3.86Å; P329-M332 HydrophobicContact CG-CB 4.1Å; P329-M332 WeakPolarHBondContact O-CB 3.22Å; P329-M332 PolarHBondContact O-N 3.36Å; E330-M332 VanDerWaalsContact C-N 3.3Å; M332-L334 HydrophobicContact CB-CD1 4.45Å; M332-L334 HydrophobicContact CG-CD1 3.51Å; M332-L334 HydrophobicContact CG-CG 4.24Å; M332-L334 PolarHBondContact O-N 3.02Å
333	Y	50	Low	52.6	Low	194 Å²	194	91.9 Å²	91.9	76%	0.761	47%	0.471	S	S	*	.	S	Bend	trans	-63.3	63.6	132	-67.1	-82.6	0	0	0	107.3	D331 E335	D331-Y333 CarbonylContact O-C 3.55Å; D331-Y333 PolarHBondContact O-N 2.97Å; D331-Y333 VanDerWaalsContact O-O 3.14Å; Y333-E335 PolarHBondContact O-N 3.3Å
334	L	46.6	Very low	51.2	Low	44 Å²	44	89.8 Å²	89.8	23%	0.23	47%	0.469	C	S	.	.			trans	-60.8	96.6	-177.9	-94.8	146.1	0	0	0	103.8	D331 M332 V336 K338 I339	D331-L334 VanDerWaalsContact O-CA 3.29Å; D331-L334 WeakPolarHBondContact O-CA 3.42Å; D331-L334 PolarHBondContact O-N 2.96Å; D331-L334 VanDerWaalsContact O-N 3.08Å; M332-L334 HydrophobicContact CB-CD1 4.45Å; M332-L334 HydrophobicContact CG-CD1 3.51Å; M332-L334 HydrophobicContact CG-CG 4.24Å; M332-L334 PolarHBondContact O-N 3.02Å; L334-V336 PolarHBondContact O-N 3.38Å; L334-K338 HydrophobicContact CD2-CB 4.06Å; L334-I339 HydrophobicContact CB-CD1 3.84Å; L334-I339 HydrophobicContact CD1-CD1 3.99Å; L334-I339 HydrophobicContact CD2-CD1 3.82Å; L334-I339 HydrophobicContact CD2-CG1 3.7Å; L334-I339 HydrophobicContact CG-CD1 4.07Å; L334-I339 HydrophobicContact CG-CG1 4.49Å
335	E	44.1	Very low	49.7	Very low	100 Å²	100	90.6 Å²	90.6	47%	0.467	47%	0.472	S	S	.	.			trans	-52	122.5	161.8	-68.1	-166.1	149.1	0	0	103.8	K81 Y333 S337 K338	K81-E335 IonicContact NZ-OE1 3.76Å; K81-E335 PolarHBondContact NZ-OE1 2.96Å; Y333-E335 PolarHBondContact O-N 3.3Å; E335-S337 WeakPolarHBondContact CB-OG 3.13Å; E335-S337 PolarHBondContact O-N 3.04Å; E335-S337 PolarHBondContact O-OG 3.01Å; E335-K338 PolarHBondContact O-N 3.12Å
336	V	50.4	Low	48.2	Very low	7 Å²	7	87.2 Å²	87.2	4%	0.042	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-45.3	-23	179.9	-179.9	0	0	0	0	111.2	Y68 L334 K338 I339 G773	Y68-V336 HydrophobicContact CD1-CG2 4.31Å; Y68-V336 HydrophobicContact CD2-CG2 4.14Å; Y68-V336 HydrophobicContact CE1-CG2 4.23Å; Y68-V336 HydrophobicContact CE2-CG1 3.92Å; Y68-V336 HydrophobicContact CE2-CG2 4.06Å; Y68-V336 HydrophobicContact CG-CG2 4.27Å; L334-V336 PolarHBondContact O-N 3.38Å; V336-K338 PolarHBondContact O-N 2.54Å; V336-I339 PolarHBondContact O-N 3.21Å; V336-G773 VanDerWaalsContact CB-O 3.31Å; V336-G773 WeakPolarHBondContact CB-O 3.22Å; V336-G773 WeakPolarHBondContact CG1-O 3.42Å
337	S	48.8	Very low	46.8	Very low	53 Å²	53	83 Å²	83	37%	0.371	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-45.1	-27.8	169.9	71.2	0	0	0	0	116.8	E335 K775	E335-S337 WeakPolarHBondContact CB-OG 3.13Å; E335-S337 PolarHBondContact O-N 3.04Å; E335-S337 PolarHBondContact O-OG 3.01Å; S337-K775 PolarHBondContact O-NZ 3.23Å
338	K	41.9	Very low	46.1	Very low	113 Å²	113	81 Å²	81	49%	0.491	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-97.6	-14.9	-177.5	-66.5	-171.2	-176.2	-175.5	0	115.9	D331 L334 E335 V336 S341	D331-K338 IonicContact OD2-NZ 3.88Å; D331-K338 PolarHBondContact OD2-NZ 3.35Å; L334-K338 HydrophobicContact CD2-CB 4.06Å; E335-K338 PolarHBondContact O-N 3.12Å; V336-K338 PolarHBondContact O-N 2.54Å; K338-S341 PolarHBondContact O-OG 3.34Å
339	I	48	Very low	45.3	Very low	21 Å²	21	80.8 Å²	80.8	11%	0.108	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-27.2	-167.5	-58.2	171.5	0	0	0	113.7	I84 L334 V336 S341 Q342 D343	I84-I339 HydrophobicContact CD1-CD1 3.21Å; I84-I339 HydrophobicContact CG1-CD1 4.45Å; L334-I339 HydrophobicContact CB-CD1 3.84Å; L334-I339 HydrophobicContact CD1-CD1 3.99Å; L334-I339 HydrophobicContact CD2-CD1 3.82Å; L334-I339 HydrophobicContact CD2-CG1 3.7Å; L334-I339 HydrophobicContact CG-CD1 4.07Å; L334-I339 HydrophobicContact CG-CG1 4.49Å; V336-I339 PolarHBondContact O-N 3.21Å; I339-S341 PolarHBondContact O-N 3.35Å; I339-Q342 PolarHBondContact O-N 3.35Å; I339-D343 HydrophobicContact CG2-CB 4.37Å; I339-D343 VanDerWaalsContact CG2-OD2 3.22Å; I339-D343 WeakPolarHBondContact CG2-OD2 3.47Å; I339-D343 PolarHBondContact O-N 2.95Å; I339-D343 VanDerWaalsContact O-N 3.14Å
340	D	44	Very low	44.6	Very low	55 Å²	55	85.7 Å²	85.7	29%	0.294	44%	0.444	S	S	.	.	H	α-helix	trans	-55.6	-19.7	-179.7	-72.3	-24.2	0	0	0	113.2	A344	D340-A344 VanDerWaalsContact O-CB 3.27Å; D340-A344 WeakPolarHBondContact O-CB 3.39Å
341	S	44	Very low	43.9	Very low	85 Å²	85	83.2 Å²	83.2	59%	0.594	43%	0.43	S	S	*	.	H	α-helix	trans	-76.8	-20.8	172.6	53.9	0	0	0	0	115	K338 I339 V345	K338-S341 PolarHBondContact O-OG 3.34Å; I339-S341 PolarHBondContact O-N 3.35Å; S341-V345 VanDerWaalsContact O-CG2 3.28Å; S341-V345 WeakPolarHBondContact O-CG2 3.48Å
342	Q	40.3	Very low	43.3	Very low	139 Å²	139	81.1 Å²	81.1	65%	0.65	42%	0.423	S	S	*	.	H	α-helix	trans	-104	-36.8	-177.9	-69.1	-173.9	-13.1	0	0	112.9	I339 V345 A346	I339-Q342 PolarHBondContact O-N 3.35Å; Q342-V345 PolarHBondContact O-N 3.2Å; Q342-A346 PolarHBondContact O-N 2.9Å; Q342-A346 VanDerWaalsContact O-N 3.13Å
343	D	42.7	Very low	42.5	Very low	83 Å²	83	83.9 Å²	83.9	44%	0.444	44%	0.441	S	S	.	.	H	α-helix	trans	-76.7	-32.2	178.9	-76.6	-15.7	0	0	0	112.2	I339 V345 A346 D347	I339-D343 HydrophobicContact CG2-CB 4.37Å; I339-D343 VanDerWaalsContact CG2-OD2 3.22Å; I339-D343 WeakPolarHBondContact CG2-OD2 3.47Å; I339-D343 PolarHBondContact O-N 2.95Å; I339-D343 VanDerWaalsContact O-N 3.14Å; D343-V345 PolarHBondContact O-N 3.02Å; D343-A346 PolarHBondContact O-N 3.33Å; D343-A346 VanDerWaalsContact O-N 3.09Å; D343-D347 WeakPolarHBondContact O-CB 3.34Å; D343-D347 PolarHBondContact O-N 3.28Å
344	A	44.2	Very low	42	Very low	53 Å²	53	79.8 Å²	79.8	44%	0.438	44%	0.439	S	S	.	.	H	α-helix	trans	-59.5	-39.1	169.6	0	0	0	0	0	111.3	D340 A346 D348	D340-A344 VanDerWaalsContact O-CB 3.27Å; D340-A344 WeakPolarHBondContact O-CB 3.39Å; A344-A346 VanDerWaalsContact C-N 3.33Å; A344-A346 PolarHBondContact O-N 3Å; A344-D348 VanDerWaalsContact O-CB 3.23Å; A344-D348 WeakPolarHBondContact O-CB 3.44Å; A344-D348 PolarHBondContact O-N 3.4Å
345	V	42.8	Very low	41.3	Very low	84 Å²	84	86.7 Å²	86.7	51%	0.509	47%	0.47	S	S	.	.	H	α-helix	trans	-66.5	-36.3	175.1	178.2	0	0	0	0	111.1	S341 Q342 D343 L349	S341-V345 VanDerWaalsContact O-CG2 3.28Å; S341-V345 WeakPolarHBondContact O-CG2 3.48Å; Q342-V345 PolarHBondContact O-N 3.2Å; D343-V345 PolarHBondContact O-N 3.02Å; V345-L349 HydrophobicContact CG1-CD1 3.86Å; V345-L349 WeakPolarHBondContact O-CB 3.36Å; V345-L349 WeakPolarHBondContact O-CD1 3.5Å; V345-L349 PolarHBondContact O-N 3.32Å; V345-L349 VanDerWaalsContact O-N 3.11Å
346	A	40.5	Very low	40.6	Very low	29 Å²	29	89.4 Å²	89.4	24%	0.24	48%	0.483	C	S	.	.	H	α-helix	trans	-76.5	-40.1	-179.5	0	0	0	0	0	113.3	Q342 D343 A344 L349 Q350	Q342-A346 PolarHBondContact O-N 2.9Å; Q342-A346 VanDerWaalsContact O-N 3.13Å; D343-A346 PolarHBondContact O-N 3.33Å; D343-A346 VanDerWaalsContact O-N 3.09Å; A344-A346 VanDerWaalsContact C-N 3.33Å; A344-A346 PolarHBondContact O-N 3Å; A346-L349 CarbonylContact O-C 3.51Å; A346-L349 WeakPolarHBondContact O-CB 3.27Å; A346-L349 PolarHBondContact O-N 3.17Å; A346-Q350 PolarHBondContact O-N 3.43Å
347	D	41.8	Very low	39.6	Very low	72 Å²	72	92.9 Å²	92.9	39%	0.385	50%	0.504	S	S	.	.	H	α-helix	trans	-71.7	-37.3	177.1	-162.8	34.2	0	0	0	110.9	D343 L349 Q350 K351	D343-D347 WeakPolarHBondContact O-CB 3.34Å; D343-D347 PolarHBondContact O-N 3.28Å; D347-L349 VanDerWaalsContact C-N 3.26Å; D347-L349 PolarHBondContact O-N 3.02Å; D347-Q350 PolarHBondContact O-N 3.02Å; D347-K351 WeakPolarHBondContact O-CB 3.35Å; D347-K351 PolarHBondContact O-N 3.31Å; D347-K351 IonicContact OD1-NZ 3.36Å; D347-K351 WeakPolarHBondContact OD2-CE 3.43Å; D347-K351 IonicContact OD2-NZ 3.62Å; D347-K351 PolarHBondContact OD2-NZ 3.06Å
348	D	43.2	Very low	39.1	Very low	118 Å²	118	93.8 Å²	93.8	63%	0.631	51%	0.51	S	S	*	.	H	α-helix	trans	-62.2	-34.6	168.3	-81	-16	0	0	0	111.6	A344 A352	A344-D348 VanDerWaalsContact O-CB 3.23Å; A344-D348 WeakPolarHBondContact O-CB 3.44Å; A344-D348 PolarHBondContact O-N 3.4Å; D348-A352 WeakPolarHBondContact O-CB 3.42Å; D348-A352 PolarHBondContact O-N 3.48Å; D348-A352 VanDerWaalsContact O-N 3.14Å
349	L	40.1	Very low	38.6	Very low	89 Å²	89	96.6 Å²	96.6	47%	0.466	52%	0.524	S	S	.	.	H	α-helix	trans	-73.8	-23.2	175.7	-107	118.4	0	0	0	114.2	V345 A346 D347	V345-L349 HydrophobicContact CG1-CD1 3.86Å; V345-L349 WeakPolarHBondContact O-CB 3.36Å; V345-L349 WeakPolarHBondContact O-CD1 3.5Å; V345-L349 PolarHBondContact O-N 3.32Å; V345-L349 VanDerWaalsContact O-N 3.11Å; A346-L349 CarbonylContact O-C 3.51Å; A346-L349 WeakPolarHBondContact O-CB 3.27Å; A346-L349 PolarHBondContact O-N 3.17Å; D347-L349 VanDerWaalsContact C-N 3.26Å; D347-L349 PolarHBondContact O-N 3.02Å
350	Q	37	Very low	38.3	Very low	163 Å²	163	101.5 Å²	101.5	76%	0.762	55%	0.545	S	S	*	.	H	α-helix	trans	-95.5	-34.4	-179.9	-102.4	179.6	-14.5	0	0	113.1	A346 D347	A346-Q350 PolarHBondContact O-N 3.43Å; D347-Q350 PolarHBondContact O-N 3.02Å
351	K	37.9	Very low	38.3	Very low	146 Å²	146	105.4 Å²	105.4	64%	0.635	57%	0.566	S	S	*	*	H	α-helix	trans	-73.1	-19.2	168.8	-73.7	171.8	179.8	159.1	0	112.3	D347 T353	D347-K351 WeakPolarHBondContact O-CB 3.35Å; D347-K351 PolarHBondContact O-N 3.31Å; D347-K351 IonicContact OD1-NZ 3.36Å; D347-K351 WeakPolarHBondContact OD2-CE 3.43Å; D347-K351 IonicContact OD2-NZ 3.62Å; D347-K351 PolarHBondContact OD2-NZ 3.06Å; K351-T353 PolarHBondContact O-N 2.97Å
352	A	33.2	Very low	38.7	Very low	28 Å²	28	104 Å²	104	23%	0.231	55%	0.552	C	S	.	*			trans	-68	83.5	164.4	0	0	0	0	0	110.6	D348 T357	D348-A352 WeakPolarHBondContact O-CB 3.42Å; D348-A352 PolarHBondContact O-N 3.48Å; D348-A352 VanDerWaalsContact O-N 3.14Å; A352-T357 HydrophobicContact CB-CG2 3.64Å
353	T	32	Very low	39.2	Very low	85 Å²	85	105.6 Å²	105.6	52%	0.521	56%	0.559	S	S	.	*			trans	-45.2	127.5	146.4	21.4	0	0	0	0	107.9	K351 E355 E356	K351-T353 PolarHBondContact O-N 2.97Å; T353-E355 PolarHBondContact O-N 2.99Å; T353-E356 PolarHBondContact O-N 3.13Å; T353-E356 VanDerWaalsContact O-N 3.09Å
354	P	37.8	Very low	39.8	Very low	108 Å²	108	102.1 Å²	102.1	70%	0.701	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-2.7	-166.2	19.9	-30.2	0	0	0	115.3	T357	P354-T357 PolarHBondContact O-OG1 3.5Å
355	E	32	Very low	40.8	Very low	190 Å²	190	100.5 Å²	100.5	89%	0.888	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-9.7	177.4	-65.6	-173.5	163.6	0	0	114.5	T353	T353-E355 PolarHBondContact O-N 2.99Å
356	E	30.5	Very low	42.1	Very low	157 Å²	157	101.5 Å²	101.5	73%	0.734	53%	0.529	S	S	*	.	S	Bend	trans	-101.8	-0.9	178.9	-69	-173	169.5	0	0	113.9	T353 S358	T353-E356 PolarHBondContact O-N 3.13Å; T353-E356 VanDerWaalsContact O-N 3.09Å; E356-S358 PolarHBondContact O-N 3.01Å; E356-S358 VanDerWaalsContact O-N 3.09Å
357	T	28.7	Very low	43.7	Very low	80 Å²	80	106.7 Å²	106.7	49%	0.491	54%	0.543	S	S	.	.	S	Bend	trans	-73.6	106.4	177	45	0	0	0	0	112	A352 P354	A352-T357 HydrophobicContact CB-CG2 3.64Å; P354-T357 PolarHBondContact O-OG1 3.5Å
358	S	38.7	Very low	45.3	Very low	71 Å²	71	105.4 Å²	105.4	50%	0.497	54%	0.538	S	S	.	.	S	Bend	trans	97.9	8.8	155.9	75.9	0	0	0	0	120.5	E356	E356-S358 PolarHBondContact O-N 3.01Å; E356-S358 VanDerWaalsContact O-N 3.09Å
359	H	31.1	Very low	47	Very low	172 Å²	172	102.1 Å²	102.1	80%	0.796	53%	0.533	S	S	*	.			trans	-107.4	88.7	156.4	-74.9	-81.9	0	0	0	108.7
360	F	42.5	Very low	49.1	Very low	125 Å²	125	107.2 Å²	107.2	55%	0.548	55%	0.545	S	S	.	.			trans	-28.4	148.7	163.8	-80	-110.1	0	0	0	112	L362 P717	F360-L362 WeakPolarHBondContact O-CA 3.36Å; F360-L362 VanDerWaalsContact O-CB 3.31Å; F360-L362 WeakPolarHBondContact O-CB 3.46Å; F360-L362 PolarHBondContact O-N 2.88Å; F360-P717 HydrophobicContact CD1-CG 4.15Å; F360-P717 HydrophobicContact CE1-CG 3.7Å
361	N	44	Very low	51.5	Low	136 Å²	136	105.2 Å²	105.2	73%	0.727	54%	0.539	S	S	*	.	S	Bend	trans	-41.7	64.2	170.7	-69.3	-28.3	0	0	0	114.8	E363	N361-E363 VanDerWaalsContact C-N 3.25Å
362	L	50.9	Low	53.8	Low	57 Å²	57	101.6 Å²	101.6	30%	0.298	52%	0.524	S	S	.	.			trans	-90.3	1.7	-177	-145.6	77	0	0	0	110.1	F360 G364 L365 L366 A512	F360-L362 WeakPolarHBondContact O-CA 3.36Å; F360-L362 VanDerWaalsContact O-CB 3.31Å; F360-L362 WeakPolarHBondContact O-CB 3.46Å; F360-L362 PolarHBondContact O-N 2.88Å; L362-G364 PolarHBondContact O-N 3.29Å; L362-L365 HydrophobicContact CD1-CB 3.99Å; L362-L365 HydrophobicContact CD1-CD1 3.97Å; L362-L365 HydrophobicContact CG-CB 3.9Å; L362-L365 CarbonylContact O-C 3.57Å; L362-L365 PolarHBondContact O-N 3.49Å; L362-L366 HydrophobicContact CD2-CD2 4.32Å; L362-L366 WeakPolarHBondContact O-CG 3.14Å; L362-L366 PolarHBondContact O-N 2.87Å; L362-L366 VanDerWaalsContact O-N 3.13Å; L362-A512 HydrophobicContact CD1-CB 3.77Å; L362-A512 HydrophobicContact CD2-CB 4.3Å; L362-A512 HydrophobicContact CG-CB 4.38Å
363	E	51.3	Low	56.3	Low	171 Å²	171	100.5 Å²	100.5	80%	0.799	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.7	-173.4	-152.7	175.6	-164.5	0	0	112.7	N361	N361-E363 VanDerWaalsContact C-N 3.25Å
364	G	56.1	Low	58.9	Low	11 Å²	11	96.6 Å²	96.6	11%	0.113	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	7.1	171	0	0	0	0	0	116	L362 F725	L362-G364 PolarHBondContact O-N 3.29Å; G364-F725 VanDerWaalsContact CA-CE2 3.44Å
365	L	65.7	Low	61.3	Low	19 Å²	19	92.4 Å²	92.4	10%	0.099	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	3.1	174.8	-76	166.1	0	0	0	111.7	L362 S508 F509 V511 A512 F725 Y727	L362-L365 HydrophobicContact CD1-CB 3.99Å; L362-L365 HydrophobicContact CD1-CD1 3.97Å; L362-L365 HydrophobicContact CG-CB 3.9Å; L362-L365 CarbonylContact O-C 3.57Å; L362-L365 PolarHBondContact O-N 3.49Å; L365-S508 WeakPolarHBondContact CD2-O 3.46Å; L365-F509 WeakPolarHBondContact O-CA 3.31Å; L365-F509 WeakPolarHBondContact O-CB 3.4Å; L365-V511 HydrophobicContact CD2-CB 3.98Å; L365-V511 HydrophobicContact CD2-CG1 4.36Å; L365-A512 HydrophobicContact CB-CB 4.5Å; L365-F725 HydrophobicContact CG-CE2 4.47Å; L365-Y727 HydrophobicContact CD1-CE2 3.98Å; L365-Y727 HydrophobicContact CD2-CD2 3.65Å; L365-Y727 HydrophobicContact CD2-CE2 3.8Å; L365-Y727 HydrophobicContact CD2-CG 4.37Å; L365-Y727 HydrophobicContact CG-CD2 4.14Å; L365-Y727 HydrophobicContact CG-CE2 3.91Å
366	L	69	Low	64.1	Low	104 Å²	104	89.9 Å²	89.9	55%	0.545	45%	0.45	S	S	.	.	S	Bend	trans	-71.3	135.7	172.8	-71.9	167.9	0	0	0	110	L362 T368	L362-L366 HydrophobicContact CD2-CD2 4.32Å; L362-L366 WeakPolarHBondContact O-CG 3.14Å; L362-L366 PolarHBondContact O-N 2.87Å; L362-L366 VanDerWaalsContact O-N 3.13Å; L366-T368 PolarHBondContact O-N 3.29Å; L366-T368 VanDerWaalsContact O-N 3.14Å
367	Y	74	Confident	66.8	Low	139 Å²	139	86.1 Å²	86.1	55%	0.545	44%	0.435	S	S	.	.			trans	-62.7	115.8	175.7	-176.3	-112	0	0	0	110.4	D506 F509	Y367-D506 HydrophobicContact CD2-CB 4.18Å; Y367-D506 HydrophobicContact CE2-CB 4.07Å; Y367-F509 AromaticContact CD2-CD1 3.84Å; Y367-F509 HydrophobicContact CD2-CD1 3.84Å; Y367-F509 HydrophobicContact CD2-CE1 4.29Å; Y367-F509 HydrophobicContact CD2-CG 4.3Å; Y367-F509 HydrophobicContact CE2-CD1 4.5Å
368	T	76.6	Confident	69.7	Low	44 Å²	44	82.4 Å²	82.4	27%	0.27	41%	0.412	S	S	.	.			trans	-80.8	-20.7	-174.1	62.1	0	0	0	0	113	L366 R370 G373 G374 D506	L366-T368 PolarHBondContact O-N 3.29Å; L366-T368 VanDerWaalsContact O-N 3.14Å; T368-R370 PolarHBondContact O-N 2.99Å; T368-R370 VanDerWaalsContact O-N 3.15Å; T368-G373 WeakPolarHBondContact OG1-CA 3.46Å; T368-G374 PolarHBondContact OG1-N 3.43Å; T368-D506 WeakPolarHBondContact CB-OD2 3.25Å; T368-D506 PolarHBondContact N-OD2 2.99Å; T368-D506 PolarHBondContact OG1-OD2 2.65Å
369	G	78.5	Confident	72.1	Confident	50 Å²	50	81.6 Å²	81.6	52%	0.515	40%	0.404	S	S	.	.			trans	66.6	7.8	-179.3	0	0	0	0	0	115.2
370	R	84.1	Confident	74.9	Confident	195 Å²	195	81.1 Å²	81.1	74%	0.736	40%	0.4	S	S	*	.	S	Bend	trans	-113.2	141.1	177.4	-62.1	178.4	-173.7	-175.8	2	109.4	T368 F372 G373	T368-R370 PolarHBondContact O-N 2.99Å; T368-R370 VanDerWaalsContact O-N 3.15Å; R370-F372 PolarHBondContact O-N 3.22Å; R370-G373 PolarHBondContact O-N 3.43Å
371	L	86.1	Confident	77	Confident	121 Å²	121	77.8 Å²	77.8	63%	0.634	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	127.6	171.4	-70.6	172.9	0	0	0	109.4	G373 A504 F505	L371-G373 PolarHBondContact O-N 3.23Å; L371-A504 WeakPolarHBondContact CA-O 3.45Å; L371-F505 HydrophobicContact CD2-CD1 4.24Å; L371-F505 HydrophobicContact CD2-CE1 4.28Å
372	F	87.3	Confident	79	Confident	70 Å²	70	72 Å²	72	31%	0.307	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	17	-172.8	-60.2	-82.5	0	0	0	115.3	R370 G374 L375 F376 V503 A504	R370-F372 PolarHBondContact O-N 3.22Å; F372-G374 PolarHBondContact O-N 2.79Å; F372-L375 HydrophobicContact CB-CB 4.41Å; F372-L375 HydrophobicContact CD1-CD2 3.77Å; F372-L375 HydrophobicContact CE1-CD2 4.49Å; F372-L375 PolarHBondContact O-N 3.37Å; F372-F376 HydrophobicContact CB-CD2 4Å; F372-F376 HydrophobicContact CB-CE2 3.75Å; F372-F376 WeakPolarHBondContact O-CD2 3.34Å; F372-F376 PolarHBondContact O-N 2.94Å; F372-V503 HydrophobicContact CD1-CG1 4.4Å; F372-A504 HydrophobicContact CD1-CB 4.29Å; F372-A504 HydrophobicContact CD2-CB 4.32Å; F372-A504 HydrophobicContact CE1-CB 3.81Å; F372-A504 HydrophobicContact CE2-CB 3.83Å; F372-A504 HydrophobicContact CZ-CB 3.56Å; F372-A504 PolarHBondContact N-O 2.79Å
373	G	85.2	Confident	80.7	Confident	6 Å²	6	75.3 Å²	75.3	6%	0.062	37%	0.37	C	S	.	.	H	α-helix	trans	-56.5	-54.2	-178.3	0	0	0	0	0	112.4	T368 R370 L371 L375 F376 D377	T368-G373 WeakPolarHBondContact OG1-CA 3.46Å; R370-G373 PolarHBondContact O-N 3.43Å; L371-G373 PolarHBondContact O-N 3.23Å; G373-L375 VanDerWaalsContact C-N 3.27Å; G373-L375 PolarHBondContact O-N 3.19Å; G373-F376 PolarHBondContact O-N 3.25Å; G373-F376 VanDerWaalsContact O-N 3.14Å; G373-D377 PolarHBondContact O-N 2.98Å
374	G	86.2	Confident	82.4	Confident	3 Å²	3	71.8 Å²	71.8	3%	0.031	36%	0.362	C	S	.	.	H	α-helix	trans	-59.9	-33.7	177.7	0	0	0	0	0	114	T368 F372 D378 D506	T368-G374 PolarHBondContact OG1-N 3.43Å; F372-G374 PolarHBondContact O-N 2.79Å; G374-D378 WeakPolarHBondContact O-CB 3.36Å; G374-D378 VanDerWaalsContact O-CG 3.27Å; G374-D378 PolarHBondContact O-N 3.45Å; G374-D506 WeakPolarHBondContact CA-OD1 3.44Å
375	L	89.2	Confident	83.7	Confident	19 Å²	19	76.2 Å²	76.2	10%	0.099	38%	0.375	C	S	.	.	H	α-helix	trans	-66.8	-44.4	175.1	179.1	68.8	0	0	0	111.9	F372 G373 D377 D378 V379 V503 H728 L729 L732	F372-L375 HydrophobicContact CB-CB 4.41Å; F372-L375 HydrophobicContact CD1-CD2 3.77Å; F372-L375 HydrophobicContact CE1-CD2 4.49Å; F372-L375 PolarHBondContact O-N 3.37Å; G373-L375 VanDerWaalsContact C-N 3.27Å; G373-L375 PolarHBondContact O-N 3.19Å; L375-D377 VanDerWaalsContact C-N 3.31Å; L375-D377 PolarHBondContact O-N 3.01Å; L375-D378 PolarHBondContact O-N 3.47Å; L375-V379 WeakPolarHBondContact O-CG2 3.41Å; L375-V379 PolarHBondContact O-N 3.24Å; L375-V503 HydrophobicContact CB-CG1 4.3Å; L375-V503 HydrophobicContact CD2-CG1 4.42Å; L375-H728 HydrophobicContact CB-CB 4.14Å; L375-H728 HydrophobicContact CD1-CB 4.27Å; L375-L729 HydrophobicContact CD1-CB 4.21Å; L375-L729 HydrophobicContact CD1-CD1 4.1Å; L375-L732 HydrophobicContact CD1-CB 4.43Å; L375-L732 HydrophobicContact CD1-CD2 3.92Å; L375-L732 HydrophobicContact CD2-CD2 3.79Å
376	F	90.1	Very high	84.6	Confident	137 Å²	137	78.4 Å²	78.4	60%	0.601	38%	0.382	S	S	*	.	H	α-helix	trans	-64.9	-37.3	178.4	-75.7	-63	0	0	0	111.9	F372 G373 V379 K380	F372-F376 HydrophobicContact CB-CD2 4Å; F372-F376 HydrophobicContact CB-CE2 3.75Å; F372-F376 WeakPolarHBondContact O-CD2 3.34Å; F372-F376 PolarHBondContact O-N 2.94Å; G373-F376 PolarHBondContact O-N 3.25Å; G373-F376 VanDerWaalsContact O-N 3.14Å; F376-V379 PolarHBondContact O-N 3.45Å; F376-K380 VanDerWaalsContact O-CB 3.25Å; F376-K380 WeakPolarHBondContact O-CB 3.04Å; F376-K380 PolarHBondContact O-N 3.43Å
377	D	87.4	Confident	85.4	Confident	79 Å²	79	79.6 Å²	79.6	42%	0.422	39%	0.389	S	S	.	.	H	α-helix	trans	-67.6	-40.6	177	-69.8	-26.9	0	0	0	111.8	G373 L375 K380 R381	G373-D377 PolarHBondContact O-N 2.98Å; L375-D377 VanDerWaalsContact C-N 3.31Å; L375-D377 PolarHBondContact O-N 3.01Å; D377-K380 PolarHBondContact O-N 3.22Å; D377-R381 WeakPolarHBondContact O-CB 3.49Å; D377-R381 PolarHBondContact O-N 2.91Å
378	D	89.5	Confident	85.9	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-59.2	-51.1	172.7	-75.9	-8.1	0	0	0	110.9	G374 L375 K380 R381 I382 G726 Y727 H728 L729	G374-D378 WeakPolarHBondContact O-CB 3.36Å; G374-D378 VanDerWaalsContact O-CG 3.27Å; G374-D378 PolarHBondContact O-N 3.45Å; L375-D378 PolarHBondContact O-N 3.47Å; D378-K380 VanDerWaalsContact C-N 3.34Å; D378-K380 PolarHBondContact O-N 2.95Å; D378-R381 WeakPolarHBondContact O-CB 2.99Å; D378-R381 PolarHBondContact O-N 2.93Å; D378-I382 WeakPolarHBondContact O-CD1 3.34Å; D378-I382 WeakPolarHBondContact O-CG1 3.32Å; D378-I382 PolarHBondContact O-N 2.93Å; D378-I382 VanDerWaalsContact O-N 3.08Å; D378-G726 VanDerWaalsContact CG-CA 3.48Å; D378-G726 VanDerWaalsContact OD2-C 3.23Å; D378-G726 VanDerWaalsContact OD2-CA 3.31Å; D378-G726 WeakPolarHBondContact OD2-CA 3.28Å; D378-Y727 PolarHBondContact OD2-N 2.6Å; D378-Y727 VanDerWaalsContact OD2-N 3.13Å; D378-H728 WeakPolarHBondContact OD2-CA 3.29Å; D378-H728 VanDerWaalsContact OD2-CB 3.28Å; D378-H728 WeakPolarHBondContact OD2-CB 3.41Å; D378-H728 IonicContact OD2-CG 2.78Å; D378-H728 PolarHBondContact OD2-N 2.83Å; D378-H728 IonicContact OD2-ND1 3.74Å; D378-L729 HydrophobicContact CB-CB 4.32Å; D378-L729 PolarHBondContact OD2-N 2.9Å
379	V	90.1	Very high	86.3	Confident	55 Å²	55	72.9 Å²	72.9	33%	0.333	36%	0.363	S	S	.	.	H	α-helix	trans	-60.9	-43.6	179.4	172.4	0	0	0	0	111.1	L375 F376 R381 I382 L383 L729	L375-V379 WeakPolarHBondContact O-CG2 3.41Å; L375-V379 PolarHBondContact O-N 3.24Å; F376-V379 PolarHBondContact O-N 3.45Å; V379-R381 VanDerWaalsContact C-N 3.26Å; V379-R381 PolarHBondContact O-N 3.13Å; V379-I382 PolarHBondContact O-N 2.87Å; V379-L383 WeakPolarHBondContact O-CB 3.47Å; V379-L383 PolarHBondContact O-N 3.13Å; V379-L729 HydrophobicContact CG2-CD1 4.32Å
380	K	89.5	Confident	86.7	Confident	162 Å²	162	73.9 Å²	73.9	70%	0.704	36%	0.356	S	S	*	.	H	α-helix	trans	-63.5	-32.5	179.4	-171.9	179.5	179.5	-174.8	0	112.3	F376 D377 D378 P384	F376-K380 VanDerWaalsContact O-CB 3.25Å; F376-K380 WeakPolarHBondContact O-CB 3.04Å; F376-K380 PolarHBondContact O-N 3.43Å; D377-K380 PolarHBondContact O-N 3.22Å; D378-K380 VanDerWaalsContact C-N 3.34Å; D378-K380 PolarHBondContact O-N 2.95Å; K380-P384 VanDerWaalsContact O-CD 3.26Å; K380-P384 WeakPolarHBondContact O-CD 3.39Å
381	R	86.1	Confident	86.7	Confident	55 Å²	55	68.4 Å²	68.4	21%	0.208	34%	0.344	C	S	.	.	H	α-helix	trans	-73.1	-39.4	177	-174.8	-177	-65.2	158.9	-7.4	112.6	D377 D378 V379 R385 F725	D377-R381 WeakPolarHBondContact O-CB 3.49Å; D377-R381 PolarHBondContact O-N 2.91Å; D378-R381 WeakPolarHBondContact O-CB 2.99Å; D378-R381 PolarHBondContact O-N 2.93Å; V379-R381 VanDerWaalsContact C-N 3.26Å; V379-R381 PolarHBondContact O-N 3.13Å; R381-R385 PolarHBondContact O-NH1 2.59Å; R381-F725 PolarHBondContact NH1-O 2.93Å
382	I	87	Confident	86.4	Confident	13 Å²	13	66 Å²	66	7%	0.067	33%	0.332	C	S	.	.	H	α-helix	trans	-87	-42.2	-171.6	-66.3	155.9	0	0	0	112.2	D378 V379 P384 R385 Y386 L729	D378-I382 WeakPolarHBondContact O-CD1 3.34Å; D378-I382 WeakPolarHBondContact O-CG1 3.32Å; D378-I382 PolarHBondContact O-N 2.93Å; D378-I382 VanDerWaalsContact O-N 3.08Å; V379-I382 PolarHBondContact O-N 2.87Å; I382-P384 VanDerWaalsContact C-CD 3.46Å; I382-R385 CarbonylContact O-C 3.6Å; I382-R385 WeakPolarHBondContact O-CA 3.48Å; I382-R385 PolarHBondContact O-N 3.25Å; I382-Y386 PolarHBondContact O-N 3.42Å; I382-L729 HydrophobicContact CD1-CD2 3.84Å
383	L	86.4	Confident	86.1	Confident	127 Å²	127	62.7 Å²	62.7	67%	0.665	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-46.3	-174.2	-172.1	65.9	0	0	0	114.8	V379 R385	V379-L383 WeakPolarHBondContact O-CB 3.47Å; V379-L383 PolarHBondContact O-N 3.13Å; L383-R385 VanDerWaalsContact C-N 3.29Å; L383-R385 PolarHBondContact O-N 2.82Å
384	P	85.6	Confident	85.9	Confident	97 Å²	97	69.1 Å²	69.1	63%	0.63	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-24.7	178.9	27.4	-35	0	0	0	113.5	K380 I382	K380-P384 VanDerWaalsContact O-CD 3.26Å; K380-P384 WeakPolarHBondContact O-CD 3.39Å; I382-P384 VanDerWaalsContact C-CD 3.46Å
385	R	83.8	Confident	85.3	Confident	104 Å²	104	74 Å²	74	39%	0.392	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-8.6	-177.9	-63.6	-176.9	-177.7	95.5	-4.4	113.1	R381 I382 L383 L387 S388 D389	R381-R385 PolarHBondContact O-NH1 2.59Å; I382-R385 CarbonylContact O-C 3.6Å; I382-R385 WeakPolarHBondContact O-CA 3.48Å; I382-R385 PolarHBondContact O-N 3.25Å; L383-R385 VanDerWaalsContact C-N 3.29Å; L383-R385 PolarHBondContact O-N 2.82Å; R385-L387 VanDerWaalsContact C-N 3.29Å; R385-L387 PolarHBondContact O-N 3.22Å; R385-S388 WeakPolarHBondContact O-CA 3.27Å; R385-S388 WeakPolarHBondContact O-CB 3.38Å; R385-S388 PolarHBondContact O-N 3.46Å; R385-S388 PolarHBondContact O-OG 2.88Å; R385-D389 PolarHBondContact O-N 3.16Å
386	Y	86.2	Confident	84.4	Confident	65 Å²	65	75.9 Å²	75.9	26%	0.255	39%	0.388	S	S	.	.	H	α-helix	trans	-56.9	-40.1	-175.8	-170.3	-91.2	0	0	0	113.4	I382 S388 D389 I390 L451	I382-Y386 PolarHBondContact O-N 3.42Å; Y386-S388 VanDerWaalsContact C-N 3.29Å; Y386-S388 PolarHBondContact O-N 2.75Å; Y386-D389 WeakPolarHBondContact O-CB 3.11Å; Y386-D389 PolarHBondContact O-N 3.15Å; Y386-I390 HydrophobicContact CE1-CD1 4.05Å; Y386-L451 WeakPolarHBondContact CE2-O 3.39Å; Y386-L451 PolarHBondContact OH-O 3.39Å
387	L	84.5	Confident	83.6	Confident	130 Å²	130	78 Å²	78	68%	0.681	40%	0.398	S	S	*	.	H	α-helix	trans	-65.4	-35.1	176.1	-65.1	178.4	0	0	0	111.9	R385 D389 I390 T391	R385-L387 VanDerWaalsContact C-N 3.29Å; R385-L387 PolarHBondContact O-N 3.22Å; L387-D389 VanDerWaalsContact C-N 3.26Å; L387-D389 PolarHBondContact O-N 3.31Å; L387-I390 PolarHBondContact O-N 2.63Å; L387-T391 WeakPolarHBondContact O-CG2 3.47Å; L387-T391 PolarHBondContact O-N 2.82Å; L387-T391 PolarHBondContact O-OG1 3.27Å
388	S	84.1	Confident	82.8	Confident	33 Å²	33	75.4 Å²	75.4	23%	0.231	39%	0.386	C	S	.	.	H	α-helix	trans	-63.8	-31.5	176.2	77.4	0	0	0	0	112.5	R385 Y386 I390 T391 D392 K723	R385-S388 WeakPolarHBondContact O-CA 3.27Å; R385-S388 WeakPolarHBondContact O-CB 3.38Å; R385-S388 PolarHBondContact O-N 3.46Å; R385-S388 PolarHBondContact O-OG 2.88Å; Y386-S388 VanDerWaalsContact C-N 3.29Å; Y386-S388 PolarHBondContact O-N 2.75Å; S388-I390 PolarHBondContact O-N 2.84Å; S388-T391 WeakPolarHBondContact CA-OG1 3.41Å; S388-T391 PolarHBondContact O-N 3.1Å; S388-T391 PolarHBondContact O-OG1 3.25Å; S388-D392 WeakPolarHBondContact O-CB 3.43Å; S388-D392 PolarHBondContact O-N 3.1Å; S388-K723 PolarHBondContact O-NZ 3.11Å
389	D	85.1	Confident	82.2	Confident	9 Å²	9	75.9 Å²	75.9	5%	0.048	39%	0.389	C	S	.	.	H	α-helix	trans	-64.8	-26.7	178	-64.7	-18.4	0	0	0	113.6	R385 Y386 L387 K723 Q784 R785	R385-D389 PolarHBondContact O-N 3.16Å; Y386-D389 WeakPolarHBondContact O-CB 3.11Å; Y386-D389 PolarHBondContact O-N 3.15Å; L387-D389 VanDerWaalsContact C-N 3.26Å; L387-D389 PolarHBondContact O-N 3.31Å; D389-K723 WeakPolarHBondContact OD1-CD 3.46Å; D389-K723 WeakPolarHBondContact OD1-CE 3Å; D389-K723 IonicContact OD1-NZ 3.16Å; D389-K723 PolarHBondContact OD1-NZ 2.95Å; D389-Q784 WeakPolarHBondContact O-CA 3.46Å; D389-Q784 WeakPolarHBondContact O-CB 3.38Å; D389-R785 HydrophobicContact CB-CB 4.5Å; D389-R785 HydrophobicContact CB-CG 3.91Å; D389-R785 PolarHBondContact O-N 3.03Å; D389-R785 IonicContact OD2-CZ 2.9Å; D389-R785 IonicContact OD2-NE 3.53Å; D389-R785 PolarHBondContact OD2-NE 3.39Å; D389-R785 IonicContact OD2-NH2 2.8Å; D389-R785 PolarHBondContact OD2-NH2 3.45Å
390	I	86.4	Confident	81.7	Confident	70 Å²	70	75.5 Å²	75.5	36%	0.359	39%	0.389	S	S	.	.	H	α-helix	trans	-90.8	-42.9	177.3	-58.1	176	0	0	0	109.7	Y386 L387 S388 A393 F394	Y386-I390 HydrophobicContact CE1-CD1 4.05Å; L387-I390 PolarHBondContact O-N 2.63Å; S388-I390 PolarHBondContact O-N 2.84Å; I390-A393 WeakPolarHBondContact O-CB 3.45Å; I390-A393 PolarHBondContact O-N 3.45Å; I390-F394 HydrophobicContact CG2-CE2 4.46Å; I390-F394 VanDerWaalsContact O-CD2 3.28Å; I390-F394 WeakPolarHBondContact O-CD2 3.35Å
391	T	84.5	Confident	81.4	Confident	81 Å²	81	68.6 Å²	68.6	50%	0.497	36%	0.361	S	S	.	.	H	α-helix	trans	-70.9	-35.5	-178.1	57.1	0	0	0	0	113.1	L387 S388 A393 F394 T395	L387-T391 WeakPolarHBondContact O-CG2 3.47Å; L387-T391 PolarHBondContact O-N 2.82Å; L387-T391 PolarHBondContact O-OG1 3.27Å; S388-T391 WeakPolarHBondContact CA-OG1 3.41Å; S388-T391 PolarHBondContact O-N 3.1Å; S388-T391 PolarHBondContact O-OG1 3.25Å; T391-A393 PolarHBondContact O-N 3.43Å; T391-F394 PolarHBondContact O-N 3.43Å; T391-T395 PolarHBondContact O-N 2.91Å; T391-T395 PolarHBondContact O-OG1 2.65Å
392	D	81.5	Confident	81.4	Confident	69 Å²	69	66.1 Å²	66.1	37%	0.369	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25	179.2	-71.2	-9.8	0	0	0	111.8	S388 F394 K723	S388-D392 WeakPolarHBondContact O-CB 3.43Å; S388-D392 PolarHBondContact O-N 3.1Å; D392-F394 VanDerWaalsContact C-N 3.26Å; D392-F394 PolarHBondContact O-N 2.96Å; D392-K723 WeakPolarHBondContact OD2-CE 3.27Å; D392-K723 IonicContact OD2-NZ 3.51Å; D392-K723 PolarHBondContact OD2-NZ 2.88Å
393	A	79.4	Confident	81.5	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.008	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-29.1	174.4	0	0	0	0	0	113.2	I390 T391 I403 Q784 V786	I390-A393 WeakPolarHBondContact O-CB 3.45Å; I390-A393 PolarHBondContact O-N 3.45Å; T391-A393 PolarHBondContact O-N 3.43Å; A393-I403 HydrophobicContact CB-CD1 3.7Å; A393-I403 WeakPolarHBondContact O-CD1 3.2Å; A393-Q784 HydrophobicContact CB-CB 4.29Å; A393-V786 HydrophobicContact CB-CB 4.04Å; A393-V786 HydrophobicContact CB-CG2 3.61Å
394	F	81.5	Confident	81.6	Confident	142 Å²	142	63 Å²	63	62%	0.623	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	4.3	-173.5	-60.3	-72.9	0	0	0	114.2	I390 T391 D392 S396 V786	I390-F394 HydrophobicContact CG2-CE2 4.46Å; I390-F394 VanDerWaalsContact O-CD2 3.28Å; I390-F394 WeakPolarHBondContact O-CD2 3.35Å; T391-F394 PolarHBondContact O-N 3.43Å; D392-F394 VanDerWaalsContact C-N 3.26Å; D392-F394 PolarHBondContact O-N 2.96Å; F394-S396 VanDerWaalsContact C-N 3.34Å; F394-S396 PolarHBondContact O-N 2.72Å; F394-V786 HydrophobicContact CE2-CG2 4.19Å; F394-V786 HydrophobicContact CZ-CG1 4.29Å
395	T	74.2	Confident	81.7	Confident	105 Å²	105	58.5 Å²	58.5	64%	0.644	31%	0.309	S	S	*	.	S	Bend	trans	-68.6	-28.1	-172	-61.3	0	0	0	0	113.7	T391	T391-T395 PolarHBondContact O-N 2.91Å; T391-T395 PolarHBondContact O-OG1 2.65Å
396	S	70.4	Confident	82	Confident	59 Å²	59	53.6 Å²	53.6	41%	0.413	29%	0.291	S	S	.	.			trans	-142.4	150.2	-178.5	178.9	0	0	0	0	112.3	F394 S398 S399 S400	F394-S396 VanDerWaalsContact C-N 3.34Å; F394-S396 PolarHBondContact O-N 2.72Å; S396-S398 VanDerWaalsContact C-N 3.32Å; S396-S398 PolarHBondContact O-N 2.87Å; S396-S399 WeakPolarHBondContact O-CB 3.47Å; S396-S399 PolarHBondContact O-N 2.95Å; S396-S399 VanDerWaalsContact O-N 3.15Å; S396-S400 PolarHBondContact O-N 3.23Å
397	F	73	Confident	82.3	Confident	181 Å²	181	51.1 Å²	51.1	79%	0.794	28%	0.283	S	S	*	.	H	α-helix	trans	-59.3	-40.2	175.8	-179.3	-96.5	0	0	0	112.4	S400 S401	F397-S400 PolarHBondContact O-N 2.87Å; F397-S401 PolarHBondContact O-N 3.48Å
398	S	70	Confident	82.5	Confident	25 Å²	25	47.6 Å²	47.6	18%	0.175	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-41.2	175.3	168.9	0	0	0	0	111.1	S396 S401 Q402 E634	S396-S398 VanDerWaalsContact C-N 3.32Å; S396-S398 PolarHBondContact O-N 2.87Å; S398-S401 PolarHBondContact O-N 3.49Å; S398-Q402 PolarHBondContact O-N 2.03Å; S398-E634 PolarHBondContact OG-OE1 3.12Å; S398-E634 PolarHBondContact OG-OE2 2.86Å
399	S	76.2	Confident	82.7	Confident	11 Å²	11	46.4 Å²	46.4	8%	0.077	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-48.1	174.3	-53.2	0	0	0	0	112.2	S396 S401 Q402 I403 R782	S396-S399 WeakPolarHBondContact O-CB 3.47Å; S396-S399 PolarHBondContact O-N 2.95Å; S396-S399 VanDerWaalsContact O-N 3.15Å; S399-S401 VanDerWaalsContact C-N 3.33Å; S399-S401 PolarHBondContact O-N 3.01Å; S399-Q402 PolarHBondContact O-N 3.3Å; S399-I403 WeakPolarHBondContact O-CB 2.99Å; S399-I403 WeakPolarHBondContact O-CD1 3.34Å; S399-I403 VanDerWaalsContact O-CG1 3.26Å; S399-I403 WeakPolarHBondContact O-CG1 3.05Å; S399-I403 PolarHBondContact O-N 3.08Å; S399-R782 VanDerWaalsContact CA-NH1 3.3Å; S399-R782 PolarHBondContact OG-NE 3.35Å
400	S	81.4	Confident	83	Confident	46 Å²	46	46.1 Å²	46.1	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-61.8	-40.4	178.7	-176.5	0	0	0	0	112	S396 F397 T404	S396-S400 PolarHBondContact O-N 3.23Å; F397-S400 PolarHBondContact O-N 2.87Å; S400-T404 VanDerWaalsContact O-CB 3.32Å; S400-T404 WeakPolarHBondContact O-CB 3.28Å; S400-T404 PolarHBondContact O-N 3.21Å; S400-T404 PolarHBondContact O-OG1 2.93Å
401	S	82.3	Confident	83.2	Confident	18 Å²	18	43.4 Å²	43.4	13%	0.126	24%	0.239	C	C	.	.	H	α-helix	trans	-62.3	-45.5	175	171.9	0	0	0	0	112.6	F397 S398 S399 A405	F397-S401 PolarHBondContact O-N 3.48Å; S398-S401 PolarHBondContact O-N 3.49Å; S399-S401 VanDerWaalsContact C-N 3.33Å; S399-S401 PolarHBondContact O-N 3.01Å; S401-A405 WeakPolarHBondContact O-CB 3.4Å; S401-A405 PolarHBondContact O-N 3.37Å
402	Q	85.8	Confident	83.4	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-44.7	179.9	-174.2	179.7	21.1	0	0	111	S398 S399 T404 A405 A406 S762 L763 K764	S398-Q402 PolarHBondContact O-N 2.03Å; S399-Q402 PolarHBondContact O-N 3.3Å; Q402-T404 PolarHBondContact O-N 3.13Å; Q402-A405 PolarHBondContact O-N 3.25Å; Q402-A406 VanDerWaalsContact O-CB 3.31Å; Q402-A406 WeakPolarHBondContact O-CB 2.84Å; Q402-A406 PolarHBondContact O-N 3.05Å; Q402-S762 VanDerWaalsContact CG-O 3.26Å; Q402-S762 WeakPolarHBondContact CG-O 3.39Å; Q402-S762 PolarHBondContact NE2-O 2.85Å; Q402-L763 VanDerWaalsContact NE2-CA 3.33Å; Q402-K764 PolarHBondContact NE2-O 2.91Å; Q402-K764 VanDerWaalsContact NE2-O 3.09Å
403	I	89.5	Confident	83.6	Confident	9 Å²	9	37.2 Å²	37.2	5%	0.046	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-40.4	-179.7	-68.9	166.1	0	0	0	110.8	A393 S399 A406 T407 L763 Q784	A393-I403 HydrophobicContact CB-CD1 3.7Å; A393-I403 WeakPolarHBondContact O-CD1 3.2Å; S399-I403 WeakPolarHBondContact O-CB 2.99Å; S399-I403 WeakPolarHBondContact O-CD1 3.34Å; S399-I403 VanDerWaalsContact O-CG1 3.26Å; S399-I403 WeakPolarHBondContact O-CG1 3.05Å; S399-I403 PolarHBondContact O-N 3.08Å; I403-A406 PolarHBondContact O-N 3.05Å; I403-T407 VanDerWaalsContact O-CB 3.31Å; I403-T407 WeakPolarHBondContact O-CB 3.44Å; I403-T407 PolarHBondContact O-N 3.2Å; I403-T407 PolarHBondContact O-OG1 3.45Å; I403-L763 HydrophobicContact CG1-CD2 4.2Å; I403-Q784 HydrophobicContact CD1-CG 4.02Å; I403-Q784 HydrophobicContact CG1-CG 4.29Å
404	T	89.3	Confident	84.1	Confident	66 Å²	66	37.2 Å²	37.2	41%	0.405	20%	0.203	S	C	.	.	H	α-helix	trans	-63.4	-44.8	175.3	-55.9	0	0	0	0	110.8	S400 Q402 T407 L408	S400-T404 VanDerWaalsContact O-CB 3.32Å; S400-T404 WeakPolarHBondContact O-CB 3.28Å; S400-T404 PolarHBondContact O-N 3.21Å; S400-T404 PolarHBondContact O-OG1 2.93Å; Q402-T404 PolarHBondContact O-N 3.13Å; T404-T407 PolarHBondContact O-N 3.09Å; T404-L408 HydrophobicContact CG2-CD1 4.27Å; T404-L408 WeakPolarHBondContact O-CG 3.33Å; T404-L408 PolarHBondContact O-N 2.85Å
405	A	86.9	Confident	84.5	Confident	3 Å²	3	30.5 Å²	30.5	3%	0.025	17%	0.173	C	C	.	.	H	α-helix	trans	-61.3	-47	176.1	0	0	0	0	0	111.8	S401 Q402 T407 L408 F409 N638 F639	S401-A405 WeakPolarHBondContact O-CB 3.4Å; S401-A405 PolarHBondContact O-N 3.37Å; Q402-A405 PolarHBondContact O-N 3.25Å; A405-T407 VanDerWaalsContact C-N 3.34Å; A405-T407 PolarHBondContact O-N 3.09Å; A405-L408 PolarHBondContact O-N 2.94Å; A405-F409 VanDerWaalsContact O-CB 3.3Å; A405-F409 WeakPolarHBondContact O-CB 3.29Å; A405-F409 PolarHBondContact O-N 3.27Å; A405-N638 HydrophobicContact CB-CB 4.28Å; A405-F639 HydrophobicContact CB-CD1 3.57Å; A405-F639 HydrophobicContact CB-CD2 4.15Å; A405-F639 HydrophobicContact CB-CE1 3.55Å; A405-F639 HydrophobicContact CB-CE2 4.11Å; A405-F639 HydrophobicContact CB-CG 3.89Å; A405-F639 HydrophobicContact CB-CZ 3.83Å
406	A	89.3	Confident	85	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-59.7	-42.7	176.6	0	0	0	0	0	111.9	Q402 I403 F409 L410 S762 L763	Q402-A406 VanDerWaalsContact O-CB 3.31Å; Q402-A406 WeakPolarHBondContact O-CB 2.84Å; Q402-A406 PolarHBondContact O-N 3.05Å; I403-A406 PolarHBondContact O-N 3.05Å; A406-F409 PolarHBondContact O-N 3.28Å; A406-L410 WeakPolarHBondContact O-CB 3.29Å; A406-L410 PolarHBondContact O-N 3.24Å; A406-S762 WeakPolarHBondContact CB-OG 3.39Å; A406-L763 HydrophobicContact CB-CD2 4.16Å
407	T	92.4	Very high	85.8	Confident	12 Å²	12	23.4 Å²	23.4	7%	0.074	13%	0.127	C	C	.	.	H	α-helix	trans	-61.7	-49.1	178.1	-57.7	0	0	0	0	111.5	I403 T404 A405 L410 F411 S787 A790 A791 L794	I403-T407 VanDerWaalsContact O-CB 3.31Å; I403-T407 WeakPolarHBondContact O-CB 3.44Å; I403-T407 PolarHBondContact O-N 3.2Å; I403-T407 PolarHBondContact O-OG1 3.45Å; T404-T407 PolarHBondContact O-N 3.09Å; A405-T407 VanDerWaalsContact C-N 3.34Å; A405-T407 PolarHBondContact O-N 3.09Å; T407-L410 PolarHBondContact O-N 3.01Å; T407-F411 VanDerWaalsContact O-CB 3.3Å; T407-F411 WeakPolarHBondContact O-CB 3.41Å; T407-F411 PolarHBondContact O-N 3.23Å; T407-S787 VanDerWaalsContact OG1-CA 3.3Å; T407-S787 WeakPolarHBondContact OG1-CA 3.42Å; T407-S787 WeakPolarHBondContact OG1-CB 3.5Å; T407-A790 HydrophobicContact CG2-CB 3.56Å; T407-A791 HydrophobicContact CG2-CB 4.17Å; T407-L794 HydrophobicContact CG2-CD1 4.09Å
408	L	90	Very high	86.6	Confident	57 Å²	57	14.8 Å²	14.8	30%	0.298	9%	0.089	S	C	.	.	H	α-helix	trans	-65.4	-41.2	179.4	-69.6	172.6	0	0	0	111.8	T404 A405 F411 L412 F639 L642	T404-L408 HydrophobicContact CG2-CD1 4.27Å; T404-L408 WeakPolarHBondContact O-CG 3.33Å; T404-L408 PolarHBondContact O-N 2.85Å; A405-L408 PolarHBondContact O-N 2.94Å; L408-F411 PolarHBondContact O-N 3.08Å; L408-L412 WeakPolarHBondContact O-CG 3.46Å; L408-L412 PolarHBondContact O-N 3.35Å; L408-L412 VanDerWaalsContact O-N 3.08Å; L408-F639 HydrophobicContact CD1-CE1 4.4Å; L408-L642 HydrophobicContact CB-CD1 4.37Å; L408-L642 HydrophobicContact CB-CD2 4.48Å; L408-L642 HydrophobicContact CD1-CD2 3.79Å
409	F	87.5	Confident	87.4	Confident	7 Å²	7	14.1 Å²	14.1	3%	0.031	8%	0.083	C	C	.	.	H	α-helix	trans	-62.2	-48	175.7	164.5	-104.6	0	0	0	111.7	A405 A406 F411 L412 T413 P641 S758 V816 M820	A405-F409 VanDerWaalsContact O-CB 3.3Å; A405-F409 WeakPolarHBondContact O-CB 3.29Å; A405-F409 PolarHBondContact O-N 3.27Å; A406-F409 PolarHBondContact O-N 3.28Å; F409-F411 VanDerWaalsContact C-N 3.33Å; F409-F411 PolarHBondContact O-N 3.22Å; F409-L412 PolarHBondContact O-N 2.96Å; F409-T413 WeakPolarHBondContact CD2-OG1 3.49Å; F409-T413 HydrophobicContact CE2-CG2 4.23Å; F409-T413 WeakPolarHBondContact CE2-OG1 3.37Å; F409-T413 HydrophobicContact CZ-CG2 3.81Å; F409-T413 WeakPolarHBondContact CZ-OG1 3.37Å; F409-T413 VanDerWaalsContact O-CB 3.3Å; F409-T413 WeakPolarHBondContact O-CB 3.39Å; F409-T413 PolarHBondContact O-N 3.44Å; F409-T413 PolarHBondContact O-OG1 3.3Å; F409-P641 HydrophobicContact CB-CB 4.29Å; F409-P641 HydrophobicContact CD2-CB 3.22Å; F409-P641 HydrophobicContact CD2-CG 3.86Å; F409-P641 HydrophobicContact CE2-CB 3.88Å; F409-P641 HydrophobicContact CE2-CG 4.47Å; F409-P641 HydrophobicContact CG-CB 3.88Å; F409-P641 HydrophobicContact CG-CG 4.12Å; F409-S758 WeakPolarHBondContact CE1-OG 3.34Å; F409-S758 WeakPolarHBondContact CZ-OG 3.07Å; F409-V816 HydrophobicContact CE2-CG1 4.33Å; F409-M820 HydrophobicContact CD1-CE 4.4Å; F409-M820 HydrophobicContact CD2-CE 3.91Å; F409-M820 HydrophobicContact CE1-CE 3.66Å; F409-M820 HydrophobicContact CE1-SD 4.22Å; F409-M820 HydrophobicContact CE2-CE 3.01Å; F409-M820 HydrophobicContact CE2-SD 3.72Å; F409-M820 HydrophobicContact CZ-CE 2.95Å; F409-M820 HydrophobicContact CZ-SD 3.29Å; F409-M820 WeakPolarHBondContact CZ-SD 3.37Å
410	L	90.7	Very high	87.7	Confident	3 Å²	3	15.8 Å²	15.8	2%	0.016	9%	0.091	C	C	.	.	H	α-helix	trans	-63.2	-41.7	178.7	-165.1	157.4	0	0	0	110.9	A406 T407 T413 N414 I459 H759 A791	A406-L410 WeakPolarHBondContact O-CB 3.29Å; A406-L410 PolarHBondContact O-N 3.24Å; T407-L410 PolarHBondContact O-N 3.01Å; L410-T413 PolarHBondContact O-N 3.38Å; L410-N414 HydrophobicContact CD2-CB 4.11Å; L410-N414 WeakPolarHBondContact O-CB 3.27Å; L410-N414 PolarHBondContact O-N 3.26Å; L410-I459 HydrophobicContact CD1-CD1 3.62Å; L410-I459 HydrophobicContact CD1-CG1 3.78Å; L410-I459 HydrophobicContact CD1-CG2 4.45Å; L410-I459 HydrophobicContact CD2-CG2 4.03Å; L410-H759 HydrophobicContact CD1-CB 4.1Å; L410-A791 HydrophobicContact CB-CB 4.03Å; L410-A791 HydrophobicContact CD2-CB 3.38Å; L410-A791 HydrophobicContact CG-CB 4.16Å
411	F	92.1	Very high	88	Confident	13 Å²	13	15 Å²	15	6%	0.057	8%	0.081	C	C	.	.	H	α-helix	trans	-55.2	-55.5	174.2	163	-111.1	0	0	0	111.6	T407 L408 F409 T413 L415 A791 L794 I795 L801 L805	T407-F411 VanDerWaalsContact O-CB 3.3Å; T407-F411 WeakPolarHBondContact O-CB 3.41Å; T407-F411 PolarHBondContact O-N 3.23Å; L408-F411 PolarHBondContact O-N 3.08Å; F409-F411 VanDerWaalsContact C-N 3.33Å; F409-F411 PolarHBondContact O-N 3.22Å; F411-T413 VanDerWaalsContact C-N 3.32Å; F411-T413 PolarHBondContact O-N 2.8Å; F411-L415 HydrophobicContact CE2-CD2 3.99Å; F411-L415 HydrophobicContact CZ-CD2 3.91Å; F411-L415 WeakPolarHBondContact O-CB 3.47Å; F411-L415 PolarHBondContact O-N 3.22Å; F411-A791 HydrophobicContact CB-CB 4.41Å; F411-L794 HydrophobicContact CB-CB 4.29Å; F411-L794 HydrophobicContact CB-CD1 4.19Å; F411-L794 HydrophobicContact CD2-CB 3.4Å; F411-L794 VanDerWaalsContact CD2-CB 3.4Å; F411-L794 VanDerWaalsContact CE2-C 3.44Å; F411-L794 HydrophobicContact CE2-CB 3.83Å; F411-L794 VanDerWaalsContact CE2-O 3.25Å; F411-L794 WeakPolarHBondContact CE2-O 3.25Å; F411-L794 HydrophobicContact CG-CB 3.85Å; F411-L794 HydrophobicContact CG-CD1 4.23Å; F411-I795 HydrophobicContact CD2-CG1 3.91Å; F411-I795 HydrophobicContact CE2-CG1 4.39Å; F411-L801 HydrophobicContact CZ-CD1 4.34Å; F411-L805 HydrophobicContact CE1-CD2 4.11Å; F411-L805 HydrophobicContact CZ-CD1 4.35Å; F411-L805 HydrophobicContact CZ-CD2 3.99Å
412	L	88.3	Confident	88.3	Confident	20 Å²	20	14.1 Å²	14.1	11%	0.105	8%	0.076	C	C	.	.	H	α-helix	trans	-62.8	-40	-177.4	-69.5	173.2	0	0	0	112.3	L408 F409 A416 L642 I645 L805 I808	L408-L412 WeakPolarHBondContact O-CG 3.46Å; L408-L412 PolarHBondContact O-N 3.35Å; L408-L412 VanDerWaalsContact O-N 3.08Å; F409-L412 PolarHBondContact O-N 2.96Å; L412-A416 WeakPolarHBondContact O-CB 3.26Å; L412-A416 PolarHBondContact O-N 3.48Å; L412-A416 VanDerWaalsContact O-N 3.1Å; L412-L642 HydrophobicContact CD1-CD1 3.69Å; L412-I645 HydrophobicContact CB-CD1 4.09Å; L412-I645 HydrophobicContact CD1-CD1 3.76Å; L412-I645 HydrophobicContact CD1-CG2 4.4Å; L412-L805 HydrophobicContact CD2-CD2 4.35Å; L412-I808 HydrophobicContact CD2-CD1 3.8Å
413	T	84.7	Confident	88.3	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-77.2	-45.5	-174.6	-59.9	0	0	0	0	111.8	F409 L410 F411 A416 N417 L755 F817	F409-T413 WeakPolarHBondContact CD2-OG1 3.49Å; F409-T413 HydrophobicContact CE2-CG2 4.23Å; F409-T413 WeakPolarHBondContact CE2-OG1 3.37Å; F409-T413 HydrophobicContact CZ-CG2 3.81Å; F409-T413 WeakPolarHBondContact CZ-OG1 3.37Å; F409-T413 VanDerWaalsContact O-CB 3.3Å; F409-T413 WeakPolarHBondContact O-CB 3.39Å; F409-T413 PolarHBondContact O-N 3.44Å; F409-T413 PolarHBondContact O-OG1 3.3Å; L410-T413 PolarHBondContact O-N 3.38Å; F411-T413 VanDerWaalsContact C-N 3.32Å; F411-T413 PolarHBondContact O-N 2.8Å; T413-A416 PolarHBondContact O-N 3.29Å; T413-N417 WeakPolarHBondContact O-CB 3.28Å; T413-N417 PolarHBondContact O-N 2.78Å; T413-L755 HydrophobicContact CG2-CD2 3.46Å; T413-L755 VanDerWaalsContact CG2-CD2 3.46Å; T413-F817 HydrophobicContact CG2-CD1 4.2Å; T413-F817 HydrophobicContact CG2-CE1 3.33Å; T413-F817 HydrophobicContact CG2-CZ 3.96Å
414	N	90.7	Very high	88.1	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-69.1	-36.6	176.6	-167.2	19.3	0	0	0	111	L410 N417 I418 S461 L755 H792 I795	L410-N414 HydrophobicContact CD2-CB 4.11Å; L410-N414 WeakPolarHBondContact O-CB 3.27Å; L410-N414 PolarHBondContact O-N 3.26Å; N414-N417 WeakPolarHBondContact O-CB 3.36Å; N414-N417 PolarHBondContact O-N 2.91Å; N414-I418 WeakPolarHBondContact O-CB 3.31Å; N414-I418 WeakPolarHBondContact O-CG1 3.16Å; N414-I418 PolarHBondContact O-N 2.82Å; N414-S461 WeakPolarHBondContact OD1-CB 3.16Å; N414-S461 PolarHBondContact OD1-OG 3.41Å; N414-L755 HydrophobicContact CB-CD1 4.12Å; N414-L755 WeakPolarHBondContact OD1-CD1 3.46Å; N414-H792 PolarHBondContact ND2-NE2 3.31Å; N414-H792 VanDerWaalsContact ND2-NE2 3.14Å; N414-I795 HydrophobicContact CB-CD1 3.89Å; N414-I795 VanDerWaalsContact ND2-CD1 3.32Å; N414-I795 WeakPolarHBondContact ND2-CD1 3.35Å
415	L	90.4	Very high	88.1	Confident	2 Å²	2	16.3 Å²	16.3	1%	0.01	9%	0.093	C	C	.	.	H	α-helix	trans	-61.3	-46.5	173.8	179	63.7	0	0	0	111.7	F411 N417 I418 I419 I795 L805	F411-L415 HydrophobicContact CE2-CD2 3.99Å; F411-L415 HydrophobicContact CZ-CD2 3.91Å; F411-L415 WeakPolarHBondContact O-CB 3.47Å; F411-L415 PolarHBondContact O-N 3.22Å; L415-N417 VanDerWaalsContact C-N 3.3Å; L415-N417 PolarHBondContact O-N 2.8Å; L415-I418 PolarHBondContact O-N 3.45Å; L415-I419 HydrophobicContact CD1-CD1 4.03Å; L415-I419 HydrophobicContact CD1-CG1 4.32Å; L415-I419 HydrophobicContact CG-CD1 3.88Å; L415-I419 VanDerWaalsContact O-CG1 3.27Å; L415-I419 WeakPolarHBondContact O-CG1 3.4Å; L415-I419 PolarHBondContact O-N 3.44Å; L415-I795 HydrophobicContact CB-CG1 4.5Å; L415-I795 HydrophobicContact CD1-CG2 4.46Å; L415-L805 HydrophobicContact CD2-CD1 3.68Å; L415-L805 HydrophobicContact CD2-CD2 3.7Å; L415-L805 HydrophobicContact CD2-CG 4.26Å
416	A	84.5	Confident	88.2	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.1	-43.6	175.5	0	0	0	0	0	111.6	L412 T413 I418 I419 I420 L813 F817	L412-A416 WeakPolarHBondContact O-CB 3.26Å; L412-A416 PolarHBondContact O-N 3.48Å; L412-A416 VanDerWaalsContact O-N 3.1Å; T413-A416 PolarHBondContact O-N 3.29Å; A416-I418 PolarHBondContact O-N 3.15Å; A416-I419 PolarHBondContact O-N 3.01Å; A416-I420 VanDerWaalsContact O-CG1 3.28Å; A416-I420 WeakPolarHBondContact O-CG1 3.26Å; A416-I420 PolarHBondContact O-N 3.09Å; A416-L813 HydrophobicContact CB-CD1 3.86Å; A416-F817 HydrophobicContact CB-CZ 3.99Å
417	N	86.3	Confident	88.1	Confident	15 Å²	15	24.7 Å²	24.7	8%	0.08	13%	0.134	C	C	.	.	H	α-helix	trans	-59.2	-47.4	176.4	-165.6	37.2	0	0	0	112.3	T413 N414 L415 I419 I420 F421 S461	T413-N417 WeakPolarHBondContact O-CB 3.28Å; T413-N417 PolarHBondContact O-N 2.78Å; N414-N417 WeakPolarHBondContact O-CB 3.36Å; N414-N417 PolarHBondContact O-N 2.91Å; L415-N417 VanDerWaalsContact C-N 3.3Å; L415-N417 PolarHBondContact O-N 2.8Å; N417-I419 VanDerWaalsContact C-N 3.32Å; N417-I419 PolarHBondContact O-N 3.08Å; N417-I420 PolarHBondContact O-N 3.4Å; N417-F421 WeakPolarHBondContact O-CB 3.2Å; N417-F421 WeakPolarHBondContact O-CD2 3.13Å; N417-F421 PolarHBondContact O-N 3.25Å; N417-F421 WeakPolarHBondContact OD1-CD2 3.36Å; N417-F421 WeakPolarHBondContact OD1-CE2 3.33Å; N417-S461 PolarHBondContact ND2-OG 3.24Å
418	I	90.3	Very high	88	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.9	-40.1	178	-72.6	170	0	0	0	111.4	N414 L415 A416 G422 C438 I439 F749 I795	N414-I418 WeakPolarHBondContact O-CB 3.31Å; N414-I418 WeakPolarHBondContact O-CG1 3.16Å; N414-I418 PolarHBondContact O-N 2.82Å; L415-I418 PolarHBondContact O-N 3.45Å; A416-I418 PolarHBondContact O-N 3.15Å; I418-G422 WeakPolarHBondContact O-CA 3.41Å; I418-G422 PolarHBondContact O-N 3.38Å; I418-C438 HydrophobicContact CG2-CB 3.75Å; I418-I439 HydrophobicContact CG2-CG1 3.95Å; I418-F749 HydrophobicContact CD1-CE2 4.09Å; I418-F749 HydrophobicContact CD1-CZ 4.48Å; I418-F749 HydrophobicContact CG1-CE2 4.09Å; I418-F749 HydrophobicContact CG1-CZ 4.15Å; I418-I795 HydrophobicContact CD1-CD1 3.95Å; I418-I795 HydrophobicContact CD1-CG2 3.91Å
419	I	86.6	Confident	88	Confident	11 Å²	11	22.9 Å²	22.9	6%	0.056	13%	0.127	C	C	.	.	H	α-helix	trans	-68.7	-46.3	178.6	-67.2	164	0	0	0	110.8	L415 A416 N417 G422 A423 I435 L662 L664	L415-I419 HydrophobicContact CD1-CD1 4.03Å; L415-I419 HydrophobicContact CD1-CG1 4.32Å; L415-I419 HydrophobicContact CG-CD1 3.88Å; L415-I419 VanDerWaalsContact O-CG1 3.27Å; L415-I419 WeakPolarHBondContact O-CG1 3.4Å; L415-I419 PolarHBondContact O-N 3.44Å; A416-I419 PolarHBondContact O-N 3.01Å; N417-I419 VanDerWaalsContact C-N 3.32Å; N417-I419 PolarHBondContact O-N 3.08Å; I419-G422 PolarHBondContact O-N 3.35Å; I419-A423 WeakPolarHBondContact O-CB 3.32Å; I419-A423 PolarHBondContact O-N 2.83Å; I419-I435 HydrophobicContact CG1-CG2 4.35Å; I419-L662 HydrophobicContact CD1-CD2 4.07Å; I419-L664 HydrophobicContact CD1-CD1 3.58Å; I419-L664 HydrophobicContact CG1-CD1 3.95Å
420	I	83.2	Confident	87.9	Confident	46 Å²	46	27 Å²	27	24%	0.236	15%	0.149	C	C	.	.	H	α-helix	trans	-60.6	-52.3	179.4	-68.2	165.4	0	0	0	109.8	A416 N417 G422 A423 V424 L810	A416-I420 VanDerWaalsContact O-CG1 3.28Å; A416-I420 WeakPolarHBondContact O-CG1 3.26Å; A416-I420 PolarHBondContact O-N 3.09Å; N417-I420 PolarHBondContact O-N 3.4Å; I420-G422 VanDerWaalsContact C-N 3.32Å; I420-G422 PolarHBondContact O-N 3.46Å; I420-A423 PolarHBondContact O-N 3.47Å; I420-V424 WeakPolarHBondContact O-CG2 3.33Å; I420-V424 PolarHBondContact O-N 2.86Å; I420-V424 VanDerWaalsContact O-N 3.11Å; I420-L810 HydrophobicContact CD1-CD1 4.46Å
421	F	87.8	Confident	87.7	Confident	28 Å²	28	31.1 Å²	31.1	12%	0.123	17%	0.171	C	C	.	.	H	α-helix	trans	-65.7	-35.6	177.6	-78.6	-58.6	0	0	0	112.5	N417 V424 M425 A462 L467	N417-F421 WeakPolarHBondContact O-CB 3.2Å; N417-F421 WeakPolarHBondContact O-CD2 3.13Å; N417-F421 PolarHBondContact O-N 3.25Å; N417-F421 WeakPolarHBondContact OD1-CD2 3.36Å; N417-F421 WeakPolarHBondContact OD1-CE2 3.33Å; F421-V424 PolarHBondContact O-N 3.29Å; F421-M425 WeakPolarHBondContact O-CB 3.48Å; F421-M425 PolarHBondContact O-N 2.69Å; F421-A462 HydrophobicContact CB-CB 3.81Å; F421-A462 HydrophobicContact CD2-CB 4.09Å; F421-A462 WeakPolarHBondContact CD2-O 2.82Å; F421-A462 WeakPolarHBondContact CE2-O 3.5Å; F421-A462 HydrophobicContact CG-CB 4.07Å; F421-L467 HydrophobicContact CD1-CD2 3.68Å; F421-L467 HydrophobicContact CE1-CD2 4.26Å
422	G	88.5	Confident	87.3	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.2	-36.7	174.9	0	0	0	0	0	113.5	I418 I419 I420 S426 C438	I418-G422 WeakPolarHBondContact O-CA 3.41Å; I418-G422 PolarHBondContact O-N 3.38Å; I419-G422 PolarHBondContact O-N 3.35Å; I420-G422 VanDerWaalsContact C-N 3.32Å; I420-G422 PolarHBondContact O-N 3.46Å; G422-S426 WeakPolarHBondContact O-CB 3.43Å; G422-S426 PolarHBondContact O-N 3.05Å; G422-C438 VanDerWaalsContact CA-SG 3.57Å
423	A	85.6	Confident	87.3	Confident	46 Å²	46	31.7 Å²	31.7	38%	0.38	17%	0.174	S	C	.	.	H	α-helix	trans	-69.2	-45.2	175.7	0	0	0	0	0	111.6	I419 I420 M425 S426 H427 I435	I419-A423 WeakPolarHBondContact O-CB 3.32Å; I419-A423 PolarHBondContact O-N 2.83Å; I420-A423 PolarHBondContact O-N 3.47Å; A423-M425 VanDerWaalsContact C-N 3.32Å; A423-M425 PolarHBondContact O-N 2.95Å; A423-S426 WeakPolarHBondContact O-CB 3.28Å; A423-S426 PolarHBondContact O-N 3.38Å; A423-H427 PolarHBondContact O-N 3.41Å; A423-I435 HydrophobicContact CB-CD1 4.36Å
424	V	85.8	Confident	87.5	Confident	69 Å²	69	31.7 Å²	31.7	42%	0.418	17%	0.173	S	C	.	.	H	α-helix	trans	-64.4	-38.8	175.8	-179.3	0	0	0	0	111.1	I420 F421 H427 S428 L467	I420-V424 WeakPolarHBondContact O-CG2 3.33Å; I420-V424 PolarHBondContact O-N 2.86Å; I420-V424 VanDerWaalsContact O-N 3.11Å; F421-V424 PolarHBondContact O-N 3.29Å; V424-H427 PolarHBondContact O-N 3.07Å; V424-S428 VanDerWaalsContact O-CB 3.26Å; V424-S428 WeakPolarHBondContact O-CB 3.39Å; V424-S428 PolarHBondContact O-N 2.8Å; V424-S428 PolarHBondContact O-OG 3.43Å; V424-L467 HydrophobicContact CB-CD2 4.15Å; V424-L467 HydrophobicContact CG1-CD2 3.82Å
425	M	88.7	Confident	87.4	Confident	8 Å²	8	33.1 Å²	33.1	4%	0.039	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-48.9	173.7	-171.9	77.6	75.2	0	0	110.9	F421 A423 H427 S428 L429 M433 L467 P747	F421-M425 WeakPolarHBondContact O-CB 3.48Å; F421-M425 PolarHBondContact O-N 2.69Å; A423-M425 VanDerWaalsContact C-N 3.32Å; A423-M425 PolarHBondContact O-N 2.95Å; M425-H427 VanDerWaalsContact C-N 3.28Å; M425-H427 PolarHBondContact O-N 2.93Å; M425-S428 PolarHBondContact O-N 3.16Å; M425-S428 VanDerWaalsContact O-N 3.14Å; M425-L429 HydrophobicContact CB-CD1 4.46Å; M425-L429 HydrophobicContact CG-CD1 3.61Å; M425-L429 VanDerWaalsContact O-CD1 3.28Å; M425-L429 WeakPolarHBondContact O-CD1 3.11Å; M425-L429 PolarHBondContact O-N 3.45Å; M425-L429 HydrophobicContact SD-CD1 3.09Å; M425-L429 WeakPolarHBondContact SD-CD1 3.42Å; M425-M433 CarbonylContact C-O 3.53Å; M425-M433 HydrophobicContact CG-CB 4.38Å; M425-L467 HydrophobicContact CB-CD1 3.89Å; M425-L467 HydrophobicContact CE-CB 4.26Å; M425-L467 HydrophobicContact CE-CD1 3.36Å; M425-L467 HydrophobicContact CE-CG 4.38Å; M425-L467 HydrophobicContact CG-CD1 4.19Å; M425-L467 HydrophobicContact SD-CD1 3.26Å; M425-L467 WeakPolarHBondContact SD-CD1 3.47Å; M425-P747 HydrophobicContact CE-CB 4.27Å
426	S	88.3	Confident	87.4	Confident	23 Å²	23	33.4 Å²	33.4	16%	0.161	18%	0.182	C	C	.	.	H	α-helix	trans	-56.4	-43.1	177.4	-154.9	0	0	0	0	112	G422 A423 D430 N431 M433	G422-S426 WeakPolarHBondContact O-CB 3.43Å; G422-S426 PolarHBondContact O-N 3.05Å; A423-S426 WeakPolarHBondContact O-CB 3.28Å; A423-S426 PolarHBondContact O-N 3.38Å; S426-D430 PolarHBondContact O-N 3.27Å; S426-N431 PolarHBondContact O-N 2.79Å; S426-N431 PolarHBondContact O-OD1 3.44Å; S426-N431 PolarHBondContact OG-OD1 3.26Å; S426-M433 VanDerWaalsContact CA-O 3.23Å; S426-M433 WeakPolarHBondContact CA-O 3.41Å; S426-M433 PolarHBondContact N-O 3.38Å
427	H	88.3	Confident	87.7	Confident	158 Å²	158	33.4 Å²	33.4	73%	0.731	18%	0.182	S	C	*	.	H	α-helix	trans	-71.6	-37	178.4	-174	60.5	0	0	0	113	A423 V424 M425	A423-H427 PolarHBondContact O-N 3.41Å; V424-H427 PolarHBondContact O-N 3.07Å; M425-H427 VanDerWaalsContact C-N 3.28Å; M425-H427 PolarHBondContact O-N 2.93Å
428	S	89	Confident	88	Confident	30 Å²	30	32.8 Å²	32.8	21%	0.21	18%	0.179	C	C	.	.	H	α-helix	trans	-82	-17.9	-174.1	-56.1	0	0	0	0	114.1	V424 M425	V424-S428 VanDerWaalsContact O-CB 3.26Å; V424-S428 WeakPolarHBondContact O-CB 3.39Å; V424-S428 PolarHBondContact O-N 2.8Å; V424-S428 PolarHBondContact O-OG 3.43Å; M425-S428 PolarHBondContact O-N 3.16Å; M425-S428 VanDerWaalsContact O-N 3.14Å
429	L	90.1	Very high	88.1	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	24.1	179.7	-71.2	112	0	0	0	112.8	M425 N431 Q432 Y474 F484	M425-L429 HydrophobicContact CB-CD1 4.46Å; M425-L429 HydrophobicContact CG-CD1 3.61Å; M425-L429 VanDerWaalsContact O-CD1 3.28Å; M425-L429 WeakPolarHBondContact O-CD1 3.11Å; M425-L429 PolarHBondContact O-N 3.45Å; M425-L429 HydrophobicContact SD-CD1 3.09Å; M425-L429 WeakPolarHBondContact SD-CD1 3.42Å; L429-N431 VanDerWaalsContact C-N 3.25Å; L429-N431 PolarHBondContact O-N 2.95Å; L429-N431 VanDerWaalsContact O-N 3.1Å; L429-Q432 HydrophobicContact CB-CB 4.24Å; L429-Q432 VanDerWaalsContact O-CB 3.3Å; L429-Q432 WeakPolarHBondContact O-CB 3.29Å; L429-Q432 WeakPolarHBondContact O-CG 3.46Å; L429-Q432 PolarHBondContact O-N 3.38Å; L429-Y474 HydrophobicContact CB-CD1 4.44Å; L429-Y474 HydrophobicContact CB-CG 4.4Å; L429-Y474 HydrophobicContact CD2-CD2 4.09Å; L429-Y474 HydrophobicContact CD2-CG 3.86Å; L429-Y474 HydrophobicContact CG-CD1 4.35Å; L429-Y474 HydrophobicContact CG-CG 4.1Å; L429-F484 HydrophobicContact CD2-CD1 4.28Å; L429-F484 HydrophobicContact CD2-CE1 3.42Å; L429-F484 VanDerWaalsContact CD2-CE1 3.42Å; L429-F484 HydrophobicContact CD2-CE2 3.77Å; L429-F484 HydrophobicContact CD2-CZ 3.11Å
430	D	86.7	Confident	88.4	Confident	93 Å²	93	33.6 Å²	33.6	50%	0.497	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.3	45.7	179	-54.2	-47.1	0	0	0	114	S426 Q432 Y474	S426-D430 PolarHBondContact O-N 3.27Å; D430-Q432 VanDerWaalsContact C-N 3.25Å; D430-Q432 PolarHBondContact O-N 3.04Å; D430-Y474 WeakPolarHBondContact CB-OH 3.33Å; D430-Y474 VanDerWaalsContact OD2-CE1 3.26Å; D430-Y474 WeakPolarHBondContact OD2-CE1 3.44Å; D430-Y474 PolarHBondContact OD2-OH 3.35Å
431	N	85.2	Confident	88.9	Confident	90 Å²	90	31.5 Å²	31.5	48%	0.481	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	17.4	-177.7	-56.2	-41.5	0	0	0	116	S426 L429 M433 S671 I672	S426-N431 PolarHBondContact O-N 2.79Å; S426-N431 PolarHBondContact O-OD1 3.44Å; S426-N431 PolarHBondContact OG-OD1 3.26Å; L429-N431 VanDerWaalsContact C-N 3.25Å; L429-N431 PolarHBondContact O-N 2.95Å; L429-N431 VanDerWaalsContact O-N 3.1Å; N431-M433 PolarHBondContact O-N 2.97Å; N431-S671 WeakPolarHBondContact O-CB 3.23Å; N431-I672 WeakPolarHBondContact O-CG1 3.35Å
432	Q	85.5	Confident	89.2	Confident	45 Å²	45	30.1 Å²	30.1	21%	0.21	17%	0.166	C	C	.	.	S	Bend	trans	-60.1	-34.1	169.5	-66.3	-69.8	-37.2	0	0	112.5	L429 D430 Y474 F484 I672	L429-Q432 HydrophobicContact CB-CB 4.24Å; L429-Q432 VanDerWaalsContact O-CB 3.3Å; L429-Q432 WeakPolarHBondContact O-CB 3.29Å; L429-Q432 WeakPolarHBondContact O-CG 3.46Å; L429-Q432 PolarHBondContact O-N 3.38Å; D430-Q432 VanDerWaalsContact C-N 3.25Å; D430-Q432 PolarHBondContact O-N 3.04Å; Q432-Y474 HydrophobicContact CG-CD2 4.42Å; Q432-Y474 HydrophobicContact CG-CE2 3.7Å; Q432-F484 HydrophobicContact CB-CD1 4.16Å; Q432-F484 HydrophobicContact CB-CE1 4.33Å; Q432-F484 HydrophobicContact CG-CD1 4.36Å; Q432-I672 HydrophobicContact CB-CD1 4.34Å; Q432-I672 HydrophobicContact CG-CD1 4.25Å; Q432-I672 VanDerWaalsContact OE1-CD1 3.24Å
433	M	87.7	Confident	89.5	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	18%	0.176	C	C	.	.	S	Bend	trans	-148.2	140.4	176.6	-65.3	175.3	62.7	0	0	108.7	M425 S426 N431 F484 G745 P747	M425-M433 CarbonylContact C-O 3.53Å; M425-M433 HydrophobicContact CG-CB 4.38Å; S426-M433 VanDerWaalsContact CA-O 3.23Å; S426-M433 WeakPolarHBondContact CA-O 3.41Å; S426-M433 PolarHBondContact N-O 3.38Å; N431-M433 PolarHBondContact O-N 2.97Å; M433-F484 HydrophobicContact SD-CE1 4.08Å; M433-G745 VanDerWaalsContact CE-O 3.31Å; M433-G745 WeakPolarHBondContact CE-O 3.41Å; M433-P747 HydrophobicContact CE-CB 3.99Å; M433-P747 HydrophobicContact CE-CG 4.25Å
434	G	88.2	Confident	89.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.174	C	C	.	.			trans	-143.8	-144.1	-178.5	0	0	0	0	0	113.2	M436 E437 C438 S671	G434-M436 PolarHBondContact O-N 3.37Å; G434-E437 PolarHBondContact N-OE2 3.24Å; G434-C438 PolarHBondContact O-N 3.46Å; G434-C438 PolarHBondContact O-SG 2.91Å; G434-C438 VanDerWaalsContact O-SG 3.37Å; G434-S671 WeakPolarHBondContact CA-OG 3.39Å; G434-S671 PolarHBondContact N-OG 3.27Å; G434-S671 VanDerWaalsContact N-OG 3.12Å
435	I	89.4	Confident	90.3	Very high	30 Å²	30	28.9 Å²	28.9	15%	0.154	16%	0.155	C	C	.	.	H	α-helix	trans	-67.4	-36.6	-171.6	-59.1	169.5	0	0	0	111.5	I419 A423 C438 I439 P665	I419-I435 HydrophobicContact CG1-CG2 4.35Å; A423-I435 HydrophobicContact CB-CD1 4.36Å; I435-C438 WeakPolarHBondContact O-CB 3.36Å; I435-C438 PolarHBondContact O-N 2.97Å; I435-I439 HydrophobicContact CG2-CD1 3.85Å; I435-I439 HydrophobicContact CG2-CG1 4.37Å; I435-I439 WeakPolarHBondContact O-CG1 3.15Å; I435-I439 PolarHBondContact O-N 2.96Å; I435-P665 HydrophobicContact CB-CG 4.27Å; I435-P665 HydrophobicContact CG2-CG 4.01Å
436	M	89.7	Confident	90.6	Very high	9 Å²	9	28.6 Å²	28.6	4%	0.044	15%	0.154	C	C	.	.	H	α-helix	trans	-67.6	-45.4	-176.3	-73.2	-57.4	-53.3	0	0	112.6	G434 C438 I439 I440 P665 F668 R669 L799	G434-M436 PolarHBondContact O-N 3.37Å; M436-C438 VanDerWaalsContact C-N 3.29Å; M436-C438 PolarHBondContact O-N 2.95Å; M436-I439 PolarHBondContact O-N 3.4Å; M436-I440 WeakPolarHBondContact O-CG1 3.41Å; M436-I440 PolarHBondContact O-N 3.24Å; M436-I440 VanDerWaalsContact O-N 3.09Å; M436-P665 HydrophobicContact CG-CB 4.13Å; M436-P665 HydrophobicContact CG-CG 3.78Å; M436-P665 HydrophobicContact SD-CB 3.78Å; M436-P665 HydrophobicContact SD-CG 3.25Å; M436-P665 WeakPolarHBondContact SD-CG 3.49Å; M436-F668 HydrophobicContact CE-CB 4.37Å; M436-F668 HydrophobicContact CE-CD2 3.64Å; M436-F668 HydrophobicContact CE-CE2 4.35Å; M436-F668 HydrophobicContact CE-CG 4.31Å; M436-R669 WeakPolarHBondContact CB-O 3.49Å; M436-R669 WeakPolarHBondContact CG-O 3.37Å; M436-L799 HydrophobicContact CE-CD1 3.9Å; M436-L799 HydrophobicContact CE-CD2 3.92Å; M436-L799 HydrophobicContact SD-CD2 3.99Å
437	E	91.8	Very high	91	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.3	-37.5	174.7	-65.1	78.8	-177.2	0	0	111	G434 S441 P670 S671 W676 L746 P747	G434-E437 PolarHBondContact N-OE2 3.24Å; E437-S441 WeakPolarHBondContact O-CB 3.46Å; E437-S441 PolarHBondContact O-N 3.48Å; E437-P670 VanDerWaalsContact OE1-CA 3.25Å; E437-P670 WeakPolarHBondContact OE1-CA 3.45Å; E437-P670 WeakPolarHBondContact OE1-CB 3.46Å; E437-S671 PolarHBondContact OE1-N 3.01Å; E437-S671 PolarHBondContact OE2-OG 3.23Å; E437-W676 HydrophobicContact CG-CZ3 4.29Å; E437-L746 HydrophobicContact CB-CD2 4.07Å; E437-L746 HydrophobicContact CG-CD2 4.4Å; E437-P747 WeakPolarHBondContact O-CD 3.43Å
438	C	92.1	Very high	91.3	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.007	13%	0.131	C	C	.	.	H	α-helix	trans	-62.4	-43.6	174.1	-75.8	0	0	0	0	112.7	I418 G422 G434 I435 M436 S441 G442 P747 F749	I418-C438 HydrophobicContact CG2-CB 3.75Å; G422-C438 VanDerWaalsContact CA-SG 3.57Å; G434-C438 PolarHBondContact O-N 3.46Å; G434-C438 PolarHBondContact O-SG 2.91Å; G434-C438 VanDerWaalsContact O-SG 3.37Å; I435-C438 WeakPolarHBondContact O-CB 3.36Å; I435-C438 PolarHBondContact O-N 2.97Å; M436-C438 VanDerWaalsContact C-N 3.29Å; M436-C438 PolarHBondContact O-N 2.95Å; C438-S441 PolarHBondContact O-N 3.33Å; C438-G442 PolarHBondContact O-N 3.29Å; C438-P747 HydrophobicContact CB-CG 4.31Å; C438-F749 VanDerWaalsContact O-CZ 3.31Å; C438-F749 WeakPolarHBondContact O-CZ 3.09Å
439	I	92.7	Very high	91.6	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-64.8	-45.8	178.6	-69.3	166.3	0	0	0	111.1	I418 I435 M436 G442 C443 L664 I795 L799	I418-I439 HydrophobicContact CG2-CG1 3.95Å; I435-I439 HydrophobicContact CG2-CD1 3.85Å; I435-I439 HydrophobicContact CG2-CG1 4.37Å; I435-I439 WeakPolarHBondContact O-CG1 3.15Å; I435-I439 PolarHBondContact O-N 2.96Å; M436-I439 PolarHBondContact O-N 3.4Å; I439-G442 PolarHBondContact O-N 3.32Å; I439-C443 PolarHBondContact O-N 2.96Å; I439-L664 HydrophobicContact CD1-CD1 3.72Å; I439-I795 HydrophobicContact CG2-CG2 4.28Å; I439-L799 HydrophobicContact CD1-CD2 4.48Å
440	I	92.3	Very high	91.7	Very high	28 Å²	28	22.3 Å²	22.3	14%	0.144	12%	0.123	C	C	.	.	H	α-helix	trans	-65.8	-42.8	178.8	-66.3	164.8	0	0	0	110.4	M436 G442 C443 V444 F668 W676 L746	M436-I440 WeakPolarHBondContact O-CG1 3.41Å; M436-I440 PolarHBondContact O-N 3.24Å; M436-I440 VanDerWaalsContact O-N 3.09Å; I440-G442 VanDerWaalsContact C-N 3.33Å; I440-G442 PolarHBondContact O-N 2.88Å; I440-C443 PolarHBondContact O-N 2.69Å; I440-V444 HydrophobicContact CG2-CG2 4.2Å; I440-V444 WeakPolarHBondContact O-CG2 3.3Å; I440-V444 PolarHBondContact O-N 3.46Å; I440-F668 HydrophobicContact CD1-CD2 4.32Å; I440-F668 HydrophobicContact CD1-CE2 3.37Å; I440-F668 HydrophobicContact CD1-CZ 3.51Å; I440-F668 HydrophobicContact CG1-CE2 3.72Å; I440-F668 HydrophobicContact CG1-CZ 4.16Å; I440-W676 HydrophobicContact CD1-CE3 4.37Å; I440-W676 HydrophobicContact CD1-CH2 3.05Å; I440-W676 HydrophobicContact CD1-CZ2 3.62Å; I440-W676 HydrophobicContact CD1-CZ3 3.47Å; I440-W676 VanDerWaalsContact CD1-CZ3 3.47Å; I440-L746 HydrophobicContact CB-CD2 4.23Å; I440-L746 HydrophobicContact CG2-CD1 4.13Å; I440-L746 HydrophobicContact CG2-CD2 4.04Å
441	S	93.7	Very high	92	Very high	1 Å²	1	21 Å²	21	1%	0.007	12%	0.115	C	C	.	.	H	α-helix	trans	-59.3	-45.3	175.2	-168	0	0	0	0	111.1	E437 C438 C443 V444 S445 P747 F749	E437-S441 WeakPolarHBondContact O-CB 3.46Å; E437-S441 PolarHBondContact O-N 3.48Å; C438-S441 PolarHBondContact O-N 3.33Å; S441-C443 VanDerWaalsContact C-N 3.33Å; S441-C443 PolarHBondContact O-N 2.73Å; S441-V444 PolarHBondContact O-N 3.42Å; S441-S445 WeakPolarHBondContact O-CA 3.15Å; S441-S445 WeakPolarHBondContact O-CB 3.3Å; S441-S445 PolarHBondContact O-N 3.13Å; S441-S445 PolarHBondContact O-OG 3.12Å; S441-P747 PolarHBondContact OG-O 2.71Å; S441-F749 WeakPolarHBondContact OG-CD1 3.36Å
442	G	93.8	Very high	92.3	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58.9	-42.5	175.8	0	0	0	0	0	113.2	C438 I439 I440 G446 H792	C438-G442 PolarHBondContact O-N 3.29Å; I439-G442 PolarHBondContact O-N 3.32Å; I440-G442 VanDerWaalsContact C-N 3.33Å; I440-G442 PolarHBondContact O-N 2.88Å; G442-G446 PolarHBondContact O-N 2.75Å; G442-H792 PolarHBondContact O-CD2 2.8Å
443	C	94.6	Very high	92.6	Very high	30 Å²	30	18.7 Å²	18.7	20%	0.203	10%	0.104	C	C	.	.	H	α-helix	trans	-63.1	-56	175.1	-177.3	0	0	0	0	111.7	I439 I440 S441 V447	I439-C443 PolarHBondContact O-N 2.96Å; I440-C443 PolarHBondContact O-N 2.69Å; S441-C443 VanDerWaalsContact C-N 3.33Å; S441-C443 PolarHBondContact O-N 2.73Å; C443-V447 VanDerWaalsContact O-CB 3.23Å; C443-V447 WeakPolarHBondContact O-CB 3.43Å; C443-V447 WeakPolarHBondContact O-CG2 3.39Å; C443-V447 PolarHBondContact O-N 2.87Å
444	V	94.7	Very high	92.7	Very high	57 Å²	57	18.9 Å²	18.9	35%	0.345	11%	0.106	S	C	.	.	H	α-helix	trans	-65.4	-49.3	-174.9	174.4	0	0	0	0	111.3	I440 S441 L448 I740	I440-V444 HydrophobicContact CG2-CG2 4.2Å; I440-V444 WeakPolarHBondContact O-CG2 3.3Å; I440-V444 PolarHBondContact O-N 3.46Å; S441-V444 PolarHBondContact O-N 3.42Å; V444-L448 WeakPolarHBondContact O-CB 3.41Å; V444-L448 PolarHBondContact O-N 3.18Å; V444-I740 HydrophobicContact CG1-CG2 4.1Å
445	S	94.4	Very high	92.8	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.014	11%	0.107	C	C	.	.	H	α-helix	trans	-65	-45.6	-178.6	66.2	0	0	0	0	112.1	S441 F449 F749	S441-S445 WeakPolarHBondContact O-CA 3.15Å; S441-S445 WeakPolarHBondContact O-CB 3.3Å; S441-S445 PolarHBondContact O-N 3.13Å; S441-S445 PolarHBondContact O-OG 3.12Å; S445-F449 WeakPolarHBondContact O-CB 3.46Å; S445-F449 PolarHBondContact O-N 2.92Å; S445-F749 WeakPolarHBondContact OG-CB 3.3Å; S445-F749 VanDerWaalsContact OG-CD2 3.28Å; S445-F749 WeakPolarHBondContact OG-CD2 3.25Å
446	G	94.6	Very high	92.8	Very high	1 Å²	1	18 Å²	18	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-70.5	-35.6	-179.3	0	0	0	0	0	114	G442 G450 H792	G442-G446 PolarHBondContact O-N 2.75Å; G446-G450 PolarHBondContact O-N 2.85Å; G446-H792 VanDerWaalsContact CA-CG 3.45Å
447	V	95.9	Very high	92.9	Very high	31 Å²	31	17.6 Å²	17.6	19%	0.188	10%	0.1	C	C	.	.	H	α-helix	trans	-68.4	-49.4	175	168.5	0	0	0	0	110.8	C443 F449 G450 L451 L789 H792 L793	C443-V447 VanDerWaalsContact O-CB 3.23Å; C443-V447 WeakPolarHBondContact O-CB 3.43Å; C443-V447 WeakPolarHBondContact O-CG2 3.39Å; C443-V447 PolarHBondContact O-N 2.87Å; V447-F449 VanDerWaalsContact C-N 3.33Å; V447-F449 PolarHBondContact O-N 3.1Å; V447-G450 PolarHBondContact O-N 3.45Å; V447-L451 HydrophobicContact CG1-CD1 4.09Å; V447-L451 WeakPolarHBondContact O-CG 3.27Å; V447-L451 PolarHBondContact O-N 3.39Å; V447-L451 VanDerWaalsContact O-N 3.12Å; V447-L789 HydrophobicContact CB-CD1 4.22Å; V447-L789 HydrophobicContact CG1-CD1 3.83Å; V447-L789 HydrophobicContact CG2-CD1 4.16Å; V447-H792 HydrophobicContact CG2-CB 4.18Å; V447-L793 HydrophobicContact CG2-CD2 3.79Å; V447-L793 HydrophobicContact CG2-CG 3.9Å
448	L	95.1	Very high	93	Very high	43 Å²	43	17.7 Å²	17.7	23%	0.225	10%	0.1	C	C	.	.	H	α-helix	trans	-65.7	-40.6	-178.8	-169.5	65.7	0	0	0	111.1	V444 L451 L452 I736 L737 I740	V444-L448 WeakPolarHBondContact O-CB 3.41Å; V444-L448 PolarHBondContact O-N 3.18Å; L448-L451 PolarHBondContact O-N 3.45Å; L448-L452 HydrophobicContact CD1-CD1 3.47Å; L448-L452 VanDerWaalsContact CD1-CD1 3.47Å; L448-L452 HydrophobicContact CD1-CG 4.12Å; L448-L452 HydrophobicContact CG-CD1 3.96Å; L448-L452 WeakPolarHBondContact O-CB 3.2Å; L448-L452 PolarHBondContact O-N 3.08Å; L448-I736 HydrophobicContact CD2-CG2 4.34Å; L448-L737 HydrophobicContact CB-CD2 3.98Å; L448-L737 HydrophobicContact CD2-CD2 3.54Å; L448-L737 HydrophobicContact CD2-CG 4.04Å; L448-L737 HydrophobicContact CG-CD2 4.28Å; L448-I740 HydrophobicContact CD2-CD1 3.68Å
449	F	95.5	Very high	93.1	Very high	3 Å²	3	17.6 Å²	17.6	1%	0.013	10%	0.1	C	C	.	.	H	α-helix	trans	-65.7	-47.4	175.2	-168.7	-90.5	0	0	0	111.6	S445 V447 L451 L452 S453 N458 L460 D730 V733 V734 L737	S445-F449 WeakPolarHBondContact O-CB 3.46Å; S445-F449 PolarHBondContact O-N 2.92Å; V447-F449 VanDerWaalsContact C-N 3.33Å; V447-F449 PolarHBondContact O-N 3.1Å; F449-L451 PolarHBondContact O-N 3.03Å; F449-L451 VanDerWaalsContact O-N 3.14Å; F449-L452 PolarHBondContact O-N 3.49Å; F449-S453 WeakPolarHBondContact CE1-OG 3.47Å; F449-S453 VanDerWaalsContact CZ-CB 3.43Å; F449-S453 WeakPolarHBondContact O-CA 3.3Å; F449-S453 WeakPolarHBondContact O-CB 3.49Å; F449-S453 PolarHBondContact O-N 3.47Å; F449-S453 PolarHBondContact O-OG 2.91Å; F449-N458 HydrophobicContact CE1-CB 3.78Å; F449-N458 WeakPolarHBondContact CE1-O 3.4Å; F449-N458 HydrophobicContact CZ-CB 4Å; F449-L460 HydrophobicContact CB-CD1 3.86Å; F449-L460 HydrophobicContact CB-CD2 3.82Å; F449-L460 HydrophobicContact CB-CG 4.4Å; F449-L460 HydrophobicContact CD1-CD1 3.23Å; F449-L460 HydrophobicContact CD2-CD1 3.51Å; F449-L460 HydrophobicContact CD2-CD2 3.83Å; F449-L460 HydrophobicContact CD2-CG 4.31Å; F449-L460 HydrophobicContact CE1-CD1 3.51Å; F449-L460 HydrophobicContact CE2-CD1 3.77Å; F449-L460 HydrophobicContact CG-CD1 3.22Å; F449-L460 HydrophobicContact CG-CD2 3.87Å; F449-L460 HydrophobicContact CG-CG 4.17Å; F449-L460 HydrophobicContact CZ-CD1 3.77Å; F449-D730 HydrophobicContact CE2-CB 4.24Å; F449-D730 HydrophobicContact CZ-CB 4.3Å; F449-V733 HydrophobicContact CB-CG1 4.4Å; F449-V733 HydrophobicContact CD2-CB 4.33Å; F449-V733 HydrophobicContact CD2-CG1 3.84Å; F449-V734 HydrophobicContact CD2-CG2 4.45Å; F449-V734 HydrophobicContact CE2-CG2 4.17Å; F449-L737 HydrophobicContact CB-CD1 4.17Å
450	G	92.1	Very high	93.2	Very high	2 Å²	2	17.6 Å²	17.6	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-57.4	-32.1	178.3	0	0	0	0	0	114	G446 V447 R785	G446-G450 PolarHBondContact O-N 2.85Å; V447-G450 PolarHBondContact O-N 3.45Å; G450-R785 PolarHBondContact O-NH1 3.48Å
451	L	92.7	Very high	93.3	Very high	66 Å²	66	16.3 Å²	16.3	35%	0.346	9%	0.093	S	C	.	.	H	α-helix	trans	-82.5	-44.3	177.7	-68.2	173.1	0	0	0	113.4	Y386 V447 L448 F449 L789	Y386-L451 WeakPolarHBondContact CE2-O 3.39Å; Y386-L451 PolarHBondContact OH-O 3.39Å; V447-L451 HydrophobicContact CG1-CD1 4.09Å; V447-L451 WeakPolarHBondContact O-CG 3.27Å; V447-L451 PolarHBondContact O-N 3.39Å; V447-L451 VanDerWaalsContact O-N 3.12Å; L448-L451 PolarHBondContact O-N 3.45Å; F449-L451 PolarHBondContact O-N 3.03Å; F449-L451 VanDerWaalsContact O-N 3.14Å; L451-L789 HydrophobicContact CD1-CD1 4.43Å; L451-L789 HydrophobicContact CD2-CD1 4.21Å; L451-L789 HydrophobicContact CD2-CD2 3.97Å; L451-L789 HydrophobicContact CG-CD1 4.02Å
452	L	92.3	Very high	93.2	Very high	87 Å²	87	16.5 Å²	16.5	46%	0.455	10%	0.095	S	C	.	.	H	α-helix	trans	-102.1	-12.1	-168.7	-59.5	-176.8	0	0	0	114.5	L448 F449 L729 V733	L448-L452 HydrophobicContact CD1-CD1 3.47Å; L448-L452 VanDerWaalsContact CD1-CD1 3.47Å; L448-L452 HydrophobicContact CD1-CG 4.12Å; L448-L452 HydrophobicContact CG-CD1 3.96Å; L448-L452 WeakPolarHBondContact O-CB 3.2Å; L448-L452 PolarHBondContact O-N 3.08Å; F449-L452 PolarHBondContact O-N 3.49Å; L452-L729 WeakPolarHBondContact O-CD2 3.37Å; L452-L729 WeakPolarHBondContact O-CG 3.01Å; L452-V733 HydrophobicContact CB-CG1 4.34Å; L452-V733 HydrophobicContact CB-CG2 3.69Å
453	S	91.8	Very high	93	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.1	C	C	.	.			trans	-71.8	155.5	-174.7	69.8	0	0	0	0	113.2	F449 P456 D730 R785	F449-S453 WeakPolarHBondContact CE1-OG 3.47Å; F449-S453 VanDerWaalsContact CZ-CB 3.43Å; F449-S453 WeakPolarHBondContact O-CA 3.3Å; F449-S453 WeakPolarHBondContact O-CB 3.49Å; F449-S453 PolarHBondContact O-N 3.47Å; F449-S453 PolarHBondContact O-OG 2.91Å; S453-P456 WeakPolarHBondContact OG-CA 3.2Å; S453-D730 WeakPolarHBondContact CB-OD1 3.46Å; S453-R785 PolarHBondContact O-NH1 3.09Å; S453-R785 PolarHBondContact O-NH2 3.33Å
454	G	88.5	Confident	92.7	Very high	5 Å²	5	17 Å²	17	5%	0.052	10%	0.101	C	C	.	.	S	Bend	trans	-78.5	-35.3	172	0	0	0	0	0	113	D730	G454-D730 WeakPolarHBondContact CA-OD1 3.04Å; G454-D730 PolarHBondContact N-OD1 3.29Å
455	Q	91.1	Very high	92.5	Very high	5 Å²	5	17.2 Å²	17.2	2%	0.023	10%	0.104	C	C	.	.			trans	-118.8	91.4	173.1	-177.4	52.9	-58.4	0	0	111.7	L457 N458 V714 N715 D730	Q455-L457 HydrophobicContact CG-CB 4.38Å; Q455-L457 PolarHBondContact O-N 3.27Å; Q455-N458 WeakPolarHBondContact O-CB 3.37Å; Q455-N458 PolarHBondContact O-N 3.1Å; Q455-N458 VanDerWaalsContact O-N 3.16Å; Q455-V714 HydrophobicContact CG-CG1 3.88Å; Q455-N715 PolarHBondContact NE2-OD1 3.12Å; Q455-D730 PolarHBondContact N-OD1 3.14Å
456	P	90.3	Very high	92.4	Very high	7 Å²	7	17.3 Å²	17.3	5%	0.045	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-8.6	-177.2	30.7	-38.3	0	0	0	114.8	S453 N458 R785	S453-P456 WeakPolarHBondContact OG-CA 3.2Å; P456-N458 PolarHBondContact O-N 2.87Å; P456-R785 HydrophobicContact CB-CB 4.39Å; P456-R785 HydrophobicContact CB-CG 3.59Å; P456-R785 HydrophobicContact CG-CG 3.55Å
457	L	91.8	Very high	92.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-16.6	170.8	-62.1	179.2	0	0	0	112.4	Q455 I459 V714 L721 I760 L763 I781 E783	Q455-L457 HydrophobicContact CG-CB 4.38Å; Q455-L457 PolarHBondContact O-N 3.27Å; L457-I459 PolarHBondContact O-N 3.21Å; L457-V714 HydrophobicContact CB-CG1 3.93Å; L457-V714 HydrophobicContact CD1-CG1 4.29Å; L457-L721 HydrophobicContact CD1-CD2 3.87Å; L457-I760 HydrophobicContact CB-CG1 4.49Å; L457-I760 HydrophobicContact CD1-CG1 4.38Å; L457-L763 HydrophobicContact CD2-CD1 3.72Å; L457-I781 HydrophobicContact CD1-CG2 4.35Å; L457-E783 HydrophobicContact CD1-CG 4.5Å
458	N	93.5	Very high	92.2	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	12%	0.124	C	C	.	.	S	Bend	trans	-76	121.1	172.2	-66.4	-25.6	0	0	0	109.6	F449 Q455 P456 V714 D730 A751	F449-N458 HydrophobicContact CE1-CB 3.78Å; F449-N458 WeakPolarHBondContact CE1-O 3.4Å; F449-N458 HydrophobicContact CZ-CB 4Å; Q455-N458 WeakPolarHBondContact O-CB 3.37Å; Q455-N458 PolarHBondContact O-N 3.1Å; Q455-N458 VanDerWaalsContact O-N 3.16Å; P456-N458 PolarHBondContact O-N 2.87Å; N458-V714 WeakPolarHBondContact OD1-CG2 3.24Å; N458-D730 PolarHBondContact ND2-OD2 3.45Å; N458-D730 VanDerWaalsContact ND2-OD2 3.08Å; N458-A751 HydrophobicContact CB-CB 4.11Å
459	I	94.2	Very high	92.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.121	C	C	.	.	P	Polyproline II helix	trans	-102.3	121.9	-177.3	-57.6	-56	0	0	0	109.7	L410 L457 A751 A752 L755 S756 H759 A788	L410-I459 HydrophobicContact CD1-CD1 3.62Å; L410-I459 HydrophobicContact CD1-CG1 3.78Å; L410-I459 HydrophobicContact CD1-CG2 4.45Å; L410-I459 HydrophobicContact CD2-CG2 4.03Å; L457-I459 PolarHBondContact O-N 3.21Å; I459-A751 CarbonylContact O-C 3.59Å; I459-A751 WeakPolarHBondContact O-CA 3.47Å; I459-A752 PolarHBondContact O-N 3.26Å; I459-L755 HydrophobicContact CB-CB 4.25Å; I459-L755 HydrophobicContact CG2-CB 4.19Å; I459-L755 HydrophobicContact CG2-CD1 4.37Å; I459-S756 PolarHBondContact N-OG 3.43Å; I459-H759 HydrophobicContact CG1-CB 4.22Å; I459-A788 HydrophobicContact CD1-CB 3.56Å
460	L	94.9	Very high	92.1	Very high	1 Å²	1	21 Å²	21	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	133	179.8	-84.9	65.7	0	0	0	110.9	F449 L737 F749 V750 H792	F449-L460 HydrophobicContact CB-CD1 3.86Å; F449-L460 HydrophobicContact CB-CD2 3.82Å; F449-L460 HydrophobicContact CB-CG 4.4Å; F449-L460 HydrophobicContact CD1-CD1 3.23Å; F449-L460 HydrophobicContact CD2-CD1 3.51Å; F449-L460 HydrophobicContact CD2-CD2 3.83Å; F449-L460 HydrophobicContact CD2-CG 4.31Å; F449-L460 HydrophobicContact CE1-CD1 3.51Å; F449-L460 HydrophobicContact CE2-CD1 3.77Å; F449-L460 HydrophobicContact CG-CD1 3.22Å; F449-L460 HydrophobicContact CG-CD2 3.87Å; F449-L460 HydrophobicContact CG-CG 4.17Å; F449-L460 HydrophobicContact CZ-CD1 3.77Å; L460-L737 HydrophobicContact CD2-CD1 3.6Å; L460-F749 HydrophobicContact CB-CB 4.28Å; L460-V750 WeakPolarHBondContact CA-O 3.29Å; L460-H792 PolarHBondContact O-NE2 2.95Å
461	S	93.7	Very high	92.2	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	174.7	174.3	-157.3	0	0	0	0	110.2	N414 N417 F749 V750	N414-S461 WeakPolarHBondContact OD1-CB 3.16Å; N414-S461 PolarHBondContact OD1-OG 3.41Å; N417-S461 PolarHBondContact ND2-OG 3.24Å; S461-F749 VanDerWaalsContact CA-CD2 3.45Å; S461-V750 PolarHBondContact N-O 2.93Å; S461-V750 PolarHBondContact O-N 2.87Å; S461-V750 VanDerWaalsContact O-N 3.13Å
462	A	91.2	Very high	92.3	Very high	5 Å²	5	23.4 Å²	23.4	4%	0.041	13%	0.133	C	C	.	.			trans	-68.8	135.3	169	0	0	0	0	0	109.6	F421 F749	F421-A462 HydrophobicContact CB-CB 3.81Å; F421-A462 HydrophobicContact CD2-CB 4.09Å; F421-A462 WeakPolarHBondContact CD2-O 2.82Å; F421-A462 WeakPolarHBondContact CE2-O 3.5Å; F421-A462 HydrophobicContact CG-CB 4.07Å; A462-F749 HydrophobicContact CB-CD1 4.48Å; A462-F749 HydrophobicContact CB-CE1 3.96Å; A462-F749 HydrophobicContact CB-CZ 4.24Å
463	T	89.6	Confident	92.4	Very high	19 Å²	19	20 Å²	20	12%	0.117	12%	0.115	C	C	.	.			trans	-116.1	146.7	175.8	67.1	0	0	0	0	110.7	V466 L467	T463-V466 PolarHBondContact O-N 3.16Å; T463-V466 WeakPolarHBondContact OG1-CG2 3.5Å; T463-L467 PolarHBondContact O-N 3.22Å; T463-L467 VanDerWaalsContact O-N 3.09Å
464	G	88.6	Confident	92.5	Very high	21 Å²	21	20.9 Å²	20.9	22%	0.216	12%	0.118	C	C	.	.	H	α-helix	trans	-55	-45.6	179.9	0	0	0	0	0	114.4	V466 L467 I468	G464-V466 PolarHBondContact O-N 3.13Å; G464-L467 PolarHBondContact O-N 3.11Å; G464-I468 VanDerWaalsContact O-CG1 3.31Å; G464-I468 WeakPolarHBondContact O-CG1 3.04Å; G464-I468 PolarHBondContact O-N 2.87Å
465	P	90.9	Very high	92.7	Very high	63 Å²	63	28.6 Å²	28.6	41%	0.409	15%	0.146	S	C	.	.	H	α-helix	trans	-60.6	-41.3	178.9	-26.8	36.4	0	0	0	113.8	I468 F469 L702	P465-I468 PolarHBondContact O-N 3.15Å; P465-F469 PolarHBondContact O-N 3.39Å; P465-L702 HydrophobicContact CB-CD1 3.82Å; P465-L702 HydrophobicContact CB-CD2 4.09Å; P465-L702 HydrophobicContact CB-CG 4.43Å
466	V	93.2	Very high	92.8	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.024	17%	0.165	C	C	.	.	H	α-helix	trans	-66.7	-42.2	177.7	176.3	0	0	0	0	110.3	T463 G464 I468 F469 E470 L702 L703 I748 V750	T463-V466 PolarHBondContact O-N 3.16Å; T463-V466 WeakPolarHBondContact OG1-CG2 3.5Å; G464-V466 PolarHBondContact O-N 3.13Å; V466-I468 PolarHBondContact O-N 2.98Å; V466-F469 PolarHBondContact O-N 3.14Å; V466-E470 HydrophobicContact CG1-CG 4.38Å; V466-E470 WeakPolarHBondContact O-CB 3.31Å; V466-E470 WeakPolarHBondContact O-CG 3.37Å; V466-E470 PolarHBondContact O-N 3.06Å; V466-L702 HydrophobicContact CG2-CD2 3.95Å; V466-L702 HydrophobicContact CG2-CG 4.46Å; V466-L703 HydrophobicContact CG2-CD2 3.86Å; V466-I748 HydrophobicContact CG1-CB 4.17Å; V466-V750 HydrophobicContact CG2-CG2 4.19Å
467	L	91.9	Very high	92.9	Very high	11 Å²	11	31.5 Å²	31.5	6%	0.058	16%	0.164	C	C	.	.	H	α-helix	trans	-59.8	-44.5	174.8	167.8	64.5	0	0	0	112.5	F421 V424 M425 T463 G464 F469 E470 S471	F421-L467 HydrophobicContact CD1-CD2 3.68Å; F421-L467 HydrophobicContact CE1-CD2 4.26Å; V424-L467 HydrophobicContact CB-CD2 4.15Å; V424-L467 HydrophobicContact CG1-CD2 3.82Å; M425-L467 HydrophobicContact CB-CD1 3.89Å; M425-L467 HydrophobicContact CE-CB 4.26Å; M425-L467 HydrophobicContact CE-CD1 3.36Å; M425-L467 HydrophobicContact CE-CG 4.38Å; M425-L467 HydrophobicContact CG-CD1 4.19Å; M425-L467 HydrophobicContact SD-CD1 3.26Å; M425-L467 WeakPolarHBondContact SD-CD1 3.47Å; T463-L467 PolarHBondContact O-N 3.22Å; T463-L467 VanDerWaalsContact O-N 3.09Å; G464-L467 PolarHBondContact O-N 3.11Å; L467-F469 VanDerWaalsContact C-N 3.35Å; L467-E470 PolarHBondContact O-N 3.21Å; L467-S471 WeakPolarHBondContact O-CB 3.39Å; L467-S471 PolarHBondContact O-N 3.49Å
468	I	93.4	Very high	92.8	Very high	106 Å²	106	36.7 Å²	36.7	54%	0.544	19%	0.188	S	C	.	.	H	α-helix	trans	-64.1	-43.2	178.6	-68.2	165.4	0	0	0	110.4	G464 P465 V466 E470 S471 I472	G464-I468 VanDerWaalsContact O-CG1 3.31Å; G464-I468 WeakPolarHBondContact O-CG1 3.04Å; G464-I468 PolarHBondContact O-N 2.87Å; P465-I468 PolarHBondContact O-N 3.15Å; V466-I468 PolarHBondContact O-N 2.98Å; I468-E470 VanDerWaalsContact C-N 3.34Å; I468-E470 PolarHBondContact O-N 3.18Å; I468-S471 PolarHBondContact O-N 3.49Å; I468-I472 HydrophobicContact CG2-CD1 3.88Å; I468-I472 WeakPolarHBondContact O-CG1 3.5Å; I468-I472 PolarHBondContact O-N 2.87Å
469	F	95.6	Very high	92.7	Very high	37 Å²	37	41 Å²	41	16%	0.162	22%	0.218	C	C	.	.	H	α-helix	trans	-58	-47.7	175.6	178.5	-85.5	0	0	0	111.4	P465 V466 L467 S471 I472 F473 L491 P695 L698 L699 L702	P465-F469 PolarHBondContact O-N 3.39Å; V466-F469 PolarHBondContact O-N 3.14Å; L467-F469 VanDerWaalsContact C-N 3.35Å; F469-S471 PolarHBondContact O-N 3.36Å; F469-I472 PolarHBondContact O-N 3.23Å; F469-F473 HydrophobicContact CE1-CB 4.46Å; F469-F473 WeakPolarHBondContact O-CB 3.4Å; F469-F473 PolarHBondContact O-N 3.33Å; F469-L491 HydrophobicContact CE1-CD1 4.23Å; F469-L491 HydrophobicContact CE1-CD2 4.04Å; F469-L491 HydrophobicContact CZ-CD1 4.34Å; F469-P695 HydrophobicContact CZ-CB 4.07Å; F469-P695 VanDerWaalsContact CZ-O 3.31Å; F469-P695 WeakPolarHBondContact CZ-O 3.46Å; F469-L698 HydrophobicContact CE2-CB 4.08Å; F469-L699 HydrophobicContact CD1-CB 4.42Å; F469-L699 HydrophobicContact CD1-CD1 3.86Å; F469-L699 HydrophobicContact CD1-CD2 4.48Å; F469-L699 HydrophobicContact CD1-CG 4.48Å; F469-L699 HydrophobicContact CE1-CB 3.85Å; F469-L699 HydrophobicContact CE1-CD1 4.1Å; F469-L699 HydrophobicContact CE1-CD2 4.06Å; F469-L699 HydrophobicContact CE1-CG 4.22Å; F469-L699 HydrophobicContact CE2-CB 4.32Å; F469-L699 HydrophobicContact CG-CD1 4.3Å; F469-L699 HydrophobicContact CZ-CB 3.79Å; F469-L702 HydrophobicContact CB-CD2 4.36Å
470	E	93.4	Very high	92.5	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-40.8	179.3	-69.3	-84.3	-149.9	0	0	112	V466 L467 I468 F473 Y474 R488	V466-E470 HydrophobicContact CG1-CG 4.38Å; V466-E470 WeakPolarHBondContact O-CB 3.31Å; V466-E470 WeakPolarHBondContact O-CG 3.37Å; V466-E470 PolarHBondContact O-N 3.06Å; L467-E470 PolarHBondContact O-N 3.21Å; I468-E470 VanDerWaalsContact C-N 3.34Å; I468-E470 PolarHBondContact O-N 3.18Å; E470-F473 PolarHBondContact O-N 2.96Å; E470-Y474 WeakPolarHBondContact O-CB 3.19Å; E470-Y474 PolarHBondContact O-N 2.9Å; E470-R488 IonicContact OE1-CZ 2.63Å; E470-R488 IonicContact OE1-NH1 3.99Å; E470-R488 PolarHBondContact OE1-NH1 3.4Å; E470-R488 IonicContact OE1-NH2 3.81Å; E470-R488 PolarHBondContact OE1-NH2 2.91Å; E470-R488 IonicContact OE2-CZ 2.79Å; E470-R488 IonicContact OE2-NH1 3.13Å; E470-R488 PolarHBondContact OE2-NH1 3.01Å
471	S	92.8	Very high	92	Very high	16 Å²	16	50.8 Å²	50.8	11%	0.112	28%	0.283	C	S	.	.	H	α-helix	trans	-63.1	-41.8	175.2	177.9	0	0	0	0	112.3	L467 I468 F469 Y474 R475	L467-S471 WeakPolarHBondContact O-CB 3.39Å; L467-S471 PolarHBondContact O-N 3.49Å; I468-S471 PolarHBondContact O-N 3.49Å; F469-S471 PolarHBondContact O-N 3.36Å; S471-Y474 PolarHBondContact O-N 3.12Å; S471-R475 WeakPolarHBondContact O-CG 3.47Å; S471-R475 PolarHBondContact O-N 3.22Å; S471-R475 VanDerWaalsContact O-N 3.15Å
472	I	94.8	Very high	91.8	Very high	101 Å²	101	52.9 Å²	52.9	52%	0.518	29%	0.294	S	S	.	.	H	α-helix	trans	-66.1	-43.8	175.9	-66.3	166.2	0	0	0	110.2	I468 F469 Y474 R475 V476	I468-I472 HydrophobicContact CG2-CD1 3.88Å; I468-I472 WeakPolarHBondContact O-CG1 3.5Å; I468-I472 PolarHBondContact O-N 2.87Å; F469-I472 PolarHBondContact O-N 3.23Å; I472-Y474 VanDerWaalsContact C-N 3.31Å; I472-Y474 PolarHBondContact O-N 2.76Å; I472-R475 PolarHBondContact O-N 3.11Å; I472-V476 WeakPolarHBondContact O-CG2 3.28Å; I472-V476 PolarHBondContact O-N 3.16Å
473	F	94.5	Very high	91.7	Very high	17 Å²	17	55.7 Å²	55.7	8%	0.075	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-39.9	178.3	-176.1	-108.6	0	0	0	111.9	F469 E470 V476 C477 F484 A487 L491 T692 P695	F469-F473 HydrophobicContact CE1-CB 4.46Å; F469-F473 WeakPolarHBondContact O-CB 3.4Å; F469-F473 PolarHBondContact O-N 3.33Å; E470-F473 PolarHBondContact O-N 2.96Å; F473-V476 PolarHBondContact O-N 3.46Å; F473-C477 PolarHBondContact O-N 3.43Å; F473-C477 PolarHBondContact O-SG 3.38Å; F473-F484 HydrophobicContact CD1-CD2 4.11Å; F473-F484 AromaticContact CD1-CE2 3.88Å; F473-F484 HydrophobicContact CD1-CE2 3.88Å; F473-F484 HydrophobicContact CE1-CD2 4.39Å; F473-F484 HydrophobicContact CE1-CE2 4.45Å; F473-A487 HydrophobicContact CE1-CB 4.14Å; F473-A487 HydrophobicContact CZ-CB 3.92Å; F473-L491 HydrophobicContact CD1-CD2 3.93Å; F473-L491 HydrophobicContact CE1-CB 4.43Å; F473-L491 HydrophobicContact CE1-CD2 3.93Å; F473-L491 HydrophobicContact CE2-CD1 4.49Å; F473-L491 HydrophobicContact CG-CD2 4.31Å; F473-L491 HydrophobicContact CZ-CB 4.28Å; F473-L491 HydrophobicContact CZ-CD2 4.29Å; F473-T692 HydrophobicContact CZ-CG2 4.34Å; F473-P695 HydrophobicContact CD2-CB 4.19Å; F473-P695 HydrophobicContact CD2-CG 4.46Å; F473-P695 HydrophobicContact CE2-CB 4.18Å; F473-P695 HydrophobicContact CE2-CG 4.24Å
474	Y	94	Very high	91.7	Very high	18 Å²	18	55.1 Å²	55.1	7%	0.071	30%	0.304	C	S	.	.	H	α-helix	trans	-58.3	-51	173.2	173.9	-107.9	0	0	0	112.2	L429 D430 Q432 E470 S471 I472 V476 C477 E478 F484	L429-Y474 HydrophobicContact CB-CD1 4.44Å; L429-Y474 HydrophobicContact CB-CG 4.4Å; L429-Y474 HydrophobicContact CD2-CD2 4.09Å; L429-Y474 HydrophobicContact CD2-CG 3.86Å; L429-Y474 HydrophobicContact CG-CD1 4.35Å; L429-Y474 HydrophobicContact CG-CG 4.1Å; D430-Y474 WeakPolarHBondContact CB-OH 3.33Å; D430-Y474 VanDerWaalsContact OD2-CE1 3.26Å; D430-Y474 WeakPolarHBondContact OD2-CE1 3.44Å; D430-Y474 PolarHBondContact OD2-OH 3.35Å; Q432-Y474 HydrophobicContact CG-CD2 4.42Å; Q432-Y474 HydrophobicContact CG-CE2 3.7Å; E470-Y474 WeakPolarHBondContact O-CB 3.19Å; E470-Y474 PolarHBondContact O-N 2.9Å; S471-Y474 PolarHBondContact O-N 3.12Å; I472-Y474 VanDerWaalsContact C-N 3.31Å; I472-Y474 PolarHBondContact O-N 2.76Å; Y474-V476 VanDerWaalsContact C-N 3.26Å; Y474-V476 PolarHBondContact O-N 2.89Å; Y474-C477 WeakPolarHBondContact O-CB 3.24Å; Y474-C477 PolarHBondContact O-N 3.44Å; Y474-E478 WeakPolarHBondContact O-CB 3.33Å; Y474-E478 PolarHBondContact O-N 3.17Å; Y474-F484 HydrophobicContact CD2-CB 3.85Å; Y474-F484 HydrophobicContact CD2-CD1 4.01Å; Y474-F484 AromaticContact CD2-CD2 3.73Å; Y474-F484 HydrophobicContact CD2-CD2 3.73Å; Y474-F484 HydrophobicContact CD2-CE2 4.26Å; Y474-F484 AromaticContact CD2-CG 3.58Å; Y474-F484 HydrophobicContact CD2-CG 3.58Å; Y474-F484 HydrophobicContact CE2-CB 4.25Å; Y474-F484 HydrophobicContact CE2-CG 4.34Å; Y474-F484 HydrophobicContact CG-CD2 4.31Å
475	R	94	Very high	91.8	Very high	166 Å²	166	54.9 Å²	54.9	63%	0.626	30%	0.298	S	S	*	.	H	α-helix	trans	-59.6	-35.6	177.5	-69.9	-179.5	178.8	-163.8	-0.2	112.8	S471 I472 S479	S471-R475 WeakPolarHBondContact O-CG 3.47Å; S471-R475 PolarHBondContact O-N 3.22Å; S471-R475 VanDerWaalsContact O-N 3.15Å; I472-R475 PolarHBondContact O-N 3.11Å; R475-S479 WeakPolarHBondContact O-CB 3.29Å; R475-S479 PolarHBondContact O-N 2.87Å; R475-S479 PolarHBondContact O-OG 3.19Å
476	V	92.7	Very high	91.8	Very high	70 Å²	70	51.9 Å²	51.9	42%	0.424	28%	0.278	S	S	.	.	H	α-helix	trans	-67.5	-42.6	174.3	173.5	0	0	0	0	111	I472 F473 Y474 S479 H480	I472-V476 WeakPolarHBondContact O-CG2 3.28Å; I472-V476 PolarHBondContact O-N 3.16Å; F473-V476 PolarHBondContact O-N 3.46Å; Y474-V476 VanDerWaalsContact C-N 3.26Å; Y474-V476 PolarHBondContact O-N 2.89Å; V476-S479 WeakPolarHBondContact CA-OG 3.42Å; V476-S479 PolarHBondContact O-OG 3.04Å; V476-H480 PolarHBondContact O-N 3.25Å; V476-H480 PolarHBondContact O-ND1 3.35Å
477	C	91.3	Very high	91.7	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.02	28%	0.277	C	S	.	.	H	α-helix	trans	-64.2	-45.1	176.8	-66.9	0	0	0	0	111.5	F473 Y474 H480 G481 I482 F484	F473-C477 PolarHBondContact O-N 3.43Å; F473-C477 PolarHBondContact O-SG 3.38Å; Y474-C477 WeakPolarHBondContact O-CB 3.24Å; Y474-C477 PolarHBondContact O-N 3.44Å; C477-H480 CarbonylContact O-C 3.34Å; C477-H480 PolarHBondContact O-N 3.06Å; C477-G481 PolarHBondContact O-N 2.99Å; C477-I482 HydrophobicContact CB-CB 4.24Å; C477-I482 PolarHBondContact O-N 3.49Å; C477-F484 HydrophobicContact CB-CB 4.28Å
478	E	90.6	Very high	91.7	Very high	110 Å²	110	51.2 Å²	51.2	51%	0.514	28%	0.275	S	S	.	.	H	α-helix	trans	-60.8	-48	178.7	-172.8	-176.6	-152.5	0	0	111.7	Y474 H480 G481	Y474-E478 WeakPolarHBondContact O-CB 3.33Å; Y474-E478 PolarHBondContact O-N 3.17Å; E478-H480 PolarHBondContact O-N 3.41Å; E478-G481 PolarHBondContact O-N 3.15Å
479	S	91	Very high	91.7	Very high	90 Å²	90	46.2 Å²	46.2	63%	0.629	25%	0.249	S	C	*	.	H	α-helix	trans	-61.5	-27.8	178.2	56.2	0	0	0	0	114	R475 V476	R475-S479 WeakPolarHBondContact O-CB 3.29Å; R475-S479 PolarHBondContact O-N 2.87Å; R475-S479 PolarHBondContact O-OG 3.19Å; V476-S479 WeakPolarHBondContact CA-OG 3.42Å; V476-S479 PolarHBondContact O-OG 3.04Å
480	H	89.6	Confident	91.6	Very high	136 Å²	136	47.4 Å²	47.4	63%	0.63	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	1.3	176.5	-66.5	78.6	0	0	0	113.3	V476 C477 E478 I482	V476-H480 PolarHBondContact O-N 3.25Å; V476-H480 PolarHBondContact O-ND1 3.35Å; C477-H480 CarbonylContact O-C 3.34Å; C477-H480 PolarHBondContact O-N 3.06Å; E478-H480 PolarHBondContact O-N 3.41Å; H480-I482 HydrophobicContact CB-CD1 3.79Å; H480-I482 HydrophobicContact CB-CG1 3.87Å; H480-I482 PolarHBondContact O-N 3.47Å
481	G	86.2	Confident	91.7	Very high	72 Å²	72	47.3 Å²	47.3	74%	0.742	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	29.2	-176.8	0	0	0	0	0	113.8	C477 E478	C477-G481 PolarHBondContact O-N 2.99Å; E478-G481 PolarHBondContact O-N 3.15Å
482	I	88	Confident	91.8	Very high	44 Å²	44	46.6 Å²	46.6	23%	0.226	25%	0.247	C	C	.	.			trans	-89.1	136.9	177.7	-58.4	171.8	0	0	0	108.5	C477 H480 F484 A487 I688	C477-I482 HydrophobicContact CB-CB 4.24Å; C477-I482 PolarHBondContact O-N 3.49Å; H480-I482 HydrophobicContact CB-CD1 3.79Å; H480-I482 HydrophobicContact CB-CG1 3.87Å; H480-I482 PolarHBondContact O-N 3.47Å; I482-F484 PolarHBondContact O-N 2.87Å; I482-A487 HydrophobicContact CG2-CB 3.82Å; I482-I688 HydrophobicContact CD1-CD1 3.97Å; I482-I688 HydrophobicContact CD1-CG1 4.12Å; I482-I688 HydrophobicContact CG1-CD1 3.93Å; I482-I688 HydrophobicContact CG2-CD1 4.14Å; I482-I688 HydrophobicContact CG2-CG2 4.32Å
483	D	89.1	Confident	91.8	Very high	64 Å²	64	44.3 Å²	44.3	34%	0.342	24%	0.235	S	C	.	.			trans	-62.7	109	171.4	-176.8	-4.5	0	0	0	109.8	L485 A486 A487	D483-L485 VanDerWaalsContact C-N 3.32Å; D483-L485 PolarHBondContact O-N 3.05Å; D483-L485 PolarHBondContact OD1-N 3.12Å; D483-L485 VanDerWaalsContact OD1-N 3.16Å; D483-A486 HydrophobicContact CB-CB 4.17Å; D483-A486 PolarHBondContact O-N 3.26Å; D483-A487 WeakPolarHBondContact O-CB 3.12Å; D483-A487 PolarHBondContact O-N 2.7Å
484	F	90.9	Very high	91.9	Very high	7 Å²	7	47.2 Å²	47.2	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	-56.6	-44	-178	166.3	-106.5	0	0	0	112	L429 Q432 M433 F473 Y474 C477 I482 A486 A487 R488	L429-F484 HydrophobicContact CD2-CD1 4.28Å; L429-F484 HydrophobicContact CD2-CE1 3.42Å; L429-F484 VanDerWaalsContact CD2-CE1 3.42Å; L429-F484 HydrophobicContact CD2-CE2 3.77Å; L429-F484 HydrophobicContact CD2-CZ 3.11Å; Q432-F484 HydrophobicContact CB-CD1 4.16Å; Q432-F484 HydrophobicContact CB-CE1 4.33Å; Q432-F484 HydrophobicContact CG-CD1 4.36Å; M433-F484 HydrophobicContact SD-CE1 4.08Å; F473-F484 HydrophobicContact CD1-CD2 4.11Å; F473-F484 AromaticContact CD1-CE2 3.88Å; F473-F484 HydrophobicContact CD1-CE2 3.88Å; F473-F484 HydrophobicContact CE1-CD2 4.39Å; F473-F484 HydrophobicContact CE1-CE2 4.45Å; Y474-F484 HydrophobicContact CD2-CB 3.85Å; Y474-F484 HydrophobicContact CD2-CD1 4.01Å; Y474-F484 AromaticContact CD2-CD2 3.73Å; Y474-F484 HydrophobicContact CD2-CD2 3.73Å; Y474-F484 HydrophobicContact CD2-CE2 4.26Å; Y474-F484 AromaticContact CD2-CG 3.58Å; Y474-F484 HydrophobicContact CD2-CG 3.58Å; Y474-F484 HydrophobicContact CE2-CB 4.25Å; Y474-F484 HydrophobicContact CE2-CG 4.34Å; Y474-F484 HydrophobicContact CG-CD2 4.31Å; C477-F484 HydrophobicContact CB-CB 4.28Å; I482-F484 PolarHBondContact O-N 2.87Å; F484-A486 PolarHBondContact O-N 3.2Å; F484-A487 PolarHBondContact O-N 3.44Å; F484-R488 WeakPolarHBondContact O-CB 3.48Å; F484-R488 PolarHBondContact O-N 3.15Å
485	L	90.1	Very high	92	Very high	16 Å²	16	46.3 Å²	46.3	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-67.2	-40.4	-175.3	-68.5	174	0	0	0	111.1	D483 G489 V678	D483-L485 VanDerWaalsContact C-N 3.32Å; D483-L485 PolarHBondContact O-N 3.05Å; D483-L485 PolarHBondContact OD1-N 3.12Å; D483-L485 VanDerWaalsContact OD1-N 3.16Å; L485-G489 PolarHBondContact O-N 3.47Å; L485-G489 VanDerWaalsContact O-N 3.11Å; L485-V678 HydrophobicContact CB-CG1 3.78Å
486	A	90.1	Very high	92.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-69.6	-43.3	176.5	0	0	0	0	0	111.9	D483 F484 R488 G489 W490 I683	D483-A486 HydrophobicContact CB-CB 4.17Å; D483-A486 PolarHBondContact O-N 3.26Å; F484-A486 PolarHBondContact O-N 3.2Å; A486-R488 VanDerWaalsContact C-N 3.33Å; A486-R488 PolarHBondContact O-N 3.3Å; A486-G489 PolarHBondContact O-N 3.3Å; A486-W490 PolarHBondContact O-N 3.44Å; A486-I683 HydrophobicContact CB-CD1 3.98Å; A486-I683 HydrophobicContact CB-CG1 3.58Å
487	A	92.1	Very high	92.3	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-63.9	-38	176.5	0	0	0	0	0	112.3	F473 I482 D483 F484 G489 W490 L491	F473-A487 HydrophobicContact CE1-CB 4.14Å; F473-A487 HydrophobicContact CZ-CB 3.92Å; I482-A487 HydrophobicContact CG2-CB 3.82Å; D483-A487 WeakPolarHBondContact O-CB 3.12Å; D483-A487 PolarHBondContact O-N 2.7Å; F484-A487 PolarHBondContact O-N 3.44Å; A487-G489 VanDerWaalsContact C-N 3.33Å; A487-G489 PolarHBondContact O-N 3.32Å; A487-W490 PolarHBondContact O-N 2.79Å; A487-L491 WeakPolarHBondContact O-CB 3.39Å; A487-L491 PolarHBondContact O-N 3.5Å
488	R	92.3	Very high	92.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-41.3	171.8	179.7	-163.7	-177.9	71.2	21.2	111.7	E470 F484 A486 W490 L491 C492 L746	E470-R488 IonicContact OE1-CZ 2.63Å; E470-R488 IonicContact OE1-NH1 3.99Å; E470-R488 PolarHBondContact OE1-NH1 3.4Å; E470-R488 IonicContact OE1-NH2 3.81Å; E470-R488 PolarHBondContact OE1-NH2 2.91Å; E470-R488 IonicContact OE2-CZ 2.79Å; E470-R488 IonicContact OE2-NH1 3.13Å; E470-R488 PolarHBondContact OE2-NH1 3.01Å; F484-R488 WeakPolarHBondContact O-CB 3.48Å; F484-R488 PolarHBondContact O-N 3.15Å; A486-R488 VanDerWaalsContact C-N 3.33Å; A486-R488 PolarHBondContact O-N 3.3Å; R488-W490 VanDerWaalsContact C-N 3.34Å; R488-W490 PolarHBondContact O-N 2.74Å; R488-L491 WeakPolarHBondContact O-CB 3.27Å; R488-L491 PolarHBondContact O-N 2.78Å; R488-C492 PolarHBondContact O-N 2.88Å; R488-C492 PolarHBondContact O-SG 3.21Å; R488-L746 PolarHBondContact NE-O 2.7Å; R488-L746 PolarHBondContact NH2-O 3.47Å
489	G	92.6	Very high	92.8	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-55.8	-48.5	175.1	0	0	0	0	0	111.8	L485 A486 A487 C492 M493	L485-G489 PolarHBondContact O-N 3.47Å; L485-G489 VanDerWaalsContact O-N 3.11Å; A486-G489 PolarHBondContact O-N 3.3Å; A487-G489 VanDerWaalsContact C-N 3.33Å; A487-G489 PolarHBondContact O-N 3.32Å; G489-C492 PolarHBondContact O-N 2.85Å; G489-M493 WeakPolarHBondContact O-CG 3.42Å; G489-M493 PolarHBondContact O-N 3.33Å
490	W	93.2	Very high	93	Very high	63 Å²	63	32.3 Å²	32.3	24%	0.239	18%	0.175	C	C	.	.	H	α-helix	trans	-67.9	-38.9	176.5	-76.8	96.4	0	0	0	113.6	A486 A487 R488 C492 M493 W494 W680 L681 Y689	A486-W490 PolarHBondContact O-N 3.44Å; A487-W490 PolarHBondContact O-N 2.79Å; R488-W490 VanDerWaalsContact C-N 3.34Å; R488-W490 PolarHBondContact O-N 2.74Å; W490-C492 VanDerWaalsContact C-N 3.3Å; W490-C492 PolarHBondContact O-N 3.14Å; W490-M493 PolarHBondContact O-N 2.82Å; W490-W494 VanDerWaalsContact O-CD1 3.3Å; W490-W494 PolarHBondContact O-N 3.19Å; W490-W680 PolarHBondContact NE1-O 2.75Å; W490-L681 HydrophobicContact CZ2-CD2 4.45Å; W490-Y689 AromaticContact CD1-CD1 3.55Å; W490-Y689 AromaticContact CD1-CE1 3.79Å; W490-Y689 AromaticContact CD2-CD1 3.69Å; W490-Y689 HydrophobicContact CD2-CD1 3.69Å; W490-Y689 HydrophobicContact CD2-CE1 4.39Å; W490-Y689 HydrophobicContact CD2-CG 4.25Å; W490-Y689 AromaticContact CE2-CD1 3.26Å; W490-Y689 AromaticContact CE2-CE1 3.56Å; W490-Y689 AromaticContact CE2-CG 3.94Å; W490-Y689 AromaticContact CG-CD1 3.84Å; W490-Y689 HydrophobicContact CG-CD1 3.84Å; W490-Y689 HydrophobicContact CG-CE1 4.49Å; W490-Y689 AromaticContact CZ2-CD1 3.77Å; W490-Y689 HydrophobicContact CZ2-CD1 3.77Å; W490-Y689 AromaticContact CZ2-CE1 3.95Å; W490-Y689 HydrophobicContact CZ2-CE1 3.95Å; W490-Y689 HydrophobicContact CZ2-CG 4.07Å; W490-Y689 AromaticContact NE1-CD1 3.19Å; W490-Y689 AromaticContact NE1-CE1 3.15Å
491	L	94.9	Very high	93.2	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-54.5	-47.5	172.4	175.1	76.9	0	0	0	110.8	F469 F473 A487 R488 T495 P695 A696 L699	F469-L491 HydrophobicContact CE1-CD1 4.23Å; F469-L491 HydrophobicContact CE1-CD2 4.04Å; F469-L491 HydrophobicContact CZ-CD1 4.34Å; F473-L491 HydrophobicContact CD1-CD2 3.93Å; F473-L491 HydrophobicContact CE1-CB 4.43Å; F473-L491 HydrophobicContact CE1-CD2 3.93Å; F473-L491 HydrophobicContact CE2-CD1 4.49Å; F473-L491 HydrophobicContact CG-CD2 4.31Å; F473-L491 HydrophobicContact CZ-CB 4.28Å; F473-L491 HydrophobicContact CZ-CD2 4.29Å; A487-L491 WeakPolarHBondContact O-CB 3.39Å; A487-L491 PolarHBondContact O-N 3.5Å; R488-L491 WeakPolarHBondContact O-CB 3.27Å; R488-L491 PolarHBondContact O-N 2.78Å; L491-T495 VanDerWaalsContact O-CB 3.29Å; L491-T495 WeakPolarHBondContact O-CB 3.24Å; L491-T495 PolarHBondContact O-N 3.15Å; L491-T495 PolarHBondContact O-OG1 3.43Å; L491-P695 HydrophobicContact CD1-CB 3.79Å; L491-A696 HydrophobicContact CD1-CB 4.02Å; L491-L699 HydrophobicContact CD1-CD2 4.28Å; L491-L699 HydrophobicContact CD2-CD2 4Å; L491-L699 HydrophobicContact CG-CD2 3.95Å
492	C	95.6	Very high	93.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.3	-42.9	178.1	-66.7	0	0	0	0	112.1	R488 G489 W490 T495 A496 T738	R488-C492 PolarHBondContact O-N 2.88Å; R488-C492 PolarHBondContact O-SG 3.21Å; G489-C492 PolarHBondContact O-N 2.85Å; W490-C492 VanDerWaalsContact C-N 3.3Å; W490-C492 PolarHBondContact O-N 3.14Å; C492-T495 PolarHBondContact O-N 3.23Å; C492-A496 WeakPolarHBondContact O-CB 3.28Å; C492-A496 PolarHBondContact O-N 3.35Å; C492-T738 HydrophobicContact CB-CG2 3.96Å; C492-T738 WeakPolarHBondContact CB-O 3.49Å
493	M	94.2	Very high	93.7	Very high	54 Å²	54	26.7 Å²	26.7	27%	0.266	13%	0.132	S	C	.	.	H	α-helix	trans	-62.4	-47.2	178.3	-69.2	-57.4	-114.5	0	0	112.2	G489 W490 T495 A496 V497 W680 I739	G489-M493 WeakPolarHBondContact O-CG 3.42Å; G489-M493 PolarHBondContact O-N 3.33Å; W490-M493 PolarHBondContact O-N 2.82Å; M493-T495 PolarHBondContact O-N 3.32Å; M493-A496 PolarHBondContact O-N 2.79Å; M493-V497 VanDerWaalsContact O-CG2 3.31Å; M493-V497 WeakPolarHBondContact O-CG2 3.08Å; M493-V497 PolarHBondContact O-N 3.36Å; M493-W680 HydrophobicContact CE-CE3 4.22Å; M493-W680 HydrophobicContact CE-CH2 3.35Å; M493-W680 HydrophobicContact CE-CZ2 4.5Å; M493-W680 HydrophobicContact CE-CZ3 3.18Å; M493-W680 HydrophobicContact CG-CE3 4.15Å; M493-W680 HydrophobicContact CG-CZ3 3.85Å; M493-W680 HydrophobicContact SD-CE3 4.49Å; M493-W680 HydrophobicContact SD-CH2 4.33Å; M493-W680 HydrophobicContact SD-CZ3 3.63Å; M493-I739 HydrophobicContact CE-CG2 4.47Å; M493-I739 HydrophobicContact SD-CB 4.42Å; M493-I739 HydrophobicContact SD-CG1 4.13Å; M493-I739 HydrophobicContact SD-CG2 3.88Å
494	W	96.7	Very high	93.9	Very high	77 Å²	77	24.1 Å²	24.1	29%	0.292	12%	0.119	S	C	.	.	H	α-helix	trans	-63	-43.2	176.4	-79.5	121.5	0	0	0	112.1	W490 A496 V497 I498 Y689 F693 A696	W490-W494 VanDerWaalsContact O-CD1 3.3Å; W490-W494 PolarHBondContact O-N 3.19Å; W494-A496 VanDerWaalsContact C-N 3.33Å; W494-A496 PolarHBondContact O-N 3.2Å; W494-V497 PolarHBondContact O-N 3.21Å; W494-I498 VanDerWaalsContact O-CG1 3.22Å; W494-I498 WeakPolarHBondContact O-CG1 3.38Å; W494-I498 PolarHBondContact O-N 3.2Å; W494-Y689 PolarHBondContact NE1-O 2.8Å; W494-F693 HydrophobicContact CD2-CB 4.46Å; W494-F693 AromaticContact CD2-CD2 3.88Å; W494-F693 HydrophobicContact CD2-CD2 3.88Å; W494-F693 AromaticContact CE3-CD2 3.65Å; W494-F693 HydrophobicContact CE3-CD2 3.65Å; W494-F693 HydrophobicContact CE3-CE2 4.19Å; W494-F693 HydrophobicContact CG-CD2 4.36Å; W494-F693 HydrophobicContact CZ3-CD2 4.04Å; W494-F693 HydrophobicContact CZ3-CE2 4.41Å; W494-A696 HydrophobicContact CB-CB 3.38Å; W494-A696 HydrophobicContact CG-CB 4.44Å
495	T	96.6	Very high	93.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59	-46.1	177.6	-58.3	0	0	0	0	110.8	L491 C492 M493 V497 I498 I499 A696 L699 T700 L703 T738	L491-T495 VanDerWaalsContact O-CB 3.29Å; L491-T495 WeakPolarHBondContact O-CB 3.24Å; L491-T495 PolarHBondContact O-N 3.15Å; L491-T495 PolarHBondContact O-OG1 3.43Å; C492-T495 PolarHBondContact O-N 3.23Å; M493-T495 PolarHBondContact O-N 3.32Å; T495-V497 PolarHBondContact O-N 2.75Å; T495-I498 PolarHBondContact O-N 2.87Å; T495-I499 HydrophobicContact CG2-CD1 4.03Å; T495-I499 VanDerWaalsContact O-CG1 3.31Å; T495-I499 WeakPolarHBondContact O-CG1 3.42Å; T495-I499 PolarHBondContact O-N 3.18Å; T495-A696 PolarHBondContact OG1-O 3.36Å; T495-L699 HydrophobicContact CG2-CD2 4.21Å; T495-L699 HydrophobicContact CG2-CG 4.09Å; T495-T700 WeakPolarHBondContact CA-OG1 3.38Å; T495-L703 HydrophobicContact CG2-CD1 3.5Å; T495-L703 VanDerWaalsContact CG2-CD1 3.5Å; T495-T738 HydrophobicContact CG2-CG2 4.23Å
496	A	96.6	Very high	93.7	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.008	14%	0.14	C	C	.	.	H	α-helix	trans	-62.3	-44.4	177.6	0	0	0	0	0	112.8	C492 M493 W494 I498 I499 I500 S735 I739	C492-A496 WeakPolarHBondContact O-CB 3.28Å; C492-A496 PolarHBondContact O-N 3.35Å; M493-A496 PolarHBondContact O-N 2.79Å; W494-A496 VanDerWaalsContact C-N 3.33Å; W494-A496 PolarHBondContact O-N 3.2Å; A496-I498 PolarHBondContact O-N 2.86Å; A496-I499 PolarHBondContact O-N 2.98Å; A496-I500 WeakPolarHBondContact O-CG1 3.4Å; A496-I500 PolarHBondContact O-N 3.49Å; A496-S735 VanDerWaalsContact CA-OG 3.23Å; A496-S735 WeakPolarHBondContact CA-OG 3.32Å; A496-S735 WeakPolarHBondContact CB-OG 3.48Å; A496-S735 PolarHBondContact O-OG 3.31Å; A496-I739 HydrophobicContact CB-CD1 3.87Å; A496-I739 HydrophobicContact CB-CG1 3.37Å
497	V	96.4	Very high	93.4	Very high	69 Å²	69	30.5 Å²	30.5	42%	0.418	15%	0.15	S	C	.	.	H	α-helix	trans	-60.4	-45.7	176.4	170.1	0	0	0	0	110.9	M493 W494 T495 I499 I500 L501	M493-V497 VanDerWaalsContact O-CG2 3.31Å; M493-V497 WeakPolarHBondContact O-CG2 3.08Å; M493-V497 PolarHBondContact O-N 3.36Å; W494-V497 PolarHBondContact O-N 3.21Å; T495-V497 PolarHBondContact O-N 2.75Å; V497-I499 PolarHBondContact O-N 3.11Å; V497-I500 PolarHBondContact O-N 3.11Å; V497-L501 HydrophobicContact CG1-CD1 4.29Å; V497-L501 WeakPolarHBondContact O-CG 3.37Å; V497-L501 PolarHBondContact O-N 3.35Å
498	I	96.3	Very high	92.9	Very high	19 Å²	19	30.6 Å²	30.6	10%	0.097	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-43.4	178.8	-61.3	163.2	0	0	0	110.2	W494 T495 A496 I500 L501 L502 F693 L697 T700	W494-I498 VanDerWaalsContact O-CG1 3.22Å; W494-I498 WeakPolarHBondContact O-CG1 3.38Å; W494-I498 PolarHBondContact O-N 3.2Å; T495-I498 PolarHBondContact O-N 2.87Å; A496-I498 PolarHBondContact O-N 2.86Å; I498-I500 PolarHBondContact O-N 2.95Å; I498-L501 WeakPolarHBondContact O-CB 3.44Å; I498-L501 PolarHBondContact O-N 2.84Å; I498-L502 HydrophobicContact CG2-CD1 4.44Å; I498-L502 WeakPolarHBondContact O-CG 3.39Å; I498-L502 PolarHBondContact O-N 3.21Å; I498-F693 HydrophobicContact CD1-CD2 4.38Å; I498-F693 HydrophobicContact CD1-CE2 3.94Å; I498-F693 HydrophobicContact CD1-CZ 4.48Å; I498-F693 HydrophobicContact CG1-CE2 4.25Å; I498-L697 HydrophobicContact CD1-CB 4.38Å; I498-L697 HydrophobicContact CD1-CD1 4.33Å; I498-L697 HydrophobicContact CG2-CD1 4.47Å; I498-T700 HydrophobicContact CB-CG2 4.05Å; I498-T700 HydrophobicContact CG2-CG2 3.58Å
499	I	95.8	Very high	92.3	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-42.6	176.2	-65.4	169.1	0	0	0	111.4	T495 A496 V497 L501 L502 V503 T700 L703 V704 L731	T495-I499 HydrophobicContact CG2-CD1 4.03Å; T495-I499 VanDerWaalsContact O-CG1 3.31Å; T495-I499 WeakPolarHBondContact O-CG1 3.42Å; T495-I499 PolarHBondContact O-N 3.18Å; A496-I499 PolarHBondContact O-N 2.98Å; V497-I499 PolarHBondContact O-N 3.11Å; I499-L501 VanDerWaalsContact C-N 3.28Å; I499-L501 PolarHBondContact O-N 3.45Å; I499-L502 WeakPolarHBondContact O-CB 3.05Å; I499-L502 PolarHBondContact O-N 3.39Å; I499-L502 VanDerWaalsContact O-N 3.14Å; I499-V503 HydrophobicContact CG2-CG2 4.45Å; I499-V503 WeakPolarHBondContact O-CG2 3.11Å; I499-V503 PolarHBondContact O-N 2.93Å; I499-T700 HydrophobicContact CG1-CG2 3.62Å; I499-L703 HydrophobicContact CD1-CB 4.42Å; I499-L703 HydrophobicContact CD1-CD1 4.13Å; I499-V704 HydrophobicContact CG1-CG2 4.06Å; I499-L731 HydrophobicContact CG2-CB 4.15Å; I499-L731 WeakPolarHBondContact CG2-O 3.29Å
500	I	95.2	Very high	91.7	Very high	55 Å²	55	37.8 Å²	37.8	28%	0.282	19%	0.185	S	C	.	.	H	α-helix	trans	-60.9	-40.3	176.3	-71.8	161.1	0	0	0	110.5	A496 V497 I498 V503 A504 L732 S735	A496-I500 WeakPolarHBondContact O-CG1 3.4Å; A496-I500 PolarHBondContact O-N 3.49Å; V497-I500 PolarHBondContact O-N 3.11Å; I498-I500 PolarHBondContact O-N 2.95Å; I500-V503 PolarHBondContact O-N 2.65Å; I500-A504 WeakPolarHBondContact O-CB 3.47Å; I500-A504 PolarHBondContact O-N 3.2Å; I500-L732 HydrophobicContact CG1-CD1 4.3Å; I500-S735 WeakPolarHBondContact CG1-OG 3.21Å
501	L	94.5	Very high	90.9	Very high	86 Å²	86	35.4 Å²	35.4	45%	0.45	18%	0.178	S	C	.	.	H	α-helix	trans	-63.2	-43.3	174.2	-69.3	173.4	0	0	0	111.6	V497 I498 I499 V503 A504 F505	V497-L501 HydrophobicContact CG1-CD1 4.29Å; V497-L501 WeakPolarHBondContact O-CG 3.37Å; V497-L501 PolarHBondContact O-N 3.35Å; I498-L501 WeakPolarHBondContact O-CB 3.44Å; I498-L501 PolarHBondContact O-N 2.84Å; I499-L501 VanDerWaalsContact C-N 3.28Å; I499-L501 PolarHBondContact O-N 3.45Å; L501-V503 VanDerWaalsContact C-N 3.31Å; L501-V503 PolarHBondContact O-N 3.04Å; L501-A504 PolarHBondContact O-N 2.61Å; L501-F505 HydrophobicContact CB-CD2 4.4Å; L501-F505 HydrophobicContact CB-CE2 4.36Å; L501-F505 HydrophobicContact CD2-CE2 4.37Å; L501-F505 WeakPolarHBondContact O-CD2 3.2Å; L501-F505 PolarHBondContact O-N 3.42Å
502	L	93	Very high	89.9	Confident	48 Å²	48	37.3 Å²	37.3	25%	0.251	19%	0.194	S	C	.	.	H	α-helix	trans	-61.4	-39.9	176.7	-67.9	174.2	0	0	0	112.2	I498 I499 D506 T507 T700 V704	I498-L502 HydrophobicContact CG2-CD1 4.44Å; I498-L502 WeakPolarHBondContact O-CG 3.39Å; I498-L502 PolarHBondContact O-N 3.21Å; I499-L502 WeakPolarHBondContact O-CB 3.05Å; I499-L502 PolarHBondContact O-N 3.39Å; I499-L502 VanDerWaalsContact O-N 3.14Å; L502-D506 PolarHBondContact O-N 2.68Å; L502-T507 HydrophobicContact CD2-CG2 4Å; L502-T507 VanDerWaalsContact O-CB 3.31Å; L502-T507 WeakPolarHBondContact O-CB 3.47Å; L502-T507 PolarHBondContact O-N 3.36Å; L502-T507 PolarHBondContact O-OG1 3.35Å; L502-T700 HydrophobicContact CD1-CG2 3.85Å; L502-V704 HydrophobicContact CD1-CG2 3.88Å
503	V	92.5	Very high	89.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.9	-41.9	174	172.6	0	0	0	0	111.1	F372 L375 I499 I500 L501 F505 D506 H728 L731	F372-V503 HydrophobicContact CD1-CG1 4.4Å; L375-V503 HydrophobicContact CB-CG1 4.3Å; L375-V503 HydrophobicContact CD2-CG1 4.42Å; I499-V503 HydrophobicContact CG2-CG2 4.45Å; I499-V503 WeakPolarHBondContact O-CG2 3.11Å; I499-V503 PolarHBondContact O-N 2.93Å; I500-V503 PolarHBondContact O-N 2.65Å; L501-V503 VanDerWaalsContact C-N 3.31Å; L501-V503 PolarHBondContact O-N 3.04Å; V503-F505 VanDerWaalsContact C-N 3.33Å; V503-F505 PolarHBondContact O-N 3.39Å; V503-D506 PolarHBondContact O-N 3.18Å; V503-D506 VanDerWaalsContact O-N 3.16Å; V503-H728 HydrophobicContact CG1-CB 4.3Å; V503-L731 HydrophobicContact CG2-CB 3.55Å; V503-L731 HydrophobicContact CG2-CD1 4.19Å
504	A	91.4	Very high	88.3	Confident	9 Å²	9	44.1 Å²	44.1	7%	0.074	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-38.8	178.3	0	0	0	0	0	112.2	L371 F372 I500 L501 D506	L371-A504 WeakPolarHBondContact CA-O 3.45Å; F372-A504 HydrophobicContact CD1-CB 4.29Å; F372-A504 HydrophobicContact CD2-CB 4.32Å; F372-A504 HydrophobicContact CE1-CB 3.81Å; F372-A504 HydrophobicContact CE2-CB 3.83Å; F372-A504 HydrophobicContact CZ-CB 3.56Å; F372-A504 PolarHBondContact N-O 2.79Å; I500-A504 WeakPolarHBondContact O-CB 3.47Å; I500-A504 PolarHBondContact O-N 3.2Å; L501-A504 PolarHBondContact O-N 2.61Å; A504-D506 PolarHBondContact O-N 2.84Å
505	F	90.9	Very high	87.5	Confident	120 Å²	120	44 Å²	44	53%	0.526	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	7.4	176.1	-69.9	-60.1	0	0	0	114.2	L371 L501 V503 T507	L371-F505 HydrophobicContact CD2-CD1 4.24Å; L371-F505 HydrophobicContact CD2-CE1 4.28Å; L501-F505 HydrophobicContact CB-CD2 4.4Å; L501-F505 HydrophobicContact CB-CE2 4.36Å; L501-F505 HydrophobicContact CD2-CE2 4.37Å; L501-F505 WeakPolarHBondContact O-CD2 3.2Å; L501-F505 PolarHBondContact O-N 3.42Å; V503-F505 VanDerWaalsContact C-N 3.33Å; V503-F505 PolarHBondContact O-N 3.39Å; F505-T507 PolarHBondContact O-N 2.94Å
506	D	87.2	Confident	86.5	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.016	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	35.1	176.6	-164.9	27.1	0	0	0	112.6	Y367 T368 G374 L502 V503 A504 S508 F509 H728	Y367-D506 HydrophobicContact CD2-CB 4.18Å; Y367-D506 HydrophobicContact CE2-CB 4.07Å; T368-D506 WeakPolarHBondContact CB-OD2 3.25Å; T368-D506 PolarHBondContact N-OD2 2.99Å; T368-D506 PolarHBondContact OG1-OD2 2.65Å; G374-D506 WeakPolarHBondContact CA-OD1 3.44Å; L502-D506 PolarHBondContact O-N 2.68Å; V503-D506 PolarHBondContact O-N 3.18Å; V503-D506 VanDerWaalsContact O-N 3.16Å; A504-D506 PolarHBondContact O-N 2.84Å; D506-S508 PolarHBondContact O-N 2.84Å; D506-S508 VanDerWaalsContact O-N 3.1Å; D506-F509 VanDerWaalsContact O-CD1 3.31Å; D506-F509 WeakPolarHBondContact O-CD1 3.42Å; D506-F509 PolarHBondContact O-N 2.88Å; D506-H728 IonicContact OD1-CD2 3.53Å; D506-H728 IonicContact OD1-CE1 2.88Å; D506-H728 PolarHBondContact OD1-CE1 3.42Å; D506-H728 IonicContact OD1-NE2 3.64Å; D506-H728 PolarHBondContact OD1-NE2 3.1Å
507	T	84.4	Confident	85.7	Confident	34 Å²	34	55 Å²	55	21%	0.209	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-67.5	-13.1	-171.7	-48.8	0	0	0	0	113.1	L502 F505 F509 L510	L502-T507 HydrophobicContact CD2-CG2 4Å; L502-T507 VanDerWaalsContact O-CB 3.31Å; L502-T507 WeakPolarHBondContact O-CB 3.47Å; L502-T507 PolarHBondContact O-N 3.36Å; L502-T507 PolarHBondContact O-OG1 3.35Å; F505-T507 PolarHBondContact O-N 2.94Å; T507-F509 PolarHBondContact O-N 3.33Å; T507-L510 HydrophobicContact CG2-CD1 3.49Å; T507-L510 VanDerWaalsContact CG2-CD1 3.49Å; T507-L510 HydrophobicContact CG2-CG 4.02Å; T507-L510 WeakPolarHBondContact O-CB 3.4Å; T507-L510 WeakPolarHBondContact O-CG 3.48Å; T507-L510 PolarHBondContact O-N 3.09Å
508	S	79.8	Confident	84.8	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.021	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-66.6	-10.5	179.3	-36.5	0	0	0	0	112.8	L365 D506 L510 V511 Q708 H728	L365-S508 WeakPolarHBondContact CD2-O 3.46Å; D506-S508 PolarHBondContact O-N 2.84Å; D506-S508 VanDerWaalsContact O-N 3.1Å; S508-L510 PolarHBondContact O-N 3.18Å; S508-L510 VanDerWaalsContact O-N 3.14Å; S508-V511 WeakPolarHBondContact O-CB 3.26Å; S508-V511 WeakPolarHBondContact O-CG2 3.44Å; S508-V511 PolarHBondContact O-N 3.34Å; S508-Q708 PolarHBondContact OG-NE2 2.95Å; S508-H728 VanDerWaalsContact CB-CE1 3.46Å; S508-H728 WeakPolarHBondContact CB-CE1 3.18Å; S508-H728 WeakPolarHBondContact CB-NE2 3.15Å; S508-H728 PolarHBondContact OG-CD2 2.98Å; S508-H728 PolarHBondContact OG-CE1 3.27Å; S508-H728 PolarHBondContact OG-NE2 2.91Å
509	F	79.7	Confident	84	Confident	67 Å²	67	55.1 Å²	55.1	29%	0.294	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-55.2	-28.4	166.8	88.5	-89.9	0	0	0	112.2	L365 Y367 D506 T507 V511 A512 F513	L365-F509 WeakPolarHBondContact O-CA 3.31Å; L365-F509 WeakPolarHBondContact O-CB 3.4Å; Y367-F509 AromaticContact CD2-CD1 3.84Å; Y367-F509 HydrophobicContact CD2-CD1 3.84Å; Y367-F509 HydrophobicContact CD2-CE1 4.29Å; Y367-F509 HydrophobicContact CD2-CG 4.3Å; Y367-F509 HydrophobicContact CE2-CD1 4.5Å; D506-F509 VanDerWaalsContact O-CD1 3.31Å; D506-F509 WeakPolarHBondContact O-CD1 3.42Å; D506-F509 PolarHBondContact O-N 2.88Å; T507-F509 PolarHBondContact O-N 3.33Å; F509-V511 PolarHBondContact O-N 3.09Å; F509-A512 WeakPolarHBondContact O-CB 3.36Å; F509-A512 PolarHBondContact O-N 3.26Å; F509-F513 HydrophobicContact CD2-CE2 4.26Å; F509-F513 AromaticContact CE2-CE2 3.87Å; F509-F513 HydrophobicContact CE2-CE2 3.87Å
510	L	79.8	Confident	83.2	Confident	85 Å²	85	56 Å²	56	45%	0.445	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-62.3	-24.3	177.8	-68.3	-178.3	0	0	0	113.1	T507 S508 A512 F513	T507-L510 HydrophobicContact CG2-CD1 3.49Å; T507-L510 VanDerWaalsContact CG2-CD1 3.49Å; T507-L510 HydrophobicContact CG2-CG 4.02Å; T507-L510 WeakPolarHBondContact O-CB 3.4Å; T507-L510 WeakPolarHBondContact O-CG 3.48Å; T507-L510 PolarHBondContact O-N 3.09Å; S508-L510 PolarHBondContact O-N 3.18Å; S508-L510 VanDerWaalsContact O-N 3.14Å; L510-A512 PolarHBondContact O-N 3.02Å; L510-F513 HydrophobicContact CB-CD2 4.48Å; L510-F513 HydrophobicContact CD2-CD2 3.87Å; L510-F513 HydrophobicContact CD2-CE2 3.79Å; L510-F513 WeakPolarHBondContact O-CB 3.16Å; L510-F513 PolarHBondContact O-N 3.37Å
511	V	77.2	Confident	82.6	Confident	12 Å²	12	57.4 Å²	57.4	7%	0.073	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-61	-28.3	176.7	-178.6	0	0	0	0	110.7	L365 S508 F509 F513 I514 Q708 V712	L365-V511 HydrophobicContact CD2-CB 3.98Å; L365-V511 HydrophobicContact CD2-CG1 4.36Å; S508-V511 WeakPolarHBondContact O-CB 3.26Å; S508-V511 WeakPolarHBondContact O-CG2 3.44Å; S508-V511 PolarHBondContact O-N 3.34Å; F509-V511 PolarHBondContact O-N 3.09Å; V511-F513 PolarHBondContact O-N 3.39Å; V511-I514 HydrophobicContact CG1-CD1 4.2Å; V511-I514 WeakPolarHBondContact O-CB 3.47Å; V511-I514 WeakPolarHBondContact O-CG1 3.21Å; V511-I514 PolarHBondContact O-N 3.32Å; V511-Q708 HydrophobicContact CG2-CB 3.91Å; V511-Q708 HydrophobicContact CG2-CG 3.87Å; V511-V712 HydrophobicContact CG1-CG2 3.04Å
512	A	74.8	Confident	82.1	Confident	41 Å²	41	55.6 Å²	55.6	34%	0.339	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-62.8	-19.9	173.4	0	0	0	0	0	114	L362 L365 F509 L510 I514	L362-A512 HydrophobicContact CD1-CB 3.77Å; L362-A512 HydrophobicContact CD2-CB 4.3Å; L362-A512 HydrophobicContact CG-CB 4.38Å; L365-A512 HydrophobicContact CB-CB 4.5Å; F509-A512 WeakPolarHBondContact O-CB 3.36Å; F509-A512 PolarHBondContact O-N 3.26Å; L510-A512 PolarHBondContact O-N 3.02Å; A512-I514 VanDerWaalsContact C-N 3.3Å
513	F	79.2	Confident	81.6	Confident	150 Å²	150	53.5 Å²	53.5	66%	0.658	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-79.9	-13.1	175	-67.5	-68.4	0	0	0	113.1	F509 L510 V511 T515	F509-F513 HydrophobicContact CD2-CE2 4.26Å; F509-F513 AromaticContact CE2-CE2 3.87Å; F509-F513 HydrophobicContact CE2-CE2 3.87Å; L510-F513 HydrophobicContact CB-CD2 4.48Å; L510-F513 HydrophobicContact CD2-CD2 3.87Å; L510-F513 HydrophobicContact CD2-CE2 3.79Å; L510-F513 WeakPolarHBondContact O-CB 3.16Å; L510-F513 PolarHBondContact O-N 3.37Å; V511-F513 PolarHBondContact O-N 3.39Å; F513-T515 PolarHBondContact O-N 3.23Å; F513-T515 VanDerWaalsContact O-N 3.12Å
514	I	76.4	Confident	81.1	Confident	47 Å²	47	54.4 Å²	54.4	24%	0.241	27%	0.272	C	S	.	.			trans	-67.9	114.5	173.5	-57	177.4	0	0	0	107	V511 A512 T518 E519 I709	V511-I514 HydrophobicContact CG1-CD1 4.2Å; V511-I514 WeakPolarHBondContact O-CB 3.47Å; V511-I514 WeakPolarHBondContact O-CG1 3.21Å; V511-I514 PolarHBondContact O-N 3.32Å; A512-I514 VanDerWaalsContact C-N 3.3Å; I514-T518 WeakPolarHBondContact CG2-OG1 3.26Å; I514-E519 HydrophobicContact CG2-CG 3.61Å; I514-I709 HydrophobicContact CD1-CG1 4.03Å
515	T	79.7	Confident	80.8	Confident	73 Å²	73	58.5 Å²	58.5	45%	0.448	29%	0.292	S	S	.	.			trans	-78	153.1	177.5	67.2	0	0	0	0	110.4	F513 F517 T518 E519	F513-T515 PolarHBondContact O-N 3.23Å; F513-T515 VanDerWaalsContact O-N 3.12Å; T515-F517 PolarHBondContact O-N 3.05Å; T515-F517 VanDerWaalsContact O-N 3.13Å; T515-T518 WeakPolarHBondContact CA-OG1 3.42Å; T515-T518 PolarHBondContact N-OG1 3.25Å; T515-T518 PolarHBondContact O-N 3.47Å; T515-T518 PolarHBondContact O-OG1 3.5Å; T515-T518 PolarHBondContact OG1-N 3.03Å; T515-T518 PolarHBondContact OG1-OG1 3.41Å; T515-E519 PolarHBondContact O-N 2.82Å
516	R	75.4	Confident	80.4	Confident	118 Å²	118	54.1 Å²	54.1	45%	0.445	27%	0.274	S	S	.	.	H	α-helix	trans	-49.7	-40.6	170.4	-179.4	179.5	172.4	148.2	12.2	112.8	T518 E519 E520 E718	R516-T518 PolarHBondContact O-N 3.41Å; R516-E519 PolarHBondContact O-N 3.36Å; R516-E520 IonicContact CZ-OE1 2.91Å; R516-E520 IonicContact NE-OE1 3.84Å; R516-E520 PolarHBondContact NE-OE1 3.46Å; R516-E520 IonicContact NH2-OE1 2.7Å; R516-E520 PolarHBondContact NH2-OE1 3.09Å; R516-E520 WeakPolarHBondContact O-CG 3.31Å; R516-E520 PolarHBondContact O-N 2.85Å; R516-E718 IonicContact CZ-OE1 2.79Å; R516-E718 IonicContact NH1-OE1 3.06Å; R516-E718 IonicContact NH2-OE1 3.99Å; R516-E718 PolarHBondContact NH2-OE1 2.86Å
517	F	79.9	Confident	80.2	Confident	115 Å²	115	54.2 Å²	54.2	50%	0.504	28%	0.275	S	S	.	.	H	α-helix	trans	-61.7	-43.9	177.9	177.7	-105.9	0	0	0	112.1	T515 E520 L521 L830	T515-F517 PolarHBondContact O-N 3.05Å; T515-F517 VanDerWaalsContact O-N 3.13Å; F517-E520 PolarHBondContact O-N 3.13Å; F517-L521 HydrophobicContact CD1-CD1 3.83Å; F517-L521 HydrophobicContact CD1-CG 4.42Å; F517-L521 HydrophobicContact CE1-CD1 3.28Å; F517-L521 HydrophobicContact CE1-CG 4.08Å; F517-L521 HydrophobicContact CE2-CD1 4.31Å; F517-L521 HydrophobicContact CE2-CD2 4.47Å; F517-L521 HydrophobicContact CE2-CG 4.29Å; F517-L521 HydrophobicContact CZ-CD1 3.56Å; F517-L521 HydrophobicContact CZ-CD2 4.24Å; F517-L521 HydrophobicContact CZ-CG 4Å; F517-L521 WeakPolarHBondContact O-CG 3.3Å; F517-L521 PolarHBondContact O-N 2.92Å; F517-L830 HydrophobicContact CD2-CD2 3.69Å; F517-L830 HydrophobicContact CE2-CD2 3.8Å
518	T	77.9	Confident	80.3	Confident	63 Å²	63	55.5 Å²	55.5	39%	0.387	28%	0.282	S	S	.	.	H	α-helix	trans	-66.2	-36.4	177.2	42	0	0	0	0	112.6	I514 T515 R516 L521 F522	I514-T518 WeakPolarHBondContact CG2-OG1 3.26Å; T515-T518 WeakPolarHBondContact CA-OG1 3.42Å; T515-T518 PolarHBondContact N-OG1 3.25Å; T515-T518 PolarHBondContact O-N 3.47Å; T515-T518 PolarHBondContact O-OG1 3.5Å; T515-T518 PolarHBondContact OG1-N 3.03Å; T515-T518 PolarHBondContact OG1-OG1 3.41Å; R516-T518 PolarHBondContact O-N 3.41Å; T518-L521 PolarHBondContact O-N 2.89Å; T518-F522 WeakPolarHBondContact O-CB 3.3Å; T518-F522 PolarHBondContact O-N 2.88Å
519	E	78.9	Confident	80.6	Confident	27 Å²	27	59.8 Å²	59.8	13%	0.126	30%	0.304	C	S	.	.	H	α-helix	trans	-63.8	-46.8	174.6	-62.8	169.4	-152.6	0	0	112	I514 T515 R516 L521 F522 A523 V712 I713 R716	I514-E519 HydrophobicContact CG2-CG 3.61Å; T515-E519 PolarHBondContact O-N 2.82Å; R516-E519 PolarHBondContact O-N 3.36Å; E519-L521 VanDerWaalsContact C-N 3.35Å; E519-F522 PolarHBondContact O-N 2.75Å; E519-A523 WeakPolarHBondContact O-CB 3.4Å; E519-A523 PolarHBondContact O-N 2.92Å; E519-V712 HydrophobicContact CG-CG1 3.8Å; E519-V712 WeakPolarHBondContact OE1-CG1 3.42Å; E519-I713 HydrophobicContact CB-CG1 4.42Å; E519-R716 IonicContact OE2-NE 2.71Å
520	E	79.9	Confident	80.7	Confident	20 Å²	20	57.6 Å²	57.6	9%	0.093	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-40.1	178.8	-71.7	177.9	-173.7	0	0	111.3	R516 F517 T524 L830	R516-E520 IonicContact CZ-OE1 2.91Å; R516-E520 IonicContact NE-OE1 3.84Å; R516-E520 PolarHBondContact NE-OE1 3.46Å; R516-E520 IonicContact NH2-OE1 2.7Å; R516-E520 PolarHBondContact NH2-OE1 3.09Å; R516-E520 WeakPolarHBondContact O-CG 3.31Å; R516-E520 PolarHBondContact O-N 2.85Å; F517-E520 PolarHBondContact O-N 3.13Å; E520-T524 WeakPolarHBondContact O-CB 3.48Å; E520-T524 PolarHBondContact O-N 3.3Å; E520-T524 PolarHBondContact O-OG1 2.86Å; E520-L830 HydrophobicContact CB-CD2 4.25Å; E520-L830 WeakPolarHBondContact OE2-CB 3.19Å; E520-L830 WeakPolarHBondContact OE2-CD2 3.42Å
521	L	83.4	Confident	81.1	Confident	85 Å²	85	54.7 Å²	54.7	45%	0.445	28%	0.28	S	S	.	.	H	α-helix	trans	-61.5	-43	173.4	-76	-178.8	0	0	0	112.3	F517 T518 E519 T524 L525	F517-L521 HydrophobicContact CD1-CD1 3.83Å; F517-L521 HydrophobicContact CD1-CG 4.42Å; F517-L521 HydrophobicContact CE1-CD1 3.28Å; F517-L521 HydrophobicContact CE1-CG 4.08Å; F517-L521 HydrophobicContact CE2-CD1 4.31Å; F517-L521 HydrophobicContact CE2-CD2 4.47Å; F517-L521 HydrophobicContact CE2-CG 4.29Å; F517-L521 HydrophobicContact CZ-CD1 3.56Å; F517-L521 HydrophobicContact CZ-CD2 4.24Å; F517-L521 HydrophobicContact CZ-CG 4Å; F517-L521 WeakPolarHBondContact O-CG 3.3Å; F517-L521 PolarHBondContact O-N 2.92Å; T518-L521 PolarHBondContact O-N 2.89Å; E519-L521 VanDerWaalsContact C-N 3.35Å; L521-T524 WeakPolarHBondContact O-CB 3.5Å; L521-T524 PolarHBondContact O-N 3.24Å; L521-L525 WeakPolarHBondContact O-CB 3.37Å; L521-L525 PolarHBondContact O-N 3.2Å
522	F	83.5	Confident	81.6	Confident	47 Å²	47	57.1 Å²	57.1	21%	0.206	30%	0.295	C	S	.	.	H	α-helix	trans	-70	-46.6	-179.3	-169.1	-103.8	0	0	0	112	T518 E519 T524 L525 I526 I709 I713 T753	T518-F522 WeakPolarHBondContact O-CB 3.3Å; T518-F522 PolarHBondContact O-N 2.88Å; E519-F522 PolarHBondContact O-N 2.75Å; F522-T524 PolarHBondContact O-N 3.29Å; F522-L525 PolarHBondContact O-N 3.25Å; F522-I526 HydrophobicContact CD1-CD1 3.34Å; F522-I526 HydrophobicContact CD1-CG1 4.49Å; F522-I526 HydrophobicContact CE1-CD1 3.15Å; F522-I526 HydrophobicContact CE1-CG1 4.32Å; F522-I526 HydrophobicContact CE2-CD1 4.38Å; F522-I526 HydrophobicContact CG-CD1 4.11Å; F522-I526 HydrophobicContact CZ-CD1 3.72Å; F522-I526 WeakPolarHBondContact O-CD1 3.45Å; F522-I526 PolarHBondContact O-N 3.11Å; F522-I709 HydrophobicContact CB-CG2 4.33Å; F522-I709 HydrophobicContact CD1-CB 4.3Å; F522-I709 HydrophobicContact CD1-CG2 3.17Å; F522-I709 HydrophobicContact CD2-CD1 4.49Å; F522-I709 HydrophobicContact CE1-CB 4.07Å; F522-I709 HydrophobicContact CE1-CD1 4.41Å; F522-I709 HydrophobicContact CE1-CG2 3.39Å; F522-I709 HydrophobicContact CE2-CD1 4.31Å; F522-I709 HydrophobicContact CG-CG2 3.82Å; F522-I709 HydrophobicContact CZ-CD1 4.25Å; F522-I709 HydrophobicContact CZ-CG2 4.26Å; F522-I713 HydrophobicContact CD1-CD1 3.81Å; F522-T753 HydrophobicContact CE1-CG2 3.92Å
523	A	81.2	Confident	82.1	Confident	5 Å²	5	58 Å²	58	4%	0.041	29%	0.292	C	S	.	.	H	α-helix	trans	-57.3	-41.5	174.7	0	0	0	0	0	111.4	E519 A527 I713	E519-A523 WeakPolarHBondContact O-CB 3.4Å; E519-A523 PolarHBondContact O-N 2.92Å; A523-A527 WeakPolarHBondContact O-CB 3.34Å; A523-A527 PolarHBondContact O-N 3.16Å; A523-I713 HydrophobicContact CB-CD1 4.26Å
524	T	82.6	Confident	82.5	Confident	18 Å²	18	51 Å²	51	11%	0.11	26%	0.262	C	S	.	.	H	α-helix	trans	-63.2	-48.3	175	-66.5	0	0	0	0	112.4	E520 L521 F522 I526 A527 V528 L825 L831	E520-T524 WeakPolarHBondContact O-CB 3.48Å; E520-T524 PolarHBondContact O-N 3.3Å; E520-T524 PolarHBondContact O-OG1 2.86Å; L521-T524 WeakPolarHBondContact O-CB 3.5Å; L521-T524 PolarHBondContact O-N 3.24Å; F522-T524 PolarHBondContact O-N 3.29Å; T524-I526 VanDerWaalsContact C-N 3.31Å; T524-I526 PolarHBondContact O-N 3.22Å; T524-A527 PolarHBondContact O-N 3.39Å; T524-V528 HydrophobicContact CG2-CG2 4.49Å; T524-V528 WeakPolarHBondContact O-CG2 3.45Å; T524-V528 PolarHBondContact O-N 3.14Å; T524-L825 HydrophobicContact CG2-CD1 4.46Å; T524-L831 HydrophobicContact CG2-CB 4.2Å; T524-L831 HydrophobicContact CG2-CD1 3.23Å; T524-L831 HydrophobicContact CG2-CG 4.25Å
525	L	85.9	Confident	83.2	Confident	96 Å²	96	53.3 Å²	53.3	50%	0.503	27%	0.274	S	S	.	.	H	α-helix	trans	-57.9	-46	-180	175.7	61.6	0	0	0	110.9	L521 F522 V528 I529	L521-L525 WeakPolarHBondContact O-CB 3.37Å; L521-L525 PolarHBondContact O-N 3.2Å; F522-L525 PolarHBondContact O-N 3.25Å; L525-V528 PolarHBondContact O-N 3.02Å; L525-I529 HydrophobicContact CD1-CD1 4.09Å; L525-I529 HydrophobicContact CD1-CG1 4.33Å; L525-I529 HydrophobicContact CG-CD1 3.9Å; L525-I529 VanDerWaalsContact O-CG1 3.27Å; L525-I529 WeakPolarHBondContact O-CG1 3.23Å; L525-I529 PolarHBondContact O-N 3.4Å
526	I	81.4	Confident	83.7	Confident	28 Å²	28	55.2 Å²	55.2	14%	0.144	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-43.9	177.8	-69.9	155.1	0	0	0	111.5	F522 T524 V528 I529 F530 T753 M754	F522-I526 HydrophobicContact CD1-CD1 3.34Å; F522-I526 HydrophobicContact CD1-CG1 4.49Å; F522-I526 HydrophobicContact CE1-CD1 3.15Å; F522-I526 HydrophobicContact CE1-CG1 4.32Å; F522-I526 HydrophobicContact CE2-CD1 4.38Å; F522-I526 HydrophobicContact CG-CD1 4.11Å; F522-I526 HydrophobicContact CZ-CD1 3.72Å; F522-I526 WeakPolarHBondContact O-CD1 3.45Å; F522-I526 PolarHBondContact O-N 3.11Å; T524-I526 VanDerWaalsContact C-N 3.31Å; T524-I526 PolarHBondContact O-N 3.22Å; I526-V528 VanDerWaalsContact C-N 3.25Å; I526-V528 PolarHBondContact O-N 2.97Å; I526-I529 PolarHBondContact O-N 3.03Å; I526-F530 WeakPolarHBondContact O-CB 3.46Å; I526-F530 PolarHBondContact O-N 2.75Å; I526-T753 HydrophobicContact CD1-CG2 3.59Å; I526-T753 WeakPolarHBondContact CD1-OG1 3.42Å; I526-T753 WeakPolarHBondContact CG2-OG1 3.45Å; I526-M754 HydrophobicContact CG2-CB 4.06Å
527	A	83.3	Confident	84.3	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.033	26%	0.264	C	S	.	.	H	α-helix	trans	-58.3	-40.9	176.6	0	0	0	0	0	111.2	A523 T524 F530 V531 C824	A523-A527 WeakPolarHBondContact O-CB 3.34Å; A523-A527 PolarHBondContact O-N 3.16Å; T524-A527 PolarHBondContact O-N 3.39Å; A527-F530 PolarHBondContact O-N 3.03Å; A527-V531 WeakPolarHBondContact O-CG2 3.1Å; A527-V531 PolarHBondContact O-N 2.87Å; A527-V531 VanDerWaalsContact O-N 3.08Å; A527-C824 HydrophobicContact CB-CB 4.19Å
528	V	86.4	Confident	84.8	Confident	61 Å²	61	45.6 Å²	45.6	37%	0.37	24%	0.244	S	C	.	.	H	α-helix	trans	-66.3	-46.4	175.2	171.7	0	0	0	0	111.7	T524 L525 I526 F530 V531 V532 L825	T524-V528 HydrophobicContact CG2-CG2 4.49Å; T524-V528 WeakPolarHBondContact O-CG2 3.45Å; T524-V528 PolarHBondContact O-N 3.14Å; L525-V528 PolarHBondContact O-N 3.02Å; I526-V528 VanDerWaalsContact C-N 3.25Å; I526-V528 PolarHBondContact O-N 2.97Å; V528-F530 PolarHBondContact O-N 3.05Å; V528-V531 PolarHBondContact O-N 3.16Å; V528-V532 HydrophobicContact CG1-CG2 4.32Å; V528-V532 WeakPolarHBondContact O-CG2 3.39Å; V528-V532 PolarHBondContact O-N 3.44Å; V528-L825 HydrophobicContact CG2-CD1 3.89Å
529	I	85.7	Confident	85.4	Confident	94 Å²	94	44.6 Å²	44.6	48%	0.482	24%	0.242	S	C	.	.	H	α-helix	trans	-55	-43.6	176.9	-72.2	166.3	0	0	0	110	L525 I526 V532 E533	L525-I529 HydrophobicContact CD1-CD1 4.09Å; L525-I529 HydrophobicContact CD1-CG1 4.33Å; L525-I529 HydrophobicContact CG-CD1 3.9Å; L525-I529 VanDerWaalsContact O-CG1 3.27Å; L525-I529 WeakPolarHBondContact O-CG1 3.23Å; L525-I529 PolarHBondContact O-N 3.4Å; I526-I529 PolarHBondContact O-N 3.03Å; I529-V532 PolarHBondContact O-N 2.97Å; I529-E533 WeakPolarHBondContact O-CB 3.35Å; I529-E533 PolarHBondContact O-N 2.82Å
530	F	81.7	Confident	85.7	Confident	20 Å²	20	47.1 Å²	47.1	9%	0.088	26%	0.257	C	S	.	.	H	α-helix	trans	-69.7	-37.8	-178.8	-159	-110.5	0	0	0	113.4	I526 A527 V528 V532 E533 A534 M754 F817	I526-F530 WeakPolarHBondContact O-CB 3.46Å; I526-F530 PolarHBondContact O-N 2.75Å; A527-F530 PolarHBondContact O-N 3.03Å; V528-F530 PolarHBondContact O-N 3.05Å; F530-V532 VanDerWaalsContact C-N 3.32Å; F530-E533 PolarHBondContact O-N 3.34Å; F530-A534 PolarHBondContact O-N 3.36Å; F530-M754 HydrophobicContact CD1-CE 3.64Å; F530-M754 HydrophobicContact CD1-CG 4.08Å; F530-M754 HydrophobicContact CD1-SD 3.96Å; F530-M754 HydrophobicContact CD2-CG 4.28Å; F530-M754 HydrophobicContact CD2-SD 4.15Å; F530-M754 HydrophobicContact CE1-CE 3.12Å; F530-M754 HydrophobicContact CE1-CG 4.28Å; F530-M754 HydrophobicContact CE1-SD 3.54Å; F530-M754 VanDerWaalsContact CE1-SD 3.54Å; F530-M754 HydrophobicContact CE2-CE 4.46Å; F530-M754 HydrophobicContact CE2-CG 4.49Å; F530-M754 HydrophobicContact CE2-SD 3.78Å; F530-M754 HydrophobicContact CG-CE 4.46Å; F530-M754 HydrophobicContact CG-CG 4.06Å; F530-M754 HydrophobicContact CG-SD 4.22Å; F530-M754 HydrophobicContact CZ-CE 3.61Å; F530-M754 HydrophobicContact CZ-CG 4.48Å; F530-M754 HydrophobicContact CZ-SD 3.44Å; F530-M754 WeakPolarHBondContact CZ-SD 3.35Å; F530-F817 HydrophobicContact CD1-CB 4.29Å; F530-F817 WeakPolarHBondContact CD1-O 3.42Å; F530-F817 HydrophobicContact CE1-CB 3.32Å; F530-F817 HydrophobicContact CE1-CD1 4.12Å; F530-F817 HydrophobicContact CE1-CD2 4.3Å; F530-F817 AromaticContact CE1-CG 3.67Å; F530-F817 HydrophobicContact CE1-CG 3.67Å; F530-F817 VanDerWaalsContact CE1-O 3.31Å; F530-F817 WeakPolarHBondContact CE1-O 3.4Å; F530-F817 HydrophobicContact CE2-CD2 4.3Å; F530-F817 HydrophobicContact CE2-CG 4.44Å; F530-F817 HydrophobicContact CZ-CB 3.56Å; F530-F817 AromaticContact CZ-CD1 3.81Å; F530-F817 HydrophobicContact CZ-CD1 3.81Å; F530-F817 AromaticContact CZ-CD2 3.61Å; F530-F817 HydrophobicContact CZ-CD2 3.61Å; F530-F817 HydrophobicContact CZ-CE1 4.41Å; F530-F817 HydrophobicContact CZ-CE2 4.22Å; F530-F817 AromaticContact CZ-CG 3.37Å; F530-F817 HydrophobicContact CZ-CG 3.37Å
531	V	88.1	Confident	86.1	Confident	24 Å²	24	46.4 Å²	46.4	15%	0.145	25%	0.253	C	S	.	.	H	α-helix	trans	-61.9	-43.5	171.3	169.7	0	0	0	0	110.5	A527 V528 A534 I535 L818 L822	A527-V531 WeakPolarHBondContact O-CG2 3.1Å; A527-V531 PolarHBondContact O-N 2.87Å; A527-V531 VanDerWaalsContact O-N 3.08Å; V528-V531 PolarHBondContact O-N 3.16Å; V531-A534 PolarHBondContact O-N 3.47Å; V531-I535 HydrophobicContact CG1-CD1 4.04Å; V531-I535 WeakPolarHBondContact O-CG1 3.48Å; V531-I535 PolarHBondContact O-N 3.2Å; V531-I535 VanDerWaalsContact O-N 3.17Å; V531-L818 HydrophobicContact CG1-CD1 3.89Å; V531-L818 HydrophobicContact CG2-CD1 4.46Å; V531-L822 HydrophobicContact CG2-CD2 4.22Å; V531-L822 HydrophobicContact CG2-CG 4.22Å
532	V	89.3	Confident	86.3	Confident	64 Å²	64	47.7 Å²	47.7	39%	0.388	25%	0.253	S	S	.	.	H	α-helix	trans	-64.2	-42.7	177.2	170.3	0	0	0	0	110.8	V528 I529 F530 I535 Q536	V528-V532 HydrophobicContact CG1-CG2 4.32Å; V528-V532 WeakPolarHBondContact O-CG2 3.39Å; V528-V532 PolarHBondContact O-N 3.44Å; I529-V532 PolarHBondContact O-N 2.97Å; F530-V532 VanDerWaalsContact C-N 3.32Å; V532-I535 PolarHBondContact O-N 3.23Å; V532-Q536 HydrophobicContact CG1-CG 4.1Å; V532-Q536 WeakPolarHBondContact O-CB 3.32Å; V532-Q536 VanDerWaalsContact O-CG 3.27Å; V532-Q536 WeakPolarHBondContact O-CG 3.41Å; V532-Q536 PolarHBondContact O-N 3.31Å
533	E	84.5	Confident	86.4	Confident	60 Å²	60	52.9 Å²	52.9	28%	0.28	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-42.2	177.9	-173.4	174.7	-179.6	0	0	111.9	I529 F530 I535 Q536 G537	I529-E533 WeakPolarHBondContact O-CB 3.35Å; I529-E533 PolarHBondContact O-N 2.82Å; F530-E533 PolarHBondContact O-N 3.34Å; E533-I535 VanDerWaalsContact C-N 3.32Å; E533-I535 PolarHBondContact O-N 3.15Å; E533-Q536 PolarHBondContact O-N 3.23Å; E533-G537 PolarHBondContact O-N 3.1Å
534	A	88.1	Confident	86.4	Confident	2 Å²	2	59 Å²	59	2%	0.017	30%	0.303	C	S	.	.	H	α-helix	trans	-60.6	-41.1	175.1	0	0	0	0	0	112.2	F530 V531 M538 L818	F530-A534 PolarHBondContact O-N 3.36Å; V531-A534 PolarHBondContact O-N 3.47Å; A534-M538 PolarHBondContact O-N 2.73Å; A534-L818 HydrophobicContact CB-CB 4.09Å
535	I	91.6	Very high	86.4	Confident	96 Å²	96	60.2 Å²	60.2	49%	0.492	31%	0.308	S	S	.	.	H	α-helix	trans	-70.9	-41.8	177.1	-65.3	167	0	0	0	111	V531 V532 E533 G537 M538 A539	V531-I535 HydrophobicContact CG1-CD1 4.04Å; V531-I535 WeakPolarHBondContact O-CG1 3.48Å; V531-I535 PolarHBondContact O-N 3.2Å; V531-I535 VanDerWaalsContact O-N 3.17Å; V532-I535 PolarHBondContact O-N 3.23Å; E533-I535 VanDerWaalsContact C-N 3.32Å; E533-I535 PolarHBondContact O-N 3.15Å; I535-G537 VanDerWaalsContact C-N 3.31Å; I535-G537 PolarHBondContact O-N 3.47Å; I535-M538 WeakPolarHBondContact O-CB 3.31Å; I535-M538 PolarHBondContact O-N 3.04Å; I535-A539 PolarHBondContact O-N 3.44Å
536	Q	90.1	Very high	86.1	Confident	112 Å²	112	58.5 Å²	58.5	52%	0.523	30%	0.302	S	S	.	.	H	α-helix	trans	-63.1	-38.8	176.2	-77	178.1	-3.7	0	0	111.4	V532 E533 M538 A539 N540	V532-Q536 HydrophobicContact CG1-CG 4.1Å; V532-Q536 WeakPolarHBondContact O-CB 3.32Å; V532-Q536 VanDerWaalsContact O-CG 3.27Å; V532-Q536 WeakPolarHBondContact O-CG 3.41Å; V532-Q536 PolarHBondContact O-N 3.31Å; E533-Q536 PolarHBondContact O-N 3.23Å; Q536-M538 VanDerWaalsContact C-N 3.32Å; Q536-M538 PolarHBondContact O-N 3.42Å; Q536-A539 CarbonylContact O-C 3.59Å; Q536-A539 PolarHBondContact O-N 3.12Å; Q536-A539 VanDerWaalsContact O-N 3.15Å; Q536-N540 VanDerWaalsContact O-CG 3.25Å; Q536-N540 PolarHBondContact O-N 2.73Å
537	G	86.1	Confident	85.9	Confident	17 Å²	17	61.6 Å²	61.6	18%	0.175	32%	0.318	C	S	.	.	H	α-helix	trans	-57.2	-45.2	172.1	0	0	0	0	0	111.7	E533 I535 N540 I541	E533-G537 PolarHBondContact O-N 3.1Å; I535-G537 VanDerWaalsContact C-N 3.31Å; I535-G537 PolarHBondContact O-N 3.47Å; G537-N540 PolarHBondContact O-N 2.64Å; G537-I541 WeakPolarHBondContact O-CG1 3.4Å; G537-I541 PolarHBondContact O-N 3.15Å
538	M	90.7	Very high	85.4	Confident	14 Å²	14	63.7 Å²	63.7	7%	0.069	33%	0.33	C	S	.	.	H	α-helix	trans	-65.3	-40	174.2	-172.6	56.1	59.2	0	0	112.5	A534 I535 Q536 N540 I541 Y542 F602 L606 F609 P811	A534-M538 PolarHBondContact O-N 2.73Å; I535-M538 WeakPolarHBondContact O-CB 3.31Å; I535-M538 PolarHBondContact O-N 3.04Å; Q536-M538 VanDerWaalsContact C-N 3.32Å; Q536-M538 PolarHBondContact O-N 3.42Å; M538-N540 VanDerWaalsContact C-N 3.31Å; M538-N540 PolarHBondContact O-N 3.49Å; M538-I541 PolarHBondContact O-N 3.16Å; M538-Y542 PolarHBondContact O-N 3.17Å; M538-F602 HydrophobicContact CG-CE2 4.05Å; M538-F602 HydrophobicContact SD-CD2 4.37Å; M538-F602 HydrophobicContact SD-CE2 3.75Å; M538-L606 HydrophobicContact CG-CD1 4.38Å; M538-L606 HydrophobicContact SD-CB 4.44Å; M538-L606 HydrophobicContact SD-CD1 4.45Å; M538-F609 HydrophobicContact CE-CB 3.27Å; M538-F609 HydrophobicContact CE-CD1 4.23Å; M538-F609 HydrophobicContact CE-CD2 3.52Å; M538-F609 HydrophobicContact CE-CE2 4.36Å; M538-F609 HydrophobicContact CE-CG 3.44Å; M538-F609 VanDerWaalsContact CE-CG 3.44Å; M538-P811 HydrophobicContact CE-CB 4.26Å
539	A	90.6	Very high	84.6	Confident	43 Å²	43	67 Å²	67	36%	0.355	35%	0.351	S	S	.	.	H	α-helix	trans	-67.4	-30.5	177.7	0	0	0	0	0	112.8	I535 Q536 Y542 K543	I535-A539 PolarHBondContact O-N 3.44Å; Q536-A539 CarbonylContact O-C 3.59Å; Q536-A539 PolarHBondContact O-N 3.12Å; Q536-A539 VanDerWaalsContact O-N 3.15Å; A539-Y542 WeakPolarHBondContact O-CB 3.41Å; A539-Y542 PolarHBondContact O-N 3.35Å; A539-K543 WeakPolarHBondContact O-CG 3.46Å; A539-K543 PolarHBondContact O-N 3.4Å; A539-K543 VanDerWaalsContact O-N 3.09Å
540	N	86.8	Confident	83.8	Confident	80 Å²	80	65.9 Å²	65.9	43%	0.428	35%	0.346	S	S	.	.	H	α-helix	trans	-68.3	-40.2	173.7	-70.8	-15.1	0	0	0	110.9	Q536 G537 M538 Y542 K543 E544	Q536-N540 VanDerWaalsContact O-CG 3.25Å; Q536-N540 PolarHBondContact O-N 2.73Å; G537-N540 PolarHBondContact O-N 2.64Å; M538-N540 VanDerWaalsContact C-N 3.31Å; M538-N540 PolarHBondContact O-N 3.49Å; N540-Y542 VanDerWaalsContact C-N 3.27Å; N540-Y542 PolarHBondContact O-N 2.85Å; N540-K543 WeakPolarHBondContact O-CB 3.34Å; N540-K543 PolarHBondContact O-N 3.5Å; N540-K543 VanDerWaalsContact O-N 3.08Å; N540-E544 PolarHBondContact O-N 3.15Å
541	I	87.7	Confident	83.1	Confident	5 Å²	5	69 Å²	69	3%	0.026	37%	0.368	C	S	.	.	H	α-helix	trans	-62.9	-36.2	173.3	-59.8	169	0	0	0	110.9	G537 M538 K543 E544 H545 F602 P660 P811 L814	G537-I541 WeakPolarHBondContact O-CG1 3.4Å; G537-I541 PolarHBondContact O-N 3.15Å; M538-I541 PolarHBondContact O-N 3.16Å; I541-K543 VanDerWaalsContact C-N 3.35Å; I541-E544 PolarHBondContact O-N 2.73Å; I541-H545 PolarHBondContact O-N 2.93Å; I541-F602 HydrophobicContact CG2-CD2 4.23Å; I541-P660 HydrophobicContact CD1-CG 3.91Å; I541-P660 HydrophobicContact CG1-CG 4.1Å; I541-P660 HydrophobicContact CG2-CG 4.26Å; I541-P811 HydrophobicContact CD1-CG 3.98Å; I541-L814 HydrophobicContact CD1-CD1 4.19Å
542	Y	88.1	Confident	81.9	Confident	111 Å²	111	74 Å²	74	44%	0.435	39%	0.39	S	S	.	.	H	α-helix	trans	-63	-38.8	172.7	177.7	-106.3	0	0	0	112.8	M538 A539 N540 H545 P546 I547 F602	M538-Y542 PolarHBondContact O-N 3.17Å; A539-Y542 WeakPolarHBondContact O-CB 3.41Å; A539-Y542 PolarHBondContact O-N 3.35Å; N540-Y542 VanDerWaalsContact C-N 3.27Å; N540-Y542 PolarHBondContact O-N 2.85Å; Y542-H545 CarbonylContact O-C 3.52Å; Y542-P546 VanDerWaalsContact O-CA 3.28Å; Y542-P546 WeakPolarHBondContact O-CA 3.48Å; Y542-P546 VanDerWaalsContact O-N 3.11Å; Y542-I547 HydrophobicContact CE2-CD1 4.44Å; Y542-I547 HydrophobicContact CE2-CG1 4.16Å; Y542-F602 VanDerWaalsContact CA-CD2 3.48Å; Y542-F602 VanDerWaalsContact CB-CE2 3.45Å; Y542-F602 AromaticContact CD2-CD1 3.83Å; Y542-F602 HydrophobicContact CD2-CD1 3.83Å; Y542-F602 HydrophobicContact CD2-CD2 4.2Å; Y542-F602 AromaticContact CD2-CE1 3.74Å; Y542-F602 HydrophobicContact CD2-CE1 3.74Å; Y542-F602 HydrophobicContact CD2-CE2 4.15Å; Y542-F602 HydrophobicContact CD2-CG 4.05Å; Y542-F602 AromaticContact CD2-CZ 3.9Å; Y542-F602 HydrophobicContact CD2-CZ 3.9Å; Y542-F602 HydrophobicContact CE2-CE1 4.49Å; Y542-F602 HydrophobicContact CG-CD2 4.48Å; Y542-F602 HydrophobicContact CG-CE2 4.26Å; Y542-F602 HydrophobicContact CG-CZ 4.27Å
543	K	84.9	Confident	80.6	Confident	157 Å²	157	77 Å²	77	68%	0.683	40%	0.401	S	S	*	.	H	α-helix	trans	-68.7	-38.4	177.8	-71.3	173.7	-177.3	172.2	0	112	A539 N540 I541	A539-K543 WeakPolarHBondContact O-CG 3.46Å; A539-K543 PolarHBondContact O-N 3.4Å; A539-K543 VanDerWaalsContact O-N 3.09Å; N540-K543 WeakPolarHBondContact O-CB 3.34Å; N540-K543 PolarHBondContact O-N 3.5Å; N540-K543 VanDerWaalsContact O-N 3.08Å; I541-K543 VanDerWaalsContact C-N 3.35Å
544	E	81.3	Confident	79.5	Confident	133 Å²	133	75.7 Å²	75.7	62%	0.621	40%	0.396	S	S	*	.	H	α-helix	trans	-72.3	-33.9	176.8	-70.1	174.9	-174.6	0	0	112	N540 I541	N540-E544 PolarHBondContact O-N 3.15Å; I541-E544 PolarHBondContact O-N 2.73Å
545	H	82.9	Confident	78.3	Confident	44 Å²	44	82.5 Å²	82.5	20%	0.204	43%	0.425	C	S	.	.	S	Bend	trans	-131.8	75.5	-178.8	-59.6	-52.5	0	0	0	111.8	I541 Y542 I601 F602	I541-H545 PolarHBondContact O-N 2.93Å; Y542-H545 CarbonylContact O-C 3.52Å; H545-I601 HydrophobicContact CB-CB 4.37Å; H545-I601 HydrophobicContact CB-CG2 4.33Å; H545-F602 HydrophobicContact CB-CB 4.41Å; H545-F602 VanDerWaalsContact O-CB 3.24Å; H545-F602 WeakPolarHBondContact O-CB 3.38Å
546	P	79.1	Confident	76.9	Confident	59 Å²	59	84.5 Å²	84.5	38%	0.383	44%	0.437	S	S	.	.			trans	-68.3	148.5	-178	27.6	-34.8	0	0	0	112.5	Y542 V548	Y542-P546 VanDerWaalsContact O-CA 3.28Å; Y542-P546 WeakPolarHBondContact O-CA 3.48Å; Y542-P546 VanDerWaalsContact O-N 3.11Å; P546-V548 PolarHBondContact O-N 3.41Å
547	I	77.8	Confident	75.4	Confident	93 Å²	93	82.4 Å²	82.4	48%	0.477	43%	0.427	S	S	.	.			trans	-77.2	116.1	172	-55.1	172.9	0	0	0	108.5	Y542 F602	Y542-I547 HydrophobicContact CE2-CD1 4.44Å; Y542-I547 HydrophobicContact CE2-CG1 4.16Å; I547-F602 HydrophobicContact CD1-CD1 3.71Å; I547-F602 HydrophobicContact CD1-CE1 3.98Å; I547-F602 HydrophobicContact CG1-CD1 3.77Å; I547-F602 HydrophobicContact CG1-CE1 4.46Å
548	V	71.4	Confident	74.3	Confident	48 Å²	48	85.4 Å²	85.4	29%	0.291	44%	0.443	S	S	.	.			trans	-91.9	114.2	172.7	178.3	0	0	0	0	108.7	P546 D550 L554 F597	P546-V548 PolarHBondContact O-N 3.41Å; V548-D550 VanDerWaalsContact CG1-O 3.27Å; V548-D550 WeakPolarHBondContact CG1-O 3.16Å; V548-L554 HydrophobicContact CB-CD1 4.42Å; V548-L554 HydrophobicContact CG1-CD1 4.15Å; V548-L554 HydrophobicContact CG2-CD1 4.01Å; V548-F597 HydrophobicContact CB-CE2 4.08Å; V548-F597 HydrophobicContact CB-CZ 4.03Å; V548-F597 HydrophobicContact CG2-CD2 4.36Å; V548-F597 HydrophobicContact CG2-CE2 3.56Å; V548-F597 HydrophobicContact CG2-CZ 4.03Å
549	T	70.4	Confident	73	Confident	131 Å²	131	87.2 Å²	87.2	80%	0.804	46%	0.457	S	S	*	.	S	Bend	trans	-81.9	-28.6	-180	51.5	0	0	0	0	113.3
550	D	68.9	Low	71.9	Confident	71 Å²	71	85.9 Å²	85.9	38%	0.38	44%	0.444	S	S	.	.			trans	-113.4	108.4	-177.2	-154.6	-20.3	0	0	0	110	V548 Q552 M553	V548-D550 VanDerWaalsContact CG1-O 3.27Å; V548-D550 WeakPolarHBondContact CG1-O 3.16Å; D550-Q552 PolarHBondContact O-N 3.26Å; D550-Q552 VanDerWaalsContact O-N 3.16Å; D550-Q552 PolarHBondContact OD1-N 3.01Å; D550-M553 PolarHBondContact O-N 3.41Å
551	P	66.1	Low	71.2	Confident	85 Å²	85	84.5 Å²	84.5	55%	0.552	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-24.1	179.7	23	-31.3	0	0	0	112.1	M553 L554 F555	P551-M553 PolarHBondContact O-N 3.31Å; P551-L554 VanDerWaalsContact O-CB 3.29Å; P551-L554 WeakPolarHBondContact O-CB 3.23Å; P551-L554 PolarHBondContact O-N 3Å; P551-L554 VanDerWaalsContact O-N 3.15Å; P551-F555 WeakPolarHBondContact O-CD2 3.32Å; P551-F555 PolarHBondContact O-N 3.29Å
552	Q	63.9	Low	70.4	Confident	130 Å²	130	84.5 Å²	84.5	61%	0.607	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-36.2	-180	-66	-169.7	-15	0	0	113.1	D550 L554 F555 D556	D550-Q552 PolarHBondContact O-N 3.26Å; D550-Q552 VanDerWaalsContact O-N 3.16Å; D550-Q552 PolarHBondContact OD1-N 3.01Å; Q552-L554 PolarHBondContact O-N 3.01Å; Q552-F555 WeakPolarHBondContact O-CA 2.99Å; Q552-F555 PolarHBondContact O-N 2.97Å; Q552-D556 PolarHBondContact O-N 3.09Å
553	M	62.3	Low	69.5	Low	126 Å²	126	81.8 Å²	81.8	62%	0.621	43%	0.43	S	S	*	.	H	α-helix	trans	-61.3	-29.7	175.1	-73.1	-141.2	-94.4	0	0	112.4	D550 P551 F555 E557	D550-M553 PolarHBondContact O-N 3.41Å; P551-M553 PolarHBondContact O-N 3.31Å; M553-F555 VanDerWaalsContact C-N 3.28Å; M553-F555 PolarHBondContact O-N 3.43Å; M553-E557 PolarHBondContact O-N 3.05Å
554	L	60.7	Low	68.7	Low	32 Å²	32	76.4 Å²	76.4	17%	0.168	41%	0.411	C	S	.	.	H	α-helix	trans	-72.9	-20.3	174.1	-137.1	92.2	0	0	0	112.7	V548 P551 Q552 R594 F597	V548-L554 HydrophobicContact CB-CD1 4.42Å; V548-L554 HydrophobicContact CG1-CD1 4.15Å; V548-L554 HydrophobicContact CG2-CD1 4.01Å; P551-L554 VanDerWaalsContact O-CB 3.29Å; P551-L554 WeakPolarHBondContact O-CB 3.23Å; P551-L554 PolarHBondContact O-N 3Å; P551-L554 VanDerWaalsContact O-N 3.15Å; Q552-L554 PolarHBondContact O-N 3.01Å; L554-R594 VanDerWaalsContact O-CZ 3.29Å; L554-R594 PolarHBondContact O-NE 3.38Å; L554-R594 PolarHBondContact O-NH2 2.91Å; L554-R594 VanDerWaalsContact O-NH2 3.15Å; L554-F597 HydrophobicContact CD1-CD1 4.15Å; L554-F597 HydrophobicContact CD1-CD2 4.19Å; L554-F597 HydrophobicContact CD1-CE1 4.24Å; L554-F597 HydrophobicContact CD1-CE2 4.29Å; L554-F597 HydrophobicContact CD1-CG 4.12Å; L554-F597 HydrophobicContact CD1-CZ 4.31Å; L554-F597 HydrophobicContact CD2-CD1 3.74Å; L554-F597 HydrophobicContact CD2-CE1 4.05Å; L554-F597 HydrophobicContact CD2-CG 4.32Å
555	F	64	Low	67.8	Low	146 Å²	146	78.1 Å²	78.1	64%	0.64	42%	0.424	S	S	*	.	H	α-helix	trans	-91.2	-29.6	176.8	-71.7	-80.1	0	0	0	114	P551 Q552 M553	P551-F555 WeakPolarHBondContact O-CD2 3.32Å; P551-F555 PolarHBondContact O-N 3.29Å; Q552-F555 WeakPolarHBondContact O-CA 2.99Å; Q552-F555 PolarHBondContact O-N 2.97Å; M553-F555 VanDerWaalsContact C-N 3.28Å; M553-F555 PolarHBondContact O-N 3.43Å
556	D	62.2	Low	66.6	Low	137 Å²	137	79.9 Å²	79.9	73%	0.733	44%	0.442	S	S	*	.	H	α-helix	trans	-79	-22	179.9	-68.6	-26.5	0	0	0	113.2	Q552	Q552-D556 PolarHBondContact O-N 3.09Å
557	E	58.7	Low	65.5	Low	68 Å²	68	82.1 Å²	82.1	32%	0.318	46%	0.459	S	S	.	.	S	Bend	trans	-76.5	143.3	173.8	-80	177.1	156.5	0	0	112.8	M553 L593	M553-E557 PolarHBondContact O-N 3.05Å; E557-L593 VanDerWaalsContact OE1-CD1 3.28Å; E557-L593 WeakPolarHBondContact OE1-CD1 3.42Å; E557-L593 WeakPolarHBondContact OE2-CB 3.38Å; E557-L593 VanDerWaalsContact OE2-CD1 3.26Å; E557-L593 WeakPolarHBondContact OE2-CD1 3.5Å; E557-L593 VanDerWaalsContact OE2-CD2 3.26Å; E557-L593 WeakPolarHBondContact OE2-CD2 3.34Å; E557-L593 VanDerWaalsContact OE2-CG 3.31Å; E557-L593 WeakPolarHBondContact OE2-CG 3.41Å
558	P	62.1	Low	64.3	Low	80 Å²	80	84.4 Å²	84.4	52%	0.519	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-58.5	145.6	-178.6	22.9	-32	0	0	0	111.4	F573	P558-F573 HydrophobicContact CB-CE1 4.48Å
559	P	62.8	Low	63.3	Low	53 Å²	53	88.1 Å²	88.1	34%	0.344	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-58.1	157.1	174.1	23	-29.2	0	0	0	110.8	H561 F573	P559-H561 PolarHBondContact O-N 2.88Å; P559-F573 HydrophobicContact CG-CD1 3.79Å; P559-F573 HydrophobicContact CG-CE1 4.35Å
560	C	68.8	Low	62.5	Low	15 Å²	15	85.9 Å²	85.9	10%	0.101	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-47	129.9	178.5	-73	0	0	0	0	112.5	L574 C595	C560-L574 HydrophobicContact CB-CB 4.23Å; C560-L574 HydrophobicContact CB-CD1 3.28Å; C560-L574 HydrophobicContact CB-CG 4.33Å; C560-L574 PolarHBondContact O-N 3.47Å; C560-C595 WeakPolarHBondContact CA-SG 3.16Å; C560-C595 HydrophobicContact CB-CB 4.13Å; C560-C595 WeakPolarHBondContact CB-SG 3.43Å; C560-C595 WeakPolarHBondContact SG-CA 3.31Å; C560-C595 WeakPolarHBondContact SG-CB 3.49Å; C560-C595 PolarHBondContact SG-N 3.06Å; C560-C595 CovalentContact SG-SG 2.03Å; C560-C595 PolarHBondContact SG-SG 2.79Å
561	H	71.3	Confident	61.7	Low	51 Å²	51	85.4 Å²	85.4	24%	0.236	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.2	172.9	55.4	-77.7	0	0	0	109.9	P559 M572 H591	P559-H561 PolarHBondContact O-N 2.88Å; H561-M572 WeakPolarHBondContact CA-O 3.12Å; H561-H591 VanDerWaalsContact CE1-CB 3.42Å; H561-H591 WeakPolarHBondContact CE1-CB 3.49Å; H561-H591 PolarHBondContact CE1-O 2.83Å; H561-H591 PolarHBondContact N-O 3.48Å; H561-H591 PolarHBondContact ND1-O 3.33Å; H561-H591 WeakPolarHBondContact NE2-CB 3.39Å; H561-H591 PolarHBondContact O-N 3.06Å
562	C	69.8	Low	61.3	Low	4 Å²	4	87 Å²	87	3%	0.027	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	124.8	170.5	-176.7	0	0	0	0	108.6	M572 F578 C583	C562-M572 PolarHBondContact N-O 2.92Å; C562-M572 PolarHBondContact O-N 2.88Å; C562-F578 HydrophobicContact CB-CE1 4.42Å; C562-C583 VanDerWaalsContact CA-SG 3.51Å; C562-C583 HydrophobicContact CB-CB 3.74Å; C562-C583 WeakPolarHBondContact CB-SG 3.3Å; C562-C583 WeakPolarHBondContact SG-CB 3.39Å; C562-C583 CovalentContact SG-SG 2.01Å; C562-C583 PolarHBondContact SG-SG 3.01Å
563	V	70.8	Confident	60.9	Low	54 Å²	54	85.4 Å²	85.4	33%	0.327	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	107.8	172.3	-177	0	0	0	0	107.8	G588 T589	V563-G588 CarbonylContact O-C 3.53Å; V563-G588 WeakPolarHBondContact O-CA 3.47Å; V563-T589 PolarHBondContact N-O 3.37Å; V563-T589 PolarHBondContact O-N 3.06Å
564	T	66.9	Low	60.5	Low	45 Å²	45	80.8 Å²	80.8	28%	0.276	46%	0.462	S	S	.	.			trans	-96.8	141.8	171	62.1	0	0	0	0	109.2	S566	T564-S566 PolarHBondContact O-N 3.25Å
565	N	63.8	Low	60.1	Low	169 Å²	169	89.1 Å²	89.1	90%	0.904	49%	0.492	S	S	*	.			trans	-74.6	15.2	178.5	-95.7	-14.4	0	0	0	113.7
566	S	56.8	Low	59.8	Low	81 Å²	81	90.3 Å²	90.3	57%	0.566	51%	0.505	S	S	*	.	S	Bend	trans	-76.1	127.3	173.3	-176.9	0	0	0	0	109.5	T564 N568	T564-S566 PolarHBondContact O-N 3.25Å; S566-N568 PolarHBondContact O-N 3.39Å
567	S	55	Low	59.6	Low	106 Å²	106	91.4 Å²	91.4	74%	0.741	51%	0.511	S	S	*	.	S	Bend	trans	-41.2	129.9	177.8	51	0	0	0	0	113
568	N	54.3	Low	59.8	Low	140 Å²	140	91.4 Å²	91.4	75%	0.749	51%	0.51	S	S	*	.	S	Bend	trans	86.1	105.9	-160.9	-61.7	-17.1	0	0	0	112.3	S566 S570	S566-N568 PolarHBondContact O-N 3.39Å; N568-S570 PolarHBondContact O-N 3.26Å; N568-S570 PolarHBondContact O-OG 2.87Å
569	S	49.3	Very low	60	Low	127 Å²	127	91 Å²	91	89%	0.888	51%	0.506	S	S	*	.			trans	-60.3	61.7	170.2	49.6	0	0	0	0	112.3	S571	S569-S571 VanDerWaalsContact C-N 3.31Å; S569-S571 PolarHBondContact O-N 3.41Å
570	S	52.9	Low	60.1	Low	83 Å²	83	89.5 Å²	89.5	58%	0.58	50%	0.498	S	S	*	.			trans	-80.6	86.1	163.1	42.1	0	0	0	0	107	N568 M572	N568-S570 PolarHBondContact O-N 3.26Å; N568-S570 PolarHBondContact O-OG 2.87Å; S570-M572 VanDerWaalsContact C-N 3.31Å; S570-M572 PolarHBondContact O-N 3.45Å
571	S	54.1	Low	60.1	Low	62 Å²	62	95.2 Å²	95.2	43%	0.434	52%	0.521	S	S	.	.			trans	-59.2	100.8	159.6	54.1	0	0	0	0	106.8	S569 F573	S569-S571 VanDerWaalsContact C-N 3.31Å; S569-S571 PolarHBondContact O-N 3.41Å; S571-F573 PolarHBondContact O-N 2.92Å
572	M	55.8	Low	60.1	Low	118 Å²	118	95.6 Å²	95.6	58%	0.581	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	115.5	174.9	-175.5	172.7	-99.8	0	0	107	H561 C562 S570 L574	H561-M572 WeakPolarHBondContact CA-O 3.12Å; C562-M572 PolarHBondContact N-O 2.92Å; C562-M572 PolarHBondContact O-N 2.88Å; S570-M572 VanDerWaalsContact C-N 3.31Å; S570-M572 PolarHBondContact O-N 3.45Å; M572-L574 PolarHBondContact O-N 3.29Å
573	F	56	Low	60.2	Low	96 Å²	96	95.4 Å²	95.4	42%	0.421	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	128.5	164.8	-66.3	-74.4	0	0	0	107.6	P558 P559 S571 W575	P558-F573 HydrophobicContact CB-CE1 4.48Å; P559-F573 HydrophobicContact CG-CD1 3.79Å; P559-F573 HydrophobicContact CG-CE1 4.35Å; S571-F573 PolarHBondContact O-N 2.92Å; F573-W575 VanDerWaalsContact O-CD1 3.22Å; F573-W575 PolarHBondContact O-N 3.48Å; F573-W575 VanDerWaalsContact O-N 3.08Å
574	L	55.2	Low	60.2	Low	30 Å²	30	97.8 Å²	97.8	16%	0.157	53%	0.531	C	S	.	.			trans	-67.2	105.2	174.2	-75.8	138.8	0	0	0	108.2	C560 M572 F578 T579 V590	C560-L574 HydrophobicContact CB-CB 4.23Å; C560-L574 HydrophobicContact CB-CD1 3.28Å; C560-L574 HydrophobicContact CB-CG 4.33Å; C560-L574 PolarHBondContact O-N 3.47Å; M572-L574 PolarHBondContact O-N 3.29Å; L574-F578 VanDerWaalsContact CD2-C 3.46Å; L574-F578 HydrophobicContact CD2-CB 4.04Å; L574-F578 HydrophobicContact CD2-CD1 3.45Å; L574-F578 VanDerWaalsContact CD2-CD1 3.45Å; L574-F578 HydrophobicContact CD2-CE1 4.33Å; L574-F578 HydrophobicContact CD2-CG 4.11Å; L574-F578 WeakPolarHBondContact CD2-O 3.28Å; L574-F578 HydrophobicContact CG-CD1 4.32Å; L574-T579 VanDerWaalsContact CD2-C 3.42Å; L574-T579 WeakPolarHBondContact CD2-O 3.48Å; L574-V590 HydrophobicContact CD1-CG1 3.65Å
575	W	51.4	Low	60.4	Low	207 Å²	207	102.6 Å²	102.6	78%	0.784	55%	0.554	S	S	*	*			trans	-97.7	157.6	169.3	-70	38.8	0	0	0	108.3	F573 N577 F578	F573-W575 VanDerWaalsContact O-CD1 3.22Å; F573-W575 PolarHBondContact O-N 3.48Å; F573-W575 VanDerWaalsContact O-N 3.08Å; W575-N577 PolarHBondContact O-N 2.88Å; W575-F578 PolarHBondContact O-N 3.28Å
576	D	58.5	Low	60.7	Low	171 Å²	171	100.5 Å²	100.5	91%	0.914	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-33.1	-21.6	-164.9	-71.7	-22	0	0	0	119.8
577	N	57.3	Low	61.3	Low	160 Å²	160	99.6 Å²	99.6	86%	0.856	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-4.1	-179.2	-73.3	-13	0	0	0	115.8	W575	W575-N577 PolarHBondContact O-N 2.88Å
578	F	62	Low	62	Low	68 Å²	68	94.9 Å²	94.9	30%	0.298	52%	0.515	S	S	.	.			trans	-119.3	122.2	178	-157.3	-116.6	0	0	0	108.5	C562 L574 W575 D582 C583	C562-F578 HydrophobicContact CB-CE1 4.42Å; L574-F578 VanDerWaalsContact CD2-C 3.46Å; L574-F578 HydrophobicContact CD2-CB 4.04Å; L574-F578 HydrophobicContact CD2-CD1 3.45Å; L574-F578 VanDerWaalsContact CD2-CD1 3.45Å; L574-F578 HydrophobicContact CD2-CE1 4.33Å; L574-F578 HydrophobicContact CD2-CG 4.11Å; L574-F578 WeakPolarHBondContact CD2-O 3.28Å; L574-F578 HydrophobicContact CG-CD1 4.32Å; W575-F578 PolarHBondContact O-N 3.28Å; F578-D582 HydrophobicContact CD2-CB 3.81Å; F578-D582 HydrophobicContact CE1-CB 4.47Å; F578-D582 HydrophobicContact CE2-CB 3.57Å; F578-D582 HydrophobicContact CG-CB 4.37Å; F578-D582 HydrophobicContact CZ-CB 3.92Å; F578-C583 HydrophobicContact CE1-CB 3.88Å
579	T	66.6	Low	62.6	Low	71 Å²	71	92.1 Å²	92.1	44%	0.436	50%	0.503	S	S	.	.			trans	-97.7	159	179.6	67.1	0	0	0	0	111.5	L574 K581 D582 C583	L574-T579 VanDerWaalsContact CD2-C 3.42Å; L574-T579 WeakPolarHBondContact CD2-O 3.48Å; T579-K581 PolarHBondContact O-N 3.29Å; T579-K581 VanDerWaalsContact O-N 3.1Å; T579-D582 WeakPolarHBondContact CB-OD2 3.19Å; T579-D582 PolarHBondContact N-OD2 3.28Å; T579-D582 WeakPolarHBondContact O-CB 3.43Å; T579-D582 PolarHBondContact O-N 3.48Å; T579-D582 PolarHBondContact OG1-N 3.43Å; T579-D582 PolarHBondContact OG1-OD2 2.98Å; T579-C583 PolarHBondContact O-N 3.03Å
580	A	66.1	Low	63.4	Low	22 Å²	22	87 Å²	87	18%	0.182	47%	0.467	C	S	.	.	H	α-helix	trans	-54	-30.4	174.2	0	0	0	0	0	112.5	C583 E584 V590	A580-C583 WeakPolarHBondContact O-CB 3.33Å; A580-C583 PolarHBondContact O-N 3.18Å; A580-E584 PolarHBondContact O-N 3.24Å; A580-V590 HydrophobicContact CB-CG1 4.08Å; A580-V590 HydrophobicContact CB-CG2 4.36Å
581	K	67.5	Low	63.9	Low	134 Å²	134	87.9 Å²	87.9	58%	0.583	46%	0.462	S	S	*	.	H	α-helix	trans	-69.2	-37.2	175	-66.9	-175.9	174.8	-174.4	0	113.1	T579 C583 E584 L585	T579-K581 PolarHBondContact O-N 3.29Å; T579-K581 VanDerWaalsContact O-N 3.1Å; K581-C583 VanDerWaalsContact C-N 3.3Å; K581-E584 PolarHBondContact O-N 3.08Å; K581-L585 WeakPolarHBondContact O-CB 3.45Å; K581-L585 VanDerWaalsContact O-CG 3.3Å; K581-L585 WeakPolarHBondContact O-CG 3.48Å; K581-L585 PolarHBondContact O-N 2.65Å
582	D	71.3	Confident	64.4	Low	60 Å²	60	86.5 Å²	86.5	32%	0.321	46%	0.457	S	S	.	.	H	α-helix	trans	-67.5	-36.5	178	-55.3	-46.1	0	0	0	110.4	F578 T579 L585 D586	F578-D582 HydrophobicContact CD2-CB 3.81Å; F578-D582 HydrophobicContact CE1-CB 4.47Å; F578-D582 HydrophobicContact CE2-CB 3.57Å; F578-D582 HydrophobicContact CG-CB 4.37Å; F578-D582 HydrophobicContact CZ-CB 3.92Å; T579-D582 WeakPolarHBondContact CB-OD2 3.19Å; T579-D582 PolarHBondContact N-OD2 3.28Å; T579-D582 WeakPolarHBondContact O-CB 3.43Å; T579-D582 PolarHBondContact O-N 3.48Å; T579-D582 PolarHBondContact OG1-N 3.43Å; T579-D582 PolarHBondContact OG1-OD2 2.98Å; D582-L585 PolarHBondContact O-N 3.4Å; D582-D586 PolarHBondContact O-N 3.05Å; D582-D586 VanDerWaalsContact O-N 3.13Å
583	C	72.2	Confident	64.6	Low	0 Å²	0	85.3 Å²	85.3	0%	0	45%	0.452	C	S	.	.	H	α-helix	trans	-61.7	-46.2	172.4	177.5	0	0	0	0	112.9	C562 F578 T579 A580 K581 D586 G587 G588 V590	C562-C583 VanDerWaalsContact CA-SG 3.51Å; C562-C583 HydrophobicContact CB-CB 3.74Å; C562-C583 WeakPolarHBondContact CB-SG 3.3Å; C562-C583 WeakPolarHBondContact SG-CB 3.39Å; C562-C583 CovalentContact SG-SG 2.01Å; C562-C583 PolarHBondContact SG-SG 3.01Å; F578-C583 HydrophobicContact CE1-CB 3.88Å; T579-C583 PolarHBondContact O-N 3.03Å; A580-C583 WeakPolarHBondContact O-CB 3.33Å; A580-C583 PolarHBondContact O-N 3.18Å; K581-C583 VanDerWaalsContact C-N 3.3Å; C583-D586 PolarHBondContact O-N 3.23Å; C583-G587 PolarHBondContact O-N 3.36Å; C583-G588 WeakPolarHBondContact O-CA 3.37Å; C583-G588 PolarHBondContact O-N 2.9Å; C583-V590 HydrophobicContact CB-CG1 4.37Å
584	E	70.2	Confident	64.8	Low	103 Å²	103	85 Å²	85	48%	0.481	45%	0.448	S	S	.	.	H	α-helix	trans	-65.9	-38	177.9	-73.5	174.1	-179.4	0	0	112.1	A580 K581 D586 G587 V590 H596	A580-E584 PolarHBondContact O-N 3.24Å; K581-E584 PolarHBondContact O-N 3.08Å; E584-D586 VanDerWaalsContact C-N 3.28Å; E584-D586 PolarHBondContact O-N 3.2Å; E584-G587 PolarHBondContact O-N 3.26Å; E584-V590 HydrophobicContact CG-CG2 3.93Å; E584-H596 IonicContact OE1-CE1 2.81Å; E584-H596 IonicContact OE1-NE2 3.88Å
585	L	72.4	Confident	65.1	Low	146 Å²	146	84.3 Å²	84.3	76%	0.764	45%	0.446	S	S	*	.	H	α-helix	trans	-63.4	-33.6	175.3	-77.7	166	0	0	0	112.6	K581 D582 G587	K581-L585 WeakPolarHBondContact O-CB 3.45Å; K581-L585 VanDerWaalsContact O-CG 3.3Å; K581-L585 WeakPolarHBondContact O-CG 3.48Å; K581-L585 PolarHBondContact O-N 2.65Å; D582-L585 PolarHBondContact O-N 3.4Å; L585-G587 PolarHBondContact O-N 3.43Å
586	D	70.2	Confident	65.4	Low	125 Å²	125	78.9 Å²	78.9	67%	0.668	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	7.1	177.8	-132.5	28.4	0	0	0	113	D582 C583 E584 G588	D582-D586 PolarHBondContact O-N 3.05Å; D582-D586 VanDerWaalsContact O-N 3.13Å; C583-D586 PolarHBondContact O-N 3.23Å; E584-D586 VanDerWaalsContact C-N 3.28Å; E584-D586 PolarHBondContact O-N 3.2Å; D586-G588 VanDerWaalsContact C-N 3.35Å
587	G	68.2	Low	65.5	Low	63 Å²	63	73.9 Å²	73.9	65%	0.649	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	18.5	179.8	0	0	0	0	0	114.4	C583 E584 L585	C583-G587 PolarHBondContact O-N 3.36Å; E584-G587 PolarHBondContact O-N 3.26Å; L585-G587 PolarHBondContact O-N 3.43Å
588	G	71.2	Confident	65.9	Low	7 Å²	7	71.1 Å²	71.1	7%	0.072	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-90.4	157.6	173.9	0	0	0	0	0	113.5	V563 C583 D586	V563-G588 CarbonylContact O-C 3.53Å; V563-G588 WeakPolarHBondContact O-CA 3.47Å; C583-G588 WeakPolarHBondContact O-CA 3.37Å; C583-G588 PolarHBondContact O-N 2.9Å; D586-G588 VanDerWaalsContact C-N 3.35Å
589	T	65.6	Low	66.2	Low	81 Å²	81	71.6 Å²	71.6	50%	0.497	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.8	171.1	56.9	0	0	0	0	110.4	V563	V563-T589 PolarHBondContact N-O 3.37Å; V563-T589 PolarHBondContact O-N 3.06Å
590	V	67.3	Low	66.7	Low	20 Å²	20	73.5 Å²	73.5	12%	0.121	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	130.3	178.6	-121.3	0	0	0	0	110.1	L574 A580 C583 E584 C595	L574-V590 HydrophobicContact CD1-CG1 3.65Å; A580-V590 HydrophobicContact CB-CG1 4.08Å; A580-V590 HydrophobicContact CB-CG2 4.36Å; C583-V590 HydrophobicContact CB-CG1 4.37Å; E584-V590 HydrophobicContact CG-CG2 3.93Å; V590-C595 HydrophobicContact CB-CB 4.37Å; V590-C595 HydrophobicContact CG1-CB 4.31Å
591	H	63.2	Low	67.7	Low	102 Å²	102	72.6 Å²	72.6	47%	0.472	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.7	176	-78.9	-75.7	0	0	0	111.1	H561	H561-H591 VanDerWaalsContact CE1-CB 3.42Å; H561-H591 WeakPolarHBondContact CE1-CB 3.49Å; H561-H591 PolarHBondContact CE1-O 2.83Å; H561-H591 PolarHBondContact N-O 3.48Å; H561-H591 PolarHBondContact ND1-O 3.33Å; H561-H591 WeakPolarHBondContact NE2-CB 3.39Å; H561-H591 PolarHBondContact O-N 3.06Å
592	G	64.2	Low	68.8	Low	33 Å²	33	67.5 Å²	67.5	34%	0.34	37%	0.365	S	S	.	.	S	Bend	trans	133.9	141.5	179.8	0	0	0	0	0	111.9	R594 C595	G592-R594 PolarHBondContact O-N 3.48Å; G592-C595 PolarHBondContact O-N 2.9Å; G592-C595 PolarHBondContact O-SG 2.97Å
593	L	59.5	Low	69.7	Low	92 Å²	92	69.4 Å²	69.4	48%	0.482	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-61	-28.9	-179.6	-81.9	73.8	0	0	0	112.1	E557 C595 F597	E557-L593 VanDerWaalsContact OE1-CD1 3.28Å; E557-L593 WeakPolarHBondContact OE1-CD1 3.42Å; E557-L593 WeakPolarHBondContact OE2-CB 3.38Å; E557-L593 VanDerWaalsContact OE2-CD1 3.26Å; E557-L593 WeakPolarHBondContact OE2-CD1 3.5Å; E557-L593 VanDerWaalsContact OE2-CD2 3.26Å; E557-L593 WeakPolarHBondContact OE2-CD2 3.34Å; E557-L593 VanDerWaalsContact OE2-CG 3.31Å; E557-L593 WeakPolarHBondContact OE2-CG 3.41Å; L593-C595 VanDerWaalsContact C-N 3.28Å; L593-C595 PolarHBondContact O-N 3.45Å; L593-F597 VanDerWaalsContact O-CB 3.29Å; L593-F597 WeakPolarHBondContact O-CB 3.32Å
594	R	60.6	Low	70.7	Confident	89 Å²	89	70.2 Å²	70.2	34%	0.336	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-67	-17.4	179.7	-75.7	177.6	164.7	-170.4	-9.1	115.3	L554 G592	L554-R594 VanDerWaalsContact O-CZ 3.29Å; L554-R594 PolarHBondContact O-NE 3.38Å; L554-R594 PolarHBondContact O-NH2 2.91Å; L554-R594 VanDerWaalsContact O-NH2 3.15Å; G592-R594 PolarHBondContact O-N 3.48Å
595	C	61.7	Low	71.8	Confident	17 Å²	17	65.3 Å²	65.3	12%	0.115	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-80.5	-31	-163.1	-46	0	0	0	0	113.2	C560 V590 G592 L593	C560-C595 WeakPolarHBondContact CA-SG 3.16Å; C560-C595 HydrophobicContact CB-CB 4.13Å; C560-C595 WeakPolarHBondContact CB-SG 3.43Å; C560-C595 WeakPolarHBondContact SG-CA 3.31Å; C560-C595 WeakPolarHBondContact SG-CB 3.49Å; C560-C595 PolarHBondContact SG-N 3.06Å; C560-C595 CovalentContact SG-SG 2.03Å; C560-C595 PolarHBondContact SG-SG 2.79Å; V590-C595 HydrophobicContact CB-CB 4.37Å; V590-C595 HydrophobicContact CG1-CB 4.31Å; G592-C595 PolarHBondContact O-N 2.9Å; G592-C595 PolarHBondContact O-SG 2.97Å; L593-C595 VanDerWaalsContact C-N 3.28Å; L593-C595 PolarHBondContact O-N 3.45Å
596	H	57.3	Low	72.8	Confident	92 Å²	92	61 Å²	61	43%	0.426	33%	0.333	S	S	.	.	S	Bend	trans	-124.6	16.2	177.1	-58.3	-76.5	0	0	0	112.2	E584 Y598	E584-H596 IonicContact OE1-CE1 2.81Å; E584-H596 IonicContact OE1-NE2 3.88Å; H596-Y598 WeakPolarHBondContact O-CD2 3.24Å; H596-Y598 PolarHBondContact O-N 3.39Å; H596-Y598 VanDerWaalsContact O-N 3.12Å
597	F	61.2	Low	73.9	Confident	67 Å²	67	59.9 Å²	59.9	29%	0.294	33%	0.327	S	S	.	.			trans	-77.4	102.4	176.5	-170.1	-99	0	0	0	110.6	V548 L554 L593 P599	V548-F597 HydrophobicContact CB-CE2 4.08Å; V548-F597 HydrophobicContact CB-CZ 4.03Å; V548-F597 HydrophobicContact CG2-CD2 4.36Å; V548-F597 HydrophobicContact CG2-CE2 3.56Å; V548-F597 HydrophobicContact CG2-CZ 4.03Å; L554-F597 HydrophobicContact CD1-CD1 4.15Å; L554-F597 HydrophobicContact CD1-CD2 4.19Å; L554-F597 HydrophobicContact CD1-CE1 4.24Å; L554-F597 HydrophobicContact CD1-CE2 4.29Å; L554-F597 HydrophobicContact CD1-CG 4.12Å; L554-F597 HydrophobicContact CD1-CZ 4.31Å; L554-F597 HydrophobicContact CD2-CD1 3.74Å; L554-F597 HydrophobicContact CD2-CE1 4.05Å; L554-F597 HydrophobicContact CD2-CG 4.32Å; L593-F597 VanDerWaalsContact O-CB 3.29Å; L593-F597 WeakPolarHBondContact O-CB 3.32Å; F597-P599 HydrophobicContact CE1-CB 4.2Å
598	Y	65.4	Low	75.2	Confident	102 Å²	102	56.9 Å²	56.9	40%	0.4	30%	0.296	S	S	.	.			trans	-104	123.5	161.3	-63.2	-90.1	0	0	0	107	H596 I601 K658	H596-Y598 WeakPolarHBondContact O-CD2 3.24Å; H596-Y598 PolarHBondContact O-N 3.39Å; H596-Y598 VanDerWaalsContact O-N 3.12Å; Y598-I601 VanDerWaalsContact CB-CD1 3.41Å; Y598-I601 HydrophobicContact CD2-CD1 3.9Å; Y598-I601 HydrophobicContact CG-CD1 3.91Å; Y598-K658 HydrophobicContact CE1-CD 4.22Å; Y598-K658 HydrophobicContact CE2-CD 4.44Å; Y598-K658 PolarHBondContact OH-NZ 3.35Å
599	P	68.1	Low	76.3	Confident	78 Å²	78	57.2 Å²	57.2	51%	0.506	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	150.2	176.5	25	-32.6	0	0	0	110.7	F597 I601	F597-P599 HydrophobicContact CE1-CB 4.2Å; P599-I601 VanDerWaalsContact C-N 3.27Å; P599-I601 PolarHBondContact O-N 3.39Å; P599-I601 VanDerWaalsContact O-N 3.09Å
600	D	78.2	Confident	77.7	Confident	110 Å²	110	57.1 Å²	57.1	59%	0.588	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	3.3	169.6	-50.9	-38.4	0	0	0	118.3	F602 L603 F604	D600-F602 VanDerWaalsContact C-N 3.32Å; D600-F602 PolarHBondContact O-N 2.7Å; D600-L603 PolarHBondContact O-N 2.84Å; D600-F604 WeakPolarHBondContact O-CB 3.32Å; D600-F604 PolarHBondContact O-N 3.2Å
601	I	87	Confident	79.1	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.015	30%	0.297	C	S	.	.	H	α-helix	trans	-54.9	-47.4	178.3	-69.7	-172.9	0	0	0	111.6	H545 Y598 P599 S605	H545-I601 HydrophobicContact CB-CB 4.37Å; H545-I601 HydrophobicContact CB-CG2 4.33Å; Y598-I601 VanDerWaalsContact CB-CD1 3.41Å; Y598-I601 HydrophobicContact CD2-CD1 3.9Å; Y598-I601 HydrophobicContact CG-CD1 3.91Å; P599-I601 VanDerWaalsContact C-N 3.27Å; P599-I601 PolarHBondContact O-N 3.39Å; P599-I601 VanDerWaalsContact O-N 3.09Å; I601-S605 VanDerWaalsContact O-CB 3.32Å; I601-S605 WeakPolarHBondContact O-CB 3.34Å; I601-S605 PolarHBondContact O-N 3.48Å; I601-S605 PolarHBondContact O-OG 3.39Å
602	F	89.6	Confident	80.5	Confident	28 Å²	28	53.6 Å²	53.6	12%	0.123	28%	0.275	C	S	.	.	H	α-helix	trans	-67	-44.2	-179.4	171.7	-100.3	0	0	0	112	M538 I541 Y542 H545 I547 D600 F604 S605 L606	M538-F602 HydrophobicContact CG-CE2 4.05Å; M538-F602 HydrophobicContact SD-CD2 4.37Å; M538-F602 HydrophobicContact SD-CE2 3.75Å; I541-F602 HydrophobicContact CG2-CD2 4.23Å; Y542-F602 VanDerWaalsContact CA-CD2 3.48Å; Y542-F602 VanDerWaalsContact CB-CE2 3.45Å; Y542-F602 AromaticContact CD2-CD1 3.83Å; Y542-F602 HydrophobicContact CD2-CD1 3.83Å; Y542-F602 HydrophobicContact CD2-CD2 4.2Å; Y542-F602 AromaticContact CD2-CE1 3.74Å; Y542-F602 HydrophobicContact CD2-CE1 3.74Å; Y542-F602 HydrophobicContact CD2-CE2 4.15Å; Y542-F602 HydrophobicContact CD2-CG 4.05Å; Y542-F602 AromaticContact CD2-CZ 3.9Å; Y542-F602 HydrophobicContact CD2-CZ 3.9Å; Y542-F602 HydrophobicContact CE2-CE1 4.49Å; Y542-F602 HydrophobicContact CG-CD2 4.48Å; Y542-F602 HydrophobicContact CG-CE2 4.26Å; Y542-F602 HydrophobicContact CG-CZ 4.27Å; H545-F602 HydrophobicContact CB-CB 4.41Å; H545-F602 VanDerWaalsContact O-CB 3.24Å; H545-F602 WeakPolarHBondContact O-CB 3.38Å; I547-F602 HydrophobicContact CD1-CD1 3.71Å; I547-F602 HydrophobicContact CD1-CE1 3.98Å; I547-F602 HydrophobicContact CG1-CD1 3.77Å; I547-F602 HydrophobicContact CG1-CE1 4.46Å; D600-F602 VanDerWaalsContact C-N 3.32Å; D600-F602 PolarHBondContact O-N 2.7Å; F602-F604 VanDerWaalsContact C-N 3.29Å; F602-F604 PolarHBondContact O-N 2.92Å; F602-S605 WeakPolarHBondContact O-CB 3.44Å; F602-S605 PolarHBondContact O-N 3.09Å; F602-S605 VanDerWaalsContact O-N 3.13Å; F602-L606 WeakPolarHBondContact O-CB 3.33Å; F602-L606 PolarHBondContact O-N 3.13Å
603	L	90.6	Very high	81.9	Confident	99 Å²	99	54.6 Å²	54.6	52%	0.518	27%	0.269	S	S	.	.	H	α-helix	trans	-61.6	-41	178.9	-176.3	65.7	0	0	0	111.1	D600 L606 L607	D600-L603 PolarHBondContact O-N 2.84Å; L603-L606 PolarHBondContact O-N 3.14Å; L603-L607 PolarHBondContact O-N 3.35Å
604	F	92.7	Very high	83.6	Confident	18 Å²	18	54.6 Å²	54.6	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-68.9	-36.8	174.8	-174.9	-117.1	0	0	0	112.3	D600 F602 L606 L607 L608 V651 V655 L657 V659	D600-F604 WeakPolarHBondContact O-CB 3.32Å; D600-F604 PolarHBondContact O-N 3.2Å; F602-F604 VanDerWaalsContact C-N 3.29Å; F602-F604 PolarHBondContact O-N 2.92Å; F604-L606 VanDerWaalsContact C-N 3.34Å; F604-L606 PolarHBondContact O-N 2.77Å; F604-L607 HydrophobicContact CD2-CD2 4.14Å; F604-L607 HydrophobicContact CE2-CD2 4.38Å; F604-L607 WeakPolarHBondContact O-CB 3.14Å; F604-L607 PolarHBondContact O-N 2.84Å; F604-L608 HydrophobicContact CD1-CD1 4.02Å; F604-L608 HydrophobicContact CD1-CG 4.35Å; F604-L608 HydrophobicContact CE1-CD1 3.58Å; F604-L608 HydrophobicContact CE1-CD2 4.36Å; F604-L608 HydrophobicContact CE1-CG 3.97Å; F604-L608 HydrophobicContact CE2-CD2 4.34Å; F604-L608 HydrophobicContact CE2-CG 4.29Å; F604-L608 HydrophobicContact CZ-CD1 4Å; F604-L608 HydrophobicContact CZ-CD2 3.9Å; F604-L608 HydrophobicContact CZ-CG 3.92Å; F604-L608 WeakPolarHBondContact O-CG 3.38Å; F604-L608 PolarHBondContact O-N 2.87Å; F604-V651 HydrophobicContact CZ-CG1 4.42Å; F604-V655 HydrophobicContact CD2-CG1 4.31Å; F604-V655 HydrophobicContact CE1-CB 4.19Å; F604-V655 HydrophobicContact CE1-CG1 4.1Å; F604-V655 HydrophobicContact CE2-CB 3.98Å; F604-V655 HydrophobicContact CE2-CG1 3.83Å; F604-V655 HydrophobicContact CE2-CG2 3.8Å; F604-V655 HydrophobicContact CZ-CB 3.57Å; F604-V655 HydrophobicContact CZ-CG1 3.73Å; F604-V655 HydrophobicContact CZ-CG2 3.77Å; F604-L657 HydrophobicContact CB-CD1 3.71Å; F604-L657 HydrophobicContact CD1-CB 3.92Å; F604-L657 HydrophobicContact CD1-CD1 3.63Å; F604-L657 HydrophobicContact CD1-CG 4.38Å; F604-L657 HydrophobicContact CD2-CD1 4.29Å; F604-L657 HydrophobicContact CE1-CB 4.21Å; F604-L657 HydrophobicContact CE1-CD1 4.33Å; F604-L657 HydrophobicContact CG-CD1 3.61Å; F604-V659 HydrophobicContact CD1-CG1 3.45Å; F604-V659 VanDerWaalsContact CD1-CG1 3.45Å; F604-V659 HydrophobicContact CE1-CG1 3.91Å
605	S	92.6	Very high	85.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-42.3	172.7	-62.3	0	0	0	0	111.7	I601 F602 L607 L608 F609 P811	I601-S605 VanDerWaalsContact O-CB 3.32Å; I601-S605 WeakPolarHBondContact O-CB 3.34Å; I601-S605 PolarHBondContact O-N 3.48Å; I601-S605 PolarHBondContact O-OG 3.39Å; F602-S605 WeakPolarHBondContact O-CB 3.44Å; F602-S605 PolarHBondContact O-N 3.09Å; F602-S605 VanDerWaalsContact O-N 3.13Å; S605-L607 VanDerWaalsContact C-N 3.34Å; S605-L608 PolarHBondContact O-N 3.38Å; S605-F609 WeakPolarHBondContact O-CB 3.44Å; S605-F609 PolarHBondContact O-N 3.15Å; S605-P811 VanDerWaalsContact O-CB 3.31Å; S605-P811 WeakPolarHBondContact O-CB 3.31Å
606	L	93.8	Very high	86.6	Confident	56 Å²	56	50.9 Å²	50.9	29%	0.293	25%	0.254	S	S	.	.	H	α-helix	trans	-63.2	-40.4	173.3	-178.6	64.4	0	0	0	111.4	M538 F602 L603 F604 F609 L610	M538-L606 HydrophobicContact CG-CD1 4.38Å; M538-L606 HydrophobicContact SD-CB 4.44Å; M538-L606 HydrophobicContact SD-CD1 4.45Å; F602-L606 WeakPolarHBondContact O-CB 3.33Å; F602-L606 PolarHBondContact O-N 3.13Å; L603-L606 PolarHBondContact O-N 3.14Å; F604-L606 VanDerWaalsContact C-N 3.34Å; F604-L606 PolarHBondContact O-N 2.77Å; L606-F609 PolarHBondContact O-N 2.85Å; L606-L610 HydrophobicContact CG-CD1 4.36Å; L606-L610 WeakPolarHBondContact O-CG 3.43Å; L606-L610 PolarHBondContact O-N 3.41Å
607	L	94.1	Very high	88.2	Confident	101 Å²	101	51.3 Å²	51.3	53%	0.529	25%	0.253	S	S	.	.	H	α-helix	trans	-62.7	-46.3	174.7	-178.4	66	0	0	0	111.6	L603 F604 S605 F609 L610 L611	L603-L607 PolarHBondContact O-N 3.35Å; F604-L607 HydrophobicContact CD2-CD2 4.14Å; F604-L607 HydrophobicContact CE2-CD2 4.38Å; F604-L607 WeakPolarHBondContact O-CB 3.14Å; F604-L607 PolarHBondContact O-N 2.84Å; S605-L607 VanDerWaalsContact C-N 3.34Å; L607-F609 VanDerWaalsContact C-N 3.33Å; L607-F609 PolarHBondContact O-N 3.33Å; L607-L610 PolarHBondContact O-N 3.48Å; L607-L611 WeakPolarHBondContact O-CB 3.33Å; L607-L611 PolarHBondContact O-N 3.03Å
608	L	94.5	Very high	89.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-39.9	176.9	-73.6	178.4	0	0	0	112	F604 S605 L611 A612 V651 V659 P809 P811	F604-L608 HydrophobicContact CD1-CD1 4.02Å; F604-L608 HydrophobicContact CD1-CG 4.35Å; F604-L608 HydrophobicContact CE1-CD1 3.58Å; F604-L608 HydrophobicContact CE1-CD2 4.36Å; F604-L608 HydrophobicContact CE1-CG 3.97Å; F604-L608 HydrophobicContact CE2-CD2 4.34Å; F604-L608 HydrophobicContact CE2-CG 4.29Å; F604-L608 HydrophobicContact CZ-CD1 4Å; F604-L608 HydrophobicContact CZ-CD2 3.9Å; F604-L608 HydrophobicContact CZ-CG 3.92Å; F604-L608 WeakPolarHBondContact O-CG 3.38Å; F604-L608 PolarHBondContact O-N 2.87Å; S605-L608 PolarHBondContact O-N 3.38Å; L608-L611 HydrophobicContact CD2-CD2 4.42Å; L608-L611 PolarHBondContact O-N 3.41Å; L608-A612 WeakPolarHBondContact O-CB 3.5Å; L608-A612 PolarHBondContact O-N 3.4Å; L608-V651 HydrophobicContact CD2-CB 4.37Å; L608-V651 HydrophobicContact CD2-CG1 4.06Å; L608-V659 HydrophobicContact CD1-CG1 4.2Å; L608-V659 HydrophobicContact CD1-CG2 4.29Å; L608-P809 HydrophobicContact CD1-CB 4.13Å; L608-P809 HydrophobicContact CD1-CG 4.32Å; L608-P811 HydrophobicContact CB-CB 4.24Å
609	F	94.6	Very high	90.7	Very high	13 Å²	13	48 Å²	48	6%	0.057	25%	0.25	C	C	.	.	H	α-helix	trans	-61.6	-49.6	175.3	173.5	-91	0	0	0	112.3	M538 S605 L606 L607 A612 Y613 P811 L814 G815 L818	M538-F609 HydrophobicContact CE-CB 3.27Å; M538-F609 HydrophobicContact CE-CD1 4.23Å; M538-F609 HydrophobicContact CE-CD2 3.52Å; M538-F609 HydrophobicContact CE-CE2 4.36Å; M538-F609 HydrophobicContact CE-CG 3.44Å; M538-F609 VanDerWaalsContact CE-CG 3.44Å; S605-F609 WeakPolarHBondContact O-CB 3.44Å; S605-F609 PolarHBondContact O-N 3.15Å; L606-F609 PolarHBondContact O-N 2.85Å; L607-F609 VanDerWaalsContact C-N 3.33Å; L607-F609 PolarHBondContact O-N 3.33Å; F609-A612 PolarHBondContact O-N 2.97Å; F609-Y613 WeakPolarHBondContact O-CB 3.16Å; F609-Y613 PolarHBondContact O-N 3.12Å; F609-P811 WeakPolarHBondContact CA-O 3.06Å; F609-P811 HydrophobicContact CB-CB 4.43Å; F609-L814 HydrophobicContact CD2-CB 3.71Å; F609-L814 HydrophobicContact CE2-CB 3.77Å; F609-L814 WeakPolarHBondContact CE2-O 3.14Å; F609-G815 VanDerWaalsContact CD2-CA 3.45Å; F609-G815 WeakPolarHBondContact O-CA 3.33Å; F609-L818 HydrophobicContact CE1-CD2 3.61Å; F609-L818 HydrophobicContact CE2-CB 4.29Å; F609-L818 HydrophobicContact CZ-CB 3.88Å; F609-L818 HydrophobicContact CZ-CD2 3.44Å; F609-L818 VanDerWaalsContact CZ-CD2 3.44Å; F609-L818 HydrophobicContact CZ-CG 4.17Å
610	L	95.4	Very high	91.4	Very high	79 Å²	79	47.1 Å²	47.1	41%	0.414	24%	0.238	S	C	.	.	H	α-helix	trans	-66.5	-39	176.9	-69.7	175.9	0	0	0	111.6	L606 L607 Y613 L614	L606-L610 HydrophobicContact CG-CD1 4.36Å; L606-L610 WeakPolarHBondContact O-CG 3.43Å; L606-L610 PolarHBondContact O-N 3.41Å; L607-L610 PolarHBondContact O-N 3.48Å; L610-Y613 PolarHBondContact O-N 3.25Å; L610-L614 VanDerWaalsContact O-CB 3.28Å; L610-L614 WeakPolarHBondContact O-CB 3.48Å; L610-L614 WeakPolarHBondContact O-CG 3.23Å; L610-L614 PolarHBondContact O-N 2.88Å
611	L	95.7	Very high	91.7	Very high	49 Å²	49	47.9 Å²	47.9	26%	0.257	24%	0.236	S	C	.	.	H	α-helix	trans	-59.5	-49.5	176.4	179.5	67.7	0	0	0	110.8	L607 L608 Y613 L614 I615 V651	L607-L611 WeakPolarHBondContact O-CB 3.33Å; L607-L611 PolarHBondContact O-N 3.03Å; L608-L611 HydrophobicContact CD2-CD2 4.42Å; L608-L611 PolarHBondContact O-N 3.41Å; L611-Y613 PolarHBondContact O-N 3.25Å; L611-L614 PolarHBondContact O-N 3.42Å; L611-I615 HydrophobicContact CD1-CD1 3.76Å; L611-I615 HydrophobicContact CD1-CG1 4.18Å; L611-I615 HydrophobicContact CG-CD1 3.77Å; L611-I615 HydrophobicContact CG-CG1 4.48Å; L611-I615 WeakPolarHBondContact O-CB 3.31Å; L611-I615 VanDerWaalsContact O-CG1 3.25Å; L611-I615 WeakPolarHBondContact O-CG1 3.43Å; L611-I615 PolarHBondContact O-N 2.94Å; L611-V651 HydrophobicContact CD2-CB 4.21Å; L611-V651 HydrophobicContact CD2-CG1 4.15Å; L611-V651 HydrophobicContact CD2-CG2 4.1Å
612	A	93.7	Very high	91.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.2	-45	178.5	0	0	0	0	0	111.6	L608 F609 M616 S644 A648 A812 V816	L608-A612 WeakPolarHBondContact O-CB 3.5Å; L608-A612 PolarHBondContact O-N 3.4Å; F609-A612 PolarHBondContact O-N 2.97Å; A612-M616 VanDerWaalsContact O-CB 3.28Å; A612-M616 WeakPolarHBondContact O-CB 3.36Å; A612-M616 PolarHBondContact O-N 2.91Å; A612-S644 WeakPolarHBondContact CA-OG 3.41Å; A612-S644 WeakPolarHBondContact CB-OG 3.22Å; A612-S644 PolarHBondContact O-OG 3.32Å; A612-A648 HydrophobicContact CB-CB 4.37Å; A612-A812 HydrophobicContact CB-CB 4.14Å; A612-A812 WeakPolarHBondContact CB-O 3.42Å; A612-V816 HydrophobicContact CB-CG2 4.34Å
613	Y	94.1	Very high	90.8	Very high	53 Å²	53	51.4 Å²	51.4	21%	0.208	25%	0.25	C	C	.	.	H	α-helix	trans	-58.9	-49.6	174.7	172	-92.9	0	0	0	112.3	F609 L610 L611 M616 Y617 L818 H819 L822	F609-Y613 WeakPolarHBondContact O-CB 3.16Å; F609-Y613 PolarHBondContact O-N 3.12Å; L610-Y613 PolarHBondContact O-N 3.25Å; L611-Y613 PolarHBondContact O-N 3.25Å; Y613-M616 PolarHBondContact O-N 3.47Å; Y613-Y617 WeakPolarHBondContact O-CB 3.28Å; Y613-Y617 PolarHBondContact O-N 3.07Å; Y613-L818 HydrophobicContact CD2-CD2 4.13Å; Y613-L818 HydrophobicContact CD2-CG 4.29Å; Y613-H819 HydrophobicContact CD2-CB 3.6Å; Y613-H819 HydrophobicContact CE2-CB 3.86Å; Y613-H819 AromaticContact CE2-ND1 3.98Å; Y613-L822 HydrophobicContact CE2-CD1 3.94Å
614	L	94.9	Very high	89.8	Confident	93 Å²	93	51.9 Å²	51.9	49%	0.487	26%	0.257	S	S	.	.	H	α-helix	trans	-68.1	-40.6	-175.9	-73.5	172.3	0	0	0	112.3	L610 L611 S618	L610-L614 VanDerWaalsContact O-CB 3.28Å; L610-L614 WeakPolarHBondContact O-CB 3.48Å; L610-L614 WeakPolarHBondContact O-CG 3.23Å; L610-L614 PolarHBondContact O-N 2.88Å; L611-L614 PolarHBondContact O-N 3.42Å; L614-S618 VanDerWaalsContact O-CB 3.22Å; L614-S618 WeakPolarHBondContact O-CB 3.25Å; L614-S618 PolarHBondContact O-N 3.31Å; L614-S618 PolarHBondContact O-OG 3.13Å
615	I	94.1	Very high	89	Confident	27 Å²	27	52.1 Å²	52.1	14%	0.138	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-49.5	174.5	-70	170.5	0	0	0	109.3	L611 Y617 S618 L619 I647	L611-I615 HydrophobicContact CD1-CD1 3.76Å; L611-I615 HydrophobicContact CD1-CG1 4.18Å; L611-I615 HydrophobicContact CG-CD1 3.77Å; L611-I615 HydrophobicContact CG-CG1 4.48Å; L611-I615 WeakPolarHBondContact O-CB 3.31Å; L611-I615 VanDerWaalsContact O-CG1 3.25Å; L611-I615 WeakPolarHBondContact O-CG1 3.43Å; L611-I615 PolarHBondContact O-N 2.94Å; I615-Y617 PolarHBondContact O-N 3.42Å; I615-S618 PolarHBondContact O-N 2.81Å; I615-L619 HydrophobicContact CG2-CD1 3.6Å; I615-L619 HydrophobicContact CG2-CG 4.11Å; I615-L619 WeakPolarHBondContact O-CB 3.14Å; I615-L619 VanDerWaalsContact O-CG 3.28Å; I615-L619 WeakPolarHBondContact O-CG 3.28Å; I615-L619 PolarHBondContact O-N 3.29Å; I615-I647 HydrophobicContact CD1-CB 3.98Å; I615-I647 HydrophobicContact CD1-CD1 4.36Å; I615-I647 HydrophobicContact CD1-CG2 3.58Å; I615-I647 HydrophobicContact CG2-CD1 4.33Å
616	M	90.5	Very high	88	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-47.2	-179.7	-173.8	179.8	-177.8	0	0	111.8	A612 Y613 K620 P641 V816 H819 M820	A612-M616 VanDerWaalsContact O-CB 3.28Å; A612-M616 WeakPolarHBondContact O-CB 3.36Å; A612-M616 PolarHBondContact O-N 2.91Å; Y613-M616 PolarHBondContact O-N 3.47Å; M616-K620 WeakPolarHBondContact O-CB 3.42Å; M616-K620 PolarHBondContact O-N 2.89Å; M616-P641 HydrophobicContact CE-CB 4.32Å; M616-P641 HydrophobicContact CE-CG 4.07Å; M616-V816 HydrophobicContact CE-CG1 4.12Å; M616-V816 HydrophobicContact SD-CB 4.09Å; M616-V816 HydrophobicContact SD-CG1 3.7Å; M616-V816 HydrophobicContact SD-CG2 4.17Å; M616-H819 HydrophobicContact CE-CB 4.4Å; M616-H819 WeakPolarHBondContact CE-CD2 3.3Å; M616-H819 HydrophobicContact CG-CB 4.4Å; M616-H819 HydrophobicContact SD-CB 3.55Å; M616-H819 VanDerWaalsContact SD-CB 3.55Å; M616-H819 PolarHBondContact SD-CD2 2.83Å; M616-H819 VanDerWaalsContact SD-CG 3.54Å; M616-M820 HydrophobicContact CE-CE 3.25Å; M616-M820 HydrophobicContact CE-CG 3.69Å; M616-M820 HydrophobicContact CE-SD 4.35Å
617	Y	90.7	Very high	87.1	Confident	102 Å²	102	61.4 Å²	61.4	40%	0.4	32%	0.318	S	S	.	.	H	α-helix	trans	-60.6	-45.2	176.4	175.8	-102.7	0	0	0	112.3	Y613 I615 K620 K621	Y613-Y617 WeakPolarHBondContact O-CB 3.28Å; Y613-Y617 PolarHBondContact O-N 3.07Å; I615-Y617 PolarHBondContact O-N 3.42Å; Y617-K620 PolarHBondContact O-N 2.97Å; Y617-K621 HydrophobicContact CE1-CD 4.2Å; Y617-K621 VanDerWaalsContact O-CB 3.31Å; Y617-K621 WeakPolarHBondContact O-CB 3.33Å; Y617-K621 PolarHBondContact O-N 3.07Å
618	S	90.4	Very high	86.4	Confident	68 Å²	68	63.3 Å²	63.3	48%	0.476	32%	0.323	S	S	.	.	H	α-helix	trans	-66.8	-44.5	-177.8	-58.8	0	0	0	0	112.1	L614 I615 K621 F622	L614-S618 VanDerWaalsContact O-CB 3.22Å; L614-S618 WeakPolarHBondContact O-CB 3.25Å; L614-S618 PolarHBondContact O-N 3.31Å; L614-S618 PolarHBondContact O-OG 3.13Å; I615-S618 PolarHBondContact O-N 2.81Å; S618-K621 PolarHBondContact O-N 3.27Å; S618-F622 WeakPolarHBondContact O-CB 3.42Å; S618-F622 PolarHBondContact O-N 3.23Å
619	L	88.7	Confident	85.4	Confident	30 Å²	30	67.3 Å²	67.3	16%	0.157	35%	0.349	C	S	.	.	H	α-helix	trans	-68.3	-35.8	179	-64.7	177.5	0	0	0	112.1	I615 F622 L636 A640 F643	I615-L619 HydrophobicContact CG2-CD1 3.6Å; I615-L619 HydrophobicContact CG2-CG 4.11Å; I615-L619 WeakPolarHBondContact O-CB 3.14Å; I615-L619 VanDerWaalsContact O-CG 3.28Å; I615-L619 WeakPolarHBondContact O-CG 3.28Å; I615-L619 PolarHBondContact O-N 3.29Å; L619-F622 WeakPolarHBondContact O-CB 3.19Å; L619-F622 PolarHBondContact O-N 3.16Å; L619-L636 HydrophobicContact CD2-CD1 3.89Å; L619-L636 HydrophobicContact CD2-CD2 3.82Å; L619-L636 HydrophobicContact CD2-CG 3.73Å; L619-A640 HydrophobicContact CB-CB 3.47Å; L619-A640 VanDerWaalsContact CB-CB 3.47Å; L619-A640 HydrophobicContact CD1-CB 4.23Å; L619-F643 HydrophobicContact CD1-CB 3.69Å; L619-F643 HydrophobicContact CD1-CD2 4.28Å; L619-F643 HydrophobicContact CD1-CG 4.44Å
620	K	84.1	Confident	84.2	Confident	61 Å²	61	71.8 Å²	71.8	27%	0.265	37%	0.373	S	S	.	.	H	α-helix	trans	-66.2	-46.4	171.2	-78.3	-161.6	-174.6	176	0	112.1	M616 Y617 F622 R623 A640 H819	M616-K620 WeakPolarHBondContact O-CB 3.42Å; M616-K620 PolarHBondContact O-N 2.89Å; Y617-K620 PolarHBondContact O-N 2.97Å; K620-F622 PolarHBondContact O-N 3.36Å; K620-R623 VanDerWaalsContact O-CB 3.23Å; K620-R623 WeakPolarHBondContact O-CB 3.38Å; K620-R623 PolarHBondContact O-N 2.94Å; K620-R623 VanDerWaalsContact O-N 3.07Å; K620-A640 HydrophobicContact CG-CB 4.07Å; K620-H819 WeakPolarHBondContact CD-NE2 3.4Å; K620-H819 PolarHBondContact NZ-NE2 3.15Å
621	K	83.8	Confident	83	Confident	126 Å²	126	76.2 Å²	76.2	55%	0.548	39%	0.389	S	S	.	.	H	α-helix	trans	-63.3	-27.9	177.3	-172.1	171.2	-176.6	174.2	0	112.3	Y617 S618 R623 T624	Y617-K621 HydrophobicContact CE1-CD 4.2Å; Y617-K621 VanDerWaalsContact O-CB 3.31Å; Y617-K621 WeakPolarHBondContact O-CB 3.33Å; Y617-K621 PolarHBondContact O-N 3.07Å; S618-K621 PolarHBondContact O-N 3.27Å; K621-R623 PolarHBondContact O-N 3.5Å; K621-R623 VanDerWaalsContact O-N 3.15Å; K621-T624 PolarHBondContact O-N 3.44Å; K621-T624 PolarHBondContact O-OG1 2.86Å
622	F	82.2	Confident	82.2	Confident	41 Å²	41	76.9 Å²	76.9	18%	0.18	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-59.6	-23.1	175	-167.7	-101.1	0	0	0	112.7	S618 L619 K620 T624 S625 F627 F628 R633 L636	S618-F622 WeakPolarHBondContact O-CB 3.42Å; S618-F622 PolarHBondContact O-N 3.23Å; L619-F622 WeakPolarHBondContact O-CB 3.19Å; L619-F622 PolarHBondContact O-N 3.16Å; K620-F622 PolarHBondContact O-N 3.36Å; F622-T624 PolarHBondContact O-N 2.9Å; F622-T624 VanDerWaalsContact O-N 3.11Å; F622-S625 WeakPolarHBondContact O-CB 3.44Å; F622-S625 PolarHBondContact O-N 3.24Å; F622-F627 HydrophobicContact CE2-CB 4.38Å; F622-F628 HydrophobicContact CE1-CD2 4.21Å; F622-F628 HydrophobicContact CE2-CD2 4.11Å; F622-F628 HydrophobicContact CE2-CE2 4.35Å; F622-F628 HydrophobicContact CZ-CB 4.36Å; F622-F628 AromaticContact CZ-CD2 3.32Å; F622-F628 HydrophobicContact CZ-CD2 3.32Å; F622-F628 AromaticContact CZ-CE2 3.8Å; F622-F628 HydrophobicContact CZ-CE2 3.8Å; F622-F628 HydrophobicContact CZ-CG 4.1Å; F622-R633 HydrophobicContact CD1-CB 4.45Å; F622-R633 HydrophobicContact CD1-CG 4.04Å; F622-R633 HydrophobicContact CE1-CB 4.33Å; F622-R633 HydrophobicContact CE1-CG 4.33Å; F622-R633 VanDerWaalsContact O-CD 3.28Å; F622-R633 WeakPolarHBondContact O-CD 3.35Å; F622-R633 WeakPolarHBondContact O-CG 3.41Å; F622-L636 HydrophobicContact CD1-CD2 3.75Å; F622-L636 HydrophobicContact CE1-CD2 3.65Å; F622-L636 HydrophobicContact CG-CD2 4.4Å; F622-L636 HydrophobicContact CZ-CD2 4.2Å
623	R	74.9	Confident	81.6	Confident	63 Å²	63	79.6 Å²	79.6	24%	0.238	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-54.5	-31	175.8	-166.2	173.3	-178.3	151.4	4.4	113.7	K620 K621 R633 E634 A637	K620-R623 VanDerWaalsContact O-CB 3.23Å; K620-R623 WeakPolarHBondContact O-CB 3.38Å; K620-R623 PolarHBondContact O-N 2.94Å; K620-R623 VanDerWaalsContact O-N 3.07Å; K621-R623 PolarHBondContact O-N 3.5Å; K621-R623 VanDerWaalsContact O-N 3.15Å; R623-R633 WeakPolarHBondContact O-CD 3.28Å; R623-R633 WeakPolarHBondContact O-CG 3.23Å; R623-R633 PolarHBondContact O-NE 3.22Å; R623-R633 PolarHBondContact O-NH1 3.18Å; R623-E634 IonicContact NH2-OE1 3.7Å; R623-A637 HydrophobicContact CB-CB 3.77Å; R623-A637 HydrophobicContact CG-CB 4.17Å
624	T	70.3	Confident	80.5	Confident	109 Å²	109	78.6 Å²	78.6	67%	0.669	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-100.7	4.8	178.6	60.6	0	0	0	0	113.3	K621 F622	K621-T624 PolarHBondContact O-N 3.44Å; K621-T624 PolarHBondContact O-OG1 2.86Å; F622-T624 PolarHBondContact O-N 2.9Å; F622-T624 VanDerWaalsContact O-N 3.11Å
625	S	75.4	Confident	79.7	Confident	24 Å²	24	76.5 Å²	76.5	17%	0.168	39%	0.393	C	S	.	.			trans	-70.2	148.3	179.8	-176.3	0	0	0	0	111.8	F622 F627 R633	F622-S625 WeakPolarHBondContact O-CB 3.44Å; F622-S625 PolarHBondContact O-N 3.24Å; S625-F627 VanDerWaalsContact C-N 3.26Å; S625-F627 VanDerWaalsContact OG-CD2 3.25Å; S625-F627 WeakPolarHBondContact OG-CD2 3.48Å; S625-F627 PolarHBondContact OG-N 2.88Å; S625-R633 WeakPolarHBondContact O-CD 3.46Å; S625-R633 PolarHBondContact O-NH1 3.18Å
626	A	71.9	Confident	79.2	Confident	103 Å²	103	77.5 Å²	77.5	85%	0.851	40%	0.399	S	S	*	.	S	Bend	trans	-82.1	-5	172.8	0	0	0	0	0	113.2
627	F	74.7	Confident	78.6	Confident	147 Å²	147	77.9 Å²	77.9	65%	0.645	40%	0.402	S	S	*	.	S	Bend	trans	-84.2	139.1	177.1	-59.8	-68.8	0	0	0	110.1	F622 S625	F622-F627 HydrophobicContact CE2-CB 4.38Å; S625-F627 VanDerWaalsContact C-N 3.26Å; S625-F627 VanDerWaalsContact OG-CD2 3.25Å; S625-F627 WeakPolarHBondContact OG-CD2 3.48Å; S625-F627 PolarHBondContact OG-N 2.88Å
628	F	79.1	Confident	78.1	Confident	142 Å²	142	74.2 Å²	74.2	62%	0.623	39%	0.389	S	S	*	.	S	Bend	trans	70.8	155.9	-179.8	-61.3	-95.6	0	0	0	115.6	F622 V632	F622-F628 HydrophobicContact CE1-CD2 4.21Å; F622-F628 HydrophobicContact CE2-CD2 4.11Å; F622-F628 HydrophobicContact CE2-CE2 4.35Å; F622-F628 HydrophobicContact CZ-CB 4.36Å; F622-F628 AromaticContact CZ-CD2 3.32Å; F622-F628 HydrophobicContact CZ-CD2 3.32Å; F622-F628 AromaticContact CZ-CE2 3.8Å; F622-F628 HydrophobicContact CZ-CE2 3.8Å; F622-F628 HydrophobicContact CZ-CG 4.1Å; F628-V632 HydrophobicContact CB-CB 4.32Å; F628-V632 HydrophobicContact CB-CG1 4.23Å; F628-V632 HydrophobicContact CD1-CG1 4.17Å; F628-V632 HydrophobicContact CG-CG1 4.42Å
629	P	74.5	Confident	77.9	Confident	84 Å²	84	72.9 Å²	72.9	55%	0.545	38%	0.375	S	S	.	.			trans	-67.2	154.6	175.4	28	-36.2	0	0	0	111.9	K631 V632 R633	P629-K631 VanDerWaalsContact C-N 3.26Å; P629-K631 PolarHBondContact O-N 3.29Å; P629-K631 VanDerWaalsContact O-N 3.12Å; P629-V632 HydrophobicContact CG-CB 4.15Å; P629-V632 HydrophobicContact CG-CG2 3.79Å; P629-V632 PolarHBondContact O-N 2.69Å; P629-R633 PolarHBondContact O-N 2.77Å; P629-R633 VanDerWaalsContact O-N 3.07Å
630	D	69.4	Low	77.8	Confident	106 Å²	106	71.5 Å²	71.5	57%	0.567	37%	0.368	S	S	*	.	H	α-helix	trans	-50.8	-42.3	-175	-63.2	-48.4	0	0	0	113.7	V632 R633 E634	D630-V632 PolarHBondContact O-N 3.35Å; D630-R633 PolarHBondContact O-N 2.71Å; D630-R633 IonicContact OD1-CZ 3.35Å; D630-R633 IonicContact OD1-NE 2.8Å; D630-R633 IonicContact OD1-NH2 3.7Å; D630-R633 PolarHBondContact OD1-NH2 2.61Å; D630-E634 WeakPolarHBondContact O-CB 3.34Å; D630-E634 PolarHBondContact O-N 3.16Å
631	K	70.7	Confident	77.8	Confident	173 Å²	173	69.1 Å²	69.1	75%	0.752	36%	0.359	S	S	*	.	H	α-helix	trans	-60.5	-44.8	178.6	-65.5	-174.2	177.7	-174.8	0	113	P629 T635	P629-K631 VanDerWaalsContact C-N 3.26Å; P629-K631 PolarHBondContact O-N 3.29Å; P629-K631 VanDerWaalsContact O-N 3.12Å; K631-T635 WeakPolarHBondContact O-CB 3.24Å; K631-T635 VanDerWaalsContact O-CG2 3.23Å; K631-T635 WeakPolarHBondContact O-CG2 3.42Å; K631-T635 PolarHBondContact O-N 3.33Å; K631-T635 PolarHBondContact O-OG1 3.48Å
632	V	79.1	Confident	78	Confident	63 Å²	63	64.6 Å²	64.6	38%	0.382	34%	0.34	S	S	.	.	H	α-helix	trans	-69.9	-41.3	-179.7	174.6	0	0	0	0	109.9	F628 P629 D630 E634 T635 L636	F628-V632 HydrophobicContact CB-CB 4.32Å; F628-V632 HydrophobicContact CB-CG1 4.23Å; F628-V632 HydrophobicContact CD1-CG1 4.17Å; F628-V632 HydrophobicContact CG-CG1 4.42Å; P629-V632 HydrophobicContact CG-CB 4.15Å; P629-V632 HydrophobicContact CG-CG2 3.79Å; P629-V632 PolarHBondContact O-N 2.69Å; D630-V632 PolarHBondContact O-N 3.35Å; V632-E634 PolarHBondContact O-N 2.88Å; V632-T635 WeakPolarHBondContact CA-OG1 3.37Å; V632-T635 PolarHBondContact O-OG1 3.5Å; V632-L636 VanDerWaalsContact O-CB 3.22Å; V632-L636 WeakPolarHBondContact O-CB 3.27Å; V632-L636 PolarHBondContact O-N 2.74Å
633	R	79.9	Confident	78.4	Confident	57 Å²	57	66.2 Å²	66.2	22%	0.215	35%	0.348	C	S	.	.	H	α-helix	trans	-61.7	-43.5	177.8	-178.5	174.3	69.4	160.8	4.4	112.5	F622 R623 S625 P629 D630 A637	F622-R633 HydrophobicContact CD1-CB 4.45Å; F622-R633 HydrophobicContact CD1-CG 4.04Å; F622-R633 HydrophobicContact CE1-CB 4.33Å; F622-R633 HydrophobicContact CE1-CG 4.33Å; F622-R633 VanDerWaalsContact O-CD 3.28Å; F622-R633 WeakPolarHBondContact O-CD 3.35Å; F622-R633 WeakPolarHBondContact O-CG 3.41Å; R623-R633 WeakPolarHBondContact O-CD 3.28Å; R623-R633 WeakPolarHBondContact O-CG 3.23Å; R623-R633 PolarHBondContact O-NE 3.22Å; R623-R633 PolarHBondContact O-NH1 3.18Å; S625-R633 WeakPolarHBondContact O-CD 3.46Å; S625-R633 PolarHBondContact O-NH1 3.18Å; P629-R633 PolarHBondContact O-N 2.77Å; P629-R633 VanDerWaalsContact O-N 3.07Å; D630-R633 PolarHBondContact O-N 2.71Å; D630-R633 IonicContact OD1-CZ 3.35Å; D630-R633 IonicContact OD1-NE 2.8Å; D630-R633 IonicContact OD1-NH2 3.7Å; D630-R633 PolarHBondContact OD1-NH2 2.61Å; R633-A637 WeakPolarHBondContact O-CB 3.28Å; R633-A637 PolarHBondContact O-N 2.92Å; R633-A637 VanDerWaalsContact O-N 3.13Å
634	E	71.9	Confident	79.2	Confident	32 Å²	32	63.2 Å²	63.2	15%	0.15	34%	0.336	C	S	.	.	H	α-helix	trans	-68.2	-49	177.7	-169.5	-172.8	-171.1	0	0	111.7	S398 R623 D630 V632 L636 A637 N638	S398-E634 PolarHBondContact OG-OE1 3.12Å; S398-E634 PolarHBondContact OG-OE2 2.86Å; R623-E634 IonicContact NH2-OE1 3.7Å; D630-E634 WeakPolarHBondContact O-CB 3.34Å; D630-E634 PolarHBondContact O-N 3.16Å; V632-E634 PolarHBondContact O-N 2.88Å; E634-L636 VanDerWaalsContact C-N 3.34Å; E634-L636 PolarHBondContact O-N 3.01Å; E634-A637 PolarHBondContact O-N 3.45Å; E634-N638 WeakPolarHBondContact O-CB 3.47Å; E634-N638 PolarHBondContact O-N 3Å; E634-N638 PolarHBondContact O-ND2 2.88Å; E634-N638 PolarHBondContact O-OD1 2.89Å
635	T	76.8	Confident	80.2	Confident	48 Å²	48	58.2 Å²	58.2	29%	0.294	31%	0.305	S	S	.	.	H	α-helix	trans	-58.7	-46	177.8	51.7	0	0	0	0	111.6	K631 V632 A637 N638 F639	K631-T635 WeakPolarHBondContact O-CB 3.24Å; K631-T635 VanDerWaalsContact O-CG2 3.23Å; K631-T635 WeakPolarHBondContact O-CG2 3.42Å; K631-T635 PolarHBondContact O-N 3.33Å; K631-T635 PolarHBondContact O-OG1 3.48Å; V632-T635 WeakPolarHBondContact CA-OG1 3.37Å; V632-T635 PolarHBondContact O-OG1 3.5Å; T635-A637 VanDerWaalsContact C-N 3.33Å; T635-A637 PolarHBondContact O-N 2.94Å; T635-N638 PolarHBondContact O-N 3.07Å; T635-F639 VanDerWaalsContact O-CD2 3.28Å; T635-F639 WeakPolarHBondContact O-CD2 3.33Å; T635-F639 PolarHBondContact O-N 3.03Å
636	L	83.2	Confident	80.9	Confident	48 Å²	48	60.4 Å²	60.4	25%	0.251	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-39.1	179.5	-171.8	63.1	0	0	0	112.4	L619 F622 V632 E634 A640 F643	L619-L636 HydrophobicContact CD2-CD1 3.89Å; L619-L636 HydrophobicContact CD2-CD2 3.82Å; L619-L636 HydrophobicContact CD2-CG 3.73Å; F622-L636 HydrophobicContact CD1-CD2 3.75Å; F622-L636 HydrophobicContact CE1-CD2 3.65Å; F622-L636 HydrophobicContact CG-CD2 4.4Å; F622-L636 HydrophobicContact CZ-CD2 4.2Å; V632-L636 VanDerWaalsContact O-CB 3.22Å; V632-L636 WeakPolarHBondContact O-CB 3.27Å; V632-L636 PolarHBondContact O-N 2.74Å; E634-L636 VanDerWaalsContact C-N 3.34Å; E634-L636 PolarHBondContact O-N 3.01Å; L636-A640 PolarHBondContact O-N 3.01Å; L636-F643 HydrophobicContact CD1-CD2 3.86Å; L636-F643 HydrophobicContact CD1-CE2 3.68Å
637	A	79.2	Confident	82	Confident	9 Å²	9	58.8 Å²	58.8	7%	0.074	29%	0.294	C	S	.	.	H	α-helix	trans	-69.2	-39.5	175.6	0	0	0	0	0	112.5	R623 R633 E634 T635 F639 A640	R623-A637 HydrophobicContact CB-CB 3.77Å; R623-A637 HydrophobicContact CG-CB 4.17Å; R633-A637 WeakPolarHBondContact O-CB 3.28Å; R633-A637 PolarHBondContact O-N 2.92Å; R633-A637 VanDerWaalsContact O-N 3.13Å; E634-A637 PolarHBondContact O-N 3.45Å; T635-A637 VanDerWaalsContact C-N 3.33Å; T635-A637 PolarHBondContact O-N 2.94Å; A637-F639 VanDerWaalsContact C-N 3.34Å; A637-F639 PolarHBondContact O-N 2.66Å; A637-A640 WeakPolarHBondContact O-CB 3.44Å; A637-A640 PolarHBondContact O-N 3.11Å
638	N	80.4	Confident	82.9	Confident	24 Å²	24	51.8 Å²	51.8	13%	0.128	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-38.6	178.9	-69.5	-13	0	0	0	111.7	A405 E634 T635 A640	A405-N638 HydrophobicContact CB-CB 4.28Å; E634-N638 WeakPolarHBondContact O-CB 3.47Å; E634-N638 PolarHBondContact O-N 3Å; E634-N638 PolarHBondContact O-ND2 2.88Å; E634-N638 PolarHBondContact O-OD1 2.89Å; T635-N638 PolarHBondContact O-N 3.07Å; N638-A640 VanDerWaalsContact C-N 3.31Å
639	F	86.3	Confident	83.5	Confident	41 Å²	41	46 Å²	46	18%	0.18	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	7.1	176.5	-74.5	-78.7	0	0	0	113.8	A405 L408 T635 A637 P641 L642 F643	A405-F639 HydrophobicContact CB-CD1 3.57Å; A405-F639 HydrophobicContact CB-CD2 4.15Å; A405-F639 HydrophobicContact CB-CE1 3.55Å; A405-F639 HydrophobicContact CB-CE2 4.11Å; A405-F639 HydrophobicContact CB-CG 3.89Å; A405-F639 HydrophobicContact CB-CZ 3.83Å; L408-F639 HydrophobicContact CD1-CE1 4.4Å; T635-F639 VanDerWaalsContact O-CD2 3.28Å; T635-F639 WeakPolarHBondContact O-CD2 3.33Å; T635-F639 PolarHBondContact O-N 3.03Å; A637-F639 VanDerWaalsContact C-N 3.34Å; A637-F639 PolarHBondContact O-N 2.66Å; F639-P641 VanDerWaalsContact C-CD 3.48Å; F639-L642 HydrophobicContact CD1-CB 4.41Å; F639-L642 HydrophobicContact CD1-CD2 3.65Å; F639-L642 HydrophobicContact CE1-CD2 4.12Å; F639-L642 WeakPolarHBondContact O-CB 3.22Å; F639-L642 PolarHBondContact O-N 3.33Å; F639-F643 HydrophobicContact CB-CD2 3.56Å; F639-F643 HydrophobicContact CB-CE2 3.33Å; F639-F643 HydrophobicContact CB-CG 4.49Å; F639-F643 HydrophobicContact CB-CZ 4.09Å; F639-F643 HydrophobicContact CG-CE2 4.26Å; F639-F643 WeakPolarHBondContact O-CD2 3.23Å; F639-F643 PolarHBondContact O-N 3.05Å
640	A	86.6	Confident	84.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-51.8	-45.8	-177.2	0	0	0	0	0	114.4	L619 K620 L636 A637 N638 S644	L619-A640 HydrophobicContact CB-CB 3.47Å; L619-A640 VanDerWaalsContact CB-CB 3.47Å; L619-A640 HydrophobicContact CD1-CB 4.23Å; K620-A640 HydrophobicContact CG-CB 4.07Å; L636-A640 PolarHBondContact O-N 3.01Å; A637-A640 WeakPolarHBondContact O-CB 3.44Å; A637-A640 PolarHBondContact O-N 3.11Å; N638-A640 VanDerWaalsContact C-N 3.31Å; A640-S644 WeakPolarHBondContact O-CB 3.38Å; A640-S644 PolarHBondContact O-N 3.43Å
641	P	84	Confident	85.6	Confident	12 Å²	12	42.8 Å²	42.8	8%	0.078	22%	0.222	C	C	.	.	H	α-helix	trans	-64.4	-40.8	177.5	-19	32.4	0	0	0	112.4	F409 M616 F639 S644 I645 M820	F409-P641 HydrophobicContact CB-CB 4.29Å; F409-P641 HydrophobicContact CD2-CB 3.22Å; F409-P641 HydrophobicContact CD2-CG 3.86Å; F409-P641 HydrophobicContact CE2-CB 3.88Å; F409-P641 HydrophobicContact CE2-CG 4.47Å; F409-P641 HydrophobicContact CG-CB 3.88Å; F409-P641 HydrophobicContact CG-CG 4.12Å; M616-P641 HydrophobicContact CE-CB 4.32Å; M616-P641 HydrophobicContact CE-CG 4.07Å; F639-P641 VanDerWaalsContact C-CD 3.48Å; P641-S644 WeakPolarHBondContact O-CB 3.1Å; P641-S644 PolarHBondContact O-N 3.06Å; P641-I645 WeakPolarHBondContact O-CG1 3.38Å; P641-I645 PolarHBondContact O-N 3.39Å; P641-M820 HydrophobicContact CB-CE 4.39Å; P641-M820 HydrophobicContact CG-CE 4.27Å
642	L	87.4	Confident	86.6	Confident	30 Å²	30	34.6 Å²	34.6	16%	0.157	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-48.4	179.4	-178.7	67.1	0	0	0	111.1	L408 L412 F639 S644 I645 V646	L408-L642 HydrophobicContact CB-CD1 4.37Å; L408-L642 HydrophobicContact CB-CD2 4.48Å; L408-L642 HydrophobicContact CD1-CD2 3.79Å; L412-L642 HydrophobicContact CD1-CD1 3.69Å; F639-L642 HydrophobicContact CD1-CB 4.41Å; F639-L642 HydrophobicContact CD1-CD2 3.65Å; F639-L642 HydrophobicContact CE1-CD2 4.12Å; F639-L642 WeakPolarHBondContact O-CB 3.22Å; F639-L642 PolarHBondContact O-N 3.33Å; L642-S644 VanDerWaalsContact C-N 3.28Å; L642-S644 PolarHBondContact O-N 3.49Å; L642-I645 PolarHBondContact O-N 3.17Å; L642-V646 HydrophobicContact CD1-CG2 4.17Å; L642-V646 HydrophobicContact CG-CG2 4.29Å; L642-V646 WeakPolarHBondContact O-CB 3.3Å; L642-V646 VanDerWaalsContact O-CG2 3.31Å; L642-V646 WeakPolarHBondContact O-CG2 3.2Å; L642-V646 PolarHBondContact O-N 3.13Å
643	F	90.9	Very high	87.2	Confident	76 Å²	76	36 Å²	36	33%	0.333	19%	0.189	S	C	.	.	H	α-helix	trans	-62.4	-36.6	178	-73.4	-50.1	0	0	0	112.1	L619 L636 F639 V646 I647	L619-F643 HydrophobicContact CD1-CB 3.69Å; L619-F643 HydrophobicContact CD1-CD2 4.28Å; L619-F643 HydrophobicContact CD1-CG 4.44Å; L636-F643 HydrophobicContact CD1-CD2 3.86Å; L636-F643 HydrophobicContact CD1-CE2 3.68Å; F639-F643 HydrophobicContact CB-CD2 3.56Å; F639-F643 HydrophobicContact CB-CE2 3.33Å; F639-F643 HydrophobicContact CB-CG 4.49Å; F639-F643 HydrophobicContact CB-CZ 4.09Å; F639-F643 HydrophobicContact CG-CE2 4.26Å; F639-F643 WeakPolarHBondContact O-CD2 3.23Å; F639-F643 PolarHBondContact O-N 3.05Å; F643-V646 PolarHBondContact O-N 3.4Å; F643-I647 HydrophobicContact CB-CD1 4.29Å; F643-I647 VanDerWaalsContact O-CB 3.24Å; F643-I647 WeakPolarHBondContact O-CB 3.31Å; F643-I647 WeakPolarHBondContact O-CD1 3.4Å; F643-I647 WeakPolarHBondContact O-CG1 3.22Å; F643-I647 PolarHBondContact O-N 3.07Å
644	S	91.8	Very high	87.7	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.6	-49.7	174.3	175.5	0	0	0	0	111.9	A612 A640 P641 L642 A648 V816	A612-S644 WeakPolarHBondContact CA-OG 3.41Å; A612-S644 WeakPolarHBondContact CB-OG 3.22Å; A612-S644 PolarHBondContact O-OG 3.32Å; A640-S644 WeakPolarHBondContact O-CB 3.38Å; A640-S644 PolarHBondContact O-N 3.43Å; P641-S644 WeakPolarHBondContact O-CB 3.1Å; P641-S644 PolarHBondContact O-N 3.06Å; L642-S644 VanDerWaalsContact C-N 3.28Å; L642-S644 PolarHBondContact O-N 3.49Å; S644-A648 VanDerWaalsContact O-CB 3.23Å; S644-A648 WeakPolarHBondContact O-CB 3.28Å; S644-A648 PolarHBondContact O-N 3.44Å; S644-V816 WeakPolarHBondContact OG-CG2 3.3Å
645	I	90.7	Very high	88.5	Confident	3 Å²	3	42 Å²	42	2%	0.015	23%	0.228	C	C	.	.	H	α-helix	trans	-67	-46.1	179.5	-61.3	167.8	0	0	0	111	L412 P641 L642 A648 T649 I808 L813 V816	L412-I645 HydrophobicContact CB-CD1 4.09Å; L412-I645 HydrophobicContact CD1-CD1 3.76Å; L412-I645 HydrophobicContact CD1-CG2 4.4Å; P641-I645 WeakPolarHBondContact O-CG1 3.38Å; P641-I645 PolarHBondContact O-N 3.39Å; L642-I645 PolarHBondContact O-N 3.17Å; I645-A648 PolarHBondContact O-N 2.91Å; I645-T649 WeakPolarHBondContact O-CB 3.5Å; I645-T649 PolarHBondContact O-N 3.41Å; I645-T649 PolarHBondContact O-OG1 3.44Å; I645-I808 HydrophobicContact CG2-CG2 3.83Å; I645-L813 HydrophobicContact CD1-CD2 3.8Å; I645-L813 HydrophobicContact CG1-CD2 4.2Å; I645-L813 HydrophobicContact CG2-CD2 4.45Å; I645-V816 HydrophobicContact CG1-CG2 3.98Å
646	V	90.9	Very high	88.7	Confident	70 Å²	70	42.4 Å²	42.4	42%	0.424	24%	0.241	S	C	.	.	H	α-helix	trans	-63.9	-47.2	-177.9	171.9	0	0	0	0	111.2	L642 F643 T649 V650	L642-V646 HydrophobicContact CD1-CG2 4.17Å; L642-V646 HydrophobicContact CG-CG2 4.29Å; L642-V646 WeakPolarHBondContact O-CB 3.3Å; L642-V646 VanDerWaalsContact O-CG2 3.31Å; L642-V646 WeakPolarHBondContact O-CG2 3.2Å; L642-V646 PolarHBondContact O-N 3.13Å; F643-V646 PolarHBondContact O-N 3.4Å; V646-T649 PolarHBondContact O-N 2.75Å; V646-V650 WeakPolarHBondContact O-CG2 3.4Å; V646-V650 PolarHBondContact O-N 3.36Å
647	I	94	Very high	88.7	Confident	69 Å²	69	42.8 Å²	42.8	35%	0.354	24%	0.244	S	C	.	.	H	α-helix	trans	-64.9	-44	179.6	-66.2	166.5	0	0	0	110.3	I615 F643 T649 V650 V651	I615-I647 HydrophobicContact CD1-CB 3.98Å; I615-I647 HydrophobicContact CD1-CD1 4.36Å; I615-I647 HydrophobicContact CD1-CG2 3.58Å; I615-I647 HydrophobicContact CG2-CD1 4.33Å; F643-I647 HydrophobicContact CB-CD1 4.29Å; F643-I647 VanDerWaalsContact O-CB 3.24Å; F643-I647 WeakPolarHBondContact O-CB 3.31Å; F643-I647 WeakPolarHBondContact O-CD1 3.4Å; F643-I647 WeakPolarHBondContact O-CG1 3.22Å; F643-I647 PolarHBondContact O-N 3.07Å; I647-T649 VanDerWaalsContact C-N 3.29Å; I647-T649 PolarHBondContact O-N 2.93Å; I647-V650 PolarHBondContact O-N 3.11Å; I647-V651 HydrophobicContact CG2-CG2 4.41Å; I647-V651 WeakPolarHBondContact O-CG2 3.07Å; I647-V651 PolarHBondContact O-N 3.41Å
648	A	93.2	Very high	88.9	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-36.5	176.6	0	0	0	0	0	112.3	A612 S644 I645 V651 S652 A812	A612-A648 HydrophobicContact CB-CB 4.37Å; S644-A648 VanDerWaalsContact O-CB 3.23Å; S644-A648 WeakPolarHBondContact O-CB 3.28Å; S644-A648 PolarHBondContact O-N 3.44Å; I645-A648 PolarHBondContact O-N 2.91Å; A648-V651 PolarHBondContact O-N 2.84Å; A648-S652 WeakPolarHBondContact O-CB 3.48Å; A648-S652 PolarHBondContact O-N 2.59Å; A648-A812 HydrophobicContact CB-CB 3.52Å
649	T	92.3	Very high	89.1	Confident	21 Å²	21	47.1 Å²	47.1	13%	0.129	26%	0.26	C	S	.	.	H	α-helix	trans	-65.4	-44.7	174.9	-56.3	0	0	0	0	111.4	I645 V646 I647 S652 E653 M807 P809	I645-T649 WeakPolarHBondContact O-CB 3.5Å; I645-T649 PolarHBondContact O-N 3.41Å; I645-T649 PolarHBondContact O-OG1 3.44Å; V646-T649 PolarHBondContact O-N 2.75Å; I647-T649 VanDerWaalsContact C-N 3.29Å; I647-T649 PolarHBondContact O-N 2.93Å; T649-S652 WeakPolarHBondContact O-CB 3.21Å; T649-S652 PolarHBondContact O-N 2.95Å; T649-E653 PolarHBondContact O-N 3.11Å; T649-M807 HydrophobicContact CG2-CB 4.11Å; T649-M807 WeakPolarHBondContact CG2-O 3.4Å; T649-P809 WeakPolarHBondContact OG1-CD 3.15Å
650	V	94	Very high	89	Confident	79 Å²	79	46.5 Å²	46.5	48%	0.479	26%	0.26	S	S	.	.	H	α-helix	trans	-62.5	-44.4	176.2	171.5	0	0	0	0	110.9	V646 I647 S652 E653 L654	V646-V650 WeakPolarHBondContact O-CG2 3.4Å; V646-V650 PolarHBondContact O-N 3.36Å; I647-V650 PolarHBondContact O-N 3.11Å; V650-S652 VanDerWaalsContact C-N 3.34Å; V650-S652 PolarHBondContact O-N 3.25Å; V650-E653 PolarHBondContact O-N 3.07Å; V650-L654 HydrophobicContact CG1-CD1 3.84Å; V650-L654 HydrophobicContact CG1-CG 4.23Å; V650-L654 WeakPolarHBondContact O-CB 3.41Å; V650-L654 VanDerWaalsContact O-CG 3.24Å; V650-L654 WeakPolarHBondContact O-CG 3.36Å; V650-L654 PolarHBondContact O-N 3.16Å
651	V	93.9	Very high	88.9	Confident	44 Å²	44	49.8 Å²	49.8	27%	0.267	27%	0.274	S	S	.	.	H	α-helix	trans	-63	-41.7	176.3	171.4	0	0	0	0	111.3	F604 L608 L611 I647 A648 E653 L654 V655	F604-V651 HydrophobicContact CZ-CG1 4.42Å; L608-V651 HydrophobicContact CD2-CB 4.37Å; L608-V651 HydrophobicContact CD2-CG1 4.06Å; L611-V651 HydrophobicContact CD2-CB 4.21Å; L611-V651 HydrophobicContact CD2-CG1 4.15Å; L611-V651 HydrophobicContact CD2-CG2 4.1Å; I647-V651 HydrophobicContact CG2-CG2 4.41Å; I647-V651 WeakPolarHBondContact O-CG2 3.07Å; I647-V651 PolarHBondContact O-N 3.41Å; A648-V651 PolarHBondContact O-N 2.84Å; V651-E653 VanDerWaalsContact C-N 3.31Å; V651-E653 PolarHBondContact O-N 3.3Å; V651-L654 PolarHBondContact O-N 3.15Å; V651-V655 HydrophobicContact CG1-CG2 4.48Å; V651-V655 WeakPolarHBondContact O-CG2 3.13Å; V651-V655 PolarHBondContact O-N 3.08Å; V651-V655 VanDerWaalsContact O-N 3.07Å
652	S	92.6	Very high	88.5	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.007	27%	0.274	C	S	.	.	H	α-helix	trans	-58.8	-43.1	175.5	-174.8	0	0	0	0	112.1	A648 T649 V650 G656 V659	A648-S652 WeakPolarHBondContact O-CB 3.48Å; A648-S652 PolarHBondContact O-N 2.59Å; T649-S652 WeakPolarHBondContact O-CB 3.21Å; T649-S652 PolarHBondContact O-N 2.95Å; V650-S652 VanDerWaalsContact C-N 3.34Å; V650-S652 PolarHBondContact O-N 3.25Å; S652-G656 PolarHBondContact O-N 3.46Å; S652-G656 VanDerWaalsContact O-N 3.08Å; S652-V659 WeakPolarHBondContact OG-CG2 3.1Å
653	E	90.2	Very high	87.9	Confident	92 Å²	92	55 Å²	55	43%	0.43	30%	0.3	S	S	.	.	H	α-helix	trans	-75.9	-35.2	-178.7	-164	60.6	-158.1	0	0	112.5	T649 V650 V651 V655 G656 K661 M807	T649-E653 PolarHBondContact O-N 3.11Å; V650-E653 PolarHBondContact O-N 3.07Å; V651-E653 VanDerWaalsContact C-N 3.31Å; V651-E653 PolarHBondContact O-N 3.3Å; E653-V655 VanDerWaalsContact C-N 3.34Å; E653-V655 PolarHBondContact O-N 3.43Å; E653-G656 PolarHBondContact O-N 3.41Å; E653-K661 IonicContact OE2-NZ 3.33Å; E653-K661 PolarHBondContact OE2-NZ 3.22Å; E653-M807 HydrophobicContact CB-CE 4.46Å; E653-M807 HydrophobicContact CG-CE 3.65Å; E653-M807 WeakPolarHBondContact OE2-CE 3.46Å
654	L	92.1	Very high	87	Confident	141 Å²	141	51.7 Å²	51.7	74%	0.738	29%	0.286	S	S	*	.	H	α-helix	trans	-64.5	-36.9	175.1	-74.6	173.8	0	0	0	112.7	V650 V651	V650-L654 HydrophobicContact CG1-CD1 3.84Å; V650-L654 HydrophobicContact CG1-CG 4.23Å; V650-L654 WeakPolarHBondContact O-CB 3.41Å; V650-L654 VanDerWaalsContact O-CG 3.24Å; V650-L654 WeakPolarHBondContact O-CG 3.36Å; V650-L654 PolarHBondContact O-N 3.16Å; V651-L654 PolarHBondContact O-N 3.15Å
655	V	88.9	Confident	86.1	Confident	75 Å²	75	53.4 Å²	53.4	46%	0.455	30%	0.297	S	S	.	.	H	α-helix	trans	-79.1	-27	177.3	175.7	0	0	0	0	111.2	F604 V651 E653 L657	F604-V655 HydrophobicContact CD2-CG1 4.31Å; F604-V655 HydrophobicContact CE1-CB 4.19Å; F604-V655 HydrophobicContact CE1-CG1 4.1Å; F604-V655 HydrophobicContact CE2-CB 3.98Å; F604-V655 HydrophobicContact CE2-CG1 3.83Å; F604-V655 HydrophobicContact CE2-CG2 3.8Å; F604-V655 HydrophobicContact CZ-CB 3.57Å; F604-V655 HydrophobicContact CZ-CG1 3.73Å; F604-V655 HydrophobicContact CZ-CG2 3.77Å; V651-V655 HydrophobicContact CG1-CG2 4.48Å; V651-V655 WeakPolarHBondContact O-CG2 3.13Å; V651-V655 PolarHBondContact O-N 3.08Å; V651-V655 VanDerWaalsContact O-N 3.07Å; E653-V655 VanDerWaalsContact C-N 3.34Å; E653-V655 PolarHBondContact O-N 3.43Å; V655-L657 HydrophobicContact CG1-CB 4.41Å; V655-L657 HydrophobicContact CG1-CD1 3.73Å; V655-L657 HydrophobicContact CG1-CG 3.82Å; V655-L657 PolarHBondContact O-N 2.85Å
656	G	81.1	Confident	85.2	Confident	55 Å²	55	57.8 Å²	57.8	57%	0.567	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	11.3	171.5	0	0	0	0	0	115.2	S652 E653	S652-G656 PolarHBondContact O-N 3.46Å; S652-G656 VanDerWaalsContact O-N 3.08Å; E653-G656 PolarHBondContact O-N 3.41Å
657	L	83.3	Confident	84.5	Confident	57 Å²	57	58.4 Å²	58.4	30%	0.298	33%	0.332	S	S	.	.			trans	-72.4	141.4	174.7	-72.8	171.5	0	0	0	110.6	F604 V655 V659	F604-L657 HydrophobicContact CB-CD1 3.71Å; F604-L657 HydrophobicContact CD1-CB 3.92Å; F604-L657 HydrophobicContact CD1-CD1 3.63Å; F604-L657 HydrophobicContact CD1-CG 4.38Å; F604-L657 HydrophobicContact CD2-CD1 4.29Å; F604-L657 HydrophobicContact CE1-CB 4.21Å; F604-L657 HydrophobicContact CE1-CD1 4.33Å; F604-L657 HydrophobicContact CG-CD1 3.61Å; V655-L657 HydrophobicContact CG1-CB 4.41Å; V655-L657 HydrophobicContact CG1-CD1 3.73Å; V655-L657 HydrophobicContact CG1-CG 3.82Å; V655-L657 PolarHBondContact O-N 2.85Å; L657-V659 HydrophobicContact CB-CG1 4.49Å; L657-V659 PolarHBondContact O-N 3.09Å
658	K	81.9	Confident	83.8	Confident	118 Å²	118	60.7 Å²	60.7	51%	0.513	34%	0.339	S	S	.	.			trans	-76.8	57.9	179.5	-63.7	-178.8	-175.2	171.9	0	112	Y598	Y598-K658 HydrophobicContact CE1-CD 4.22Å; Y598-K658 HydrophobicContact CE2-CD 4.44Å; Y598-K658 PolarHBondContact OH-NZ 3.35Å
659	V	85.7	Confident	83.1	Confident	6 Å²	6	68.5 Å²	68.5	4%	0.036	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-63.3	154.1	172.8	-67.4	0	0	0	0	111.1	F604 L608 S652 L657 K661 P809	F604-V659 HydrophobicContact CD1-CG1 3.45Å; F604-V659 VanDerWaalsContact CD1-CG1 3.45Å; F604-V659 HydrophobicContact CE1-CG1 3.91Å; L608-V659 HydrophobicContact CD1-CG1 4.2Å; L608-V659 HydrophobicContact CD1-CG2 4.29Å; S652-V659 WeakPolarHBondContact OG-CG2 3.1Å; L657-V659 HydrophobicContact CB-CG1 4.49Å; L657-V659 PolarHBondContact O-N 3.09Å; V659-K661 PolarHBondContact O-N 2.94Å; V659-K661 VanDerWaalsContact O-N 3.1Å; V659-P809 HydrophobicContact CG2-CB 3.89Å
660	P	84.2	Confident	82.6	Confident	27 Å²	27	68.4 Å²	68.4	18%	0.175	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-60	117.6	175.7	22.4	-31.6	0	0	0	110.2	I541 L810 P811	I541-P660 HydrophobicContact CD1-CG 3.91Å; I541-P660 HydrophobicContact CG1-CG 4.1Å; I541-P660 HydrophobicContact CG2-CG 4.26Å; P660-L810 WeakPolarHBondContact O-CB 3.35Å; P660-L810 PolarHBondContact O-N 3.09Å; P660-P811 HydrophobicContact CG-CG 4.3Å
661	K	84.7	Confident	81.9	Confident	70 Å²	70	66.9 Å²	66.9	30%	0.304	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-101.6	161.8	177.5	-77	169.8	168.3	-164.3	0	109.6	E653 V659 I663 Q806	E653-K661 IonicContact OE2-NZ 3.33Å; E653-K661 PolarHBondContact OE2-NZ 3.22Å; V659-K661 PolarHBondContact O-N 2.94Å; V659-K661 VanDerWaalsContact O-N 3.1Å; K661-I663 PolarHBondContact O-N 3.41Å; K661-Q806 VanDerWaalsContact CB-O 3.3Å; K661-Q806 WeakPolarHBondContact CB-O 3.35Å; K661-Q806 VanDerWaalsContact CD-O 3.25Å; K661-Q806 WeakPolarHBondContact CD-O 3.47Å; K661-Q806 WeakPolarHBondContact CG-O 3.46Å
662	L	75.4	Confident	81.3	Confident	12 Å²	12	67.4 Å²	67.4	6%	0.063	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-61.3	121.2	175.1	-75.6	172	0	0	0	111.2	I419 L664 I808 L813	I419-L662 HydrophobicContact CD1-CD2 4.07Å; L662-L664 PolarHBondContact O-N 3.43Å; L662-I808 HydrophobicContact CD1-CB 4.14Å; L662-I808 HydrophobicContact CD1-CG2 4.36Å; L662-I808 PolarHBondContact N-O 2.89Å; L662-L813 HydrophobicContact CD1-CD1 3.87Å; L662-L813 HydrophobicContact CD2-CD1 3.91Å; L662-L813 HydrophobicContact CG-CD1 3.99Å
663	I	73.5	Confident	80.6	Confident	139 Å²	139	74.6 Å²	74.6	71%	0.713	40%	0.4	S	S	*	.			trans	-86.8	96.1	177	-55.6	165.7	0	0	0	108.1	K661	K661-I663 PolarHBondContact O-N 3.41Å
664	L	72.6	Confident	80.3	Confident	7 Å²	7	71.9 Å²	71.9	4%	0.037	39%	0.386	C	S	.	.			trans	-103.4	128.4	175.5	-159.8	81.1	0	0	0	110.5	I419 I439 L662 T802 L805 Q806	I419-L664 HydrophobicContact CD1-CD1 3.58Å; I419-L664 HydrophobicContact CG1-CD1 3.95Å; I439-L664 HydrophobicContact CD1-CD1 3.72Å; L662-L664 PolarHBondContact O-N 3.43Å; L664-T802 HydrophobicContact CB-CG2 4.28Å; L664-T802 HydrophobicContact CD2-CG2 3.99Å; L664-T802 WeakPolarHBondContact CD2-OG1 3.36Å; L664-L805 HydrophobicContact CD2-CD1 4.19Å; L664-Q806 PolarHBondContact O-NE2 2.9Å
665	P	73	Confident	80	Confident	35 Å²	35	69.9 Å²	69.9	23%	0.227	38%	0.382	C	S	.	.			trans	-62.7	135.2	170.8	26.1	-35.3	0	0	0	111.1	I435 M436	I435-P665 HydrophobicContact CB-CG 4.27Å; I435-P665 HydrophobicContact CG2-CG 4.01Å; M436-P665 HydrophobicContact CG-CB 4.13Å; M436-P665 HydrophobicContact CG-CG 3.78Å; M436-P665 HydrophobicContact SD-CB 3.78Å; M436-P665 HydrophobicContact SD-CG 3.25Å; M436-P665 WeakPolarHBondContact SD-CG 3.49Å
666	S	72.8	Confident	79.9	Confident	95 Å²	95	69.5 Å²	69.5	66%	0.664	37%	0.372	S	S	*	.			trans	-89	-12.6	-179.9	56.2	0	0	0	0	113.9
667	T	75.5	Confident	80.2	Confident	83 Å²	83	72.1 Å²	72.1	51%	0.509	37%	0.372	S	S	.	.	S	Bend	trans	-111.9	133	-175.3	59.4	0	0	0	0	111.7	R669	T667-R669 VanDerWaalsContact C-N 3.29Å; T667-R669 PolarHBondContact O-N 2.93Å
668	F	78.4	Confident	80.3	Confident	118 Å²	118	69.9 Å²	69.9	52%	0.518	36%	0.361	S	S	.	.			trans	-79.4	76.8	175.1	-169.5	-98.8	0	0	0	110.4	M436 I440 W676 L799	M436-F668 HydrophobicContact CE-CB 4.37Å; M436-F668 HydrophobicContact CE-CD2 3.64Å; M436-F668 HydrophobicContact CE-CE2 4.35Å; M436-F668 HydrophobicContact CE-CG 4.31Å; I440-F668 HydrophobicContact CD1-CD2 4.32Å; I440-F668 HydrophobicContact CD1-CE2 3.37Å; I440-F668 HydrophobicContact CD1-CZ 3.51Å; I440-F668 HydrophobicContact CG1-CE2 3.72Å; I440-F668 HydrophobicContact CG1-CZ 4.16Å; F668-W676 HydrophobicContact CD1-CZ2 4.25Å; F668-W676 AromaticContact CE1-CE2 3.96Å; F668-W676 AromaticContact CE1-CZ2 3.79Å; F668-W676 HydrophobicContact CE1-CZ2 3.79Å; F668-W676 AromaticContact CE1-NE1 3.82Å; F668-W676 AromaticContact CZ-CZ2 3.95Å; F668-W676 HydrophobicContact CZ-CZ2 3.95Å; F668-L799 HydrophobicContact CD2-CD1 3.51Å; F668-L799 HydrophobicContact CE2-CD1 4.18Å; F668-L799 HydrophobicContact CG-CD1 4.49Å
669	R	79.7	Confident	80.5	Confident	163 Å²	163	69 Å²	69	62%	0.615	36%	0.361	S	S	*	.			trans	-134	146.6	174.3	-68.5	-171	-179.4	-179	2.2	110.6	M436 T667	M436-R669 WeakPolarHBondContact CB-O 3.49Å; M436-R669 WeakPolarHBondContact CG-O 3.37Å; T667-R669 VanDerWaalsContact C-N 3.29Å; T667-R669 PolarHBondContact O-N 2.93Å
670	P	81.2	Confident	80.3	Confident	19 Å²	19	72.3 Å²	72.3	12%	0.123	37%	0.374	C	S	.	.			trans	-61.2	155	168.5	22	-25.7	0	0	0	110.6	E437 I672 R674 W676	E437-P670 VanDerWaalsContact OE1-CA 3.25Å; E437-P670 WeakPolarHBondContact OE1-CA 3.45Å; E437-P670 WeakPolarHBondContact OE1-CB 3.46Å; P670-I672 CarbonylContact C-O 3.39Å; P670-I672 WeakPolarHBondContact CB-O 3.45Å; P670-I672 VanDerWaalsContact CG-O 3.3Å; P670-I672 WeakPolarHBondContact CG-O 3.42Å; P670-I672 PolarHBondContact O-N 2.75Å; P670-R674 HydrophobicContact CB-CG 4.24Å; P670-R674 HydrophobicContact CG-CG 4.32Å; P670-R674 WeakPolarHBondContact CG-O 3.11Å; P670-W676 HydrophobicContact CB-CH2 4.28Å; P670-W676 HydrophobicContact CB-CZ3 4.45Å
671	S	79.1	Confident	80.1	Confident	47 Å²	47	76.4 Å²	76.4	33%	0.329	39%	0.393	S	S	.	.	S	Bend	trans	-61.5	-28.9	-178.3	-72	0	0	0	0	113.3	N431 G434 E437	N431-S671 WeakPolarHBondContact O-CB 3.23Å; G434-S671 WeakPolarHBondContact CA-OG 3.39Å; G434-S671 PolarHBondContact N-OG 3.27Å; G434-S671 VanDerWaalsContact N-OG 3.12Å; E437-S671 PolarHBondContact OE1-N 3.01Å; E437-S671 PolarHBondContact OE2-OG 3.23Å
672	I	80.8	Confident	79.8	Confident	56 Å²	56	77.8 Å²	77.8	29%	0.287	40%	0.404	S	S	.	.	S	Bend	trans	-108.3	146.8	168.1	-62.7	-176.6	0	0	0	108.2	N431 Q432 P670 R674	N431-I672 WeakPolarHBondContact O-CG1 3.35Å; Q432-I672 HydrophobicContact CB-CD1 4.34Å; Q432-I672 HydrophobicContact CG-CD1 4.25Å; Q432-I672 VanDerWaalsContact OE1-CD1 3.24Å; P670-I672 CarbonylContact C-O 3.39Å; P670-I672 WeakPolarHBondContact CB-O 3.45Å; P670-I672 VanDerWaalsContact CG-O 3.3Å; P670-I672 WeakPolarHBondContact CG-O 3.42Å; P670-I672 PolarHBondContact O-N 2.75Å; I672-R674 HydrophobicContact CB-CG 4.41Å; I672-R674 HydrophobicContact CG2-CB 4.39Å; I672-R674 PolarHBondContact O-N 3.04Å
673	D	78.4	Confident	79.8	Confident	151 Å²	151	78 Å²	78	81%	0.807	41%	0.405	S	S	*	.	S	Bend	trans	-64.9	74.1	169.2	-78.6	-33.2	0	0	0	111.3
674	R	83.3	Confident	79.8	Confident	35 Å²	35	82 Å²	82	13%	0.132	42%	0.417	C	S	.	.			trans	-129.8	157.2	179.2	68.8	170.7	179.7	92.8	-7.7	111.2	P670 I672 W676 F744 G745	P670-R674 HydrophobicContact CB-CG 4.24Å; P670-R674 HydrophobicContact CG-CG 4.32Å; P670-R674 WeakPolarHBondContact CG-O 3.11Å; I672-R674 HydrophobicContact CB-CG 4.41Å; I672-R674 HydrophobicContact CG2-CB 4.39Å; I672-R674 PolarHBondContact O-N 3.04Å; R674-W676 PolarHBondContact NH1-O 2.94Å; R674-F744 PolarHBondContact NH1-O 2.75Å; R674-G745 PolarHBondContact NH2-O 3.48Å; R674-G745 VanDerWaalsContact NH2-O 3.15Å
675	P	86.3	Confident	80.2	Confident	99 Å²	99	83 Å²	83	64%	0.643	43%	0.427	S	S	*	.			trans	-63.4	152.3	165.5	28.1	-34.6	0	0	0	111	I677	P675-I677 VanDerWaalsContact C-N 3.29Å; P675-I677 PolarHBondContact O-N 3.42Å
676	W	86.7	Confident	80.8	Confident	68 Å²	68	90.7 Å²	90.7	26%	0.258	45%	0.451	S	S	.	.	S	Bend	trans	-61.2	-36.2	177.2	-77.9	106.9	0	0	0	112.8	E437 I440 F668 P670 R674 F744 L746	E437-W676 HydrophobicContact CG-CZ3 4.29Å; I440-W676 HydrophobicContact CD1-CE3 4.37Å; I440-W676 HydrophobicContact CD1-CH2 3.05Å; I440-W676 HydrophobicContact CD1-CZ2 3.62Å; I440-W676 HydrophobicContact CD1-CZ3 3.47Å; I440-W676 VanDerWaalsContact CD1-CZ3 3.47Å; F668-W676 HydrophobicContact CD1-CZ2 4.25Å; F668-W676 AromaticContact CE1-CE2 3.96Å; F668-W676 AromaticContact CE1-CZ2 3.79Å; F668-W676 HydrophobicContact CE1-CZ2 3.79Å; F668-W676 AromaticContact CE1-NE1 3.82Å; F668-W676 AromaticContact CZ-CZ2 3.95Å; F668-W676 HydrophobicContact CZ-CZ2 3.95Å; P670-W676 HydrophobicContact CB-CH2 4.28Å; P670-W676 HydrophobicContact CB-CZ3 4.45Å; R674-W676 PolarHBondContact NH1-O 2.94Å; W676-F744 CarbonylContact O-C 3.07Å; W676-F744 WeakPolarHBondContact O-CA 3.3Å; W676-L746 HydrophobicContact CZ3-CD2 4.34Å
677	I	88.4	Confident	81.5	Confident	109 Å²	109	94 Å²	94	56%	0.559	45%	0.449	S	S	*	.	S	Bend	trans	-81.3	120.9	175.8	-60.2	172.1	0	0	0	108.6	P675 V743 F744	P675-I677 VanDerWaalsContact C-N 3.29Å; P675-I677 PolarHBondContact O-N 3.42Å; I677-V743 HydrophobicContact CG2-CG1 4.47Å; I677-F744 HydrophobicContact CG1-CD1 4.27Å; I677-F744 HydrophobicContact CG1-CE1 3.98Å
678	V	85.6	Confident	82	Confident	11 Å²	11	91 Å²	91	7%	0.067	43%	0.43	C	S	.	.			trans	-80.4	133.9	177.8	177.5	0	0	0	0	109.7	L485 W680 V743	L485-V678 HydrophobicContact CB-CG1 3.78Å; V678-W680 VanDerWaalsContact C-N 3.33Å; V678-W680 PolarHBondContact O-N 3.12Å; V678-V743 PolarHBondContact N-O 2.74Å
679	N	84.9	Confident	82.5	Confident	98 Å²	98	87.9 Å²	87.9	52%	0.524	42%	0.415	S	S	.	.			trans	-79.9	81.3	171.1	-170.4	2.3	0	0	0	111.2	L681 N682	N679-L681 PolarHBondContact O-N 3.14Å; N679-L681 VanDerWaalsContact O-N 3.14Å; N679-L681 PolarHBondContact OD1-N 2.94Å; N679-N682 HydrophobicContact CB-CB 4.27Å; N679-N682 WeakPolarHBondContact O-CB 3.31Å; N679-N682 PolarHBondContact O-N 2.63Å; N679-N682 VanDerWaalsContact O-N 3.1Å
680	W	81.7	Confident	82.9	Confident	77 Å²	77	84.2 Å²	84.2	29%	0.292	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-13.2	174.7	51.7	3.4	0	0	0	116.3	W490 M493 V678 N682 V743	W490-W680 PolarHBondContact NE1-O 2.75Å; M493-W680 HydrophobicContact CE-CE3 4.22Å; M493-W680 HydrophobicContact CE-CH2 3.35Å; M493-W680 HydrophobicContact CE-CZ2 4.5Å; M493-W680 HydrophobicContact CE-CZ3 3.18Å; M493-W680 HydrophobicContact CG-CE3 4.15Å; M493-W680 HydrophobicContact CG-CZ3 3.85Å; M493-W680 HydrophobicContact SD-CE3 4.49Å; M493-W680 HydrophobicContact SD-CH2 4.33Å; M493-W680 HydrophobicContact SD-CZ3 3.63Å; V678-W680 VanDerWaalsContact C-N 3.33Å; V678-W680 PolarHBondContact O-N 3.12Å; W680-N682 VanDerWaalsContact C-N 3.34Å; W680-V743 HydrophobicContact CE3-CG2 4.27Å; W680-V743 HydrophobicContact CH2-CG2 3.54Å; W680-V743 HydrophobicContact CZ2-CG2 4.36Å; W680-V743 HydrophobicContact CZ3-CG2 3.46Å; W680-V743 VanDerWaalsContact CZ3-CG2 3.46Å
681	L	81.3	Confident	83.3	Confident	113 Å²	113	87.3 Å²	87.3	59%	0.592	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-6.6	176.4	-68.6	166.9	0	0	0	112.1	W490 N679 I683 Y689	W490-L681 HydrophobicContact CZ2-CD2 4.45Å; N679-L681 PolarHBondContact O-N 3.14Å; N679-L681 VanDerWaalsContact O-N 3.14Å; N679-L681 PolarHBondContact OD1-N 2.94Å; L681-I683 PolarHBondContact O-N 2.99Å; L681-Y689 PolarHBondContact O-OH 3.32Å
682	N	76.8	Confident	84	Confident	98 Å²	98	85.4 Å²	85.4	52%	0.524	42%	0.415	S	S	.	.			trans	-76.6	42.4	-175.7	-166.5	34.7	0	0	0	114	N679 W680	N679-N682 HydrophobicContact CB-CB 4.27Å; N679-N682 WeakPolarHBondContact O-CB 3.31Å; N679-N682 PolarHBondContact O-N 2.63Å; N679-N682 VanDerWaalsContact O-N 3.1Å; W680-N682 VanDerWaalsContact C-N 3.34Å
683	I	75.2	Confident	84.6	Confident	17 Å²	17	86.1 Å²	86.1	9%	0.087	42%	0.417	C	S	.	.			trans	-108.2	124.1	179	-54.9	-169	0	0	0	109.6	A486 L681 A685 I688 Y689	A486-I683 HydrophobicContact CB-CD1 3.98Å; A486-I683 HydrophobicContact CB-CG1 3.58Å; L681-I683 PolarHBondContact O-N 2.99Å; I683-A685 PolarHBondContact O-N 2.88Å; I683-I688 HydrophobicContact CD1-CG2 3.84Å; I683-I688 HydrophobicContact CG2-CB 3.81Å; I683-I688 HydrophobicContact CG2-CD1 3.37Å; I683-I688 HydrophobicContact CG2-CG1 4.16Å; I683-I688 HydrophobicContact CG2-CG2 3.98Å; I683-Y689 HydrophobicContact CB-CE1 3.71Å; I683-Y689 HydrophobicContact CD1-CD1 4.06Å; I683-Y689 HydrophobicContact CD1-CE1 3.73Å; I683-Y689 HydrophobicContact CG1-CE1 3.92Å; I683-Y689 HydrophobicContact CG2-CE1 4.35Å
684	K	73.5	Confident	85.4	Confident	222 Å²	222	85.6 Å²	85.6	97%	0.965	41%	0.407	S	S	*	.	S	Bend	trans	-61	-25.7	-177.3	-72.1	179.9	-179.7	171.9	0	114.1
685	A	82.6	Confident	85.9	Confident	29 Å²	29	85.5 Å²	85.5	24%	0.24	41%	0.412	C	S	.	.			trans	-133.4	123.5	-171.8	0	0	0	0	0	112.3	I683 W687 I688	I683-A685 PolarHBondContact O-N 2.88Å; A685-W687 VanDerWaalsContact C-N 3.26Å; A685-W687 HydrophobicContact CB-CG 4.4Å; A685-W687 PolarHBondContact O-N 3.33Å; A685-I688 HydrophobicContact CB-CD1 4.22Å; A685-I688 PolarHBondContact O-N 2.91Å
686	W	84.9	Confident	86.4	Confident	196 Å²	196	80.8 Å²	80.8	74%	0.742	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-29.2	-174.8	70.6	-84.1	0	0	0	114.3	I688 Y689 V690	W686-I688 PolarHBondContact O-N 3.12Å; W686-Y689 HydrophobicContact CB-CD2 4.3Å; W686-Y689 HydrophobicContact CB-CE2 4.28Å; W686-Y689 WeakPolarHBondContact O-CB 3.44Å; W686-Y689 WeakPolarHBondContact O-CD2 3.25Å; W686-Y689 PolarHBondContact O-N 3.46Å; W686-V690 HydrophobicContact CZ3-CG2 4.48Å
687	W	86.7	Confident	86.8	Confident	164 Å²	164	81 Å²	81	62%	0.621	39%	0.386	S	S	*	.	H	α-helix	trans	-61.2	-23.9	179.1	64.8	-13.8	0	0	0	114	A685 Y689 V690 V691	A685-W687 VanDerWaalsContact C-N 3.26Å; A685-W687 HydrophobicContact CB-CG 4.4Å; A685-W687 PolarHBondContact O-N 3.33Å; W687-Y689 VanDerWaalsContact C-N 3.27Å; W687-Y689 PolarHBondContact O-N 2.71Å; W687-V690 PolarHBondContact O-N 3.33Å; W687-V690 VanDerWaalsContact O-N 3.09Å; W687-V691 WeakPolarHBondContact O-CG2 3.22Å; W687-V691 PolarHBondContact O-N 3.34Å
688	I	86.5	Confident	87.2	Confident	21 Å²	21	81 Å²	81	11%	0.108	39%	0.387	C	S	.	.	H	α-helix	trans	-67.5	-33.7	179.9	-70.3	160.7	0	0	0	110.1	I482 I683 A685 W686 V690 V691 T692	I482-I688 HydrophobicContact CD1-CD1 3.97Å; I482-I688 HydrophobicContact CD1-CG1 4.12Å; I482-I688 HydrophobicContact CG1-CD1 3.93Å; I482-I688 HydrophobicContact CG2-CD1 4.14Å; I482-I688 HydrophobicContact CG2-CG2 4.32Å; I683-I688 HydrophobicContact CD1-CG2 3.84Å; I683-I688 HydrophobicContact CG2-CB 3.81Å; I683-I688 HydrophobicContact CG2-CD1 3.37Å; I683-I688 HydrophobicContact CG2-CG1 4.16Å; I683-I688 HydrophobicContact CG2-CG2 3.98Å; A685-I688 HydrophobicContact CB-CD1 4.22Å; A685-I688 PolarHBondContact O-N 2.91Å; W686-I688 PolarHBondContact O-N 3.12Å; I688-V690 PolarHBondContact O-N 2.84Å; I688-V691 PolarHBondContact O-N 3.18Å; I688-T692 HydrophobicContact CG2-CG2 4.08Å; I688-T692 WeakPolarHBondContact O-CB 3.49Å; I688-T692 VanDerWaalsContact O-CG2 3.27Å; I688-T692 WeakPolarHBondContact O-CG2 3.33Å; I688-T692 PolarHBondContact O-N 3.26Å; I688-T692 PolarHBondContact O-OG1 3.47Å
689	Y	88.4	Confident	87.7	Confident	53 Å²	53	80.4 Å²	80.4	21%	0.208	38%	0.384	C	S	.	.	H	α-helix	trans	-59.3	-34.5	174.1	-49.5	-39.3	0	0	0	111.4	W490 W494 L681 I683 W686 W687 T692	W490-Y689 AromaticContact CD1-CD1 3.55Å; W490-Y689 AromaticContact CD1-CE1 3.79Å; W490-Y689 AromaticContact CD2-CD1 3.69Å; W490-Y689 HydrophobicContact CD2-CD1 3.69Å; W490-Y689 HydrophobicContact CD2-CE1 4.39Å; W490-Y689 HydrophobicContact CD2-CG 4.25Å; W490-Y689 AromaticContact CE2-CD1 3.26Å; W490-Y689 AromaticContact CE2-CE1 3.56Å; W490-Y689 AromaticContact CE2-CG 3.94Å; W490-Y689 AromaticContact CG-CD1 3.84Å; W490-Y689 HydrophobicContact CG-CD1 3.84Å; W490-Y689 HydrophobicContact CG-CE1 4.49Å; W490-Y689 AromaticContact CZ2-CD1 3.77Å; W490-Y689 HydrophobicContact CZ2-CD1 3.77Å; W490-Y689 AromaticContact CZ2-CE1 3.95Å; W490-Y689 HydrophobicContact CZ2-CE1 3.95Å; W490-Y689 HydrophobicContact CZ2-CG 4.07Å; W490-Y689 AromaticContact NE1-CD1 3.19Å; W490-Y689 AromaticContact NE1-CE1 3.15Å; W494-Y689 PolarHBondContact NE1-O 2.8Å; L681-Y689 PolarHBondContact O-OH 3.32Å; I683-Y689 HydrophobicContact CB-CE1 3.71Å; I683-Y689 HydrophobicContact CD1-CD1 4.06Å; I683-Y689 HydrophobicContact CD1-CE1 3.73Å; I683-Y689 HydrophobicContact CG1-CE1 3.92Å; I683-Y689 HydrophobicContact CG2-CE1 4.35Å; W686-Y689 HydrophobicContact CB-CD2 4.3Å; W686-Y689 HydrophobicContact CB-CE2 4.28Å; W686-Y689 WeakPolarHBondContact O-CB 3.44Å; W686-Y689 WeakPolarHBondContact O-CD2 3.25Å; W686-Y689 PolarHBondContact O-N 3.46Å; W687-Y689 VanDerWaalsContact C-N 3.27Å; W687-Y689 PolarHBondContact O-N 2.71Å; Y689-T692 PolarHBondContact O-OG1 2.9Å; Y689-T692 VanDerWaalsContact O-OG1 3.11Å
690	V	88.8	Confident	88.3	Confident	85 Å²	85	75.9 Å²	75.9	52%	0.515	36%	0.359	S	S	.	.	H	α-helix	trans	-84.6	-42.1	179.7	-177	0	0	0	0	111	W686 W687 I688 T692 F693	W686-V690 HydrophobicContact CZ3-CG2 4.48Å; W687-V690 PolarHBondContact O-N 3.33Å; W687-V690 VanDerWaalsContact O-N 3.09Å; I688-V690 PolarHBondContact O-N 2.84Å; V690-T692 VanDerWaalsContact C-N 3.32Å; V690-T692 PolarHBondContact O-N 2.68Å; V690-F693 WeakPolarHBondContact O-CB 3.11Å; V690-F693 PolarHBondContact O-N 2.75Å
691	V	90.3	Very high	88.8	Confident	84 Å²	84	77.1 Å²	77.1	51%	0.509	37%	0.371	S	S	.	.	H	α-helix	trans	-66.4	-33.8	-177.3	171.9	0	0	0	0	112.2	W687 I688 F693 F694 P695	W687-V691 WeakPolarHBondContact O-CG2 3.22Å; W687-V691 PolarHBondContact O-N 3.34Å; I688-V691 PolarHBondContact O-N 3.18Å; V691-F693 PolarHBondContact O-N 2.93Å; V691-F693 VanDerWaalsContact O-N 3.07Å; V691-F694 PolarHBondContact O-N 3.29Å; V691-F694 VanDerWaalsContact O-N 3.15Å; V691-P695 VanDerWaalsContact O-CD 3.26Å; V691-P695 WeakPolarHBondContact O-CD 3.33Å
692	T	92.1	Very high	89.4	Confident	7 Å²	7	73.3 Å²	73.3	4%	0.043	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-14.5	176.1	46.3	0	0	0	0	113.8	F473 I688 Y689 V690 F694 P695 A696	F473-T692 HydrophobicContact CZ-CG2 4.34Å; I688-T692 HydrophobicContact CG2-CG2 4.08Å; I688-T692 WeakPolarHBondContact O-CB 3.49Å; I688-T692 VanDerWaalsContact O-CG2 3.27Å; I688-T692 WeakPolarHBondContact O-CG2 3.33Å; I688-T692 PolarHBondContact O-N 3.26Å; I688-T692 PolarHBondContact O-OG1 3.47Å; Y689-T692 PolarHBondContact O-OG1 2.9Å; Y689-T692 VanDerWaalsContact O-OG1 3.11Å; V690-T692 VanDerWaalsContact C-N 3.32Å; V690-T692 PolarHBondContact O-N 2.68Å; T692-F694 VanDerWaalsContact C-N 3.31Å; T692-F694 PolarHBondContact O-N 2.88Å; T692-P695 WeakPolarHBondContact O-CD 3.43Å; T692-A696 VanDerWaalsContact O-CB 3.24Å; T692-A696 WeakPolarHBondContact O-CB 3.46Å; T692-A696 PolarHBondContact O-N 3.24Å
693	F	94.6	Very high	90.3	Very high	72 Å²	72	68.6 Å²	68.6	32%	0.316	33%	0.326	S	S	.	.	H	α-helix	trans	-57.4	-39.4	171	179.8	-98.5	0	0	0	112.9	W494 I498 V690 V691 A696 L697	W494-F693 HydrophobicContact CD2-CB 4.46Å; W494-F693 AromaticContact CD2-CD2 3.88Å; W494-F693 HydrophobicContact CD2-CD2 3.88Å; W494-F693 AromaticContact CE3-CD2 3.65Å; W494-F693 HydrophobicContact CE3-CD2 3.65Å; W494-F693 HydrophobicContact CE3-CE2 4.19Å; W494-F693 HydrophobicContact CG-CD2 4.36Å; W494-F693 HydrophobicContact CZ3-CD2 4.04Å; W494-F693 HydrophobicContact CZ3-CE2 4.41Å; I498-F693 HydrophobicContact CD1-CD2 4.38Å; I498-F693 HydrophobicContact CD1-CE2 3.94Å; I498-F693 HydrophobicContact CD1-CZ 4.48Å; I498-F693 HydrophobicContact CG1-CE2 4.25Å; V690-F693 WeakPolarHBondContact O-CB 3.11Å; V690-F693 PolarHBondContact O-N 2.75Å; V691-F693 PolarHBondContact O-N 2.93Å; V691-F693 VanDerWaalsContact O-N 3.07Å; F693-A696 WeakPolarHBondContact O-CB 3.01Å; F693-A696 PolarHBondContact O-N 3.23Å; F693-L697 PolarHBondContact O-N 3.07Å
694	F	93.9	Very high	91.1	Very high	139 Å²	139	69.2 Å²	69.2	61%	0.61	33%	0.33	S	S	*	.	H	α-helix	trans	-69.4	-49.4	-176.9	-62.1	-81	0	0	0	112.8	V691 T692 A696 L697 L698	V691-F694 PolarHBondContact O-N 3.29Å; V691-F694 VanDerWaalsContact O-N 3.15Å; T692-F694 VanDerWaalsContact C-N 3.31Å; T692-F694 PolarHBondContact O-N 2.88Å; F694-A696 VanDerWaalsContact C-N 3.27Å; F694-A696 PolarHBondContact O-N 3.44Å; F694-L697 WeakPolarHBondContact O-CB 3.47Å; F694-L697 PolarHBondContact O-N 3.15Å; F694-L698 PolarHBondContact O-N 2.97Å
695	P	95.3	Very high	91.9	Very high	34 Å²	34	62.7 Å²	62.7	22%	0.221	30%	0.304	C	S	.	.	H	α-helix	trans	-58.7	-37.8	169.5	-25.2	34.9	0	0	0	112.8	F469 F473 L491 V691 T692 L697 L698 L699	F469-P695 HydrophobicContact CZ-CB 4.07Å; F469-P695 VanDerWaalsContact CZ-O 3.31Å; F469-P695 WeakPolarHBondContact CZ-O 3.46Å; F473-P695 HydrophobicContact CD2-CB 4.19Å; F473-P695 HydrophobicContact CD2-CG 4.46Å; F473-P695 HydrophobicContact CE2-CB 4.18Å; F473-P695 HydrophobicContact CE2-CG 4.24Å; L491-P695 HydrophobicContact CD1-CB 3.79Å; V691-P695 VanDerWaalsContact O-CD 3.26Å; V691-P695 WeakPolarHBondContact O-CD 3.33Å; T692-P695 WeakPolarHBondContact O-CD 3.43Å; P695-L697 VanDerWaalsContact C-N 3.31Å; P695-L697 PolarHBondContact O-N 3.38Å; P695-L698 PolarHBondContact O-N 3.14Å; P695-L699 PolarHBondContact O-N 3.21Å
696	A	96.3	Very high	92.2	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-35.7	178.1	0	0	0	0	0	112.8	L491 W494 T495 T692 F693 F694 L699 T700	L491-A696 HydrophobicContact CD1-CB 4.02Å; W494-A696 HydrophobicContact CB-CB 3.38Å; W494-A696 HydrophobicContact CG-CB 4.44Å; T495-A696 PolarHBondContact OG1-O 3.36Å; T692-A696 VanDerWaalsContact O-CB 3.24Å; T692-A696 WeakPolarHBondContact O-CB 3.46Å; T692-A696 PolarHBondContact O-N 3.24Å; F693-A696 WeakPolarHBondContact O-CB 3.01Å; F693-A696 PolarHBondContact O-N 3.23Å; F694-A696 VanDerWaalsContact C-N 3.27Å; F694-A696 PolarHBondContact O-N 3.44Å; A696-L699 PolarHBondContact O-N 2.96Å; A696-T700 WeakPolarHBondContact O-CB 3.42Å; A696-T700 PolarHBondContact O-N 3.17Å; A696-T700 PolarHBondContact O-OG1 3.2Å
697	L	95.9	Very high	92.6	Very high	71 Å²	71	52.7 Å²	52.7	37%	0.372	26%	0.261	S	S	.	.	H	α-helix	trans	-62.4	-44.3	173.5	-178	66.4	0	0	0	111.5	I498 F693 F694 P695 T700 I701	I498-L697 HydrophobicContact CD1-CB 4.38Å; I498-L697 HydrophobicContact CD1-CD1 4.33Å; I498-L697 HydrophobicContact CG2-CD1 4.47Å; F693-L697 PolarHBondContact O-N 3.07Å; F694-L697 WeakPolarHBondContact O-CB 3.47Å; F694-L697 PolarHBondContact O-N 3.15Å; P695-L697 VanDerWaalsContact C-N 3.31Å; P695-L697 PolarHBondContact O-N 3.38Å; L697-T700 WeakPolarHBondContact O-CB 3.34Å; L697-T700 PolarHBondContact O-N 3.43Å; L697-I701 WeakPolarHBondContact O-CG1 3.39Å; L697-I701 PolarHBondContact O-N 3.07Å; L697-I701 VanDerWaalsContact O-N 3.13Å
698	L	96.1	Very high	92.8	Very high	109 Å²	109	45.3 Å²	45.3	57%	0.571	23%	0.234	S	C	*	.	H	α-helix	trans	-64.6	-43.3	176.8	-64.5	176.4	0	0	0	111.7	F469 F694 P695 T700 I701 L702	F469-L698 HydrophobicContact CE2-CB 4.08Å; F694-L698 PolarHBondContact O-N 2.97Å; P695-L698 PolarHBondContact O-N 3.14Å; L698-T700 VanDerWaalsContact C-N 3.32Å; L698-T700 PolarHBondContact O-N 3.18Å; L698-I701 PolarHBondContact O-N 3.42Å; L698-L702 PolarHBondContact O-N 2.96Å; L698-L702 VanDerWaalsContact O-N 3.16Å
699	L	96.6	Very high	92.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-41.5	175	-177.9	58	0	0	0	111.1	F469 L491 T495 P695 A696 I701 L702 L703 I748	F469-L699 HydrophobicContact CD1-CB 4.42Å; F469-L699 HydrophobicContact CD1-CD1 3.86Å; F469-L699 HydrophobicContact CD1-CD2 4.48Å; F469-L699 HydrophobicContact CD1-CG 4.48Å; F469-L699 HydrophobicContact CE1-CB 3.85Å; F469-L699 HydrophobicContact CE1-CD1 4.1Å; F469-L699 HydrophobicContact CE1-CD2 4.06Å; F469-L699 HydrophobicContact CE1-CG 4.22Å; F469-L699 HydrophobicContact CE2-CB 4.32Å; F469-L699 HydrophobicContact CG-CD1 4.3Å; F469-L699 HydrophobicContact CZ-CB 3.79Å; L491-L699 HydrophobicContact CD1-CD2 4.28Å; L491-L699 HydrophobicContact CD2-CD2 4Å; L491-L699 HydrophobicContact CG-CD2 3.95Å; T495-L699 HydrophobicContact CG2-CD2 4.21Å; T495-L699 HydrophobicContact CG2-CG 4.09Å; P695-L699 PolarHBondContact O-N 3.21Å; A696-L699 PolarHBondContact O-N 2.96Å; L699-I701 VanDerWaalsContact C-N 3.33Å; L699-I701 PolarHBondContact O-N 3.43Å; L699-L702 HydrophobicContact CD1-CD2 4.47Å; L699-L702 WeakPolarHBondContact O-CB 3.36Å; L699-L702 PolarHBondContact O-N 3.46Å; L699-L702 VanDerWaalsContact O-N 3.1Å; L699-L703 HydrophobicContact CD1-CD1 4.45Å; L699-L703 HydrophobicContact CD1-CD2 4.01Å; L699-L703 HydrophobicContact CD1-CG 4.01Å; L699-L703 HydrophobicContact CG-CD1 4.15Å; L699-L703 HydrophobicContact CG-CG 4.11Å; L699-L703 WeakPolarHBondContact O-CG 3.21Å; L699-L703 PolarHBondContact O-N 2.8Å; L699-I748 HydrophobicContact CD2-CD1 3.71Å
700	T	95.9	Very high	92.9	Very high	2 Å²	2	43 Å²	43	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-59.3	-44.7	177.7	-58.2	0	0	0	0	111.7	T495 I498 I499 L502 A696 L697 L698 L702 L703 V704	T495-T700 WeakPolarHBondContact CA-OG1 3.38Å; I498-T700 HydrophobicContact CB-CG2 4.05Å; I498-T700 HydrophobicContact CG2-CG2 3.58Å; I499-T700 HydrophobicContact CG1-CG2 3.62Å; L502-T700 HydrophobicContact CD1-CG2 3.85Å; A696-T700 WeakPolarHBondContact O-CB 3.42Å; A696-T700 PolarHBondContact O-N 3.17Å; A696-T700 PolarHBondContact O-OG1 3.2Å; L697-T700 WeakPolarHBondContact O-CB 3.34Å; L697-T700 PolarHBondContact O-N 3.43Å; L698-T700 VanDerWaalsContact C-N 3.32Å; L698-T700 PolarHBondContact O-N 3.18Å; T700-L702 VanDerWaalsContact C-N 3.27Å; T700-L702 PolarHBondContact O-N 3.21Å; T700-L703 PolarHBondContact O-N 2.86Å; T700-V704 HydrophobicContact CG2-CG2 4.04Å; T700-V704 WeakPolarHBondContact O-CB 3.25Å; T700-V704 VanDerWaalsContact O-CG2 3.25Å; T700-V704 WeakPolarHBondContact O-CG2 3.1Å; T700-V704 PolarHBondContact O-N 2.77Å
701	I	93.5	Very high	93	Very high	104 Å²	104	39 Å²	39	53%	0.533	20%	0.201	S	C	.	.	H	α-helix	trans	-58.2	-44.6	176	-66.1	166.2	0	0	0	110	L697 L698 L699 M705	L697-I701 WeakPolarHBondContact O-CG1 3.39Å; L697-I701 PolarHBondContact O-N 3.07Å; L697-I701 VanDerWaalsContact O-N 3.13Å; L698-I701 PolarHBondContact O-N 3.42Å; L699-I701 VanDerWaalsContact C-N 3.33Å; L699-I701 PolarHBondContact O-N 3.43Å; I701-M705 WeakPolarHBondContact O-CB 3.07Å; I701-M705 PolarHBondContact O-N 3.36Å
702	L	93.8	Very high	92.9	Very high	32 Å²	32	35.6 Å²	35.6	17%	0.168	18%	0.18	C	C	.	.	H	α-helix	trans	-62.9	-50.8	178.5	-174	67.8	0	0	0	112.3	P465 V466 F469 L698 L699 T700 V704 M705 D706	P465-L702 HydrophobicContact CB-CD1 3.82Å; P465-L702 HydrophobicContact CB-CD2 4.09Å; P465-L702 HydrophobicContact CB-CG 4.43Å; V466-L702 HydrophobicContact CG2-CD2 3.95Å; V466-L702 HydrophobicContact CG2-CG 4.46Å; F469-L702 HydrophobicContact CB-CD2 4.36Å; L698-L702 PolarHBondContact O-N 2.96Å; L698-L702 VanDerWaalsContact O-N 3.16Å; L699-L702 HydrophobicContact CD1-CD2 4.47Å; L699-L702 WeakPolarHBondContact O-CB 3.36Å; L699-L702 PolarHBondContact O-N 3.46Å; L699-L702 VanDerWaalsContact O-N 3.1Å; T700-L702 VanDerWaalsContact C-N 3.27Å; T700-L702 PolarHBondContact O-N 3.21Å; L702-V704 PolarHBondContact O-N 3.08Å; L702-M705 HydrophobicContact CD1-CE 4.18Å; L702-M705 PolarHBondContact O-N 2.82Å; L702-D706 WeakPolarHBondContact O-CB 3.17Å; L702-D706 PolarHBondContact O-N 3.41Å
703	L	94.8	Very high	92.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.3	-44.4	-178.2	-61.5	-176	0	0	0	111.8	V466 T495 I499 L699 T700 Q707 I748 V750	V466-L703 HydrophobicContact CG2-CD2 3.86Å; T495-L703 HydrophobicContact CG2-CD1 3.5Å; T495-L703 VanDerWaalsContact CG2-CD1 3.5Å; I499-L703 HydrophobicContact CD1-CB 4.42Å; I499-L703 HydrophobicContact CD1-CD1 4.13Å; L699-L703 HydrophobicContact CD1-CD1 4.45Å; L699-L703 HydrophobicContact CD1-CD2 4.01Å; L699-L703 HydrophobicContact CD1-CG 4.01Å; L699-L703 HydrophobicContact CG-CD1 4.15Å; L699-L703 HydrophobicContact CG-CG 4.11Å; L699-L703 WeakPolarHBondContact O-CG 3.21Å; L699-L703 PolarHBondContact O-N 2.8Å; T700-L703 PolarHBondContact O-N 2.86Å; L703-Q707 WeakPolarHBondContact O-CB 3.42Å; L703-Q707 PolarHBondContact O-N 3.29Å; L703-I748 HydrophobicContact CD1-CG2 4.07Å; L703-I748 HydrophobicContact CD2-CG2 3.74Å; L703-V750 HydrophobicContact CD2-CG2 3.29Å; L703-V750 HydrophobicContact CG-CG2 4.45Å
704	V	93.4	Very high	92.2	Very high	30 Å²	30	32.2 Å²	32.2	18%	0.182	17%	0.165	C	C	.	.	H	α-helix	trans	-65.6	-43.7	179.1	172.1	0	0	0	0	110.3	I499 L502 T700 L702 Q708 L731	I499-V704 HydrophobicContact CG1-CG2 4.06Å; L502-V704 HydrophobicContact CD1-CG2 3.88Å; T700-V704 HydrophobicContact CG2-CG2 4.04Å; T700-V704 WeakPolarHBondContact O-CB 3.25Å; T700-V704 VanDerWaalsContact O-CG2 3.25Å; T700-V704 WeakPolarHBondContact O-CG2 3.1Å; T700-V704 PolarHBondContact O-N 2.77Å; L702-V704 PolarHBondContact O-N 3.08Å; V704-Q708 HydrophobicContact CG1-CG 4.1Å; V704-Q708 WeakPolarHBondContact O-CB 3.21Å; V704-Q708 WeakPolarHBondContact O-CG 3.23Å; V704-Q708 PolarHBondContact O-N 2.69Å; V704-L731 HydrophobicContact CB-CD2 4.47Å; V704-L731 HydrophobicContact CG1-CD1 4.44Å; V704-L731 HydrophobicContact CG1-CD2 4.4Å; V704-L731 HydrophobicContact CG2-CD2 4.12Å
705	M	89	Confident	91.9	Very high	85 Å²	85	27 Å²	27	42%	0.419	14%	0.143	S	C	.	.	H	α-helix	trans	-63.7	-50.5	179.4	-176.7	-178	66.9	0	0	111.5	I701 L702 Q707 Q708 I709	I701-M705 WeakPolarHBondContact O-CB 3.07Å; I701-M705 PolarHBondContact O-N 3.36Å; L702-M705 HydrophobicContact CD1-CE 4.18Å; L702-M705 PolarHBondContact O-N 2.82Å; M705-Q707 PolarHBondContact O-N 3.29Å; M705-Q708 PolarHBondContact O-N 3.22Å; M705-I709 HydrophobicContact CG-CD1 3.45Å; M705-I709 VanDerWaalsContact CG-CD1 3.45Å; M705-I709 HydrophobicContact CG-CG1 4.29Å; M705-I709 WeakPolarHBondContact O-CB 3.19Å; M705-I709 WeakPolarHBondContact O-CG1 3.39Å; M705-I709 PolarHBondContact O-N 3.38Å; M705-I709 HydrophobicContact SD-CD1 4.38Å
706	D	90.1	Very high	91.2	Very high	14 Å²	14	26.4 Å²	26.4	8%	0.075	14%	0.137	C	C	.	.	H	α-helix	trans	-61.4	-45.7	179.3	-85.8	2.8	0	0	0	111.3	L702 T710 V750	L702-D706 WeakPolarHBondContact O-CB 3.17Å; L702-D706 PolarHBondContact O-N 3.41Å; D706-T710 WeakPolarHBondContact O-CB 3.35Å; D706-T710 PolarHBondContact O-N 3.03Å; D706-T710 VanDerWaalsContact O-N 3.14Å; D706-T710 PolarHBondContact O-OG1 3.45Å; D706-V750 HydrophobicContact CB-CG1 3.72Å
707	Q	92.9	Very high	90.2	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-64	-49.3	179.7	-175.8	63.6	35	0	0	111.9	L703 M705 T710 A711 L731 V734 V750 A751	L703-Q707 WeakPolarHBondContact O-CB 3.42Å; L703-Q707 PolarHBondContact O-N 3.29Å; M705-Q707 PolarHBondContact O-N 3.29Å; Q707-T710 PolarHBondContact O-N 3.09Å; Q707-A711 WeakPolarHBondContact O-CB 3.25Å; Q707-A711 PolarHBondContact O-N 3.21Å; Q707-L731 HydrophobicContact CB-CD2 4.26Å; Q707-L731 HydrophobicContact CG-CD2 4.15Å; Q707-V734 HydrophobicContact CG-CG2 4.18Å; Q707-V750 HydrophobicContact CB-CG1 4.12Å; Q707-A751 VanDerWaalsContact OE1-N 3.1Å
708	Q	90.4	Very high	89.2	Confident	9 Å²	9	30.5 Å²	30.5	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-70.4	-42.4	-174.7	-71.1	-69.8	7.5	0	0	112.1	S508 V511 V704 M705 T710 A711 V712 L731	S508-Q708 PolarHBondContact OG-NE2 2.95Å; V511-Q708 HydrophobicContact CG2-CB 3.91Å; V511-Q708 HydrophobicContact CG2-CG 3.87Å; V704-Q708 HydrophobicContact CG1-CG 4.1Å; V704-Q708 WeakPolarHBondContact O-CB 3.21Å; V704-Q708 WeakPolarHBondContact O-CG 3.23Å; V704-Q708 PolarHBondContact O-N 2.69Å; M705-Q708 PolarHBondContact O-N 3.22Å; Q708-T710 VanDerWaalsContact C-N 3.27Å; Q708-T710 PolarHBondContact O-N 3.11Å; Q708-A711 PolarHBondContact O-N 2.86Å; Q708-V712 WeakPolarHBondContact O-CG2 2.94Å; Q708-V712 PolarHBondContact O-N 3.23Å; Q708-L731 HydrophobicContact CG-CD1 4.42Å; Q708-L731 HydrophobicContact CG-CD2 4.36Å
709	I	88.4	Confident	88.5	Confident	23 Å²	23	26.8 Å²	26.8	12%	0.118	14%	0.141	C	C	.	.	H	α-helix	trans	-61.9	-41.5	176.7	-64.7	170.3	0	0	0	110	I514 F522 M705 V712 I713	I514-I709 HydrophobicContact CD1-CG1 4.03Å; F522-I709 HydrophobicContact CB-CG2 4.33Å; F522-I709 HydrophobicContact CD1-CB 4.3Å; F522-I709 HydrophobicContact CD1-CG2 3.17Å; F522-I709 HydrophobicContact CD2-CD1 4.49Å; F522-I709 HydrophobicContact CE1-CB 4.07Å; F522-I709 HydrophobicContact CE1-CD1 4.41Å; F522-I709 HydrophobicContact CE1-CG2 3.39Å; F522-I709 HydrophobicContact CE2-CD1 4.31Å; F522-I709 HydrophobicContact CG-CG2 3.82Å; F522-I709 HydrophobicContact CZ-CD1 4.25Å; F522-I709 HydrophobicContact CZ-CG2 4.26Å; M705-I709 HydrophobicContact CG-CD1 3.45Å; M705-I709 VanDerWaalsContact CG-CD1 3.45Å; M705-I709 HydrophobicContact CG-CG1 4.29Å; M705-I709 WeakPolarHBondContact O-CB 3.19Å; M705-I709 WeakPolarHBondContact O-CG1 3.39Å; M705-I709 PolarHBondContact O-N 3.38Å; M705-I709 HydrophobicContact SD-CD1 4.38Å; I709-V712 PolarHBondContact O-N 2.8Å; I709-I713 HydrophobicContact CG2-CD1 3.69Å; I709-I713 HydrophobicContact CG2-CG1 4.36Å; I709-I713 VanDerWaalsContact O-CG1 3.28Å; I709-I713 WeakPolarHBondContact O-CG1 3.43Å; I709-I713 PolarHBondContact O-N 2.94Å
710	T	89.2	Confident	87.6	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.012	16%	0.162	C	C	.	.	H	α-helix	trans	-60.3	-48.4	175.5	-54.6	0	0	0	0	111.4	D706 Q707 Q708 V712 I713 V714 A751 T753	D706-T710 WeakPolarHBondContact O-CB 3.35Å; D706-T710 PolarHBondContact O-N 3.03Å; D706-T710 VanDerWaalsContact O-N 3.14Å; D706-T710 PolarHBondContact O-OG1 3.45Å; Q707-T710 PolarHBondContact O-N 3.09Å; Q708-T710 VanDerWaalsContact C-N 3.27Å; Q708-T710 PolarHBondContact O-N 3.11Å; T710-V712 VanDerWaalsContact C-N 3.3Å; T710-V712 PolarHBondContact O-N 3.38Å; T710-I713 PolarHBondContact O-N 3.41Å; T710-V714 WeakPolarHBondContact O-CG2 3.44Å; T710-V714 PolarHBondContact O-N 3.2Å; T710-A751 HydrophobicContact CG2-CB 3.68Å; T710-A751 PolarHBondContact OG1-O 3.19Å; T710-T753 HydrophobicContact CG2-CG2 3.97Å; T710-T753 WeakPolarHBondContact OG1-CG2 3.43Å
711	A	90.4	Very high	87	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-60.6	-38.1	179.7	0	0	0	0	0	112.6	Q707 Q708 N715 Y727	Q707-A711 WeakPolarHBondContact O-CB 3.25Å; Q707-A711 PolarHBondContact O-N 3.21Å; Q708-A711 PolarHBondContact O-N 2.86Å; A711-N715 VanDerWaalsContact O-CB 3.25Å; A711-N715 WeakPolarHBondContact O-CB 3.16Å; A711-N715 PolarHBondContact O-N 3.31Å; A711-N715 PolarHBondContact O-ND2 3.16Å; A711-N715 VanDerWaalsContact O-ND2 3.15Å; A711-Y727 HydrophobicContact CB-CD1 3.74Å; A711-Y727 HydrophobicContact CB-CE1 3.68Å
712	V	87.4	Confident	86.3	Confident	12 Å²	12	35.5 Å²	35.5	7%	0.073	18%	0.18	C	C	.	.	H	α-helix	trans	-66.2	-45.1	175.6	173.3	0	0	0	0	111.9	V511 E519 Q708 I709 T710 V714 N715 R716 Y727	V511-V712 HydrophobicContact CG1-CG2 3.04Å; E519-V712 HydrophobicContact CG-CG1 3.8Å; E519-V712 WeakPolarHBondContact OE1-CG1 3.42Å; Q708-V712 WeakPolarHBondContact O-CG2 2.94Å; Q708-V712 PolarHBondContact O-N 3.23Å; I709-V712 PolarHBondContact O-N 2.8Å; T710-V712 VanDerWaalsContact C-N 3.3Å; T710-V712 PolarHBondContact O-N 3.38Å; V712-V714 VanDerWaalsContact C-N 3.25Å; V712-V714 PolarHBondContact O-N 3.33Å; V712-N715 CarbonylContact O-C 3.49Å; V712-N715 PolarHBondContact O-N 2.81Å; V712-N715 VanDerWaalsContact O-N 3.12Å; V712-R716 PolarHBondContact O-N 2.8Å; V712-Y727 HydrophobicContact CG2-CE1 4.01Å
713	I	85.2	Confident	85.6	Confident	8 Å²	8	35.3 Å²	35.3	4%	0.041	18%	0.178	C	C	.	.	H	α-helix	trans	-61.8	-38.1	179.5	-68.7	166.2	0	0	0	110.9	E519 F522 A523 I709 T710 R716 I757	E519-I713 HydrophobicContact CB-CG1 4.42Å; F522-I713 HydrophobicContact CD1-CD1 3.81Å; A523-I713 HydrophobicContact CB-CD1 4.26Å; I709-I713 HydrophobicContact CG2-CD1 3.69Å; I709-I713 HydrophobicContact CG2-CG1 4.36Å; I709-I713 VanDerWaalsContact O-CG1 3.28Å; I709-I713 WeakPolarHBondContact O-CG1 3.43Å; I709-I713 PolarHBondContact O-N 2.94Å; T710-I713 PolarHBondContact O-N 3.41Å; I713-R716 WeakPolarHBondContact O-CG 3.22Å; I713-I757 HydrophobicContact CG2-CD1 3.89Å; I713-I757 HydrophobicContact CG2-CG1 4.08Å
714	V	88.2	Confident	84.7	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-67.3	-42.6	174.1	166.1	0	0	0	0	111.6	Q455 L457 N458 T710 V712 R716 N719 I760	Q455-V714 HydrophobicContact CG-CG1 3.88Å; L457-V714 HydrophobicContact CB-CG1 3.93Å; L457-V714 HydrophobicContact CD1-CG1 4.29Å; N458-V714 WeakPolarHBondContact OD1-CG2 3.24Å; T710-V714 WeakPolarHBondContact O-CG2 3.44Å; T710-V714 PolarHBondContact O-N 3.2Å; V712-V714 VanDerWaalsContact C-N 3.25Å; V712-V714 PolarHBondContact O-N 3.33Å; V714-R716 PolarHBondContact O-N 2.8Å; V714-R716 VanDerWaalsContact O-N 3.13Å; V714-N719 PolarHBondContact O-ND2 2.88Å; V714-I760 HydrophobicContact CB-CD1 3.8Å; V714-I760 HydrophobicContact CG1-CD1 3.57Å; V714-I760 HydrophobicContact CG2-CD1 3.51Å
715	N	86.5	Confident	84.1	Confident	28 Å²	28	36.4 Å²	36.4	15%	0.15	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	22	-175.9	-67.6	-24.3	0	0	0	114.8	Q455 A711 V712 L721 F725 Y727	Q455-N715 PolarHBondContact NE2-OD1 3.12Å; A711-N715 VanDerWaalsContact O-CB 3.25Å; A711-N715 WeakPolarHBondContact O-CB 3.16Å; A711-N715 PolarHBondContact O-N 3.31Å; A711-N715 PolarHBondContact O-ND2 3.16Å; A711-N715 VanDerWaalsContact O-ND2 3.15Å; V712-N715 CarbonylContact O-C 3.49Å; V712-N715 PolarHBondContact O-N 2.81Å; V712-N715 VanDerWaalsContact O-N 3.12Å; N715-L721 WeakPolarHBondContact OD1-CD1 3.46Å; N715-F725 WeakPolarHBondContact ND2-CB 3.33Å; N715-Y727 WeakPolarHBondContact CB-OH 3.3Å; N715-Y727 PolarHBondContact ND2-OH 3.31Å
716	R	81	Confident	84.1	Confident	23 Å²	23	32.3 Å²	32.3	9%	0.087	17%	0.166	C	C	.	.			trans	-57.7	143	176.6	-78.7	179.5	176.9	-168.1	5.6	111.5	E519 V712 I713 V714 E718 N719	E519-R716 IonicContact OE2-NE 2.71Å; V712-R716 PolarHBondContact O-N 2.8Å; I713-R716 WeakPolarHBondContact O-CG 3.22Å; V714-R716 PolarHBondContact O-N 2.8Å; V714-R716 VanDerWaalsContact O-N 3.13Å; R716-E718 HydrophobicContact CB-CB 4.42Å; R716-E718 IonicContact NH1-OE2 3.78Å; R716-E718 PolarHBondContact O-N 3.26Å; R716-N719 WeakPolarHBondContact O-CB 3.3Å; R716-N719 PolarHBondContact O-N 3.03Å
717	P	75.8	Confident	84.1	Confident	68 Å²	68	32.2 Å²	32.2	44%	0.442	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-63	-26.8	174.4	27.2	-34.9	0	0	0	112	F360 N719 L720	F360-P717 HydrophobicContact CD1-CG 4.15Å; F360-P717 HydrophobicContact CE1-CG 3.7Å; P717-N719 PolarHBondContact O-N 2.92Å; P717-L720 PolarHBondContact O-N 2.91Å
718	E	75.4	Confident	84.1	Confident	89 Å²	89	32.2 Å²	32.2	42%	0.416	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-60.2	-26.1	175.1	-63.1	172.3	171.3	0	0	112.8	R516 R716 L720 F778	R516-E718 IonicContact CZ-OE1 2.79Å; R516-E718 IonicContact NH1-OE1 3.06Å; R516-E718 IonicContact NH2-OE1 3.99Å; R516-E718 PolarHBondContact NH2-OE1 2.86Å; R716-E718 HydrophobicContact CB-CB 4.42Å; R716-E718 IonicContact NH1-OE2 3.78Å; R716-E718 PolarHBondContact O-N 3.26Å; E718-L720 VanDerWaalsContact C-N 3.29Å; E718-F778 WeakPolarHBondContact O-CE1 3.49Å
719	N	80.5	Confident	84.2	Confident	31 Å²	31	33 Å²	33	17%	0.166	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-81.2	-7.6	179.3	-79.8	-14.2	0	0	0	113.1	V714 R716 P717 L721 I781	V714-N719 PolarHBondContact O-ND2 2.88Å; R716-N719 WeakPolarHBondContact O-CB 3.3Å; R716-N719 PolarHBondContact O-N 3.03Å; P717-N719 PolarHBondContact O-N 2.92Å; N719-L721 VanDerWaalsContact C-N 3.26Å; N719-L721 HydrophobicContact CB-CG 4.2Å; N719-L721 PolarHBondContact O-N 2.93Å; N719-I781 HydrophobicContact CB-CD1 3.46Å; N719-I781 VanDerWaalsContact CB-CD1 3.46Å; N719-I781 WeakPolarHBondContact O-CD1 3.28Å
720	L	77.9	Confident	84.5	Confident	85 Å²	85	32 Å²	32	45%	0.445	16%	0.164	S	C	.	.			trans	48.5	43.6	176.2	-58.3	174.3	0	0	0	113.7	P717 E718 F778	P717-L720 PolarHBondContact O-N 2.91Å; E718-L720 VanDerWaalsContact C-N 3.29Å; L720-F778 HydrophobicContact CB-CE1 4.22Å; L720-F778 HydrophobicContact CD1-CD1 3.81Å; L720-F778 HydrophobicContact CD1-CE1 4Å; L720-F778 HydrophobicContact CG-CD1 4.33Å; L720-F778 HydrophobicContact CG-CE1 4.07Å
721	L	83	Confident	84.7	Confident	40 Å²	40	32 Å²	32	21%	0.209	16%	0.164	C	C	.	.			trans	-68.6	135.3	176.6	-62	178.5	0	0	0	110.8	L457 N715 N719 I781 E783	L457-L721 HydrophobicContact CD1-CD2 3.87Å; N715-L721 WeakPolarHBondContact OD1-CD1 3.46Å; N719-L721 VanDerWaalsContact C-N 3.26Å; N719-L721 HydrophobicContact CB-CG 4.2Å; N719-L721 PolarHBondContact O-N 2.93Å; L721-I781 HydrophobicContact CD2-CB 4.05Å; L721-I781 HydrophobicContact CD2-CD1 3.84Å; L721-E783 HydrophobicContact CD2-CG 3.71Å
722	K	78.3	Confident	85	Confident	163 Å²	163	33.8 Å²	33.8	71%	0.709	17%	0.173	S	C	*	.	S	Bend	trans	-105.7	-24.9	-172.5	-62.3	-177.9	-179.2	-179.6	0	113.3	E783	K722-E783 WeakPolarHBondContact CA-OE2 3.48Å; K722-E783 PolarHBondContact N-OE2 3.36Å
723	K	80.7	Confident	85.3	Confident	29 Å²	29	33.4 Å²	33.4	13%	0.126	17%	0.171	C	C	.	.	S	Bend	trans	-93.9	-8.5	-171.2	-61.7	-177.1	-174.2	176.8	0	114.2	S388 D389 D392 E783	S388-K723 PolarHBondContact O-NZ 3.11Å; D389-K723 WeakPolarHBondContact OD1-CD 3.46Å; D389-K723 WeakPolarHBondContact OD1-CE 3Å; D389-K723 IonicContact OD1-NZ 3.16Å; D389-K723 PolarHBondContact OD1-NZ 2.95Å; D392-K723 WeakPolarHBondContact OD2-CE 3.27Å; D392-K723 IonicContact OD2-NZ 3.51Å; D392-K723 PolarHBondContact OD2-NZ 2.88Å; K723-E783 WeakPolarHBondContact CB-OE1 3.42Å; K723-E783 HydrophobicContact CD-CB 3.8Å; K723-E783 HydrophobicContact CG-CB 4.31Å; K723-E783 WeakPolarHBondContact CG-OE2 3.43Å; K723-E783 PolarHBondContact N-OE1 2.88Å; K723-E783 VanDerWaalsContact N-OE1 3.12Å; K723-E783 PolarHBondContact N-OE2 2.79Å; K723-E783 PolarHBondContact NZ-O 3.33Å
724	G	74.6	Confident	85.8	Confident	23 Å²	23	33.1 Å²	33.1	24%	0.237	17%	0.169	C	C	.	.			trans	95.8	-164.4	171.3	0	0	0	0	0	113.4
725	F	82.4	Confident	86.2	Confident	29 Å²	29	33 Å²	33	13%	0.127	17%	0.169	C	C	.	.			trans	-131.8	156.9	-171.4	51.5	-90.8	0	0	0	111.4	G364 L365 R381 N715 Y727	G364-F725 VanDerWaalsContact CA-CE2 3.44Å; L365-F725 HydrophobicContact CG-CE2 4.47Å; R381-F725 PolarHBondContact NH1-O 2.93Å; N715-F725 WeakPolarHBondContact ND2-CB 3.33Å; F725-Y727 HydrophobicContact CB-CD2 4.45Å; F725-Y727 HydrophobicContact CB-CE2 3.96Å; F725-Y727 AromaticContact CD2-CD2 3.49Å; F725-Y727 HydrophobicContact CD2-CD2 3.49Å; F725-Y727 VanDerWaalsContact CD2-CD2 3.49Å; F725-Y727 AromaticContact CD2-CE2 3.26Å; F725-Y727 HydrophobicContact CD2-CE2 3.26Å; F725-Y727 HydrophobicContact CE2-CD2 4.07Å; F725-Y727 AromaticContact CE2-CE2 3.82Å; F725-Y727 HydrophobicContact CE2-CE2 3.82Å; F725-Y727 HydrophobicContact CG-CD2 4.32Å; F725-Y727 AromaticContact CG-CE2 3.78Å; F725-Y727 HydrophobicContact CG-CE2 3.78Å
726	G	88.4	Confident	86.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.178	C	C	.	.			trans	-146.2	77	176.4	0	0	0	0	0	113.5	D378 D730	D378-G726 VanDerWaalsContact CG-CA 3.48Å; D378-G726 VanDerWaalsContact OD2-C 3.23Å; D378-G726 VanDerWaalsContact OD2-CA 3.31Å; D378-G726 WeakPolarHBondContact OD2-CA 3.28Å; G726-D730 WeakPolarHBondContact O-CB 3.33Å; G726-D730 VanDerWaalsContact O-CG 3.22Å; G726-D730 PolarHBondContact O-N 2.92Å; G726-D730 VanDerWaalsContact O-N 3.12Å
727	Y	90.4	Very high	87.4	Confident	12 Å²	12	34 Å²	34	5%	0.047	18%	0.175	C	C	.	.	H	α-helix	trans	-69.9	-38.1	-176.7	-62.7	-73	0	0	0	113.1	L365 D378 A711 V712 N715 F725 L731	L365-Y727 HydrophobicContact CD1-CE2 3.98Å; L365-Y727 HydrophobicContact CD2-CD2 3.65Å; L365-Y727 HydrophobicContact CD2-CE2 3.8Å; L365-Y727 HydrophobicContact CD2-CG 4.37Å; L365-Y727 HydrophobicContact CG-CD2 4.14Å; L365-Y727 HydrophobicContact CG-CE2 3.91Å; D378-Y727 PolarHBondContact OD2-N 2.6Å; D378-Y727 VanDerWaalsContact OD2-N 3.13Å; A711-Y727 HydrophobicContact CB-CD1 3.74Å; A711-Y727 HydrophobicContact CB-CE1 3.68Å; V712-Y727 HydrophobicContact CG2-CE1 4.01Å; N715-Y727 WeakPolarHBondContact CB-OH 3.3Å; N715-Y727 PolarHBondContact ND2-OH 3.31Å; F725-Y727 HydrophobicContact CB-CD2 4.45Å; F725-Y727 HydrophobicContact CB-CE2 3.96Å; F725-Y727 AromaticContact CD2-CD2 3.49Å; F725-Y727 HydrophobicContact CD2-CD2 3.49Å; F725-Y727 VanDerWaalsContact CD2-CD2 3.49Å; F725-Y727 AromaticContact CD2-CE2 3.26Å; F725-Y727 HydrophobicContact CD2-CE2 3.26Å; F725-Y727 HydrophobicContact CE2-CD2 4.07Å; F725-Y727 AromaticContact CE2-CE2 3.82Å; F725-Y727 HydrophobicContact CE2-CE2 3.82Å; F725-Y727 HydrophobicContact CG-CD2 4.32Å; F725-Y727 AromaticContact CG-CE2 3.78Å; F725-Y727 HydrophobicContact CG-CE2 3.78Å; Y727-L731 PolarHBondContact O-N 2.85Å
728	H	92.4	Very high	88.3	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-74.4	-40.2	-180	-63.8	94.8	0	0	0	111.2	L375 D378 V503 D506 S508 L731 L732	L375-H728 HydrophobicContact CB-CB 4.14Å; L375-H728 HydrophobicContact CD1-CB 4.27Å; D378-H728 WeakPolarHBondContact OD2-CA 3.29Å; D378-H728 VanDerWaalsContact OD2-CB 3.28Å; D378-H728 WeakPolarHBondContact OD2-CB 3.41Å; D378-H728 IonicContact OD2-CG 2.78Å; D378-H728 PolarHBondContact OD2-N 2.83Å; D378-H728 IonicContact OD2-ND1 3.74Å; V503-H728 HydrophobicContact CG1-CB 4.3Å; D506-H728 IonicContact OD1-CD2 3.53Å; D506-H728 IonicContact OD1-CE1 2.88Å; D506-H728 PolarHBondContact OD1-CE1 3.42Å; D506-H728 IonicContact OD1-NE2 3.64Å; D506-H728 PolarHBondContact OD1-NE2 3.1Å; S508-H728 VanDerWaalsContact CB-CE1 3.46Å; S508-H728 WeakPolarHBondContact CB-CE1 3.18Å; S508-H728 WeakPolarHBondContact CB-NE2 3.15Å; S508-H728 PolarHBondContact OG-CD2 2.98Å; S508-H728 PolarHBondContact OG-CE1 3.27Å; S508-H728 PolarHBondContact OG-NE2 2.91Å; H728-L731 PolarHBondContact O-N 2.86Å; H728-L732 PolarHBondContact O-N 2.78Å
729	L	92.8	Very high	89.3	Confident	24 Å²	24	29.2 Å²	29.2	13%	0.126	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-43.4	177	-175.1	60.1	0	0	0	110.9	L375 D378 V379 I382 L452 L731 L732 V733	L375-L729 HydrophobicContact CD1-CB 4.21Å; L375-L729 HydrophobicContact CD1-CD1 4.1Å; D378-L729 HydrophobicContact CB-CB 4.32Å; D378-L729 PolarHBondContact OD2-N 2.9Å; V379-L729 HydrophobicContact CG2-CD1 4.32Å; I382-L729 HydrophobicContact CD1-CD2 3.84Å; L452-L729 WeakPolarHBondContact O-CD2 3.37Å; L452-L729 WeakPolarHBondContact O-CG 3.01Å; L729-L731 PolarHBondContact O-N 3.16Å; L729-L732 PolarHBondContact O-N 2.9Å; L729-V733 HydrophobicContact CD1-CG2 4.5Å; L729-V733 VanDerWaalsContact O-CG2 3.31Å; L729-V733 WeakPolarHBondContact O-CG2 3.48Å; L729-V733 PolarHBondContact O-N 3.4Å
730	D	94	Very high	90	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.011	15%	0.151	C	C	.	.	H	α-helix	trans	-57.6	-47.8	175.3	-78.3	10.1	0	0	0	111.9	F449 S453 G454 Q455 N458 G726 L732 V733 V734	F449-D730 HydrophobicContact CE2-CB 4.24Å; F449-D730 HydrophobicContact CZ-CB 4.3Å; S453-D730 WeakPolarHBondContact CB-OD1 3.46Å; G454-D730 WeakPolarHBondContact CA-OD1 3.04Å; G454-D730 PolarHBondContact N-OD1 3.29Å; Q455-D730 PolarHBondContact N-OD1 3.14Å; N458-D730 PolarHBondContact ND2-OD2 3.45Å; N458-D730 VanDerWaalsContact ND2-OD2 3.08Å; G726-D730 WeakPolarHBondContact O-CB 3.33Å; G726-D730 VanDerWaalsContact O-CG 3.22Å; G726-D730 PolarHBondContact O-N 2.92Å; G726-D730 VanDerWaalsContact O-N 3.12Å; D730-L732 PolarHBondContact O-N 3.39Å; D730-V733 PolarHBondContact O-N 3.47Å; D730-V734 WeakPolarHBondContact O-CG2 3.47Å; D730-V734 PolarHBondContact O-N 3.06Å
731	L	94.1	Very high	90.8	Very high	4 Å²	4	26 Å²	26	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-63.1	-39.8	177.7	-76.4	-175.1	0	0	0	112.9	I499 V503 V704 Q707 Q708 Y727 H728 L729 V733 V734 S735	I499-L731 HydrophobicContact CG2-CB 4.15Å; I499-L731 WeakPolarHBondContact CG2-O 3.29Å; V503-L731 HydrophobicContact CG2-CB 3.55Å; V503-L731 HydrophobicContact CG2-CD1 4.19Å; V704-L731 HydrophobicContact CB-CD2 4.47Å; V704-L731 HydrophobicContact CG1-CD1 4.44Å; V704-L731 HydrophobicContact CG1-CD2 4.4Å; V704-L731 HydrophobicContact CG2-CD2 4.12Å; Q707-L731 HydrophobicContact CB-CD2 4.26Å; Q707-L731 HydrophobicContact CG-CD2 4.15Å; Q708-L731 HydrophobicContact CG-CD1 4.42Å; Q708-L731 HydrophobicContact CG-CD2 4.36Å; Y727-L731 PolarHBondContact O-N 2.85Å; H728-L731 PolarHBondContact O-N 2.86Å; L729-L731 PolarHBondContact O-N 3.16Å; L731-V733 VanDerWaalsContact C-N 3.34Å; L731-V734 PolarHBondContact O-N 2.93Å; L731-S735 PolarHBondContact O-N 3.38Å
732	L	95.4	Very high	91.3	Very high	38 Å²	38	24.2 Å²	24.2	20%	0.199	12%	0.122	C	C	.	.	H	α-helix	trans	-62.3	-44	176.7	-179.3	65.9	0	0	0	111.1	L375 I500 H728 L729 D730 S735 I736	L375-L732 HydrophobicContact CD1-CB 4.43Å; L375-L732 HydrophobicContact CD1-CD2 3.92Å; L375-L732 HydrophobicContact CD2-CD2 3.79Å; I500-L732 HydrophobicContact CG1-CD1 4.3Å; H728-L732 PolarHBondContact O-N 2.78Å; L729-L732 PolarHBondContact O-N 2.9Å; D730-L732 PolarHBondContact O-N 3.39Å; L732-S735 WeakPolarHBondContact O-CB 3.25Å; L732-S735 PolarHBondContact O-N 3.24Å; L732-I736 HydrophobicContact CG-CD1 4.26Å; L732-I736 WeakPolarHBondContact O-CG1 3.49Å; L732-I736 PolarHBondContact O-N 3.21Å
733	V	95.6	Very high	92	Very high	4 Å²	4	17.9 Å²	17.9	2%	0.024	10%	0.097	C	C	.	.	H	α-helix	trans	-65.4	-42.3	178	177.6	0	0	0	0	110.9	F449 L452 L729 D730 L731 S735 I736 L737	F449-V733 HydrophobicContact CB-CG1 4.4Å; F449-V733 HydrophobicContact CD2-CB 4.33Å; F449-V733 HydrophobicContact CD2-CG1 3.84Å; L452-V733 HydrophobicContact CB-CG1 4.34Å; L452-V733 HydrophobicContact CB-CG2 3.69Å; L729-V733 HydrophobicContact CD1-CG2 4.5Å; L729-V733 VanDerWaalsContact O-CG2 3.31Å; L729-V733 WeakPolarHBondContact O-CG2 3.48Å; L729-V733 PolarHBondContact O-N 3.4Å; D730-V733 PolarHBondContact O-N 3.47Å; L731-V733 VanDerWaalsContact C-N 3.34Å; V733-S735 VanDerWaalsContact C-N 3.28Å; V733-S735 PolarHBondContact O-N 3.22Å; V733-I736 PolarHBondContact O-N 3.33Å; V733-L737 HydrophobicContact CG1-CD1 4.07Å; V733-L737 HydrophobicContact CG1-CG 4.44Å; V733-L737 WeakPolarHBondContact O-CB 3.39Å; V733-L737 WeakPolarHBondContact O-CG 3.35Å; V733-L737 PolarHBondContact O-N 3.04Å
734	V	95.5	Very high	92.5	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-60.5	-38	174.1	171	0	0	0	0	111.5	F449 Q707 D730 L731 L737 T738	F449-V734 HydrophobicContact CD2-CG2 4.45Å; F449-V734 HydrophobicContact CE2-CG2 4.17Å; Q707-V734 HydrophobicContact CG-CG2 4.18Å; D730-V734 WeakPolarHBondContact O-CG2 3.47Å; D730-V734 PolarHBondContact O-N 3.06Å; L731-V734 PolarHBondContact O-N 2.93Å; V734-L737 PolarHBondContact O-N 3.48Å; V734-T738 WeakPolarHBondContact O-CB 3.42Å; V734-T738 PolarHBondContact O-N 3.24Å; V734-T738 PolarHBondContact O-OG1 3.47Å
735	S	96	Very high	93.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.9	-47.8	174.9	177.9	0	0	0	0	112.3	A496 I500 L731 L732 V733 L737 T738 I739	A496-S735 VanDerWaalsContact CA-OG 3.23Å; A496-S735 WeakPolarHBondContact CA-OG 3.32Å; A496-S735 WeakPolarHBondContact CB-OG 3.48Å; A496-S735 PolarHBondContact O-OG 3.31Å; I500-S735 WeakPolarHBondContact CG1-OG 3.21Å; L731-S735 PolarHBondContact O-N 3.38Å; L732-S735 WeakPolarHBondContact O-CB 3.25Å; L732-S735 PolarHBondContact O-N 3.24Å; V733-S735 VanDerWaalsContact C-N 3.28Å; V733-S735 PolarHBondContact O-N 3.22Å; S735-L737 VanDerWaalsContact C-N 3.27Å; S735-L737 PolarHBondContact O-N 2.78Å; S735-T738 WeakPolarHBondContact O-CB 3.38Å; S735-T738 PolarHBondContact O-N 2.64Å; S735-T738 VanDerWaalsContact O-N 3.09Å; S735-I739 PolarHBondContact O-N 2.81Å; S735-I739 VanDerWaalsContact O-N 3.08Å
736	I	96.4	Very high	93.8	Very high	66 Å²	66	18 Å²	18	34%	0.338	9%	0.092	S	C	.	.	H	α-helix	trans	-59.8	-42.1	176.1	-66.2	166.5	0	0	0	110.4	L448 L732 V733 T738 I739 I740	L448-I736 HydrophobicContact CD2-CG2 4.34Å; L732-I736 HydrophobicContact CG-CD1 4.26Å; L732-I736 WeakPolarHBondContact O-CG1 3.49Å; L732-I736 PolarHBondContact O-N 3.21Å; V733-I736 PolarHBondContact O-N 3.33Å; I736-T738 VanDerWaalsContact C-N 3.33Å; I736-T738 PolarHBondContact O-N 2.94Å; I736-I739 WeakPolarHBondContact O-CB 3.41Å; I736-I739 PolarHBondContact O-N 3.48Å; I736-I740 HydrophobicContact CG2-CD1 4.04Å; I736-I740 WeakPolarHBondContact O-CG1 3.32Å; I736-I740 PolarHBondContact O-N 3.16Å
737	L	96.3	Very high	94	Very high	5 Å²	5	18.1 Å²	18.1	3%	0.026	9%	0.092	C	C	.	.	H	α-helix	trans	-62.6	-38.9	175.1	-77.5	173.8	0	0	0	112.7	L448 F449 L460 V733 V734 S735 I739 I740 C741	L448-L737 HydrophobicContact CB-CD2 3.98Å; L448-L737 HydrophobicContact CD2-CD2 3.54Å; L448-L737 HydrophobicContact CD2-CG 4.04Å; L448-L737 HydrophobicContact CG-CD2 4.28Å; F449-L737 HydrophobicContact CB-CD1 4.17Å; L460-L737 HydrophobicContact CD2-CD1 3.6Å; V733-L737 HydrophobicContact CG1-CD1 4.07Å; V733-L737 HydrophobicContact CG1-CG 4.44Å; V733-L737 WeakPolarHBondContact O-CB 3.39Å; V733-L737 WeakPolarHBondContact O-CG 3.35Å; V733-L737 PolarHBondContact O-N 3.04Å; V734-L737 PolarHBondContact O-N 3.48Å; S735-L737 VanDerWaalsContact C-N 3.27Å; S735-L737 PolarHBondContact O-N 2.78Å; L737-I739 VanDerWaalsContact C-N 3.29Å; L737-I739 PolarHBondContact O-N 3.33Å; L737-I740 HydrophobicContact CD2-CD1 4.45Å; L737-I740 PolarHBondContact O-N 3.1Å; L737-C741 WeakPolarHBondContact O-CB 3.14Å; L737-C741 PolarHBondContact O-N 2.71Å; L737-C741 PolarHBondContact O-SG 3.24Å; L737-C741 VanDerWaalsContact O-SG 3.33Å
738	T	95.5	Very high	94.2	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.012	9%	0.092	C	C	.	.	H	α-helix	trans	-61.9	-39.6	176.2	-56.2	0	0	0	0	110.9	C492 T495 V734 S735 I736 C741 G742 I748	C492-T738 HydrophobicContact CB-CG2 3.96Å; C492-T738 WeakPolarHBondContact CB-O 3.49Å; T495-T738 HydrophobicContact CG2-CG2 4.23Å; V734-T738 WeakPolarHBondContact O-CB 3.42Å; V734-T738 PolarHBondContact O-N 3.24Å; V734-T738 PolarHBondContact O-OG1 3.47Å; S735-T738 WeakPolarHBondContact O-CB 3.38Å; S735-T738 PolarHBondContact O-N 2.64Å; S735-T738 VanDerWaalsContact O-N 3.09Å; I736-T738 VanDerWaalsContact C-N 3.33Å; I736-T738 PolarHBondContact O-N 2.94Å; T738-C741 PolarHBondContact O-N 3.32Å; T738-G742 PolarHBondContact O-N 2.87Å; T738-I748 HydrophobicContact CG2-CD1 4.37Å
739	I	95.7	Very high	94.4	Very high	55 Å²	55	18 Å²	18	28%	0.282	9%	0.092	S	C	.	.	H	α-helix	trans	-61.9	-49.1	173.5	-63.2	173.3	0	0	0	110.7	M493 A496 S735 I736 L737 C741 G742 V743	M493-I739 HydrophobicContact CE-CG2 4.47Å; M493-I739 HydrophobicContact SD-CB 4.42Å; M493-I739 HydrophobicContact SD-CG1 4.13Å; M493-I739 HydrophobicContact SD-CG2 3.88Å; A496-I739 HydrophobicContact CB-CD1 3.87Å; A496-I739 HydrophobicContact CB-CG1 3.37Å; S735-I739 PolarHBondContact O-N 2.81Å; S735-I739 VanDerWaalsContact O-N 3.08Å; I736-I739 WeakPolarHBondContact O-CB 3.41Å; I736-I739 PolarHBondContact O-N 3.48Å; L737-I739 VanDerWaalsContact C-N 3.29Å; L737-I739 PolarHBondContact O-N 3.33Å; I739-C741 VanDerWaalsContact C-N 3.32Å; I739-C741 PolarHBondContact O-N 2.96Å; I739-G742 PolarHBondContact O-N 3.48Å; I739-G742 VanDerWaalsContact O-N 3.14Å; I739-V743 HydrophobicContact CG2-CG2 4.39Å; I739-V743 WeakPolarHBondContact O-CG2 3.25Å; I739-V743 PolarHBondContact O-N 3.33Å
740	I	95.2	Very high	94.4	Very high	44 Å²	44	16.8 Å²	16.8	23%	0.226	9%	0.086	C	C	.	.	H	α-helix	trans	-58.9	-46.8	179.2	-66.2	167	0	0	0	109.9	V444 L448 I736 L737 G742 V743 F744	V444-I740 HydrophobicContact CG1-CG2 4.1Å; L448-I740 HydrophobicContact CD2-CD1 3.68Å; I736-I740 HydrophobicContact CG2-CD1 4.04Å; I736-I740 WeakPolarHBondContact O-CG1 3.32Å; I736-I740 PolarHBondContact O-N 3.16Å; L737-I740 HydrophobicContact CD2-CD1 4.45Å; L737-I740 PolarHBondContact O-N 3.1Å; I740-G742 VanDerWaalsContact C-N 3.31Å; I740-G742 PolarHBondContact O-N 3.15Å; I740-V743 PolarHBondContact O-N 3.47Å; I740-F744 HydrophobicContact CG2-CD2 3.86Å; I740-F744 HydrophobicContact CG2-CE2 4.12Å; I740-F744 VanDerWaalsContact O-CD2 3.29Å; I740-F744 WeakPolarHBondContact O-CD2 3.24Å; I740-F744 PolarHBondContact O-N 2.7Å; I740-F744 VanDerWaalsContact O-N 3.11Å
741	C	93.9	Very high	94.4	Very high	5 Å²	5	16.8 Å²	16.8	3%	0.034	9%	0.087	C	C	.	.	H	α-helix	trans	-61.5	-38.4	176.8	-70.6	0	0	0	0	112.4	L737 T738 I739 G745 L746 P747	L737-C741 WeakPolarHBondContact O-CB 3.14Å; L737-C741 PolarHBondContact O-N 2.71Å; L737-C741 PolarHBondContact O-SG 3.24Å; L737-C741 VanDerWaalsContact O-SG 3.33Å; T738-C741 PolarHBondContact O-N 3.32Å; I739-C741 VanDerWaalsContact C-N 3.32Å; I739-C741 PolarHBondContact O-N 2.96Å; C741-G745 CarbonylContact O-C 3.53Å; C741-G745 WeakPolarHBondContact O-CA 3.29Å; C741-G745 PolarHBondContact O-N 3.01Å; C741-L746 HydrophobicContact CB-CB 4.22Å; C741-L746 WeakPolarHBondContact CB-O 3.18Å; C741-L746 PolarHBondContact O-N 3.22Å; C741-P747 PolarHBondContact SG-O 2.63Å
742	G	93.3	Very high	94.3	Very high	1 Å²	1	17 Å²	17	1%	0.01	9%	0.089	C	C	.	.	H	α-helix	trans	-63	-44.9	174.4	0	0	0	0	0	113.4	T738 I739 I740 G745	T738-G742 PolarHBondContact O-N 2.87Å; I739-G742 PolarHBondContact O-N 3.48Å; I739-G742 VanDerWaalsContact O-N 3.14Å; I740-G742 VanDerWaalsContact C-N 3.31Å; I740-G742 PolarHBondContact O-N 3.15Å; G742-G745 PolarHBondContact O-N 2.9Å
743	V	93.1	Very high	93.9	Very high	31 Å²	31	16.2 Å²	16.2	19%	0.188	9%	0.085	C	C	.	.	H	α-helix	trans	-66.2	-42.4	-178.2	172.1	0	0	0	0	112.2	I677 V678 W680 I739 I740	I677-V743 HydrophobicContact CG2-CG1 4.47Å; V678-V743 PolarHBondContact N-O 2.74Å; W680-V743 HydrophobicContact CE3-CG2 4.27Å; W680-V743 HydrophobicContact CH2-CG2 3.54Å; W680-V743 HydrophobicContact CZ2-CG2 4.36Å; W680-V743 HydrophobicContact CZ3-CG2 3.46Å; W680-V743 VanDerWaalsContact CZ3-CG2 3.46Å; I739-V743 HydrophobicContact CG2-CG2 4.39Å; I739-V743 WeakPolarHBondContact O-CG2 3.25Å; I739-V743 PolarHBondContact O-N 3.33Å; I740-V743 PolarHBondContact O-N 3.47Å
744	F	92.3	Very high	93.3	Very high	78 Å²	78	16.8 Å²	16.8	34%	0.342	9%	0.088	S	C	.	.	H	α-helix	trans	-90.1	-4	-178.5	-68.7	-76	0	0	0	113.4	R674 W676 I677 I740 L746	R674-F744 PolarHBondContact NH1-O 2.75Å; W676-F744 CarbonylContact O-C 3.07Å; W676-F744 WeakPolarHBondContact O-CA 3.3Å; I677-F744 HydrophobicContact CG1-CD1 4.27Å; I677-F744 HydrophobicContact CG1-CE1 3.98Å; I740-F744 HydrophobicContact CG2-CD2 3.86Å; I740-F744 HydrophobicContact CG2-CE2 4.12Å; I740-F744 VanDerWaalsContact O-CD2 3.29Å; I740-F744 WeakPolarHBondContact O-CD2 3.24Å; I740-F744 PolarHBondContact O-N 2.7Å; I740-F744 VanDerWaalsContact O-N 3.11Å; F744-L746 VanDerWaalsContact C-N 3.29Å; F744-L746 HydrophobicContact CB-CD1 3.82Å; F744-L746 HydrophobicContact CB-CG 3.69Å; F744-L746 PolarHBondContact O-N 2.06Å
745	G	90	Very high	92.9	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.01	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	43.4	-172.4	0	0	0	0	0	111.7	M433 R674 C741 G742	M433-G745 VanDerWaalsContact CE-O 3.31Å; M433-G745 WeakPolarHBondContact CE-O 3.41Å; R674-G745 PolarHBondContact NH2-O 3.48Å; R674-G745 VanDerWaalsContact NH2-O 3.15Å; C741-G745 CarbonylContact O-C 3.53Å; C741-G745 WeakPolarHBondContact O-CA 3.29Å; C741-G745 PolarHBondContact O-N 3.01Å; G742-G745 PolarHBondContact O-N 2.9Å
746	L	93.4	Very high	92.7	Very high	4 Å²	4	17.3 Å²	17.3	2%	0.021	9%	0.091	C	C	.	.	P	Polyproline II helix	trans	-95.2	153.5	175.1	-59.9	172.8	0	0	0	110	E437 I440 R488 W676 C741 F744	E437-L746 HydrophobicContact CB-CD2 4.07Å; E437-L746 HydrophobicContact CG-CD2 4.4Å; I440-L746 HydrophobicContact CB-CD2 4.23Å; I440-L746 HydrophobicContact CG2-CD1 4.13Å; I440-L746 HydrophobicContact CG2-CD2 4.04Å; R488-L746 PolarHBondContact NE-O 2.7Å; R488-L746 PolarHBondContact NH2-O 3.47Å; W676-L746 HydrophobicContact CZ3-CD2 4.34Å; C741-L746 HydrophobicContact CB-CB 4.22Å; C741-L746 WeakPolarHBondContact CB-O 3.18Å; C741-L746 PolarHBondContact O-N 3.22Å; F744-L746 VanDerWaalsContact C-N 3.29Å; F744-L746 HydrophobicContact CB-CD1 3.82Å; F744-L746 HydrophobicContact CB-CG 3.69Å; F744-L746 PolarHBondContact O-N 2.06Å
747	P	93.3	Very high	92.2	Very high	2 Å²	2	15.7 Å²	15.7	1%	0.013	8%	0.082	C	C	.	.	P	Polyproline II helix	trans	-64.7	145.3	175.8	24.6	-33.6	0	0	0	110.9	M425 M433 E437 C438 S441 C741 F749	M425-P747 HydrophobicContact CE-CB 4.27Å; M433-P747 HydrophobicContact CE-CB 3.99Å; M433-P747 HydrophobicContact CE-CG 4.25Å; E437-P747 WeakPolarHBondContact O-CD 3.43Å; C438-P747 HydrophobicContact CB-CG 4.31Å; S441-P747 PolarHBondContact OG-O 2.71Å; C741-P747 PolarHBondContact SG-O 2.63Å; P747-F749 HydrophobicContact CB-CD1 4.33Å; P747-F749 HydrophobicContact CB-CE1 4Å; P747-F749 HydrophobicContact CG-CD1 4.3Å; P747-F749 HydrophobicContact CG-CE1 3.68Å
748	I	95.2	Very high	91.6	Very high	6 Å²	6	15.9 Å²	15.9	3%	0.031	9%	0.085	C	C	.	.	P	Polyproline II helix	trans	-78.3	125.4	178.2	-59	169.3	0	0	0	108.5	V466 L699 L703 T738 V750	V466-I748 HydrophobicContact CG1-CB 4.17Å; L699-I748 HydrophobicContact CD2-CD1 3.71Å; L703-I748 HydrophobicContact CD1-CG2 4.07Å; L703-I748 HydrophobicContact CD2-CG2 3.74Å; T738-I748 HydrophobicContact CG2-CD1 4.37Å; I748-V750 HydrophobicContact CG2-CG2 4.45Å
749	F	94.8	Very high	91.3	Very high	4 Å²	4	15.9 Å²	15.9	2%	0.018	8%	0.084	C	C	.	.			trans	-108.2	137.4	180	-84.1	33.7	0	0	0	109.3	I418 C438 S441 S445 L460 S461 A462 P747	I418-F749 HydrophobicContact CD1-CE2 4.09Å; I418-F749 HydrophobicContact CD1-CZ 4.48Å; I418-F749 HydrophobicContact CG1-CE2 4.09Å; I418-F749 HydrophobicContact CG1-CZ 4.15Å; C438-F749 VanDerWaalsContact O-CZ 3.31Å; C438-F749 WeakPolarHBondContact O-CZ 3.09Å; S441-F749 WeakPolarHBondContact OG-CD1 3.36Å; S445-F749 WeakPolarHBondContact OG-CB 3.3Å; S445-F749 VanDerWaalsContact OG-CD2 3.28Å; S445-F749 WeakPolarHBondContact OG-CD2 3.25Å; L460-F749 HydrophobicContact CB-CB 4.28Å; S461-F749 VanDerWaalsContact CA-CD2 3.45Å; A462-F749 HydrophobicContact CB-CD1 4.48Å; A462-F749 HydrophobicContact CB-CE1 3.96Å; A462-F749 HydrophobicContact CB-CZ 4.24Å; P747-F749 HydrophobicContact CB-CD1 4.33Å; P747-F749 HydrophobicContact CB-CE1 4Å; P747-F749 HydrophobicContact CG-CD1 4.3Å; P747-F749 HydrophobicContact CG-CE1 3.68Å
750	V	94.4	Very high	90.9	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	160.8	-180	-174.9	0	0	0	0	108.3	L460 S461 V466 L703 D706 Q707 I748 A752	L460-V750 WeakPolarHBondContact CA-O 3.29Å; S461-V750 PolarHBondContact N-O 2.93Å; S461-V750 PolarHBondContact O-N 2.87Å; S461-V750 VanDerWaalsContact O-N 3.13Å; V466-V750 HydrophobicContact CG2-CG2 4.19Å; L703-V750 HydrophobicContact CD2-CG2 3.29Å; L703-V750 HydrophobicContact CG-CG2 4.45Å; D706-V750 HydrophobicContact CB-CG1 3.72Å; Q707-V750 HydrophobicContact CB-CG1 4.12Å; I748-V750 HydrophobicContact CG2-CG2 4.45Å; V750-A752 PolarHBondContact O-N 3.37Å
751	A	93.8	Very high	90.3	Very high	2 Å²	2	14.6 Å²	14.6	2%	0.017	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	117.2	174	0	0	0	0	0	111.3	N458 I459 Q707 T710 T753	N458-A751 HydrophobicContact CB-CB 4.11Å; I459-A751 CarbonylContact O-C 3.59Å; I459-A751 WeakPolarHBondContact O-CA 3.47Å; Q707-A751 VanDerWaalsContact OE1-N 3.1Å; T710-A751 HydrophobicContact CG2-CB 3.68Å; T710-A751 PolarHBondContact OG1-O 3.19Å; A751-T753 PolarHBondContact O-N 3.31Å
752	A	91.6	Very high	89.8	Confident	9 Å²	9	15.8 Å²	15.8	7%	0.074	9%	0.085	C	C	.	.			trans	-85	110.2	174.1	0	0	0	0	0	108.7	I459 V750 M754 L755 S756	I459-A752 PolarHBondContact O-N 3.26Å; V750-A752 PolarHBondContact O-N 3.37Å; A752-M754 PolarHBondContact O-N 3.26Å; A752-L755 HydrophobicContact CB-CB 4.06Å; A752-L755 HydrophobicContact CB-CD1 3.89Å; A752-L755 HydrophobicContact CB-CG 4.13Å; A752-L755 PolarHBondContact O-N 2.96Å; A752-S756 WeakPolarHBondContact O-CB 3.47Å; A752-S756 PolarHBondContact O-N 3.05Å; A752-S756 PolarHBondContact O-OG 3.41Å
753	T	86.6	Confident	89.4	Confident	20 Å²	20	15.7 Å²	15.7	12%	0.123	8%	0.084	C	C	.	.	H	α-helix	trans	-50.3	-53.1	179.8	42.8	0	0	0	0	113.5	F522 I526 T710 A751 L755 S756 I757	F522-T753 HydrophobicContact CE1-CG2 3.92Å; I526-T753 HydrophobicContact CD1-CG2 3.59Å; I526-T753 WeakPolarHBondContact CD1-OG1 3.42Å; I526-T753 WeakPolarHBondContact CG2-OG1 3.45Å; T710-T753 HydrophobicContact CG2-CG2 3.97Å; T710-T753 WeakPolarHBondContact OG1-CG2 3.43Å; A751-T753 PolarHBondContact O-N 3.31Å; T753-L755 PolarHBondContact O-N 2.78Å; T753-S756 PolarHBondContact O-N 2.76Å; T753-I757 VanDerWaalsContact O-CG1 3.29Å; T753-I757 WeakPolarHBondContact O-CG1 3.49Å; T753-I757 PolarHBondContact O-N 3.38Å
754	M	82.2	Confident	89	Confident	17 Å²	17	16.4 Å²	16.4	8%	0.084	8%	0.084	C	C	.	.	H	α-helix	trans	-66.5	-40.2	-175.1	-178.1	-91.4	162.9	0	0	112.5	I526 F530 A752 S756 S758 M820	I526-M754 HydrophobicContact CG2-CB 4.06Å; F530-M754 HydrophobicContact CD1-CE 3.64Å; F530-M754 HydrophobicContact CD1-CG 4.08Å; F530-M754 HydrophobicContact CD1-SD 3.96Å; F530-M754 HydrophobicContact CD2-CG 4.28Å; F530-M754 HydrophobicContact CD2-SD 4.15Å; F530-M754 HydrophobicContact CE1-CE 3.12Å; F530-M754 HydrophobicContact CE1-CG 4.28Å; F530-M754 HydrophobicContact CE1-SD 3.54Å; F530-M754 VanDerWaalsContact CE1-SD 3.54Å; F530-M754 HydrophobicContact CE2-CE 4.46Å; F530-M754 HydrophobicContact CE2-CG 4.49Å; F530-M754 HydrophobicContact CE2-SD 3.78Å; F530-M754 HydrophobicContact CG-CE 4.46Å; F530-M754 HydrophobicContact CG-CG 4.06Å; F530-M754 HydrophobicContact CG-SD 4.22Å; F530-M754 HydrophobicContact CZ-CE 3.61Å; F530-M754 HydrophobicContact CZ-CG 4.48Å; F530-M754 HydrophobicContact CZ-SD 3.44Å; F530-M754 WeakPolarHBondContact CZ-SD 3.35Å; A752-M754 PolarHBondContact O-N 3.26Å; M754-S756 VanDerWaalsContact C-N 3.34Å; M754-S758 VanDerWaalsContact O-CB 3.24Å; M754-S758 WeakPolarHBondContact O-CB 3.43Å; M754-S758 PolarHBondContact O-N 2.97Å; M754-M820 HydrophobicContact CE-CB 3.32Å; M754-M820 HydrophobicContact CE-CG 4.14Å; M754-M820 HydrophobicContact CE-SD 3.83Å
755	L	88.7	Confident	88.2	Confident	11 Å²	11	14 Å²	14	6%	0.058	8%	0.076	C	C	.	.	H	α-helix	trans	-64.4	-40.6	174.2	-68.3	178.5	0	0	0	111.4	T413 N414 I459 A752 T753 S758 H759	T413-L755 HydrophobicContact CG2-CD2 3.46Å; T413-L755 VanDerWaalsContact CG2-CD2 3.46Å; N414-L755 HydrophobicContact CB-CD1 4.12Å; N414-L755 WeakPolarHBondContact OD1-CD1 3.46Å; I459-L755 HydrophobicContact CB-CB 4.25Å; I459-L755 HydrophobicContact CG2-CB 4.19Å; I459-L755 HydrophobicContact CG2-CD1 4.37Å; A752-L755 HydrophobicContact CB-CB 4.06Å; A752-L755 HydrophobicContact CB-CD1 3.89Å; A752-L755 HydrophobicContact CB-CG 4.13Å; A752-L755 PolarHBondContact O-N 2.96Å; T753-L755 PolarHBondContact O-N 2.78Å; L755-S758 PolarHBondContact O-N 2.81Å; L755-H759 WeakPolarHBondContact O-CB 3.23Å; L755-H759 PolarHBondContact O-N 2.85Å
756	S	91.1	Very high	87.3	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-67.7	-42.6	179.2	-52.1	0	0	0	0	111.8	I459 A752 T753 M754 H759 I760	I459-S756 PolarHBondContact N-OG 3.43Å; A752-S756 WeakPolarHBondContact O-CB 3.47Å; A752-S756 PolarHBondContact O-N 3.05Å; A752-S756 PolarHBondContact O-OG 3.41Å; T753-S756 PolarHBondContact O-N 2.76Å; M754-S756 VanDerWaalsContact C-N 3.34Å; S756-H759 WeakPolarHBondContact O-CB 3.25Å; S756-H759 PolarHBondContact O-N 2.83Å; S756-I760 WeakPolarHBondContact O-CG1 3.41Å; S756-I760 PolarHBondContact O-N 2.79Å
757	I	86.7	Confident	85.8	Confident	32 Å²	32	17.2 Å²	17.2	16%	0.164	10%	0.097	C	C	.	.	H	α-helix	trans	-65.3	-44.5	175.3	-66.3	166.4	0	0	0	110.7	I713 T753 H759 I760 E761	I713-I757 HydrophobicContact CG2-CD1 3.89Å; I713-I757 HydrophobicContact CG2-CG1 4.08Å; T753-I757 VanDerWaalsContact O-CG1 3.29Å; T753-I757 WeakPolarHBondContact O-CG1 3.49Å; T753-I757 PolarHBondContact O-N 3.38Å; I757-H759 VanDerWaalsContact C-N 3.27Å; I757-H759 PolarHBondContact O-N 2.74Å; I757-I760 WeakPolarHBondContact O-CB 3.1Å; I757-I760 PolarHBondContact O-N 2.76Å; I757-E761 PolarHBondContact O-N 3.38Å
758	S	82.8	Confident	84.2	Confident	10 Å²	10	23.7 Å²	23.7	7%	0.07	13%	0.128	C	C	.	.	H	α-helix	trans	-63	-37	177.5	-173.9	0	0	0	0	111.9	F409 M754 L755 E761 S762 M820	F409-S758 WeakPolarHBondContact CE1-OG 3.34Å; F409-S758 WeakPolarHBondContact CZ-OG 3.07Å; M754-S758 VanDerWaalsContact O-CB 3.24Å; M754-S758 WeakPolarHBondContact O-CB 3.43Å; M754-S758 PolarHBondContact O-N 2.97Å; L755-S758 PolarHBondContact O-N 2.81Å; S758-E761 PolarHBondContact O-N 2.79Å; S758-S762 PolarHBondContact O-N 2.7Å; S758-M820 WeakPolarHBondContact OG-CE 3.44Å; S758-M820 PolarHBondContact OG-SD 2.64Å
759	H	89.4	Confident	82.3	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-45.5	174.1	179	-134.1	0	0	0	111.9	L410 I459 L755 S756 I757 E761 S762 L763 S787	L410-H759 HydrophobicContact CD1-CB 4.1Å; I459-H759 HydrophobicContact CG1-CB 4.22Å; L755-H759 WeakPolarHBondContact O-CB 3.23Å; L755-H759 PolarHBondContact O-N 2.85Å; S756-H759 WeakPolarHBondContact O-CB 3.25Å; S756-H759 PolarHBondContact O-N 2.83Å; I757-H759 VanDerWaalsContact C-N 3.27Å; I757-H759 PolarHBondContact O-N 2.74Å; H759-E761 VanDerWaalsContact C-N 3.33Å; H759-E761 PolarHBondContact O-N 2.94Å; H759-S762 WeakPolarHBondContact O-CB 3.08Å; H759-S762 PolarHBondContact O-N 3.23Å; H759-S762 VanDerWaalsContact O-N 3.15Å; H759-S762 PolarHBondContact O-OG 2.92Å; H759-L763 VanDerWaalsContact NE2-CD1 3.27Å; H759-L763 WeakPolarHBondContact NE2-CD1 3.27Å; H759-L763 WeakPolarHBondContact O-CG 3.42Å; H759-L763 PolarHBondContact O-N 2.85Å; H759-L763 VanDerWaalsContact O-N 3.16Å; H759-S787 PolarHBondContact CE1-OG 3.28Å; H759-S787 PolarHBondContact NE2-OG 3.46Å
760	I	87.6	Confident	80.4	Confident	11 Å²	11	28.9 Å²	28.9	6%	0.056	16%	0.156	C	C	.	.	H	α-helix	trans	-57.2	-46.6	173.5	-75.3	164.9	0	0	0	111.5	L457 V714 S756 I757 S762 L763 K764 I781	L457-I760 HydrophobicContact CB-CG1 4.49Å; L457-I760 HydrophobicContact CD1-CG1 4.38Å; V714-I760 HydrophobicContact CB-CD1 3.8Å; V714-I760 HydrophobicContact CG1-CD1 3.57Å; V714-I760 HydrophobicContact CG2-CD1 3.51Å; S756-I760 WeakPolarHBondContact O-CG1 3.41Å; S756-I760 PolarHBondContact O-N 2.79Å; I757-I760 WeakPolarHBondContact O-CB 3.1Å; I757-I760 PolarHBondContact O-N 2.76Å; I760-S762 PolarHBondContact O-N 2.83Å; I760-L763 CarbonylContact O-C 3.58Å; I760-L763 WeakPolarHBondContact O-CA 3.24Å; I760-L763 PolarHBondContact O-N 3.46Å; I760-K764 PolarHBondContact O-N 3.12Å; I760-K764 VanDerWaalsContact O-N 3.1Å; I760-I781 HydrophobicContact CB-CD1 4.41Å; I760-I781 HydrophobicContact CG1-CD1 4.46Å; I760-I781 HydrophobicContact CG2-CD1 3.33Å; I760-I781 HydrophobicContact CG2-CG1 4Å
761	E	82	Confident	78.7	Confident	62 Å²	62	29.6 Å²	29.6	29%	0.29	16%	0.163	S	C	.	.	H	α-helix	trans	-63.8	-34	179.6	-175.8	56.6	-159.6	0	0	111.4	I757 S758 H759 L763 K764	I757-E761 PolarHBondContact O-N 3.38Å; S758-E761 PolarHBondContact O-N 2.79Å; H759-E761 VanDerWaalsContact C-N 3.33Å; H759-E761 PolarHBondContact O-N 2.94Å; E761-L763 PolarHBondContact O-N 2.92Å; E761-K764 VanDerWaalsContact O-CB 3.3Å; E761-K764 WeakPolarHBondContact O-CB 3.49Å; E761-K764 PolarHBondContact O-N 3.11Å; E761-K764 IonicContact OE1-NZ 3.89Å; E761-K764 WeakPolarHBondContact OE2-CD 3.26Å; E761-K764 IonicContact OE2-NZ 3.49Å; E761-K764 PolarHBondContact OE2-NZ 3.42Å
762	S	82.9	Confident	76.9	Confident	29 Å²	29	30.8 Å²	30.8	20%	0.203	17%	0.17	C	C	.	.	H	α-helix	trans	-67.7	-22.8	173.2	79.6	0	0	0	0	113.6	Q402 A406 S758 H759 I760	Q402-S762 VanDerWaalsContact CG-O 3.26Å; Q402-S762 WeakPolarHBondContact CG-O 3.39Å; Q402-S762 PolarHBondContact NE2-O 2.85Å; A406-S762 WeakPolarHBondContact CB-OG 3.39Å; S758-S762 PolarHBondContact O-N 2.7Å; H759-S762 WeakPolarHBondContact O-CB 3.08Å; H759-S762 PolarHBondContact O-N 3.23Å; H759-S762 VanDerWaalsContact O-N 3.15Å; H759-S762 PolarHBondContact O-OG 2.92Å; I760-S762 PolarHBondContact O-N 2.83Å
763	L	86.6	Confident	75.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	5.2	-179.3	-67.1	177.8	0	0	0	114	Q402 I403 A406 L457 H759 I760 E761 V765 I781 R782	Q402-L763 VanDerWaalsContact NE2-CA 3.33Å; I403-L763 HydrophobicContact CG1-CD2 4.2Å; A406-L763 HydrophobicContact CB-CD2 4.16Å; L457-L763 HydrophobicContact CD2-CD1 3.72Å; H759-L763 VanDerWaalsContact NE2-CD1 3.27Å; H759-L763 WeakPolarHBondContact NE2-CD1 3.27Å; H759-L763 WeakPolarHBondContact O-CG 3.42Å; H759-L763 PolarHBondContact O-N 2.85Å; H759-L763 VanDerWaalsContact O-N 3.16Å; I760-L763 CarbonylContact O-C 3.58Å; I760-L763 WeakPolarHBondContact O-CA 3.24Å; I760-L763 PolarHBondContact O-N 3.46Å; E761-L763 PolarHBondContact O-N 2.92Å; L763-V765 PolarHBondContact O-N 2.96Å; L763-I781 HydrophobicContact CB-CG2 3.73Å; L763-R782 PolarHBondContact O-N 3.43Å
764	K	82.9	Confident	73.6	Confident	45 Å²	45	33.8 Å²	33.8	20%	0.196	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	123.1	178	-177.2	143.3	-178.9	-170.6	0	111.8	Q402 I760 E761 V766 F778 E827	Q402-K764 PolarHBondContact NE2-O 2.91Å; Q402-K764 VanDerWaalsContact NE2-O 3.09Å; I760-K764 PolarHBondContact O-N 3.12Å; I760-K764 VanDerWaalsContact O-N 3.1Å; E761-K764 VanDerWaalsContact O-CB 3.3Å; E761-K764 WeakPolarHBondContact O-CB 3.49Å; E761-K764 PolarHBondContact O-N 3.11Å; E761-K764 IonicContact OE1-NZ 3.89Å; E761-K764 WeakPolarHBondContact OE2-CD 3.26Å; E761-K764 IonicContact OE2-NZ 3.49Å; E761-K764 PolarHBondContact OE2-NZ 3.42Å; K764-V766 HydrophobicContact CG-CG2 4.12Å; K764-F778 HydrophobicContact CB-CE2 4.37Å; K764-F778 HydrophobicContact CD-CD2 3.85Å; K764-F778 HydrophobicContact CD-CE2 3.75Å; K764-F778 HydrophobicContact CG-CD2 3.62Å; K764-F778 HydrophobicContact CG-CE2 3.54Å; K764-E827 IonicContact NZ-OE1 3.5Å; K764-E827 PolarHBondContact NZ-OE1 2.86Å
765	V	77.3	Confident	72.4	Confident	27 Å²	27	38.1 Å²	38.1	16%	0.164	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	115.4	171.7	-170.8	0	0	0	0	108.9	L763 I779 G780 R782	L763-V765 PolarHBondContact O-N 2.96Å; V765-I779 PolarHBondContact O-N 3.44Å; V765-G780 WeakPolarHBondContact CA-O 3.25Å; V765-G780 WeakPolarHBondContact CB-O 3.33Å; V765-G780 PolarHBondContact N-O 2.54Å; V765-R782 HydrophobicContact CG2-CB 4.5Å; V765-R782 HydrophobicContact CG2-CG 3.26Å
766	V	70.1	Confident	71	Confident	35 Å²	35	41 Å²	41	21%	0.212	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.8	172.5	-179.1	0	0	0	0	107.5	K764 E768 P776	K764-V766 HydrophobicContact CG-CG2 4.12Å; V766-E768 PolarHBondContact O-N 3.25Å; V766-P776 HydrophobicContact CG1-CB 3.25Å; V766-P776 HydrophobicContact CG1-CG 4.39Å
767	S	62.1	Low	69.7	Low	38 Å²	38	43.9 Å²	43.9	27%	0.266	25%	0.251	S	S	.	.			trans	-54.4	128.3	176.6	-171.8	0	0	0	0	111.2	C769 A777	S767-C769 PolarHBondContact O-N 2.93Å; S767-A777 VanDerWaalsContact CB-O 3.31Å; S767-A777 WeakPolarHBondContact CB-O 3.47Å; S767-A777 PolarHBondContact N-O 3.42Å
768	E	59.6	Low	69	Low	139 Å²	139	45.1 Å²	45.1	65%	0.65	26%	0.256	S	S	*	.			trans	-67.4	98.7	162.9	-65.2	-177.2	-178.3	0	0	106.3	V766 K770	V766-E768 PolarHBondContact O-N 3.25Å; E768-K770 PolarHBondContact O-N 3.39Å
769	C	55.5	Low	68.4	Low	59 Å²	59	48.6 Å²	48.6	40%	0.399	27%	0.272	S	S	.	.			trans	-55	106.9	179.6	-65.4	0	0	0	0	109.7	S767 P776	S767-C769 PolarHBondContact O-N 2.93Å; C769-P776 VanDerWaalsContact SG-CA 3.55Å
770	K	55.3	Low	68.1	Low	59 Å²	59	48.8 Å²	48.8	26%	0.257	28%	0.275	S	S	.	.			trans	-80.3	-51.6	170.5	-69.2	-173.5	177.2	-175.4	0	108.5	K220 Q222 E223 E768	K220-K770 CarbonylContact C-O 3.58Å; K220-K770 WeakPolarHBondContact CA-O 3.08Å; K220-K770 WeakPolarHBondContact CB-O 3.2Å; K220-K770 CarbonylContact O-C 3.52Å; K220-K770 WeakPolarHBondContact O-CA 3.37Å; K220-K770 VanDerWaalsContact O-CB 3.3Å; K220-K770 WeakPolarHBondContact O-CB 3.33Å; Q222-K770 HydrophobicContact CG-CD 4.2Å; E223-K770 IonicContact OE1-NZ 2.88Å; E223-K770 PolarHBondContact OE1-NZ 2.78Å; E768-K770 PolarHBondContact O-N 3.39Å
771	A	57.8	Low	68.1	Low	16 Å²	16	48.9 Å²	48.9	13%	0.132	28%	0.275	C	S	.	.	S	Bend	trans	-76	136.8	-176.3	0	0	0	0	0	113.6	V66 G773	V66-A771 HydrophobicContact CG1-CB 4.1Å; A771-G773 PolarHBondContact O-N 2.76Å
772	P	55.9	Low	68.3	Low	26 Å²	26	48.6 Å²	48.6	17%	0.169	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	127.6	174.3	26.9	-31.9	0	0	0	111.2	E70 P82	E70-P772 WeakPolarHBondContact OE1-CB 3.48Å; E70-P772 WeakPolarHBondContact OE1-CG 3.02Å; P82-P772 HydrophobicContact CB-CB 4.42Å; P82-P772 VanDerWaalsContact CB-O 3.3Å; P82-P772 WeakPolarHBondContact CB-O 3.2Å; P82-P772 HydrophobicContact CG-CB 4.21Å; P82-P772 WeakPolarHBondContact CG-O 3.29Å
773	G	55.4	Low	68.5	Low	33 Å²	33	47.9 Å²	47.9	34%	0.34	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.3	-22.6	172.6	0	0	0	0	0	115.4	P82 V336 A771	P82-G773 VanDerWaalsContact CG-CA 3.42Å; V336-G773 VanDerWaalsContact CB-O 3.31Å; V336-G773 WeakPolarHBondContact CB-O 3.22Å; V336-G773 WeakPolarHBondContact CG1-O 3.42Å; A771-G773 PolarHBondContact O-N 2.76Å
774	E	54.5	Low	68.7	Low	60 Å²	60	48 Å²	48	28%	0.28	27%	0.266	S	S	.	.			trans	-72.8	139.2	176.7	-71.1	-172.4	152.2	0	0	112.1	K67 Y68	K67-E774 WeakPolarHBondContact CD-OE1 3.32Å; K67-E774 WeakPolarHBondContact CE-OE1 3.35Å; K67-E774 IonicContact NZ-OE1 2.82Å; K67-E774 PolarHBondContact NZ-OE1 3.01Å; Y68-E774 HydrophobicContact CE2-CG 4.06Å
775	K	55.9	Low	69.1	Low	108 Å²	108	46.2 Å²	46.2	47%	0.47	26%	0.258	S	S	.	.			trans	-67.4	148.1	165.1	-74.7	178.9	-176.6	159.9	0	109.8	S337 A777	S337-K775 PolarHBondContact O-NZ 3.23Å; K775-A777 PolarHBondContact O-N 3.18Å
776	P	60.4	Low	69.8	Low	72 Å²	72	46.5 Å²	46.5	47%	0.468	26%	0.259	S	S	.	.			trans	-55.4	110.6	170.2	17.2	-27.2	0	0	0	110.8	V766 C769	V766-P776 HydrophobicContact CG1-CB 3.25Å; V766-P776 HydrophobicContact CG1-CG 4.39Å; C769-P776 VanDerWaalsContact SG-CA 3.55Å
777	A	63.8	Low	70.9	Confident	59 Å²	59	44.8 Å²	44.8	49%	0.488	25%	0.249	S	C	.	.			trans	-81.2	140.2	174.8	0	0	0	0	0	110.3	S767 K775 I779	S767-A777 VanDerWaalsContact CB-O 3.31Å; S767-A777 WeakPolarHBondContact CB-O 3.47Å; S767-A777 PolarHBondContact N-O 3.42Å; K775-A777 PolarHBondContact O-N 3.18Å; A777-I779 PolarHBondContact O-N 3.15Å
778	F	70.5	Confident	72.3	Confident	59 Å²	59	43.1 Å²	43.1	26%	0.259	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	115.8	171.9	172.9	-103.7	0	0	0	109	E718 L720 K764 I781	E718-F778 WeakPolarHBondContact O-CE1 3.49Å; L720-F778 HydrophobicContact CB-CE1 4.22Å; L720-F778 HydrophobicContact CD1-CD1 3.81Å; L720-F778 HydrophobicContact CD1-CE1 4Å; L720-F778 HydrophobicContact CG-CD1 4.33Å; L720-F778 HydrophobicContact CG-CE1 4.07Å; K764-F778 HydrophobicContact CB-CE2 4.37Å; K764-F778 HydrophobicContact CD-CD2 3.85Å; K764-F778 HydrophobicContact CD-CE2 3.75Å; K764-F778 HydrophobicContact CG-CD2 3.62Å; K764-F778 HydrophobicContact CG-CE2 3.54Å; F778-I781 HydrophobicContact CE2-CG1 4.34Å; F778-I781 HydrophobicContact CZ-CD1 4.45Å; F778-I781 HydrophobicContact CZ-CG1 3.95Å
779	I	71.9	Confident	74	Confident	82 Å²	82	38.5 Å²	38.5	42%	0.421	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-29.6	-178.2	-63.1	178	0	0	0	110.8	V765 A777	V765-I779 PolarHBondContact O-N 3.44Å; A777-I779 PolarHBondContact O-N 3.15Å
780	G	81.8	Confident	75.8	Confident	5 Å²	5	37.1 Å²	37.1	5%	0.052	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	141.1	-167.4	-176.3	0	0	0	0	0	112.2	V765	V765-G780 WeakPolarHBondContact CA-O 3.25Å; V765-G780 WeakPolarHBondContact CB-O 3.33Å; V765-G780 PolarHBondContact N-O 2.54Å
781	I	87.5	Confident	77.7	Confident	14 Å²	14	34.3 Å²	34.3	7%	0.072	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	143.7	-179.3	-62.8	154.3	0	0	0	109.8	L457 N719 L721 I760 L763 F778 E783	L457-I781 HydrophobicContact CD1-CG2 4.35Å; N719-I781 HydrophobicContact CB-CD1 3.46Å; N719-I781 VanDerWaalsContact CB-CD1 3.46Å; N719-I781 WeakPolarHBondContact O-CD1 3.28Å; L721-I781 HydrophobicContact CD2-CB 4.05Å; L721-I781 HydrophobicContact CD2-CD1 3.84Å; I760-I781 HydrophobicContact CB-CD1 4.41Å; I760-I781 HydrophobicContact CG1-CD1 4.46Å; I760-I781 HydrophobicContact CG2-CD1 3.33Å; I760-I781 HydrophobicContact CG2-CG1 4Å; L763-I781 HydrophobicContact CB-CG2 3.73Å; F778-I781 HydrophobicContact CE2-CG1 4.34Å; F778-I781 HydrophobicContact CZ-CD1 4.45Å; F778-I781 HydrophobicContact CZ-CG1 3.95Å; I781-E783 PolarHBondContact O-N 3.12Å; I781-E783 VanDerWaalsContact O-N 3.1Å
782	R	85.8	Confident	79.4	Confident	55 Å²	55	33.7 Å²	33.7	21%	0.208	19%	0.192	C	C	.	.			trans	-74.7	96.6	169.8	-59.5	-169.2	171.6	139.9	-5.8	109.7	S399 L763 V765 Q784	S399-R782 VanDerWaalsContact CA-NH1 3.3Å; S399-R782 PolarHBondContact OG-NE 3.35Å; L763-R782 PolarHBondContact O-N 3.43Å; V765-R782 HydrophobicContact CG2-CB 4.5Å; V765-R782 HydrophobicContact CG2-CG 3.26Å; R782-Q784 PolarHBondContact O-N 3.03Å
783	E	87.8	Confident	81.3	Confident	15 Å²	15	36.3 Å²	36.3	7%	0.07	20%	0.204	C	C	.	.			trans	-70	115.8	175.2	-68.6	171.1	108.3	0	0	111	L457 L721 K722 K723 I781	L457-E783 HydrophobicContact CD1-CG 4.5Å; L721-E783 HydrophobicContact CD2-CG 3.71Å; K722-E783 WeakPolarHBondContact CA-OE2 3.48Å; K722-E783 PolarHBondContact N-OE2 3.36Å; K723-E783 WeakPolarHBondContact CB-OE1 3.42Å; K723-E783 HydrophobicContact CD-CB 3.8Å; K723-E783 HydrophobicContact CG-CB 4.31Å; K723-E783 WeakPolarHBondContact CG-OE2 3.43Å; K723-E783 PolarHBondContact N-OE1 2.88Å; K723-E783 VanDerWaalsContact N-OE1 3.12Å; K723-E783 PolarHBondContact N-OE2 2.79Å; K723-E783 PolarHBondContact NZ-O 3.33Å; I781-E783 PolarHBondContact O-N 3.12Å; I781-E783 VanDerWaalsContact O-N 3.1Å
784	Q	90.6	Very high	83.1	Confident	2 Å²	2	37 Å²	37	1%	0.009	20%	0.2	C	C	.	.			trans	-156.5	160.9	-179.6	57.3	73.7	46.1	0	0	111.9	D389 A393 I403 R782 S787	D389-Q784 WeakPolarHBondContact O-CA 3.46Å; D389-Q784 WeakPolarHBondContact O-CB 3.38Å; A393-Q784 HydrophobicContact CB-CB 4.29Å; I403-Q784 HydrophobicContact CD1-CG 4.02Å; I403-Q784 HydrophobicContact CG1-CG 4.29Å; R782-Q784 PolarHBondContact O-N 3.03Å; Q784-S787 PolarHBondContact NE2-OG 3.27Å
785	R	92	Very high	84.9	Confident	7 Å²	7	34.2 Å²	34.2	3%	0.026	19%	0.187	C	C	.	.	S	Bend	trans	-101.2	-23	-179.3	-71.5	172.6	-174.3	-83	-2.5	114.3	D389 G450 S453 P456 S787 L789	D389-R785 HydrophobicContact CB-CB 4.5Å; D389-R785 HydrophobicContact CB-CG 3.91Å; D389-R785 PolarHBondContact O-N 3.03Å; D389-R785 IonicContact OD2-CZ 2.9Å; D389-R785 IonicContact OD2-NE 3.53Å; D389-R785 PolarHBondContact OD2-NE 3.39Å; D389-R785 IonicContact OD2-NH2 2.8Å; D389-R785 PolarHBondContact OD2-NH2 3.45Å; G450-R785 PolarHBondContact O-NH1 3.48Å; S453-R785 PolarHBondContact O-NH1 3.09Å; S453-R785 PolarHBondContact O-NH2 3.33Å; P456-R785 HydrophobicContact CB-CB 4.39Å; P456-R785 HydrophobicContact CB-CG 3.59Å; P456-R785 HydrophobicContact CG-CG 3.55Å; R785-S787 PolarHBondContact O-N 3.09Å; R785-L789 WeakPolarHBondContact O-CB 3.44Å; R785-L789 PolarHBondContact O-N 3.33Å; R785-L789 VanDerWaalsContact O-N 3.16Å
786	V	92.3	Very high	86.5	Confident	33 Å²	33	30.3 Å²	30.3	20%	0.2	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-42.8	-169.2	179.4	0	0	0	0	112.9	A393 F394 L789 A790	A393-V786 HydrophobicContact CB-CB 4.04Å; A393-V786 HydrophobicContact CB-CG2 3.61Å; F394-V786 HydrophobicContact CE2-CG2 4.19Å; F394-V786 HydrophobicContact CZ-CG1 4.29Å; V786-L789 PolarHBondContact O-N 3.1Å; V786-A790 WeakPolarHBondContact O-CB 3.35Å; V786-A790 PolarHBondContact O-N 2.98Å
787	S	92.3	Very high	87.9	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.8	-40.9	-175.1	71.9	0	0	0	0	112.7	T407 H759 Q784 R785 A791	T407-S787 VanDerWaalsContact OG1-CA 3.3Å; T407-S787 WeakPolarHBondContact OG1-CA 3.42Å; T407-S787 WeakPolarHBondContact OG1-CB 3.5Å; H759-S787 PolarHBondContact CE1-OG 3.28Å; H759-S787 PolarHBondContact NE2-OG 3.46Å; Q784-S787 PolarHBondContact NE2-OG 3.27Å; R785-S787 PolarHBondContact O-N 3.09Å; S787-A791 WeakPolarHBondContact O-CB 3.26Å; S787-A791 PolarHBondContact O-N 3.23Å
788	A	92.5	Very high	88.9	Confident	2 Å²	2	28.5 Å²	28.5	2%	0.017	16%	0.155	C	C	.	.	H	α-helix	trans	-66.7	-46.1	178.2	0	0	0	0	0	109.4	I459 H792	I459-A788 HydrophobicContact CD1-CB 3.56Å; A788-H792 PolarHBondContact O-N 3Å; A788-H792 VanDerWaalsContact O-N 3.15Å; A788-H792 PolarHBondContact O-ND1 2.78Å
789	L	94.4	Very high	89.5	Confident	43 Å²	43	27.6 Å²	27.6	23%	0.225	15%	0.153	C	C	.	.	H	α-helix	trans	-59.7	-51.9	176.4	-179	64.8	0	0	0	112	V447 L451 R785 V786 A791 H792 L793	V447-L789 HydrophobicContact CB-CD1 4.22Å; V447-L789 HydrophobicContact CG1-CD1 3.83Å; V447-L789 HydrophobicContact CG2-CD1 4.16Å; L451-L789 HydrophobicContact CD1-CD1 4.43Å; L451-L789 HydrophobicContact CD2-CD1 4.21Å; L451-L789 HydrophobicContact CD2-CD2 3.97Å; L451-L789 HydrophobicContact CG-CD1 4.02Å; R785-L789 WeakPolarHBondContact O-CB 3.44Å; R785-L789 PolarHBondContact O-N 3.33Å; R785-L789 VanDerWaalsContact O-N 3.16Å; V786-L789 PolarHBondContact O-N 3.1Å; L789-A791 PolarHBondContact O-N 3.5Å; L789-H792 PolarHBondContact O-N 3.09Å; L789-L793 HydrophobicContact CD1-CD1 4.37Å; L789-L793 HydrophobicContact CG-CD1 4.12Å; L789-L793 WeakPolarHBondContact O-CG 3.48Å; L789-L793 PolarHBondContact O-N 3.48Å
790	A	94.3	Very high	90.1	Very high	30 Å²	30	30.2 Å²	30.2	25%	0.248	17%	0.167	C	C	.	.	H	α-helix	trans	-64.8	-38.7	-177.4	0	0	0	0	0	112	T407 V786 L793 L794	T407-A790 HydrophobicContact CG2-CB 3.56Å; V786-A790 WeakPolarHBondContact O-CB 3.35Å; V786-A790 PolarHBondContact O-N 2.98Å; A790-L793 PolarHBondContact O-N 3.17Å; A790-L794 VanDerWaalsContact O-CG 3.29Å; A790-L794 WeakPolarHBondContact O-CG 3.4Å; A790-L794 PolarHBondContact O-N 3.01Å
791	A	93.8	Very high	90.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-41.7	177.9	0	0	0	0	0	112.1	T407 L410 F411 S787 L789 L794 I795	T407-A791 HydrophobicContact CG2-CB 4.17Å; L410-A791 HydrophobicContact CB-CB 4.03Å; L410-A791 HydrophobicContact CD2-CB 3.38Å; L410-A791 HydrophobicContact CG-CB 4.16Å; F411-A791 HydrophobicContact CB-CB 4.41Å; S787-A791 WeakPolarHBondContact O-CB 3.26Å; S787-A791 PolarHBondContact O-N 3.23Å; L789-A791 PolarHBondContact O-N 3.5Å; A791-L794 WeakPolarHBondContact O-CB 3.43Å; A791-L794 PolarHBondContact O-N 3.44Å; A791-I795 WeakPolarHBondContact O-CG1 3.25Å; A791-I795 PolarHBondContact O-N 2.8Å
792	H	95.2	Very high	89.7	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.009	18%	0.182	C	C	.	.	H	α-helix	trans	-71	-33.3	176.5	-67.6	104	0	0	0	113.1	N414 G442 G446 V447 L460 A788 L789 L794 I795 G796	N414-H792 PolarHBondContact ND2-NE2 3.31Å; N414-H792 VanDerWaalsContact ND2-NE2 3.14Å; G442-H792 PolarHBondContact O-CD2 2.8Å; G446-H792 VanDerWaalsContact CA-CG 3.45Å; V447-H792 HydrophobicContact CG2-CB 4.18Å; L460-H792 PolarHBondContact O-NE2 2.95Å; A788-H792 PolarHBondContact O-N 3Å; A788-H792 VanDerWaalsContact O-N 3.15Å; A788-H792 PolarHBondContact O-ND1 2.78Å; L789-H792 PolarHBondContact O-N 3.09Å; H792-L794 VanDerWaalsContact C-N 3.33Å; H792-I795 WeakPolarHBondContact O-CB 3.26Å; H792-I795 PolarHBondContact O-N 2.94Å; H792-G796 PolarHBondContact O-N 3.02Å
793	L	94.7	Very high	89.5	Confident	81 Å²	81	34.8 Å²	34.8	42%	0.424	20%	0.2	S	C	.	.	H	α-helix	trans	-61.4	-42.5	168.8	-74.3	170.4	0	0	0	111.3	V447 L789 A790 I795 G796 L797	V447-L793 HydrophobicContact CG2-CD2 3.79Å; V447-L793 HydrophobicContact CG2-CG 3.9Å; L789-L793 HydrophobicContact CD1-CD1 4.37Å; L789-L793 HydrophobicContact CG-CD1 4.12Å; L789-L793 WeakPolarHBondContact O-CG 3.48Å; L789-L793 PolarHBondContact O-N 3.48Å; A790-L793 PolarHBondContact O-N 3.17Å; L793-I795 VanDerWaalsContact C-N 3.32Å; L793-I795 PolarHBondContact O-N 3.14Å; L793-G796 PolarHBondContact O-N 3.15Å; L793-L797 WeakPolarHBondContact O-CG 3.49Å; L793-L797 PolarHBondContact O-N 3.4Å
794	L	93	Very high	89.3	Confident	49 Å²	49	38.8 Å²	38.8	26%	0.257	22%	0.224	S	C	.	.	H	α-helix	trans	-63.9	-35.8	174.4	-72.4	170.7	0	0	0	112.3	T407 F411 A790 A791 H792 G796 L797 S798	T407-L794 HydrophobicContact CG2-CD1 4.09Å; F411-L794 HydrophobicContact CB-CB 4.29Å; F411-L794 HydrophobicContact CB-CD1 4.19Å; F411-L794 HydrophobicContact CD2-CB 3.4Å; F411-L794 VanDerWaalsContact CD2-CB 3.4Å; F411-L794 VanDerWaalsContact CE2-C 3.44Å; F411-L794 HydrophobicContact CE2-CB 3.83Å; F411-L794 VanDerWaalsContact CE2-O 3.25Å; F411-L794 WeakPolarHBondContact CE2-O 3.25Å; F411-L794 HydrophobicContact CG-CB 3.85Å; F411-L794 HydrophobicContact CG-CD1 4.23Å; A790-L794 VanDerWaalsContact O-CG 3.29Å; A790-L794 WeakPolarHBondContact O-CG 3.4Å; A790-L794 PolarHBondContact O-N 3.01Å; A791-L794 WeakPolarHBondContact O-CB 3.43Å; A791-L794 PolarHBondContact O-N 3.44Å; H792-L794 VanDerWaalsContact C-N 3.33Å; L794-G796 VanDerWaalsContact C-N 3.35Å; L794-L797 CarbonylContact O-C 3.54Å; L794-L797 PolarHBondContact O-N 3.35Å; L794-S798 PolarHBondContact O-N 2.95Å
795	I	92.1	Very high	89	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.3	-44.2	172.3	-67	166.2	0	0	0	110.2	F411 N414 L415 I418 I439 A791 H792 L793 L797 S798	F411-I795 HydrophobicContact CD2-CG1 3.91Å; F411-I795 HydrophobicContact CE2-CG1 4.39Å; N414-I795 HydrophobicContact CB-CD1 3.89Å; N414-I795 VanDerWaalsContact ND2-CD1 3.32Å; N414-I795 WeakPolarHBondContact ND2-CD1 3.35Å; L415-I795 HydrophobicContact CB-CG1 4.5Å; L415-I795 HydrophobicContact CD1-CG2 4.46Å; I418-I795 HydrophobicContact CD1-CD1 3.95Å; I418-I795 HydrophobicContact CD1-CG2 3.91Å; I439-I795 HydrophobicContact CG2-CG2 4.28Å; A791-I795 WeakPolarHBondContact O-CG1 3.25Å; A791-I795 PolarHBondContact O-N 2.8Å; H792-I795 WeakPolarHBondContact O-CB 3.26Å; H792-I795 PolarHBondContact O-N 2.94Å; L793-I795 VanDerWaalsContact C-N 3.32Å; L793-I795 PolarHBondContact O-N 3.14Å; I795-L797 VanDerWaalsContact C-N 3.31Å; I795-L797 PolarHBondContact O-N 3.14Å; I795-S798 WeakPolarHBondContact O-CB 3.36Å; I795-S798 PolarHBondContact O-N 3.4Å; I795-S798 VanDerWaalsContact O-N 3.13Å; I795-S798 PolarHBondContact O-OG 3.05Å
796	G	89.4	Confident	88.7	Confident	27 Å²	27	42.5 Å²	42.5	28%	0.278	24%	0.242	S	C	.	.	H	α-helix	trans	-62.4	-37.5	174	0	0	0	0	0	113.3	H792 L793 L794 S798	H792-G796 PolarHBondContact O-N 3.02Å; L793-G796 PolarHBondContact O-N 3.15Å; L794-G796 VanDerWaalsContact C-N 3.35Å; G796-S798 VanDerWaalsContact C-N 3.27Å; G796-S798 PolarHBondContact O-N 3.17Å
797	L	89.6	Confident	88.4	Confident	92 Å²	92	44.1 Å²	44.1	48%	0.482	25%	0.249	S	C	.	.	H	α-helix	trans	-79.6	-4.3	176	-65	171.7	0	0	0	113.5	L793 L794 I795 L799 L800	L793-L797 WeakPolarHBondContact O-CG 3.49Å; L793-L797 PolarHBondContact O-N 3.4Å; L794-L797 CarbonylContact O-C 3.54Å; L794-L797 PolarHBondContact O-N 3.35Å; I795-L797 VanDerWaalsContact C-N 3.31Å; I795-L797 PolarHBondContact O-N 3.14Å; L797-L799 PolarHBondContact O-N 3.38Å; L797-L799 VanDerWaalsContact O-N 3.13Å; L797-L800 HydrophobicContact CD2-CD1 4.04Å; L797-L800 WeakPolarHBondContact O-CB 3.5Å; L797-L800 PolarHBondContact O-N 3.39Å
798	S	86.4	Confident	88.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-28.3	-176.1	67	0	0	0	0	112.7	L794 I795 G796 L800 L801 T802 L805	L794-S798 PolarHBondContact O-N 2.95Å; I795-S798 WeakPolarHBondContact O-CB 3.36Å; I795-S798 PolarHBondContact O-N 3.4Å; I795-S798 VanDerWaalsContact O-N 3.13Å; I795-S798 PolarHBondContact O-OG 3.05Å; G796-S798 VanDerWaalsContact C-N 3.27Å; G796-S798 PolarHBondContact O-N 3.17Å; S798-L800 PolarHBondContact O-N 3.34Å; S798-L801 CarbonylContact O-C 3.58Å; S798-L801 VanDerWaalsContact O-C 3.3Å; S798-L801 WeakPolarHBondContact O-CA 3.46Å; S798-L801 PolarHBondContact O-N 2.91Å; S798-T802 PolarHBondContact O-N 3.24Å; S798-L805 WeakPolarHBondContact O-CD1 3.36Å
799	L	81.6	Confident	88.2	Confident	40 Å²	40	44.7 Å²	44.7	21%	0.209	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-31.1	175.9	-61.3	173.6	0	0	0	112.9	M436 I439 F668 L797 L801 T802	M436-L799 HydrophobicContact CE-CD1 3.9Å; M436-L799 HydrophobicContact CE-CD2 3.92Å; M436-L799 HydrophobicContact SD-CD2 3.99Å; I439-L799 HydrophobicContact CD1-CD2 4.48Å; F668-L799 HydrophobicContact CD2-CD1 3.51Å; F668-L799 HydrophobicContact CE2-CD1 4.18Å; F668-L799 HydrophobicContact CG-CD1 4.49Å; L797-L799 PolarHBondContact O-N 3.38Å; L797-L799 VanDerWaalsContact O-N 3.13Å; L799-L801 VanDerWaalsContact C-N 3.33Å; L799-T802 VanDerWaalsContact C-OG1 3.32Å; L799-T802 WeakPolarHBondContact CA-OG1 3.41Å; L799-T802 PolarHBondContact O-OG1 3.28Å
800	L	84.6	Confident	87.9	Confident	138 Å²	138	44.7 Å²	44.7	72%	0.723	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-27.4	172.9	-59.7	175.3	0	0	0	111.7	L797 S798	L797-L800 HydrophobicContact CD2-CD1 4.04Å; L797-L800 WeakPolarHBondContact O-CB 3.5Å; L797-L800 PolarHBondContact O-N 3.39Å; S798-L800 PolarHBondContact O-N 3.34Å
801	L	81.6	Confident	87.7	Confident	70 Å²	70	43.3 Å²	43.3	37%	0.366	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	4.7	-179.8	-59.7	174.7	0	0	0	113.1	F411 S798 L799 P803 V804 L805	F411-L801 HydrophobicContact CZ-CD1 4.34Å; S798-L801 CarbonylContact O-C 3.58Å; S798-L801 VanDerWaalsContact O-C 3.3Å; S798-L801 WeakPolarHBondContact O-CA 3.46Å; S798-L801 PolarHBondContact O-N 2.91Å; L799-L801 VanDerWaalsContact C-N 3.33Å; L801-P803 VanDerWaalsContact C-N 3.35Å; L801-V804 PolarHBondContact O-N 2.96Å; L801-L805 HydrophobicContact CB-CD1 3.87Å; L801-L805 HydrophobicContact CB-CG 4.17Å; L801-L805 WeakPolarHBondContact O-CG 3.48Å; L801-L805 PolarHBondContact O-N 2.97Å
802	T	80	Confident	87.6	Confident	10 Å²	10	43.3 Å²	43.3	6%	0.061	24%	0.24	C	C	.	.	H	α-helix	trans	-40.5	-51.5	178.2	-56	0	0	0	0	114.1	L664 S798 L799 V804 L805 Q806	L664-T802 HydrophobicContact CB-CG2 4.28Å; L664-T802 HydrophobicContact CD2-CG2 3.99Å; L664-T802 WeakPolarHBondContact CD2-OG1 3.36Å; S798-T802 PolarHBondContact O-N 3.24Å; L799-T802 VanDerWaalsContact C-OG1 3.32Å; L799-T802 WeakPolarHBondContact CA-OG1 3.41Å; L799-T802 PolarHBondContact O-OG1 3.28Å; T802-V804 VanDerWaalsContact C-N 3.27Å; T802-V804 PolarHBondContact O-N 2.9Å; T802-L805 PolarHBondContact O-N 2.81Å; T802-Q806 HydrophobicContact CG2-CG 4.25Å; T802-Q806 WeakPolarHBondContact O-CB 3.47Å; T802-Q806 WeakPolarHBondContact O-CG 3.33Å; T802-Q806 PolarHBondContact O-N 2.89Å
803	P	82.1	Confident	87.3	Confident	90 Å²	90	43.3 Å²	43.3	58%	0.584	24%	0.24	S	C	*	.	H	α-helix	trans	-65	-30.9	-177	25.4	-35.3	0	0	0	113.1	L801 M807	L801-P803 VanDerWaalsContact C-N 3.35Å; P803-M807 WeakPolarHBondContact O-CG 3.33Å
804	V	83.7	Confident	87.1	Confident	98 Å²	98	39.9 Å²	39.9	59%	0.594	22%	0.222	S	C	*	.	H	α-helix	trans	-77.7	-40.4	177.5	-178.4	0	0	0	0	110.3	L801 T802 M807	L801-V804 PolarHBondContact O-N 2.96Å; T802-V804 VanDerWaalsContact C-N 3.27Å; T802-V804 PolarHBondContact O-N 2.9Å; V804-M807 WeakPolarHBondContact O-CB 3.24Å; V804-M807 PolarHBondContact O-N 2.8Å
805	L	83.7	Confident	87	Confident	8 Å²	8	37.6 Å²	37.6	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-68.9	-34.8	-178.1	-68.6	166.9	0	0	0	112.7	F411 L412 L415 L664 S798 L801 T802 M807 I808	F411-L805 HydrophobicContact CE1-CD2 4.11Å; F411-L805 HydrophobicContact CZ-CD1 4.35Å; F411-L805 HydrophobicContact CZ-CD2 3.99Å; L412-L805 HydrophobicContact CD2-CD2 4.35Å; L415-L805 HydrophobicContact CD2-CD1 3.68Å; L415-L805 HydrophobicContact CD2-CD2 3.7Å; L415-L805 HydrophobicContact CD2-CG 4.26Å; L664-L805 HydrophobicContact CD2-CD1 4.19Å; S798-L805 WeakPolarHBondContact O-CD1 3.36Å; L801-L805 HydrophobicContact CB-CD1 3.87Å; L801-L805 HydrophobicContact CB-CG 4.17Å; L801-L805 WeakPolarHBondContact O-CG 3.48Å; L801-L805 PolarHBondContact O-N 2.97Å; T802-L805 PolarHBondContact O-N 2.81Å; L805-M807 PolarHBondContact O-N 3.32Å; L805-I808 HydrophobicContact CD2-CD1 4.04Å; L805-I808 WeakPolarHBondContact O-CB 3.28Å; L805-I808 PolarHBondContact O-N 2.87Å; L805-I808 VanDerWaalsContact O-N 3.13Å
806	Q	85.1	Confident	86.9	Confident	79 Å²	79	37.6 Å²	37.6	37%	0.369	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.1	174.3	-74.8	-179.1	-8.9	0	0	113.1	K661 L664 T802 I808	K661-Q806 VanDerWaalsContact CB-O 3.3Å; K661-Q806 WeakPolarHBondContact CB-O 3.35Å; K661-Q806 VanDerWaalsContact CD-O 3.25Å; K661-Q806 WeakPolarHBondContact CD-O 3.47Å; K661-Q806 WeakPolarHBondContact CG-O 3.46Å; L664-Q806 PolarHBondContact O-NE2 2.9Å; T802-Q806 HydrophobicContact CG2-CG 4.25Å; T802-Q806 WeakPolarHBondContact O-CB 3.47Å; T802-Q806 WeakPolarHBondContact O-CG 3.33Å; T802-Q806 PolarHBondContact O-N 2.89Å; Q806-I808 VanDerWaalsContact C-N 3.31Å
807	M	86.9	Confident	86.7	Confident	67 Å²	67	36.7 Å²	36.7	33%	0.33	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-22	174.6	-61.1	-65.4	-79.2	0	0	112.4	T649 E653 P803 V804 L805 P809	T649-M807 HydrophobicContact CG2-CB 4.11Å; T649-M807 WeakPolarHBondContact CG2-O 3.4Å; E653-M807 HydrophobicContact CB-CE 4.46Å; E653-M807 HydrophobicContact CG-CE 3.65Å; E653-M807 WeakPolarHBondContact OE2-CE 3.46Å; P803-M807 WeakPolarHBondContact O-CG 3.33Å; V804-M807 WeakPolarHBondContact O-CB 3.24Å; V804-M807 PolarHBondContact O-N 2.8Å; L805-M807 PolarHBondContact O-N 3.32Å; M807-P809 WeakPolarHBondContact O-CD 3.45Å
808	I	89.1	Confident	86.7	Confident	14 Å²	14	33.4 Å²	33.4	7%	0.072	18%	0.181	C	C	.	.	S	Bend	trans	-73.8	122.2	-171.6	-58.1	174.5	0	0	0	109.8	L412 I645 L662 L805 Q806 L813	L412-I808 HydrophobicContact CD2-CD1 3.8Å; I645-I808 HydrophobicContact CG2-CG2 3.83Å; L662-I808 HydrophobicContact CD1-CB 4.14Å; L662-I808 HydrophobicContact CD1-CG2 4.36Å; L662-I808 PolarHBondContact N-O 2.89Å; L805-I808 HydrophobicContact CD2-CD1 4.04Å; L805-I808 WeakPolarHBondContact O-CB 3.28Å; L805-I808 PolarHBondContact O-N 2.87Å; L805-I808 VanDerWaalsContact O-N 3.13Å; Q806-I808 VanDerWaalsContact C-N 3.31Å; I808-L813 HydrophobicContact CG2-CD1 4.02Å; I808-L813 HydrophobicContact CG2-CD2 4.3Å; I808-L813 HydrophobicContact CG2-CG 4.07Å
809	P	90.3	Very high	86.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-75.1	131.3	177.8	30.5	-33.6	0	0	0	110.7	L608 T649 V659 M807 P811 A812	L608-P809 HydrophobicContact CD1-CB 4.13Å; L608-P809 HydrophobicContact CD1-CG 4.32Å; T649-P809 WeakPolarHBondContact OG1-CD 3.15Å; V659-P809 HydrophobicContact CG2-CB 3.89Å; M807-P809 WeakPolarHBondContact O-CD 3.45Å; P809-P811 VanDerWaalsContact C-CD 3.42Å; P809-A812 HydrophobicContact CG-CB 3.84Å; P809-A812 PolarHBondContact O-N 2.72Å
810	L	88.4	Confident	86.9	Confident	44 Å²	44	32.1 Å²	32.1	23%	0.23	17%	0.174	C	C	.	.	H	α-helix	trans	-56.2	-40.3	176.2	-178.2	65.1	0	0	0	113.2	I420 P660 A812 L813 L814	I420-L810 HydrophobicContact CD1-CD1 4.46Å; P660-L810 WeakPolarHBondContact O-CB 3.35Å; P660-L810 PolarHBondContact O-N 3.09Å; L810-A812 PolarHBondContact O-N 3.34Å; L810-L813 PolarHBondContact O-N 3.17Å; L810-L813 VanDerWaalsContact O-N 3.14Å; L810-L814 HydrophobicContact CG-CD1 4.34Å; L810-L814 HydrophobicContact CG-CG 4.49Å; L810-L814 WeakPolarHBondContact O-CG 3.27Å; L810-L814 PolarHBondContact O-N 2.85Å; L810-L814 VanDerWaalsContact O-N 3.11Å
811	P	91.6	Very high	86.7	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58	-32.9	177.3	-24.9	32.5	0	0	0	114.4	M538 I541 S605 L608 F609 P660 P809 L814 G815	M538-P811 HydrophobicContact CE-CB 4.26Å; I541-P811 HydrophobicContact CD1-CG 3.98Å; S605-P811 VanDerWaalsContact O-CB 3.31Å; S605-P811 WeakPolarHBondContact O-CB 3.31Å; L608-P811 HydrophobicContact CB-CB 4.24Å; F609-P811 WeakPolarHBondContact CA-O 3.06Å; F609-P811 HydrophobicContact CB-CB 4.43Å; P660-P811 HydrophobicContact CG-CG 4.3Å; P809-P811 VanDerWaalsContact C-CD 3.42Å; P811-L814 PolarHBondContact O-N 3.49Å; P811-G815 PolarHBondContact O-N 3.03Å
812	A	91.1	Very high	87	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-68.3	-39.9	178.6	0	0	0	0	0	111.7	A612 A648 P809 L810 G815 V816	A612-A812 HydrophobicContact CB-CB 4.14Å; A612-A812 WeakPolarHBondContact CB-O 3.42Å; A648-A812 HydrophobicContact CB-CB 3.52Å; P809-A812 HydrophobicContact CG-CB 3.84Å; P809-A812 PolarHBondContact O-N 2.72Å; L810-A812 PolarHBondContact O-N 3.34Å; A812-G815 PolarHBondContact O-N 3.04Å; A812-V816 PolarHBondContact O-N 2.91Å; A812-V816 VanDerWaalsContact O-N 3.09Å
813	L	89.3	Confident	87	Confident	2 Å²	2	25.1 Å²	25.1	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-64.1	-44.5	175.7	-64.6	167	0	0	0	110.8	A416 I645 L662 I808 L810 G815 V816 F817	A416-L813 HydrophobicContact CB-CD1 3.86Å; I645-L813 HydrophobicContact CD1-CD2 3.8Å; I645-L813 HydrophobicContact CG1-CD2 4.2Å; I645-L813 HydrophobicContact CG2-CD2 4.45Å; L662-L813 HydrophobicContact CD1-CD1 3.87Å; L662-L813 HydrophobicContact CD2-CD1 3.91Å; L662-L813 HydrophobicContact CG-CD1 3.99Å; I808-L813 HydrophobicContact CG2-CD1 4.02Å; I808-L813 HydrophobicContact CG2-CD2 4.3Å; I808-L813 HydrophobicContact CG2-CG 4.07Å; L810-L813 PolarHBondContact O-N 3.17Å; L810-L813 VanDerWaalsContact O-N 3.14Å; L813-G815 VanDerWaalsContact C-N 3.26Å; L813-G815 PolarHBondContact O-N 2.88Å; L813-V816 PolarHBondContact O-N 3.25Å; L813-F817 WeakPolarHBondContact O-CB 3.29Å; L813-F817 WeakPolarHBondContact O-CD1 3.4Å; L813-F817 WeakPolarHBondContact O-CG 3.46Å; L813-F817 PolarHBondContact O-N 3.49Å
814	L	89.9	Confident	86.6	Confident	10 Å²	10	21.9 Å²	21.9	5%	0.052	12%	0.119	C	C	.	.	H	α-helix	trans	-59.2	-37.2	175	-65	174.2	0	0	0	112	I541 F609 L810 P811 F817 L818	I541-L814 HydrophobicContact CD1-CD1 4.19Å; F609-L814 HydrophobicContact CD2-CB 3.71Å; F609-L814 HydrophobicContact CE2-CB 3.77Å; F609-L814 WeakPolarHBondContact CE2-O 3.14Å; L810-L814 HydrophobicContact CG-CD1 4.34Å; L810-L814 HydrophobicContact CG-CG 4.49Å; L810-L814 WeakPolarHBondContact O-CG 3.27Å; L810-L814 PolarHBondContact O-N 2.85Å; L810-L814 VanDerWaalsContact O-N 3.11Å; P811-L814 PolarHBondContact O-N 3.49Å; L814-F817 WeakPolarHBondContact O-CB 3.31Å; L814-F817 PolarHBondContact O-N 3.21Å; L814-L818 PolarHBondContact O-N 3.31Å
815	G	91.7	Very high	86.4	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-67.3	-41.3	177.1	0	0	0	0	0	113.2	F609 P811 A812 L813 F817 L818 H819	F609-G815 VanDerWaalsContact CD2-CA 3.45Å; F609-G815 WeakPolarHBondContact O-CA 3.33Å; P811-G815 PolarHBondContact O-N 3.03Å; A812-G815 PolarHBondContact O-N 3.04Å; L813-G815 VanDerWaalsContact C-N 3.26Å; L813-G815 PolarHBondContact O-N 2.88Å; G815-F817 VanDerWaalsContact C-N 3.35Å; G815-L818 PolarHBondContact O-N 3.4Å; G815-H819 PolarHBondContact O-N 2.96Å
816	V	89	Confident	86.1	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.6	-42.5	172	169.3	0	0	0	0	110.6	F409 A612 M616 S644 I645 A812 L813 L818 H819 M820	F409-V816 HydrophobicContact CE2-CG1 4.33Å; A612-V816 HydrophobicContact CB-CG2 4.34Å; M616-V816 HydrophobicContact CE-CG1 4.12Å; M616-V816 HydrophobicContact SD-CB 4.09Å; M616-V816 HydrophobicContact SD-CG1 3.7Å; M616-V816 HydrophobicContact SD-CG2 4.17Å; S644-V816 WeakPolarHBondContact OG-CG2 3.3Å; I645-V816 HydrophobicContact CG1-CG2 3.98Å; A812-V816 PolarHBondContact O-N 2.91Å; A812-V816 VanDerWaalsContact O-N 3.09Å; L813-V816 PolarHBondContact O-N 3.25Å; V816-L818 PolarHBondContact O-N 2.95Å; V816-H819 PolarHBondContact O-N 3.48Å; V816-M820 HydrophobicContact CG1-CE 4.22Å; V816-M820 HydrophobicContact CG1-SD 4.45Å; V816-M820 WeakPolarHBondContact O-CG 3.45Å; V816-M820 PolarHBondContact O-N 2.88Å; V816-M820 VanDerWaalsContact O-N 3.09Å
817	F	85	Confident	85.3	Confident	9 Å²	9	26.1 Å²	26.1	4%	0.039	13%	0.131	C	C	.	.	H	α-helix	trans	-61.9	-43.2	178	-72.9	-1.7	0	0	0	112.5	T413 A416 F530 L813 L814 G815 H819 M820 G821	T413-F817 HydrophobicContact CG2-CD1 4.2Å; T413-F817 HydrophobicContact CG2-CE1 3.33Å; T413-F817 HydrophobicContact CG2-CZ 3.96Å; A416-F817 HydrophobicContact CB-CZ 3.99Å; F530-F817 HydrophobicContact CD1-CB 4.29Å; F530-F817 WeakPolarHBondContact CD1-O 3.42Å; F530-F817 HydrophobicContact CE1-CB 3.32Å; F530-F817 HydrophobicContact CE1-CD1 4.12Å; F530-F817 HydrophobicContact CE1-CD2 4.3Å; F530-F817 AromaticContact CE1-CG 3.67Å; F530-F817 HydrophobicContact CE1-CG 3.67Å; F530-F817 VanDerWaalsContact CE1-O 3.31Å; F530-F817 WeakPolarHBondContact CE1-O 3.4Å; F530-F817 HydrophobicContact CE2-CD2 4.3Å; F530-F817 HydrophobicContact CE2-CG 4.44Å; F530-F817 HydrophobicContact CZ-CB 3.56Å; F530-F817 AromaticContact CZ-CD1 3.81Å; F530-F817 HydrophobicContact CZ-CD1 3.81Å; F530-F817 AromaticContact CZ-CD2 3.61Å; F530-F817 HydrophobicContact CZ-CD2 3.61Å; F530-F817 HydrophobicContact CZ-CE1 4.41Å; F530-F817 HydrophobicContact CZ-CE2 4.22Å; F530-F817 AromaticContact CZ-CG 3.37Å; F530-F817 HydrophobicContact CZ-CG 3.37Å; L813-F817 WeakPolarHBondContact O-CB 3.29Å; L813-F817 WeakPolarHBondContact O-CD1 3.4Å; L813-F817 WeakPolarHBondContact O-CG 3.46Å; L813-F817 PolarHBondContact O-N 3.49Å; L814-F817 WeakPolarHBondContact O-CB 3.31Å; L814-F817 PolarHBondContact O-N 3.21Å; G815-F817 VanDerWaalsContact C-N 3.35Å; F817-H819 VanDerWaalsContact C-N 3.33Å; F817-H819 PolarHBondContact O-N 3.41Å; F817-M820 PolarHBondContact O-N 3.47Å; F817-G821 PolarHBondContact O-N 3Å
818	L	90.8	Very high	84.5	Confident	22 Å²	22	24.1 Å²	24.1	12%	0.115	12%	0.121	C	C	.	.	H	α-helix	trans	-56.8	-46.9	174.1	178.1	67	0	0	0	111.5	V531 A534 F609 Y613 L814 G815 V816 M820 G821 L822	V531-L818 HydrophobicContact CG1-CD1 3.89Å; V531-L818 HydrophobicContact CG2-CD1 4.46Å; A534-L818 HydrophobicContact CB-CB 4.09Å; F609-L818 HydrophobicContact CE1-CD2 3.61Å; F609-L818 HydrophobicContact CE2-CB 4.29Å; F609-L818 HydrophobicContact CZ-CB 3.88Å; F609-L818 HydrophobicContact CZ-CD2 3.44Å; F609-L818 VanDerWaalsContact CZ-CD2 3.44Å; F609-L818 HydrophobicContact CZ-CG 4.17Å; Y613-L818 HydrophobicContact CD2-CD2 4.13Å; Y613-L818 HydrophobicContact CD2-CG 4.29Å; L814-L818 PolarHBondContact O-N 3.31Å; G815-L818 PolarHBondContact O-N 3.4Å; V816-L818 PolarHBondContact O-N 2.95Å; L818-M820 VanDerWaalsContact C-N 3.3Å; L818-M820 PolarHBondContact O-N 3.15Å; L818-G821 PolarHBondContact O-N 2.82Å; L818-L822 HydrophobicContact CD1-CD1 3.97Å; L818-L822 HydrophobicContact CD1-CG 4.21Å; L818-L822 HydrophobicContact CD2-CD1 4.43Å; L818-L822 HydrophobicContact CG-CD1 3.91Å; L818-L822 HydrophobicContact CG-CG 4.49Å; L818-L822 WeakPolarHBondContact O-CB 2.98Å; L818-L822 WeakPolarHBondContact O-CG 3.46Å; L818-L822 PolarHBondContact O-N 2.74Å
819	H	88.7	Confident	83.4	Confident	6 Å²	6	30.3 Å²	30.3	3%	0.028	15%	0.149	C	C	.	.	H	α-helix	trans	-61.2	-40.1	179.1	176.6	88.1	0	0	0	112.1	Y613 M616 K620 G815 V816 F817 S823	Y613-H819 HydrophobicContact CD2-CB 3.6Å; Y613-H819 HydrophobicContact CE2-CB 3.86Å; Y613-H819 AromaticContact CE2-ND1 3.98Å; M616-H819 HydrophobicContact CE-CB 4.4Å; M616-H819 WeakPolarHBondContact CE-CD2 3.3Å; M616-H819 HydrophobicContact CG-CB 4.4Å; M616-H819 HydrophobicContact SD-CB 3.55Å; M616-H819 VanDerWaalsContact SD-CB 3.55Å; M616-H819 PolarHBondContact SD-CD2 2.83Å; M616-H819 VanDerWaalsContact SD-CG 3.54Å; K620-H819 WeakPolarHBondContact CD-NE2 3.4Å; K620-H819 PolarHBondContact NZ-NE2 3.15Å; G815-H819 PolarHBondContact O-N 2.96Å; V816-H819 PolarHBondContact O-N 3.48Å; F817-H819 VanDerWaalsContact C-N 3.33Å; F817-H819 PolarHBondContact O-N 3.41Å; H819-S823 PolarHBondContact NE2-OG 2.98Å; H819-S823 WeakPolarHBondContact O-CB 3.41Å; H819-S823 PolarHBondContact O-N 2.93Å; H819-S823 PolarHBondContact O-OG 2.88Å
820	M	82.3	Confident	82.1	Confident	8 Å²	8	32.9 Å²	32.9	4%	0.039	16%	0.163	C	C	.	.	H	α-helix	trans	-65.4	-46.9	177.8	-67.5	-169.2	161.7	0	0	112.4	F409 M616 P641 M754 S758 V816 F817 L818 L822 S823 C824	F409-M820 HydrophobicContact CD1-CE 4.4Å; F409-M820 HydrophobicContact CD2-CE 3.91Å; F409-M820 HydrophobicContact CE1-CE 3.66Å; F409-M820 HydrophobicContact CE1-SD 4.22Å; F409-M820 HydrophobicContact CE2-CE 3.01Å; F409-M820 HydrophobicContact CE2-SD 3.72Å; F409-M820 HydrophobicContact CZ-CE 2.95Å; F409-M820 HydrophobicContact CZ-SD 3.29Å; F409-M820 WeakPolarHBondContact CZ-SD 3.37Å; M616-M820 HydrophobicContact CE-CE 3.25Å; M616-M820 HydrophobicContact CE-CG 3.69Å; M616-M820 HydrophobicContact CE-SD 4.35Å; P641-M820 HydrophobicContact CB-CE 4.39Å; P641-M820 HydrophobicContact CG-CE 4.27Å; M754-M820 HydrophobicContact CE-CB 3.32Å; M754-M820 HydrophobicContact CE-CG 4.14Å; M754-M820 HydrophobicContact CE-SD 3.83Å; S758-M820 WeakPolarHBondContact OG-CE 3.44Å; S758-M820 PolarHBondContact OG-SD 2.64Å; V816-M820 HydrophobicContact CG1-CE 4.22Å; V816-M820 HydrophobicContact CG1-SD 4.45Å; V816-M820 WeakPolarHBondContact O-CG 3.45Å; V816-M820 PolarHBondContact O-N 2.88Å; V816-M820 VanDerWaalsContact O-N 3.09Å; F817-M820 PolarHBondContact O-N 3.47Å; L818-M820 VanDerWaalsContact C-N 3.3Å; L818-M820 PolarHBondContact O-N 3.15Å; M820-L822 VanDerWaalsContact C-N 3.33Å; M820-L822 PolarHBondContact O-N 3.31Å; M820-S823 PolarHBondContact O-N 3.14Å; M820-C824 PolarHBondContact O-N 3.05Å; M820-C824 PolarHBondContact O-SG 2.84Å
821	G	81.7	Confident	81	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.8	-44.5	176.2	0	0	0	0	0	112.1	F817 L818 L825	F817-G821 PolarHBondContact O-N 3Å; L818-G821 PolarHBondContact O-N 2.82Å; G821-L825 PolarHBondContact O-N 3.46Å; G821-L825 VanDerWaalsContact O-N 3.11Å
822	L	86.3	Confident	79.7	Confident	38 Å²	38	34.7 Å²	34.7	20%	0.199	17%	0.174	C	C	.	.	H	α-helix	trans	-67.2	-41	178.3	-72.5	173.3	0	0	0	113	V531 Y613 L818 M820 L825 F826	V531-L822 HydrophobicContact CG2-CD2 4.22Å; V531-L822 HydrophobicContact CG2-CG 4.22Å; Y613-L822 HydrophobicContact CE2-CD1 3.94Å; L818-L822 HydrophobicContact CD1-CD1 3.97Å; L818-L822 HydrophobicContact CD1-CG 4.21Å; L818-L822 HydrophobicContact CD2-CD1 4.43Å; L818-L822 HydrophobicContact CG-CD1 3.91Å; L818-L822 HydrophobicContact CG-CG 4.49Å; L818-L822 WeakPolarHBondContact O-CB 2.98Å; L818-L822 WeakPolarHBondContact O-CG 3.46Å; L818-L822 PolarHBondContact O-N 2.74Å; M820-L822 VanDerWaalsContact C-N 3.33Å; M820-L822 PolarHBondContact O-N 3.31Å; L822-L825 WeakPolarHBondContact O-CB 3.24Å; L822-L825 PolarHBondContact O-N 3.17Å; L822-F826 HydrophobicContact CB-CE2 4.18Å; L822-F826 WeakPolarHBondContact O-CD2 3.22Å; L822-F826 PolarHBondContact O-N 2.95Å
823	S	80	Confident	78.6	Confident	33 Å²	33	40.6 Å²	40.6	23%	0.231	20%	0.203	C	C	.	.	H	α-helix	trans	-63.7	-43.4	178	-64.4	0	0	0	0	111.6	H819 M820 L825 F826 E827	H819-S823 PolarHBondContact NE2-OG 2.98Å; H819-S823 WeakPolarHBondContact O-CB 3.41Å; H819-S823 PolarHBondContact O-N 2.93Å; H819-S823 PolarHBondContact O-OG 2.88Å; M820-S823 PolarHBondContact O-N 3.14Å; S823-L825 VanDerWaalsContact C-N 3.26Å; S823-L825 PolarHBondContact O-N 3.36Å; S823-F826 PolarHBondContact O-N 3.45Å; S823-E827 PolarHBondContact O-N 3.48Å
824	C	75	Confident	77.6	Confident	21 Å²	21	44.2 Å²	44.2	14%	0.142	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-36.3	175.3	-63.3	0	0	0	0	111.8	A527 M820 Q828	A527-C824 HydrophobicContact CB-CB 4.19Å; M820-C824 PolarHBondContact O-N 3.05Å; M820-C824 PolarHBondContact O-SG 2.84Å; C824-Q828 WeakPolarHBondContact O-CG 3.27Å
825	L	79.7	Confident	76.7	Confident	33 Å²	33	46.9 Å²	46.9	17%	0.173	24%	0.242	C	C	.	.	H	α-helix	trans	-66.5	-43.3	177.5	-167.8	86.6	0	0	0	112.2	T524 V528 G821 L822 S823 E827 Q828 L831	T524-L825 HydrophobicContact CG2-CD1 4.46Å; V528-L825 HydrophobicContact CG2-CD1 3.89Å; G821-L825 PolarHBondContact O-N 3.46Å; G821-L825 VanDerWaalsContact O-N 3.11Å; L822-L825 WeakPolarHBondContact O-CB 3.24Å; L822-L825 PolarHBondContact O-N 3.17Å; S823-L825 VanDerWaalsContact C-N 3.26Å; S823-L825 PolarHBondContact O-N 3.36Å; L825-E827 VanDerWaalsContact C-N 3.3Å; L825-E827 PolarHBondContact O-N 2.81Å; L825-Q828 PolarHBondContact O-N 2.68Å; L825-L831 HydrophobicContact CD1-CD1 4.02Å; L825-L831 HydrophobicContact CD1-CD2 3.75Å; L825-L831 HydrophobicContact CD1-CG 4.48Å; L825-L831 HydrophobicContact CD2-CD2 4.06Å; L825-L831 HydrophobicContact CG-CD2 3.69Å
826	F	75.8	Confident	75.6	Confident	143 Å²	143	51 Å²	51	63%	0.627	26%	0.263	S	S	*	.	H	α-helix	trans	-69.9	-25.3	-178.5	-72.3	-58	0	0	0	113.5	L822 S823 Q828	L822-F826 HydrophobicContact CB-CE2 4.18Å; L822-F826 WeakPolarHBondContact O-CD2 3.22Å; L822-F826 PolarHBondContact O-N 2.95Å; S823-F826 PolarHBondContact O-N 3.45Å; F826-Q828 VanDerWaalsContact C-N 3.34Å
827	E	68.2	Low	74.8	Confident	99 Å²	99	57.2 Å²	57.2	46%	0.463	29%	0.286	S	S	.	.	H	α-helix	trans	-75.4	-22.4	175.7	-70	-173.6	155.5	0	0	112.9	K764 S823 L825 Q829	K764-E827 IonicContact NZ-OE1 3.5Å; K764-E827 PolarHBondContact NZ-OE1 2.86Å; S823-E827 PolarHBondContact O-N 3.48Å; L825-E827 VanDerWaalsContact C-N 3.3Å; L825-E827 PolarHBondContact O-N 2.81Å; E827-Q829 PolarHBondContact O-N 3.07Å
828	Q	71	Confident	74.4	Confident	25 Å²	25	63.7 Å²	63.7	12%	0.117	31%	0.314	C	S	.	.			trans	-76.4	95.9	177.5	-60.8	-72.6	-44	0	0	110.5	C824 L825 F826 L830 L831 V832	C824-Q828 WeakPolarHBondContact O-CG 3.27Å; L825-Q828 PolarHBondContact O-N 2.68Å; F826-Q828 VanDerWaalsContact C-N 3.34Å; Q828-L830 PolarHBondContact O-N 3.33Å; Q828-L831 HydrophobicContact CB-CB 4.48Å; Q828-L831 PolarHBondContact O-N 2.84Å; Q828-V832 WeakPolarHBondContact O-CG2 3.42Å; Q828-V832 PolarHBondContact O-N 3.04Å; Q828-V832 VanDerWaalsContact O-N 3.12Å
829	Q	65.4	Low	73.6	Confident	144 Å²	144	67.4 Å²	67.4	67%	0.673	33%	0.334	S	S	*	.	H	α-helix	trans	-53.1	-40.4	-179.6	-64.3	-176.3	-3.2	0	0	113	E827 V832 M833	E827-Q829 PolarHBondContact O-N 3.07Å; Q829-V832 PolarHBondContact O-N 3.12Å; Q829-M833 WeakPolarHBondContact O-CB 3.13Å; Q829-M833 WeakPolarHBondContact O-CG 3.49Å; Q829-M833 PolarHBondContact O-N 2.71Å
830	L	64.2	Low	72.9	Confident	53 Å²	53	69.2 Å²	69.2	28%	0.277	34%	0.343	S	S	.	.	H	α-helix	trans	-64.2	-47.1	-178	-179.6	71.3	0	0	0	112.2	F517 E520 Q828 M833 V834	F517-L830 HydrophobicContact CD2-CD2 3.69Å; F517-L830 HydrophobicContact CE2-CD2 3.8Å; E520-L830 HydrophobicContact CB-CD2 4.25Å; E520-L830 WeakPolarHBondContact OE2-CB 3.19Å; E520-L830 WeakPolarHBondContact OE2-CD2 3.42Å; Q828-L830 PolarHBondContact O-N 3.33Å; L830-M833 PolarHBondContact O-N 3.47Å; L830-V834 HydrophobicContact CD1-CG2 4.28Å; L830-V834 HydrophobicContact CG-CG2 4.38Å; L830-V834 WeakPolarHBondContact O-CB 3.43Å; L830-V834 VanDerWaalsContact O-CG2 3.24Å; L830-V834 WeakPolarHBondContact O-CG2 3.34Å; L830-V834 PolarHBondContact O-N 3.23Å
831	L	63.9	Low	72.7	Confident	37 Å²	37	73.1 Å²	73.1	19%	0.194	36%	0.364	C	S	.	.	H	α-helix	trans	-67.7	-42.6	178.2	175.2	135.2	0	0	0	110.5	T524 L825 Q828 M833 V834 V835	T524-L831 HydrophobicContact CG2-CB 4.2Å; T524-L831 HydrophobicContact CG2-CD1 3.23Å; T524-L831 HydrophobicContact CG2-CG 4.25Å; L825-L831 HydrophobicContact CD1-CD1 4.02Å; L825-L831 HydrophobicContact CD1-CD2 3.75Å; L825-L831 HydrophobicContact CD1-CG 4.48Å; L825-L831 HydrophobicContact CD2-CD2 4.06Å; L825-L831 HydrophobicContact CG-CD2 3.69Å; Q828-L831 HydrophobicContact CB-CB 4.48Å; Q828-L831 PolarHBondContact O-N 2.84Å; L831-M833 PolarHBondContact O-N 2.99Å; L831-V834 PolarHBondContact O-N 3.15Å; L831-V834 VanDerWaalsContact O-N 3.14Å; L831-V835 HydrophobicContact CD1-CG2 4.11Å; L831-V835 HydrophobicContact CD2-CB 4.49Å; L831-V835 HydrophobicContact CD2-CG2 3.83Å; L831-V835 HydrophobicContact CG-CG2 3.69Å; L831-V835 VanDerWaalsContact O-CB 3.28Å; L831-V835 WeakPolarHBondContact O-CB 3.48Å; L831-V835 WeakPolarHBondContact O-CG2 3.34Å; L831-V835 PolarHBondContact O-N 3.45Å
832	V	65.1	Low	72.6	Confident	45 Å²	45	83.5 Å²	83.5	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-55.9	-45.6	175.4	173.9	0	0	0	0	109.5	Q828 Q829 I836	Q828-V832 WeakPolarHBondContact O-CG2 3.42Å; Q828-V832 PolarHBondContact O-N 3.04Å; Q828-V832 VanDerWaalsContact O-N 3.12Å; Q829-V832 PolarHBondContact O-N 3.12Å; V832-I836 HydrophobicContact CG1-CD1 3.46Å; V832-I836 VanDerWaalsContact CG1-CD1 3.46Å; V832-I836 HydrophobicContact CG1-CG1 4.3Å; V832-I836 WeakPolarHBondContact O-CB 3.36Å; V832-I836 WeakPolarHBondContact O-CD1 3.4Å; V832-I836 WeakPolarHBondContact O-CG1 3.24Å; V832-I836 PolarHBondContact O-N 2.73Å
833	M	66.9	Low	72.4	Confident	125 Å²	125	87 Å²	87	62%	0.616	43%	0.426	S	S	*	.	H	α-helix	trans	-63.4	-44.1	174.4	-78.4	-160.9	175.5	0	0	113.5	Q829 L830 L831 R837	Q829-M833 WeakPolarHBondContact O-CB 3.13Å; Q829-M833 WeakPolarHBondContact O-CG 3.49Å; Q829-M833 PolarHBondContact O-N 2.71Å; L830-M833 PolarHBondContact O-N 3.47Å; L831-M833 PolarHBondContact O-N 2.99Å; M833-R837 WeakPolarHBondContact O-CB 3.39Å; M833-R837 PolarHBondContact O-N 3.41Å
834	V	69.7	Low	72.4	Confident	77 Å²	77	90.2 Å²	90.2	47%	0.467	44%	0.436	S	S	.	.	H	α-helix	trans	-70.3	-42.5	-178.1	170	0	0	0	0	111.5	L830 L831 R837 K838	L830-V834 HydrophobicContact CD1-CG2 4.28Å; L830-V834 HydrophobicContact CG-CG2 4.38Å; L830-V834 WeakPolarHBondContact O-CB 3.43Å; L830-V834 VanDerWaalsContact O-CG2 3.24Å; L830-V834 WeakPolarHBondContact O-CG2 3.34Å; L830-V834 PolarHBondContact O-N 3.23Å; L831-V834 PolarHBondContact O-N 3.15Å; L831-V834 VanDerWaalsContact O-N 3.14Å; V834-R837 PolarHBondContact O-N 3.38Å; V834-K838 WeakPolarHBondContact O-CB 3.38Å; V834-K838 PolarHBondContact O-N 3.06Å
835	V	69.5	Low	72.5	Confident	66 Å²	66	92 Å²	92	40%	0.4	45%	0.449	S	S	.	.	H	α-helix	trans	-68.6	-45.5	177.8	169	0	0	0	0	110	L831 R837 K838 L839	L831-V835 HydrophobicContact CD1-CG2 4.11Å; L831-V835 HydrophobicContact CD2-CB 4.49Å; L831-V835 HydrophobicContact CD2-CG2 3.83Å; L831-V835 HydrophobicContact CG-CG2 3.69Å; L831-V835 VanDerWaalsContact O-CB 3.28Å; L831-V835 WeakPolarHBondContact O-CB 3.48Å; L831-V835 WeakPolarHBondContact O-CG2 3.34Å; L831-V835 PolarHBondContact O-N 3.45Å; V835-R837 VanDerWaalsContact C-N 3.35Å; V835-K838 PolarHBondContact O-N 3.45Å; V835-L839 HydrophobicContact CG1-CD1 3.81Å; V835-L839 VanDerWaalsContact O-CB 3.29Å; V835-L839 WeakPolarHBondContact O-CB 3.44Å; V835-L839 WeakPolarHBondContact O-CG 3.47Å; V835-L839 PolarHBondContact O-N 3.44Å
836	I	70	Confident	72.2	Confident	87 Å²	87	101 Å²	101	45%	0.446	48%	0.481	S	S	.	.	H	α-helix	trans	-58.8	-49.1	172.5	-71	171.4	0	0	0	109.4	V832 K838 L839 L840	V832-I836 HydrophobicContact CG1-CD1 3.46Å; V832-I836 VanDerWaalsContact CG1-CD1 3.46Å; V832-I836 HydrophobicContact CG1-CG1 4.3Å; V832-I836 WeakPolarHBondContact O-CB 3.36Å; V832-I836 WeakPolarHBondContact O-CD1 3.4Å; V832-I836 WeakPolarHBondContact O-CG1 3.24Å; V832-I836 PolarHBondContact O-N 2.73Å; I836-K838 VanDerWaalsContact C-N 3.33Å; I836-K838 PolarHBondContact O-N 3.18Å; I836-L839 CarbonylContact O-C 3.51Å; I836-L839 WeakPolarHBondContact O-CB 3.49Å; I836-L839 PolarHBondContact O-N 3.03Å; I836-L840 HydrophobicContact CG2-CD1 3.67Å; I836-L840 HydrophobicContact CG2-CG 4.06Å; I836-L840 WeakPolarHBondContact O-CB 3.47Å; I836-L840 WeakPolarHBondContact O-CG 3.18Å; I836-L840 PolarHBondContact O-N 2.76Å
837	R	70.8	Confident	72	Confident	131 Å²	131	100.4 Å²	100.4	49%	0.494	48%	0.483	S	S	.	.	H	α-helix	trans	-58.6	-44.1	178.3	-175.8	175.4	-170	148	17.8	112	M833 V834 V835 L840 D841 D853	M833-R837 WeakPolarHBondContact O-CB 3.39Å; M833-R837 PolarHBondContact O-N 3.41Å; V834-R837 PolarHBondContact O-N 3.38Å; V835-R837 VanDerWaalsContact C-N 3.35Å; R837-L840 CarbonylContact O-C 3.54Å; R837-L840 WeakPolarHBondContact O-CB 3.14Å; R837-L840 PolarHBondContact O-N 3.13Å; R837-D841 WeakPolarHBondContact O-CB 3.3Å; R837-D841 VanDerWaalsContact O-CG 3.29Å; R837-D841 PolarHBondContact O-N 3.16Å; R837-D853 IonicContact NH2-OD1 3.98Å; R837-D853 IonicContact NH2-OD2 3.79Å; R837-D853 PolarHBondContact NH2-OD2 3.45Å; R837-D853 VanDerWaalsContact NH2-OD2 3.15Å
838	K	76.9	Confident	72.3	Confident	144 Å²	144	99.8 Å²	99.8	63%	0.626	48%	0.483	S	S	*	.	H	α-helix	trans	-73.8	-28.1	-178.5	-160.2	156	-173	172.4	0	112.8	V834 V835 I836 R842	V834-K838 WeakPolarHBondContact O-CB 3.38Å; V834-K838 PolarHBondContact O-N 3.06Å; V835-K838 PolarHBondContact O-N 3.45Å; I836-K838 VanDerWaalsContact C-N 3.33Å; I836-K838 PolarHBondContact O-N 3.18Å; K838-R842 PolarHBondContact O-N 2.87Å
839	L	74	Confident	72.1	Confident	101 Å²	101	99.3 Å²	99.3	53%	0.529	48%	0.481	S	S	.	.	H	α-helix	trans	-68.9	-44.2	166.9	-83.2	162	0	0	0	110.6	V835 I836 R842 V843	V835-L839 HydrophobicContact CG1-CD1 3.81Å; V835-L839 VanDerWaalsContact O-CB 3.29Å; V835-L839 WeakPolarHBondContact O-CB 3.44Å; V835-L839 WeakPolarHBondContact O-CG 3.47Å; V835-L839 PolarHBondContact O-N 3.44Å; I836-L839 CarbonylContact O-C 3.51Å; I836-L839 WeakPolarHBondContact O-CB 3.49Å; I836-L839 PolarHBondContact O-N 3.03Å; L839-R842 WeakPolarHBondContact O-CA 3.38Å; L839-R842 VanDerWaalsContact O-CB 3.3Å; L839-R842 WeakPolarHBondContact O-CB 3.1Å; L839-R842 PolarHBondContact O-N 3.5Å; L839-V843 WeakPolarHBondContact O-CG2 3.15Å; L839-V843 PolarHBondContact O-N 3.37Å
840	L	75	Confident	72.2	Confident	43 Å²	43	98.1 Å²	98.1	23%	0.225	48%	0.476	C	S	.	.	H	α-helix	trans	-62.5	-43.5	175.8	-68.5	170.6	0	0	0	110.9	I836 R837 R842 V843 F844 L849 L852	I836-L840 HydrophobicContact CG2-CD1 3.67Å; I836-L840 HydrophobicContact CG2-CG 4.06Å; I836-L840 WeakPolarHBondContact O-CB 3.47Å; I836-L840 WeakPolarHBondContact O-CG 3.18Å; I836-L840 PolarHBondContact O-N 2.76Å; R837-L840 CarbonylContact O-C 3.54Å; R837-L840 WeakPolarHBondContact O-CB 3.14Å; R837-L840 PolarHBondContact O-N 3.13Å; L840-R842 PolarHBondContact O-N 3.34Å; L840-R842 VanDerWaalsContact O-N 3.11Å; L840-V843 PolarHBondContact O-N 3.2Å; L840-F844 HydrophobicContact CB-CD2 4.2Å; L840-F844 HydrophobicContact CD2-CD2 3.5Å; L840-F844 VanDerWaalsContact CD2-CD2 3.5Å; L840-F844 HydrophobicContact CD2-CE2 3.38Å; L840-F844 HydrophobicContact CG-CD2 4.47Å; L840-F844 WeakPolarHBondContact O-CA 3.44Å; L840-F844 WeakPolarHBondContact O-CB 3.1Å; L840-F844 PolarHBondContact O-N 3.28Å; L840-L849 HydrophobicContact CB-CD2 3.87Å; L840-L852 HydrophobicContact CD1-CD2 4.21Å
841	D	77.7	Confident	72.3	Confident	90 Å²	90	98.7 Å²	98.7	48%	0.481	49%	0.488	S	S	.	.	H	α-helix	trans	-57.3	-24.9	172.1	-74.6	-25.3	0	0	0	112.9	R837 L849	R837-D841 WeakPolarHBondContact O-CB 3.3Å; R837-D841 VanDerWaalsContact O-CG 3.29Å; R837-D841 PolarHBondContact O-N 3.16Å; D841-L849 WeakPolarHBondContact OD1-CD1 3.4Å
842	R	79.8	Confident	72.2	Confident	219 Å²	219	101.5 Å²	101.5	83%	0.826	50%	0.503	S	S	*	.	H	α-helix	trans	-87.6	-25.9	178.4	-131.1	-179	-175.7	125.1	-0.6	113	K838 L839 L840	K838-R842 PolarHBondContact O-N 2.87Å; L839-R842 WeakPolarHBondContact O-CA 3.38Å; L839-R842 VanDerWaalsContact O-CB 3.3Å; L839-R842 WeakPolarHBondContact O-CB 3.1Å; L839-R842 PolarHBondContact O-N 3.5Å; L840-R842 PolarHBondContact O-N 3.34Å; L840-R842 VanDerWaalsContact O-N 3.11Å
843	V	81.1	Confident	72	Confident	110 Å²	110	101.9 Å²	101.9	67%	0.667	50%	0.503	S	S	*	.	H	α-helix	trans	-100.9	-34.6	-174.8	175.6	0	0	0	0	111.7	L839 L840	L839-V843 WeakPolarHBondContact O-CG2 3.15Å; L839-V843 PolarHBondContact O-N 3.37Å; L840-V843 PolarHBondContact O-N 3.2Å
844	F	79.9	Confident	71.5	Confident	102 Å²	102	102.4 Å²	102.4	45%	0.447	51%	0.509	S	S	.	.	S	Bend	trans	-113.1	149.4	-172.6	-68.5	-80.3	0	0	0	111.7	L840 D848 L849	L840-F844 HydrophobicContact CB-CD2 4.2Å; L840-F844 HydrophobicContact CD2-CD2 3.5Å; L840-F844 VanDerWaalsContact CD2-CD2 3.5Å; L840-F844 HydrophobicContact CD2-CE2 3.38Å; L840-F844 HydrophobicContact CG-CD2 4.47Å; L840-F844 WeakPolarHBondContact O-CA 3.44Å; L840-F844 WeakPolarHBondContact O-CB 3.1Å; L840-F844 PolarHBondContact O-N 3.28Å; F844-D848 HydrophobicContact CB-CB 4.11Å; F844-D848 HydrophobicContact CD1-CB 4.06Å; F844-L849 HydrophobicContact CB-CD1 4.26Å; F844-L849 HydrophobicContact CB-CG 4.15Å
845	S	78.3	Confident	70.9	Confident	58 Å²	58	105.9 Å²	105.9	41%	0.406	52%	0.524	S	S	.	.			trans	-74.5	160	174.3	77.8	0	0	0	0	110.9	L847 D848 L849	S845-L847 PolarHBondContact O-N 3.02Å; S845-L847 VanDerWaalsContact O-N 3.11Å; S845-D848 WeakPolarHBondContact CB-OD2 2.92Å; S845-D848 PolarHBondContact N-OD2 3.27Å; S845-D848 VanDerWaalsContact N-OD2 3.15Å; S845-D848 PolarHBondContact O-N 3.11Å; S845-D848 VanDerWaalsContact O-N 3.1Å; S845-D848 VanDerWaalsContact OG-CG 3.23Å; S845-D848 PolarHBondContact OG-N 3.08Å; S845-D848 PolarHBondContact OG-OD2 3.21Å; S845-L849 PolarHBondContact O-N 3.14Å; S845-L849 VanDerWaalsContact O-N 3.12Å
846	R	72.6	Confident	70	Confident	222 Å²	222	107.5 Å²	107.5	84%	0.838	53%	0.53	S	S	*	.	H	α-helix	trans	-56.2	-28.4	177.5	-74.3	-171.6	177.4	-177.6	0.2	113.5	Q850	R846-Q850 WeakPolarHBondContact O-CG 3.13Å; R846-Q850 PolarHBondContact O-N 2.88Å
847	L	71.3	Confident	69.1	Low	131 Å²	131	106.9 Å²	106.9	69%	0.686	53%	0.531	S	S	*	.	H	α-helix	trans	-73.8	-42.2	177.8	-77	158.9	0	0	0	111.5	S845 L849 Q850 A851	S845-L847 PolarHBondContact O-N 3.02Å; S845-L847 VanDerWaalsContact O-N 3.11Å; L847-L849 VanDerWaalsContact C-N 3.28Å; L847-L849 PolarHBondContact O-N 2.99Å; L847-Q850 PolarHBondContact O-N 2.87Å; L847-A851 PolarHBondContact O-N 3.36Å
848	D	74.5	Confident	68	Low	86 Å²	86	105.6 Å²	105.6	46%	0.46	53%	0.534	S	S	.	.	H	α-helix	trans	-65.3	-36.1	177.9	-54.9	-44.9	0	0	0	111.3	F844 S845 A851 L852	F844-D848 HydrophobicContact CB-CB 4.11Å; F844-D848 HydrophobicContact CD1-CB 4.06Å; S845-D848 WeakPolarHBondContact CB-OD2 2.92Å; S845-D848 PolarHBondContact N-OD2 3.27Å; S845-D848 VanDerWaalsContact N-OD2 3.15Å; S845-D848 PolarHBondContact O-N 3.11Å; S845-D848 VanDerWaalsContact O-N 3.1Å; S845-D848 VanDerWaalsContact OG-CG 3.23Å; S845-D848 PolarHBondContact OG-N 3.08Å; S845-D848 PolarHBondContact OG-OD2 3.21Å; D848-A851 PolarHBondContact O-N 2.64Å; D848-L852 PolarHBondContact O-N 3.41Å
849	L	67	Low	66.7	Low	14 Å²	14	107.9 Å²	107.9	7%	0.073	54%	0.539	C	S	.	.	H	α-helix	trans	-68.9	-35.1	175	-83.3	152.6	0	0	0	113.1	L840 D841 F844 S845 L847 A851 L852 D853	L840-L849 HydrophobicContact CB-CD2 3.87Å; D841-L849 WeakPolarHBondContact OD1-CD1 3.4Å; F844-L849 HydrophobicContact CB-CD1 4.26Å; F844-L849 HydrophobicContact CB-CG 4.15Å; S845-L849 PolarHBondContact O-N 3.14Å; S845-L849 VanDerWaalsContact O-N 3.12Å; L847-L849 VanDerWaalsContact C-N 3.28Å; L847-L849 PolarHBondContact O-N 2.99Å; L849-A851 VanDerWaalsContact C-N 3.31Å; L849-A851 PolarHBondContact O-N 2.65Å; L849-L852 WeakPolarHBondContact O-CB 3.34Å; L849-L852 PolarHBondContact O-N 3.4Å; L849-L852 VanDerWaalsContact O-N 3.15Å; L849-D853 WeakPolarHBondContact O-CB 3.04Å; L849-D853 PolarHBondContact O-N 3.08Å
850	Q	68.6	Low	65.5	Low	119 Å²	119	108.7 Å²	108.7	56%	0.556	54%	0.543	S	S	*	.	H	α-helix	trans	-62	-39.9	174.2	-81.9	178.9	-18.8	0	0	111.8	R846 L847 L852 D853 D854	R846-Q850 WeakPolarHBondContact O-CG 3.13Å; R846-Q850 PolarHBondContact O-N 2.88Å; L847-Q850 PolarHBondContact O-N 2.87Å; Q850-L852 PolarHBondContact O-N 3.29Å; Q850-D853 PolarHBondContact O-N 3.5Å; Q850-D854 PolarHBondContact O-N 3.33Å
851	A	64.8	Low	64.4	Low	66 Å²	66	112.7 Å²	112.7	55%	0.545	56%	0.561	S	S	.	*	H	α-helix	trans	-64.2	-29.6	175.3	0	0	0	0	0	112.8	L847 D848 L849	L847-A851 PolarHBondContact O-N 3.36Å; D848-A851 PolarHBondContact O-N 2.64Å; L849-A851 VanDerWaalsContact C-N 3.31Å; L849-A851 PolarHBondContact O-N 2.65Å
852	L	63.2	Low	63.2	Low	95 Å²	95	113.2 Å²	113.2	50%	0.497	56%	0.563	S	S	.	*	H	α-helix	trans	-77.6	-40.5	173.2	-136.8	91.8	0	0	0	111.9	L840 D848 L849 Q850 D854 L855	L840-L852 HydrophobicContact CD1-CD2 4.21Å; D848-L852 PolarHBondContact O-N 3.41Å; L849-L852 WeakPolarHBondContact O-CB 3.34Å; L849-L852 PolarHBondContact O-N 3.4Å; L849-L852 VanDerWaalsContact O-N 3.15Å; Q850-L852 PolarHBondContact O-N 3.29Å; L852-D854 VanDerWaalsContact C-N 3.29Å; L852-D854 PolarHBondContact O-N 3.44Å; L852-L855 WeakPolarHBondContact O-CB 3.36Å; L852-L855 PolarHBondContact O-N 2.91Å
853	D	59.6	Low	61.4	Low	53 Å²	53	109 Å²	109	28%	0.283	55%	0.551	S	S	.	*	H	α-helix	trans	-66.9	-26.6	179	-87.6	-9.6	0	0	0	111.8	R837 L849 Q850 L855 L856	R837-D853 IonicContact NH2-OD1 3.98Å; R837-D853 IonicContact NH2-OD2 3.79Å; R837-D853 PolarHBondContact NH2-OD2 3.45Å; R837-D853 VanDerWaalsContact NH2-OD2 3.15Å; L849-D853 WeakPolarHBondContact O-CB 3.04Å; L849-D853 PolarHBondContact O-N 3.08Å; Q850-D853 PolarHBondContact O-N 3.5Å; D853-L855 PolarHBondContact O-N 3.4Å; D853-L855 VanDerWaalsContact O-N 3.16Å; D853-L856 CarbonylContact O-C 3.58Å; D853-L856 WeakPolarHBondContact O-CA 3.45Å; D853-L856 WeakPolarHBondContact O-CB 3.46Å; D853-L856 PolarHBondContact O-N 2.81Å
854	D	57.6	Low	59.4	Low	136 Å²	136	105.4 Å²	105.4	73%	0.727	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.9	173	-81.2	-17.8	0	0	0	113.2	Q850 L852	Q850-D854 PolarHBondContact O-N 3.33Å; L852-D854 VanDerWaalsContact C-N 3.29Å; L852-D854 PolarHBondContact O-N 3.44Å
855	L	56.8	Low	57.6	Low	151 Å²	151	105.2 Å²	105.2	79%	0.791	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-18.2	171.5	-66.2	167.8	0	0	0	112.8	L852 D853	L852-L855 WeakPolarHBondContact O-CB 3.36Å; L852-L855 PolarHBondContact O-N 2.91Å; D853-L855 PolarHBondContact O-N 3.4Å; D853-L855 VanDerWaalsContact O-N 3.16Å
856	L	51.6	Low	55.9	Low	100 Å²	100	109.9 Å²	109.9	52%	0.524	56%	0.559	S	S	.	*	S	Bend	trans	-95.2	128.9	175.7	-76.2	160.7	0	0	0	109.1	D853 L858	D853-L856 CarbonylContact O-C 3.58Å; D853-L856 WeakPolarHBondContact O-CA 3.45Å; D853-L856 WeakPolarHBondContact O-CB 3.46Å; D853-L856 PolarHBondContact O-N 2.81Å; L856-L858 PolarHBondContact O-N 3.37Å
857	P	50.1	Low	54.4	Low	73 Å²	73	103.3 Å²	103.3	47%	0.474	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-60.1	129.1	178	23.1	-31.2	0	0	0	110.3	L862	P857-L862 HydrophobicContact CG-CD2 4.48Å
858	L	47.7	Very low	52.7	Low	105 Å²	105	106.7 Å²	106.7	55%	0.55	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-55.9	145.3	178	-129.5	100	0	0	0	110.3	L856 N860 Q861 L862	L856-L858 PolarHBondContact O-N 3.37Å; L858-N860 HydrophobicContact CD2-CB 4.43Å; L858-N860 PolarHBondContact O-N 3.46Å; L858-Q861 HydrophobicContact CB-CG 4.37Å; L858-Q861 WeakPolarHBondContact O-CA 3.49Å; L858-Q861 WeakPolarHBondContact O-CB 3.4Å; L858-Q861 PolarHBondContact O-N 2.76Å; L858-L862 PolarHBondContact O-N 3.22Å
859	W	50.7	Low	50.8	Low	191 Å²	191	113.8 Å²	113.8	72%	0.723	58%	0.581	S	S	*	*	H	α-helix	trans	-51.6	-29.6	176.3	-104.3	81.8	0	0	0	113.8	L862 K863	W859-L862 PolarHBondContact O-N 3.27Å; W859-K863 PolarHBondContact O-N 2.9Å
860	N	47.9	Very low	50	Low	118 Å²	118	118.8 Å²	118.8	63%	0.631	61%	0.607	S	S	*	*	H	α-helix	trans	-73	-29.5	175.6	-68.3	-15.7	0	0	0	113.3	L858 G864	L858-N860 HydrophobicContact CD2-CB 4.43Å; L858-N860 PolarHBondContact O-N 3.46Å; N860-G864 WeakPolarHBondContact O-CA 3.46Å; N860-G864 PolarHBondContact O-N 3.29Å
861	Q	52.4	Low	49	Very low	127 Å²	127	118.7 Å²	118.7	59%	0.593	61%	0.61	S	S	*	*	H	α-helix	trans	-71.8	-38.3	171	-66.2	-177.6	-10.6	0	0	110.7	L858 G864 C865	L858-Q861 HydrophobicContact CB-CG 4.37Å; L858-Q861 WeakPolarHBondContact O-CA 3.49Å; L858-Q861 WeakPolarHBondContact O-CB 3.4Å; L858-Q861 PolarHBondContact O-N 2.76Å; Q861-G864 PolarHBondContact O-N 2.79Å; Q861-C865 PolarHBondContact O-N 2.83Å; Q861-C865 PolarHBondContact O-SG 2.85Å
862	L	50.9	Low	48.1	Very low	101 Å²	101	121.7 Å²	121.7	53%	0.529	61%	0.613	S	S	.	*	H	α-helix	trans	-64.5	-41.6	174	-69.6	167.6	0	0	0	112.3	P857 L858 W859	P857-L862 HydrophobicContact CG-CD2 4.48Å; L858-L862 PolarHBondContact O-N 3.22Å; W859-L862 PolarHBondContact O-N 3.27Å
863	K	43.6	Very low	47.3	Very low	132 Å²	132	123.2 Å²	123.2	57%	0.574	62%	0.62	S	S	*	*	H	α-helix	trans	-73.8	-37.2	174	-76.6	-174.7	175.9	-179.7	0	113	W859 C865 K866 A867	W859-K863 PolarHBondContact O-N 2.9Å; K863-C865 VanDerWaalsContact C-N 3.3Å; K863-C865 PolarHBondContact O-N 3.02Å; K863-K866 PolarHBondContact O-N 3.21Å; K863-A867 PolarHBondContact O-N 2.81Å
864	G	38.1	Very low	46.5	Very low	34 Å²	34	127.6 Å²	127.6	35%	0.351	64%	0.641	S	S	.	*	H	α-helix	trans	-65.3	-30.9	179.6	0	0	0	0	0	113.3	N860 Q861 K866 A867 K868	N860-G864 WeakPolarHBondContact O-CA 3.46Å; N860-G864 PolarHBondContact O-N 3.29Å; Q861-G864 PolarHBondContact O-N 2.79Å; G864-K866 PolarHBondContact O-N 2.79Å; G864-A867 PolarHBondContact O-N 3.26Å; G864-A867 VanDerWaalsContact O-N 3.16Å; G864-K868 PolarHBondContact O-N 3.44Å
865	C	43	Very low	45.7	Very low	97 Å²	97	127.1 Å²	127.1	66%	0.655	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-21.4	171.6	-78.9	0	0	0	0	113.6	Q861 K863	Q861-C865 PolarHBondContact O-N 2.83Å; Q861-C865 PolarHBondContact O-SG 2.85Å; K863-C865 VanDerWaalsContact C-N 3.3Å; K863-C865 PolarHBondContact O-N 3.02Å
866	K	42	Very low	45	Very low	157 Å²	157	125.4 Å²	125.4	68%	0.683	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-13.2	171.1	-79.2	-164.4	174.3	-164.8	0	114.2	K863 G864	K863-K866 PolarHBondContact O-N 3.21Å; G864-K866 PolarHBondContact O-N 2.79Å
867	A	40.7	Very low	44.5	Very low	83 Å²	83	127.3 Å²	127.3	69%	0.686	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-5.5	-178.2	0	0	0	0	0	113.8	K863 G864	K863-A867 PolarHBondContact O-N 2.81Å; G864-A867 PolarHBondContact O-N 3.26Å; G864-A867 VanDerWaalsContact O-N 3.16Å
868	K	36.4	Very low	44	Very low	202 Å²	202	131.8 Å²	131.8	88%	0.878	65%	0.645	S	S	*	*			trans	-113.8	3.3	176.5	-88.1	-169.2	175.6	-176.1	0	114.6	G864	G864-K868 PolarHBondContact O-N 3.44Å
869	R	34.4	Very low	43.6	Very low	235 Å²	235	134.3 Å²	134.3	89%	0.887	65%	0.654	S	S	*	*			trans	-105.4	0	155.8	-80.6	-175.7	176.5	-177.3	-1.8	106.9

Retrieved 869 of 869 residues in 1487.8 ms (Link to these results)

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