A0A087XFP7_POEFO Loading...

Serine/threonine-protein kinase receptor

AlphaFold DB , UniProt , Accession A0A087XFP7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 521 aa.

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(Predicted Aligned Error values between residue pairs)

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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	49.8	Very low	51.3	Low	179 Å²	179	94.4 Å²	94.4	88%	0.882	56%	0.564	S	S	*	*				0	112.1	0	-82.6	158.4	66.3	0	0	107.6	I9	M1-I9 HydrophobicContact CE-CD1 4.45Å
2	G	56.7	Low	50.7	Low	44 Å²	44	98.6 Å²	98.6	45%	0.454	57%	0.57	S	S	.	*			trans	-73.7	160.9	-175.5	0	0	0	0	0	112.1	A4 T5 K6	G2-A4 PolarHBondContact O-N 3.19Å; G2-A4 VanDerWaalsContact O-N 3.11Å; G2-T5 WeakPolarHBondContact O-CB 3.31Å; G2-T5 PolarHBondContact O-N 3.12Å; G2-T5 PolarHBondContact O-OG1 2.96Å; G2-K6 PolarHBondContact O-N 2.83Å
3	D	49.2	Very low	50.4	Low	132 Å²	132	99.5 Å²	99.5	71%	0.706	57%	0.571	S	S	*	*	H	α-helix	trans	-60.2	-25.2	-174.4	-63.7	-38	0	0	0	113.1	T5 K6 L7	D3-T5 VanDerWaalsContact C-N 3.35Å; D3-T5 PolarHBondContact O-N 3.07Å; D3-K6 PolarHBondContact O-N 3.02Å; D3-L7 PolarHBondContact O-N 3.12Å; D3-L7 VanDerWaalsContact O-N 3.09Å
4	A	48	Very low	49.9	Very low	82 Å²	82	100.5 Å²	100.5	68%	0.678	57%	0.572	S	S	*	*	H	α-helix	trans	-65.4	-33.8	171.5	0	0	0	0	0	113.4	G2 A8	G2-A4 PolarHBondContact O-N 3.19Å; G2-A4 VanDerWaalsContact O-N 3.11Å; A4-A8 WeakPolarHBondContact O-CB 3.33Å; A4-A8 PolarHBondContact O-N 3.43Å
5	T	52	Low	49.3	Very low	67 Å²	67	99.1 Å²	99.1	41%	0.411	57%	0.571	S	S	.	*	H	α-helix	trans	-76.7	-30.4	179	-35.9	0	0	0	0	111.4	G2 D3 I9	G2-T5 WeakPolarHBondContact O-CB 3.31Å; G2-T5 PolarHBondContact O-N 3.12Å; G2-T5 PolarHBondContact O-OG1 2.96Å; D3-T5 VanDerWaalsContact C-N 3.35Å; D3-T5 PolarHBondContact O-N 3.07Å; T5-I9 HydrophobicContact CG2-CD1 4.46Å; T5-I9 VanDerWaalsContact O-CG1 3.31Å; T5-I9 WeakPolarHBondContact O-CG1 3.15Å; T5-I9 PolarHBondContact O-N 3.44Å
6	K	50.8	Low	48.6	Very low	126 Å²	126	98.3 Å²	98.3	55%	0.548	57%	0.571	S	S	.	*	H	α-helix	trans	-71.6	-37.3	173.4	-69.2	-179	179.5	174	0	111.7	G2 D3 A10	G2-K6 PolarHBondContact O-N 2.83Å; D3-K6 PolarHBondContact O-N 3.02Å; K6-A10 WeakPolarHBondContact O-CB 3.35Å; K6-A10 PolarHBondContact O-N 3.43Å
7	L	52.3	Low	48	Very low	122 Å²	122	97.3 Å²	97.3	64%	0.639	57%	0.571	S	S	*	*	H	α-helix	trans	-68.3	-39.9	175.6	-157.9	75.4	0	0	0	111.6	D3 I9 A10 V11	D3-L7 PolarHBondContact O-N 3.12Å; D3-L7 VanDerWaalsContact O-N 3.09Å; L7-I9 PolarHBondContact O-N 2.88Å; L7-A10 PolarHBondContact O-N 3.28Å; L7-V11 WeakPolarHBondContact O-CB 3.24Å; L7-V11 VanDerWaalsContact O-CG2 3.25Å; L7-V11 WeakPolarHBondContact O-CG2 3.45Å; L7-V11 PolarHBondContact O-N 3.41Å
8	A	50.9	Low	47.6	Very low	60 Å²	60	96.9 Å²	96.9	50%	0.496	58%	0.575	S	S	.	*	H	α-helix	trans	-64.5	-39.7	177	0	0	0	0	0	112.7	A4 F12	A4-A8 WeakPolarHBondContact O-CB 3.33Å; A4-A8 PolarHBondContact O-N 3.43Å; A8-F12 VanDerWaalsContact O-CB 3.31Å; A8-F12 WeakPolarHBondContact O-CB 2.98Å; A8-F12 PolarHBondContact O-N 3.25Å
9	I	53.3	Low	47	Very low	87 Å²	87	96.1 Å²	96.1	45%	0.446	59%	0.588	S	S	.	*	H	α-helix	trans	-72.6	-36.2	177	-63.7	169	0	0	0	110.9	M1 T5 L7 F12 L13	M1-I9 HydrophobicContact CE-CD1 4.45Å; T5-I9 HydrophobicContact CG2-CD1 4.46Å; T5-I9 VanDerWaalsContact O-CG1 3.31Å; T5-I9 WeakPolarHBondContact O-CG1 3.15Å; T5-I9 PolarHBondContact O-N 3.44Å; L7-I9 PolarHBondContact O-N 2.88Å; I9-F12 PolarHBondContact O-N 3.1Å; I9-L13 HydrophobicContact CG2-CD1 4.08Å; I9-L13 WeakPolarHBondContact O-CB 3.46Å; I9-L13 WeakPolarHBondContact O-CG 3.16Å; I9-L13 PolarHBondContact O-N 3.32Å
10	A	49.9	Very low	46.6	Very low	48 Å²	48	94.6 Å²	94.6	40%	0.397	59%	0.586	S	S	.	*	H	α-helix	trans	-65.1	-41.7	174	0	0	0	0	0	112.2	K6 L7 L13 I14	K6-A10 WeakPolarHBondContact O-CB 3.35Å; K6-A10 PolarHBondContact O-N 3.43Å; L7-A10 PolarHBondContact O-N 3.28Å; A10-L13 PolarHBondContact O-N 3.03Å; A10-I14 WeakPolarHBondContact O-CD1 3.03Å; A10-I14 VanDerWaalsContact O-CG1 3.22Å; A10-I14 WeakPolarHBondContact O-CG1 3.41Å; A10-I14 PolarHBondContact O-N 2.68Å
11	V	51.5	Low	46.4	Very low	91 Å²	91	98 Å²	98	55%	0.552	60%	0.598	S	S	*	*	H	α-helix	trans	-68.6	-34.7	175.6	173.5	0	0	0	0	111.3	L7 S15	L7-V11 WeakPolarHBondContact O-CB 3.24Å; L7-V11 VanDerWaalsContact O-CG2 3.25Å; L7-V11 WeakPolarHBondContact O-CG2 3.45Å; L7-V11 PolarHBondContact O-N 3.41Å; V11-S15 WeakPolarHBondContact O-CB 3.47Å; V11-S15 PolarHBondContact O-N 3.25Å
12	F	44.5	Very low	45.7	Very low	145 Å²	145	97.8 Å²	97.8	64%	0.636	60%	0.6	S	S	*	*	H	α-helix	trans	-71.5	-37.4	176.5	-151.4	-95.8	0	0	0	112.6	A8 I9 S15 C16	A8-F12 VanDerWaalsContact O-CB 3.31Å; A8-F12 WeakPolarHBondContact O-CB 2.98Å; A8-F12 PolarHBondContact O-N 3.25Å; I9-F12 PolarHBondContact O-N 3.1Å; F12-S15 PolarHBondContact O-N 3.11Å; F12-C16 WeakPolarHBondContact O-CB 3.14Å; F12-C16 PolarHBondContact O-N 3.45Å; F12-C16 PolarHBondContact O-SG 2.99Å
13	L	45.7	Very low	44.7	Very low	110 Å²	110	98.5 Å²	98.5	58%	0.576	61%	0.608	S	S	*	*	H	α-helix	trans	-71.2	-32.8	174.3	-74.1	169.7	0	0	0	112.4	I9 A10 S17	I9-L13 HydrophobicContact CG2-CD1 4.08Å; I9-L13 WeakPolarHBondContact O-CB 3.46Å; I9-L13 WeakPolarHBondContact O-CG 3.16Å; I9-L13 PolarHBondContact O-N 3.32Å; A10-L13 PolarHBondContact O-N 3.03Å; L13-S17 WeakPolarHBondContact O-CB 3.22Å; L13-S17 PolarHBondContact O-N 3.21Å; L13-S17 PolarHBondContact O-OG 2.88Å
14	I	44.5	Very low	44.3	Very low	114 Å²	114	102 Å²	102	59%	0.585	61%	0.611	S	S	*	*	H	α-helix	trans	-70.8	-42.4	171.8	-65.3	165.7	0	0	0	110	A10 C16 S17 S18	A10-I14 WeakPolarHBondContact O-CD1 3.03Å; A10-I14 VanDerWaalsContact O-CG1 3.22Å; A10-I14 WeakPolarHBondContact O-CG1 3.41Å; A10-I14 PolarHBondContact O-N 2.68Å; I14-C16 PolarHBondContact O-N 3.39Å; I14-S17 PolarHBondContact O-N 3.48Å; I14-S18 PolarHBondContact O-N 2.91Å; I14-S18 VanDerWaalsContact O-N 3.15Å; I14-S18 PolarHBondContact O-OG 3.37Å
15	S	40.3	Very low	43.9	Very low	80 Å²	80	101.2 Å²	101.2	56%	0.559	60%	0.601	S	S	*	*	H	α-helix	trans	-67.7	-31.1	178.5	-177.1	0	0	0	0	113.9	V11 F12	V11-S15 WeakPolarHBondContact O-CB 3.47Å; V11-S15 PolarHBondContact O-N 3.25Å; F12-S15 PolarHBondContact O-N 3.11Å
16	C	38.3	Very low	44	Very low	85 Å²	85	106.3 Å²	106.3	57%	0.574	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-3	176.2	-68.8	0	0	0	0	113.5	F12 I14	F12-C16 WeakPolarHBondContact O-CB 3.14Å; F12-C16 PolarHBondContact O-N 3.45Å; F12-C16 PolarHBondContact O-SG 2.99Å; I14-C16 PolarHBondContact O-N 3.39Å
17	S	39	Very low	44.4	Very low	82 Å²	82	103.5 Å²	103.5	57%	0.573	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-13.1	170.6	-51.1	0	0	0	0	112.9	L13 I14	L13-S17 WeakPolarHBondContact O-CB 3.22Å; L13-S17 PolarHBondContact O-N 3.21Å; L13-S17 PolarHBondContact O-OG 2.88Å; I14-S17 PolarHBondContact O-N 3.48Å
18	S	39.3	Very low	45.5	Very low	91 Å²	91	99 Å²	99	64%	0.636	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	2	-179.6	-59.2	0	0	0	0	114.7	I14	I14-S18 PolarHBondContact O-N 2.91Å; I14-S18 VanDerWaalsContact O-N 3.15Å; I14-S18 PolarHBondContact O-OG 3.37Å
19	G	36.5	Very low	47.2	Very low	80 Å²	80	99.8 Å²	99.8	83%	0.825	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-4.1	171.2	0	0	0	0	0	114.2
20	A	40.2	Very low	48.9	Very low	66 Å²	66	95.6 Å²	95.6	55%	0.545	56%	0.561	S	S	.	*	S	Bend	trans	-129.5	126.6	172.2	0	0	0	0	0	107.6
21	I	42.6	Very low	50.6	Low	166 Å²	166	94.1 Å²	94.1	85%	0.851	55%	0.547	S	S	*	.			trans	80.4	65.2	178.3	-37.6	166.1	0	0	0	114.4
22	L	34.9	Very low	52.2	Low	175 Å²	175	92.4 Å²	92.4	92%	0.916	54%	0.535	S	S	*	.				-101.6	93.7	126.1	-105.1	148.3	0	0	0	104.6	R24	L22-R24 PolarHBondContact O-N 2.89Å
23	G	34.3	Very low	54	Low	60 Å²	60	86.7 Å²	86.7	62%	0.619	51%	0.51	S	S	*	.			trans	-52.6	113.8	174.3	0	0	0	0	0	107.9	S25	G23-S25 VanDerWaalsContact C-N 3.28Å; G23-S25 PolarHBondContact O-N 3.41Å
24	R	41.9	Very low	55.3	Low	205 Å²	205	83.7 Å²	83.7	77%	0.774	50%	0.498	S	S	*	.			trans	-53	108.7	151.4	-119.4	178.6	175.5	169.5	-2.2	103.4	L22 E26	L22-R24 PolarHBondContact O-N 2.89Å; R24-E26 PolarHBondContact O-N 3.39Å
25	S	40	Very low	56.2	Low	66 Å²	66	80.2 Å²	80.2	46%	0.462	48%	0.484	S	S	.	.			trans	-50.2	116.8	175	-173.5	0	0	0	0	106.2	G23 T27	G23-S25 VanDerWaalsContact C-N 3.28Å; G23-S25 PolarHBondContact O-N 3.41Å; S25-T27 VanDerWaalsContact CB-O 3.22Å; S25-T27 WeakPolarHBondContact CB-O 3.15Å; S25-T27 PolarHBondContact O-N 2.83Å; S25-T27 PolarHBondContact OG-O 3.27Å; S25-T27 PolarHBondContact OG-OG1 3.44Å
26	E	54.1	Low	57	Low	174 Å²	174	79.1 Å²	79.1	81%	0.813	48%	0.476	S	S	*	.	S	Bend	trans	-62.9	-11.1	178.6	-75.5	-175.4	146.4	0	0	111	R24 R58	R24-E26 PolarHBondContact O-N 3.39Å; E26-R58 VanDerWaalsContact O-CZ 3.25Å; E26-R58 PolarHBondContact O-NH1 2.77Å; E26-R58 PolarHBondContact O-NH2 2.94Å
27	T	57.7	Low	57.6	Low	67 Å²	67	85.5 Å²	85.5	41%	0.411	49%	0.488	S	S	.	.	S	Bend	trans	-116.1	130.5	173.5	56.5	0	0	0	0	110.7	S25	S25-T27 VanDerWaalsContact CB-O 3.22Å; S25-T27 WeakPolarHBondContact CB-O 3.15Å; S25-T27 PolarHBondContact O-N 2.83Å; S25-T27 PolarHBondContact OG-O 3.27Å; S25-T27 PolarHBondContact OG-OG1 3.44Å
28	Q	75.8	Confident	58.2	Low	26 Å²	26	89.9 Å²	89.9	12%	0.121	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	114.9	176.3	170.5	58.7	59.5	0	0	106.4	C50 R58 C60 G107 N108	Q28-C50 HydrophobicContact CB-CB 4.24Å; Q28-C50 HydrophobicContact CG-CB 4.34Å; Q28-C50 VanDerWaalsContact O-CB 3.27Å; Q28-C50 WeakPolarHBondContact O-CB 3.41Å; Q28-C50 PolarHBondContact O-N 3.26Å; Q28-C50 PolarHBondContact O-SG 2.86Å; Q28-C50 VanDerWaalsContact O-SG 3.35Å; Q28-R58 HydrophobicContact CB-CB 4.09Å; Q28-R58 HydrophobicContact CG-CB 3.97Å; Q28-C60 PolarHBondContact NE2-SG 2.88Å; Q28-G107 PolarHBondContact NE2-O 3.25Å; Q28-N108 VanDerWaalsContact CA-OD1 3.3Å; Q28-N108 WeakPolarHBondContact CA-OD1 3.07Å; Q28-N108 VanDerWaalsContact NE2-CA 3.32Å; Q28-N108 PolarHBondContact NE2-OD1 3.34Å
29	E	86.3	Confident	58.7	Low	77 Å²	77	94.7 Å²	94.7	36%	0.36	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	136.4	-176.6	-79.6	178.3	-162.6	0	0	110.5	T47 E48 D49 N108 M109	E29-T47 HydrophobicContact CB-CG2 4.03Å; E29-T47 HydrophobicContact CG-CG2 4.35Å; E29-E48 WeakPolarHBondContact CA-O 3.31Å; E29-D49 WeakPolarHBondContact CG-OD1 3.21Å; E29-N108 PolarHBondContact N-OD1 3.42Å; E29-N108 WeakPolarHBondContact O-CA 3.45Å; E29-M109 HydrophobicContact CB-SD 4.36Å; E29-M109 PolarHBondContact O-N 2.85Å
30	C	88.6	Confident	59.4	Low	0 Å²	0	96.7 Å²	96.7	0%	0	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	152.7	178.9	-62.1	0	0	0	0	111.8	L32 T47 E48 C50 C60 M109	C30-L32 PolarHBondContact O-N 3.42Å; C30-T47 WeakPolarHBondContact O-CA 3.2Å; C30-E48 PolarHBondContact N-O 3.44Å; C30-E48 PolarHBondContact O-N 3.09Å; C30-C50 PolarHBondContact SG-SG 2.88Å; C30-C60 VanDerWaalsContact CA-SG 3.57Å; C30-C60 HydrophobicContact CB-CB 3.7Å; C30-C60 WeakPolarHBondContact CB-SG 3.34Å; C30-C60 WeakPolarHBondContact SG-CA 3.44Å; C30-C60 WeakPolarHBondContact SG-CB 3.36Å; C30-C60 CovalentContact SG-SG 2.02Å; C30-C60 PolarHBondContact SG-SG 3.42Å; C30-M109 VanDerWaalsContact C-SD 3.6Å
31	V	86.9	Confident	59.9	Low	17 Å²	17	105.8 Å²	105.8	10%	0.103	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	126.1	170.9	178.3	0	0	0	0	108.5	Q76 G77 M109 N111 E112	V31-Q76 HydrophobicContact CG1-CB 4.5Å; V31-Q76 CarbonylContact O-C 3.52Å; V31-Q76 VanDerWaalsContact O-C 3.32Å; V31-Q76 VanDerWaalsContact O-CB 3.24Å; V31-Q76 WeakPolarHBondContact O-CB 3.49Å; V31-G77 WeakPolarHBondContact O-CA 3.49Å; V31-G77 PolarHBondContact O-N 2.85Å; V31-M109 HydrophobicContact CG2-CE 3.43Å; V31-M109 VanDerWaalsContact CG2-CE 3.43Å; V31-M109 HydrophobicContact CG2-SD 4.01Å; V31-N111 WeakPolarHBondContact CB-OD1 3.08Å; V31-N111 PolarHBondContact N-OD1 2.9Å; V31-N111 PolarHBondContact O-ND2 2.9Å; V31-E112 HydrophobicContact CG2-CB 3.89Å; V31-E112 HydrophobicContact CG2-CG 4.37Å
32	L	84.4	Confident	60.2	Low	55 Å²	55	100.5 Å²	100.5	29%	0.288	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.2	172.8	179.3	72.4	0	0	0	108.9	C30 G46 E48 Q76	C30-L32 PolarHBondContact O-N 3.42Å; L32-G46 PolarHBondContact N-O 3.2Å; L32-G46 PolarHBondContact O-N 3.43Å; L32-E48 HydrophobicContact CB-CB 4.17Å; L32-E48 HydrophobicContact CB-CG 4.02Å; L32-E48 HydrophobicContact CD1-CG 4.41Å; L32-E48 HydrophobicContact CD2-CB 4.46Å; L32-Q76 WeakPolarHBondContact CA-O 3.45Å; L32-Q76 WeakPolarHBondContact CD1-O 3.38Å
33	F	82.1	Confident	61.2	Low	25 Å²	25	98.1 Å²	98.1	11%	0.11	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	130.9	168.5	-178.4	-88.7	0	0	0	108.5	N43 T45 I73 K75 Q76	F33-N43 HydrophobicContact CE2-CB 4.49Å; F33-T45 HydrophobicContact CD2-CG2 3.89Å; F33-I73 HydrophobicContact CB-CG2 4.3Å; F33-I73 HydrophobicContact CD1-CB 3.95Å; F33-I73 HydrophobicContact CD1-CG2 3.42Å; F33-I73 VanDerWaalsContact CD1-CG2 3.42Å; F33-I73 HydrophobicContact CE1-CB 3.9Å; F33-I73 HydrophobicContact CE1-CG2 3.91Å; F33-I73 WeakPolarHBondContact CE1-O 3.21Å; F33-I73 HydrophobicContact CG-CG2 3.94Å; F33-I73 HydrophobicContact CZ-CB 4.46Å; F33-K75 CarbonylContact O-C 3.6Å; F33-K75 VanDerWaalsContact O-CA 3.28Å; F33-K75 WeakPolarHBondContact O-CA 3.32Å; F33-Q76 HydrophobicContact CB-CB 3.95Å; F33-Q76 HydrophobicContact CB-CG 4.13Å; F33-Q76 PolarHBondContact N-O 2.03Å; F33-Q76 VanDerWaalsContact N-O 3.1Å; F33-Q76 PolarHBondContact O-N 3.1Å
34	S	73.3	Confident	62.3	Low	47 Å²	47	100.5 Å²	100.5	33%	0.329	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	111.3	176.1	-174	0	0	0	0	110	S36 H44	S34-S36 PolarHBondContact O-N 2.86Å; S34-H44 PolarHBondContact N-O 2.92Å
35	S	63.7	Low	63.8	Low	41 Å²	41	95.7 Å²	95.7	29%	0.287	48%	0.475	S	S	.	.			trans	-83.2	85.2	166.8	65.3	0	0	0	0	109.1	W37 I74	S35-W37 PolarHBondContact O-N 3.46Å; S35-W37 VanDerWaalsContact O-N 3.14Å; S35-I74 PolarHBondContact N-O 3.43Å; S35-I74 PolarHBondContact OG-O 3Å; S35-I74 VanDerWaalsContact OG-O 3.12Å
36	S	56.6	Low	65.8	Low	56 Å²	56	94.1 Å²	94.1	39%	0.392	47%	0.469	S	S	.	.			trans	-72.6	104.2	174.6	60.4	0	0	0	0	110	S34 E38	S34-S36 PolarHBondContact O-N 2.86Å; S36-E38 PolarHBondContact O-N 3.4Å
37	W	51.8	Low	67.2	Low	220 Å²	220	89.6 Å²	89.6	83%	0.833	45%	0.454	S	S	*	.	S	Bend	trans	-74.1	-6.8	176.5	-148.6	-77.4	0	0	0	113.6	S35	S35-W37 PolarHBondContact O-N 3.46Å; S35-W37 VanDerWaalsContact O-N 3.14Å
38	E	51.5	Low	68.4	Low	174 Å²	174	89.1 Å²	89.1	81%	0.813	45%	0.447	S	S	*	.	S	Bend	trans	-140.1	84.2	177.8	-69	-178.5	157.2	0	0	110.9	S36	S36-E38 PolarHBondContact O-N 3.4Å
39	K	49.7	Very low	68.8	Low	192 Å²	192	92.1 Å²	92.1	84%	0.835	46%	0.463	S	S	*	.	S	Bend		164.9	-23	129	-90.2	169.1	177.2	173.6	0	116.4
40	D	52.1	Low	68.5	Low	121 Å²	121	88.6 Å²	88.6	65%	0.647	45%	0.447	S	S	*	.			trans	-125	9.2	-166.6	-74.1	-32.1	0	0	0	118.3	S42	D40-S42 PolarHBondContact O-N 3.31Å; D40-S42 PolarHBondContact O-OG 2.8Å; D40-S42 VanDerWaalsContact O-OG 3.05Å
41	R	49.1	Very low	67.7	Low	257 Å²	257	95.8 Å²	95.8	97%	0.97	48%	0.484	S	S	*	.			trans	37.9	44.2	173.2	-79.9	-168	176.8	-167.9	-0	115.1
42	S	49.8	Very low	66.6	Low	56 Å²	56	96.3 Å²	96.3	39%	0.392	49%	0.493	S	S	.	.			trans	-150.4	132.8	172.2	44.5	0	0	0	0	111	D40 H44	D40-S42 PolarHBondContact O-N 3.31Å; D40-S42 PolarHBondContact O-OG 2.8Å; D40-S42 VanDerWaalsContact O-OG 3.05Å; S42-H44 PolarHBondContact O-N 3.38Å; S42-H44 PolarHBondContact O-ND1 3.1Å; S42-H44 VanDerWaalsContact O-ND1 3.08Å; S42-H44 PolarHBondContact OG-CE1 3.02Å
43	N	55.5	Low	65.8	Low	125 Å²	125	99.7 Å²	99.7	67%	0.668	51%	0.507	S	S	*	.			trans	-74.6	112.5	174.3	-68.2	-8.6	0	0	0	108	F33	F33-N43 HydrophobicContact CE2-CB 4.49Å
44	H	58.6	Low	64.7	Low	110 Å²	110	108.7 Å²	108.7	51%	0.509	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	108.6	174.4	-69.6	79.6	0	0	0	108.2	S34 S42	S34-H44 PolarHBondContact N-O 2.92Å; S42-H44 PolarHBondContact O-N 3.38Å; S42-H44 PolarHBondContact O-ND1 3.1Å; S42-H44 VanDerWaalsContact O-ND1 3.08Å; S42-H44 PolarHBondContact OG-CE1 3.02Å
45	T	73.4	Confident	64.3	Low	104 Å²	104	114.1 Å²	114.1	64%	0.638	57%	0.572	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115	125.6	176	-22.5	0	0	0	0	106.3	F33	F33-T45 HydrophobicContact CD2-CG2 3.89Å
46	G	80.1	Confident	64.8	Low	33 Å²	33	116.1 Å²	116.1	34%	0.34	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-164	-166.7	-174.3	0	0	0	0	0	112.5	L32	L32-G46 PolarHBondContact N-O 3.2Å; L32-G46 PolarHBondContact O-N 3.43Å
47	T	83.4	Confident	65.8	Low	78 Å²	78	117.1 Å²	117.1	48%	0.479	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.8	137.3	174.8	-54	0	0	0	0	107.3	E29 C30 M109	E29-T47 HydrophobicContact CB-CG2 4.03Å; E29-T47 HydrophobicContact CG-CG2 4.35Å; C30-T47 WeakPolarHBondContact O-CA 3.2Å; T47-M109 HydrophobicContact CG2-CE 3.94Å; T47-M109 HydrophobicContact CG2-SD 3.52Å; T47-M109 VanDerWaalsContact CG2-SD 3.52Å; T47-M109 WeakPolarHBondContact OG1-CE 2.97Å
48	E	84.4	Confident	67.4	Low	58 Å²	58	110.1 Å²	110.1	27%	0.271	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	144.2	175.5	68.7	174.6	166.5	0	0	111.2	E29 C30 L32 G77 C78	E29-E48 WeakPolarHBondContact CA-O 3.31Å; C30-E48 PolarHBondContact N-O 3.44Å; C30-E48 PolarHBondContact O-N 3.09Å; L32-E48 HydrophobicContact CB-CB 4.17Å; L32-E48 HydrophobicContact CB-CG 4.02Å; L32-E48 HydrophobicContact CD1-CG 4.41Å; L32-E48 HydrophobicContact CD2-CB 4.46Å; E48-G77 VanDerWaalsContact OE1-C 3.25Å; E48-G77 WeakPolarHBondContact OE1-CA 3.01Å; E48-C78 PolarHBondContact OE1-N 2.96Å
49	D	83.9	Confident	69.2	Low	88 Å²	88	101.8 Å²	101.8	47%	0.471	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	120.9	173.6	-65	-13.7	0	0	0	109.2	E29 I51	E29-D49 WeakPolarHBondContact CG-OD1 3.21Å; D49-I51 PolarHBondContact O-N 2.81Å
50	C	78.9	Confident	71.1	Confident	3 Å²	3	92.7 Å²	92.7	2%	0.02	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	102.3	176.2	-54.9	0	0	0	0	111	Q28 C30 R58 C78	Q28-C50 HydrophobicContact CB-CB 4.24Å; Q28-C50 HydrophobicContact CG-CB 4.34Å; Q28-C50 VanDerWaalsContact O-CB 3.27Å; Q28-C50 WeakPolarHBondContact O-CB 3.41Å; Q28-C50 PolarHBondContact O-N 3.26Å; Q28-C50 PolarHBondContact O-SG 2.86Å; Q28-C50 VanDerWaalsContact O-SG 3.35Å; C30-C50 PolarHBondContact SG-SG 2.88Å; C50-R58 HydrophobicContact CB-CB 4.34Å; C50-R58 HydrophobicContact CB-CG 4.48Å; C50-R58 WeakPolarHBondContact O-CD 3.38Å; C50-R58 PolarHBondContact O-NH1 3.3Å; C50-C78 WeakPolarHBondContact CA-SG 3.1Å; C50-C78 HydrophobicContact CB-CB 3.8Å; C50-C78 WeakPolarHBondContact CB-SG 3.23Å; C50-C78 WeakPolarHBondContact SG-CB 3.3Å; C50-C78 CovalentContact SG-SG 2.03Å; C50-C78 PolarHBondContact SG-SG 3.05Å
51	I	73.2	Confident	73	Confident	152 Å²	152	87.5 Å²	87.5	78%	0.779	44%	0.437	S	S	*	.			trans	-92.7	123.1	174.4	-56.7	169	0	0	0	108.5	D49	D49-I51 PolarHBondContact O-N 2.81Å
52	G	64.3	Low	75	Confident	28 Å²	28	75.2 Å²	75.2	29%	0.289	39%	0.391	S	S	.	.			trans	-150.6	166.9	-179.3	0	0	0	0	0	112.5
53	E	65.8	Low	76.9	Confident	125 Å²	125	73.6 Å²	73.6	58%	0.584	38%	0.378	S	S	*	.			trans	-61.7	147.4	177.1	-68.1	171.8	165.5	0	0	111.4	D55 K56	E53-D55 PolarHBondContact O-N 3.48Å; E53-K56 HydrophobicContact CB-CD 4.44Å; E53-K56 HydrophobicContact CB-CG 4.47Å; E53-K56 PolarHBondContact O-N 3.21Å; E53-K56 VanDerWaalsContact O-N 3.13Å; E53-K56 WeakPolarHBondContact OE2-CE 3.37Å; E53-K56 IonicContact OE2-NZ 2.7Å; E53-K56 PolarHBondContact OE2-NZ 2.93Å
54	K	60.1	Low	78.5	Confident	214 Å²	214	68 Å²	68	93%	0.93	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.3	-173	-75.4	-175.8	176.1	-176.9	0	114.7
55	D	65.4	Low	79.7	Confident	161 Å²	161	66.9 Å²	66.9	86%	0.861	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-0.8	-174.9	-58.7	-33.6	0	0	0	113.9	E53	E53-D55 PolarHBondContact O-N 3.48Å
56	K	73.2	Confident	80	Confident	83 Å²	83	66.3 Å²	66.3	36%	0.361	34%	0.335	S	S	.	.	S	Bend	trans	-105.9	139.1	-177.3	-73	-174	173	149.3	0	112.2	E53 D81	E53-K56 HydrophobicContact CB-CD 4.44Å; E53-K56 HydrophobicContact CB-CG 4.47Å; E53-K56 PolarHBondContact O-N 3.21Å; E53-K56 VanDerWaalsContact O-N 3.13Å; E53-K56 WeakPolarHBondContact OE2-CE 3.37Å; E53-K56 IonicContact OE2-NZ 2.7Å; E53-K56 PolarHBondContact OE2-NZ 2.93Å; K56-D81 HydrophobicContact CB-CB 3.92Å; K56-D81 HydrophobicContact CD-CB 4.05Å; K56-D81 HydrophobicContact CG-CB 3.95Å
57	R	78.5	Confident	79.8	Confident	78 Å²	78	68.2 Å²	68.2	29%	0.294	34%	0.339	S	S	.	.			trans	-73.8	145.9	174.8	-66.4	-158.5	-173.7	-168.8	9.1	110.8	H59 D81 Y86 D87 E106	R57-H59 VanDerWaalsContact CB-NE2 3.32Å; R57-H59 WeakPolarHBondContact CB-NE2 3.38Å; R57-D81 PolarHBondContact N-OD1 2.83Å; R57-D81 VanDerWaalsContact N-OD1 3.17Å; R57-D81 PolarHBondContact O-N 2.81Å; R57-Y86 HydrophobicContact CB-CD1 4.42Å; R57-Y86 HydrophobicContact CB-CE1 3.78Å; R57-Y86 HydrophobicContact CG-CE1 3.97Å; R57-Y86 HydrophobicContact CG-CE2 4.47Å; R57-D87 IonicContact CZ-OD1 3.56Å; R57-D87 IonicContact NH1-OD1 3.99Å; R57-D87 PolarHBondContact NH1-OD1 2.8Å; R57-E106 IonicContact NH1-OE1 2.68Å; R57-E106 IonicContact NH1-OE2 3.07Å; R57-E106 PolarHBondContact NH1-OE2 3.21Å
58	R	84.9	Confident	79.2	Confident	72 Å²	72	70.4 Å²	70.4	27%	0.272	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	127.4	-176.4	-69.7	-180	-94.4	179.2	-0.6	109.4	E26 Q28 C50 L80	E26-R58 VanDerWaalsContact O-CZ 3.25Å; E26-R58 PolarHBondContact O-NH1 2.77Å; E26-R58 PolarHBondContact O-NH2 2.94Å; Q28-R58 HydrophobicContact CB-CB 4.09Å; Q28-R58 HydrophobicContact CG-CB 3.97Å; C50-R58 HydrophobicContact CB-CB 4.34Å; C50-R58 HydrophobicContact CB-CG 4.48Å; C50-R58 WeakPolarHBondContact O-CD 3.38Å; C50-R58 PolarHBondContact O-NH1 3.3Å; R58-L80 HydrophobicContact CG-CD2 3.74Å
59	H	88.8	Confident	78.4	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.1	-175.6	-57.1	-73.6	0	0	0	110.6	R57 W79 C85 Y86 C105 E106	R57-H59 VanDerWaalsContact CB-NE2 3.32Å; R57-H59 WeakPolarHBondContact CB-NE2 3.38Å; H59-W79 PolarHBondContact N-O 2.75Å; H59-W79 PolarHBondContact O-N 3.35Å; H59-W79 VanDerWaalsContact O-O 3.13Å; H59-C85 HydrophobicContact CB-CB 4.02Å; H59-C85 PolarHBondContact CE1-O 2.75Å; H59-C85 PolarHBondContact ND1-O 2.75Å; H59-Y86 AromaticContact CE1-CD1 3.71Å; H59-Y86 AromaticContact NE2-CD1 3.42Å; H59-Y86 WeakPolarHBondContact NE2-CD1 3.46Å; H59-Y86 AromaticContact NE2-CE1 3.5Å; H59-Y86 WeakPolarHBondContact NE2-CE1 3.39Å; H59-C105 CarbonylContact C-O 3.58Å; H59-C105 VanDerWaalsContact CA-O 3.25Å; H59-C105 WeakPolarHBondContact CA-O 2.92Å; H59-C105 WeakPolarHBondContact CB-O 3.46Å; H59-E106 IonicContact CE1-OE2 3.57Å
60	C	90.5	Very high	77.7	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	152.3	164.7	-52	0	0	0	0	109.7	Q28 C30 G77 C104 C105 N111	Q28-C60 PolarHBondContact NE2-SG 2.88Å; C30-C60 VanDerWaalsContact CA-SG 3.57Å; C30-C60 HydrophobicContact CB-CB 3.7Å; C30-C60 WeakPolarHBondContact CB-SG 3.34Å; C30-C60 WeakPolarHBondContact SG-CA 3.44Å; C30-C60 WeakPolarHBondContact SG-CB 3.36Å; C30-C60 CovalentContact SG-SG 2.02Å; C30-C60 PolarHBondContact SG-SG 3.42Å; C60-G77 CarbonylContact C-O 3.36Å; C60-G77 WeakPolarHBondContact CA-O 3.27Å; C60-C104 CarbonylContact O-C 3.49Å; C60-C104 WeakPolarHBondContact O-CA 3Å; C60-C104 WeakPolarHBondContact O-CB 3.5Å; C60-C105 PolarHBondContact N-O 3.16Å; C60-C105 PolarHBondContact O-N 2.94Å; C60-N111 HydrophobicContact CB-CB 3.61Å; C60-N111 VanDerWaalsContact CB-CG 3.48Å
61	F	92.4	Very high	77.9	Confident	12 Å²	12	75.2 Å²	75.2	5%	0.053	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	160	173.2	79.4	-87	0	0	0	112.7	K75 Q76 G77 C78 W79 F102 C103 C104 N111	F61-K75 HydrophobicContact CE2-CB 4.32Å; F61-K75 HydrophobicContact CE2-CD 4.44Å; F61-K75 HydrophobicContact CE2-CG 4.23Å; F61-K75 HydrophobicContact CZ-CD 4.12Å; F61-K75 HydrophobicContact CZ-CG 4.11Å; F61-Q76 WeakPolarHBondContact O-CA 3.46Å; F61-G77 VanDerWaalsContact CD1-C 3.43Å; F61-G77 WeakPolarHBondContact CD1-O 3.06Å; F61-G77 VanDerWaalsContact CE1-C 3.41Å; F61-G77 PolarHBondContact N-O 3.3Å; F61-G77 PolarHBondContact O-N 2.78Å; F61-C78 WeakPolarHBondContact CE1-O 3.26Å; F61-W79 HydrophobicContact CB-CB 4.5Å; F61-W79 HydrophobicContact CD1-CB 3.92Å; F61-W79 AromaticContact CD1-CE3 3.91Å; F61-W79 HydrophobicContact CD1-CE3 3.91Å; F61-W79 AromaticContact CE1-CE3 4Å; F61-W79 HydrophobicContact CE1-CE3 4Å; F61-W79 HydrophobicContact CG-CE3 4.3Å; F61-W79 HydrophobicContact CZ-CE3 4.47Å; F61-F102 HydrophobicContact CB-CE2 3.94Å; F61-F102 HydrophobicContact CB-CZ 4.1Å; F61-F102 HydrophobicContact CD2-CD2 4.4Å; F61-F102 AromaticContact CD2-CE2 3.79Å; F61-F102 HydrophobicContact CD2-CE2 3.79Å; F61-F102 HydrophobicContact CG-CE2 4.1Å; F61-C103 CarbonylContact C-O 3.5Å; F61-C103 WeakPolarHBondContact CA-O 3.3Å; F61-C103 WeakPolarHBondContact CB-O 3.31Å; F61-C104 HydrophobicContact CB-CB 4.22Å; F61-N111 PolarHBondContact O-ND2 2.89Å
62	A	90.7	Very high	78.3	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	145	170	0	0	0	0	0	111.2	W64 Q76 F102 C103 N111 F114	A62-W64 HydrophobicContact CB-CE3 4.36Å; A62-W64 HydrophobicContact CB-CZ3 4.34Å; A62-Q76 HydrophobicContact CB-CG 3.92Å; A62-F102 WeakPolarHBondContact O-CA 3.4Å; A62-C103 PolarHBondContact N-O 3.39Å; A62-C103 PolarHBondContact O-N 3.47Å; A62-N111 HydrophobicContact CB-CB 4.45Å; A62-F114 HydrophobicContact CB-CB 4.11Å; A62-F114 HydrophobicContact CB-CD1 3.9Å; A62-F114 HydrophobicContact CB-CG 4.13Å
63	T	89.5	Confident	79.1	Confident	21 Å²	21	73 Å²	73	13%	0.129	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	126.8	178.6	-51.7	0	0	0	0	110.2	I74 K75 V100 F101	T63-I74 HydrophobicContact CG2-CB 4.29Å; T63-I74 HydrophobicContact CG2-CD1 3.98Å; T63-I74 HydrophobicContact CG2-CG1 4.49Å; T63-I74 PolarHBondContact O-N 3.47Å; T63-K75 PolarHBondContact N-O 2.87Å; T63-K75 PolarHBondContact O-N 2.81Å; T63-V100 HydrophobicContact CG2-CG1 3.16Å; T63-F101 VanDerWaalsContact CA-O 3.26Å; T63-F101 WeakPolarHBondContact CA-O 3.32Å; T63-F101 WeakPolarHBondContact CG2-O 3Å
64	W	87.7	Confident	80	Confident	9 Å²	9	69.4 Å²	69.4	3%	0.034	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	159.9	-176.8	69.8	97.9	0	0	0	113	A62 I71 E72 E93 F101 C103 F114	A62-W64 HydrophobicContact CB-CE3 4.36Å; A62-W64 HydrophobicContact CB-CZ3 4.34Å; W64-I71 HydrophobicContact CB-CG2 4.1Å; W64-I71 HydrophobicContact CG-CG2 4.15Å; W64-E72 CarbonylContact C-O 3.57Å; W64-E72 VanDerWaalsContact CA-O 3.25Å; W64-E72 WeakPolarHBondContact CA-O 3.39Å; W64-E72 WeakPolarHBondContact CB-O 3.25Å; W64-E93 HydrophobicContact CH2-CB 4.01Å; W64-E93 HydrophobicContact CZ2-CB 4.36Å; W64-F101 HydrophobicContact CD2-CB 3.56Å; W64-F101 HydrophobicContact CD2-CG 4.4Å; W64-F101 AromaticContact CE2-CG 3.74Å; W64-F101 HydrophobicContact CE3-CB 3.97Å; W64-F101 HydrophobicContact CG-CB 4.08Å; W64-F101 HydrophobicContact CH2-CB 3.88Å; W64-F101 HydrophobicContact CZ2-CB 3.46Å; W64-F101 VanDerWaalsContact CZ2-CB 3.46Å; W64-F101 HydrophobicContact CZ2-CD1 4.14Å; W64-F101 AromaticContact CZ2-CG 3.97Å; W64-F101 HydrophobicContact CZ2-CG 3.97Å; W64-F101 HydrophobicContact CZ3-CB 4.1Å; W64-F101 PolarHBondContact N-O 2.73Å; W64-F101 VanDerWaalsContact N-O 3.09Å; W64-F101 AromaticContact NE1-CD2 3.77Å; W64-F101 AromaticContact NE1-CG 3.59Å; W64-F101 PolarHBondContact O-N 2.95Å; W64-C103 HydrophobicContact CH2-CB 4.4Å; W64-C103 HydrophobicContact CZ3-CB 4.35Å; W64-C103 VanDerWaalsContact CZ3-SG 3.51Å; W64-F114 HydrophobicContact CB-CE2 4.06Å; W64-F114 HydrophobicContact CB-CZ 4.39Å; W64-F114 AromaticContact CD1-CE2 3.96Å; W64-F114 AromaticContact CD2-CD2 3.35Å; W64-F114 HydrophobicContact CD2-CD2 3.35Å; W64-F114 AromaticContact CD2-CE2 3.42Å; W64-F114 HydrophobicContact CD2-CE2 3.42Å; W64-F114 VanDerWaalsContact CD2-CE2 3.42Å; W64-F114 HydrophobicContact CD2-CG 4.29Å; W64-F114 HydrophobicContact CD2-CZ 4.41Å; W64-F114 AromaticContact CE2-CD2 3.52Å; W64-F114 AromaticContact CE2-CE2 3.79Å; W64-F114 HydrophobicContact CE3-CB 4.3Å; W64-F114 AromaticContact CE3-CD2 3.39Å; W64-F114 HydrophobicContact CE3-CD2 3.39Å; W64-F114 AromaticContact CE3-CE2 3.82Å; W64-F114 HydrophobicContact CE3-CE2 3.82Å; W64-F114 AromaticContact CE3-CG 3.88Å; W64-F114 HydrophobicContact CE3-CG 3.88Å; W64-F114 HydrophobicContact CG-CD2 4.02Å; W64-F114 AromaticContact CG-CE2 3.55Å; W64-F114 HydrophobicContact CG-CE2 3.55Å; W64-F114 HydrophobicContact CG-CZ 4.34Å; W64-F114 HydrophobicContact CH2-CB 3.98Å; W64-F114 AromaticContact CH2-CD2 3.8Å; W64-F114 HydrophobicContact CH2-CD2 3.8Å; W64-F114 HydrophobicContact CH2-CG 4.27Å; W64-F114 AromaticContact CZ2-CD2 3.74Å; W64-F114 HydrophobicContact CZ2-CD2 3.74Å; W64-F114 HydrophobicContact CZ2-CE2 4.46Å; W64-F114 HydrophobicContact CZ3-CB 3.8Å; W64-F114 AromaticContact CZ3-CD2 3.64Å; W64-F114 HydrophobicContact CZ3-CD2 3.64Å; W64-F114 HydrophobicContact CZ3-CE2 4.49Å; W64-F114 AromaticContact CZ3-CG 3.9Å; W64-F114 HydrophobicContact CZ3-CG 3.9Å
65	K	85.3	Confident	81.3	Confident	86 Å²	86	64.3 Å²	64.3	37%	0.374	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	152.4	169.2	-62.6	-173.5	173.5	172.1	0	110.1	V67 I71 E72 I74 V100	K65-V67 HydrophobicContact CB-CG2 4.15Å; K65-I71 WeakPolarHBondContact O-CA 3.17Å; K65-E72 PolarHBondContact N-O 3.46Å; K65-E72 PolarHBondContact O-N 2.85Å; K65-I74 HydrophobicContact CD-CD1 4.11Å; K65-I74 HydrophobicContact CG-CD1 3.67Å; K65-I74 HydrophobicContact CG-CG1 4.08Å; K65-V100 HydrophobicContact CD-CG2 4.48Å; K65-V100 VanDerWaalsContact CE-CG2 3.47Å; K65-V100 HydrophobicContact CG-CG2 4.27Å
66	N	78.6	Confident	82.5	Confident	92 Å²	92	57.1 Å²	57.1	49%	0.492	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	101.6	166.4	-173.8	-14.4	0	0	0	108.4	G69 T70 F101	N66-G69 WeakPolarHBondContact OD1-CA 3.27Å; N66-G69 PolarHBondContact OD1-N 2.67Å; N66-T70 WeakPolarHBondContact CA-O 3.16Å; N66-F101 HydrophobicContact CB-CE2 4.11Å
67	V	76.6	Confident	83.2	Confident	72 Å²	72	53.2 Å²	53.2	44%	0.436	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	106	178.9	-175.3	0	0	0	0	107.7	K65 G69 T70	K65-V67 HydrophobicContact CB-CG2 4.15Å; V67-G69 VanDerWaalsContact C-N 3.28Å; V67-G69 PolarHBondContact O-N 3.22Å; V67-T70 PolarHBondContact N-O 3.26Å; V67-T70 PolarHBondContact O-N 2.86Å
68	S	71.6	Confident	83.7	Confident	125 Å²	125	51 Å²	51	87%	0.874	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	37.6	176.8	-53	0	0	0	0	114.7
69	G	66.8	Low	83.6	Confident	61 Å²	61	52.9 Å²	52.9	63%	0.629	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	0.1	179.9	0	0	0	0	0	114.6	N66 V67	N66-G69 WeakPolarHBondContact OD1-CA 3.27Å; N66-G69 PolarHBondContact OD1-N 2.67Å; V67-G69 VanDerWaalsContact C-N 3.28Å; V67-G69 PolarHBondContact O-N 3.22Å
70	T	70	Confident	83.1	Confident	100 Å²	100	56.5 Å²	56.5	61%	0.613	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.8	174.2	-51.2	0	0	0	0	110	N66 V67	N66-T70 WeakPolarHBondContact CA-O 3.16Å; V67-T70 PolarHBondContact N-O 3.26Å; V67-T70 PolarHBondContact O-N 2.86Å
71	I	81.4	Confident	82.3	Confident	88 Å²	88	59.4 Å²	59.4	45%	0.451	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	122.9	176.7	-63.5	175.2	0	0	0	108.9	W64 K65 F114	W64-I71 HydrophobicContact CB-CG2 4.1Å; W64-I71 HydrophobicContact CG-CG2 4.15Å; K65-I71 WeakPolarHBondContact O-CA 3.17Å; I71-F114 HydrophobicContact CG2-CE2 3.92Å; I71-F114 HydrophobicContact CG2-CZ 4.04Å
72	E	81.5	Confident	81.6	Confident	84 Å²	84	60.5 Å²	60.5	39%	0.393	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	111.8	171.7	-173	179.4	-171.3	0	0	108.7	W64 K65 I74	W64-E72 CarbonylContact C-O 3.57Å; W64-E72 VanDerWaalsContact CA-O 3.25Å; W64-E72 WeakPolarHBondContact CA-O 3.39Å; W64-E72 WeakPolarHBondContact CB-O 3.25Å; K65-E72 PolarHBondContact N-O 3.46Å; K65-E72 PolarHBondContact O-N 2.85Å; E72-I74 PolarHBondContact O-N 3.47Å
73	I	82.4	Confident	81	Confident	49 Å²	49	67.4 Å²	67.4	25%	0.251	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	127.8	175.5	-55.5	175.8	0	0	0	107.7	F33 Q76 F114	F33-I73 HydrophobicContact CB-CG2 4.3Å; F33-I73 HydrophobicContact CD1-CB 3.95Å; F33-I73 HydrophobicContact CD1-CG2 3.42Å; F33-I73 VanDerWaalsContact CD1-CG2 3.42Å; F33-I73 HydrophobicContact CE1-CB 3.9Å; F33-I73 HydrophobicContact CE1-CG2 3.91Å; F33-I73 WeakPolarHBondContact CE1-O 3.21Å; F33-I73 HydrophobicContact CG-CG2 3.94Å; F33-I73 HydrophobicContact CZ-CB 4.46Å; I73-Q76 HydrophobicContact CG2-CG 3.92Å; I73-F114 HydrophobicContact CD1-CE1 3.98Å; I73-F114 HydrophobicContact CD1-CZ 4.02Å; I73-F114 HydrophobicContact CG1-CE1 4.17Å; I73-F114 HydrophobicContact CG1-CZ 3.81Å
74	I	84.7	Confident	80.3	Confident	51 Å²	51	73.1 Å²	73.1	26%	0.262	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-53	175.1	-51.3	-178.8	0	0	0	109.4	S35 T63 K65 E72 V100	S35-I74 PolarHBondContact N-O 3.43Å; S35-I74 PolarHBondContact OG-O 3Å; S35-I74 VanDerWaalsContact OG-O 3.12Å; T63-I74 HydrophobicContact CG2-CB 4.29Å; T63-I74 HydrophobicContact CG2-CD1 3.98Å; T63-I74 HydrophobicContact CG2-CG1 4.49Å; T63-I74 PolarHBondContact O-N 3.47Å; K65-I74 HydrophobicContact CD-CD1 4.11Å; K65-I74 HydrophobicContact CG-CD1 3.67Å; K65-I74 HydrophobicContact CG-CG1 4.08Å; E72-I74 PolarHBondContact O-N 3.47Å; I74-V100 HydrophobicContact CD1-CB 4.47Å; I74-V100 HydrophobicContact CD1-CG1 3.59Å; I74-V100 HydrophobicContact CD1-CG2 4.03Å
75	K	87.5	Confident	79.8	Confident	107 Å²	107	72.7 Å²	72.7	47%	0.465	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	142.5	-174.1	-161.4	174.1	-178.5	-175.7	0	111.6	F33 F61 T63	F33-K75 CarbonylContact O-C 3.6Å; F33-K75 VanDerWaalsContact O-CA 3.28Å; F33-K75 WeakPolarHBondContact O-CA 3.32Å; F61-K75 HydrophobicContact CE2-CB 4.32Å; F61-K75 HydrophobicContact CE2-CD 4.44Å; F61-K75 HydrophobicContact CE2-CG 4.23Å; F61-K75 HydrophobicContact CZ-CD 4.12Å; F61-K75 HydrophobicContact CZ-CG 4.11Å; T63-K75 PolarHBondContact N-O 2.87Å; T63-K75 PolarHBondContact O-N 2.81Å
76	Q	89.4	Confident	79.6	Confident	9 Å²	9	71.7 Å²	71.7	4%	0.042	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	147.6	166.8	-64.2	173.9	-75.1	0	0	108.2	V31 L32 F33 F61 A62 I73 N111	V31-Q76 HydrophobicContact CG1-CB 4.5Å; V31-Q76 CarbonylContact O-C 3.52Å; V31-Q76 VanDerWaalsContact O-C 3.32Å; V31-Q76 VanDerWaalsContact O-CB 3.24Å; V31-Q76 WeakPolarHBondContact O-CB 3.49Å; L32-Q76 WeakPolarHBondContact CA-O 3.45Å; L32-Q76 WeakPolarHBondContact CD1-O 3.38Å; F33-Q76 HydrophobicContact CB-CB 3.95Å; F33-Q76 HydrophobicContact CB-CG 4.13Å; F33-Q76 PolarHBondContact N-O 2.03Å; F33-Q76 VanDerWaalsContact N-O 3.1Å; F33-Q76 PolarHBondContact O-N 3.1Å; F61-Q76 WeakPolarHBondContact O-CA 3.46Å; A62-Q76 HydrophobicContact CB-CG 3.92Å; I73-Q76 HydrophobicContact CG2-CG 3.92Å; Q76-N111 PolarHBondContact NE2-O 2.79Å
77	G	88.8	Confident	79.6	Confident	1 Å²	1	72 Å²	72	1%	0.01	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.4	-157.5	174.7	0	0	0	0	0	114	V31 E48 C60 F61	V31-G77 WeakPolarHBondContact O-CA 3.49Å; V31-G77 PolarHBondContact O-N 2.85Å; E48-G77 VanDerWaalsContact OE1-C 3.25Å; E48-G77 WeakPolarHBondContact OE1-CA 3.01Å; C60-G77 CarbonylContact C-O 3.36Å; C60-G77 WeakPolarHBondContact CA-O 3.27Å; F61-G77 VanDerWaalsContact CD1-C 3.43Å; F61-G77 WeakPolarHBondContact CD1-O 3.06Å; F61-G77 VanDerWaalsContact CE1-C 3.41Å; F61-G77 PolarHBondContact N-O 3.3Å; F61-G77 PolarHBondContact O-N 2.78Å
78	C	88.5	Confident	79.9	Confident	33 Å²	33	70.5 Å²	70.5	22%	0.223	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	141.3	179	-66.5	0	0	0	0	112.8	E48 C50 F61	E48-C78 PolarHBondContact OE1-N 2.96Å; C50-C78 WeakPolarHBondContact CA-SG 3.1Å; C50-C78 HydrophobicContact CB-CB 3.8Å; C50-C78 WeakPolarHBondContact CB-SG 3.23Å; C50-C78 WeakPolarHBondContact SG-CB 3.3Å; C50-C78 CovalentContact SG-SG 2.03Å; C50-C78 PolarHBondContact SG-SG 3.05Å; F61-C78 WeakPolarHBondContact CE1-O 3.26Å
79	W	82.3	Confident	80.6	Confident	111 Å²	111	72 Å²	72	42%	0.42	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	140.4	172.3	-158.7	-89.2	0	0	0	109.7	H59 F61 D82	H59-W79 PolarHBondContact N-O 2.75Å; H59-W79 PolarHBondContact O-N 3.35Å; H59-W79 VanDerWaalsContact O-O 3.13Å; F61-W79 HydrophobicContact CB-CB 4.5Å; F61-W79 HydrophobicContact CD1-CB 3.92Å; F61-W79 AromaticContact CD1-CE3 3.91Å; F61-W79 HydrophobicContact CD1-CE3 3.91Å; F61-W79 AromaticContact CE1-CE3 4Å; F61-W79 HydrophobicContact CE1-CE3 4Å; F61-W79 HydrophobicContact CG-CE3 4.3Å; F61-W79 HydrophobicContact CZ-CE3 4.47Å; W79-D82 VanDerWaalsContact CD1-CB 3.46Å; W79-D82 PolarHBondContact NE1-OD2 3.12Å
80	L	78.8	Confident	81.5	Confident	76 Å²	76	75.2 Å²	75.2	40%	0.398	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.1	-177.6	-63.2	177.9	0	0	0	110.4	R58 D82	R58-L80 HydrophobicContact CG-CD2 3.74Å; L80-D82 PolarHBondContact O-N 3.22Å
81	D	74.7	Confident	82.3	Confident	60 Å²	60	70.5 Å²	70.5	32%	0.321	34%	0.342	S	S	.	.			trans	59.8	34.5	161.8	-145.1	34.7	0	0	0	117.6	K56 R57 Y86	K56-D81 HydrophobicContact CB-CB 3.92Å; K56-D81 HydrophobicContact CD-CB 4.05Å; K56-D81 HydrophobicContact CG-CB 3.95Å; R57-D81 PolarHBondContact N-OD1 2.83Å; R57-D81 VanDerWaalsContact N-OD1 3.17Å; R57-D81 PolarHBondContact O-N 2.81Å; D81-Y86 PolarHBondContact OD1-OH 3.44Å
82	D	76	Confident	82.6	Confident	36 Å²	36	67.7 Å²	67.7	19%	0.193	33%	0.329	C	S	.	.			trans	-89.2	116.7	174	-169.7	-34.6	0	0	0	110.8	W79 L80 N84 C85 Y86	W79-D82 VanDerWaalsContact CD1-CB 3.46Å; W79-D82 PolarHBondContact NE1-OD2 3.12Å; L80-D82 PolarHBondContact O-N 3.22Å; D82-N84 PolarHBondContact O-N 3.15Å; D82-N84 VanDerWaalsContact O-N 3.16Å; D82-N84 VanDerWaalsContact OD1-CB 3.3Å; D82-N84 WeakPolarHBondContact OD1-CB 3.36Å; D82-N84 PolarHBondContact OD1-N 3.17Å; D82-N84 PolarHBondContact OD1-ND2 3.26Å; D82-C85 WeakPolarHBondContact O-CB 3.46Å; D82-C85 PolarHBondContact O-N 3.32Å; D82-Y86 WeakPolarHBondContact O-CD1 3.29Å; D82-Y86 WeakPolarHBondContact O-CE1 3.46Å
83	M	78.2	Confident	82.8	Confident	144 Å²	144	64.7 Å²	64.7	71%	0.709	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-60.7	-24.8	-177.1	-59.4	-166.2	83.1	0	0	113	C85 Y86	M83-C85 PolarHBondContact O-N 3.45Å; M83-Y86 HydrophobicContact CE-CE2 4.47Å; M83-Y86 HydrophobicContact CG-CE2 4.49Å; M83-Y86 PolarHBondContact O-N 2.9Å
84	N	75.9	Confident	82.7	Confident	141 Å²	141	68.6 Å²	68.6	75%	0.754	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-71	-15.3	177.2	-58	-63.4	0	0	0	112.6	D82	D82-N84 PolarHBondContact O-N 3.15Å; D82-N84 VanDerWaalsContact O-N 3.16Å; D82-N84 VanDerWaalsContact OD1-CB 3.3Å; D82-N84 WeakPolarHBondContact OD1-CB 3.36Å; D82-N84 PolarHBondContact OD1-N 3.17Å; D82-N84 PolarHBondContact OD1-ND2 3.26Å
85	C	76.8	Confident	82.3	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-98.6	-4	-178.5	-48.1	0	0	0	0	112.7	H59 D82 M83 D87 S88 C104	H59-C85 HydrophobicContact CB-CB 4.02Å; H59-C85 PolarHBondContact CE1-O 2.75Å; H59-C85 PolarHBondContact ND1-O 2.75Å; D82-C85 WeakPolarHBondContact O-CB 3.46Å; D82-C85 PolarHBondContact O-N 3.32Å; M83-C85 PolarHBondContact O-N 3.45Å; C85-D87 PolarHBondContact O-N 3.31Å; C85-S88 PolarHBondContact O-N 2.87Å; C85-C104 WeakPolarHBondContact CA-SG 3.21Å; C85-C104 HydrophobicContact CB-CB 3.76Å; C85-C104 WeakPolarHBondContact CB-SG 3.22Å; C85-C104 WeakPolarHBondContact SG-CB 3.25Å; C85-C104 CovalentContact SG-SG 2Å; C85-C104 PolarHBondContact SG-SG 2.89Å
86	Y	80.5	Confident	81.2	Confident	65 Å²	65	73.3 Å²	73.3	26%	0.255	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	132.2	-176.2	-76.6	20.6	0	0	0	110.3	R57 H59 D81 D82 M83 S88	R57-Y86 HydrophobicContact CB-CD1 4.42Å; R57-Y86 HydrophobicContact CB-CE1 3.78Å; R57-Y86 HydrophobicContact CG-CE1 3.97Å; R57-Y86 HydrophobicContact CG-CE2 4.47Å; H59-Y86 AromaticContact CE1-CD1 3.71Å; H59-Y86 AromaticContact NE2-CD1 3.42Å; H59-Y86 WeakPolarHBondContact NE2-CD1 3.46Å; H59-Y86 AromaticContact NE2-CE1 3.5Å; H59-Y86 WeakPolarHBondContact NE2-CE1 3.39Å; D81-Y86 PolarHBondContact OD1-OH 3.44Å; D82-Y86 WeakPolarHBondContact O-CD1 3.29Å; D82-Y86 WeakPolarHBondContact O-CE1 3.46Å; M83-Y86 HydrophobicContact CE-CE2 4.47Å; M83-Y86 HydrophobicContact CG-CE2 4.49Å; M83-Y86 PolarHBondContact O-N 2.9Å; Y86-S88 PolarHBondContact O-N 3.3Å
87	D	80	Confident	79.9	Confident	99 Å²	99	77.8 Å²	77.8	53%	0.529	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	15.5	177	-46.5	-35.9	0	0	0	114	R57 C85 Y89 E106	R57-D87 IonicContact CZ-OD1 3.56Å; R57-D87 IonicContact NH1-OD1 3.99Å; R57-D87 PolarHBondContact NH1-OD1 2.8Å; C85-D87 PolarHBondContact O-N 3.31Å; D87-Y89 WeakPolarHBondContact O-CE2 3.36Å; D87-E106 PolarHBondContact N-OE2 3.36Å
88	S	82.1	Confident	78.8	Confident	41 Å²	41	79.3 Å²	79.3	29%	0.287	40%	0.396	S	S	.	.			trans	-93.4	108.6	172.3	-177.9	0	0	0	0	109.5	C85 Y86 E90 C104 C105 E106	C85-S88 PolarHBondContact O-N 2.87Å; Y86-S88 PolarHBondContact O-N 3.3Å; S88-E90 PolarHBondContact OG-O 3.44Å; S88-C104 PolarHBondContact OG-O 2.78Å; S88-C105 CarbonylContact O-C 3.52Å; S88-C105 WeakPolarHBondContact O-CA 3.28Å; S88-C105 WeakPolarHBondContact O-CB 3.21Å; S88-E106 PolarHBondContact O-N 2.73Å
89	Y	85.9	Confident	78	Confident	156 Å²	156	86.9 Å²	86.9	61%	0.612	43%	0.428	S	S	*	.			trans	-92.2	-7.4	-176.8	-55.8	-74.3	0	0	0	113.8	D87 E106	D87-Y89 WeakPolarHBondContact O-CE2 3.36Å; Y89-E106 VanDerWaalsContact CD1-O 3.31Å; Y89-E106 WeakPolarHBondContact CD1-O 3.16Å
90	E	86.1	Confident	78.1	Confident	128 Å²	128	84.2 Å²	84.2	60%	0.598	42%	0.424	S	S	*	.	S	Bend	trans	-124.5	135.6	-178.6	-63	-173.3	157.7	0	0	110.5	S88 V92	S88-E90 PolarHBondContact OG-O 3.44Å; E90-V92 HydrophobicContact CB-CG2 3.95Å; E90-V92 PolarHBondContact O-N 3.47Å; E90-V92 VanDerWaalsContact O-N 3.1Å
91	C	87.7	Confident	78.4	Confident	2 Å²	2	81.7 Å²	81.7	1%	0.014	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	90.5	178.5	-154.9	0	0	0	0	110.3	C103 C105 F114 M115	C91-C103 VanDerWaalsContact C-CB 3.49Å; C91-C103 VanDerWaalsContact CA-SG 3.51Å; C91-C103 HydrophobicContact CB-CB 4.01Å; C91-C103 WeakPolarHBondContact CB-SG 3.38Å; C91-C103 PolarHBondContact O-SG 2.87Å; C91-C103 VanDerWaalsContact O-SG 3.38Å; C91-C103 WeakPolarHBondContact SG-CB 3.46Å; C91-C103 PolarHBondContact SG-O 3.34Å; C91-C103 CovalentContact SG-SG 2.03Å; C91-C103 PolarHBondContact SG-SG 2.97Å; C91-C105 HydrophobicContact CB-CB 4.4Å; C91-F114 HydrophobicContact CB-CB 4.24Å; C91-F114 VanDerWaalsContact O-CA 3.27Å; C91-F114 WeakPolarHBondContact O-CA 3.27Å; C91-M115 PolarHBondContact O-N 3.33Å
92	V	87.3	Confident	79.2	Confident	29 Å²	29	82 Å²	82	18%	0.176	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128.9	-176.3	-174.6	0	0	0	0	111.9	E90 R94 M115 V117	E90-V92 HydrophobicContact CB-CG2 3.95Å; E90-V92 PolarHBondContact O-N 3.47Å; E90-V92 VanDerWaalsContact O-N 3.1Å; V92-R94 HydrophobicContact CG1-CG 4.31Å; V92-M115 WeakPolarHBondContact CA-O 3.41Å; V92-M115 HydrophobicContact CG2-CB 4.47Å; V92-M115 HydrophobicContact CG2-CE 4.14Å; V92-V117 HydrophobicContact CG1-CB 3.98Å; V92-V117 HydrophobicContact CG1-CG2 3.85Å
93	E	85.9	Confident	79.9	Confident	21 Å²	21	80.5 Å²	80.5	10%	0.098	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	134.5	169.6	178.3	57.1	-85.6	0	0	110.1	W64 K95 P98 F101 F102 M115 Y116 V117	W64-E93 HydrophobicContact CH2-CB 4.01Å; W64-E93 HydrophobicContact CZ2-CB 4.36Å; E93-K95 WeakPolarHBondContact OE1-CB 3.17Å; E93-K95 WeakPolarHBondContact OE1-CG 3.08Å; E93-K95 PolarHBondContact OE1-N 3.36Å; E93-P98 HydrophobicContact CG-CG 4.46Å; E93-F101 HydrophobicContact CB-CD1 4.33Å; E93-F101 HydrophobicContact CG-CB 4.44Å; E93-F101 HydrophobicContact CG-CD1 3.86Å; E93-F102 PolarHBondContact OE2-N 3Å; E93-M115 PolarHBondContact N-O 3.23Å; E93-Y116 HydrophobicContact CB-CD2 4.35Å; E93-Y116 HydrophobicContact CG-CD2 4.26Å; E93-Y116 VanDerWaalsContact O-CD2 3.31Å; E93-Y116 WeakPolarHBondContact O-CD2 3.23Å; E93-V117 PolarHBondContact O-N 2.85Å
94	R	80.3	Confident	80.6	Confident	131 Å²	131	74.2 Å²	74.2	49%	0.494	37%	0.371	S	S	.	.			trans	-119.2	-15.9	-176.4	-63.9	180	-178.7	-98.1	-3.9	113.5	V92 V117 D119	V92-R94 HydrophobicContact CG1-CG 4.31Å; R94-V117 WeakPolarHBondContact CA-O 3.49Å; R94-D119 IonicContact NH1-OD1 2.71Å; R94-D119 PolarHBondContact NH1-OD1 3.1Å
95	K	74.8	Confident	81.2	Confident	150 Å²	150	67.5 Å²	67.5	65%	0.652	34%	0.335	S	S	*	.	S	Bend	trans	-65	138.6	-179.6	-70.6	179.2	-180	174.4	0	111.3	E93 P98 Y116	E93-K95 WeakPolarHBondContact OE1-CB 3.17Å; E93-K95 WeakPolarHBondContact OE1-CG 3.08Å; E93-K95 PolarHBondContact OE1-N 3.36Å; K95-P98 WeakPolarHBondContact O-CD 3.31Å; K95-Y116 WeakPolarHBondContact O-CE2 3.48Å; K95-Y116 PolarHBondContact O-OH 3.35Å
96	V	64.9	Low	81.7	Confident	107 Å²	107	69 Å²	69	65%	0.648	34%	0.342	S	S	*	.	S	Bend	trans	-77	127.9	178.3	-175.8	0	0	0	0	109.5
97	S	61.9	Low	81.8	Confident	103 Å²	103	67.1 Å²	67.1	72%	0.72	34%	0.342	S	S	*	.	S	Bend	trans	51.5	55.1	172.9	63	0	0	0	0	117.5
98	P	66.1	Low	82.1	Confident	33 Å²	33	66.4 Å²	66.4	21%	0.214	34%	0.338	C	S	.	.			trans	-74.8	142.9	170.8	33.9	-35.2	0	0	0	110.8	E93 K95 V100 F101	E93-P98 HydrophobicContact CG-CG 4.46Å; K95-P98 WeakPolarHBondContact O-CD 3.31Å; P98-V100 WeakPolarHBondContact CB-O 3.37Å; P98-V100 PolarHBondContact O-N 3.29Å; P98-F101 HydrophobicContact CG-CD1 3.62Å; P98-F101 HydrophobicContact CG-CD2 4.39Å; P98-F101 HydrophobicContact CG-CE1 3.73Å; P98-F101 HydrophobicContact CG-CE2 4.48Å; P98-F101 HydrophobicContact CG-CG 3.96Å; P98-F101 HydrophobicContact CG-CZ 4.16Å
99	E	72.6	Confident	82.2	Confident	192 Å²	192	66.9 Å²	66.9	90%	0.897	34%	0.337	S	S	*	.	S	Bend	trans	-60.9	-26.8	171.7	-66.4	-174.2	168.3	0	0	112
100	V	83	Confident	82.3	Confident	55 Å²	55	60.5 Å²	60.5	33%	0.333	32%	0.315	S	S	.	.	S	Bend	trans	-142	124.3	176.8	176.1	0	0	0	0	108.7	T63 K65 I74 P98	T63-V100 HydrophobicContact CG2-CG1 3.16Å; K65-V100 HydrophobicContact CD-CG2 4.48Å; K65-V100 VanDerWaalsContact CE-CG2 3.47Å; K65-V100 HydrophobicContact CG-CG2 4.27Å; I74-V100 HydrophobicContact CD1-CB 4.47Å; I74-V100 HydrophobicContact CD1-CG1 3.59Å; I74-V100 HydrophobicContact CD1-CG2 4.03Å; P98-V100 WeakPolarHBondContact CB-O 3.37Å; P98-V100 PolarHBondContact O-N 3.29Å
101	F	86.8	Confident	82.4	Confident	23 Å²	23	54.4 Å²	54.4	10%	0.101	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	139.2	177.5	-64.5	-95.8	0	0	0	110.4	T63 W64 N66 E93 P98 Y116	T63-F101 VanDerWaalsContact CA-O 3.26Å; T63-F101 WeakPolarHBondContact CA-O 3.32Å; T63-F101 WeakPolarHBondContact CG2-O 3Å; W64-F101 HydrophobicContact CD2-CB 3.56Å; W64-F101 HydrophobicContact CD2-CG 4.4Å; W64-F101 AromaticContact CE2-CG 3.74Å; W64-F101 HydrophobicContact CE3-CB 3.97Å; W64-F101 HydrophobicContact CG-CB 4.08Å; W64-F101 HydrophobicContact CH2-CB 3.88Å; W64-F101 HydrophobicContact CZ2-CB 3.46Å; W64-F101 VanDerWaalsContact CZ2-CB 3.46Å; W64-F101 HydrophobicContact CZ2-CD1 4.14Å; W64-F101 AromaticContact CZ2-CG 3.97Å; W64-F101 HydrophobicContact CZ2-CG 3.97Å; W64-F101 HydrophobicContact CZ3-CB 4.1Å; W64-F101 PolarHBondContact N-O 2.73Å; W64-F101 VanDerWaalsContact N-O 3.09Å; W64-F101 AromaticContact NE1-CD2 3.77Å; W64-F101 AromaticContact NE1-CG 3.59Å; W64-F101 PolarHBondContact O-N 2.95Å; N66-F101 HydrophobicContact CB-CE2 4.11Å; E93-F101 HydrophobicContact CB-CD1 4.33Å; E93-F101 HydrophobicContact CG-CB 4.44Å; E93-F101 HydrophobicContact CG-CD1 3.86Å; P98-F101 HydrophobicContact CG-CD1 3.62Å; P98-F101 HydrophobicContact CG-CD2 4.39Å; P98-F101 HydrophobicContact CG-CE1 3.73Å; P98-F101 HydrophobicContact CG-CE2 4.48Å; P98-F101 HydrophobicContact CG-CG 3.96Å; P98-F101 HydrophobicContact CG-CZ 4.16Å; F101-Y116 AromaticContact CD1-CD2 3.85Å; F101-Y116 HydrophobicContact CD1-CD2 3.85Å; F101-Y116 HydrophobicContact CD1-CE2 4.44Å; F101-Y116 HydrophobicContact CD1-CG 4.09Å; F101-Y116 HydrophobicContact CE1-CD1 4.01Å; F101-Y116 AromaticContact CE1-CD2 3.53Å; F101-Y116 HydrophobicContact CE1-CD2 3.53Å; F101-Y116 HydrophobicContact CE1-CE1 4.26Å; F101-Y116 AromaticContact CE1-CE2 3.85Å; F101-Y116 HydrophobicContact CE1-CE2 3.85Å; F101-Y116 AromaticContact CE1-CG 3.62Å; F101-Y116 HydrophobicContact CE1-CG 3.62Å
102	F	91.3	Very high	82.3	Confident	66 Å²	66	60.2 Å²	60.2	29%	0.289	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	138	178.3	176.5	-92.5	0	0	0	111	F61 A62 E93 C104	F61-F102 HydrophobicContact CB-CE2 3.94Å; F61-F102 HydrophobicContact CB-CZ 4.1Å; F61-F102 HydrophobicContact CD2-CD2 4.4Å; F61-F102 AromaticContact CD2-CE2 3.79Å; F61-F102 HydrophobicContact CD2-CE2 3.79Å; F61-F102 HydrophobicContact CG-CE2 4.1Å; A62-F102 WeakPolarHBondContact O-CA 3.4Å; E93-F102 PolarHBondContact OE2-N 3Å; F102-C104 HydrophobicContact CE1-CB 4.32Å; F102-C104 HydrophobicContact CZ-CB 4.35Å
103	C	90.4	Very high	82.1	Confident	4 Å²	4	68.4 Å²	68.4	3%	0.027	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	158.3	168.4	61.8	0	0	0	0	111	F61 A62 W64 C91	F61-C103 CarbonylContact C-O 3.5Å; F61-C103 WeakPolarHBondContact CA-O 3.3Å; F61-C103 WeakPolarHBondContact CB-O 3.31Å; A62-C103 PolarHBondContact N-O 3.39Å; A62-C103 PolarHBondContact O-N 3.47Å; W64-C103 HydrophobicContact CH2-CB 4.4Å; W64-C103 HydrophobicContact CZ3-CB 4.35Å; W64-C103 VanDerWaalsContact CZ3-SG 3.51Å; C91-C103 VanDerWaalsContact C-CB 3.49Å; C91-C103 VanDerWaalsContact CA-SG 3.51Å; C91-C103 HydrophobicContact CB-CB 4.01Å; C91-C103 WeakPolarHBondContact CB-SG 3.38Å; C91-C103 PolarHBondContact O-SG 2.87Å; C91-C103 VanDerWaalsContact O-SG 3.38Å; C91-C103 WeakPolarHBondContact SG-CB 3.46Å; C91-C103 PolarHBondContact SG-O 3.34Å; C91-C103 CovalentContact SG-SG 2.03Å; C91-C103 PolarHBondContact SG-SG 2.97Å
104	C	91.5	Very high	82.1	Confident	12 Å²	12	69.3 Å²	69.3	8%	0.081	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	154.6	173.3	59.1	0	0	0	0	111.8	C60 F61 C85 S88 F102	C60-C104 CarbonylContact O-C 3.49Å; C60-C104 WeakPolarHBondContact O-CA 3Å; C60-C104 WeakPolarHBondContact O-CB 3.5Å; F61-C104 HydrophobicContact CB-CB 4.22Å; C85-C104 WeakPolarHBondContact CA-SG 3.21Å; C85-C104 HydrophobicContact CB-CB 3.76Å; C85-C104 WeakPolarHBondContact CB-SG 3.22Å; C85-C104 WeakPolarHBondContact SG-CB 3.25Å; C85-C104 CovalentContact SG-SG 2Å; C85-C104 PolarHBondContact SG-SG 2.89Å; S88-C104 PolarHBondContact OG-O 2.78Å; F102-C104 HydrophobicContact CE1-CB 4.32Å; F102-C104 HydrophobicContact CZ-CB 4.35Å
105	C	88.8	Confident	82.2	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	158.7	-175.1	55	0	0	0	0	112.4	H59 C60 S88 C91 C110	H59-C105 CarbonylContact C-O 3.58Å; H59-C105 VanDerWaalsContact CA-O 3.25Å; H59-C105 WeakPolarHBondContact CA-O 2.92Å; H59-C105 WeakPolarHBondContact CB-O 3.46Å; C60-C105 PolarHBondContact N-O 3.16Å; C60-C105 PolarHBondContact O-N 2.94Å; S88-C105 CarbonylContact O-C 3.52Å; S88-C105 WeakPolarHBondContact O-CA 3.28Å; S88-C105 WeakPolarHBondContact O-CB 3.21Å; C91-C105 HydrophobicContact CB-CB 4.4Å; C105-C110 HydrophobicContact CB-CB 3.82Å; C105-C110 WeakPolarHBondContact CB-SG 3.37Å; C105-C110 PolarHBondContact O-SG 2Å; C105-C110 VanDerWaalsContact O-SG 3.34Å; C105-C110 WeakPolarHBondContact SG-CB 3.31Å; C105-C110 PolarHBondContact SG-O 2.76Å; C105-C110 VanDerWaalsContact SG-O 3.42Å; C105-C110 CovalentContact SG-SG 2.03Å; C105-C110 PolarHBondContact SG-SG 3.38Å
106	E	87.3	Confident	82.5	Confident	32 Å²	32	64.8 Å²	64.8	15%	0.15	33%	0.329	C	S	.	.	S	Bend	trans	-108	118.9	178.1	-166.6	172.9	163.5	0	0	109	R57 H59 D87 S88 Y89	R57-E106 IonicContact NH1-OE1 2.68Å; R57-E106 IonicContact NH1-OE2 3.07Å; R57-E106 PolarHBondContact NH1-OE2 3.21Å; H59-E106 IonicContact CE1-OE2 3.57Å; D87-E106 PolarHBondContact N-OE2 3.36Å; S88-E106 PolarHBondContact O-N 2.73Å; Y89-E106 VanDerWaalsContact CD1-O 3.31Å; Y89-E106 WeakPolarHBondContact CD1-O 3.16Å
107	G	82.6	Confident	83.2	Confident	25 Å²	25	62.7 Å²	62.7	26%	0.258	32%	0.317	S	S	.	.	S	Bend	trans	134.8	149.5	179.5	0	0	0	0	0	113.4	Q28 M109 C110	Q28-G107 PolarHBondContact NE2-O 3.25Å; G107-M109 PolarHBondContact O-N 3.33Å; G107-C110 VanDerWaalsContact O-CB 3.31Å; G107-C110 WeakPolarHBondContact O-CB 3.44Å; G107-C110 PolarHBondContact O-N 3.19Å; G107-C110 PolarHBondContact O-SG 2.03Å
108	N	86.2	Confident	83.7	Confident	84 Å²	84	60.8 Å²	60.8	45%	0.449	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	129	-173.6	-77.6	-22.3	0	0	0	112	Q28 E29 C110	Q28-N108 VanDerWaalsContact CA-OD1 3.3Å; Q28-N108 WeakPolarHBondContact CA-OD1 3.07Å; Q28-N108 VanDerWaalsContact NE2-CA 3.32Å; Q28-N108 PolarHBondContact NE2-OD1 3.34Å; E29-N108 PolarHBondContact N-OD1 3.42Å; E29-N108 WeakPolarHBondContact O-CA 3.45Å; N108-C110 PolarHBondContact O-N 2.89Å; N108-C110 VanDerWaalsContact O-N 3.09Å
109	M	84.8	Confident	83.5	Confident	52 Å²	52	64.3 Å²	64.3	26%	0.256	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	22.5	178.2	-55.8	-65.2	-84.8	0	0	114	E29 C30 V31 T47 G107 N111 E112	E29-M109 HydrophobicContact CB-SD 4.36Å; E29-M109 PolarHBondContact O-N 2.85Å; C30-M109 VanDerWaalsContact C-SD 3.6Å; V31-M109 HydrophobicContact CG2-CE 3.43Å; V31-M109 VanDerWaalsContact CG2-CE 3.43Å; V31-M109 HydrophobicContact CG2-SD 4.01Å; T47-M109 HydrophobicContact CG2-CE 3.94Å; T47-M109 HydrophobicContact CG2-SD 3.52Å; T47-M109 VanDerWaalsContact CG2-SD 3.52Å; T47-M109 WeakPolarHBondContact OG1-CE 2.97Å; G107-M109 PolarHBondContact O-N 3.33Å; M109-N111 PolarHBondContact O-N 3.09Å; M109-N111 VanDerWaalsContact O-N 3.1Å; M109-E112 VanDerWaalsContact O-CB 3.23Å; M109-E112 WeakPolarHBondContact O-CB 3.38Å; M109-E112 PolarHBondContact O-N 2.02Å
110	C	87.3	Confident	82.3	Confident	22 Å²	22	61.4 Å²	61.4	15%	0.149	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-17.6	-175.5	68.8	0	0	0	0	113.3	C105 G107 N108 E112	C105-C110 HydrophobicContact CB-CB 3.82Å; C105-C110 WeakPolarHBondContact CB-SG 3.37Å; C105-C110 PolarHBondContact O-SG 2Å; C105-C110 VanDerWaalsContact O-SG 3.34Å; C105-C110 WeakPolarHBondContact SG-CB 3.31Å; C105-C110 PolarHBondContact SG-O 2.76Å; C105-C110 VanDerWaalsContact SG-O 3.42Å; C105-C110 CovalentContact SG-SG 2.03Å; C105-C110 PolarHBondContact SG-SG 3.38Å; G107-C110 VanDerWaalsContact O-CB 3.31Å; G107-C110 WeakPolarHBondContact O-CB 3.44Å; G107-C110 PolarHBondContact O-N 3.19Å; G107-C110 PolarHBondContact O-SG 2.03Å; N108-C110 PolarHBondContact O-N 2.89Å; N108-C110 VanDerWaalsContact O-N 3.09Å; C110-E112 VanDerWaalsContact C-N 3.35Å
111	N	89.6	Confident	80.3	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	3.1	175.2	69.6	-28.4	0	0	0	113.9	V31 C60 F61 A62 Q76 M109 R113	V31-N111 WeakPolarHBondContact CB-OD1 3.08Å; V31-N111 PolarHBondContact N-OD1 2.9Å; V31-N111 PolarHBondContact O-ND2 2.9Å; C60-N111 HydrophobicContact CB-CB 3.61Å; C60-N111 VanDerWaalsContact CB-CG 3.48Å; F61-N111 PolarHBondContact O-ND2 2.89Å; A62-N111 HydrophobicContact CB-CB 4.45Å; Q76-N111 PolarHBondContact NE2-O 2.79Å; M109-N111 PolarHBondContact O-N 3.09Å; M109-N111 VanDerWaalsContact O-N 3.1Å; N111-R113 PolarHBondContact O-N 2.86Å
112	E	85.3	Confident	78	Confident	124 Å²	124	71.9 Å²	71.9	58%	0.579	37%	0.371	S	S	*	.	S	Bend	trans	-61.3	-36.2	174	-174.1	-173.4	-154.4	0	0	111.6	V31 M109 C110	V31-E112 HydrophobicContact CG2-CB 3.89Å; V31-E112 HydrophobicContact CG2-CG 4.37Å; M109-E112 VanDerWaalsContact O-CB 3.23Å; M109-E112 WeakPolarHBondContact O-CB 3.38Å; M109-E112 PolarHBondContact O-N 2.02Å; C110-E112 VanDerWaalsContact C-N 3.35Å
113	R	83.3	Confident	75.4	Confident	200 Å²	200	77 Å²	77	76%	0.755	40%	0.396	S	S	*	.	S	Bend	trans	-119.3	121.7	175.9	-61.7	-176.5	-174	172.3	3	109.1	N111	N111-R113 PolarHBondContact O-N 2.86Å
114	F	85.6	Confident	72.8	Confident	41 Å²	41	84.3 Å²	84.3	18%	0.18	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	144.9	175.1	55.2	-93.6	0	0	0	110.5	A62 W64 I71 I73 C91	A62-F114 HydrophobicContact CB-CB 4.11Å; A62-F114 HydrophobicContact CB-CD1 3.9Å; A62-F114 HydrophobicContact CB-CG 4.13Å; W64-F114 HydrophobicContact CB-CE2 4.06Å; W64-F114 HydrophobicContact CB-CZ 4.39Å; W64-F114 AromaticContact CD1-CE2 3.96Å; W64-F114 AromaticContact CD2-CD2 3.35Å; W64-F114 HydrophobicContact CD2-CD2 3.35Å; W64-F114 AromaticContact CD2-CE2 3.42Å; W64-F114 HydrophobicContact CD2-CE2 3.42Å; W64-F114 VanDerWaalsContact CD2-CE2 3.42Å; W64-F114 HydrophobicContact CD2-CG 4.29Å; W64-F114 HydrophobicContact CD2-CZ 4.41Å; W64-F114 AromaticContact CE2-CD2 3.52Å; W64-F114 AromaticContact CE2-CE2 3.79Å; W64-F114 HydrophobicContact CE3-CB 4.3Å; W64-F114 AromaticContact CE3-CD2 3.39Å; W64-F114 HydrophobicContact CE3-CD2 3.39Å; W64-F114 AromaticContact CE3-CE2 3.82Å; W64-F114 HydrophobicContact CE3-CE2 3.82Å; W64-F114 AromaticContact CE3-CG 3.88Å; W64-F114 HydrophobicContact CE3-CG 3.88Å; W64-F114 HydrophobicContact CG-CD2 4.02Å; W64-F114 AromaticContact CG-CE2 3.55Å; W64-F114 HydrophobicContact CG-CE2 3.55Å; W64-F114 HydrophobicContact CG-CZ 4.34Å; W64-F114 HydrophobicContact CH2-CB 3.98Å; W64-F114 AromaticContact CH2-CD2 3.8Å; W64-F114 HydrophobicContact CH2-CD2 3.8Å; W64-F114 HydrophobicContact CH2-CG 4.27Å; W64-F114 AromaticContact CZ2-CD2 3.74Å; W64-F114 HydrophobicContact CZ2-CD2 3.74Å; W64-F114 HydrophobicContact CZ2-CE2 4.46Å; W64-F114 HydrophobicContact CZ3-CB 3.8Å; W64-F114 AromaticContact CZ3-CD2 3.64Å; W64-F114 HydrophobicContact CZ3-CD2 3.64Å; W64-F114 HydrophobicContact CZ3-CE2 4.49Å; W64-F114 AromaticContact CZ3-CG 3.9Å; W64-F114 HydrophobicContact CZ3-CG 3.9Å; I71-F114 HydrophobicContact CG2-CE2 3.92Å; I71-F114 HydrophobicContact CG2-CZ 4.04Å; I73-F114 HydrophobicContact CD1-CE1 3.98Å; I73-F114 HydrophobicContact CD1-CZ 4.02Å; I73-F114 HydrophobicContact CG1-CE1 4.17Å; I73-F114 HydrophobicContact CG1-CZ 3.81Å; C91-F114 HydrophobicContact CB-CB 4.24Å; C91-F114 VanDerWaalsContact O-CA 3.27Å; C91-F114 WeakPolarHBondContact O-CA 3.27Å
115	M	81.8	Confident	69.9	Low	98 Å²	98	91.3 Å²	91.3	48%	0.483	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	150.3	-175.3	-64.7	-173.8	-68.1	0	0	111.6	C91 V92 E93 V117	C91-M115 PolarHBondContact O-N 3.33Å; V92-M115 WeakPolarHBondContact CA-O 3.41Å; V92-M115 HydrophobicContact CG2-CB 4.47Å; V92-M115 HydrophobicContact CG2-CE 4.14Å; E93-M115 PolarHBondContact N-O 3.23Å; M115-V117 HydrophobicContact CB-CG2 4.48Å
116	Y	81.4	Confident	67.4	Low	88 Å²	88	97.9 Å²	97.9	35%	0.345	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	120.6	167.4	173.9	-122.4	0	0	0	109.2	E93 K95 F101 P118	E93-Y116 HydrophobicContact CB-CD2 4.35Å; E93-Y116 HydrophobicContact CG-CD2 4.26Å; E93-Y116 VanDerWaalsContact O-CD2 3.31Å; E93-Y116 WeakPolarHBondContact O-CD2 3.23Å; K95-Y116 WeakPolarHBondContact O-CE2 3.48Å; K95-Y116 PolarHBondContact O-OH 3.35Å; F101-Y116 AromaticContact CD1-CD2 3.85Å; F101-Y116 HydrophobicContact CD1-CD2 3.85Å; F101-Y116 HydrophobicContact CD1-CE2 4.44Å; F101-Y116 HydrophobicContact CD1-CG 4.09Å; F101-Y116 HydrophobicContact CE1-CD1 4.01Å; F101-Y116 AromaticContact CE1-CD2 3.53Å; F101-Y116 HydrophobicContact CE1-CD2 3.53Å; F101-Y116 HydrophobicContact CE1-CE1 4.26Å; F101-Y116 AromaticContact CE1-CE2 3.85Å; F101-Y116 HydrophobicContact CE1-CE2 3.85Å; F101-Y116 AromaticContact CE1-CG 3.62Å; F101-Y116 HydrophobicContact CE1-CG 3.62Å; Y116-P118 HydrophobicContact CE1-CB 4.45Å; Y116-P118 HydrophobicContact CE1-CG 4.25Å
117	V	79.1	Confident	64.7	Low	63 Å²	63	101.4 Å²	101.4	38%	0.382	54%	0.54	S	S	.	.			trans	-130.8	99.2	178.5	-176.2	0	0	0	0	108.5	V92 E93 R94 M115 D119	V92-V117 HydrophobicContact CG1-CB 3.98Å; V92-V117 HydrophobicContact CG1-CG2 3.85Å; E93-V117 PolarHBondContact O-N 2.85Å; R94-V117 WeakPolarHBondContact CA-O 3.49Å; M115-V117 HydrophobicContact CB-CG2 4.48Å; V117-D119 PolarHBondContact O-N 3.24Å
118	P	73.1	Confident	62.5	Low	62 Å²	62	109 Å²	109	40%	0.403	57%	0.569	S	S	.	*			trans	-65.5	132.6	177.1	24.4	-30.4	0	0	0	110.5	Y116 T120	Y116-P118 HydrophobicContact CE1-CB 4.45Å; Y116-P118 HydrophobicContact CE1-CG 4.25Å; P118-T120 PolarHBondContact O-N 2.91Å; P118-T120 VanDerWaalsContact O-N 3.11Å
119	D	61.3	Low	59.8	Low	107 Å²	107	109.9 Å²	109.9	57%	0.572	58%	0.581	S	S	*	*			trans	-67.2	108.2	172.1	-97.3	-10.2	0	0	0	109.5	R94 V117 Q121	R94-D119 IonicContact NH1-OD1 2.71Å; R94-D119 PolarHBondContact NH1-OD1 3.1Å; V117-D119 PolarHBondContact O-N 3.24Å; D119-Q121 PolarHBondContact O-N 2.94Å
120	T	48.2	Very low	57.2	Low	132 Å²	132	112.3 Å²	112.3	81%	0.81	60%	0.599	S	S	*	*			trans	-80.9	97.4	171.5	51.9	0	0	0	0	109.6	P118	P118-T120 PolarHBondContact O-N 2.91Å; P118-T120 VanDerWaalsContact O-N 3.11Å
121	Q	40	Very low	54.5	Low	164 Å²	164	115.8 Å²	115.8	77%	0.766	63%	0.63	S	S	*	*			trans	-77.2	139.5	154.5	-71.6	-165.7	-7	0	0	109.3	D119 Q123	D119-Q121 PolarHBondContact O-N 2.94Å; Q121-Q123 PolarHBondContact O-N 3.45Å
122	P	39.3	Very low	51.8	Low	133 Å²	133	125.8 Å²	125.8	86%	0.864	67%	0.669	S	S	*	*			trans	-77.4	94.7	173.4	30.7	-30.2	0	0	0	109.2
123	Q	35.6	Very low	49.2	Very low	174 Å²	174	125.3 Å²	125.3	81%	0.813	67%	0.674	S	S	*	*			trans	-102.8	122	156.5	-87.2	-173.7	-27.8	0	0	108.7	Q121 D125	Q121-Q123 PolarHBondContact O-N 3.45Å; Q123-D125 PolarHBondContact O-N 3.32Å; Q123-D125 VanDerWaalsContact O-N 3.12Å
124	N	35.9	Very low	46.8	Very low	158 Å²	158	122 Å²	122	85%	0.845	68%	0.676	S	S	*	*			trans	-57.5	109.8	161.6	-74.2	-24.7	0	0	0	107.4
125	D	30.5	Very low	44.6	Very low	159 Å²	159	124.7 Å²	124.7	85%	0.85	70%	0.701	S	S	*	*			trans	-165	132.4	136.2	-91.5	-28.2	0	0	0	111	Q123	Q123-D125 PolarHBondContact O-N 3.32Å; Q123-D125 VanDerWaalsContact O-N 3.12Å
126	T	37.3	Very low	42.2	Very low	137 Å²	137	127.1 Å²	127.1	84%	0.84	72%	0.715	S	S	*	*			trans	-70.1	116.3	178.3	26.1	0	0	0	0	112.2
127	S	30.8	Very low	40.5	Very low	106 Å²	106	127.6 Å²	127.6	74%	0.741	73%	0.73	S	S	*	*			trans	177.9	128.8	133.6	52.3	0	0	0	0	112
128	H	35.3	Very low	38.4	Very low	185 Å²	185	134.1 Å²	134.1	86%	0.856	75%	0.753	S	S	*	*			trans	17.1	119.3	154.4	-65.9	-80.1	0	0	0	117.7
129	S	29.9	Very low	36.5	Very low	102 Å²	102	136 Å²	136	71%	0.713	77%	0.768	S	S	*	*				175.7	145.3	67.6	-107.7	0	0	0	0	112.3
130	T	30.7	Very low	35.6	Very low	103 Å²	103	136.7 Å²	136.7	63%	0.632	78%	0.778	S	S	*	*			trans	39	98.4	150.6	48.4	0	0	0	0	120.3
131	A	30.3	Very low	35.2	Very low	96 Å²	96	140.2 Å²	140.2	79%	0.793	78%	0.782	S	S	*	*			trans	-78.1	122.4	155.5	0	0	0	0	0	110.2
132	Y	34.1	Very low	35.4	Very low	209 Å²	209	137.3 Å²	137.3	82%	0.82	78%	0.778	S	S	*	*			trans	-90.6	104.7	166	-68.6	-82	0	0	0	108.7
133	T	29.9	Very low	36.4	Very low	114 Å²	114	134.6 Å²	134.6	70%	0.699	77%	0.766	S	S	*	*			trans	-91.7	115.4	169.7	-45.5	0	0	0	0	108.5	S135	T133-S135 PolarHBondContact O-N 3.08Å
134	T	32.8	Very low	37.6	Very low	130 Å²	130	133.3 Å²	133.3	80%	0.798	76%	0.764	S	S	*	*			trans	-92	84.7	166.6	40.2	0	0	0	0	109.7
135	S	39.1	Very low	38.7	Very low	98 Å²	98	133.6 Å²	133.6	69%	0.685	76%	0.758	S	S	*	*			trans	-153.6	147.7	156.2	69	0	0	0	0	110.8	T133	T133-S135 PolarHBondContact O-N 3.08Å
136	N	31.9	Very low	40	Very low	149 Å²	149	128.3 Å²	128.3	80%	0.797	73%	0.734	S	S	*	*			trans	-156.9	153	168.5	-134.4	16.5	0	0	0	109.6
137	P	46.3	Very low	41.3	Very low	99 Å²	99	126.1 Å²	126.1	64%	0.643	72%	0.72	S	S	*	*			cis	-132.4	158.5	-30.6	20.9	2.3	0	0	0	116.1
138	F	35	Very low	43	Very low	199 Å²	199	125.7 Å²	125.7	87%	0.873	71%	0.709	S	S	*	*			trans	28	149.1	141.6	-77	-95.4	0	0	0	122
139	S	33.3	Very low	44.6	Very low	101 Å²	101	121.3 Å²	121.3	71%	0.706	69%	0.691	S	S	*	*			cis	177.8	176.1	13.5	52.4	0	0	0	0	108.7
140	P	42.1	Very low	46.4	Very low	123 Å²	123	124.8 Å²	124.8	80%	0.799	69%	0.69	S	S	*	*			cis	-127.5	167.9	9.4	38.6	-19.7	0	0	0	115.9
141	K	39.4	Very low	48.6	Very low	206 Å²	206	122.2 Å²	122.2	90%	0.896	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-73.4	139.9	179.8	-65.7	179.1	177.6	178.7	0	112.6
142	P	43.4	Very low	50.9	Low	103 Å²	103	122 Å²	122	67%	0.669	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-88.3	155.6	160.8	31.6	-23.2	0	0	0	111.6
143	A	60.8	Low	53.2	Low	75 Å²	75	116.1 Å²	116.1	62%	0.62	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-55.1	141.6	-169.8	0	0	0	0	0	114.3	F145 S146	A143-F145 PolarHBondContact O-N 3.25Å; A143-S146 PolarHBondContact O-N 3.05Å
144	L	61.4	Low	55.5	Low	147 Å²	147	113.9 Å²	113.9	77%	0.77	64%	0.635	S	S	*	*	H	α-helix	trans	-41.7	-26.8	177	-85.5	158.3	0	0	0	115.1	T147 L148	L144-T147 PolarHBondContact O-N 3.14Å; L144-L148 PolarHBondContact O-N 3.31Å
145	F	58.3	Low	58.1	Low	164 Å²	164	112.8 Å²	112.8	72%	0.719	62%	0.623	S	S	*	*	H	α-helix	trans	-66.4	-37.5	179.6	-158.8	-98.7	0	0	0	113.3	A143 L149	A143-F145 PolarHBondContact O-N 3.25Å; F145-L149 PolarHBondContact O-N 3.41Å; F145-L149 VanDerWaalsContact O-N 3.1Å
146	S	58	Low	60.4	Low	48 Å²	48	113.6 Å²	113.6	34%	0.336	62%	0.618	S	S	.	*	H	α-helix	trans	-67	-41.9	175.6	-84.1	0	0	0	0	111.3	A143 L148 L149 Y150	A143-S146 PolarHBondContact O-N 3.05Å; S146-L148 VanDerWaalsContact C-N 3.33Å; S146-L148 PolarHBondContact O-N 3.11Å; S146-L149 PolarHBondContact O-N 2.78Å; S146-Y150 WeakPolarHBondContact O-CB 3.48Å; S146-Y150 WeakPolarHBondContact O-CD2 3.5Å; S146-Y150 PolarHBondContact O-N 2.88Å
147	T	64.8	Low	63.2	Low	91 Å²	91	108.4 Å²	108.4	56%	0.558	60%	0.6	S	S	*	*	H	α-helix	trans	-64.9	-36.7	-180	-47	0	0	0	0	112	L144 S151	L144-T147 PolarHBondContact O-N 3.14Å; T147-S151 WeakPolarHBondContact O-CB 3.28Å; T147-S151 PolarHBondContact O-N 2.89Å; T147-S151 VanDerWaalsContact O-N 3.12Å; T147-S151 PolarHBondContact O-OG 2.83Å
148	L	67.3	Low	65.3	Low	97 Å²	97	109.4 Å²	109.4	51%	0.508	60%	0.599	S	S	.	*	H	α-helix	trans	-67.9	-41.3	174.3	-78.2	166.9	0	0	0	112	L144 S146 S151 L152	L144-L148 PolarHBondContact O-N 3.31Å; S146-L148 VanDerWaalsContact C-N 3.33Å; S146-L148 PolarHBondContact O-N 3.11Å; L148-S151 PolarHBondContact O-OG 2.91Å; L148-L152 HydrophobicContact CB-CD1 4.49Å; L148-L152 HydrophobicContact CD2-CD1 4.14Å; L148-L152 VanDerWaalsContact O-CB 3.31Å; L148-L152 WeakPolarHBondContact O-CB 3.33Å; L148-L152 PolarHBondContact O-N 3.33Å
149	L	67.3	Low	68	Low	93 Å²	93	102.3 Å²	102.3	49%	0.487	58%	0.577	S	S	.	*	H	α-helix	trans	-65.8	-45.4	177.1	-170.3	68.9	0	0	0	112	F145 S146 S151 V153	F145-L149 PolarHBondContact O-N 3.41Å; F145-L149 VanDerWaalsContact O-N 3.1Å; S146-L149 PolarHBondContact O-N 2.78Å; L149-S151 VanDerWaalsContact C-N 3.32Å; L149-S151 PolarHBondContact O-N 3.35Å; L149-V153 HydrophobicContact CD1-CG2 3.92Å; L149-V153 HydrophobicContact CG-CG2 4.37Å; L149-V153 WeakPolarHBondContact O-CB 3.24Å; L149-V153 WeakPolarHBondContact O-CG2 2.9Å; L149-V153 PolarHBondContact O-N 2.99Å
150	Y	68.8	Low	70.8	Confident	175 Å²	175	99.2 Å²	99.2	69%	0.686	56%	0.561	S	S	*	*	H	α-helix	trans	-75.1	-15.9	-178.3	-69.8	-61	0	0	0	114.3	S146 P154	S146-Y150 WeakPolarHBondContact O-CB 3.48Å; S146-Y150 WeakPolarHBondContact O-CD2 3.5Å; S146-Y150 PolarHBondContact O-N 2.88Å; Y150-P154 WeakPolarHBondContact O-CD 3.15Å; Y150-P154 WeakPolarHBondContact O-CG 3.47Å
151	S	75.9	Confident	73.2	Confident	50 Å²	50	97.7 Å²	97.7	35%	0.35	55%	0.55	S	S	.	.	H	α-helix	trans	-95.5	-43.4	174.8	54.5	0	0	0	0	112.3	T147 L148 L149 P154 I155	T147-S151 WeakPolarHBondContact O-CB 3.28Å; T147-S151 PolarHBondContact O-N 2.89Å; T147-S151 VanDerWaalsContact O-N 3.12Å; T147-S151 PolarHBondContact O-OG 2.83Å; L148-S151 PolarHBondContact O-OG 2.91Å; L149-S151 VanDerWaalsContact C-N 3.32Å; L149-S151 PolarHBondContact O-N 3.35Å; S151-P154 WeakPolarHBondContact O-CD 3.47Å; S151-P154 WeakPolarHBondContact O-CG 3.4Å; S151-I155 VanDerWaalsContact O-CD1 3.22Å; S151-I155 WeakPolarHBondContact O-CD1 3.43Å; S151-I155 WeakPolarHBondContact O-CG1 3.49Å; S151-I155 PolarHBondContact O-N 2.97Å
152	L	79.1	Confident	75.7	Confident	90 Å²	90	92.2 Å²	92.2	47%	0.471	53%	0.533	S	S	.	.	H	α-helix	trans	-74	-36.4	-175.9	-75	161.8	0	0	0	113.1	L148 I155 I156	L148-L152 HydrophobicContact CB-CD1 4.49Å; L148-L152 HydrophobicContact CD2-CD1 4.14Å; L148-L152 VanDerWaalsContact O-CB 3.31Å; L148-L152 WeakPolarHBondContact O-CB 3.33Å; L148-L152 PolarHBondContact O-N 3.33Å; L152-I155 PolarHBondContact O-N 2.88Å; L152-I156 WeakPolarHBondContact O-CB 3.46Å; L152-I156 VanDerWaalsContact O-CG1 3.24Å; L152-I156 WeakPolarHBondContact O-CG1 3.1Å; L152-I156 PolarHBondContact O-N 3.3Å
153	V	81.9	Confident	78	Confident	87 Å²	87	93 Å²	93	53%	0.527	53%	0.531	S	S	.	.	H	α-helix	trans	-63	-49	-179.6	174.7	0	0	0	0	112.6	L149 I155 I156 G157	L149-V153 HydrophobicContact CD1-CG2 3.92Å; L149-V153 HydrophobicContact CG-CG2 4.37Å; L149-V153 WeakPolarHBondContact O-CB 3.24Å; L149-V153 WeakPolarHBondContact O-CG2 2.9Å; L149-V153 PolarHBondContact O-N 2.99Å; V153-I155 VanDerWaalsContact C-N 3.34Å; V153-I155 PolarHBondContact O-N 2.64Å; V153-I156 PolarHBondContact O-N 3.34Å; V153-G157 PolarHBondContact O-N 3.34Å
154	P	79.3	Confident	79.4	Confident	66 Å²	66	95 Å²	95	43%	0.429	53%	0.526	S	S	.	.	H	α-helix	trans	-68.8	-30.9	176.6	23.1	-30.6	0	0	0	112.8	Y150 S151 G157 L158	Y150-P154 WeakPolarHBondContact O-CD 3.15Å; Y150-P154 WeakPolarHBondContact O-CG 3.47Å; S151-P154 WeakPolarHBondContact O-CD 3.47Å; S151-P154 WeakPolarHBondContact O-CG 3.4Å; P154-G157 PolarHBondContact O-N 3.1Å; P154-L158 WeakPolarHBondContact O-CB 3.4Å; P154-L158 PolarHBondContact O-N 3.27Å
155	I	86.5	Confident	80.4	Confident	107 Å²	107	91 Å²	91	55%	0.549	51%	0.51	S	S	.	.	H	α-helix	trans	-65.3	-44.1	174.4	-68	168.5	0	0	0	110.8	S151 L152 V153 G157 L158 A159	S151-I155 VanDerWaalsContact O-CD1 3.22Å; S151-I155 WeakPolarHBondContact O-CD1 3.43Å; S151-I155 WeakPolarHBondContact O-CG1 3.49Å; S151-I155 PolarHBondContact O-N 2.97Å; L152-I155 PolarHBondContact O-N 2.88Å; V153-I155 VanDerWaalsContact C-N 3.34Å; V153-I155 PolarHBondContact O-N 2.64Å; I155-G157 VanDerWaalsContact C-N 3.32Å; I155-L158 PolarHBondContact O-N 2.82Å; I155-A159 WeakPolarHBondContact O-CB 3.25Å; I155-A159 PolarHBondContact O-N 2.68Å
156	I	88.7	Confident	81.7	Confident	116 Å²	116	88.3 Å²	88.3	60%	0.595	50%	0.499	S	S	*	.	H	α-helix	trans	-65.6	-38.1	174.9	-67.3	166.2	0	0	0	110.5	L152 V153 A159 G160	L152-I156 WeakPolarHBondContact O-CB 3.46Å; L152-I156 VanDerWaalsContact O-CG1 3.24Å; L152-I156 WeakPolarHBondContact O-CG1 3.1Å; L152-I156 PolarHBondContact O-N 3.3Å; V153-I156 PolarHBondContact O-N 3.34Å; I156-A159 PolarHBondContact O-N 2.7Å; I156-G160 PolarHBondContact O-N 3.41Å
157	G	89.4	Confident	83	Confident	39 Å²	39	92.4 Å²	92.4	40%	0.402	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-47.5	174.1	0	0	0	0	0	112.6	V153 P154 I155 G160 V161	V153-G157 PolarHBondContact O-N 3.34Å; P154-G157 PolarHBondContact O-N 3.1Å; I155-G157 VanDerWaalsContact C-N 3.32Å; G157-G160 PolarHBondContact O-N 3.41Å; G157-V161 WeakPolarHBondContact O-CG2 3.21Å; G157-V161 PolarHBondContact O-N 3.47Å
158	L	89.9	Confident	83.6	Confident	120 Å²	120	91.7 Å²	91.7	63%	0.628	50%	0.498	S	S	*	.	H	α-helix	trans	-63	-43.8	175.9	-105.4	132.2	0	0	0	111.6	P154 I155 G160 V161 V162	P154-L158 WeakPolarHBondContact O-CB 3.4Å; P154-L158 PolarHBondContact O-N 3.27Å; I155-L158 PolarHBondContact O-N 2.82Å; L158-G160 VanDerWaalsContact C-N 3.29Å; L158-G160 PolarHBondContact O-N 2.86Å; L158-V161 PolarHBondContact O-N 3.06Å; L158-V162 VanDerWaalsContact O-CG2 3.32Å; L158-V162 WeakPolarHBondContact O-CG2 3.31Å; L158-V162 PolarHBondContact O-N 3.42Å
159	A	91.9	Very high	83.8	Confident	50 Å²	50	93.8 Å²	93.8	41%	0.413	50%	0.499	S	S	.	.	H	α-helix	trans	-60.5	-41.1	174	0	0	0	0	0	111.2	I155 I156 V162 L163	I155-A159 WeakPolarHBondContact O-CB 3.25Å; I155-A159 PolarHBondContact O-N 2.68Å; I156-A159 PolarHBondContact O-N 2.7Å; A159-V162 PolarHBondContact O-N 3.35Å; A159-L163 VanDerWaalsContact O-CB 3.3Å; A159-L163 WeakPolarHBondContact O-CB 3.19Å; A159-L163 WeakPolarHBondContact O-CG 3.09Å; A159-L163 PolarHBondContact O-N 3.11Å
160	G	93.4	Very high	84.2	Confident	36 Å²	36	96.3 Å²	96.3	37%	0.371	50%	0.502	S	S	.	.	H	α-helix	trans	-61.6	-43.7	173.9	0	0	0	0	0	112.8	I156 G157 L158 L163 F164	I156-G160 PolarHBondContact O-N 3.41Å; G157-G160 PolarHBondContact O-N 3.41Å; L158-G160 VanDerWaalsContact C-N 3.29Å; L158-G160 PolarHBondContact O-N 2.86Å; G160-L163 PolarHBondContact O-N 2.9Å; G160-F164 WeakPolarHBondContact O-CB 3.11Å; G160-F164 PolarHBondContact O-N 3.09Å
161	V	91.7	Very high	84.2	Confident	92 Å²	92	92.7 Å²	92.7	56%	0.558	49%	0.492	S	S	*	.	H	α-helix	trans	-66.1	-42	176.4	171.6	0	0	0	0	111.2	G157 L158 F164 S165	G157-V161 WeakPolarHBondContact O-CG2 3.21Å; G157-V161 PolarHBondContact O-N 3.47Å; L158-V161 PolarHBondContact O-N 3.06Å; V161-F164 PolarHBondContact O-N 3.03Å; V161-S165 WeakPolarHBondContact O-CB 3.45Å; V161-S165 PolarHBondContact O-N 3.39Å; V161-S165 PolarHBondContact O-OG 2.74Å
162	V	92.5	Very high	83.4	Confident	91 Å²	91	96.3 Å²	96.3	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-64.9	-45.1	176.8	171	0	0	0	0	110.4	L158 A159 S165 F166	L158-V162 VanDerWaalsContact O-CG2 3.32Å; L158-V162 WeakPolarHBondContact O-CG2 3.31Å; L158-V162 PolarHBondContact O-N 3.42Å; A159-V162 PolarHBondContact O-N 3.35Å; V162-S165 PolarHBondContact O-N 2.91Å; V162-F166 VanDerWaalsContact O-CB 3.27Å; V162-F166 WeakPolarHBondContact O-CB 3.44Å; V162-F166 PolarHBondContact O-N 2.94Å
163	L	91.4	Very high	82.1	Confident	118 Å²	118	98.6 Å²	98.6	62%	0.618	51%	0.509	S	S	*	.	H	α-helix	trans	-66	-39	177.1	-71.6	172.5	0	0	0	111.9	A159 G160 F166 W167	A159-L163 VanDerWaalsContact O-CB 3.3Å; A159-L163 WeakPolarHBondContact O-CB 3.19Å; A159-L163 WeakPolarHBondContact O-CG 3.09Å; A159-L163 PolarHBondContact O-N 3.11Å; G160-L163 PolarHBondContact O-N 2.9Å; L163-F166 PolarHBondContact O-N 2.94Å; L163-W167 WeakPolarHBondContact O-CB 3.22Å; L163-W167 PolarHBondContact O-N 3.37Å
164	F	89.6	Confident	80.5	Confident	117 Å²	117	100.1 Å²	100.1	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-68.6	-39.4	174.8	-176.6	-101.1	0	0	0	111.7	G160 V161 W167 M168	G160-F164 WeakPolarHBondContact O-CB 3.11Å; G160-F164 PolarHBondContact O-N 3.09Å; V161-F164 PolarHBondContact O-N 3.03Å; F164-W167 HydrophobicContact CD2-CE3 4.13Å; F164-W167 AromaticContact CE2-CE3 3.94Å; F164-W167 HydrophobicContact CE2-CE3 3.94Å; F164-W167 HydrophobicContact CE2-CZ3 4.01Å; F164-W167 PolarHBondContact O-N 3.5Å; F164-M168 HydrophobicContact CD1-CG 3.94Å; F164-M168 HydrophobicContact CE1-CG 3.53Å; F164-M168 HydrophobicContact CE1-SD 4.16Å; F164-M168 HydrophobicContact CE2-CG 4.28Å; F164-M168 HydrophobicContact CG-CG 4.48Å; F164-M168 HydrophobicContact CZ-CG 3.72Å; F164-M168 HydrophobicContact CZ-SD 4.02Å; F164-M168 VanDerWaalsContact O-CB 3.23Å; F164-M168 WeakPolarHBondContact O-CB 3.31Å; F164-M168 VanDerWaalsContact O-CG 3.27Å; F164-M168 WeakPolarHBondContact O-CG 3.37Å; F164-M168 PolarHBondContact O-N 3.4Å
165	S	81.9	Confident	78.7	Confident	64 Å²	64	100.4 Å²	100.4	45%	0.448	52%	0.521	S	S	.	.	H	α-helix	trans	-66.8	-39.5	175.3	-57.8	0	0	0	0	110.9	V161 V162 W169	V161-S165 WeakPolarHBondContact O-CB 3.45Å; V161-S165 PolarHBondContact O-N 3.39Å; V161-S165 PolarHBondContact O-OG 2.74Å; V162-S165 PolarHBondContact O-N 2.91Å; S165-W169 WeakPolarHBondContact O-CB 3.43Å; S165-W169 PolarHBondContact O-N 3.1Å
166	F	86.1	Confident	76.4	Confident	108 Å²	108	104.7 Å²	104.7	47%	0.474	53%	0.532	S	S	.	.	H	α-helix	trans	-67.1	-40.3	172.7	-178.2	-100.1	0	0	0	111.7	V162 L163 W169 R170	V162-F166 VanDerWaalsContact O-CB 3.27Å; V162-F166 WeakPolarHBondContact O-CB 3.44Å; V162-F166 PolarHBondContact O-N 2.94Å; L163-F166 PolarHBondContact O-N 2.94Å; F166-W169 HydrophobicContact CD2-CE3 4.17Å; F166-W169 HydrophobicContact CD2-CZ3 4.5Å; F166-W169 HydrophobicContact CE2-CE3 4.09Å; F166-W169 HydrophobicContact CE2-CZ3 4.01Å; F166-W169 PolarHBondContact O-N 2.81Å; F166-R170 WeakPolarHBondContact O-CB 3.43Å; F166-R170 PolarHBondContact O-N 3.4Å
167	W	85.8	Confident	73.9	Confident	133 Å²	133	104.8 Å²	104.8	50%	0.504	54%	0.54	S	S	.	.	H	α-helix	trans	-65.8	-44.7	175.5	-178.6	83.2	0	0	0	111.4	L163 F164 R170 H171	L163-W167 WeakPolarHBondContact O-CB 3.22Å; L163-W167 PolarHBondContact O-N 3.37Å; F164-W167 HydrophobicContact CD2-CE3 4.13Å; F164-W167 AromaticContact CE2-CE3 3.94Å; F164-W167 HydrophobicContact CE2-CE3 3.94Å; F164-W167 HydrophobicContact CE2-CZ3 4.01Å; F164-W167 PolarHBondContact O-N 3.5Å; W167-R170 PolarHBondContact O-N 2.85Å; W167-H171 AromaticContact CD1-CD2 3.79Å; W167-H171 AromaticContact CD2-CD2 3.75Å; W167-H171 AromaticContact CE2-CD2 3.19Å; W167-H171 AromaticContact CE2-NE2 3.43Å; W167-H171 AromaticContact CZ2-CD2 3.46Å; W167-H171 VanDerWaalsContact CZ2-CD2 3.46Å; W167-H171 WeakPolarHBondContact CZ2-CD2 3.27Å; W167-H171 AromaticContact CZ2-NE2 3.46Å; W167-H171 WeakPolarHBondContact CZ2-NE2 3.19Å; W167-H171 AromaticContact NE1-CD2 3.21Å; W167-H171 PolarHBondContact NE1-CD2 3.04Å; W167-H171 AromaticContact NE1-NE2 3.26Å; W167-H171 PolarHBondContact NE1-NE2 3.33Å; W167-H171 WeakPolarHBondContact O-CB 3.5Å; W167-H171 PolarHBondContact O-N 2.67Å
168	M	77	Confident	71.6	Confident	76 Å²	76	107.4 Å²	107.4	37%	0.374	56%	0.558	S	S	.	*	H	α-helix	trans	-60.1	-47.4	171.6	-81.7	-85.2	-69.2	0	0	111.1	F164 R170 H171 H172	F164-M168 HydrophobicContact CD1-CG 3.94Å; F164-M168 HydrophobicContact CE1-CG 3.53Å; F164-M168 HydrophobicContact CE1-SD 4.16Å; F164-M168 HydrophobicContact CE2-CG 4.28Å; F164-M168 HydrophobicContact CG-CG 4.48Å; F164-M168 HydrophobicContact CZ-CG 3.72Å; F164-M168 HydrophobicContact CZ-SD 4.02Å; F164-M168 VanDerWaalsContact O-CB 3.23Å; F164-M168 WeakPolarHBondContact O-CB 3.31Å; F164-M168 VanDerWaalsContact O-CG 3.27Å; F164-M168 WeakPolarHBondContact O-CG 3.37Å; F164-M168 PolarHBondContact O-N 3.4Å; M168-R170 VanDerWaalsContact C-N 3.32Å; M168-R170 PolarHBondContact O-N 3.02Å; M168-H171 PolarHBondContact O-N 2.94Å; M168-H172 VanDerWaalsContact O-CB 3.28Å; M168-H172 WeakPolarHBondContact O-CB 2.96Å; M168-H172 PolarHBondContact O-CD2 2.63Å; M168-H172 VanDerWaalsContact O-CD2 3.3Å; M168-H172 PolarHBondContact O-N 3.42Å
169	W	72.2	Confident	69.2	Low	141 Å²	141	106.1 Å²	106.1	53%	0.534	57%	0.565	S	S	.	*	H	α-helix	trans	-61	-42	176.3	179.6	78.6	0	0	0	111.5	S165 F166 K173	S165-W169 WeakPolarHBondContact O-CB 3.43Å; S165-W169 PolarHBondContact O-N 3.1Å; F166-W169 HydrophobicContact CD2-CE3 4.17Å; F166-W169 HydrophobicContact CD2-CZ3 4.5Å; F166-W169 HydrophobicContact CE2-CE3 4.09Å; F166-W169 HydrophobicContact CE2-CZ3 4.01Å; F166-W169 PolarHBondContact O-N 2.81Å; W169-K173 HydrophobicContact CH2-CD 4.1Å; W169-K173 HydrophobicContact CZ2-CD 3.85Å; W169-K173 WeakPolarHBondContact O-CB 3.42Å; W169-K173 PolarHBondContact O-N 3.06Å
170	R	76	Confident	66.5	Low	146 Å²	146	111.7 Å²	111.7	55%	0.551	59%	0.587	S	S	*	*	H	α-helix	trans	-68.7	-41.2	176.7	-169.4	176.2	176.6	165.1	0	111.8	F166 W167 M168 K173 L174	F166-R170 WeakPolarHBondContact O-CB 3.43Å; F166-R170 PolarHBondContact O-N 3.4Å; W167-R170 PolarHBondContact O-N 2.85Å; M168-R170 VanDerWaalsContact C-N 3.32Å; M168-R170 PolarHBondContact O-N 3.02Å; R170-K173 PolarHBondContact O-N 3.21Å; R170-L174 HydrophobicContact CG-CD1 3.76Å; R170-L174 WeakPolarHBondContact O-CB 3.42Å; R170-L174 VanDerWaalsContact O-CD1 3.29Å; R170-L174 WeakPolarHBondContact O-CD1 3.32Å; R170-L174 PolarHBondContact O-N 3.44Å
171	H	67.2	Low	64	Low	100 Å²	100	116 Å²	116	46%	0.463	61%	0.605	S	S	.	*	H	α-helix	trans	-70.8	-34.8	175.7	-96.2	-86.8	0	0	0	112.6	W167 M168 L174 A175	W167-H171 AromaticContact CD1-CD2 3.79Å; W167-H171 AromaticContact CD2-CD2 3.75Å; W167-H171 AromaticContact CE2-CD2 3.19Å; W167-H171 AromaticContact CE2-NE2 3.43Å; W167-H171 AromaticContact CZ2-CD2 3.46Å; W167-H171 VanDerWaalsContact CZ2-CD2 3.46Å; W167-H171 WeakPolarHBondContact CZ2-CD2 3.27Å; W167-H171 AromaticContact CZ2-NE2 3.46Å; W167-H171 WeakPolarHBondContact CZ2-NE2 3.19Å; W167-H171 AromaticContact NE1-CD2 3.21Å; W167-H171 PolarHBondContact NE1-CD2 3.04Å; W167-H171 AromaticContact NE1-NE2 3.26Å; W167-H171 PolarHBondContact NE1-NE2 3.33Å; W167-H171 WeakPolarHBondContact O-CB 3.5Å; W167-H171 PolarHBondContact O-N 2.67Å; M168-H171 PolarHBondContact O-N 2.94Å; H171-L174 CarbonylContact O-C 3.48Å; H171-L174 PolarHBondContact O-N 2.89Å; H171-A175 WeakPolarHBondContact O-CB 3.3Å; H171-A175 PolarHBondContact O-N 3.49Å
172	H	60.1	Low	61.1	Low	126 Å²	126	117 Å²	117	58%	0.583	61%	0.614	S	S	*	*	H	α-helix	trans	-70.1	-32.9	171.1	-88.8	-81.9	0	0	0	112	M168	M168-H172 VanDerWaalsContact O-CB 3.28Å; M168-H172 WeakPolarHBondContact O-CB 2.96Å; M168-H172 PolarHBondContact O-CD2 2.63Å; M168-H172 VanDerWaalsContact O-CD2 3.3Å; M168-H172 PolarHBondContact O-N 3.42Å
173	K	51.2	Low	58.9	Low	137 Å²	137	118.6 Å²	118.6	60%	0.596	62%	0.624	S	S	*	*	H	α-helix	trans	-72	-27.6	169.5	-102	-171	170.6	-176.6	0	113.5	W169 R170	W169-K173 HydrophobicContact CH2-CD 4.1Å; W169-K173 HydrophobicContact CZ2-CD 3.85Å; W169-K173 WeakPolarHBondContact O-CB 3.42Å; W169-K173 PolarHBondContact O-N 3.06Å; R170-K173 PolarHBondContact O-N 3.21Å
174	L	47.7	Very low	56.1	Low	119 Å²	119	121.9 Å²	121.9	62%	0.623	64%	0.636	S	S	*	*	H	α-helix	trans	-92	-6.4	175.6	-92.6	118.2	0	0	0	114.1	R170 H171 Y176	R170-L174 HydrophobicContact CG-CD1 3.76Å; R170-L174 WeakPolarHBondContact O-CB 3.42Å; R170-L174 VanDerWaalsContact O-CD1 3.29Å; R170-L174 WeakPolarHBondContact O-CD1 3.32Å; R170-L174 PolarHBondContact O-N 3.44Å; H171-L174 CarbonylContact O-C 3.48Å; H171-L174 PolarHBondContact O-N 2.89Å; L174-Y176 PolarHBondContact O-N 2.9Å
175	A	43	Very low	53.3	Low	72 Å²	72	123 Å²	123	60%	0.595	65%	0.647	S	S	*	*	S	Bend	trans	-76.9	1.8	172.3	0	0	0	0	0	113.4	H171 P177	H171-A175 WeakPolarHBondContact O-CB 3.3Å; H171-A175 PolarHBondContact O-N 3.49Å; A175-P177 WeakPolarHBondContact O-CD 3.17Å
176	Y	38.3	Very low	51.3	Low	198 Å²	198	126 Å²	126	78%	0.776	67%	0.665	S	S	*	*	S	Bend	trans	-99.8	104.9	155.7	-68.5	-80.6	0	0	0	108.1	L174 A178	L174-Y176 PolarHBondContact O-N 2.9Å; Y176-A178 PolarHBondContact O-N 2.83Å
177	P	36.4	Very low	48.9	Very low	118 Å²	118	123.9 Å²	123.9	77%	0.766	67%	0.673	S	S	*	*			trans	-62.9	131	168.8	-13.5	27.7	0	0	0	108.8	A175	A175-P177 WeakPolarHBondContact O-CD 3.17Å
178	A	40.1	Very low	46.8	Very low	94 Å²	94	123.9 Å²	123.9	78%	0.777	69%	0.69	S	S	*	*			trans	-54.9	138.7	155.8	0	0	0	0	0	108.7	Y176 L180	Y176-A178 PolarHBondContact O-N 2.83Å; A178-L180 PolarHBondContact O-N 2.81Å
179	A	39	Very low	45.1	Very low	93 Å²	93	125.2 Å²	125.2	77%	0.769	71%	0.708	S	S	*	*			trans	-35.3	125.8	-175.8	0	0	0	0	0	115
180	L	35.7	Very low	43.6	Very low	167 Å²	167	123.9 Å²	123.9	87%	0.874	72%	0.717	S	S	*	*			trans	-101.9	117.3	145	-78.1	171.6	0	0	0	106.8	A178 P182	A178-L180 PolarHBondContact O-N 2.81Å; L180-P182 VanDerWaalsContact O-CD 3.3Å; L180-P182 WeakPolarHBondContact O-CD 3.45Å
181	V	40.4	Very low	41.9	Very low	125 Å²	125	122.7 Å²	122.7	76%	0.758	73%	0.728	S	S	*	*			trans	-70.1	129.7	167.2	174	0	0	0	0	108.3
182	P	30.9	Very low	41.2	Very low	115 Å²	115	122 Å²	122	75%	0.747	73%	0.734	S	S	*	*			trans	-112.7	122.3	148.9	1.9	20.6	0	0	0	108.8	L180 H184	L180-P182 VanDerWaalsContact O-CD 3.3Å; L180-P182 WeakPolarHBondContact O-CD 3.45Å; P182-H184 PolarHBondContact O-N 2.91Å
183	T	46.9	Very low	40.3	Very low	124 Å²	124	120.4 Å²	120.4	76%	0.761	74%	0.735	S	S	*	*			trans	-55.6	111.8	163.7	42.3	0	0	0	0	110.2
184	H	31.8	Very low	40	Very low	187 Å²	187	119.3 Å²	119.3	87%	0.866	74%	0.735	S	S	*	*			trans	-162.6	141.5	147.8	-119.2	-77.5	0	0	0	111.1	P182	P182-H184 PolarHBondContact O-N 2.91Å
185	D	31.6	Very low	39.9	Very low	139 Å²	139	118 Å²	118	74%	0.743	73%	0.728	S	S	*	*			trans	-44.2	159.3	-173	-74.5	-52.6	0	0	0	118.6	G187	D185-G187 PolarHBondContact O-N 2.76Å
186	P	40.6	Very low	40.2	Very low	128 Å²	128	116.6 Å²	116.6	83%	0.831	72%	0.72	S	S	*	*			trans	-75.5	108.5	-164.7	30.2	-32.7	0	0	0	112.1
187	G	35.4	Very low	40.9	Very low	63 Å²	63	115.7 Å²	115.7	65%	0.649	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-79.4	147	161	0	0	0	0	0	111	D185 S189	D185-G187 PolarHBondContact O-N 2.76Å; G187-S189 PolarHBondContact O-N 3.35Å
188	P	41.8	Very low	42.2	Very low	133 Å²	133	115.6 Å²	115.6	86%	0.864	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-67.7	129.5	-172.1	11.4	-3.9	0	0	0	111
189	S	40.4	Very low	43.8	Very low	105 Å²	105	115.3 Å²	115.3	73%	0.734	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-58.7	144.5	172	49.1	0	0	0	0	111.4	G187	G187-S189 PolarHBondContact O-N 3.35Å
190	P	41.2	Very low	46.1	Very low	113 Å²	113	112.2 Å²	112.2	73%	0.734	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-61.5	152.6	-179.3	25.6	-32.4	0	0	0	111.6	S192	P190-S192 PolarHBondContact O-N 2.03Å
191	P	41.2	Very low	48.7	Very low	120 Å²	120	110.3 Å²	110.3	78%	0.779	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-69.7	128.4	-167.8	27.2	-32.1	0	0	0	111	P193	P191-P193 WeakPolarHBondContact O-CD 3.27Å
192	S	51.9	Low	51.2	Low	85 Å²	85	107 Å²	107	59%	0.594	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-80.6	128.3	161.7	-59.8	0	0	0	0	109.8	P190	P190-S192 PolarHBondContact O-N 2.03Å
193	P	41	Very low	54.3	Low	93 Å²	93	105.3 Å²	105.3	60%	0.604	62%	0.62	S	S	*	*			trans	-142.4	149.5	152.5	31	-12.2	0	0	0	113.8	P191	P191-P193 WeakPolarHBondContact O-CD 3.27Å
194	I	45.7	Very low	56.5	Low	114 Å²	114	103.7 Å²	103.7	59%	0.585	60%	0.604	S	S	*	*			cis	-163.4	122.7	0.9	-96.1	157.7	0	0	0	106.3
195	L	44.5	Very low	59.5	Low	92 Å²	92	97.7 Å²	97.7	48%	0.482	58%	0.577	S	S	.	*	S	Bend		-104.8	68.5	120.3	-166.1	79.7	0	0	0	105.9
196	G	49.2	Very low	62.4	Low	42 Å²	42	95.1 Å²	95.1	43%	0.433	56%	0.56	S	S	.	*	S	Bend	trans	64.9	76.3	174.1	0	0	0	0	0	116.5	K198	G196-K198 WeakPolarHBondContact O-CG 3.06Å; G196-K198 PolarHBondContact O-N 3.18Å
197	Q	52.8	Low	64.7	Low	179 Å²	179	90.7 Å²	90.7	84%	0.836	53%	0.534	S	S	*	.	S	Bend	trans	52.5	19.4	161.8	-65	-175.4	-21.2	0	0	118.3
198	K	63.2	Low	67.1	Low	116 Å²	116	97 Å²	97	50%	0.504	54%	0.538	S	S	.	.			trans	-107.2	128.2	177.8	-66.4	175.3	179.1	-166.2	0	110.1	G196 L200 L219 L220	G196-K198 WeakPolarHBondContact O-CG 3.06Å; G196-K198 PolarHBondContact O-N 3.18Å; K198-L200 PolarHBondContact O-N 2.91Å; K198-L219 HydrophobicContact CB-CD1 3.85Å; K198-L220 HydrophobicContact CB-CD2 4.05Å; K198-L220 HydrophobicContact CB-CG 4.01Å; K198-L220 HydrophobicContact CD-CD1 3.42Å; K198-L220 VanDerWaalsContact CD-CD1 3.42Å; K198-L220 HydrophobicContact CD-CD2 4.36Å; K198-L220 HydrophobicContact CD-CG 3.79Å; K198-L220 VanDerWaalsContact CE-CD1 3.48Å; K198-L220 HydrophobicContact CG-CD1 3.86Å; K198-L220 HydrophobicContact CG-CD2 3.87Å; K198-L220 HydrophobicContact CG-CG 3.82Å
199	P	75.7	Confident	68.7	Low	89 Å²	89	92.4 Å²	92.4	58%	0.578	51%	0.514	S	S	*	.			trans	-65.3	118.3	174.3	26.7	-32.5	0	0	0	109.2	L220	P199-L220 PolarHBondContact O-N 2.74Å
200	L	86.9	Confident	70.5	Confident	28 Å²	28	94 Å²	94	15%	0.147	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.1	168	-173.3	164.8	0	0	0	107.9	K198 L202 A217 Q218 L219 V226 W272 I274	K198-L200 PolarHBondContact O-N 2.91Å; L200-L202 HydrophobicContact CD2-CD2 4.05Å; L200-A217 HydrophobicContact CD2-CB 4.01Å; L200-Q218 WeakPolarHBondContact CA-O 3.3Å; L200-L219 HydrophobicContact CB-CD1 4.04Å; L200-L219 HydrophobicContact CD1-CD1 4.5Å; L200-L219 HydrophobicContact CG-CD1 4.47Å; L200-V226 HydrophobicContact CD1-CG2 4.1Å; L200-V226 HydrophobicContact CD2-CG2 4.25Å; L200-W272 HydrophobicContact CD1-CE3 4.23Å; L200-W272 HydrophobicContact CD1-CZ3 3.97Å; L200-W272 HydrophobicContact CD2-CE3 4.4Å; L200-W272 HydrophobicContact CD2-CH2 4.1Å; L200-W272 HydrophobicContact CD2-CZ3 3.45Å; L200-W272 VanDerWaalsContact CD2-CZ3 3.45Å; L200-W272 HydrophobicContact CG-CZ3 4.27Å; L200-I274 HydrophobicContact CD1-CD1 3.74Å; L200-I274 HydrophobicContact CD1-CG1 4.48Å
201	Q	90.6	Very high	72.5	Confident	126 Å²	126	89.3 Å²	89.3	59%	0.589	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.5	179	-176.2	175.7	3.3	0	0	110.5	A217 Q218	Q201-A217 CarbonylContact O-C 3.57Å; Q201-A217 WeakPolarHBondContact O-CA 3.27Å; Q201-A217 VanDerWaalsContact O-CB 3.31Å; Q201-A217 WeakPolarHBondContact O-CB 3.48Å; Q201-Q218 PolarHBondContact N-O 2.91Å; Q201-Q218 PolarHBondContact O-N 2.52Å
202	L	92.7	Very high	74.7	Confident	57 Å²	57	84.3 Å²	84.3	30%	0.298	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	134.9	170.1	-57.2	-179.9	0	0	0	109.3	L200 W215 A217 V226 I228 W272	L200-L202 HydrophobicContact CD2-CD2 4.05Å; L202-W215 HydrophobicContact CB-CD2 4.41Å; L202-W215 HydrophobicContact CB-CE3 3.98Å; L202-W215 HydrophobicContact CD1-CD2 4.31Å; L202-W215 HydrophobicContact CD1-CG 4.49Å; L202-W215 HydrophobicContact CD2-CB 3.9Å; L202-W215 HydrophobicContact CD2-CG 4.22Å; L202-A217 HydrophobicContact CD2-CB 4Å; L202-V226 HydrophobicContact CD2-CB 4.06Å; L202-V226 HydrophobicContact CD2-CG1 4.22Å; L202-V226 HydrophobicContact CD2-CG2 4.24Å; L202-I228 HydrophobicContact CD1-CD1 3.81Å; L202-I228 HydrophobicContact CD2-CD1 4.43Å; L202-W272 HydrophobicContact CD1-CH2 4.07Å; L202-W272 HydrophobicContact CD1-CZ2 4.09Å; L202-W272 HydrophobicContact CD2-CH2 4.02Å; L202-W272 HydrophobicContact CD2-CZ3 4.35Å; L202-W272 HydrophobicContact CG-CH2 4.05Å
203	I	94.4	Very high	76.6	Confident	78 Å²	78	81.8 Å²	81.8	40%	0.4	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-59.4	-177.2	-60.5	172.4	0	0	0	110.3	K216 Q218 Y223	I203-K216 WeakPolarHBondContact CA-O 3.03Å; I203-K216 WeakPolarHBondContact CB-O 3.39Å; I203-K216 PolarHBondContact N-O 3.01Å; I203-Q218 HydrophobicContact CD1-CB 3.76Å; I203-Y223 HydrophobicContact CD1-CD1 3.97Å; I203-Y223 HydrophobicContact CD1-CE1 3.54Å
204	E	94.5	Very high	79.2	Confident	91 Å²	91	79.2 Å²	79.2	43%	0.425	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	134	-169.1	-170.9	-167	146.5	0	0	110.8	K206 W215 K216	E204-K206 PolarHBondContact O-N 3.19Å; E204-K206 WeakPolarHBondContact OE1-CE 3.4Å; E204-K206 IonicContact OE1-NZ 2.86Å; E204-K206 PolarHBondContact OE1-NZ 3.41Å; E204-K206 WeakPolarHBondContact OE2-CE 3.31Å; E204-K206 IonicContact OE2-NZ 3.16Å; E204-K206 PolarHBondContact OE2-NZ 2.91Å; E204-W215 VanDerWaalsContact C-CE3 3.42Å; E204-W215 CarbonylContact O-C 3.56Å; E204-W215 WeakPolarHBondContact O-CA 3.49Å; E204-K216 HydrophobicContact CB-CB 4.47Å; E204-K216 PolarHBondContact N-O 2.85Å; E204-K216 PolarHBondContact O-N 3.21Å
205	L	93.8	Very high	81.6	Confident	60 Å²	60	77.2 Å²	77.2	31%	0.314	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	115.2	170.9	176.2	65.8	0	0	0	109.3	C213 W215	L205-C213 HydrophobicContact CD1-CB 3.68Å; L205-W215 HydrophobicContact CB-CD2 4.19Å; L205-W215 HydrophobicContact CB-CE3 4.2Å; L205-W215 HydrophobicContact CB-CH2 4.11Å; L205-W215 HydrophobicContact CB-CZ2 4.09Å; L205-W215 HydrophobicContact CB-CZ3 4.17Å; L205-W215 HydrophobicContact CD1-CD2 4.37Å; L205-W215 HydrophobicContact CD1-CG 4.5Å; L205-W215 HydrophobicContact CD1-CZ2 4.37Å
206	K	92.9	Very high	84.1	Confident	86 Å²	86	74 Å²	74	37%	0.374	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-39	-177.6	-70.1	-68.4	174.8	-171	0	113.4	E204 V214 K216 Y277	E204-K206 PolarHBondContact O-N 3.19Å; E204-K206 WeakPolarHBondContact OE1-CE 3.4Å; E204-K206 IonicContact OE1-NZ 2.86Å; E204-K206 PolarHBondContact OE1-NZ 3.41Å; E204-K206 WeakPolarHBondContact OE2-CE 3.31Å; E204-K206 IonicContact OE2-NZ 3.16Å; E204-K206 PolarHBondContact OE2-NZ 2.91Å; K206-V214 PolarHBondContact N-O 3.38Å; K206-K216 HydrophobicContact CG-CB 3.9Å; K206-Y277 WeakPolarHBondContact CE-OH 3.42Å; K206-Y277 HydrophobicContact CG-CE2 4.13Å
207	A	88.6	Confident	86.3	Confident	35 Å²	35	72 Å²	72	29%	0.289	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	153.9	-178.4	0	0	0	0	0	112.4	C213 V214	A207-C213 CarbonylContact O-C 3.59Å; A207-C213 WeakPolarHBondContact O-CA 3.32Å; A207-V214 HydrophobicContact CB-CB 4.32Å; A207-V214 PolarHBondContact N-O 2.88Å; A207-V214 PolarHBondContact O-N 3.12Å
208	R	86.6	Confident	88.3	Confident	196 Å²	196	66.6 Å²	66.6	74%	0.74	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	114.2	161	-64.1	-179.2	-178.6	-129.9	-0.8	107.1
209	G	74.9	Confident	89.7	Confident	35 Å²	35	62.5 Å²	62.5	36%	0.361	31%	0.312	S	S	.	.			trans	-91.7	-175.7	175.7	0	0	0	0	0	111.4	F211 G212	G209-F211 VanDerWaalsContact C-N 3.33Å; G209-F211 PolarHBondContact O-N 3.36Å; G209-G212 WeakPolarHBondContact CA-O 3.32Å; G209-G212 PolarHBondContact N-O 2.88Å
210	R	79.3	Confident	90.2	Very high	138 Å²	138	61.9 Å²	61.9	52%	0.521	30%	0.303	S	S	.	.	S	Bend	trans	-64.3	-37.5	179.3	-177.6	175.6	174.8	-175.1	0.1	113
211	F	81.9	Confident	90.2	Very high	15 Å²	15	68.1 Å²	68.1	7%	0.066	34%	0.337	C	S	.	.	S	Bend	trans	-115.1	6	-169.9	-51.6	-63.3	0	0	0	113.6	G209 F229 P230 D233 S236 L351	G209-F211 VanDerWaalsContact C-N 3.33Å; G209-F211 PolarHBondContact O-N 3.36Å; F211-F229 HydrophobicContact CB-CD1 3.74Å; F211-F229 HydrophobicContact CB-CE1 3.63Å; F211-F229 WeakPolarHBondContact O-CD1 3.27Å; F211-P230 WeakPolarHBondContact O-CD 3.5Å; F211-D233 HydrophobicContact CB-CB 4.25Å; F211-S236 WeakPolarHBondContact CD1-OG 3.47Å; F211-S236 WeakPolarHBondContact CE1-OG 3.45Å; F211-L351 HydrophobicContact CE2-CD2 4.29Å; F211-L351 HydrophobicContact CE2-CG 4.13Å; F211-L351 HydrophobicContact CZ-CD2 3.68Å; F211-L351 HydrophobicContact CZ-CG 3.98Å
212	G	87.4	Confident	90.3	Very high	15 Å²	15	69 Å²	69	16%	0.155	34%	0.341	C	S	.	.	S	Bend	trans	167.4	-177.1	-172.8	0	0	0	0	0	114.4	G209 I228	G209-G212 WeakPolarHBondContact CA-O 3.32Å; G209-G212 PolarHBondContact N-O 2.88Å; G212-I228 CarbonylContact C-O 3.52Å; G212-I228 WeakPolarHBondContact CA-O 3.44Å
213	C	92.4	Very high	90.5	Very high	33 Å²	33	71.8 Å²	71.8	22%	0.223	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	137.2	179.4	63.3	0	0	0	0	111	L205 A207 W215 K227 I228	L205-C213 HydrophobicContact CD1-CB 3.68Å; A207-C213 CarbonylContact O-C 3.59Å; A207-C213 WeakPolarHBondContact O-CA 3.32Å; C213-W215 PolarHBondContact SG-NE1 3.15Å; C213-K227 CarbonylContact O-C 3.49Å; C213-K227 WeakPolarHBondContact O-CA 3.34Å; C213-I228 PolarHBondContact N-O 2.9Å; C213-I228 PolarHBondContact O-N 3.07Å
214	V	95.2	Very high	90.7	Very high	38 Å²	38	68.2 Å²	68.2	23%	0.23	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.6	-178.4	-176.9	0	0	0	0	108.9	K206 A207 A225 V226 K227	K206-V214 PolarHBondContact N-O 3.38Å; A207-V214 HydrophobicContact CB-CB 4.32Å; A207-V214 PolarHBondContact N-O 2.88Å; A207-V214 PolarHBondContact O-N 3.12Å; V214-A225 HydrophobicContact CG1-CB 4.21Å; V214-V226 WeakPolarHBondContact CA-O 3.47Å; V214-K227 HydrophobicContact CG2-CB 4.23Å; V214-K227 HydrophobicContact CG2-CD 4.4Å; V214-K227 HydrophobicContact CG2-CG 3.97Å
215	W	96.4	Very high	90.8	Very high	72 Å²	72	64.3 Å²	64.3	27%	0.273	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.9	177.7	-69.8	77.8	0	0	0	110.7	L202 E204 L205 C213 A225 V226 I228	L202-W215 HydrophobicContact CB-CD2 4.41Å; L202-W215 HydrophobicContact CB-CE3 3.98Å; L202-W215 HydrophobicContact CD1-CD2 4.31Å; L202-W215 HydrophobicContact CD1-CG 4.49Å; L202-W215 HydrophobicContact CD2-CB 3.9Å; L202-W215 HydrophobicContact CD2-CG 4.22Å; E204-W215 VanDerWaalsContact C-CE3 3.42Å; E204-W215 CarbonylContact O-C 3.56Å; E204-W215 WeakPolarHBondContact O-CA 3.49Å; L205-W215 HydrophobicContact CB-CD2 4.19Å; L205-W215 HydrophobicContact CB-CE3 4.2Å; L205-W215 HydrophobicContact CB-CH2 4.11Å; L205-W215 HydrophobicContact CB-CZ2 4.09Å; L205-W215 HydrophobicContact CB-CZ3 4.17Å; L205-W215 HydrophobicContact CD1-CD2 4.37Å; L205-W215 HydrophobicContact CD1-CG 4.5Å; L205-W215 HydrophobicContact CD1-CZ2 4.37Å; C213-W215 PolarHBondContact SG-NE1 3.15Å; W215-A225 CarbonylContact O-C 3.55Å; W215-A225 WeakPolarHBondContact O-CA 3.49Å; W215-V226 PolarHBondContact N-O 3.29Å; W215-V226 PolarHBondContact O-N 2.93Å; W215-I228 HydrophobicContact CG-CD1 4.46Å
216	K	97.1	Very high	90.9	Very high	25 Å²	25	61.4 Å²	61.4	11%	0.109	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	126.8	155.1	-176.7	175.3	-174.4	164.2	0	106.9	I203 E204 K206 Y223 Y277 D279	I203-K216 WeakPolarHBondContact CA-O 3.03Å; I203-K216 WeakPolarHBondContact CB-O 3.39Å; I203-K216 PolarHBondContact N-O 3.01Å; E204-K216 HydrophobicContact CB-CB 4.47Å; E204-K216 PolarHBondContact N-O 2.85Å; E204-K216 PolarHBondContact O-N 3.21Å; K206-K216 HydrophobicContact CG-CB 3.9Å; K216-Y223 VanDerWaalsContact CE-CD1 3.49Å; K216-Y223 VanDerWaalsContact CE-CG 3.46Å; K216-Y223 HydrophobicContact CG-CD1 4.38Å; K216-Y277 HydrophobicContact CB-CD2 4.36Å; K216-Y277 HydrophobicContact CB-CE2 3.95Å; K216-Y277 HydrophobicContact CD-CD1 4.22Å; K216-Y277 HydrophobicContact CD-CE1 3.57Å; K216-Y277 HydrophobicContact CD-CE2 4.31Å; K216-Y277 VanDerWaalsContact CE-CE1 3.49Å; K216-Y277 HydrophobicContact CG-CD1 4.22Å; K216-Y277 HydrophobicContact CG-CD2 4.27Å; K216-Y277 HydrophobicContact CG-CE1 3.96Å; K216-Y277 HydrophobicContact CG-CE2 4.06Å; K216-Y277 HydrophobicContact CG-CG 4.37Å; K216-D279 IonicContact NZ-OD1 3.86Å; K216-D279 PolarHBondContact NZ-OD1 3.21Å
217	A	96	Very high	91.1	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	160.8	177.8	0	0	0	0	0	110.1	L200 Q201 L202 Y223 V224 V226	L200-A217 HydrophobicContact CD2-CB 4.01Å; Q201-A217 CarbonylContact O-C 3.57Å; Q201-A217 WeakPolarHBondContact O-CA 3.27Å; Q201-A217 VanDerWaalsContact O-CB 3.31Å; Q201-A217 WeakPolarHBondContact O-CB 3.48Å; L202-A217 HydrophobicContact CD2-CB 4Å; A217-Y223 CarbonylContact O-C 3.59Å; A217-Y223 WeakPolarHBondContact O-CA 3.31Å; A217-V224 HydrophobicContact CB-CG2 3.98Å; A217-V224 PolarHBondContact N-O 3.34Å; A217-V224 PolarHBondContact O-N 3.21Å; A217-V226 HydrophobicContact CB-CB 4.45Å; A217-V226 HydrophobicContact CB-CG2 3.53Å
218	Q	94.6	Very high	91.3	Very high	65 Å²	65	57.1 Å²	57.1	30%	0.304	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.8	171.9	176.8	169.6	11.1	0	0	108.9	L200 Q201 I203 L220 Y223	L200-Q218 WeakPolarHBondContact CA-O 3.3Å; Q201-Q218 PolarHBondContact N-O 2.91Å; Q201-Q218 PolarHBondContact O-N 2.52Å; I203-Q218 HydrophobicContact CD1-CB 3.76Å; Q218-L220 WeakPolarHBondContact CG-O 3.33Å; Q218-L220 PolarHBondContact NE2-O 3.48Å; Q218-Y223 HydrophobicContact CB-CD1 4.35Å; Q218-Y223 HydrophobicContact CB-CE1 4.39Å
219	L	91.3	Very high	91.7	Very high	31 Å²	31	47.8 Å²	47.8	16%	0.162	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	107.3	172.5	178.9	66.3	0	0	0	107	K198 L200 N221 E222 V224 I258	K198-L219 HydrophobicContact CB-CD1 3.85Å; L200-L219 HydrophobicContact CB-CD1 4.04Å; L200-L219 HydrophobicContact CD1-CD1 4.5Å; L200-L219 HydrophobicContact CG-CD1 4.47Å; L219-N221 PolarHBondContact O-N 2.98Å; L219-E222 PolarHBondContact N-O 3.2Å; L219-E222 PolarHBondContact O-N 2.85Å; L219-E222 VanDerWaalsContact O-N 3.17Å; L219-V224 HydrophobicContact CB-CG1 3.91Å; L219-V224 HydrophobicContact CB-CG2 3.8Å; L219-V224 HydrophobicContact CD2-CG1 4.26Å; L219-I258 HydrophobicContact CD2-CG2 4.27Å
220	L	87.4	Confident	92.4	Very high	75 Å²	75	48.5 Å²	48.5	39%	0.393	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	-117	-166.4	-61.2	174.8	0	0	0	112.2	K198 P199 Q218	K198-L220 HydrophobicContact CB-CD2 4.05Å; K198-L220 HydrophobicContact CB-CG 4.01Å; K198-L220 HydrophobicContact CD-CD1 3.42Å; K198-L220 VanDerWaalsContact CD-CD1 3.42Å; K198-L220 HydrophobicContact CD-CD2 4.36Å; K198-L220 HydrophobicContact CD-CG 3.79Å; K198-L220 VanDerWaalsContact CE-CD1 3.48Å; K198-L220 HydrophobicContact CG-CD1 3.86Å; K198-L220 HydrophobicContact CG-CD2 3.87Å; K198-L220 HydrophobicContact CG-CG 3.82Å; P199-L220 PolarHBondContact O-N 2.74Å; Q218-L220 WeakPolarHBondContact CG-O 3.33Å; Q218-L220 PolarHBondContact NE2-O 3.48Å
221	N	87.3	Confident	92.8	Very high	160 Å²	160	45.9 Å²	45.9	86%	0.856	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.1	8.8	-178.2	-65.9	-11.8	0	0	0	112.1	L219	L219-N221 PolarHBondContact O-N 2.98Å
222	E	92.8	Very high	93.1	Very high	144 Å²	144	52.9 Å²	52.9	67%	0.673	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	142.7	-178.8	-63.7	-171.1	147	0	0	110.8	L219	L219-E222 PolarHBondContact N-O 3.2Å; L219-E222 PolarHBondContact O-N 2.85Å; L219-E222 VanDerWaalsContact O-N 3.17Å
223	Y	96.4	Very high	93.2	Very high	116 Å²	116	54 Å²	54	46%	0.455	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	132.9	169.7	-68.2	-54.7	0	0	0	110.1	I203 K216 A217 Q218 Y277	I203-Y223 HydrophobicContact CD1-CD1 3.97Å; I203-Y223 HydrophobicContact CD1-CE1 3.54Å; K216-Y223 VanDerWaalsContact CE-CD1 3.49Å; K216-Y223 VanDerWaalsContact CE-CG 3.46Å; K216-Y223 HydrophobicContact CG-CD1 4.38Å; A217-Y223 CarbonylContact O-C 3.59Å; A217-Y223 WeakPolarHBondContact O-CA 3.31Å; Q218-Y223 HydrophobicContact CB-CD1 4.35Å; Q218-Y223 HydrophobicContact CB-CE1 4.39Å; Y223-Y277 WeakPolarHBondContact O-CB 3.49Å
224	V	97.3	Very high	93.1	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	155.7	178.6	-58.7	0	0	0	0	110.1	A217 L219 V226 I258 I274 T275	A217-V224 HydrophobicContact CB-CG2 3.98Å; A217-V224 PolarHBondContact N-O 3.34Å; A217-V224 PolarHBondContact O-N 3.21Å; L219-V224 HydrophobicContact CB-CG1 3.91Å; L219-V224 HydrophobicContact CB-CG2 3.8Å; L219-V224 HydrophobicContact CD2-CG1 4.26Å; V224-V226 HydrophobicContact CG2-CG2 4.18Å; V224-I258 HydrophobicContact CB-CD1 4.12Å; V224-I258 HydrophobicContact CG1-CD1 3.5Å; V224-I258 VanDerWaalsContact CG1-CD1 3.5Å; V224-I274 HydrophobicContact CB-CG2 4Å; V224-I274 HydrophobicContact CG2-CG2 3.94Å; V224-T275 WeakPolarHBondContact CB-O 3.43Å
225	A	97.6	Very high	92.8	Very high	9 Å²	9	62.9 Å²	62.9	7%	0.074	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.4	172.2	0	0	0	0	0	108.6	V214 W215 I274 T275 Y277	V214-A225 HydrophobicContact CG1-CB 4.21Å; W215-A225 CarbonylContact O-C 3.55Å; W215-A225 WeakPolarHBondContact O-CA 3.49Å; A225-I274 WeakPolarHBondContact O-CA 3.44Å; A225-T275 PolarHBondContact N-O 3.47Å; A225-T275 PolarHBondContact O-N 3.5Å; A225-Y277 HydrophobicContact CB-CD2 4.21Å
226	V	96.6	Very high	92.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	108.2	177.2	-176.7	0	0	0	0	108.2	L200 L202 V214 W215 A217 V224 I228 W272 I274	L200-V226 HydrophobicContact CD1-CG2 4.1Å; L200-V226 HydrophobicContact CD2-CG2 4.25Å; L202-V226 HydrophobicContact CD2-CB 4.06Å; L202-V226 HydrophobicContact CD2-CG1 4.22Å; L202-V226 HydrophobicContact CD2-CG2 4.24Å; V214-V226 WeakPolarHBondContact CA-O 3.47Å; W215-V226 PolarHBondContact N-O 3.29Å; W215-V226 PolarHBondContact O-N 2.93Å; A217-V226 HydrophobicContact CB-CB 4.45Å; A217-V226 HydrophobicContact CB-CG2 3.53Å; V224-V226 HydrophobicContact CG2-CG2 4.18Å; V226-I228 HydrophobicContact CG1-CD1 4.47Å; V226-I228 HydrophobicContact CG1-CG1 3.88Å; V226-W272 HydrophobicContact CG1-CB 4.17Å; V226-W272 HydrophobicContact CG1-CD2 3.71Å; V226-W272 HydrophobicContact CG1-CE3 3.57Å; V226-W272 HydrophobicContact CG1-CG 4.04Å; V226-W272 HydrophobicContact CG1-CZ3 4.17Å; V226-I274 HydrophobicContact CG2-CG1 4.42Å; V226-I274 HydrophobicContact CG2-CG2 4.46Å
227	K	95.9	Very high	92.4	Very high	14 Å²	14	59.3 Å²	59.3	6%	0.061	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	113	172.6	-168.4	175.8	178.8	-173.6	0	108.2	C213 V214 F229 E240 W272 L273 D348	C213-K227 CarbonylContact O-C 3.49Å; C213-K227 WeakPolarHBondContact O-CA 3.34Å; V214-K227 HydrophobicContact CG2-CB 4.23Å; V214-K227 HydrophobicContact CG2-CD 4.4Å; V214-K227 HydrophobicContact CG2-CG 3.97Å; K227-F229 HydrophobicContact CB-CE2 3.88Å; K227-F229 HydrophobicContact CB-CZ 4.48Å; K227-F229 HydrophobicContact CD-CE1 4.3Å; K227-F229 HydrophobicContact CD-CE2 3.68Å; K227-F229 HydrophobicContact CD-CZ 3.41Å; K227-F229 VanDerWaalsContact CD-CZ 3.41Å; K227-F229 VanDerWaalsContact CE-CZ 3.4Å; K227-F229 HydrophobicContact CG-CD2 4.17Å; K227-F229 HydrophobicContact CG-CE2 3.47Å; K227-F229 VanDerWaalsContact CG-CE2 3.47Å; K227-F229 HydrophobicContact CG-CZ 3.72Å; K227-F229 WeakPolarHBondContact O-CD2 3.32Å; K227-E240 IonicContact NZ-OE1 2.75Å; K227-E240 PolarHBondContact NZ-OE1 3.25Å; K227-E240 IonicContact NZ-OE2 3.77Å; K227-E240 PolarHBondContact NZ-OE2 2.86Å; K227-W272 WeakPolarHBondContact O-CA 3.48Å; K227-L273 HydrophobicContact CB-CB 4.46Å; K227-L273 PolarHBondContact N-O 3.22Å; K227-L273 PolarHBondContact O-N 2.86Å; K227-D348 VanDerWaalsContact NZ-CG 3.29Å; K227-D348 IonicContact NZ-OD1 2.72Å; K227-D348 PolarHBondContact NZ-OD1 2.62Å; K227-D348 IonicContact NZ-OD2 2.99Å; K227-D348 PolarHBondContact NZ-OD2 3.33Å
228	I	94	Very high	92.3	Very high	16 Å²	16	62 Å²	62	8%	0.082	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	120.2	-179.3	-53.5	178.5	0	0	0	108.2	L202 G212 C213 W215 V226 E270 W272	L202-I228 HydrophobicContact CD1-CD1 3.81Å; L202-I228 HydrophobicContact CD2-CD1 4.43Å; G212-I228 CarbonylContact C-O 3.52Å; G212-I228 WeakPolarHBondContact CA-O 3.44Å; C213-I228 PolarHBondContact N-O 2.9Å; C213-I228 PolarHBondContact O-N 3.07Å; W215-I228 HydrophobicContact CG-CD1 4.46Å; V226-I228 HydrophobicContact CG1-CD1 4.47Å; V226-I228 HydrophobicContact CG1-CG1 3.88Å; I228-E270 HydrophobicContact CG2-CB 4.18Å; I228-E270 HydrophobicContact CG2-CG 4.3Å; I228-W272 HydrophobicContact CD1-CZ2 3.94Å; I228-W272 HydrophobicContact CG1-CD2 4.34Å; I228-W272 HydrophobicContact CG1-CG 4.25Å
229	F	93.2	Very high	92.2	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.9	179.8	-60.5	-112.6	0	0	0	109.5	F211 K227 D233 W237 E240 L271 L273	F211-F229 HydrophobicContact CB-CD1 3.74Å; F211-F229 HydrophobicContact CB-CE1 3.63Å; F211-F229 WeakPolarHBondContact O-CD1 3.27Å; K227-F229 HydrophobicContact CB-CE2 3.88Å; K227-F229 HydrophobicContact CB-CZ 4.48Å; K227-F229 HydrophobicContact CD-CE1 4.3Å; K227-F229 HydrophobicContact CD-CE2 3.68Å; K227-F229 HydrophobicContact CD-CZ 3.41Å; K227-F229 VanDerWaalsContact CD-CZ 3.41Å; K227-F229 VanDerWaalsContact CE-CZ 3.4Å; K227-F229 HydrophobicContact CG-CD2 4.17Å; K227-F229 HydrophobicContact CG-CE2 3.47Å; K227-F229 VanDerWaalsContact CG-CE2 3.47Å; K227-F229 HydrophobicContact CG-CZ 3.72Å; K227-F229 WeakPolarHBondContact O-CD2 3.32Å; F229-D233 HydrophobicContact CD1-CB 4.32Å; F229-W237 HydrophobicContact CB-CB 4.16Å; F229-W237 HydrophobicContact CD1-CB 3.82Å; F229-W237 HydrophobicContact CD2-CB 3.99Å; F229-W237 AromaticContact CD2-CD1 3.52Å; F229-W237 HydrophobicContact CD2-CG 4.13Å; F229-W237 HydrophobicContact CE1-CB 4.12Å; F229-W237 HydrophobicContact CE2-CB 4.27Å; F229-W237 AromaticContact CE2-CD1 3.71Å; F229-W237 HydrophobicContact CE2-CG 4.4Å; F229-W237 HydrophobicContact CG-CB 3.75Å; F229-W237 HydrophobicContact CG-CG 4.33Å; F229-W237 HydrophobicContact CZ-CB 4.32Å; F229-E240 VanDerWaalsContact CZ-OE2 3.29Å; F229-E240 WeakPolarHBondContact CZ-OE2 3.44Å; F229-L271 HydrophobicContact CB-CB 4.22Å; F229-L271 WeakPolarHBondContact CD2-O 3.37Å; F229-L271 PolarHBondContact N-O 3.45Å; F229-L271 PolarHBondContact O-N 2.88Å; F229-L273 HydrophobicContact CE2-CB 3.86Å
230	P	89.5	Confident	92.4	Very high	50 Å²	50	59.9 Å²	59.9	33%	0.325	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-68	157.6	166.5	32.1	-34.7	0	0	0	110	F211 Q232 D233	F211-P230 WeakPolarHBondContact O-CD 3.5Å; P230-Q232 HydrophobicContact CB-CG 4.02Å; P230-Q232 HydrophobicContact CG-CG 3.77Å; P230-Q232 PolarHBondContact O-N 2.88Å; P230-Q232 VanDerWaalsContact O-N 3.12Å; P230-D233 HydrophobicContact CG-CB 4.19Å; P230-D233 WeakPolarHBondContact CG-OD2 3.36Å; P230-D233 PolarHBondContact O-N 3.45Å
231	I	88.3	Confident	92.8	Very high	84 Å²	84	60.2 Å²	60.2	43%	0.431	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-59.8	-28.8	-175.8	-167.5	55.6	0	0	0	113.8	D233 K234 L269 L271	I231-D233 PolarHBondContact O-N 2.91Å; I231-K234 HydrophobicContact CD1-CB 4.39Å; I231-K234 HydrophobicContact CD1-CD 4.24Å; I231-K234 WeakPolarHBondContact O-CB 3.38Å; I231-K234 PolarHBondContact O-N 2.89Å; I231-L269 HydrophobicContact CD1-CB 4.39Å; I231-L269 HydrophobicContact CD1-CD2 3.62Å; I231-L269 HydrophobicContact CD1-CG 4.13Å; I231-L271 HydrophobicContact CD1-CD1 4.34Å
232	Q	88.8	Confident	93.2	Very high	161 Å²	161	57 Å²	57	75%	0.752	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-61.7	-28.9	174.6	67	-164.1	22	0	0	112.9	P230 K234	P230-Q232 HydrophobicContact CB-CG 4.02Å; P230-Q232 HydrophobicContact CG-CG 3.77Å; P230-Q232 PolarHBondContact O-N 2.88Å; P230-Q232 VanDerWaalsContact O-N 3.12Å; Q232-K234 VanDerWaalsContact C-N 3.34Å
233	D	88.8	Confident	93.3	Very high	39 Å²	39	50.3 Å²	50.3	21%	0.209	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-97.8	20.5	-179.9	-65.1	-44.8	0	0	0	112.2	F211 F229 P230 I231 L235 S236 W237	F211-D233 HydrophobicContact CB-CB 4.25Å; F229-D233 HydrophobicContact CD1-CB 4.32Å; P230-D233 HydrophobicContact CG-CB 4.19Å; P230-D233 WeakPolarHBondContact CG-OD2 3.36Å; P230-D233 PolarHBondContact O-N 3.45Å; I231-D233 PolarHBondContact O-N 2.91Å; D233-L235 PolarHBondContact O-N 3.36Å; D233-S236 PolarHBondContact O-N 3.48Å; D233-S236 VanDerWaalsContact O-N 3.08Å; D233-W237 PolarHBondContact O-N 3.42Å; D233-W237 VanDerWaalsContact O-N 3.11Å
234	K	90.6	Very high	93.4	Very high	109 Å²	109	45.5 Å²	45.5	47%	0.474	22%	0.224	S	C	.	.	H	α-helix	trans	-54.6	-37	179.8	176.2	-178.7	174.4	-169.7	0	113.3	I231 Q232 S236 W237 Q238 L271	I231-K234 HydrophobicContact CD1-CB 4.39Å; I231-K234 HydrophobicContact CD1-CD 4.24Å; I231-K234 WeakPolarHBondContact O-CB 3.38Å; I231-K234 PolarHBondContact O-N 2.89Å; Q232-K234 VanDerWaalsContact C-N 3.34Å; K234-S236 VanDerWaalsContact C-N 3.34Å; K234-W237 PolarHBondContact O-N 3.31Å; K234-Q238 VanDerWaalsContact O-CB 3.3Å; K234-Q238 WeakPolarHBondContact O-CB 3.28Å; K234-Q238 PolarHBondContact O-N 3.22Å; K234-L271 HydrophobicContact CB-CD1 3.71Å; K234-L271 HydrophobicContact CG-CD1 3.78Å
235	L	89.5	Confident	93.3	Very high	149 Å²	149	48.4 Å²	48.4	78%	0.78	24%	0.244	S	C	*	.	H	α-helix	trans	-64.6	-40	179.1	-68.1	176.9	0	0	0	111.5	D233 Q238 N239	D233-L235 PolarHBondContact O-N 3.36Å; L235-Q238 PolarHBondContact O-N 3.43Å; L235-N239 WeakPolarHBondContact O-CB 3.4Å; L235-N239 PolarHBondContact O-N 3.42Å
236	S	90.1	Very high	93.1	Very high	18 Å²	18	48.8 Å²	48.8	13%	0.126	25%	0.246	C	C	.	.	H	α-helix	trans	-68.3	-42	176.6	-58.2	0	0	0	0	112	F211 D233 K234 Q238 N239 E240	F211-S236 WeakPolarHBondContact CD1-OG 3.47Å; F211-S236 WeakPolarHBondContact CE1-OG 3.45Å; D233-S236 PolarHBondContact O-N 3.48Å; D233-S236 VanDerWaalsContact O-N 3.08Å; K234-S236 VanDerWaalsContact C-N 3.34Å; S236-Q238 VanDerWaalsContact C-N 3.33Å; S236-Q238 PolarHBondContact O-N 2.62Å; S236-N239 PolarHBondContact O-N 3.23Å; S236-E240 WeakPolarHBondContact O-CB 3.38Å; S236-E240 PolarHBondContact O-N 3.48Å
237	W	93.9	Very high	93	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-59.9	-43.9	172.5	173.9	87.6	0	0	0	111.7	F229 D233 K234 E240 Y241 V260 K262 L271 W272	F229-W237 HydrophobicContact CB-CB 4.16Å; F229-W237 HydrophobicContact CD1-CB 3.82Å; F229-W237 HydrophobicContact CD2-CB 3.99Å; F229-W237 AromaticContact CD2-CD1 3.52Å; F229-W237 HydrophobicContact CD2-CG 4.13Å; F229-W237 HydrophobicContact CE1-CB 4.12Å; F229-W237 HydrophobicContact CE2-CB 4.27Å; F229-W237 AromaticContact CE2-CD1 3.71Å; F229-W237 HydrophobicContact CE2-CG 4.4Å; F229-W237 HydrophobicContact CG-CB 3.75Å; F229-W237 HydrophobicContact CG-CG 4.33Å; F229-W237 HydrophobicContact CZ-CB 4.32Å; D233-W237 PolarHBondContact O-N 3.42Å; D233-W237 VanDerWaalsContact O-N 3.11Å; K234-W237 PolarHBondContact O-N 3.31Å; W237-E240 PolarHBondContact O-N 3.03Å; W237-Y241 WeakPolarHBondContact O-CB 3.38Å; W237-Y241 PolarHBondContact O-N 3.15Å; W237-V260 HydrophobicContact CH2-CG2 4.5Å; W237-V260 HydrophobicContact CZ2-CB 3.71Å; W237-V260 HydrophobicContact CZ2-CG1 3.95Å; W237-V260 HydrophobicContact CZ2-CG2 3.98Å; W237-K262 HydrophobicContact CH2-CD 4.42Å; W237-K262 HydrophobicContact CH2-CG 4.38Å; W237-K262 HydrophobicContact CZ2-CG 4.34Å; W237-L271 HydrophobicContact CB-CB 4.35Å; W237-L271 HydrophobicContact CB-CD1 4.22Å; W237-L271 HydrophobicContact CD2-CB 3.88Å; W237-L271 HydrophobicContact CD2-CD1 4.14Å; W237-L271 HydrophobicContact CD2-CG 4.43Å; W237-L271 HydrophobicContact CE3-CD1 4.17Å; W237-L271 HydrophobicContact CG-CB 3.72Å; W237-L271 HydrophobicContact CG-CD1 4.18Å; W237-W272 PolarHBondContact NE1-O 2.94Å; W237-W272 VanDerWaalsContact NE1-O 3.07Å
238	Q	93.8	Very high	92.9	Very high	57 Å²	57	50.6 Å²	50.6	27%	0.266	26%	0.26	S	S	.	.	H	α-helix	trans	-64.9	-45.3	179.3	-177.4	66.8	39	0	0	111	K234 L235 S236 Y241 E242	K234-Q238 VanDerWaalsContact O-CB 3.3Å; K234-Q238 WeakPolarHBondContact O-CB 3.28Å; K234-Q238 PolarHBondContact O-N 3.22Å; L235-Q238 PolarHBondContact O-N 3.43Å; S236-Q238 VanDerWaalsContact C-N 3.33Å; S236-Q238 PolarHBondContact O-N 2.62Å; Q238-Y241 PolarHBondContact O-N 3.46Å; Q238-E242 WeakPolarHBondContact CG-OE1 3.35Å; Q238-E242 PolarHBondContact NE2-OE1 3.01Å; Q238-E242 WeakPolarHBondContact O-CB 3.3Å; Q238-E242 VanDerWaalsContact O-CG 3.31Å; Q238-E242 WeakPolarHBondContact O-CG 3.2Å; Q238-E242 PolarHBondContact O-N 2.99Å
239	N	92.8	Very high	93	Very high	46 Å²	46	50.5 Å²	50.5	25%	0.246	26%	0.26	C	S	.	.	H	α-helix	trans	-60.5	-47.6	177.2	-170.2	58.5	0	0	0	111.1	L235 S236 Y241 E242 I243 F349 G350 A352	L235-N239 WeakPolarHBondContact O-CB 3.4Å; L235-N239 PolarHBondContact O-N 3.42Å; S236-N239 PolarHBondContact O-N 3.23Å; N239-Y241 VanDerWaalsContact C-N 3.34Å; N239-Y241 PolarHBondContact O-N 3.46Å; N239-E242 PolarHBondContact O-N 2.88Å; N239-I243 VanDerWaalsContact O-CG1 3.27Å; N239-I243 WeakPolarHBondContact O-CG1 3.19Å; N239-I243 PolarHBondContact O-N 2.92Å; N239-F349 PolarHBondContact ND2-O 3.23Å; N239-G350 PolarHBondContact ND2-O 2.75Å; N239-A352 PolarHBondContact ND2-O 3.27Å
240	E	95.3	Very high	93.1	Very high	5 Å²	5	58.2 Å²	58.2	2%	0.023	29%	0.293	C	S	.	.	H	α-helix	trans	-63.3	-41.3	179.8	-164.1	166	-179.9	0	0	111.6	K227 F229 S236 W237 Y244 L273 F349	K227-E240 IonicContact NZ-OE1 2.75Å; K227-E240 PolarHBondContact NZ-OE1 3.25Å; K227-E240 IonicContact NZ-OE2 3.77Å; K227-E240 PolarHBondContact NZ-OE2 2.86Å; F229-E240 VanDerWaalsContact CZ-OE2 3.29Å; F229-E240 WeakPolarHBondContact CZ-OE2 3.44Å; S236-E240 WeakPolarHBondContact O-CB 3.38Å; S236-E240 PolarHBondContact O-N 3.48Å; W237-E240 PolarHBondContact O-N 3.03Å; E240-Y244 HydrophobicContact CG-CD2 3.99Å; E240-Y244 HydrophobicContact CG-CE2 3.76Å; E240-Y244 WeakPolarHBondContact O-CD2 3.26Å; E240-Y244 PolarHBondContact O-N 3.35Å; E240-L273 HydrophobicContact CB-CD1 3.84Å; E240-L273 HydrophobicContact CG-CD1 3.66Å; E240-F349 HydrophobicContact CG-CB 4.06Å; E240-F349 PolarHBondContact OE1-N 3.37Å
241	Y	96.1	Very high	93.5	Very high	81 Å²	81	58.1 Å²	58.1	32%	0.318	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-44.8	173.3	171.7	-116.7	0	0	0	112.6	W237 Q238 N239 Y244 S245 F257 V260	W237-Y241 WeakPolarHBondContact O-CB 3.38Å; W237-Y241 PolarHBondContact O-N 3.15Å; Q238-Y241 PolarHBondContact O-N 3.46Å; N239-Y241 VanDerWaalsContact C-N 3.34Å; N239-Y241 PolarHBondContact O-N 3.46Å; Y241-Y244 PolarHBondContact O-N 2.82Å; Y241-S245 WeakPolarHBondContact CE2-OG 3.14Å; Y241-S245 WeakPolarHBondContact O-CB 3.22Å; Y241-S245 PolarHBondContact O-N 3.15Å; Y241-S245 PolarHBondContact O-OG 3.29Å; Y241-F257 HydrophobicContact CD2-CE2 4.48Å; Y241-F257 AromaticContact CD2-CZ 3.86Å; Y241-F257 HydrophobicContact CD2-CZ 3.86Å; Y241-F257 HydrophobicContact CE2-CZ 4.08Å; Y241-V260 HydrophobicContact CD2-CB 4.35Å; Y241-V260 HydrophobicContact CD2-CG1 3.56Å; Y241-V260 HydrophobicContact CD2-CG2 3.81Å; Y241-V260 HydrophobicContact CE2-CG1 4.27Å; Y241-V260 HydrophobicContact CE2-CG2 3.7Å; Y241-V260 HydrophobicContact CG-CG1 4.11Å; Y241-V260 HydrophobicContact CG-CG2 4.46Å
242	E	95.4	Very high	93.9	Very high	93 Å²	93	59.9 Å²	59.9	44%	0.435	30%	0.299	S	S	.	.	H	α-helix	trans	-63.7	-43	178.7	-78.5	177.5	-165.3	0	0	111.8	Q238 N239 S245 V246	Q238-E242 WeakPolarHBondContact CG-OE1 3.35Å; Q238-E242 PolarHBondContact NE2-OE1 3.01Å; Q238-E242 WeakPolarHBondContact O-CB 3.3Å; Q238-E242 VanDerWaalsContact O-CG 3.31Å; Q238-E242 WeakPolarHBondContact O-CG 3.2Å; Q238-E242 PolarHBondContact O-N 2.99Å; N239-E242 PolarHBondContact O-N 2.88Å; E242-S245 PolarHBondContact O-N 2.94Å; E242-V246 PolarHBondContact O-N 3.17Å
243	I	96.4	Very high	94.4	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-48	176.2	-66.7	-71.6	0	0	0	110.1	N239 S245 V246 M249 I326 F349 A352 K354	N239-I243 VanDerWaalsContact O-CG1 3.27Å; N239-I243 WeakPolarHBondContact O-CG1 3.19Å; N239-I243 PolarHBondContact O-N 2.92Å; I243-S245 PolarHBondContact O-N 2.96Å; I243-V246 WeakPolarHBondContact O-CB 3.48Å; I243-V246 WeakPolarHBondContact O-CG2 3.39Å; I243-V246 PolarHBondContact O-N 2.97Å; I243-V246 VanDerWaalsContact O-N 3.12Å; I243-M249 HydrophobicContact CG2-CE 3.83Å; I243-M249 VanDerWaalsContact O-CG 3.26Å; I243-M249 WeakPolarHBondContact O-CG 3.46Å; I243-I326 HydrophobicContact CD1-CG2 4.26Å; I243-I326 HydrophobicContact CG2-CD1 4.45Å; I243-I326 HydrophobicContact CG2-CG2 4.4Å; I243-F349 HydrophobicContact CB-CB 4.05Å; I243-F349 HydrophobicContact CG2-CB 3.67Å; I243-F349 HydrophobicContact CG2-CD1 3.94Å; I243-F349 HydrophobicContact CG2-CG 3.85Å; I243-A352 HydrophobicContact CD1-CB 4.15Å; I243-A352 HydrophobicContact CG1-CB 4.04Å; I243-A352 HydrophobicContact CG2-CB 4.25Å; I243-K354 HydrophobicContact CD1-CB 4.25Å
244	Y	96.9	Very high	94.9	Very high	14 Å²	14	50.8 Å²	50.8	6%	0.055	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-25.6	175.7	-81.8	-55.1	0	0	0	114.1	E240 Y241 V246 L255 F257 L273 T275 F349	E240-Y244 HydrophobicContact CG-CD2 3.99Å; E240-Y244 HydrophobicContact CG-CE2 3.76Å; E240-Y244 WeakPolarHBondContact O-CD2 3.26Å; E240-Y244 PolarHBondContact O-N 3.35Å; Y241-Y244 PolarHBondContact O-N 2.82Å; Y244-V246 VanDerWaalsContact C-N 3.3Å; Y244-L255 WeakPolarHBondContact CE1-O 3.35Å; Y244-F257 HydrophobicContact CD1-CB 3.54Å; Y244-F257 HydrophobicContact CD1-CD2 4.46Å; Y244-F257 HydrophobicContact CD1-CG 4.18Å; Y244-F257 HydrophobicContact CD2-CB 4.32Å; Y244-F257 AromaticContact CD2-CD2 3.72Å; Y244-F257 HydrophobicContact CD2-CD2 3.72Å; Y244-F257 HydrophobicContact CD2-CE2 4.37Å; Y244-F257 HydrophobicContact CD2-CG 4.23Å; Y244-F257 HydrophobicContact CE1-CB 3.98Å; Y244-F257 HydrophobicContact CE2-CD2 4.31Å; Y244-F257 HydrophobicContact CG-CB 3.72Å; Y244-F257 AromaticContact CG-CD2 3.79Å; Y244-F257 HydrophobicContact CG-CD2 3.79Å; Y244-F257 AromaticContact CG-CG 3.82Å; Y244-F257 HydrophobicContact CG-CG 3.82Å; Y244-L273 HydrophobicContact CD2-CD1 4.2Å; Y244-L273 HydrophobicContact CD2-CD2 4.34Å; Y244-L273 HydrophobicContact CE2-CD1 4.37Å; Y244-L273 HydrophobicContact CE2-CD2 3.89Å; Y244-T275 HydrophobicContact CE2-CG2 4.24Å; Y244-F349 HydrophobicContact CD1-CD2 4.2Å; Y244-F349 HydrophobicContact CD1-CE2 4.32Å; Y244-F349 HydrophobicContact CD2-CD2 4.45Å; Y244-F349 AromaticContact CE1-CD2 3.53Å; Y244-F349 HydrophobicContact CE1-CD2 3.53Å; Y244-F349 AromaticContact CE1-CE2 3.43Å; Y244-F349 HydrophobicContact CE1-CE2 3.43Å; Y244-F349 VanDerWaalsContact CE1-CE2 3.43Å; Y244-F349 AromaticContact CE2-CD2 3.81Å; Y244-F349 HydrophobicContact CE2-CD2 3.81Å; Y244-F349 HydrophobicContact CE2-CE2 4.44Å; Y244-F349 AromaticContact CZ-CD2 3.32Å; Y244-F349 AromaticContact CZ-CE2 3.51Å; Y244-F349 WeakPolarHBondContact OH-CD2 3.24Å; Y244-F349 WeakPolarHBondContact OH-CE2 3.44Å
245	S	95.6	Very high	95.3	Very high	63 Å²	63	46 Å²	46	44%	0.441	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-4	179	-58.1	0	0	0	0	113.5	Y241 E242 I243	Y241-S245 WeakPolarHBondContact CE2-OG 3.14Å; Y241-S245 WeakPolarHBondContact O-CB 3.22Å; Y241-S245 PolarHBondContact O-N 3.15Å; Y241-S245 PolarHBondContact O-OG 3.29Å; E242-S245 PolarHBondContact O-N 2.94Å; I243-S245 PolarHBondContact O-N 2.96Å
246	V	94.6	Very high	95.7	Very high	18 Å²	18	44.1 Å²	44.1	11%	0.109	22%	0.222	C	C	.	.	S	Bend	trans	-64.1	140	174.7	172.6	0	0	0	0	110.5	E242 I243 Y244 G248 M249 P324 I326 K354	E242-V246 PolarHBondContact O-N 3.17Å; I243-V246 WeakPolarHBondContact O-CB 3.48Å; I243-V246 WeakPolarHBondContact O-CG2 3.39Å; I243-V246 PolarHBondContact O-N 2.97Å; I243-V246 VanDerWaalsContact O-N 3.12Å; Y244-V246 VanDerWaalsContact C-N 3.3Å; V246-G248 PolarHBondContact O-N 3.31Å; V246-M249 HydrophobicContact CB-CG 3.67Å; V246-M249 HydrophobicContact CG1-CG 4.22Å; V246-M249 WeakPolarHBondContact O-CB 3.3Å; V246-M249 VanDerWaalsContact O-CG 3.23Å; V246-M249 WeakPolarHBondContact O-CG 3.41Å; V246-M249 PolarHBondContact O-N 2.71Å; V246-P324 HydrophobicContact CG1-CG 3.89Å; V246-I326 HydrophobicContact CG1-CD1 4.31Å; V246-K354 HydrophobicContact CG2-CD 4.15Å
247	C	93.8	Very high	96	Very high	49 Å²	49	46.1 Å²	46.1	33%	0.331	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	132.1	174.6	-63.3	0	0	0	0	110.4	D320 K323	C247-D320 HydrophobicContact CB-CB 4.46Å; C247-D320 PolarHBondContact SG-O 3.05Å; C247-K323 WeakPolarHBondContact O-CA 3.45Å; C247-K323 WeakPolarHBondContact O-CB 3.19Å; C247-K323 VanDerWaalsContact O-CG 3.25Å; C247-K323 WeakPolarHBondContact O-CG 3.34Å
248	G	93.7	Very high	96.1	Very high	3 Å²	3	48.9 Å²	48.9	3%	0.031	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	31.1	179.5	0	0	0	0	0	115.3	V246 K250 Y310 H318 K323	V246-G248 PolarHBondContact O-N 3.31Å; G248-K250 VanDerWaalsContact C-N 3.33Å; G248-Y310 WeakPolarHBondContact O-CE1 3.48Å; G248-Y310 VanDerWaalsContact O-CZ 3.27Å; G248-Y310 PolarHBondContact O-OH 3.06Å; G248-H318 WeakPolarHBondContact CA-CE1 3.36Å; G248-H318 WeakPolarHBondContact CA-ND1 3.42Å; G248-K323 WeakPolarHBondContact O-CD 3.46Å
249	M	95.7	Very high	96.1	Very high	14 Å²	14	46.5 Å²	46.5	7%	0.069	23%	0.234	C	C	.	.			trans	-85.1	-3.9	171.4	-77.7	-66.5	-62.6	0	0	114.9	I243 V246 H251 V254 L311 I326 F349	I243-M249 HydrophobicContact CG2-CE 3.83Å; I243-M249 VanDerWaalsContact O-CG 3.26Å; I243-M249 WeakPolarHBondContact O-CG 3.46Å; V246-M249 HydrophobicContact CB-CG 3.67Å; V246-M249 HydrophobicContact CG1-CG 4.22Å; V246-M249 WeakPolarHBondContact O-CB 3.3Å; V246-M249 VanDerWaalsContact O-CG 3.23Å; V246-M249 WeakPolarHBondContact O-CG 3.41Å; V246-M249 PolarHBondContact O-N 2.71Å; M249-H251 PolarHBondContact O-N 2.79Å; M249-V254 HydrophobicContact CE-CG1 4.23Å; M249-L311 HydrophobicContact CE-CD2 3.85Å; M249-L311 HydrophobicContact SD-CD2 4.11Å; M249-I326 HydrophobicContact CE-CD1 4.35Å; M249-I326 HydrophobicContact SD-CD1 3.38Å; M249-I326 WeakPolarHBondContact SD-CD1 3.43Å; M249-F349 HydrophobicContact CE-CE1 4.41Å; M249-F349 HydrophobicContact CE-CZ 4.47Å
250	K	95.7	Very high	96.1	Very high	162 Å²	162	45.7 Å²	45.7	70%	0.704	23%	0.23	S	C	*	.			trans	-88.5	109.1	177.8	-174.1	178.2	-179.6	178	0	110.5	G248	G248-K250 VanDerWaalsContact C-N 3.33Å
251	H	97.6	Very high	95.9	Very high	48 Å²	48	46.7 Å²	46.7	22%	0.222	24%	0.235	C	C	.	.			trans	-146.1	152.3	177.5	-178.8	-97.5	0	0	0	110.8	M249 N253 V254 Y310	M249-H251 PolarHBondContact O-N 2.79Å; H251-N253 PolarHBondContact CE1-OD1 2.68Å; H251-N253 VanDerWaalsContact CE1-OD1 3.26Å; H251-N253 PolarHBondContact ND1-N 3.42Å; H251-N253 PolarHBondContact O-N 3.07Å; H251-V254 HydrophobicContact CB-CB 4.15Å; H251-V254 HydrophobicContact CB-CG2 4.05Å; H251-V254 PolarHBondContact O-N 2.71Å; H251-V254 VanDerWaalsContact O-N 3.13Å; H251-Y310 HydrophobicContact CB-CD1 3.49Å; H251-Y310 VanDerWaalsContact CB-CD1 3.49Å; H251-Y310 HydrophobicContact CB-CE1 3.45Å; H251-Y310 VanDerWaalsContact CB-CE1 3.45Å; H251-Y310 HydrophobicContact CB-CG 4.14Å; H251-Y310 AromaticContact CD2-CD2 3.84Å; H251-Y310 AromaticContact CD2-CG 3.79Å; H251-Y310 AromaticContact CG-CD1 3.67Å; H251-Y310 AromaticContact CG-CG 3.8Å
252	D	97.8	Very high	95.5	Very high	121 Å²	121	48.9 Å²	48.9	65%	0.647	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.5	-175.7	-77.3	-18.9	0	0	0	113.2	K339	D252-K339 VanDerWaalsContact O-CE 3.26Å; D252-K339 WeakPolarHBondContact O-CE 3.18Å; D252-K339 PolarHBondContact O-NZ 2.98Å
253	N	98.8	Very high	94.9	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.021	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	18	179.3	-52.3	110.6	0	0	0	113.7	H251 S303 R306 G307 T343 A344 C345 V346	H251-N253 PolarHBondContact CE1-OD1 2.68Å; H251-N253 VanDerWaalsContact CE1-OD1 3.26Å; H251-N253 PolarHBondContact ND1-N 3.42Å; H251-N253 PolarHBondContact O-N 3.07Å; N253-S303 WeakPolarHBondContact CB-O 3.41Å; N253-S303 VanDerWaalsContact ND2-CB 3.34Å; N253-S303 WeakPolarHBondContact ND2-CB 3.44Å; N253-S303 PolarHBondContact ND2-O 2.94Å; N253-R306 WeakPolarHBondContact OD1-CD 3.28Å; N253-G307 VanDerWaalsContact CB-CA 3.45Å; N253-G307 WeakPolarHBondContact O-CA 3.45Å; N253-T343 WeakPolarHBondContact ND2-CG2 3.34Å; N253-A344 WeakPolarHBondContact CA-O 3.26Å; N253-A344 WeakPolarHBondContact CB-O 3.43Å; N253-A344 PolarHBondContact ND2-O 3.18Å; N253-C345 CarbonylContact O-C 3.52Å; N253-C345 VanDerWaalsContact O-CA 3.24Å; N253-C345 WeakPolarHBondContact O-CA 3.38Å; N253-V346 PolarHBondContact O-N 3.33Å
254	V	98.6	Very high	94	Very high	5 Å²	5	53.1 Å²	53.1	3%	0.03	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-120.8	132.5	169.2	172.5	0	0	0	0	107.2	M249 H251 Q256 Y310 L311 F349	M249-V254 HydrophobicContact CE-CG1 4.23Å; H251-V254 HydrophobicContact CB-CB 4.15Å; H251-V254 HydrophobicContact CB-CG2 4.05Å; H251-V254 PolarHBondContact O-N 2.71Å; H251-V254 VanDerWaalsContact O-N 3.13Å; V254-Q256 PolarHBondContact O-N 2.82Å; V254-Y310 HydrophobicContact CG2-CD1 4.26Å; V254-L311 HydrophobicContact CG2-CD2 4.06Å; V254-L311 HydrophobicContact CG2-CG 4.06Å; V254-F349 HydrophobicContact CG1-CE2 4.22Å; V254-F349 HydrophobicContact CG1-CZ 3.81Å
255	L	98.4	Very high	92.6	Very high	9 Å²	9	56.8 Å²	56.8	5%	0.047	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-57.1	126.7	-175.5	178.4	61.3	0	0	0	110.6	Y244 F257 T275 A276 L337 V346 A347	Y244-L255 WeakPolarHBondContact CE1-O 3.35Å; L255-F257 PolarHBondContact O-N 2.89Å; L255-T275 HydrophobicContact CD2-CG2 3.99Å; L255-T275 HydrophobicContact CG-CG2 4.26Å; L255-A276 HydrophobicContact CD1-CB 4.3Å; L255-L337 HydrophobicContact CD1-CD1 3.96Å; L255-L337 HydrophobicContact CD2-CD1 3.85Å; L255-L337 HydrophobicContact CG-CD1 4.47Å; L255-V346 WeakPolarHBondContact CB-O 3.01Å; L255-V346 PolarHBondContact N-O 2.96Å; L255-A347 HydrophobicContact CB-CB 3.92Å; L255-A347 HydrophobicContact CD2-CB 3.62Å; L255-A347 HydrophobicContact CG-CB 4.38Å
256	Q	97.8	Very high	90.9	Very high	109 Å²	109	61.3 Å²	61.3	51%	0.509	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-67.9	117.7	-176.3	-179.4	179.7	3.5	0	0	111.4	V254 T275 A276	V254-Q256 PolarHBondContact O-N 2.82Å; Q256-T275 CarbonylContact O-C 3.56Å; Q256-T275 VanDerWaalsContact O-CA 3.22Å; Q256-T275 WeakPolarHBondContact O-CA 3.48Å; Q256-T275 WeakPolarHBondContact O-CB 3.32Å; Q256-A276 HydrophobicContact CB-CB 3.97Å; Q256-A276 PolarHBondContact O-N 3.27Å
257	F	97	Very high	89.4	Confident	59 Å²	59	68.1 Å²	68.1	26%	0.259	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	137.3	167.7	178.2	-111.1	0	0	0	111.4	Y241 Y244 L255 G259 V260 L273	Y241-F257 HydrophobicContact CD2-CE2 4.48Å; Y241-F257 AromaticContact CD2-CZ 3.86Å; Y241-F257 HydrophobicContact CD2-CZ 3.86Å; Y241-F257 HydrophobicContact CE2-CZ 4.08Å; Y244-F257 HydrophobicContact CD1-CB 3.54Å; Y244-F257 HydrophobicContact CD1-CD2 4.46Å; Y244-F257 HydrophobicContact CD1-CG 4.18Å; Y244-F257 HydrophobicContact CD2-CB 4.32Å; Y244-F257 AromaticContact CD2-CD2 3.72Å; Y244-F257 HydrophobicContact CD2-CD2 3.72Å; Y244-F257 HydrophobicContact CD2-CE2 4.37Å; Y244-F257 HydrophobicContact CD2-CG 4.23Å; Y244-F257 HydrophobicContact CE1-CB 3.98Å; Y244-F257 HydrophobicContact CE2-CD2 4.31Å; Y244-F257 HydrophobicContact CG-CB 3.72Å; Y244-F257 AromaticContact CG-CD2 3.79Å; Y244-F257 HydrophobicContact CG-CD2 3.79Å; Y244-F257 AromaticContact CG-CG 3.82Å; Y244-F257 HydrophobicContact CG-CG 3.82Å; L255-F257 PolarHBondContact O-N 2.89Å; F257-G259 VanDerWaalsContact CE2-C 3.49Å; F257-G259 VanDerWaalsContact CE2-O 3.25Å; F257-G259 WeakPolarHBondContact CE2-O 3.42Å; F257-G259 VanDerWaalsContact CZ-C 3.43Å; F257-G259 VanDerWaalsContact CZ-CA 3.41Å; F257-V260 HydrophobicContact CE2-CG1 3.84Å; F257-V260 HydrophobicContact CZ-CG1 3.91Å; F257-L273 HydrophobicContact CD2-CD2 4.49Å; F257-L273 HydrophobicContact CE2-CG 4.19Å
258	I	95.6	Very high	88.4	Confident	62 Å²	62	71.2 Å²	71.2	32%	0.318	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-43.9	178.8	-61	177.7	0	0	0	110.3	L219 V224 I274 T275	L219-I258 HydrophobicContact CD2-CG2 4.27Å; V224-I258 HydrophobicContact CB-CD1 4.12Å; V224-I258 HydrophobicContact CG1-CD1 3.5Å; V224-I258 VanDerWaalsContact CG1-CD1 3.5Å; I258-I274 HydrophobicContact CB-CB 4.3Å; I258-I274 HydrophobicContact CB-CG2 4Å; I258-I274 WeakPolarHBondContact CB-O 3.31Å; I258-I274 HydrophobicContact CD1-CG2 4.27Å; I258-I274 HydrophobicContact CG2-CG2 4.17Å; I258-I274 PolarHBondContact N-O 3.13Å; I258-T275 WeakPolarHBondContact CD1-O 3.42Å
259	G	93.9	Very high	87.9	Confident	7 Å²	7	74.5 Å²	74.5	7%	0.072	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.7	-176.6	-179.9	0	0	0	0	0	113.4	F257 I274	F257-G259 VanDerWaalsContact CE2-C 3.49Å; F257-G259 VanDerWaalsContact CE2-O 3.25Å; F257-G259 WeakPolarHBondContact CE2-O 3.42Å; F257-G259 VanDerWaalsContact CZ-C 3.43Å; F257-G259 VanDerWaalsContact CZ-CA 3.41Å; G259-I274 PolarHBondContact N-O 2.89Å; G259-I274 WeakPolarHBondContact O-CB 3.43Å; G259-I274 PolarHBondContact O-N 3.36Å
260	V	94.3	Very high	87.5	Confident	29 Å²	29	76.4 Å²	76.4	18%	0.176	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	153.6	172.5	-69.2	0	0	0	0	110.3	W237 Y241 F257 W272 L273	W237-V260 HydrophobicContact CH2-CG2 4.5Å; W237-V260 HydrophobicContact CZ2-CB 3.71Å; W237-V260 HydrophobicContact CZ2-CG1 3.95Å; W237-V260 HydrophobicContact CZ2-CG2 3.98Å; Y241-V260 HydrophobicContact CD2-CB 4.35Å; Y241-V260 HydrophobicContact CD2-CG1 3.56Å; Y241-V260 HydrophobicContact CD2-CG2 3.81Å; Y241-V260 HydrophobicContact CE2-CG1 4.27Å; Y241-V260 HydrophobicContact CE2-CG2 3.7Å; Y241-V260 HydrophobicContact CG-CG1 4.11Å; Y241-V260 HydrophobicContact CG-CG2 4.46Å; F257-V260 HydrophobicContact CE2-CG1 3.84Å; F257-V260 HydrophobicContact CZ-CG1 3.91Å; V260-W272 VanDerWaalsContact CA-O 3.25Å; V260-W272 WeakPolarHBondContact CA-O 3.28Å; V260-W272 WeakPolarHBondContact CB-O 3.36Å; V260-L273 HydrophobicContact CG1-CB 4.36Å; V260-L273 HydrophobicContact CG1-CD1 4.38Å; V260-L273 HydrophobicContact CG1-CG 4.19Å
261	E	89.4	Confident	87.4	Confident	26 Å²	26	68.8 Å²	68.8	12%	0.121	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	141.7	175.6	-166.6	-179.6	176.4	0	0	109.3	R263 W272	E261-R263 HydrophobicContact CG-CG 3.86Å; E261-R263 IonicContact OE1-CZ 2.75Å; E261-R263 IonicContact OE1-NH1 2.71Å; E261-R263 IonicContact OE2-NH1 3.37Å; E261-W272 HydrophobicContact CB-CB 4.1Å; E261-W272 PolarHBondContact N-O 3.45Å; E261-W272 WeakPolarHBondContact O-CB 3.32Å; E261-W272 PolarHBondContact O-N 2.78Å
262	K	88.4	Confident	87.3	Confident	127 Å²	127	67 Å²	67	55%	0.552	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	113	171.3	-64	-175.7	-179.2	171.8	0	107.3	W237 L269 L271	W237-K262 HydrophobicContact CH2-CD 4.42Å; W237-K262 HydrophobicContact CH2-CG 4.38Å; W237-K262 HydrophobicContact CZ2-CG 4.34Å; K262-L269 HydrophobicContact CB-CD1 4.44Å; K262-L271 HydrophobicContact CB-CD2 4.46Å; K262-L271 HydrophobicContact CD-CD2 4.13Å; K262-L271 HydrophobicContact CG-CD2 3.81Å
263	R	82.9	Confident	87.2	Confident	63 Å²	63	61.3 Å²	61.3	24%	0.238	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.7	-177.1	-62.5	-177.4	78	127.2	-5.6	109.8	E261 E270 W272	E261-R263 HydrophobicContact CG-CG 3.86Å; E261-R263 IonicContact OE1-CZ 2.75Å; E261-R263 IonicContact OE1-NH1 2.71Å; E261-R263 IonicContact OE2-NH1 3.37Å; R263-E270 HydrophobicContact CB-CB 4.49Å; R263-E270 PolarHBondContact N-O 3.43Å; R263-E270 PolarHBondContact O-N 2.64Å; R263-W272 VanDerWaalsContact CD-CE2 3.43Å; R263-W272 VanDerWaalsContact CD-CZ2 3.46Å; R263-W272 HydrophobicContact CG-CD2 4.46Å
264	N	77.8	Confident	87.1	Confident	123 Å²	123	61.2 Å²	61.2	66%	0.658	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.6	103.9	174	-173.1	0.8	0	0	0	108.4
265	N	67.6	Low	87	Confident	92 Å²	92	61.5 Å²	61.5	49%	0.492	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	72.5	176.7	-92.7	-6.1	0	0	0	109.5	L267 D268	N265-L267 PolarHBondContact O-N 3.19Å; N265-D268 PolarHBondContact N-O 3.49Å; N265-D268 VanDerWaalsContact N-O 3.1Å; N265-D268 PolarHBondContact O-N 2.82Å
266	N	59.3	Low	87	Confident	158 Å²	158	61.8 Å²	61.8	85%	0.845	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	43	-7.3	168.5	-68.4	-16.8	0	0	0	120.4
267	L	63.5	Low	87	Confident	160 Å²	160	58.4 Å²	58.4	84%	0.838	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.5	-31.8	-172.6	-70.5	172.8	0	0	0	110.6	N265	N265-L267 PolarHBondContact O-N 3.19Å
268	D	72.8	Confident	87	Confident	114 Å²	114	57.2 Å²	57.2	61%	0.61	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.6	143	178	-70.5	-52.6	0	0	0	113.4	N265	N265-D268 PolarHBondContact N-O 3.49Å; N265-D268 VanDerWaalsContact N-O 3.1Å; N265-D268 PolarHBondContact O-N 2.82Å
269	L	84.1	Confident	87	Confident	72 Å²	72	58.6 Å²	58.6	38%	0.377	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	115.5	170.9	175.3	61.2	0	0	0	109.2	I231 K262 L271	I231-L269 HydrophobicContact CD1-CB 4.39Å; I231-L269 HydrophobicContact CD1-CD2 3.62Å; I231-L269 HydrophobicContact CD1-CG 4.13Å; K262-L269 HydrophobicContact CB-CD1 4.44Å; L269-L271 HydrophobicContact CD2-CD2 4.45Å; L269-L271 HydrophobicContact CG-CD2 4.28Å
270	E	87	Confident	87.2	Confident	54 Å²	54	61.6 Å²	61.6	25%	0.252	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.9	175.1	-64.7	-176.8	170.9	0	0	110.7	I228 R263 W272	I228-E270 HydrophobicContact CG2-CB 4.18Å; I228-E270 HydrophobicContact CG2-CG 4.3Å; R263-E270 HydrophobicContact CB-CB 4.49Å; R263-E270 PolarHBondContact N-O 3.43Å; R263-E270 PolarHBondContact O-N 2.64Å; E270-W272 PolarHBondContact OE2-NE1 3.34Å
271	L	93.3	Very high	87.3	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	115.4	176.7	-55.4	173.3	0	0	0	108.3	F229 I231 K234 W237 K262 L269	F229-L271 HydrophobicContact CB-CB 4.22Å; F229-L271 WeakPolarHBondContact CD2-O 3.37Å; F229-L271 PolarHBondContact N-O 3.45Å; F229-L271 PolarHBondContact O-N 2.88Å; I231-L271 HydrophobicContact CD1-CD1 4.34Å; K234-L271 HydrophobicContact CB-CD1 3.71Å; K234-L271 HydrophobicContact CG-CD1 3.78Å; W237-L271 HydrophobicContact CB-CB 4.35Å; W237-L271 HydrophobicContact CB-CD1 4.22Å; W237-L271 HydrophobicContact CD2-CB 3.88Å; W237-L271 HydrophobicContact CD2-CD1 4.14Å; W237-L271 HydrophobicContact CD2-CG 4.43Å; W237-L271 HydrophobicContact CE3-CD1 4.17Å; W237-L271 HydrophobicContact CG-CB 3.72Å; W237-L271 HydrophobicContact CG-CD1 4.18Å; K262-L271 HydrophobicContact CB-CD2 4.46Å; K262-L271 HydrophobicContact CD-CD2 4.13Å; K262-L271 HydrophobicContact CG-CD2 3.81Å; L269-L271 HydrophobicContact CD2-CD2 4.45Å; L269-L271 HydrophobicContact CG-CD2 4.28Å
272	W	94.9	Very high	87.7	Confident	11 Å²	11	60.1 Å²	60.1	4%	0.042	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	137.4	-175.6	-69.3	23.5	0	0	0	109.8	L200 L202 V226 K227 I228 W237 V260 E261 R263 E270	L200-W272 HydrophobicContact CD1-CE3 4.23Å; L200-W272 HydrophobicContact CD1-CZ3 3.97Å; L200-W272 HydrophobicContact CD2-CE3 4.4Å; L200-W272 HydrophobicContact CD2-CH2 4.1Å; L200-W272 HydrophobicContact CD2-CZ3 3.45Å; L200-W272 VanDerWaalsContact CD2-CZ3 3.45Å; L200-W272 HydrophobicContact CG-CZ3 4.27Å; L202-W272 HydrophobicContact CD1-CH2 4.07Å; L202-W272 HydrophobicContact CD1-CZ2 4.09Å; L202-W272 HydrophobicContact CD2-CH2 4.02Å; L202-W272 HydrophobicContact CD2-CZ3 4.35Å; L202-W272 HydrophobicContact CG-CH2 4.05Å; V226-W272 HydrophobicContact CG1-CB 4.17Å; V226-W272 HydrophobicContact CG1-CD2 3.71Å; V226-W272 HydrophobicContact CG1-CE3 3.57Å; V226-W272 HydrophobicContact CG1-CG 4.04Å; V226-W272 HydrophobicContact CG1-CZ3 4.17Å; K227-W272 WeakPolarHBondContact O-CA 3.48Å; I228-W272 HydrophobicContact CD1-CZ2 3.94Å; I228-W272 HydrophobicContact CG1-CD2 4.34Å; I228-W272 HydrophobicContact CG1-CG 4.25Å; W237-W272 PolarHBondContact NE1-O 2.94Å; W237-W272 VanDerWaalsContact NE1-O 3.07Å; V260-W272 VanDerWaalsContact CA-O 3.25Å; V260-W272 WeakPolarHBondContact CA-O 3.28Å; V260-W272 WeakPolarHBondContact CB-O 3.36Å; E261-W272 HydrophobicContact CB-CB 4.1Å; E261-W272 PolarHBondContact N-O 3.45Å; E261-W272 WeakPolarHBondContact O-CB 3.32Å; E261-W272 PolarHBondContact O-N 2.78Å; R263-W272 VanDerWaalsContact CD-CE2 3.43Å; R263-W272 VanDerWaalsContact CD-CZ2 3.46Å; R263-W272 HydrophobicContact CG-CD2 4.46Å; E270-W272 PolarHBondContact OE2-NE1 3.34Å
273	L	96.1	Very high	88.2	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	124.4	170.3	-171	147.4	0	0	0	108.3	K227 F229 E240 Y244 F257 V260 T275	K227-L273 HydrophobicContact CB-CB 4.46Å; K227-L273 PolarHBondContact N-O 3.22Å; K227-L273 PolarHBondContact O-N 2.86Å; F229-L273 HydrophobicContact CE2-CB 3.86Å; E240-L273 HydrophobicContact CB-CD1 3.84Å; E240-L273 HydrophobicContact CG-CD1 3.66Å; Y244-L273 HydrophobicContact CD2-CD1 4.2Å; Y244-L273 HydrophobicContact CD2-CD2 4.34Å; Y244-L273 HydrophobicContact CE2-CD1 4.37Å; Y244-L273 HydrophobicContact CE2-CD2 3.89Å; F257-L273 HydrophobicContact CD2-CD2 4.49Å; F257-L273 HydrophobicContact CE2-CG 4.19Å; V260-L273 HydrophobicContact CG1-CB 4.36Å; V260-L273 HydrophobicContact CG1-CD1 4.38Å; V260-L273 HydrophobicContact CG1-CG 4.19Å; L273-T275 HydrophobicContact CD2-CG2 3.64Å
274	I	96.6	Very high	88.9	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125	-169.6	-49.1	172.2	0	0	0	108.9	L200 V224 A225 V226 I258 G259	L200-I274 HydrophobicContact CD1-CD1 3.74Å; L200-I274 HydrophobicContact CD1-CG1 4.48Å; V224-I274 HydrophobicContact CB-CG2 4Å; V224-I274 HydrophobicContact CG2-CG2 3.94Å; A225-I274 WeakPolarHBondContact O-CA 3.44Å; V226-I274 HydrophobicContact CG2-CG1 4.42Å; V226-I274 HydrophobicContact CG2-CG2 4.46Å; I258-I274 HydrophobicContact CB-CB 4.3Å; I258-I274 HydrophobicContact CB-CG2 4Å; I258-I274 WeakPolarHBondContact CB-O 3.31Å; I258-I274 HydrophobicContact CD1-CG2 4.27Å; I258-I274 HydrophobicContact CG2-CG2 4.17Å; I258-I274 PolarHBondContact N-O 3.13Å; G259-I274 PolarHBondContact N-O 2.89Å; G259-I274 WeakPolarHBondContact O-CB 3.43Å; G259-I274 PolarHBondContact O-N 3.36Å
275	T	97.6	Very high	89.8	Confident	10 Å²	10	49.7 Å²	49.7	6%	0.061	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	169.8	179.3	54.6	0	0	0	0	111.3	V224 A225 Y244 L255 Q256 I258 L273	V224-T275 WeakPolarHBondContact CB-O 3.43Å; A225-T275 PolarHBondContact N-O 3.47Å; A225-T275 PolarHBondContact O-N 3.5Å; Y244-T275 HydrophobicContact CE2-CG2 4.24Å; L255-T275 HydrophobicContact CD2-CG2 3.99Å; L255-T275 HydrophobicContact CG-CG2 4.26Å; Q256-T275 CarbonylContact O-C 3.56Å; Q256-T275 VanDerWaalsContact O-CA 3.22Å; Q256-T275 WeakPolarHBondContact O-CA 3.48Å; Q256-T275 WeakPolarHBondContact O-CB 3.32Å; I258-T275 WeakPolarHBondContact CD1-O 3.42Å; L273-T275 HydrophobicContact CD2-CG2 3.64Å
276	A	97.5	Very high	91.3	Very high	15 Å²	15	46.4 Å²	46.4	12%	0.124	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	142.4	171	0	0	0	0	0	111.3	L255 Q256	L255-A276 HydrophobicContact CD1-CB 4.3Å; Q256-A276 HydrophobicContact CB-CB 3.97Å; Q256-A276 PolarHBondContact O-N 3.27Å
277	Y	97.7	Very high	93.2	Very high	39 Å²	39	38.9 Å²	38.9	15%	0.153	20%	0.203	C	C	.	.			trans	-96.1	140.8	172.8	-174.3	-106	0	0	0	110.9	K206 K216 Y223 A225 D279	K206-Y277 WeakPolarHBondContact CE-OH 3.42Å; K206-Y277 HydrophobicContact CG-CE2 4.13Å; K216-Y277 HydrophobicContact CB-CD2 4.36Å; K216-Y277 HydrophobicContact CB-CE2 3.95Å; K216-Y277 HydrophobicContact CD-CD1 4.22Å; K216-Y277 HydrophobicContact CD-CE1 3.57Å; K216-Y277 HydrophobicContact CD-CE2 4.31Å; K216-Y277 VanDerWaalsContact CE-CE1 3.49Å; K216-Y277 HydrophobicContact CG-CD1 4.22Å; K216-Y277 HydrophobicContact CG-CD2 4.27Å; K216-Y277 HydrophobicContact CG-CE1 3.96Å; K216-Y277 HydrophobicContact CG-CE2 4.06Å; K216-Y277 HydrophobicContact CG-CG 4.37Å; Y223-Y277 WeakPolarHBondContact O-CB 3.49Å; A225-Y277 HydrophobicContact CB-CD2 4.21Å; Y277-D279 HydrophobicContact CE1-CB 4.38Å; Y277-D279 VanDerWaalsContact CE1-OD1 3.31Å; Y277-D279 WeakPolarHBondContact CE1-OD1 3.32Å
278	H	97.5	Very high	94.8	Very high	33 Å²	33	37.1 Å²	37.1	15%	0.153	19%	0.189	C	C	.	.			trans	-128.5	117.9	175.7	-63.5	-34.4	0	0	0	109.8	K280 G281 L338	H278-K280 VanDerWaalsContact C-N 3.27Å; H278-K280 PolarHBondContact O-N 3.47Å; H278-G281 PolarHBondContact O-N 3.31Å; H278-L338 WeakPolarHBondContact CB-O 3.31Å
279	D	95.9	Very high	95.9	Very high	91 Å²	91	35.5 Å²	35.5	49%	0.487	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-27.2	-172.7	-69.8	-81.1	0	0	0	113.4	K216 Y277 G281	K216-D279 IonicContact NZ-OD1 3.86Å; K216-D279 PolarHBondContact NZ-OD1 3.21Å; Y277-D279 HydrophobicContact CE1-CB 4.38Å; Y277-D279 VanDerWaalsContact CE1-OD1 3.31Å; Y277-D279 WeakPolarHBondContact CE1-OD1 3.32Å; D279-G281 PolarHBondContact O-N 3.36Å
280	K	96.8	Very high	96.6	Very high	70 Å²	70	35 Å²	35	30%	0.304	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-9	174.6	-70.2	-174.2	-178.2	-81	0	113.5	H278 Y286 L338 K339 N340 L342	H278-K280 VanDerWaalsContact C-N 3.27Å; H278-K280 PolarHBondContact O-N 3.47Å; K280-Y286 HydrophobicContact CB-CD2 4.24Å; K280-Y286 HydrophobicContact CD-CD2 4.22Å; K280-Y286 HydrophobicContact CD-CE2 3.87Å; K280-Y286 HydrophobicContact CG-CD2 4.41Å; K280-Y286 HydrophobicContact CG-CE2 4.35Å; K280-L338 HydrophobicContact CB-CB 4.04Å; K280-L338 HydrophobicContact CD-CB 4.43Å; K280-K339 WeakPolarHBondContact CD-O 3.19Å; K280-N340 WeakPolarHBondContact CE-O 3.12Å; K280-L342 HydrophobicContact CD-CD2 3.61Å
281	G	96.8	Very high	97.1	Very high	21 Å²	21	35.5 Å²	35.5	22%	0.216	20%	0.196	C	C	.	.			trans	66.8	-149.4	175.3	0	0	0	0	0	113.4	H278 D279 L337 L338	H278-G281 PolarHBondContact O-N 3.31Å; D279-G281 PolarHBondContact O-N 3.36Å; G281-L337 WeakPolarHBondContact O-CA 3.47Å; G281-L338 PolarHBondContact O-N 3.39Å
282	S	98.1	Very high	97.3	Very high	4 Å²	4	35.5 Å²	35.5	3%	0.028	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-78.6	158.3	178.1	73.5	0	0	0	0	112.1	T284 D285 Y286 K334 V336	S282-T284 PolarHBondContact O-N 3.42Å; S282-D285 PolarHBondContact N-OD2 3.19Å; S282-D285 PolarHBondContact O-N 3.33Å; S282-D285 VanDerWaalsContact O-N 3.13Å; S282-D285 PolarHBondContact OG-N 2.55Å; S282-D285 PolarHBondContact OG-OD2 2.6Å; S282-Y286 PolarHBondContact O-N 3.49Å; S282-K334 VanDerWaalsContact CB-O 3.3Å; S282-K334 WeakPolarHBondContact CB-O 3.25Å; S282-V336 CarbonylContact C-O 3.57Å; S282-V336 WeakPolarHBondContact CA-O 3.49Å
283	L	98.7	Very high	97.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60	-36.8	174.3	178.2	62.2	0	0	0	110.7	D285 Y286 L287 I300 S333 V336 L338 V401 L405	L283-D285 PolarHBondContact O-N 3.49Å; L283-Y286 PolarHBondContact O-N 3.14Å; L283-L287 HydrophobicContact CD1-CD1 3.79Å; L283-L287 HydrophobicContact CD1-CD2 4.12Å; L283-L287 HydrophobicContact CD1-CG 3.68Å; L283-L287 HydrophobicContact CD2-CD1 4.41Å; L283-L287 HydrophobicContact CG-CD1 3.78Å; L283-L287 HydrophobicContact CG-CG 4.08Å; L283-L287 WeakPolarHBondContact O-CB 3.23Å; L283-L287 VanDerWaalsContact O-CG 3.24Å; L283-L287 WeakPolarHBondContact O-CG 3.28Å; L283-L287 PolarHBondContact O-N 3.28Å; L283-I300 HydrophobicContact CD1-CG2 4.04Å; L283-I300 HydrophobicContact CD2-CG2 4.34Å; L283-S333 WeakPolarHBondContact CB-O 3.46Å; L283-S333 PolarHBondContact N-O 3.39Å; L283-V336 HydrophobicContact CB-CB 4.16Å; L283-V336 HydrophobicContact CB-CG1 4.33Å; L283-V336 HydrophobicContact CD2-CG1 4.4Å; L283-V336 PolarHBondContact N-O 3.26Å; L283-L338 HydrophobicContact CD1-CD1 3.96Å; L283-L338 HydrophobicContact CD1-CD2 4.34Å; L283-L338 HydrophobicContact CD1-CG 4.44Å; L283-V401 HydrophobicContact CD2-CG1 3.78Å; L283-L405 HydrophobicContact CD1-CD2 3.88Å; L283-L405 HydrophobicContact CD2-CD1 4.37Å; L283-L405 HydrophobicContact CD2-CD2 4.22Å; L283-L405 HydrophobicContact CD2-CG 4.15Å
284	T	98	Very high	97.4	Very high	8 Å²	8	37.6 Å²	37.6	5%	0.049	21%	0.209	C	C	.	.	H	α-helix	trans	-55.6	-51.1	171.8	-54.9	0	0	0	0	111.8	S282 Y286 L287 K288 S333 K334 Y419	S282-T284 PolarHBondContact O-N 3.42Å; T284-Y286 VanDerWaalsContact C-N 3.3Å; T284-Y286 PolarHBondContact O-N 3.35Å; T284-L287 PolarHBondContact O-N 3.02Å; T284-K288 HydrophobicContact CG2-CD 4.24Å; T284-K288 WeakPolarHBondContact O-CG 3.46Å; T284-K288 PolarHBondContact O-N 3.17Å; T284-S333 PolarHBondContact N-O 3.07Å; T284-S333 WeakPolarHBondContact OG1-CB 3.4Å; T284-S333 PolarHBondContact OG1-OG 2.92Å; T284-K334 VanDerWaalsContact OG1-CA 3.3Å; T284-K334 WeakPolarHBondContact OG1-CA 3.48Å; T284-K334 PolarHBondContact OG1-N 2.7Å; T284-Y419 HydrophobicContact CG2-CE1 4Å
285	D	96.5	Very high	97.4	Very high	86 Å²	86	41.4 Å²	41.4	46%	0.46	23%	0.229	S	C	.	.	H	α-helix	trans	-65.7	-38.5	-177.3	-57.4	-43	0	0	0	110.7	S282 L283 A289	S282-D285 PolarHBondContact N-OD2 3.19Å; S282-D285 PolarHBondContact O-N 3.33Å; S282-D285 VanDerWaalsContact O-N 3.13Å; S282-D285 PolarHBondContact OG-N 2.55Å; S282-D285 PolarHBondContact OG-OD2 2.6Å; L283-D285 PolarHBondContact O-N 3.49Å; D285-A289 PolarHBondContact O-N 2.98Å
286	Y	98.4	Very high	97.5	Very high	22 Å²	22	44.1 Å²	44.1	9%	0.086	24%	0.242	C	C	.	.	H	α-helix	trans	-63.6	-48.8	177	-168.6	-96.5	0	0	0	112	K280 S282 L283 T284 K288 A289 N290 V292 L338 L342	K280-Y286 HydrophobicContact CB-CD2 4.24Å; K280-Y286 HydrophobicContact CD-CD2 4.22Å; K280-Y286 HydrophobicContact CD-CE2 3.87Å; K280-Y286 HydrophobicContact CG-CD2 4.41Å; K280-Y286 HydrophobicContact CG-CE2 4.35Å; S282-Y286 PolarHBondContact O-N 3.49Å; L283-Y286 PolarHBondContact O-N 3.14Å; T284-Y286 VanDerWaalsContact C-N 3.3Å; T284-Y286 PolarHBondContact O-N 3.35Å; Y286-K288 VanDerWaalsContact C-N 3.33Å; Y286-K288 PolarHBondContact O-N 3.29Å; Y286-A289 PolarHBondContact O-N 3.26Å; Y286-N290 HydrophobicContact CD1-CB 4.22Å; Y286-N290 HydrophobicContact CE1-CB 3.89Å; Y286-N290 HydrophobicContact CE2-CB 4.49Å; Y286-N290 VanDerWaalsContact O-CB 3.31Å; Y286-N290 WeakPolarHBondContact O-CB 3.36Å; Y286-N290 PolarHBondContact O-N 3.12Å; Y286-N290 PolarHBondContact O-ND2 2.92Å; Y286-V292 HydrophobicContact CE1-CG1 3.97Å; Y286-L338 HydrophobicContact CD1-CD1 3.66Å; Y286-L338 HydrophobicContact CD2-CD1 4Å; Y286-L338 HydrophobicContact CE1-CD1 4.32Å; Y286-L338 HydrophobicContact CG-CD1 3.48Å; Y286-L338 VanDerWaalsContact CG-CD1 3.48Å; Y286-L342 HydrophobicContact CE1-CD2 4.07Å; Y286-L342 HydrophobicContact CE2-CD2 3.92Å; Y286-L342 WeakPolarHBondContact OH-CD2 3.33Å
287	L	98.6	Very high	97.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-70.6	-26.4	-177.2	-69.6	-177.7	0	0	0	113.5	L283 T284 A289 N290 V292 E404 L405 R408 Y419	L283-L287 HydrophobicContact CD1-CD1 3.79Å; L283-L287 HydrophobicContact CD1-CD2 4.12Å; L283-L287 HydrophobicContact CD1-CG 3.68Å; L283-L287 HydrophobicContact CD2-CD1 4.41Å; L283-L287 HydrophobicContact CG-CD1 3.78Å; L283-L287 HydrophobicContact CG-CG 4.08Å; L283-L287 WeakPolarHBondContact O-CB 3.23Å; L283-L287 VanDerWaalsContact O-CG 3.24Å; L283-L287 WeakPolarHBondContact O-CG 3.28Å; L283-L287 PolarHBondContact O-N 3.28Å; T284-L287 PolarHBondContact O-N 3.02Å; L287-A289 VanDerWaalsContact C-N 3.34Å; L287-N290 CarbonylContact C-O 3.58Å; L287-V292 HydrophobicContact CD2-CG1 4.17Å; L287-E404 HydrophobicContact CD1-CB 4.14Å; L287-L405 HydrophobicContact CD1-CD2 4.34Å; L287-L405 HydrophobicContact CD2-CD2 4.32Å; L287-R408 HydrophobicContact CB-CG 4.2Å; L287-R408 HydrophobicContact CD2-CB 3.9Å; L287-R408 HydrophobicContact CD2-CG 4.36Å; L287-R408 PolarHBondContact O-NE 3.26Å; L287-R408 PolarHBondContact O-NH2 3.01Å; L287-Y419 HydrophobicContact CB-CD2 3.67Å; L287-Y419 HydrophobicContact CB-CE2 3.94Å; L287-Y419 HydrophobicContact CD1-CE2 4.25Å
288	K	97.6	Very high	97.6	Very high	124 Å²	124	41.7 Å²	41.7	54%	0.539	23%	0.229	S	C	.	.	H	α-helix	trans	-63.5	-39.8	169.4	-78.6	176.5	177.7	-175.5	0	112.7	T284 Y286 Y419	T284-K288 HydrophobicContact CG2-CD 4.24Å; T284-K288 WeakPolarHBondContact O-CG 3.46Å; T284-K288 PolarHBondContact O-N 3.17Å; Y286-K288 VanDerWaalsContact C-N 3.33Å; Y286-K288 PolarHBondContact O-N 3.29Å; K288-Y419 HydrophobicContact CD-CD1 4.17Å; K288-Y419 HydrophobicContact CD-CE1 4.37Å; K288-Y419 HydrophobicContact CG-CD1 3.31Å; K288-Y419 HydrophobicContact CG-CE1 3.86Å; K288-Y419 HydrophobicContact CG-CG 3.81Å
289	A	97.3	Very high	97.6	Very high	79 Å²	79	43 Å²	43	65%	0.653	24%	0.235	S	C	*	.	H	α-helix	trans	-95.3	-17.5	-175.1	0	0	0	0	0	113.8	D285 Y286 L287	D285-A289 PolarHBondContact O-N 2.98Å; Y286-A289 PolarHBondContact O-N 3.26Å; L287-A289 VanDerWaalsContact C-N 3.34Å
290	N	98.1	Very high	97.7	Very high	63 Å²	63	38.6 Å²	38.6	34%	0.337	21%	0.212	S	C	.	.			trans	-136.4	158.9	-170.4	-53.6	-89.2	0	0	0	111.3	Y286 L287 R408	Y286-N290 HydrophobicContact CD1-CB 4.22Å; Y286-N290 HydrophobicContact CE1-CB 3.89Å; Y286-N290 HydrophobicContact CE2-CB 4.49Å; Y286-N290 VanDerWaalsContact O-CB 3.31Å; Y286-N290 WeakPolarHBondContact O-CB 3.36Å; Y286-N290 PolarHBondContact O-N 3.12Å; Y286-N290 PolarHBondContact O-ND2 2.92Å; L287-N290 CarbonylContact C-O 3.58Å; N290-R408 PolarHBondContact O-NE 2.84Å; N290-R408 PolarHBondContact O-NH2 3.37Å
291	V	97.8	Very high	97.8	Very high	64 Å²	64	35.3 Å²	35.3	39%	0.388	20%	0.197	S	C	.	.			trans	-105.6	162.4	161.9	-65.6	0	0	0	0	108.5	R408 T410 V416	V291-R408 WeakPolarHBondContact CA-O 3.42Å; V291-R408 WeakPolarHBondContact CB-O 3.4Å; V291-T410 HydrophobicContact CB-CG2 3.79Å; V291-T410 HydrophobicContact CG2-CG2 3.57Å; V291-V416 HydrophobicContact CG1-CB 4.2Å; V291-V416 HydrophobicContact CG1-CG1 3.86Å
292	V	97.8	Very high	97.9	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-121.5	142.3	179.1	-66	0	0	0	0	111	Y286 L287 E296 L297 I300 R408 C409 T410	Y286-V292 HydrophobicContact CE1-CG1 3.97Å; L287-V292 HydrophobicContact CD2-CG1 4.17Å; V292-E296 HydrophobicContact CB-CB 4.12Å; V292-E296 HydrophobicContact CG1-CB 4.48Å; V292-L297 HydrophobicContact CG2-CB 4.08Å; V292-I300 HydrophobicContact CG1-CD1 4.1Å; V292-R408 PolarHBondContact N-O 3.12Å; V292-C409 CarbonylContact O-C 3.32Å; V292-C409 VanDerWaalsContact O-CA 3.26Å; V292-C409 WeakPolarHBondContact O-CA 3.36Å; V292-T410 PolarHBondContact O-N 2.64Å
293	S	96.9	Very high	98	Very high	38 Å²	38	35.6 Å²	35.6	27%	0.266	19%	0.194	S	C	.	.			trans	-71	166.5	166.3	65	0	0	0	0	111.1	N295 E296 L297	S293-N295 VanDerWaalsContact C-N 3.29Å; S293-N295 PolarHBondContact O-N 2.94Å; S293-E296 WeakPolarHBondContact CB-OE2 3.05Å; S293-E296 PolarHBondContact N-OE2 3.08Å; S293-E296 PolarHBondContact O-N 3.13Å; S293-E296 VanDerWaalsContact OG-CG 3.28Å; S293-E296 WeakPolarHBondContact OG-CG 3.36Å; S293-E296 PolarHBondContact OG-N 2.67Å; S293-E296 PolarHBondContact OG-OE2 3.4Å; S293-L297 WeakPolarHBondContact O-CB 3.45Å; S293-L297 PolarHBondContact O-N 2.78Å
294	W	96.3	Very high	98	Very high	20 Å²	20	35.8 Å²	35.8	8%	0.076	20%	0.195	C	C	.	.	H	α-helix	trans	-52.3	-46.4	174.1	176.9	-115.2	0	0	0	112.9	L297 C298 A411 H456 G458 L459 L462 M490 A494	W294-L297 HydrophobicContact CE3-CD2 4.45Å; W294-L297 HydrophobicContact CZ3-CD2 4.09Å; W294-L297 WeakPolarHBondContact O-CB 3.3Å; W294-L297 PolarHBondContact O-N 3.16Å; W294-C298 WeakPolarHBondContact CZ2-SG 3.48Å; W294-C298 PolarHBondContact O-N 3.3Å; W294-C298 PolarHBondContact O-SG 3.12Å; W294-C298 VanDerWaalsContact O-SG 3.41Å; W294-A411 HydrophobicContact CB-CB 3.78Å; W294-A411 HydrophobicContact CE3-CB 4.34Å; W294-A411 HydrophobicContact CG-CB 4.47Å; W294-H456 AromaticContact CD2-CE1 3.58Å; W294-H456 AromaticContact CE2-CE1 3.89Å; W294-H456 AromaticContact CE3-CE1 3.82Å; W294-H456 AromaticContact CG-CE1 3.9Å; W294-G458 VanDerWaalsContact CH2-CA 3.41Å; W294-G458 WeakPolarHBondContact CH2-O 3.39Å; W294-G458 VanDerWaalsContact CZ2-CA 3.41Å; W294-L459 HydrophobicContact CE3-CD2 4.11Å; W294-L459 HydrophobicContact CE3-CG 4.09Å; W294-L459 HydrophobicContact CZ3-CD2 3.8Å; W294-L459 HydrophobicContact CZ3-CG 3.94Å; W294-L462 HydrophobicContact CZ3-CD2 4.46Å; W294-M490 HydrophobicContact CH2-CB 4.4Å; W294-M490 HydrophobicContact CH2-SD 4.38Å; W294-M490 HydrophobicContact CZ2-CB 3.99Å; W294-A494 HydrophobicContact CZ2-CB 4.47Å
295	N	96.6	Very high	98	Very high	81 Å²	81	35.4 Å²	35.4	43%	0.433	19%	0.192	S	C	.	.	H	α-helix	trans	-68.3	-39.1	-177.1	-71	-41.3	0	0	0	112.1	S293 C298 H299	S293-N295 VanDerWaalsContact C-N 3.29Å; S293-N295 PolarHBondContact O-N 2.94Å; N295-C298 PolarHBondContact O-N 2.88Å; N295-H299 WeakPolarHBondContact O-CB 3.38Å; N295-H299 PolarHBondContact O-N 3.09Å
296	E	98.3	Very high	98.1	Very high	68 Å²	68	35.8 Å²	35.8	32%	0.318	19%	0.188	S	C	.	.	H	α-helix	trans	-66.5	-40.7	175	-69.1	167.9	132.5	0	0	111	V292 S293 H299 I300 L342	V292-E296 HydrophobicContact CB-CB 4.12Å; V292-E296 HydrophobicContact CG1-CB 4.48Å; S293-E296 WeakPolarHBondContact CB-OE2 3.05Å; S293-E296 PolarHBondContact N-OE2 3.08Å; S293-E296 PolarHBondContact O-N 3.13Å; S293-E296 VanDerWaalsContact OG-CG 3.28Å; S293-E296 WeakPolarHBondContact OG-CG 3.36Å; S293-E296 PolarHBondContact OG-N 2.67Å; S293-E296 PolarHBondContact OG-OE2 3.4Å; E296-H299 PolarHBondContact O-N 2.78Å; E296-I300 WeakPolarHBondContact O-CB 3.2Å; E296-I300 WeakPolarHBondContact O-CD1 3.42Å; E296-I300 VanDerWaalsContact O-CG1 3.23Å; E296-I300 WeakPolarHBondContact O-CG1 3.34Å; E296-I300 PolarHBondContact O-N 3.12Å; E296-L342 HydrophobicContact CB-CD1 4.03Å; E296-L342 HydrophobicContact CG-CD1 3.71Å; E296-L342 WeakPolarHBondContact OE1-CD1 3.46Å
297	L	98.5	Very high	98.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-56.1	-53.5	172.2	-179.6	154.4	0	0	0	110.8	V292 S293 W294 H299 I300 A301 L405 C409 L459 L462	V292-L297 HydrophobicContact CG2-CB 4.08Å; S293-L297 WeakPolarHBondContact O-CB 3.45Å; S293-L297 PolarHBondContact O-N 2.78Å; W294-L297 HydrophobicContact CE3-CD2 4.45Å; W294-L297 HydrophobicContact CZ3-CD2 4.09Å; W294-L297 WeakPolarHBondContact O-CB 3.3Å; W294-L297 PolarHBondContact O-N 3.16Å; L297-H299 VanDerWaalsContact C-N 3.29Å; L297-H299 PolarHBondContact O-N 2.95Å; L297-I300 PolarHBondContact O-N 2.88Å; L297-A301 WeakPolarHBondContact O-CB 3.22Å; L297-A301 PolarHBondContact O-N 3.09Å; L297-L405 HydrophobicContact CD1-CB 4Å; L297-L405 HydrophobicContact CG-CB 4.05Å; L297-C409 HydrophobicContact CD1-CB 3.68Å; L297-L459 HydrophobicContact CD1-CD2 4.47Å; L297-L462 HydrophobicContact CD1-CD2 3.99Å; L297-L462 HydrophobicContact CD2-CD2 3.67Å; L297-L462 HydrophobicContact CG-CD2 4.47Å
298	C	98.4	Very high	98.2	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.007	18%	0.184	C	C	.	.	H	α-helix	trans	-58.4	-43.4	179.8	-71.5	0	0	0	0	111.5	W294 N295 A301 Q302 I487 Q491	W294-C298 WeakPolarHBondContact CZ2-SG 3.48Å; W294-C298 PolarHBondContact O-N 3.3Å; W294-C298 PolarHBondContact O-SG 3.12Å; W294-C298 VanDerWaalsContact O-SG 3.41Å; N295-C298 PolarHBondContact O-N 2.88Å; C298-A301 PolarHBondContact O-N 3.49Å; C298-Q302 WeakPolarHBondContact O-CB 3.45Å; C298-Q302 PolarHBondContact O-N 3.23Å; C298-I487 HydrophobicContact CB-CG2 4.17Å; C298-I487 WeakPolarHBondContact O-CG2 3.44Å; C298-Q491 HydrophobicContact CB-CB 4.17Å; C298-Q491 HydrophobicContact CB-CG 4.15Å
299	H	98.4	Very high	98.2	Very high	60 Å²	60	29.7 Å²	29.7	28%	0.278	17%	0.165	S	C	.	.	H	α-helix	trans	-63.5	-46.6	179.3	-178.1	69.7	0	0	0	112.4	N295 E296 L297 S303 N341 T343	N295-H299 WeakPolarHBondContact O-CB 3.38Å; N295-H299 PolarHBondContact O-N 3.09Å; E296-H299 PolarHBondContact O-N 2.78Å; L297-H299 VanDerWaalsContact C-N 3.29Å; L297-H299 PolarHBondContact O-N 2.95Å; H299-S303 VanDerWaalsContact O-CB 3.26Å; H299-S303 WeakPolarHBondContact O-CB 3.14Å; H299-S303 PolarHBondContact O-N 2.79Å; H299-S303 PolarHBondContact O-OG 3.24Å; H299-N341 PolarHBondContact CD2-O 3.42Å; H299-N341 PolarHBondContact NE2-O 3.16Å; H299-T343 PolarHBondContact NE2-N 3.34Å; H299-T343 PolarHBondContact NE2-OG1 2.86Å
300	I	98.8	Very high	98.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-49.1	177.3	-66.5	163.5	0	0	0	110.2	L283 V292 E296 L297 S303 A304 L338 L342 A344 L405	L283-I300 HydrophobicContact CD1-CG2 4.04Å; L283-I300 HydrophobicContact CD2-CG2 4.34Å; V292-I300 HydrophobicContact CG1-CD1 4.1Å; E296-I300 WeakPolarHBondContact O-CB 3.2Å; E296-I300 WeakPolarHBondContact O-CD1 3.42Å; E296-I300 VanDerWaalsContact O-CG1 3.23Å; E296-I300 WeakPolarHBondContact O-CG1 3.34Å; E296-I300 PolarHBondContact O-N 3.12Å; L297-I300 PolarHBondContact O-N 2.88Å; I300-S303 PolarHBondContact O-N 3.41Å; I300-S303 PolarHBondContact O-OG 3.07Å; I300-A304 WeakPolarHBondContact O-CB 3.45Å; I300-A304 PolarHBondContact O-N 3.13Å; I300-L338 HydrophobicContact CD1-CD1 4.39Å; I300-L338 HydrophobicContact CG1-CD2 4.18Å; I300-L338 HydrophobicContact CG2-CD2 3.9Å; I300-L342 HydrophobicContact CD1-CB 4.34Å; I300-L342 HydrophobicContact CG1-CB 4.01Å; I300-L342 WeakPolarHBondContact CG1-O 3.16Å; I300-A344 HydrophobicContact CG2-CB 4.28Å; I300-L405 HydrophobicContact CB-CD2 4.25Å; I300-L405 HydrophobicContact CD1-CD2 4.3Å; I300-L405 HydrophobicContact CG2-CD1 4.06Å; I300-L405 HydrophobicContact CG2-CD2 3.86Å
301	A	98.8	Very high	98.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.3	-46.3	-177.5	0	0	0	0	0	111.8	L297 C298 A304 A305 L402 L405 I487	L297-A301 WeakPolarHBondContact O-CB 3.22Å; L297-A301 PolarHBondContact O-N 3.09Å; C298-A301 PolarHBondContact O-N 3.49Å; A301-A304 PolarHBondContact O-N 2.99Å; A301-A305 VanDerWaalsContact O-CB 3.26Å; A301-A305 WeakPolarHBondContact O-CB 3.12Å; A301-A305 PolarHBondContact O-N 2.75Å; A301-L402 HydrophobicContact CB-CD2 3.68Å; A301-L405 HydrophobicContact CB-CD1 3.95Å; A301-I487 HydrophobicContact CB-CD1 3.64Å; A301-I487 HydrophobicContact CB-CG1 4.42Å; A301-I487 HydrophobicContact CB-CG2 4.32Å
302	Q	98.6	Very high	98.3	Very high	26 Å²	26	22.1 Å²	22.1	12%	0.121	11%	0.108	C	C	.	.	H	α-helix	trans	-63.6	-46.1	178.5	-174.9	-174.3	54.8	0	0	111.2	C298 A304 A305 R306 E484 I487 S488	C298-Q302 WeakPolarHBondContact O-CB 3.45Å; C298-Q302 PolarHBondContact O-N 3.23Å; Q302-A304 PolarHBondContact O-N 2.88Å; Q302-A305 PolarHBondContact O-N 2.96Å; Q302-R306 WeakPolarHBondContact O-CB 3.46Å; Q302-R306 PolarHBondContact O-N 3.2Å; Q302-E484 HydrophobicContact CG-CG 3.96Å; Q302-I487 HydrophobicContact CB-CB 4.4Å; Q302-I487 HydrophobicContact CB-CG2 3.81Å; Q302-S488 VanDerWaalsContact NE2-CB 3.29Å; Q302-S488 PolarHBondContact NE2-OG 2.64Å
303	S	98.8	Very high	98.3	Very high	6 Å²	6	27.2 Å²	27.2	4%	0.042	13%	0.132	C	C	.	.	H	α-helix	trans	-65.4	-38.2	179.7	54.9	0	0	0	0	112.2	N253 H299 I300 G307 A344	N253-S303 WeakPolarHBondContact CB-O 3.41Å; N253-S303 VanDerWaalsContact ND2-CB 3.34Å; N253-S303 WeakPolarHBondContact ND2-CB 3.44Å; N253-S303 PolarHBondContact ND2-O 2.94Å; H299-S303 VanDerWaalsContact O-CB 3.26Å; H299-S303 WeakPolarHBondContact O-CB 3.14Å; H299-S303 PolarHBondContact O-N 2.79Å; H299-S303 PolarHBondContact O-OG 3.24Å; I300-S303 PolarHBondContact O-N 3.41Å; I300-S303 PolarHBondContact O-OG 3.07Å; S303-G307 PolarHBondContact O-N 3.45Å; S303-G307 VanDerWaalsContact O-N 3.11Å; S303-A344 WeakPolarHBondContact OG-CB 3.13Å; S303-A344 PolarHBondContact OG-N 3.29Å
304	A	98.9	Very high	98.2	Very high	3 Å²	3	28.4 Å²	28.4	3%	0.025	14%	0.136	C	C	.	.	H	α-helix	trans	-66.4	-44.8	173.4	0	0	0	0	0	112	I300 A301 Q302 R306 G307 L308 V336 A344 F398	I300-A304 WeakPolarHBondContact O-CB 3.45Å; I300-A304 PolarHBondContact O-N 3.13Å; A301-A304 PolarHBondContact O-N 2.99Å; Q302-A304 PolarHBondContact O-N 2.88Å; A304-R306 PolarHBondContact O-N 2.99Å; A304-G307 PolarHBondContact O-N 2.86Å; A304-L308 PolarHBondContact O-N 3.29Å; A304-V336 HydrophobicContact CB-CG1 4.24Å; A304-A344 HydrophobicContact CB-CB 3.82Å; A304-F398 HydrophobicContact CB-CE2 3.78Å; A304-F398 HydrophobicContact CB-CZ 3.97Å
305	A	98.9	Very high	98.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.5	-43	177.1	0	0	0	0	0	111.6	A301 Q302 G307 L308 A309 F398 V483 E484 I487	A301-A305 VanDerWaalsContact O-CB 3.26Å; A301-A305 WeakPolarHBondContact O-CB 3.12Å; A301-A305 PolarHBondContact O-N 2.75Å; Q302-A305 PolarHBondContact O-N 2.96Å; A305-G307 VanDerWaalsContact C-N 3.34Å; A305-G307 PolarHBondContact O-N 2.79Å; A305-L308 PolarHBondContact O-N 3.02Å; A305-A309 VanDerWaalsContact O-CB 3.3Å; A305-A309 WeakPolarHBondContact O-CB 3.23Å; A305-A309 PolarHBondContact O-N 3.2Å; A305-F398 HydrophobicContact CB-CE1 3.79Å; A305-F398 HydrophobicContact CB-CZ 3.86Å; A305-V483 HydrophobicContact CB-CG1 4.23Å; A305-E484 HydrophobicContact CB-CB 3.95Å; A305-I487 HydrophobicContact CB-CD1 4.32Å
306	R	98.9	Very high	97.9	Very high	95 Å²	95	29.6 Å²	29.6	36%	0.358	15%	0.148	S	C	.	.	H	α-helix	trans	-60.1	-42.7	174.2	-172.4	-178.3	-66.5	156.4	8.3	112.1	N253 Q302 A304 A309 Y310 E484	N253-R306 WeakPolarHBondContact OD1-CD 3.28Å; Q302-R306 WeakPolarHBondContact O-CB 3.46Å; Q302-R306 PolarHBondContact O-N 3.2Å; A304-R306 PolarHBondContact O-N 2.99Å; R306-A309 PolarHBondContact O-N 3.2Å; R306-Y310 WeakPolarHBondContact O-CB 3.47Å; R306-Y310 PolarHBondContact O-N 2.89Å; R306-E484 HydrophobicContact CB-CG 4.25Å; R306-E484 IonicContact CZ-OE1 2.73Å; R306-E484 IonicContact NE-OE1 2.67Å; R306-E484 PolarHBondContact NE-OE1 3Å; R306-E484 IonicContact NH2-OE1 2.77Å; R306-E484 PolarHBondContact NH2-OE1 3.12Å
307	G	98.8	Very high	97.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-45.1	175.6	0	0	0	0	0	112.4	N253 S303 A304 A305 Y310 L311	N253-G307 VanDerWaalsContact CB-CA 3.45Å; N253-G307 WeakPolarHBondContact O-CA 3.45Å; S303-G307 PolarHBondContact O-N 3.45Å; S303-G307 VanDerWaalsContact O-N 3.11Å; A304-G307 PolarHBondContact O-N 2.86Å; A305-G307 VanDerWaalsContact C-N 3.34Å; A305-G307 PolarHBondContact O-N 2.79Å; G307-Y310 PolarHBondContact O-N 3.33Å; G307-L311 WeakPolarHBondContact O-CG 3.48Å; G307-L311 PolarHBondContact O-N 3.29Å
308	L	98.9	Very high	97.2	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-67.9	-42.2	177.6	-172.1	56.3	0	0	0	112.3	A304 A305 Y310 L311 H312 I331 D394 M395 F398 A480	A304-L308 PolarHBondContact O-N 3.29Å; A305-L308 PolarHBondContact O-N 3.02Å; L308-Y310 VanDerWaalsContact C-N 3.33Å; L308-Y310 PolarHBondContact O-N 3.28Å; L308-L311 WeakPolarHBondContact O-CB 3.21Å; L308-L311 PolarHBondContact O-N 3.32Å; L308-H312 VanDerWaalsContact CD1-NE2 3.31Å; L308-H312 WeakPolarHBondContact CD1-NE2 3.33Å; L308-H312 WeakPolarHBondContact O-CB 3.07Å; L308-H312 PolarHBondContact O-CD2 2.92Å; L308-H312 VanDerWaalsContact O-CG 3.29Å; L308-H312 PolarHBondContact O-N 2.88Å; L308-I331 HydrophobicContact CD1-CD1 3.99Å; L308-I331 HydrophobicContact CD1-CG1 4.26Å; L308-D394 HydrophobicContact CD1-CB 4.35Å; L308-M395 HydrophobicContact CD2-SD 3.78Å; L308-F398 HydrophobicContact CD2-CB 3.97Å; L308-F398 HydrophobicContact CD2-CD1 4.44Å; L308-F398 HydrophobicContact CD2-CD2 4.18Å; L308-F398 HydrophobicContact CD2-CG 3.94Å; L308-A480 HydrophobicContact CB-CB 4.08Å; L308-A480 HydrophobicContact CD2-CB 4.27Å; L308-A480 HydrophobicContact CG-CB 3.91Å
309	A	98.8	Very high	96.8	Very high	17 Å²	17	39.5 Å²	39.5	14%	0.14	21%	0.211	C	C	.	.	H	α-helix	trans	-59.1	-45.8	175.3	0	0	0	0	0	111.1	A305 R306 L311 H312 E313 A480	A305-A309 VanDerWaalsContact O-CB 3.3Å; A305-A309 WeakPolarHBondContact O-CB 3.23Å; A305-A309 PolarHBondContact O-N 3.2Å; R306-A309 PolarHBondContact O-N 3.2Å; A309-L311 VanDerWaalsContact C-N 3.34Å; A309-L311 PolarHBondContact O-N 3.33Å; A309-H312 PolarHBondContact O-N 3.44Å; A309-E313 WeakPolarHBondContact O-CB 3.46Å; A309-E313 PolarHBondContact O-N 2.82Å; A309-A480 HydrophobicContact CB-CB 3.8Å
310	Y	98.6	Very high	96.3	Very high	29 Å²	29	41.2 Å²	41.2	11%	0.114	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-40.9	175.9	-173.7	-102.8	0	0	0	112.3	G248 H251 V254 R306 G307 L308 E313 I315 H318 K323	G248-Y310 WeakPolarHBondContact O-CE1 3.48Å; G248-Y310 VanDerWaalsContact O-CZ 3.27Å; G248-Y310 PolarHBondContact O-OH 3.06Å; H251-Y310 HydrophobicContact CB-CD1 3.49Å; H251-Y310 VanDerWaalsContact CB-CD1 3.49Å; H251-Y310 HydrophobicContact CB-CE1 3.45Å; H251-Y310 VanDerWaalsContact CB-CE1 3.45Å; H251-Y310 HydrophobicContact CB-CG 4.14Å; H251-Y310 AromaticContact CD2-CD2 3.84Å; H251-Y310 AromaticContact CD2-CG 3.79Å; H251-Y310 AromaticContact CG-CD1 3.67Å; H251-Y310 AromaticContact CG-CG 3.8Å; V254-Y310 HydrophobicContact CG2-CD1 4.26Å; R306-Y310 WeakPolarHBondContact O-CB 3.47Å; R306-Y310 PolarHBondContact O-N 2.89Å; G307-Y310 PolarHBondContact O-N 3.33Å; L308-Y310 VanDerWaalsContact C-N 3.33Å; L308-Y310 PolarHBondContact O-N 3.28Å; Y310-E313 PolarHBondContact O-N 2.98Å; Y310-I315 HydrophobicContact CD2-CD1 4.29Å; Y310-I315 HydrophobicContact CE2-CD1 3.8Å; Y310-H318 PolarHBondContact OH-NE2 3.02Å; Y310-K323 HydrophobicContact CE1-CD 4.18Å; Y310-K323 WeakPolarHBondContact O-CE 3.45Å; Y310-K323 PolarHBondContact O-NZ 2.84Å
311	L	98.4	Very high	95.9	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-46.3	174.4	-71.7	168.9	0	0	0	111.5	M249 V254 G307 L308 A309 E313 K323 I326 V346 F349	M249-L311 HydrophobicContact CE-CD2 3.85Å; M249-L311 HydrophobicContact SD-CD2 4.11Å; V254-L311 HydrophobicContact CG2-CD2 4.06Å; V254-L311 HydrophobicContact CG2-CG 4.06Å; G307-L311 WeakPolarHBondContact O-CG 3.48Å; G307-L311 PolarHBondContact O-N 3.29Å; L308-L311 WeakPolarHBondContact O-CB 3.21Å; L308-L311 PolarHBondContact O-N 3.32Å; A309-L311 VanDerWaalsContact C-N 3.34Å; A309-L311 PolarHBondContact O-N 3.33Å; L311-E313 VanDerWaalsContact C-N 3.3Å; L311-E313 PolarHBondContact O-N 2.81Å; L311-K323 PolarHBondContact O-NZ 2.9Å; L311-I326 CarbonylContact C-O 3.52Å; L311-I326 PolarHBondContact O-N 2.96Å; L311-V346 HydrophobicContact CD1-CB 4.06Å; L311-V346 HydrophobicContact CD1-CG1 3.82Å; L311-V346 HydrophobicContact CD1-CG2 4.4Å; L311-F349 HydrophobicContact CD1-CE1 3.74Å; L311-F349 HydrophobicContact CD1-CZ 4.33Å; L311-F349 HydrophobicContact CD2-CE1 3.76Å; L311-F349 HydrophobicContact CD2-CZ 4.31Å; L311-F349 HydrophobicContact CG-CE1 4.42Å
312	H	98.3	Very high	95.7	Very high	17 Å²	17	46.7 Å²	46.7	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-68.5	-25.5	-178.1	-72.2	-166.7	0	0	0	113.5	L308 A309 S325 I326 L391 D394	L308-H312 VanDerWaalsContact CD1-NE2 3.31Å; L308-H312 WeakPolarHBondContact CD1-NE2 3.33Å; L308-H312 WeakPolarHBondContact O-CB 3.07Å; L308-H312 PolarHBondContact O-CD2 2.92Å; L308-H312 VanDerWaalsContact O-CG 3.29Å; L308-H312 PolarHBondContact O-N 2.88Å; A309-H312 PolarHBondContact O-N 3.44Å; H312-S325 WeakPolarHBondContact O-CB 3.35Å; H312-S325 PolarHBondContact O-OG 3.41Å; H312-I326 PolarHBondContact CD2-O 2.94Å; H312-I326 VanDerWaalsContact CD2-O 3.32Å; H312-L391 HydrophobicContact CB-CD1 4.27Å; H312-L391 HydrophobicContact CB-CD2 4.12Å; H312-D394 IonicContact CD2-OD2 3.17Å; H312-D394 IonicContact CE1-OD2 3.6Å; H312-D394 IonicContact NE2-OD2 2.76Å; H312-D394 PolarHBondContact NE2-OD2 3.13Å
313	E	96.8	Very high	95.5	Very high	107 Å²	107	45.4 Å²	45.4	50%	0.5	25%	0.251	S	S	.	.			trans	-71.6	135.9	-176.5	-165.7	176.6	-170.2	0	0	113.1	A309 Y310 L311 I315 K323	A309-E313 WeakPolarHBondContact O-CB 3.46Å; A309-E313 PolarHBondContact O-N 2.82Å; Y310-E313 PolarHBondContact O-N 2.98Å; L311-E313 VanDerWaalsContact C-N 3.3Å; L311-E313 PolarHBondContact O-N 2.81Å; E313-I315 HydrophobicContact CB-CD1 4.49Å; E313-I315 HydrophobicContact CB-CG1 4.23Å; E313-I315 HydrophobicContact CG-CD1 4.28Å; E313-I315 HydrophobicContact CG-CG1 3.75Å; E313-K323 PolarHBondContact O-NZ 3.28Å
314	D	95.8	Very high	95.4	Very high	64 Å²	64	45.4 Å²	45.4	34%	0.342	25%	0.251	S	S	.	.			trans	-93.4	115.8	170.1	-173.8	30.7	0	0	0	109.5	P316 H322 P324	D314-P316 WeakPolarHBondContact O-CD 3.48Å; D314-H322 IonicContact OD1-CD2 2.77Å; D314-H322 IonicContact OD1-CE1 3.26Å; D314-H322 IonicContact OD1-NE2 3.71Å; D314-H322 PolarHBondContact OD1-NE2 3.46Å; D314-H322 IonicContact OD2-NE2 2.68Å; D314-P324 WeakPolarHBondContact OD1-CA 3.33Å
315	I	95.4	Very high	95.3	Very high	34 Å²	34	45.4 Å²	45.4	17%	0.174	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-122.3	87.2	-173.9	-43.6	176.9	0	0	0	110.1	Y310 E313 G317 H318 K323	Y310-I315 HydrophobicContact CD2-CD1 4.29Å; Y310-I315 HydrophobicContact CE2-CD1 3.8Å; E313-I315 HydrophobicContact CB-CD1 4.49Å; E313-I315 HydrophobicContact CB-CG1 4.23Å; E313-I315 HydrophobicContact CG-CD1 4.28Å; E313-I315 HydrophobicContact CG-CG1 3.75Å; I315-G317 VanDerWaalsContact C-N 3.3Å; I315-G317 PolarHBondContact O-N 3.28Å; I315-H318 HydrophobicContact CB-CB 4.26Å; I315-H318 HydrophobicContact CG2-CB 3.88Å; I315-H318 PolarHBondContact O-N 2.75Å; I315-K323 HydrophobicContact CB-CB 4.13Å; I315-K323 HydrophobicContact CD1-CD 3.86Å; I315-K323 HydrophobicContact CG1-CD 4.22Å; I315-K323 PolarHBondContact N-O 2.85Å; I315-K323 PolarHBondContact O-N 3.48Å
316	P	91.8	Very high	95.2	Very high	91 Å²	91	45.4 Å²	45.4	59%	0.591	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-34	-178.6	-27.2	35.5	0	0	0	115.1	D314 H322	D314-P316 WeakPolarHBondContact O-CD 3.48Å; P316-H322 VanDerWaalsContact CA-CD2 3.42Å; P316-H322 WeakPolarHBondContact CA-CD2 3.37Å
317	G	89.1	Confident	95.2	Very high	74 Å²	74	40.9 Å²	40.9	76%	0.763	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.1	26.1	-175	0	0	0	0	0	114.5	I315	I315-G317 VanDerWaalsContact C-N 3.3Å; I315-G317 PolarHBondContact O-N 3.28Å
318	H	92.3	Very high	95.1	Very high	35 Å²	35	40.9 Å²	40.9	16%	0.162	23%	0.233	C	C	.	.			trans	-63.5	146.4	178	-175.3	-85.3	0	0	0	110.3	G248 Y310 I315 D320 G321 K323	G248-H318 WeakPolarHBondContact CA-CE1 3.36Å; G248-H318 WeakPolarHBondContact CA-ND1 3.42Å; Y310-H318 PolarHBondContact OH-NE2 3.02Å; I315-H318 HydrophobicContact CB-CB 4.26Å; I315-H318 HydrophobicContact CG2-CB 3.88Å; I315-H318 PolarHBondContact O-N 2.75Å; H318-D320 IonicContact CE1-OD2 2.65Å; H318-D320 PolarHBondContact CE1-OD2 2.84Å; H318-D320 VanDerWaalsContact CE1-OD2 3.26Å; H318-D320 PolarHBondContact ND1-N 3.34Å; H318-D320 IonicContact ND1-OD2 3.52Å; H318-D320 PolarHBondContact O-N 3.25Å; H318-G321 CarbonylContact C-O 3.59Å; H318-G321 WeakPolarHBondContact CA-O 3.32Å; H318-G321 VanDerWaalsContact CB-O 3.22Å; H318-G321 WeakPolarHBondContact CB-O 3.25Å; H318-G321 PolarHBondContact N-O 2.99Å; H318-G321 PolarHBondContact O-N 3.32Å; H318-K323 HydrophobicContact CB-CB 4.38Å
319	K	89.8	Confident	95	Very high	169 Å²	169	42.1 Å²	42.1	74%	0.735	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-27.1	-172.9	59.3	176.4	-177.6	-172.3	0	114.7
320	D	87.8	Confident	94.9	Very high	97 Å²	97	41.6 Å²	41.6	52%	0.519	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	3.8	-176.9	-55.9	-45.1	0	0	0	112.9	C247 H318	C247-D320 HydrophobicContact CB-CB 4.46Å; C247-D320 PolarHBondContact SG-O 3.05Å; H318-D320 IonicContact CE1-OD2 2.65Å; H318-D320 PolarHBondContact CE1-OD2 2.84Å; H318-D320 VanDerWaalsContact CE1-OD2 3.26Å; H318-D320 PolarHBondContact ND1-N 3.34Å; H318-D320 IonicContact ND1-OD2 3.52Å; H318-D320 PolarHBondContact O-N 3.25Å
321	G	91.1	Very high	94.9	Very high	32 Å²	32	40.4 Å²	40.4	33%	0.33	23%	0.228	S	C	.	.	S	Bend	trans	122.2	-172.2	-173.3	0	0	0	0	0	112.6	H318 K323	H318-G321 CarbonylContact C-O 3.59Å; H318-G321 WeakPolarHBondContact CA-O 3.32Å; H318-G321 VanDerWaalsContact CB-O 3.22Å; H318-G321 WeakPolarHBondContact CB-O 3.25Å; H318-G321 PolarHBondContact N-O 2.99Å; H318-G321 PolarHBondContact O-N 3.32Å; G321-K323 PolarHBondContact O-N 2.79Å
322	H	93.4	Very high	94.9	Very high	82 Å²	82	41.8 Å²	41.8	38%	0.38	23%	0.234	S	C	.	.			trans	-73.5	119.3	177.7	178.1	-169.2	0	0	0	110.8	D314 P316 P324	D314-H322 IonicContact OD1-CD2 2.77Å; D314-H322 IonicContact OD1-CE1 3.26Å; D314-H322 IonicContact OD1-NE2 3.71Å; D314-H322 PolarHBondContact OD1-NE2 3.46Å; D314-H322 IonicContact OD2-NE2 2.68Å; P316-H322 VanDerWaalsContact CA-CD2 3.42Å; P316-H322 WeakPolarHBondContact CA-CD2 3.37Å; H322-P324 WeakPolarHBondContact O-CD 3.46Å
323	K	95.9	Very high	95	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-90.5	109.2	168.9	-177.1	-161.1	167.3	-65.4	0	109.8	C247 G248 Y310 L311 E313 I315 H318 G321	C247-K323 WeakPolarHBondContact O-CA 3.45Å; C247-K323 WeakPolarHBondContact O-CB 3.19Å; C247-K323 VanDerWaalsContact O-CG 3.25Å; C247-K323 WeakPolarHBondContact O-CG 3.34Å; G248-K323 WeakPolarHBondContact O-CD 3.46Å; Y310-K323 HydrophobicContact CE1-CD 4.18Å; Y310-K323 WeakPolarHBondContact O-CE 3.45Å; Y310-K323 PolarHBondContact O-NZ 2.84Å; L311-K323 PolarHBondContact O-NZ 2.9Å; E313-K323 PolarHBondContact O-NZ 3.28Å; I315-K323 HydrophobicContact CB-CB 4.13Å; I315-K323 HydrophobicContact CD1-CD 3.86Å; I315-K323 HydrophobicContact CG1-CD 4.22Å; I315-K323 PolarHBondContact N-O 2.85Å; I315-K323 PolarHBondContact O-N 3.48Å; H318-K323 HydrophobicContact CB-CB 4.38Å; G321-K323 PolarHBondContact O-N 2.79Å
324	P	96.1	Very high	95	Very high	6 Å²	6	40.7 Å²	40.7	4%	0.039	23%	0.227	C	C	.	.			trans	-67.9	163	172	28.1	-35.5	0	0	0	112.9	V246 D314 H322 K354 F355 E356	V246-P324 HydrophobicContact CG1-CG 3.89Å; D314-P324 WeakPolarHBondContact OD1-CA 3.33Å; H322-P324 WeakPolarHBondContact O-CD 3.46Å; P324-K354 HydrophobicContact CG-CB 4.17Å; P324-K354 HydrophobicContact CG-CD 4.48Å; P324-F355 WeakPolarHBondContact CB-O 3.27Å; P324-E356 HydrophobicContact CB-CG 4.26Å
325	S	96.7	Very high	95.1	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.014	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	137.5	163.2	-70.7	0	0	0	0	110.7	H312 K354 F355	H312-S325 WeakPolarHBondContact O-CB 3.35Å; H312-S325 PolarHBondContact O-OG 3.41Å; S325-K354 WeakPolarHBondContact O-CA 3.46Å; S325-F355 PolarHBondContact O-N 2.8Å
326	I	97.6	Very high	95.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	124.1	178.8	-62	164.2	0	0	0	108.9	I243 V246 M249 L311 H312 A352 L353 K354	I243-I326 HydrophobicContact CD1-CG2 4.26Å; I243-I326 HydrophobicContact CG2-CD1 4.45Å; I243-I326 HydrophobicContact CG2-CG2 4.4Å; V246-I326 HydrophobicContact CG1-CD1 4.31Å; M249-I326 HydrophobicContact CE-CD1 4.35Å; M249-I326 HydrophobicContact SD-CD1 3.38Å; M249-I326 WeakPolarHBondContact SD-CD1 3.43Å; L311-I326 CarbonylContact C-O 3.52Å; L311-I326 PolarHBondContact O-N 2.96Å; H312-I326 PolarHBondContact CD2-O 2.94Å; H312-I326 VanDerWaalsContact CD2-O 3.32Å; I326-A352 HydrophobicContact CG2-CB 4.04Å; I326-L353 CarbonylContact C-O 3.56Å; I326-L353 WeakPolarHBondContact CA-O 3.33Å; I326-K354 HydrophobicContact CG1-CB 4.01Å
327	A	97.4	Very high	95.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	137.1	166	0	0	0	0	0	109.9	R329 A352 L353 F355 F390 L391 D394	A327-R329 HydrophobicContact CB-CG 4.08Å; A327-A352 CarbonylContact O-C 3.52Å; A327-A352 WeakPolarHBondContact O-CA 3.46Å; A327-A352 WeakPolarHBondContact O-CB 3.3Å; A327-L353 PolarHBondContact N-O 3.11Å; A327-L353 PolarHBondContact O-N 2.97Å; A327-F355 HydrophobicContact CB-CE2 3.73Å; A327-F355 HydrophobicContact CB-CZ 4.35Å; A327-F390 HydrophobicContact CB-CB 3.58Å; A327-L391 HydrophobicContact CB-CD2 4.1Å; A327-D394 WeakPolarHBondContact CA-OD2 3.36Å
328	H	98	Very high	96.1	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.15	C	C	.	.			trans	-80.6	-41.5	-176.5	-174.6	-82	0	0	0	112.6	D330 I331 V346 A347 D348 F349 A352 D394	H328-D330 PolarHBondContact CE1-O 3.18Å; H328-D330 VanDerWaalsContact CE1-O 3.3Å; H328-D330 PolarHBondContact ND1-N 2.99Å; H328-D330 PolarHBondContact ND1-O 3.44Å; H328-D330 PolarHBondContact O-N 3.32Å; H328-D330 VanDerWaalsContact O-N 3.11Å; H328-I331 HydrophobicContact CB-CD1 3.66Å; H328-I331 HydrophobicContact CB-CG1 3.88Å; H328-I331 VanDerWaalsContact CG-CD1 3.44Å; H328-I331 PolarHBondContact ND1-N 2.88Å; H328-V346 VanDerWaalsContact CD2-CG1 3.49Å; H328-V346 WeakPolarHBondContact CD2-CG1 3.29Å; H328-A347 PolarHBondContact NE2-O 2.96Å; H328-D348 PolarHBondContact CE1-O 3.25Å; H328-D348 PolarHBondContact NE2-O 3.02Å; H328-D348 VanDerWaalsContact NE2-O 3.16Å; H328-F349 AromaticContact CD2-CD1 3.89Å; H328-F349 AromaticContact CD2-CE1 3.8Å; H328-A352 WeakPolarHBondContact O-CA 3.31Å; H328-D394 PolarHBondContact N-OD2 2.91Å
329	R	96.3	Very high	96.4	Very high	26 Å²	26	31.2 Å²	31.2	10%	0.098	15%	0.153	C	C	.	.	S	Bend	trans	67.6	0	174.5	-52	179.2	59.9	-153.1	10.9	116.7	A327 L351 H365 V368 F390 D394	A327-R329 HydrophobicContact CB-CG 4.08Å; R329-L351 HydrophobicContact CB-CB 4.37Å; R329-L351 WeakPolarHBondContact CD-O 3.49Å; R329-L351 PolarHBondContact NH1-O 3.06Å; R329-H365 PolarHBondContact NH2-O 2.88Å; R329-V368 HydrophobicContact CB-CG2 4.5Å; R329-F390 HydrophobicContact CG-CD1 4.14Å; R329-D394 WeakPolarHBondContact CA-OD1 3.16Å; R329-D394 PolarHBondContact N-OD1 3.31Å
330	D	97.2	Very high	96.7	Very high	7 Å²	7	28.8 Å²	28.8	4%	0.037	15%	0.148	C	C	.	.			trans	-143.4	44.3	169.9	-161.6	33.6	0	0	0	111.7	H328 K332 N335 L351 G369 T370	H328-D330 PolarHBondContact CE1-O 3.18Å; H328-D330 VanDerWaalsContact CE1-O 3.3Å; H328-D330 PolarHBondContact ND1-N 2.99Å; H328-D330 PolarHBondContact ND1-O 3.44Å; H328-D330 PolarHBondContact O-N 3.32Å; H328-D330 VanDerWaalsContact O-N 3.11Å; D330-K332 PolarHBondContact O-N 2.72Å; D330-K332 IonicContact OD1-NZ 3.86Å; D330-K332 PolarHBondContact OD1-NZ 3.3Å; D330-K332 VanDerWaalsContact OD2-CE 3.22Å; D330-K332 WeakPolarHBondContact OD2-CE 3.41Å; D330-K332 IonicContact OD2-NZ 3.21Å; D330-K332 PolarHBondContact OD2-NZ 3.41Å; D330-N335 PolarHBondContact O-ND2 3.36Å; D330-N335 PolarHBondContact OD2-ND2 3.2Å; D330-L351 HydrophobicContact CB-CD1 3.98Å; D330-G369 WeakPolarHBondContact OD1-CA 3.4Å; D330-T370 WeakPolarHBondContact OD1-CB 3.48Å; D330-T370 PolarHBondContact OD1-N 3.43Å; D330-T370 PolarHBondContact OD1-OG1 3.09Å
331	I	98.8	Very high	97.2	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.021	15%	0.149	C	C	.	.			trans	-62.4	129.7	172.4	-68.8	-57.5	0	0	0	109.3	L308 H328 V346 D394 A397 F398 V401	L308-I331 HydrophobicContact CD1-CD1 3.99Å; L308-I331 HydrophobicContact CD1-CG1 4.26Å; H328-I331 HydrophobicContact CB-CD1 3.66Å; H328-I331 HydrophobicContact CB-CG1 3.88Å; H328-I331 VanDerWaalsContact CG-CD1 3.44Å; H328-I331 PolarHBondContact ND1-N 2.88Å; I331-V346 HydrophobicContact CD1-CG1 4.06Å; I331-D394 HydrophobicContact CG1-CB 4.04Å; I331-A397 HydrophobicContact CB-CB 3.8Å; I331-A397 HydrophobicContact CG2-CB 3.93Å; I331-A397 WeakPolarHBondContact O-CB 3.47Å; I331-F398 HydrophobicContact CG2-CB 4.2Å; I331-F398 HydrophobicContact CG2-CD2 4.33Å; I331-V401 HydrophobicContact CG2-CG2 4.24Å
332	K	98.6	Very high	97.5	Very high	29 Å²	29	27.9 Å²	27.9	13%	0.126	14%	0.136	C	C	.	.	S	Bend	trans	-169.3	160.8	175.4	56.9	-171.9	167.5	-163	0	108.7	D330 K334 N335 V336 T370 Y373	D330-K332 PolarHBondContact O-N 2.72Å; D330-K332 IonicContact OD1-NZ 3.86Å; D330-K332 PolarHBondContact OD1-NZ 3.3Å; D330-K332 VanDerWaalsContact OD2-CE 3.22Å; D330-K332 WeakPolarHBondContact OD2-CE 3.41Å; D330-K332 IonicContact OD2-NZ 3.21Å; D330-K332 PolarHBondContact OD2-NZ 3.41Å; K332-K334 HydrophobicContact CD-CB 4.23Å; K332-K334 HydrophobicContact CG-CB 4.17Å; K332-K334 PolarHBondContact O-N 3.05Å; K332-K334 VanDerWaalsContact O-N 3.11Å; K332-N335 WeakPolarHBondContact CE-ND2 3.35Å; K332-N335 WeakPolarHBondContact CE-OD1 3.37Å; K332-N335 HydrophobicContact CG-CB 4.01Å; K332-N335 PolarHBondContact O-N 3.35Å; K332-V336 PolarHBondContact O-N 2.95Å; K332-T370 HydrophobicContact CD-CG2 4.42Å; K332-T370 WeakPolarHBondContact CD-OG1 3.39Å; K332-T370 PolarHBondContact NZ-OG1 3.03Å; K332-Y373 HydrophobicContact CB-CD1 4.01Å; K332-Y373 HydrophobicContact CB-CD2 3.7Å; K332-Y373 HydrophobicContact CB-CE1 3.83Å; K332-Y373 HydrophobicContact CB-CE2 3.5Å; K332-Y373 HydrophobicContact CB-CG 3.97Å
333	S	98.6	Very high	97.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-58.9	-27.3	179.3	56.1	0	0	0	0	113.1	L283 T284 N335 V336 Y373 E404 Y419	L283-S333 WeakPolarHBondContact CB-O 3.46Å; L283-S333 PolarHBondContact N-O 3.39Å; T284-S333 PolarHBondContact N-O 3.07Å; T284-S333 WeakPolarHBondContact OG1-CB 3.4Å; T284-S333 PolarHBondContact OG1-OG 2.92Å; S333-N335 VanDerWaalsContact C-N 3.25Å; S333-N335 PolarHBondContact O-N 3.18Å; S333-V336 PolarHBondContact O-N 3.39Å; S333-Y373 PolarHBondContact OG-OH 3.26Å; S333-E404 WeakPolarHBondContact CB-OE2 3.32Å; S333-E404 VanDerWaalsContact OG-CD 3.24Å; S333-E404 PolarHBondContact OG-OE1 3.08Å; S333-E404 PolarHBondContact OG-OE2 3.04Å; S333-Y419 PolarHBondContact OG-OH 2.71Å
334	K	97.4	Very high	97.9	Very high	101 Å²	101	24.9 Å²	24.9	44%	0.439	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-68.2	-24.7	176.1	-167.9	167.1	-177.8	176	0	113.5	S282 T284 K332	S282-K334 VanDerWaalsContact CB-O 3.3Å; S282-K334 WeakPolarHBondContact CB-O 3.25Å; T284-K334 VanDerWaalsContact OG1-CA 3.3Å; T284-K334 WeakPolarHBondContact OG1-CA 3.48Å; T284-K334 PolarHBondContact OG1-N 2.7Å; K332-K334 HydrophobicContact CD-CB 4.23Å; K332-K334 HydrophobicContact CG-CB 4.17Å; K332-K334 PolarHBondContact O-N 3.05Å; K332-K334 VanDerWaalsContact O-N 3.11Å
335	N	98.4	Very high	98.1	Very high	11 Å²	11	24.7 Å²	24.7	6%	0.059	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-100.2	9.4	-179.9	-73.6	2.5	0	0	0	112.2	D330 K332 S333 A347	D330-N335 PolarHBondContact O-ND2 3.36Å; D330-N335 PolarHBondContact OD2-ND2 3.2Å; K332-N335 WeakPolarHBondContact CE-ND2 3.35Å; K332-N335 WeakPolarHBondContact CE-OD1 3.37Å; K332-N335 HydrophobicContact CG-CB 4.01Å; K332-N335 PolarHBondContact O-N 3.35Å; S333-N335 VanDerWaalsContact C-N 3.25Å; S333-N335 PolarHBondContact O-N 3.18Å; N335-A347 WeakPolarHBondContact CB-O 3.46Å; N335-A347 PolarHBondContact O-N 3.05Å
336	V	98.8	Very high	98.2	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.012	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	115.5	169.2	179.1	0	0	0	0	107.2	S282 L283 A304 K332 S333 A344	S282-V336 CarbonylContact C-O 3.57Å; S282-V336 WeakPolarHBondContact CA-O 3.49Å; L283-V336 HydrophobicContact CB-CB 4.16Å; L283-V336 HydrophobicContact CB-CG1 4.33Å; L283-V336 HydrophobicContact CD2-CG1 4.4Å; L283-V336 PolarHBondContact N-O 3.26Å; A304-V336 HydrophobicContact CB-CG1 4.24Å; K332-V336 PolarHBondContact O-N 2.95Å; S333-V336 PolarHBondContact O-N 3.39Å; V336-A344 HydrophobicContact CG1-CB 3.73Å
337	L	98.7	Very high	98.2	Very high	34 Å²	34	25 Å²	25	18%	0.178	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	149.1	178.5	-56.3	-175.8	0	0	0	110.9	L255 G281 A344 C345 A347	L255-L337 HydrophobicContact CD1-CD1 3.96Å; L255-L337 HydrophobicContact CD2-CD1 3.85Å; L255-L337 HydrophobicContact CG-CD1 4.47Å; G281-L337 WeakPolarHBondContact O-CA 3.47Å; L337-A344 CarbonylContact O-C 3.54Å; L337-A344 VanDerWaalsContact O-CA 3.3Å; L337-A344 WeakPolarHBondContact O-CA 3.39Å; L337-C345 PolarHBondContact N-O 2.84Å; L337-C345 PolarHBondContact O-N 2.84Å; L337-A347 HydrophobicContact CD1-CB 4.02Å; L337-A347 HydrophobicContact CG-CB 3.95Å
338	L	98.8	Very high	98	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	126.6	178.8	-60.7	-176.1	0	0	0	111.5	H278 K280 G281 L283 Y286 I300 L342 A344	H278-L338 WeakPolarHBondContact CB-O 3.31Å; K280-L338 HydrophobicContact CB-CB 4.04Å; K280-L338 HydrophobicContact CD-CB 4.43Å; G281-L338 PolarHBondContact O-N 3.39Å; L283-L338 HydrophobicContact CD1-CD1 3.96Å; L283-L338 HydrophobicContact CD1-CD2 4.34Å; L283-L338 HydrophobicContact CD1-CG 4.44Å; Y286-L338 HydrophobicContact CD1-CD1 3.66Å; Y286-L338 HydrophobicContact CD2-CD1 4Å; Y286-L338 HydrophobicContact CE1-CD1 4.32Å; Y286-L338 HydrophobicContact CG-CD1 3.48Å; Y286-L338 VanDerWaalsContact CG-CD1 3.48Å; I300-L338 HydrophobicContact CD1-CD1 4.39Å; I300-L338 HydrophobicContact CG1-CD2 4.18Å; I300-L338 HydrophobicContact CG2-CD2 3.9Å; L338-L342 HydrophobicContact CD1-CD2 4.2Å; L338-A344 HydrophobicContact CD2-CB 4Å
339	K	98.5	Very high	97.9	Very high	52 Å²	52	26.2 Å²	26.2	23%	0.226	13%	0.131	C	C	.	.			trans	-72.6	169.8	168.1	-61.1	-175.4	-171	-179.7	0	110.7	D252 K280 N341 L342 T343	D252-K339 VanDerWaalsContact O-CE 3.26Å; D252-K339 WeakPolarHBondContact O-CE 3.18Å; D252-K339 PolarHBondContact O-NZ 2.98Å; K280-K339 WeakPolarHBondContact CD-O 3.19Å; K339-N341 WeakPolarHBondContact CB-OD1 3.41Å; K339-N341 PolarHBondContact O-N 3.08Å; K339-N341 VanDerWaalsContact O-N 3.11Å; K339-L342 WeakPolarHBondContact O-CA 3.46Å; K339-L342 PolarHBondContact O-N 3.07Å; K339-T343 WeakPolarHBondContact CB-O 3.3Å; K339-T343 HydrophobicContact CD-CG2 4.27Å; K339-T343 WeakPolarHBondContact CG-O 3.39Å; K339-T343 PolarHBondContact N-O 3Å
340	N	97.4	Very high	97.7	Very high	118 Å²	118	25.1 Å²	25.1	63%	0.631	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-33	-178.3	-69.2	-15.8	0	0	0	113.9	K280 L342	K280-N340 WeakPolarHBondContact CE-O 3.12Å; N340-L342 VanDerWaalsContact C-N 3.31Å; N340-L342 PolarHBondContact O-N 3.38Å
341	N	97.7	Very high	97.5	Very high	98 Å²	98	25.9 Å²	25.9	52%	0.524	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	18.6	177.2	70.8	-21.1	0	0	0	113.5	H299 K339 T343	H299-N341 PolarHBondContact CD2-O 3.42Å; H299-N341 PolarHBondContact NE2-O 3.16Å; K339-N341 WeakPolarHBondContact CB-OD1 3.41Å; K339-N341 PolarHBondContact O-N 3.08Å; K339-N341 VanDerWaalsContact O-N 3.11Å; N341-T343 PolarHBondContact ND2-OG1 3.28Å; N341-T343 PolarHBondContact O-N 3.11Å; N341-T343 VanDerWaalsContact O-N 3.09Å; N341-T343 VanDerWaalsContact OD1-CB 3.25Å; N341-T343 WeakPolarHBondContact OD1-CB 3.47Å; N341-T343 PolarHBondContact OD1-N 3.5Å; N341-T343 VanDerWaalsContact OD1-N 3.15Å; N341-T343 PolarHBondContact OD1-OG1 3.14Å; N341-T343 VanDerWaalsContact OD1-OG1 3.09Å
342	L	98.4	Very high	97.4	Very high	13 Å²	13	25.8 Å²	25.8	7%	0.068	13%	0.132	C	C	.	.	S	Bend	trans	61.8	10.3	-176.4	-54.7	177.3	0	0	0	115.4	K280 Y286 E296 I300 L338 K339 N340 A344	K280-L342 HydrophobicContact CD-CD2 3.61Å; Y286-L342 HydrophobicContact CE1-CD2 4.07Å; Y286-L342 HydrophobicContact CE2-CD2 3.92Å; Y286-L342 WeakPolarHBondContact OH-CD2 3.33Å; E296-L342 HydrophobicContact CB-CD1 4.03Å; E296-L342 HydrophobicContact CG-CD1 3.71Å; E296-L342 WeakPolarHBondContact OE1-CD1 3.46Å; I300-L342 HydrophobicContact CD1-CB 4.34Å; I300-L342 HydrophobicContact CG1-CB 4.01Å; I300-L342 WeakPolarHBondContact CG1-O 3.16Å; L338-L342 HydrophobicContact CD1-CD2 4.2Å; K339-L342 WeakPolarHBondContact O-CA 3.46Å; K339-L342 PolarHBondContact O-N 3.07Å; N340-L342 VanDerWaalsContact C-N 3.31Å; N340-L342 PolarHBondContact O-N 3.38Å; L342-A344 PolarHBondContact O-N 3.08Å
343	T	98.8	Very high	97.2	Very high	19 Å²	19	25.6 Å²	25.6	12%	0.117	13%	0.132	C	C	.	.			trans	-63.8	124.2	167.2	-64.1	0	0	0	0	109	N253 H299 K339 N341	N253-T343 WeakPolarHBondContact ND2-CG2 3.34Å; H299-T343 PolarHBondContact NE2-N 3.34Å; H299-T343 PolarHBondContact NE2-OG1 2.86Å; K339-T343 WeakPolarHBondContact CB-O 3.3Å; K339-T343 HydrophobicContact CD-CG2 4.27Å; K339-T343 WeakPolarHBondContact CG-O 3.39Å; K339-T343 PolarHBondContact N-O 3Å; N341-T343 PolarHBondContact ND2-OG1 3.28Å; N341-T343 PolarHBondContact O-N 3.11Å; N341-T343 VanDerWaalsContact O-N 3.09Å; N341-T343 VanDerWaalsContact OD1-CB 3.25Å; N341-T343 WeakPolarHBondContact OD1-CB 3.47Å; N341-T343 PolarHBondContact OD1-N 3.5Å; N341-T343 VanDerWaalsContact OD1-N 3.15Å; N341-T343 PolarHBondContact OD1-OG1 3.14Å; N341-T343 VanDerWaalsContact OD1-OG1 3.09Å
344	A	98.9	Very high	97	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	148.6	178.3	0	0	0	0	0	112	N253 I300 S303 A304 V336 L337 L338 L342	N253-A344 WeakPolarHBondContact CA-O 3.26Å; N253-A344 WeakPolarHBondContact CB-O 3.43Å; N253-A344 PolarHBondContact ND2-O 3.18Å; I300-A344 HydrophobicContact CG2-CB 4.28Å; S303-A344 WeakPolarHBondContact OG-CB 3.13Å; S303-A344 PolarHBondContact OG-N 3.29Å; A304-A344 HydrophobicContact CB-CB 3.82Å; V336-A344 HydrophobicContact CG1-CB 3.73Å; L337-A344 CarbonylContact O-C 3.54Å; L337-A344 VanDerWaalsContact O-CA 3.3Å; L337-A344 WeakPolarHBondContact O-CA 3.39Å; L338-A344 HydrophobicContact CD2-CB 4Å; L342-A344 PolarHBondContact O-N 3.08Å
345	C	98.6	Very high	96.8	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.007	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	139.6	166	63	0	0	0	0	112	N253 L337	N253-C345 CarbonylContact O-C 3.52Å; N253-C345 VanDerWaalsContact O-CA 3.24Å; N253-C345 WeakPolarHBondContact O-CA 3.38Å; L337-C345 PolarHBondContact N-O 2.84Å; L337-C345 PolarHBondContact O-N 2.84Å
346	V	98.7	Very high	96.2	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.018	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	137.4	178.1	-175.9	0	0	0	0	110.3	N253 L255 L311 H328 I331 F349	N253-V346 PolarHBondContact O-N 3.33Å; L255-V346 WeakPolarHBondContact CB-O 3.01Å; L255-V346 PolarHBondContact N-O 2.96Å; L311-V346 HydrophobicContact CD1-CB 4.06Å; L311-V346 HydrophobicContact CD1-CG1 3.82Å; L311-V346 HydrophobicContact CD1-CG2 4.4Å; H328-V346 VanDerWaalsContact CD2-CG1 3.49Å; H328-V346 WeakPolarHBondContact CD2-CG1 3.29Å; I331-V346 HydrophobicContact CD1-CG1 4.06Å; V346-F349 HydrophobicContact CG1-CE1 4.37Å; V346-F349 HydrophobicContact CG1-CZ 4.36Å
347	A	97.5	Very high	95.3	Very high	6 Å²	6	32.4 Å²	32.4	5%	0.05	18%	0.18	C	C	.	.			trans	-139.4	167	-174.5	0	0	0	0	0	112.4	L255 H328 N335 L337	L255-A347 HydrophobicContact CB-CB 3.92Å; L255-A347 HydrophobicContact CD2-CB 3.62Å; L255-A347 HydrophobicContact CG-CB 4.38Å; H328-A347 PolarHBondContact NE2-O 2.96Å; N335-A347 WeakPolarHBondContact CB-O 3.46Å; N335-A347 PolarHBondContact O-N 3.05Å; L337-A347 HydrophobicContact CD1-CB 4.02Å; L337-A347 HydrophobicContact CG-CB 3.95Å
348	D	94.9	Very high	94.1	Very high	26 Å²	26	35.1 Å²	35.1	14%	0.139	22%	0.216	C	C	.	.			trans	68	77.8	179.4	-160.1	-9.6	0	0	0	114.5	K227 H328 G350	K227-D348 VanDerWaalsContact NZ-CG 3.29Å; K227-D348 IonicContact NZ-OD1 2.72Å; K227-D348 PolarHBondContact NZ-OD1 2.62Å; K227-D348 IonicContact NZ-OD2 2.99Å; K227-D348 PolarHBondContact NZ-OD2 3.33Å; H328-D348 PolarHBondContact CE1-O 3.25Å; H328-D348 PolarHBondContact NE2-O 3.02Å; H328-D348 VanDerWaalsContact NE2-O 3.16Å; D348-G350 VanDerWaalsContact C-N 3.26Å; D348-G350 PolarHBondContact O-N 3.23Å; D348-G350 PolarHBondContact OD1-N 3.35Å
349	F	95.8	Very high	93.2	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.246	C	C	.	.			trans	-88.8	17.8	-179.8	-56.2	-82.2	0	0	0	113.5	N239 E240 I243 Y244 M249 V254 L311 H328 V346 L351 A352	N239-F349 PolarHBondContact ND2-O 3.23Å; E240-F349 HydrophobicContact CG-CB 4.06Å; E240-F349 PolarHBondContact OE1-N 3.37Å; I243-F349 HydrophobicContact CB-CB 4.05Å; I243-F349 HydrophobicContact CG2-CB 3.67Å; I243-F349 HydrophobicContact CG2-CD1 3.94Å; I243-F349 HydrophobicContact CG2-CG 3.85Å; Y244-F349 HydrophobicContact CD1-CD2 4.2Å; Y244-F349 HydrophobicContact CD1-CE2 4.32Å; Y244-F349 HydrophobicContact CD2-CD2 4.45Å; Y244-F349 AromaticContact CE1-CD2 3.53Å; Y244-F349 HydrophobicContact CE1-CD2 3.53Å; Y244-F349 AromaticContact CE1-CE2 3.43Å; Y244-F349 HydrophobicContact CE1-CE2 3.43Å; Y244-F349 VanDerWaalsContact CE1-CE2 3.43Å; Y244-F349 AromaticContact CE2-CD2 3.81Å; Y244-F349 HydrophobicContact CE2-CD2 3.81Å; Y244-F349 HydrophobicContact CE2-CE2 4.44Å; Y244-F349 AromaticContact CZ-CD2 3.32Å; Y244-F349 AromaticContact CZ-CE2 3.51Å; Y244-F349 WeakPolarHBondContact OH-CD2 3.24Å; Y244-F349 WeakPolarHBondContact OH-CE2 3.44Å; M249-F349 HydrophobicContact CE-CE1 4.41Å; M249-F349 HydrophobicContact CE-CZ 4.47Å; V254-F349 HydrophobicContact CG1-CE2 4.22Å; V254-F349 HydrophobicContact CG1-CZ 3.81Å; L311-F349 HydrophobicContact CD1-CE1 3.74Å; L311-F349 HydrophobicContact CD1-CZ 4.33Å; L311-F349 HydrophobicContact CD2-CE1 3.76Å; L311-F349 HydrophobicContact CD2-CZ 4.31Å; L311-F349 HydrophobicContact CG-CE1 4.42Å; H328-F349 AromaticContact CD2-CD1 3.89Å; H328-F349 AromaticContact CD2-CE1 3.8Å; V346-F349 HydrophobicContact CG1-CE1 4.37Å; V346-F349 HydrophobicContact CG1-CZ 4.36Å; F349-L351 PolarHBondContact O-N 2.88Å; F349-L351 VanDerWaalsContact O-N 3.1Å; F349-A352 HydrophobicContact CB-CB 3.93Å; F349-A352 HydrophobicContact CD1-CB 4.11Å; F349-A352 WeakPolarHBondContact O-CB 3.26Å; F349-A352 PolarHBondContact O-N 3.25Å; F349-A352 VanDerWaalsContact O-N 3.08Å
350	G	92.3	Very high	91.9	Very high	4 Å²	4	44.9 Å²	44.9	4%	0.041	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.8	-176.4	0	0	0	0	0	114.5	N239 D348	N239-G350 PolarHBondContact ND2-O 2.75Å; D348-G350 VanDerWaalsContact C-N 3.26Å; D348-G350 PolarHBondContact O-N 3.23Å; D348-G350 PolarHBondContact OD1-N 3.35Å
351	L	92.8	Very high	90.4	Very high	23 Å²	23	40 Å²	40	12%	0.12	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-2.5	176.4	-67	-179.2	0	0	0	114.3	F211 R329 D330 F349 V368	F211-L351 HydrophobicContact CE2-CD2 4.29Å; F211-L351 HydrophobicContact CE2-CG 4.13Å; F211-L351 HydrophobicContact CZ-CD2 3.68Å; F211-L351 HydrophobicContact CZ-CG 3.98Å; R329-L351 HydrophobicContact CB-CB 4.37Å; R329-L351 WeakPolarHBondContact CD-O 3.49Å; R329-L351 PolarHBondContact NH1-O 3.06Å; D330-L351 HydrophobicContact CB-CD1 3.98Å; F349-L351 PolarHBondContact O-N 2.88Å; F349-L351 VanDerWaalsContact O-N 3.1Å; L351-V368 HydrophobicContact CD1-CB 4.21Å; L351-V368 HydrophobicContact CD1-CG2 4.17Å; L351-V368 HydrophobicContact CD2-CB 4.39Å; L351-V368 HydrophobicContact CD2-CG2 4.41Å
352	A	95.3	Very high	88.8	Confident	2 Å²	2	37.5 Å²	37.5	2%	0.017	25%	0.246	C	C	.	.			trans	-64.5	151.6	-171.9	0	0	0	0	0	111.5	N239 I243 I326 A327 H328 F349	N239-A352 PolarHBondContact ND2-O 3.27Å; I243-A352 HydrophobicContact CD1-CB 4.15Å; I243-A352 HydrophobicContact CG1-CB 4.04Å; I243-A352 HydrophobicContact CG2-CB 4.25Å; I326-A352 HydrophobicContact CG2-CB 4.04Å; A327-A352 CarbonylContact O-C 3.52Å; A327-A352 WeakPolarHBondContact O-CA 3.46Å; A327-A352 WeakPolarHBondContact O-CB 3.3Å; H328-A352 WeakPolarHBondContact O-CA 3.31Å; F349-A352 HydrophobicContact CB-CB 3.93Å; F349-A352 HydrophobicContact CD1-CB 4.11Å; F349-A352 WeakPolarHBondContact O-CB 3.26Å; F349-A352 PolarHBondContact O-N 3.25Å; F349-A352 VanDerWaalsContact O-N 3.08Å
353	L	94.6	Very high	87	Confident	24 Å²	24	45.1 Å²	45.1	13%	0.126	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	123.9	-176.4	-177.6	62.3	0	0	0	109.6	I326 A327 F355 A361 T364 F390	I326-L353 CarbonylContact C-O 3.56Å; I326-L353 WeakPolarHBondContact CA-O 3.33Å; A327-L353 PolarHBondContact N-O 3.11Å; A327-L353 PolarHBondContact O-N 2.97Å; L353-F355 HydrophobicContact CB-CZ 4.46Å; L353-F355 HydrophobicContact CD2-CE1 3.91Å; L353-F355 HydrophobicContact CD2-CE2 4.47Å; L353-F355 HydrophobicContact CD2-CZ 3.65Å; L353-F355 HydrophobicContact CG-CE1 4.31Å; L353-F355 HydrophobicContact CG-CE2 4.35Å; L353-F355 HydrophobicContact CG-CZ 3.97Å; L353-F355 WeakPolarHBondContact O-CE2 3.21Å; L353-A361 HydrophobicContact CD2-CB 4.16Å; L353-T364 HydrophobicContact CD1-CG2 3.86Å; L353-T364 HydrophobicContact CD2-CG2 4.06Å; L353-F390 HydrophobicContact CD2-CD2 4.37Å; L353-F390 HydrophobicContact CD2-CE1 4.4Å; L353-F390 HydrophobicContact CD2-CE2 4.09Å; L353-F390 HydrophobicContact CD2-CZ 4.11Å
354	K	94	Very high	85.6	Confident	82 Å²	82	45.7 Å²	45.7	36%	0.357	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	145.1	173.6	64.3	174	179.5	162.6	0	111.4	I243 V246 P324 S325 I326 E356	I243-K354 HydrophobicContact CD1-CB 4.25Å; V246-K354 HydrophobicContact CG2-CD 4.15Å; P324-K354 HydrophobicContact CG-CB 4.17Å; P324-K354 HydrophobicContact CG-CD 4.48Å; S325-K354 WeakPolarHBondContact O-CA 3.46Å; I326-K354 HydrophobicContact CG1-CB 4.01Å; K354-E356 WeakPolarHBondContact CE-OE1 3.5Å; K354-E356 IonicContact NZ-OE1 3.69Å; K354-E356 PolarHBondContact NZ-OE1 3.37Å
355	F	93.1	Very high	84.4	Confident	25 Å²	25	53.1 Å²	53.1	11%	0.11	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	115.7	178.1	-61.1	-85.3	0	0	0	110.1	P324 S325 A327 L353 A361 R387 F390	P324-F355 WeakPolarHBondContact CB-O 3.27Å; S325-F355 PolarHBondContact O-N 2.8Å; A327-F355 HydrophobicContact CB-CE2 3.73Å; A327-F355 HydrophobicContact CB-CZ 4.35Å; L353-F355 HydrophobicContact CB-CZ 4.46Å; L353-F355 HydrophobicContact CD2-CE1 3.91Å; L353-F355 HydrophobicContact CD2-CE2 4.47Å; L353-F355 HydrophobicContact CD2-CZ 3.65Å; L353-F355 HydrophobicContact CG-CE1 4.31Å; L353-F355 HydrophobicContact CG-CE2 4.35Å; L353-F355 HydrophobicContact CG-CZ 3.97Å; L353-F355 WeakPolarHBondContact O-CE2 3.21Å; F355-A361 HydrophobicContact CE1-CB 4.24Å; F355-R387 HydrophobicContact CB-CB 4.17Å; F355-R387 HydrophobicContact CB-CG 3.98Å; F355-R387 HydrophobicContact CD1-CB 3.81Å; F355-R387 HydrophobicContact CD1-CG 4.27Å; F355-R387 HydrophobicContact CD2-CB 4.21Å; F355-R387 HydrophobicContact CD2-CG 3.77Å; F355-R387 HydrophobicContact CE1-CB 4.27Å; F355-R387 HydrophobicContact CE2-CG 4.34Å; F355-R387 HydrophobicContact CG-CB 3.78Å; F355-R387 HydrophobicContact CG-CG 3.73Å; F355-F390 AromaticContact CE1-CD2 3.83Å; F355-F390 HydrophobicContact CE1-CD2 3.83Å; F355-F390 HydrophobicContact CE1-CE2 4.35Å; F355-F390 HydrophobicContact CE2-CB 4.16Å; F355-F390 HydrophobicContact CZ-CB 3.69Å; F355-F390 AromaticContact CZ-CD2 3.45Å; F355-F390 HydrophobicContact CZ-CD2 3.45Å; F355-F390 VanDerWaalsContact CZ-CD2 3.45Å; F355-F390 HydrophobicContact CZ-CE2 4.25Å; F355-F390 AromaticContact CZ-CG 3.76Å; F355-F390 HydrophobicContact CZ-CG 3.76Å
356	E	86.6	Confident	83.3	Confident	54 Å²	54	53.8 Å²	53.8	25%	0.252	33%	0.332	S	S	.	.			trans	-109.4	138.7	177.6	-67.4	176.2	-174.8	0	0	109.4	P324 K354 G358 K359	P324-E356 HydrophobicContact CB-CG 4.26Å; K354-E356 WeakPolarHBondContact CE-OE1 3.5Å; K354-E356 IonicContact NZ-OE1 3.69Å; K354-E356 PolarHBondContact NZ-OE1 3.37Å; E356-G358 PolarHBondContact O-N 3.38Å; E356-K359 HydrophobicContact CB-CB 4.37Å; E356-K359 HydrophobicContact CB-CD 4.1Å; E356-K359 HydrophobicContact CB-CG 4.33Å; E356-K359 PolarHBondContact O-N 3.17Å; E356-K359 VanDerWaalsContact O-N 3.08Å; E356-K359 VanDerWaalsContact OE2-CD 3.25Å; E356-K359 WeakPolarHBondContact OE2-CD 3.42Å; E356-K359 WeakPolarHBondContact OE2-CE 3.47Å; E356-K359 IonicContact OE2-NZ 3.86Å; E356-K359 PolarHBondContact OE2-NZ 3.03Å
357	A	80.6	Confident	82.6	Confident	97 Å²	97	58 Å²	58	80%	0.802	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	128.8	-180	0	0	0	0	0	111.1	K359	A357-K359 VanDerWaalsContact C-N 3.29Å; A357-K359 PolarHBondContact O-N 2.93Å
358	G	72.6	Confident	82.2	Confident	91 Å²	91	59.1 Å²	59.1	94%	0.938	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	4.3	179.2	0	0	0	0	0	115.5	E356	E356-G358 PolarHBondContact O-N 3.38Å
359	K	79.4	Confident	82.1	Confident	145 Å²	145	58.7 Å²	58.7	63%	0.63	36%	0.36	S	S	*	.			trans	-108.2	136.6	171.6	-62.2	-169.7	-173	171.3	0	110.6	E356 A357	E356-K359 HydrophobicContact CB-CB 4.37Å; E356-K359 HydrophobicContact CB-CD 4.1Å; E356-K359 HydrophobicContact CB-CG 4.33Å; E356-K359 PolarHBondContact O-N 3.17Å; E356-K359 VanDerWaalsContact O-N 3.08Å; E356-K359 VanDerWaalsContact OE2-CD 3.25Å; E356-K359 WeakPolarHBondContact OE2-CD 3.42Å; E356-K359 WeakPolarHBondContact OE2-CE 3.47Å; E356-K359 IonicContact OE2-NZ 3.86Å; E356-K359 PolarHBondContact OE2-NZ 3.03Å; A357-K359 VanDerWaalsContact C-N 3.29Å; A357-K359 PolarHBondContact O-N 2.93Å
360	S	71.9	Confident	82	Confident	111 Å²	111	60.8 Å²	60.8	78%	0.776	37%	0.372	S	S	*	.			trans	-69.9	157.4	170.6	63.4	0	0	0	0	110.2	G362	S360-G362 PolarHBondContact O-N 2.84Å
361	A	66.7	Low	82.2	Confident	15 Å²	15	66.9 Å²	66.9	12%	0.124	39%	0.394	C	S	.	.			trans	-65.9	8	175.5	0	0	0	0	0	114.4	L353 F355 T364 F385	L353-A361 HydrophobicContact CD2-CB 4.16Å; F355-A361 HydrophobicContact CE1-CB 4.24Å; A361-T364 WeakPolarHBondContact O-CG2 3.38Å; A361-T364 PolarHBondContact O-OG1 2.86Å; A361-F385 HydrophobicContact CB-CB 4.48Å
362	G	63.6	Low	82.5	Confident	46 Å²	46	66.3 Å²	66.3	47%	0.474	39%	0.39	S	S	.	.			trans	64.8	-171.1	-176.6	0	0	0	0	0	114.2	S360 T364	S360-G362 PolarHBondContact O-N 2.84Å; G362-T364 PolarHBondContact O-N 2.85Å
363	D	61.4	Low	82.6	Confident	174 Å²	174	66.8 Å²	66.8	93%	0.93	39%	0.392	S	S	*	.	S	Bend	trans	-74.8	53	173.5	-63.4	-32.9	0	0	0	111.2
364	T	67.6	Low	82.8	Confident	31 Å²	31	66.3 Å²	66.3	19%	0.19	39%	0.389	C	S	.	.			trans	-78.7	129.1	-179.4	40.7	0	0	0	0	110.4	L353 A361 G362 G366 F385	L353-T364 HydrophobicContact CD1-CG2 3.86Å; L353-T364 HydrophobicContact CD2-CG2 4.06Å; A361-T364 WeakPolarHBondContact O-CG2 3.38Å; A361-T364 PolarHBondContact O-OG1 2.86Å; G362-T364 PolarHBondContact O-N 2.85Å; T364-G366 PolarHBondContact O-N 3.11Å; T364-F385 WeakPolarHBondContact O-CE1 3.43Å
365	H	73.6	Confident	83	Confident	155 Å²	155	62.4 Å²	62.4	72%	0.718	37%	0.372	S	S	*	.			trans	-72.4	124	170.9	-68.9	-73.6	0	0	0	109.7	R329 V368	R329-H365 PolarHBondContact NH2-O 2.88Å; H365-V368 HydrophobicContact CB-CG1 4.13Å; H365-V368 WeakPolarHBondContact O-CG1 3.2Å
366	G	76.1	Confident	83.3	Confident	16 Å²	16	61.3 Å²	61.3	17%	0.165	37%	0.367	C	S	.	.	S	Bend	trans	-67.9	-36.8	-178	0	0	0	0	0	114.2	T364 V368 I383	T364-G366 PolarHBondContact O-N 3.11Å; G366-V368 VanDerWaalsContact C-N 3.33Å; G366-V368 PolarHBondContact O-N 3.15Å; G366-I383 WeakPolarHBondContact O-CD1 3.48Å
367	Q	84.1	Confident	83.8	Confident	92 Å²	92	60 Å²	60	43%	0.43	36%	0.361	S	S	.	.	S	Bend	trans	-86.9	64.4	-176.1	-59.9	-167.6	-55.4	0	0	112.7	V378 L379	Q367-V378 WeakPolarHBondContact CG-O 3.45Å; Q367-V378 PolarHBondContact NE2-O 3.5Å; Q367-L379 PolarHBondContact NE2-O 3.09Å
368	V	89.3	Confident	84.5	Confident	29 Å²	29	55.5 Å²	55.5	18%	0.176	32%	0.324	C	S	.	.			trans	-120.9	161.5	172.9	-54.3	0	0	0	0	110.8	R329 L351 H365 G366 M374	R329-V368 HydrophobicContact CB-CG2 4.5Å; L351-V368 HydrophobicContact CD1-CB 4.21Å; L351-V368 HydrophobicContact CD1-CG2 4.17Å; L351-V368 HydrophobicContact CD2-CB 4.39Å; L351-V368 HydrophobicContact CD2-CG2 4.41Å; H365-V368 HydrophobicContact CB-CG1 4.13Å; H365-V368 WeakPolarHBondContact O-CG1 3.2Å; G366-V368 VanDerWaalsContact C-N 3.33Å; G366-V368 PolarHBondContact O-N 3.15Å; V368-M374 VanDerWaalsContact C-CE 3.44Å; V368-M374 WeakPolarHBondContact O-CE 3.34Å
369	G	92.2	Very high	85.7	Confident	17 Å²	17	51.2 Å²	51.2	18%	0.175	28%	0.279	C	S	.	.	S	Bend	trans	110.3	-170.5	-178.6	0	0	0	0	0	111.1	D330	D330-G369 WeakPolarHBondContact OD1-CA 3.4Å
370	T	95.4	Very high	86.4	Confident	43 Å²	43	49.3 Å²	49.3	26%	0.264	27%	0.273	S	S	.	.			trans	-88.3	118.9	-179.2	-55.1	0	0	0	0	110	D330 K332 R372 Y373 M374	D330-T370 WeakPolarHBondContact OD1-CB 3.48Å; D330-T370 PolarHBondContact OD1-N 3.43Å; D330-T370 PolarHBondContact OD1-OG1 3.09Å; K332-T370 HydrophobicContact CD-CG2 4.42Å; K332-T370 WeakPolarHBondContact CD-OG1 3.39Å; K332-T370 PolarHBondContact NZ-OG1 3.03Å; T370-R372 VanDerWaalsContact C-N 3.3Å; T370-R372 HydrophobicContact CG2-CG 4.26Å; T370-R372 PolarHBondContact O-N 3.44Å; T370-R372 VanDerWaalsContact O-N 3.09Å; T370-Y373 HydrophobicContact CG2-CD2 3.94Å; T370-Y373 HydrophobicContact CG2-CE2 4.44Å; T370-Y373 PolarHBondContact O-N 2.85Å; T370-M374 PolarHBondContact O-N 2.92Å
371	R	96.5	Very high	87.3	Confident	132 Å²	132	46 Å²	46	50%	0.498	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-46.2	-46	-170.7	-65	-176.1	-171.2	134.7	-0.6	114.9	Y373 M374 P431 M436	R371-Y373 PolarHBondContact O-N 2.87Å; R371-Y373 VanDerWaalsContact O-N 3.16Å; R371-M374 HydrophobicContact CG-SD 4.42Å; R371-M374 WeakPolarHBondContact O-CB 3.24Å; R371-M374 PolarHBondContact O-N 2.85Å; R371-M374 VanDerWaalsContact O-N 3.08Å; R371-P431 PolarHBondContact NH1-O 2.94Å; R371-M436 HydrophobicContact CB-CG 4.22Å
372	R	98	Very high	88.3	Confident	11 Å²	11	48.8 Å²	48.8	4%	0.042	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-66	-16.7	-178.5	73	169.2	57.3	-96.2	2.3	115.3	T370 P422 F423 G428 Q429 P431 M436	T370-R372 VanDerWaalsContact C-N 3.3Å; T370-R372 HydrophobicContact CG2-CG 4.26Å; T370-R372 PolarHBondContact O-N 3.44Å; T370-R372 VanDerWaalsContact O-N 3.09Å; R372-P422 PolarHBondContact NH1-O 3.45Å; R372-F423 WeakPolarHBondContact O-CD2 3.41Å; R372-F423 WeakPolarHBondContact O-CE2 3.3Å; R372-G428 PolarHBondContact NH2-O 3.38Å; R372-Q429 VanDerWaalsContact NH2-C 3.25Å; R372-Q429 PolarHBondContact NH2-O 3.19Å; R372-P431 HydrophobicContact CB-CG 4.34Å; R372-P431 VanDerWaalsContact NH2-CD 3.27Å; R372-M436 HydrophobicContact CB-CE 4.38Å; R372-M436 HydrophobicContact CB-SD 4.1Å
373	Y	98.6	Very high	89.4	Confident	13 Å²	13	47.3 Å²	47.3	5%	0.051	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-104	0.4	177.4	-66	-90.9	0	0	0	112.3	K332 S333 T370 R371 A397 L400 V401 E404 P422	K332-Y373 HydrophobicContact CB-CD1 4.01Å; K332-Y373 HydrophobicContact CB-CD2 3.7Å; K332-Y373 HydrophobicContact CB-CE1 3.83Å; K332-Y373 HydrophobicContact CB-CE2 3.5Å; K332-Y373 HydrophobicContact CB-CG 3.97Å; S333-Y373 PolarHBondContact OG-OH 3.26Å; T370-Y373 HydrophobicContact CG2-CD2 3.94Å; T370-Y373 HydrophobicContact CG2-CE2 4.44Å; T370-Y373 PolarHBondContact O-N 2.85Å; R371-Y373 PolarHBondContact O-N 2.87Å; R371-Y373 VanDerWaalsContact O-N 3.16Å; Y373-A397 HydrophobicContact CD1-CB 4.5Å; Y373-L400 HydrophobicContact CD1-CB 3.94Å; Y373-L400 HydrophobicContact CD1-CD1 3.87Å; Y373-L400 HydrophobicContact CE1-CB 4.02Å; Y373-L400 HydrophobicContact CG-CD1 4.37Å; Y373-V401 HydrophobicContact CE1-CG2 4.18Å; Y373-E404 WeakPolarHBondContact CE1-OE1 3.4Å; Y373-E404 VanDerWaalsContact OH-CD 3.31Å; Y373-E404 PolarHBondContact OH-OE1 3.21Å; Y373-E404 PolarHBondContact OH-OE2 3.1Å; Y373-P422 HydrophobicContact CE1-CG 3.89Å; Y373-P422 WeakPolarHBondContact OH-CD 3.5Å
374	M	98.3	Very high	90.5	Very high	13 Å²	13	43 Å²	43	6%	0.064	24%	0.237	C	C	.	.			trans	-70.8	131.9	179.6	-72.2	178.6	167.1	0	0	110.5	V368 T370 R371 V378 L379 Y396	V368-M374 VanDerWaalsContact C-CE 3.44Å; V368-M374 WeakPolarHBondContact O-CE 3.34Å; T370-M374 PolarHBondContact O-N 2.92Å; R371-M374 HydrophobicContact CG-SD 4.42Å; R371-M374 WeakPolarHBondContact O-CB 3.24Å; R371-M374 PolarHBondContact O-N 2.85Å; R371-M374 VanDerWaalsContact O-N 3.08Å; M374-V378 HydrophobicContact CB-CB 4.15Å; M374-V378 HydrophobicContact CB-CG1 3.99Å; M374-V378 HydrophobicContact CE-CG1 4.37Å; M374-V378 HydrophobicContact CG-CG1 3.84Å; M374-V378 HydrophobicContact SD-CG1 3.94Å; M374-L379 HydrophobicContact CB-CD2 3.71Å; M374-L379 HydrophobicContact CB-CG 3.84Å; M374-L379 HydrophobicContact CG-CD2 4.48Å; M374-L379 HydrophobicContact SD-CD2 4.04Å; M374-Y396 VanDerWaalsContact O-CE1 3.28Å; M374-Y396 WeakPolarHBondContact O-CE1 3.24Å
375	A	98.3	Very high	91.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.249	C	C	.	.			trans	-65.6	157.2	173.6	0	0	0	0	0	111.6	E377 V378 L379 I393 Y396	A375-E377 VanDerWaalsContact C-N 3.31Å; A375-E377 WeakPolarHBondContact CB-OE2 3.49Å; A375-E377 PolarHBondContact O-N 2.88Å; A375-V378 HydrophobicContact CB-CG2 4.15Å; A375-V378 WeakPolarHBondContact O-CA 3.2Å; A375-V378 WeakPolarHBondContact O-CB 3.32Å; A375-V378 PolarHBondContact O-N 2.87Å; A375-L379 PolarHBondContact O-N 3.26Å; A375-I393 HydrophobicContact CB-CG1 4.32Å; A375-Y396 VanDerWaalsContact CA-CD1 3.45Å; A375-Y396 HydrophobicContact CB-CD1 3.81Å; A375-Y396 HydrophobicContact CB-CD2 4.22Å; A375-Y396 HydrophobicContact CB-CG 3.66Å
376	P	98.2	Very high	92.2	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.013	24%	0.24	C	C	.	.	H	α-helix	trans	-49.8	-47.9	-178.8	-25.2	30.9	0	0	0	113.8	V378 L379 E380 Y396 V440 V441	P376-V378 PolarHBondContact O-N 2.9Å; P376-L379 WeakPolarHBondContact O-CB 3.44Å; P376-L379 PolarHBondContact O-N 3.41Å; P376-E380 WeakPolarHBondContact O-CG 3.09Å; P376-E380 PolarHBondContact O-N 2.58Å; P376-Y396 HydrophobicContact CG-CE2 4.35Å; P376-V440 HydrophobicContact CB-CG1 4.31Å; P376-V440 HydrophobicContact CG-CG1 3.77Å; P376-V441 HydrophobicContact CB-CG2 4.21Å
377	E	96.9	Very high	92.9	Very high	27 Å²	27	48.4 Å²	48.4	13%	0.126	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-26.5	-179.5	67.6	-82.8	-162.7	0	0	113	A375 G381 A382 I383 I393 R477	A375-E377 VanDerWaalsContact C-N 3.31Å; A375-E377 WeakPolarHBondContact CB-OE2 3.49Å; A375-E377 PolarHBondContact O-N 2.88Å; E377-G381 PolarHBondContact O-N 3.1Å; E377-A382 PolarHBondContact O-N 3.23Å; E377-I383 HydrophobicContact CG-CG1 4.46Å; E377-I393 HydrophobicContact CG-CG1 4.48Å; E377-I393 WeakPolarHBondContact OE1-CG1 3.24Å; E377-R477 IonicContact OE1-CZ 3.53Å; E377-R477 IonicContact OE1-NH1 3.68Å; E377-R477 PolarHBondContact OE1-NH1 3.36Å; E377-R477 IonicContact OE1-NH2 2.68Å; E377-R477 PolarHBondContact OE1-NH2 3.18Å; E377-R477 IonicContact OE2-CZ 3.55Å; E377-R477 IonicContact OE2-NH1 3.37Å; E377-R477 IonicContact OE2-NH2 2.71Å; E377-R477 PolarHBondContact OE2-NH2 3.3Å
378	V	96.5	Very high	93.4	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.018	25%	0.248	C	C	.	.	H	α-helix	trans	-74.7	-43.9	173.4	-179.2	0	0	0	0	110	Q367 M374 A375 P376 E380 G381 I383 I393	Q367-V378 WeakPolarHBondContact CG-O 3.45Å; Q367-V378 PolarHBondContact NE2-O 3.5Å; M374-V378 HydrophobicContact CB-CB 4.15Å; M374-V378 HydrophobicContact CB-CG1 3.99Å; M374-V378 HydrophobicContact CE-CG1 4.37Å; M374-V378 HydrophobicContact CG-CG1 3.84Å; M374-V378 HydrophobicContact SD-CG1 3.94Å; A375-V378 HydrophobicContact CB-CG2 4.15Å; A375-V378 WeakPolarHBondContact O-CA 3.2Å; A375-V378 WeakPolarHBondContact O-CB 3.32Å; A375-V378 PolarHBondContact O-N 2.87Å; P376-V378 PolarHBondContact O-N 2.9Å; V378-E380 VanDerWaalsContact C-N 3.28Å; V378-E380 PolarHBondContact O-N 2.89Å; V378-G381 PolarHBondContact O-N 2.85Å; V378-I383 HydrophobicContact CB-CD1 4.07Å; V378-I383 HydrophobicContact CB-CG1 4.42Å; V378-I383 HydrophobicContact CG1-CD1 4.08Å; V378-I383 HydrophobicContact CG2-CD1 3.82Å; V378-I383 HydrophobicContact CG2-CG1 4.03Å; V378-I393 HydrophobicContact CG2-CB 4.37Å; V378-I393 HydrophobicContact CG2-CD1 3.46Å; V378-I393 VanDerWaalsContact CG2-CD1 3.46Å; V378-I393 HydrophobicContact CG2-CG1 3.62Å; V378-I393 HydrophobicContact CG2-CG2 3.8Å
379	L	96.9	Very high	93.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.3	-37.2	177.3	-67.1	170.7	0	0	0	111.5	Q367 M374 A375 P376 G381 L433 M436 Q437 V440 V441	Q367-L379 PolarHBondContact NE2-O 3.09Å; M374-L379 HydrophobicContact CB-CD2 3.71Å; M374-L379 HydrophobicContact CB-CG 3.84Å; M374-L379 HydrophobicContact CG-CD2 4.48Å; M374-L379 HydrophobicContact SD-CD2 4.04Å; A375-L379 PolarHBondContact O-N 3.26Å; P376-L379 WeakPolarHBondContact O-CB 3.44Å; P376-L379 PolarHBondContact O-N 3.41Å; L379-G381 VanDerWaalsContact C-N 3.27Å; L379-G381 PolarHBondContact O-N 3.31Å; L379-L433 HydrophobicContact CD2-CD1 3.6Å; L379-M436 HydrophobicContact CD1-CB 4.02Å; L379-M436 HydrophobicContact CD2-CB 3.67Å; L379-Q437 HydrophobicContact CB-CG 3.96Å; L379-Q437 PolarHBondContact O-NE2 2.8Å; L379-V440 HydrophobicContact CD1-CB 3.69Å; L379-V440 HydrophobicContact CD1-CG1 3.71Å; L379-V440 HydrophobicContact CD1-CG2 4.28Å; L379-V441 HydrophobicContact CB-CG2 3.86Å; L379-V441 HydrophobicContact CD1-CG2 4.14Å
380	E	94	Very high	93.8	Very high	105 Å²	105	46.1 Å²	46.1	49%	0.491	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.6	175.1	-68.2	178.6	117	0	0	113.7	P376 V378 A382 V441	P376-E380 WeakPolarHBondContact O-CG 3.09Å; P376-E380 PolarHBondContact O-N 2.58Å; V378-E380 VanDerWaalsContact C-N 3.28Å; V378-E380 PolarHBondContact O-N 2.89Å; E380-A382 HydrophobicContact CB-CB 4.23Å; E380-A382 PolarHBondContact O-N 2.89Å; E380-V441 VanDerWaalsContact CD-CG1 3.44Å; E380-V441 HydrophobicContact CG-CB 4.43Å; E380-V441 HydrophobicContact CG-CG1 3.62Å; E380-V441 HydrophobicContact CG-CG2 3.98Å; E380-V441 VanDerWaalsContact OE1-CG1 3.31Å; E380-V441 WeakPolarHBondContact OE1-CG1 3.35Å
381	G	91.1	Very high	93.9	Very high	43 Å²	43	45.1 Å²	45.1	44%	0.443	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	15.6	-174.7	0	0	0	0	0	113.5	E377 V378 L379 I383	E377-G381 PolarHBondContact O-N 3.1Å; V378-G381 PolarHBondContact O-N 2.85Å; L379-G381 VanDerWaalsContact C-N 3.27Å; L379-G381 PolarHBondContact O-N 3.31Å; G381-I383 PolarHBondContact O-N 2.84Å
382	A	87.9	Confident	94	Very high	72 Å²	72	41.8 Å²	41.8	60%	0.595	22%	0.218	S	C	*	.			trans	-102.2	45.8	-174.1	0	0	0	0	0	112.1	E377 E380	E377-A382 PolarHBondContact O-N 3.23Å; E380-A382 HydrophobicContact CB-CB 4.23Å; E380-A382 PolarHBondContact O-N 2.89Å
383	I	86.3	Confident	94	Very high	16 Å²	16	42.1 Å²	42.1	8%	0.082	22%	0.221	C	C	.	.			trans	-85.5	132.6	-176	-58.1	153.9	0	0	0	110.6	G366 E377 V378 G381 I393	G366-I383 WeakPolarHBondContact O-CD1 3.48Å; E377-I383 HydrophobicContact CG-CG1 4.46Å; V378-I383 HydrophobicContact CB-CD1 4.07Å; V378-I383 HydrophobicContact CB-CG1 4.42Å; V378-I383 HydrophobicContact CG1-CD1 4.08Å; V378-I383 HydrophobicContact CG2-CD1 3.82Å; V378-I383 HydrophobicContact CG2-CG1 4.03Å; G381-I383 PolarHBondContact O-N 2.84Å; I383-I393 HydrophobicContact CD1-CD1 4.41Å; I383-I393 HydrophobicContact CG1-CD1 4.25Å; I383-I393 HydrophobicContact CG2-CD1 3.92Å
384	N	85.1	Confident	94	Very high	83 Å²	83	41.5 Å²	41.5	44%	0.444	22%	0.218	S	C	.	.			trans	-78.4	128.5	165.1	-175.5	6.8	0	0	0	110.1	Q386 S389	N384-Q386 PolarHBondContact ND2-OE1 3.43Å; N384-Q386 VanDerWaalsContact ND2-OE1 3.12Å; N384-Q386 PolarHBondContact O-N 2.93Å; N384-Q386 WeakPolarHBondContact OD1-CG 3.35Å; N384-S389 WeakPolarHBondContact O-CB 3.29Å; N384-S389 PolarHBondContact O-OG 2.87Å
385	F	86.6	Confident	94	Very high	101 Å²	101	41 Å²	41	44%	0.443	22%	0.216	S	C	.	.			trans	-80.8	46.2	-177.2	-68.9	-84.5	0	0	0	113	A361 T364 F390	A361-F385 HydrophobicContact CB-CB 4.48Å; T364-F385 WeakPolarHBondContact O-CE1 3.43Å; F385-F390 HydrophobicContact CD1-CE2 4.02Å; F385-F390 AromaticContact CD1-CZ 3.79Å; F385-F390 HydrophobicContact CD1-CZ 3.79Å; F385-F390 HydrophobicContact CE1-CZ 4.14Å
386	Q	89.1	Confident	94	Very high	113 Å²	113	41 Å²	41	53%	0.528	22%	0.216	S	C	.	.	S	Bend	trans	-109.3	151.4	176.5	-72	179.1	-1.8	0	0	110.4	N384 D388 S389 F390	N384-Q386 PolarHBondContact ND2-OE1 3.43Å; N384-Q386 VanDerWaalsContact ND2-OE1 3.12Å; N384-Q386 PolarHBondContact O-N 2.93Å; N384-Q386 WeakPolarHBondContact OD1-CG 3.35Å; Q386-D388 VanDerWaalsContact C-N 3.33Å; Q386-D388 PolarHBondContact O-N 3.49Å; Q386-S389 WeakPolarHBondContact O-CB 3.16Å; Q386-S389 PolarHBondContact O-N 3.03Å; Q386-F390 WeakPolarHBondContact O-CD2 3.49Å; Q386-F390 PolarHBondContact O-N 3.03Å
387	R	92.3	Very high	94.1	Very high	101 Å²	101	41.2 Å²	41.2	38%	0.381	22%	0.217	S	C	.	.	H	α-helix	trans	-46.3	-57.4	178.9	179.8	-168	68	168.2	-1.8	111.3	F355 S389 F390 L391	F355-R387 HydrophobicContact CB-CB 4.17Å; F355-R387 HydrophobicContact CB-CG 3.98Å; F355-R387 HydrophobicContact CD1-CB 3.81Å; F355-R387 HydrophobicContact CD1-CG 4.27Å; F355-R387 HydrophobicContact CD2-CB 4.21Å; F355-R387 HydrophobicContact CD2-CG 3.77Å; F355-R387 HydrophobicContact CE1-CB 4.27Å; F355-R387 HydrophobicContact CE2-CG 4.34Å; F355-R387 HydrophobicContact CG-CB 3.78Å; F355-R387 HydrophobicContact CG-CG 3.73Å; R387-S389 VanDerWaalsContact C-N 3.25Å; R387-S389 PolarHBondContact O-N 2.64Å; R387-F390 PolarHBondContact O-N 2.84Å; R387-L391 HydrophobicContact CG-CD1 4.06Å; R387-L391 HydrophobicContact CG-CG 4.25Å; R387-L391 WeakPolarHBondContact O-CG 3.33Å; R387-L391 PolarHBondContact O-N 3.36Å
388	D	93.4	Very high	94.2	Very high	70 Å²	70	40.1 Å²	40.1	37%	0.374	21%	0.212	S	C	.	.	H	α-helix	trans	-63.6	-31.9	-171.5	-60.4	-10.4	0	0	0	112.2	Q386 L391 R392	Q386-D388 VanDerWaalsContact C-N 3.33Å; Q386-D388 PolarHBondContact O-N 3.49Å; D388-L391 PolarHBondContact O-N 3.27Å; D388-R392 WeakPolarHBondContact O-CB 3.22Å; D388-R392 VanDerWaalsContact O-CD 3.31Å; D388-R392 WeakPolarHBondContact O-CD 3.48Å; D388-R392 WeakPolarHBondContact O-CG 3.49Å; D388-R392 PolarHBondContact O-N 3.31Å
389	S	94	Very high	94.3	Very high	18 Å²	18	40 Å²	40	13%	0.126	21%	0.212	C	C	.	.	H	α-helix	trans	-62.1	-45.1	173.7	-53.4	0	0	0	0	111.8	N384 Q386 R387 R392 I393	N384-S389 WeakPolarHBondContact O-CB 3.29Å; N384-S389 PolarHBondContact O-OG 2.87Å; Q386-S389 WeakPolarHBondContact O-CB 3.16Å; Q386-S389 PolarHBondContact O-N 3.03Å; R387-S389 VanDerWaalsContact C-N 3.25Å; R387-S389 PolarHBondContact O-N 2.64Å; S389-R392 PolarHBondContact O-N 3.44Å; S389-I393 VanDerWaalsContact O-CG1 3.32Å; S389-I393 WeakPolarHBondContact O-CG1 3.47Å; S389-I393 PolarHBondContact O-N 3.41Å; S389-I393 VanDerWaalsContact O-N 3.08Å
390	F	95.7	Very high	94.4	Very high	2 Å²	2	40 Å²	40	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-68.3	-35.6	176.2	-74.4	-81.1	0	0	0	113.1	A327 R329 L353 F355 F385 Q386 R387 R392 I393 D394	A327-F390 HydrophobicContact CB-CB 3.58Å; R329-F390 HydrophobicContact CG-CD1 4.14Å; L353-F390 HydrophobicContact CD2-CD2 4.37Å; L353-F390 HydrophobicContact CD2-CE1 4.4Å; L353-F390 HydrophobicContact CD2-CE2 4.09Å; L353-F390 HydrophobicContact CD2-CZ 4.11Å; F355-F390 AromaticContact CE1-CD2 3.83Å; F355-F390 HydrophobicContact CE1-CD2 3.83Å; F355-F390 HydrophobicContact CE1-CE2 4.35Å; F355-F390 HydrophobicContact CE2-CB 4.16Å; F355-F390 HydrophobicContact CZ-CB 3.69Å; F355-F390 AromaticContact CZ-CD2 3.45Å; F355-F390 HydrophobicContact CZ-CD2 3.45Å; F355-F390 VanDerWaalsContact CZ-CD2 3.45Å; F355-F390 HydrophobicContact CZ-CE2 4.25Å; F355-F390 AromaticContact CZ-CG 3.76Å; F355-F390 HydrophobicContact CZ-CG 3.76Å; F385-F390 HydrophobicContact CD1-CE2 4.02Å; F385-F390 AromaticContact CD1-CZ 3.79Å; F385-F390 HydrophobicContact CD1-CZ 3.79Å; F385-F390 HydrophobicContact CE1-CZ 4.14Å; Q386-F390 WeakPolarHBondContact O-CD2 3.49Å; Q386-F390 PolarHBondContact O-N 3.03Å; R387-F390 PolarHBondContact O-N 2.84Å; F390-R392 VanDerWaalsContact C-N 3.34Å; F390-I393 HydrophobicContact CD1-CD1 4.33Å; F390-I393 WeakPolarHBondContact O-CB 3.42Å; F390-I393 PolarHBondContact O-N 3.5Å; F390-D394 PolarHBondContact O-N 3.46Å
391	L	97.7	Very high	94.6	Very high	23 Å²	23	35 Å²	35	12%	0.12	19%	0.188	C	C	.	.	H	α-helix	trans	-64.4	-41.5	174.7	-54.3	-174.4	0	0	0	110.8	H312 A327 R387 D388 I393 D394 M395	H312-L391 HydrophobicContact CB-CD1 4.27Å; H312-L391 HydrophobicContact CB-CD2 4.12Å; A327-L391 HydrophobicContact CB-CD2 4.1Å; R387-L391 HydrophobicContact CG-CD1 4.06Å; R387-L391 HydrophobicContact CG-CG 4.25Å; R387-L391 WeakPolarHBondContact O-CG 3.33Å; R387-L391 PolarHBondContact O-N 3.36Å; D388-L391 PolarHBondContact O-N 3.27Å; L391-I393 VanDerWaalsContact C-N 3.3Å; L391-I393 PolarHBondContact O-N 2.99Å; L391-D394 WeakPolarHBondContact O-CB 3.36Å; L391-D394 PolarHBondContact O-N 3.33Å; L391-M395 WeakPolarHBondContact O-CG 3.37Å; L391-M395 PolarHBondContact O-N 3.12Å; L391-M395 VanDerWaalsContact O-N 3.12Å
392	R	98.4	Very high	95	Very high	61 Å²	61	33 Å²	33	23%	0.23	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-29.7	176.2	-71	160.2	172.4	-177.4	1.1	113	D388 S389 F390 M395 Y396 A474 E475 R477	D388-R392 WeakPolarHBondContact O-CB 3.22Å; D388-R392 VanDerWaalsContact O-CD 3.31Å; D388-R392 WeakPolarHBondContact O-CD 3.48Å; D388-R392 WeakPolarHBondContact O-CG 3.49Å; D388-R392 PolarHBondContact O-N 3.31Å; S389-R392 PolarHBondContact O-N 3.44Å; F390-R392 VanDerWaalsContact C-N 3.34Å; R392-M395 PolarHBondContact O-N 2.71Å; R392-Y396 PolarHBondContact O-N 3.47Å; R392-Y396 VanDerWaalsContact O-N 3.14Å; R392-A474 HydrophobicContact CB-CB 4.24Å; R392-A474 WeakPolarHBondContact CD-O 3.36Å; R392-A474 VanDerWaalsContact CG-O 3.29Å; R392-A474 WeakPolarHBondContact CG-O 3.07Å; R392-A474 PolarHBondContact NE-O 3.15Å; R392-E475 VanDerWaalsContact CZ-CA 3.47Å; R392-E475 IonicContact CZ-OE1 2.83Å; R392-E475 VanDerWaalsContact NH1-CG 3.35Å; R392-E475 IonicContact NH1-OE1 3.05Å; R392-E475 PolarHBondContact NH1-OE1 3.06Å; R392-E475 IonicContact NH2-OE1 3.34Å; R392-R477 WeakPolarHBondContact O-CD 3.26Å; R392-R477 PolarHBondContact O-NH1 3.05Å
393	I	98.3	Very high	95.5	Very high	18 Å²	18	30.6 Å²	30.6	9%	0.092	14%	0.143	C	C	.	.	H	α-helix	trans	-65.7	-45	172.2	-70.4	163.2	0	0	0	110.6	A375 E377 V378 I383 S389 F390 L391 M395 Y396 A397	A375-I393 HydrophobicContact CB-CG1 4.32Å; E377-I393 HydrophobicContact CG-CG1 4.48Å; E377-I393 WeakPolarHBondContact OE1-CG1 3.24Å; V378-I393 HydrophobicContact CG2-CB 4.37Å; V378-I393 HydrophobicContact CG2-CD1 3.46Å; V378-I393 VanDerWaalsContact CG2-CD1 3.46Å; V378-I393 HydrophobicContact CG2-CG1 3.62Å; V378-I393 HydrophobicContact CG2-CG2 3.8Å; I383-I393 HydrophobicContact CD1-CD1 4.41Å; I383-I393 HydrophobicContact CG1-CD1 4.25Å; I383-I393 HydrophobicContact CG2-CD1 3.92Å; S389-I393 VanDerWaalsContact O-CG1 3.32Å; S389-I393 WeakPolarHBondContact O-CG1 3.47Å; S389-I393 PolarHBondContact O-N 3.41Å; S389-I393 VanDerWaalsContact O-N 3.08Å; F390-I393 HydrophobicContact CD1-CD1 4.33Å; F390-I393 WeakPolarHBondContact O-CB 3.42Å; F390-I393 PolarHBondContact O-N 3.5Å; L391-I393 VanDerWaalsContact C-N 3.3Å; L391-I393 PolarHBondContact O-N 2.99Å; I393-M395 PolarHBondContact O-N 3.08Å; I393-Y396 PolarHBondContact O-N 2.76Å; I393-A397 PolarHBondContact O-N 3.42Å
394	D	98.8	Very high	96.1	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-60.7	-36.9	175.5	-75.2	-19	0	0	0	111.7	L308 H312 A327 H328 R329 I331 F390 L391 A397 F398	L308-D394 HydrophobicContact CD1-CB 4.35Å; H312-D394 IonicContact CD2-OD2 3.17Å; H312-D394 IonicContact CE1-OD2 3.6Å; H312-D394 IonicContact NE2-OD2 2.76Å; H312-D394 PolarHBondContact NE2-OD2 3.13Å; A327-D394 WeakPolarHBondContact CA-OD2 3.36Å; H328-D394 PolarHBondContact N-OD2 2.91Å; R329-D394 WeakPolarHBondContact CA-OD1 3.16Å; R329-D394 PolarHBondContact N-OD1 3.31Å; I331-D394 HydrophobicContact CG1-CB 4.04Å; F390-D394 PolarHBondContact O-N 3.46Å; L391-D394 WeakPolarHBondContact O-CB 3.36Å; L391-D394 PolarHBondContact O-N 3.33Å; D394-A397 PolarHBondContact O-N 2.93Å; D394-F398 WeakPolarHBondContact O-CB 3.25Å; D394-F398 PolarHBondContact O-N 2.97Å
395	M	98.9	Very high	96.8	Very high	3 Å²	3	26 Å²	26	2%	0.015	12%	0.119	C	C	.	.	H	α-helix	trans	-69.8	-36.9	-179.1	-66.3	-53	-53.1	0	0	113.2	L308 L391 R392 I393 A397 F398 G399 L478 A480 V483	L308-M395 HydrophobicContact CD2-SD 3.78Å; L391-M395 WeakPolarHBondContact O-CG 3.37Å; L391-M395 PolarHBondContact O-N 3.12Å; L391-M395 VanDerWaalsContact O-N 3.12Å; R392-M395 PolarHBondContact O-N 2.71Å; I393-M395 PolarHBondContact O-N 3.08Å; M395-A397 VanDerWaalsContact C-N 3.35Å; M395-A397 PolarHBondContact O-N 3.35Å; M395-F398 HydrophobicContact CE-CD1 4.16Å; M395-F398 PolarHBondContact O-N 2.85Å; M395-G399 PolarHBondContact O-N 3.32Å; M395-L478 WeakPolarHBondContact CB-O 3.44Å; M395-L478 WeakPolarHBondContact CE-O 3.38Å; M395-L478 WeakPolarHBondContact CG-O 3.33Å; M395-A480 HydrophobicContact CE-CB 4.3Å; M395-A480 VanDerWaalsContact SD-CA 3.55Å; M395-A480 HydrophobicContact SD-CB 3.6Å; M395-A480 PolarHBondContact SD-N 3.37Å; M395-V483 HydrophobicContact CE-CB 4.34Å; M395-V483 HydrophobicContact CE-CG2 3.57Å
396	Y	98.9	Very high	97.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-56.5	-50.8	169.5	176	-87.6	0	0	0	111.2	M374 A375 P376 R392 I393 F398 G399 L400 V440 C469 W470	M374-Y396 VanDerWaalsContact O-CE1 3.28Å; M374-Y396 WeakPolarHBondContact O-CE1 3.24Å; A375-Y396 VanDerWaalsContact CA-CD1 3.45Å; A375-Y396 HydrophobicContact CB-CD1 3.81Å; A375-Y396 HydrophobicContact CB-CD2 4.22Å; A375-Y396 HydrophobicContact CB-CG 3.66Å; P376-Y396 HydrophobicContact CG-CE2 4.35Å; R392-Y396 PolarHBondContact O-N 3.47Å; R392-Y396 VanDerWaalsContact O-N 3.14Å; I393-Y396 PolarHBondContact O-N 2.76Å; Y396-F398 VanDerWaalsContact C-N 3.29Å; Y396-F398 PolarHBondContact O-N 2.87Å; Y396-G399 PolarHBondContact O-N 3.42Å; Y396-L400 HydrophobicContact CD1-CD1 4.22Å; Y396-L400 HydrophobicContact CE1-CD1 3.66Å; Y396-L400 HydrophobicContact CE1-CG 4.38Å; Y396-L400 PolarHBondContact O-N 2.99Å; Y396-V440 WeakPolarHBondContact OH-CG1 3.12Å; Y396-C469 VanDerWaalsContact CA-O 3.32Å; Y396-C469 WeakPolarHBondContact CA-O 3.44Å; Y396-W470 HydrophobicContact CD2-CB 3.9Å; Y396-W470 HydrophobicContact CE2-CB 3.88Å
397	A	98.9	Very high	97.7	Very high	5 Å²	5	16.3 Å²	16.3	4%	0.041	8%	0.076	C	C	.	.	H	α-helix	trans	-63.7	-35.9	178.9	0	0	0	0	0	112.1	I331 Y373 I393 D394 M395 L400 V401	I331-A397 HydrophobicContact CB-CB 3.8Å; I331-A397 HydrophobicContact CG2-CB 3.93Å; I331-A397 WeakPolarHBondContact O-CB 3.47Å; Y373-A397 HydrophobicContact CD1-CB 4.5Å; I393-A397 PolarHBondContact O-N 3.42Å; D394-A397 PolarHBondContact O-N 2.93Å; M395-A397 VanDerWaalsContact C-N 3.35Å; M395-A397 PolarHBondContact O-N 3.35Å; A397-L400 WeakPolarHBondContact O-CB 3.5Å; A397-L400 PolarHBondContact O-N 3.35Å; A397-V401 PolarHBondContact O-N 3.16Å
398	F	98.9	Very high	98	Very high	5 Å²	5	12.5 Å²	12.5	2%	0.022	6%	0.062	C	C	.	.	H	α-helix	trans	-66.8	-36.2	175.9	-166.4	-117	0	0	0	112.4	A304 A305 L308 I331 D394 M395 Y396 L400 V401 L402 V483	A304-F398 HydrophobicContact CB-CE2 3.78Å; A304-F398 HydrophobicContact CB-CZ 3.97Å; A305-F398 HydrophobicContact CB-CE1 3.79Å; A305-F398 HydrophobicContact CB-CZ 3.86Å; L308-F398 HydrophobicContact CD2-CB 3.97Å; L308-F398 HydrophobicContact CD2-CD1 4.44Å; L308-F398 HydrophobicContact CD2-CD2 4.18Å; L308-F398 HydrophobicContact CD2-CG 3.94Å; I331-F398 HydrophobicContact CG2-CB 4.2Å; I331-F398 HydrophobicContact CG2-CD2 4.33Å; D394-F398 WeakPolarHBondContact O-CB 3.25Å; D394-F398 PolarHBondContact O-N 2.97Å; M395-F398 HydrophobicContact CE-CD1 4.16Å; M395-F398 PolarHBondContact O-N 2.85Å; Y396-F398 VanDerWaalsContact C-N 3.29Å; Y396-F398 PolarHBondContact O-N 2.87Å; F398-L400 VanDerWaalsContact C-N 3.27Å; F398-L400 PolarHBondContact O-N 3.47Å; F398-V401 HydrophobicContact CD2-CB 4.39Å; F398-V401 WeakPolarHBondContact O-CB 3.47Å; F398-V401 PolarHBondContact O-N 3.4Å; F398-L402 HydrophobicContact CD1-CD1 4.17Å; F398-L402 HydrophobicContact CD1-CG 4.25Å; F398-L402 HydrophobicContact CE1-CD1 4.08Å; F398-L402 HydrophobicContact CE1-CD2 4Å; F398-L402 HydrophobicContact CE1-CG 4.05Å; F398-L402 HydrophobicContact CZ-CD2 4.06Å; F398-L402 HydrophobicContact CZ-CG 4.42Å; F398-L402 WeakPolarHBondContact O-CG 3.43Å; F398-L402 PolarHBondContact O-N 3.39Å; F398-V483 HydrophobicContact CD1-CG1 4.23Å; F398-V483 HydrophobicContact CE1-CG1 3.76Å
399	G	98.9	Very high	98.2	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-56.1	-41	171.1	0	0	0	0	0	112.6	M395 Y396 L402 W403	M395-G399 PolarHBondContact O-N 3.32Å; Y396-G399 PolarHBondContact O-N 3.42Å; G399-L402 PolarHBondContact O-N 3.1Å; G399-W403 PolarHBondContact O-N 2.93Å
400	L	98.9	Very high	98.3	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-65.9	-37.6	174.4	-59.8	170.7	0	0	0	112.2	Y373 Y396 A397 F398 W403 E404 P422 F423 P447 W470	Y373-L400 HydrophobicContact CD1-CB 3.94Å; Y373-L400 HydrophobicContact CD1-CD1 3.87Å; Y373-L400 HydrophobicContact CE1-CB 4.02Å; Y373-L400 HydrophobicContact CG-CD1 4.37Å; Y396-L400 HydrophobicContact CD1-CD1 4.22Å; Y396-L400 HydrophobicContact CE1-CD1 3.66Å; Y396-L400 HydrophobicContact CE1-CG 4.38Å; Y396-L400 PolarHBondContact O-N 2.99Å; A397-L400 WeakPolarHBondContact O-CB 3.5Å; A397-L400 PolarHBondContact O-N 3.35Å; F398-L400 VanDerWaalsContact C-N 3.27Å; F398-L400 PolarHBondContact O-N 3.47Å; L400-W403 WeakPolarHBondContact O-CB 3.14Å; L400-W403 PolarHBondContact O-N 3.22Å; L400-E404 WeakPolarHBondContact O-CG 3.34Å; L400-E404 PolarHBondContact O-N 3.34Å; L400-P422 HydrophobicContact CB-CB 4.09Å; L400-P422 HydrophobicContact CB-CG 3.94Å; L400-P422 HydrophobicContact CD1-CB 4.49Å; L400-P422 HydrophobicContact CD2-CB 3.98Å; L400-P422 HydrophobicContact CG-CB 4.42Å; L400-F423 HydrophobicContact CD1-CE2 3.98Å; L400-F423 HydrophobicContact CD2-CE2 3.69Å; L400-F423 HydrophobicContact CD2-CZ 4.05Å; L400-P447 HydrophobicContact CD2-CG 3.76Å; L400-W470 HydrophobicContact CD2-CE3 3.73Å; L400-W470 HydrophobicContact CD2-CZ3 4.13Å
401	V	98.9	Very high	98.2	Very high	1 Å²	1	12.9 Å²	12.9	1%	0.006	7%	0.068	C	C	.	.	H	α-helix	trans	-66.1	-37.7	174.8	177	0	0	0	0	111.8	L283 I331 Y373 A397 F398 W403 E404 L405	L283-V401 HydrophobicContact CD2-CG1 3.78Å; I331-V401 HydrophobicContact CG2-CG2 4.24Å; Y373-V401 HydrophobicContact CE1-CG2 4.18Å; A397-V401 PolarHBondContact O-N 3.16Å; F398-V401 HydrophobicContact CD2-CB 4.39Å; F398-V401 WeakPolarHBondContact O-CB 3.47Å; F398-V401 PolarHBondContact O-N 3.4Å; V401-W403 VanDerWaalsContact C-N 3.32Å; V401-E404 WeakPolarHBondContact O-CB 3.4Å; V401-E404 PolarHBondContact O-N 3.11Å; V401-L405 PolarHBondContact O-N 3.28Å; V401-L405 VanDerWaalsContact O-N 3.14Å
402	L	98.9	Very high	97.7	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-64.5	-37.7	173.3	-67.6	178.1	0	0	0	111.6	A301 F398 G399 L405 A406 T465 I466 V483 I487	A301-L402 HydrophobicContact CB-CD2 3.68Å; F398-L402 HydrophobicContact CD1-CD1 4.17Å; F398-L402 HydrophobicContact CD1-CG 4.25Å; F398-L402 HydrophobicContact CE1-CD1 4.08Å; F398-L402 HydrophobicContact CE1-CD2 4Å; F398-L402 HydrophobicContact CE1-CG 4.05Å; F398-L402 HydrophobicContact CZ-CD2 4.06Å; F398-L402 HydrophobicContact CZ-CG 4.42Å; F398-L402 WeakPolarHBondContact O-CG 3.43Å; F398-L402 PolarHBondContact O-N 3.39Å; G399-L402 PolarHBondContact O-N 3.1Å; L402-L405 HydrophobicContact CD2-CD1 4.43Å; L402-L405 WeakPolarHBondContact O-CB 3.41Å; L402-L405 PolarHBondContact O-N 3.27Å; L402-A406 PolarHBondContact O-N 3.34Å; L402-T465 HydrophobicContact CD1-CG2 4.41Å; L402-I466 HydrophobicContact CB-CD1 4.13Å; L402-I466 HydrophobicContact CB-CG1 3.6Å; L402-I466 HydrophobicContact CD1-CG1 4.42Å; L402-V483 HydrophobicContact CD1-CG1 3.95Å; L402-I487 HydrophobicContact CD2-CD1 4.32Å
403	W	98.8	Very high	96.8	Very high	20 Å²	20	16.2 Å²	16.2	8%	0.076	9%	0.093	C	C	.	.	H	α-helix	trans	-62.5	-41.7	172.1	175.2	91.3	0	0	0	112.3	G399 L400 V401 L405 A406 S407 P422 P447 C448 W453 I466 W470	G399-W403 PolarHBondContact O-N 2.93Å; L400-W403 WeakPolarHBondContact O-CB 3.14Å; L400-W403 PolarHBondContact O-N 3.22Å; V401-W403 VanDerWaalsContact C-N 3.32Å; W403-L405 VanDerWaalsContact C-N 3.26Å; W403-L405 PolarHBondContact O-N 3.11Å; W403-A406 PolarHBondContact O-N 2.77Å; W403-A406 VanDerWaalsContact O-N 3.17Å; W403-S407 WeakPolarHBondContact O-CB 3.33Å; W403-S407 PolarHBondContact O-N 3.21Å; W403-P422 HydrophobicContact CE3-CB 4.3Å; W403-P422 HydrophobicContact CE3-CG 4.11Å; W403-P422 HydrophobicContact CZ3-CB 4.36Å; W403-P422 HydrophobicContact CZ3-CG 4.24Å; W403-P447 HydrophobicContact CD2-CB 3.56Å; W403-P447 HydrophobicContact CD2-CG 4.28Å; W403-P447 HydrophobicContact CE3-CB 4.14Å; W403-P447 HydrophobicContact CG-CB 3.91Å; W403-P447 HydrophobicContact CH2-CB 4.23Å; W403-P447 HydrophobicContact CZ2-CB 3.67Å; W403-P447 HydrophobicContact CZ3-CB 4.45Å; W403-C448 PolarHBondContact NE1-O 3.42Å; W403-W453 AromaticContact CD1-CZ3 3.98Å; W403-W453 AromaticContact NE1-CH2 3.83Å; W403-I466 HydrophobicContact CB-CD1 4.33Å; W403-I466 HydrophobicContact CB-CG2 4.35Å; W403-W470 HydrophobicContact CB-CH2 4.45Å; W403-W470 HydrophobicContact CB-CZ3 3.87Å; W403-W470 AromaticContact CD1-CH2 3.93Å; W403-W470 HydrophobicContact CG-CH2 4.38Å; W403-W470 HydrophobicContact CG-CZ3 4.09Å
404	E	98.8	Very high	96	Very high	0 Å²	0	18 Å²	18	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.1	-36	175.7	-66.8	177	-110.4	0	0	112.3	L287 S333 Y373 L400 V401 S407 Y419 P422	L287-E404 HydrophobicContact CD1-CB 4.14Å; S333-E404 WeakPolarHBondContact CB-OE2 3.32Å; S333-E404 VanDerWaalsContact OG-CD 3.24Å; S333-E404 PolarHBondContact OG-OE1 3.08Å; S333-E404 PolarHBondContact OG-OE2 3.04Å; Y373-E404 WeakPolarHBondContact CE1-OE1 3.4Å; Y373-E404 VanDerWaalsContact OH-CD 3.31Å; Y373-E404 PolarHBondContact OH-OE1 3.21Å; Y373-E404 PolarHBondContact OH-OE2 3.1Å; L400-E404 WeakPolarHBondContact O-CG 3.34Å; L400-E404 PolarHBondContact O-N 3.34Å; V401-E404 WeakPolarHBondContact O-CB 3.4Å; V401-E404 PolarHBondContact O-N 3.11Å; E404-S407 PolarHBondContact O-OG 3.22Å; E404-Y419 HydrophobicContact CB-CE2 4.35Å; E404-Y419 HydrophobicContact CG-CE2 4.42Å; E404-Y419 WeakPolarHBondContact OE2-CE2 3.3Å; E404-Y419 PolarHBondContact OE2-OH 3.39Å; E404-P422 HydrophobicContact CG-CG 3.67Å
405	L	98.6	Very high	95.3	Very high	3 Å²	3	23.4 Å²	23.4	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-66.7	-47	173.2	-79	166.6	0	0	0	111.5	L283 L287 L297 I300 A301 V401 L402 W403 S407 R408 C409	L283-L405 HydrophobicContact CD1-CD2 3.88Å; L283-L405 HydrophobicContact CD2-CD1 4.37Å; L283-L405 HydrophobicContact CD2-CD2 4.22Å; L283-L405 HydrophobicContact CD2-CG 4.15Å; L287-L405 HydrophobicContact CD1-CD2 4.34Å; L287-L405 HydrophobicContact CD2-CD2 4.32Å; L297-L405 HydrophobicContact CD1-CB 4Å; L297-L405 HydrophobicContact CG-CB 4.05Å; I300-L405 HydrophobicContact CB-CD2 4.25Å; I300-L405 HydrophobicContact CD1-CD2 4.3Å; I300-L405 HydrophobicContact CG2-CD1 4.06Å; I300-L405 HydrophobicContact CG2-CD2 3.86Å; A301-L405 HydrophobicContact CB-CD1 3.95Å; V401-L405 PolarHBondContact O-N 3.28Å; V401-L405 VanDerWaalsContact O-N 3.14Å; L402-L405 HydrophobicContact CD2-CD1 4.43Å; L402-L405 WeakPolarHBondContact O-CB 3.41Å; L402-L405 PolarHBondContact O-N 3.27Å; W403-L405 VanDerWaalsContact C-N 3.26Å; W403-L405 PolarHBondContact O-N 3.11Å; L405-S407 VanDerWaalsContact C-N 3.3Å; L405-S407 PolarHBondContact O-N 3.33Å; L405-R408 CarbonylContact O-C 3.6Å; L405-R408 PolarHBondContact O-N 3.36Å; L405-C409 PolarHBondContact O-N 2.77Å
406	A	98.1	Very high	95.1	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-60.8	-39.8	178.7	0	0	0	0	0	111.8	L402 W403 R408 C409 W453 L459 L462 I466	L402-A406 PolarHBondContact O-N 3.34Å; W403-A406 PolarHBondContact O-N 2.77Å; W403-A406 VanDerWaalsContact O-N 3.17Å; A406-R408 PolarHBondContact O-N 3.41Å; A406-R408 VanDerWaalsContact O-N 3.15Å; A406-C409 WeakPolarHBondContact O-CB 3.43Å; A406-C409 PolarHBondContact O-N 2.68Å; A406-C409 VanDerWaalsContact O-N 3.12Å; A406-W453 HydrophobicContact CB-CE3 4.2Å; A406-W453 HydrophobicContact CB-CH2 4.07Å; A406-W453 HydrophobicContact CB-CZ3 3.89Å; A406-L459 HydrophobicContact CB-CD2 4.46Å; A406-L462 HydrophobicContact CB-CD2 4Å; A406-I466 HydrophobicContact CB-CD1 4.36Å
407	S	97.6	Very high	94.8	Very high	9 Å²	9	29 Å²	29	6%	0.063	18%	0.182	C	C	.	.	H	α-helix	trans	-65.3	-17.2	179.8	75.8	0	0	0	0	114.3	W403 E404 L405 V416	W403-S407 WeakPolarHBondContact O-CB 3.33Å; W403-S407 PolarHBondContact O-N 3.21Å; E404-S407 PolarHBondContact O-OG 3.22Å; L405-S407 VanDerWaalsContact C-N 3.3Å; L405-S407 PolarHBondContact O-N 3.33Å; S407-V416 WeakPolarHBondContact O-CG1 3.19Å
408	R	98	Very high	94.7	Very high	22 Å²	22	37 Å²	37	8%	0.083	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115	16.3	178.1	-62.2	-64.4	-68.8	155.5	1.5	113.1	L287 N290 V291 V292 L405 A406 D417 Y419	L287-R408 HydrophobicContact CB-CG 4.2Å; L287-R408 HydrophobicContact CD2-CB 3.9Å; L287-R408 HydrophobicContact CD2-CG 4.36Å; L287-R408 PolarHBondContact O-NE 3.26Å; L287-R408 PolarHBondContact O-NH2 3.01Å; N290-R408 PolarHBondContact O-NE 2.84Å; N290-R408 PolarHBondContact O-NH2 3.37Å; V291-R408 WeakPolarHBondContact CA-O 3.42Å; V291-R408 WeakPolarHBondContact CB-O 3.4Å; V292-R408 PolarHBondContact N-O 3.12Å; L405-R408 CarbonylContact O-C 3.6Å; L405-R408 PolarHBondContact O-N 3.36Å; A406-R408 PolarHBondContact O-N 3.41Å; A406-R408 VanDerWaalsContact O-N 3.15Å; R408-D417 PolarHBondContact NH1-O 2.98Å; R408-Y419 HydrophobicContact CG-CD2 4.15Å
409	C	97.3	Very high	94.6	Very high	4 Å²	4	37.9 Å²	37.9	3%	0.027	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-90	135.3	-179.7	-170.2	0	0	0	0	112.3	V292 L297 L405 A406 A411 V416 L459	V292-C409 CarbonylContact O-C 3.32Å; V292-C409 VanDerWaalsContact O-CA 3.26Å; V292-C409 WeakPolarHBondContact O-CA 3.36Å; L297-C409 HydrophobicContact CD1-CB 3.68Å; L405-C409 PolarHBondContact O-N 2.77Å; A406-C409 WeakPolarHBondContact O-CB 3.43Å; A406-C409 PolarHBondContact O-N 2.68Å; A406-C409 VanDerWaalsContact O-N 3.12Å; C409-A411 VanDerWaalsContact C-N 3.34Å; C409-A411 VanDerWaalsContact SG-CB 3.53Å; C409-V416 WeakPolarHBondContact O-CG2 3.37Å; C409-L459 HydrophobicContact CB-CD2 4.31Å
410	T	96.3	Very high	94.6	Very high	70 Å²	70	40.7 Å²	40.7	43%	0.429	24%	0.236	S	C	.	.	S	Bend	trans	-90.6	9.4	178.4	67.9	0	0	0	0	114	V291 V292 V416	V291-T410 HydrophobicContact CB-CG2 3.79Å; V291-T410 HydrophobicContact CG2-CG2 3.57Å; V292-T410 PolarHBondContact O-N 2.64Å; T410-V416 HydrophobicContact CG2-CG2 4.27Å
411	A	93.4	Very high	94.5	Very high	24 Å²	24	42.4 Å²	42.4	20%	0.198	25%	0.245	C	C	.	.	S	Bend	trans	-78	-23.1	-174.6	0	0	0	0	0	113.7	W294 C409 L459	W294-A411 HydrophobicContact CB-CB 3.78Å; W294-A411 HydrophobicContact CE3-CB 4.34Å; W294-A411 HydrophobicContact CG-CB 4.47Å; C409-A411 VanDerWaalsContact C-N 3.34Å; C409-A411 VanDerWaalsContact SG-CB 3.53Å; A411-L459 HydrophobicContact CB-CD1 3.87Å; A411-L459 HydrophobicContact CB-CG 4.3Å
412	A	87.8	Confident	94.5	Very high	13 Å²	13	42.3 Å²	42.3	11%	0.107	24%	0.244	C	C	.	.	S	Bend	trans	-86.1	145.1	172.9	0	0	0	0	0	110.3	G414 L459	A412-G414 PolarHBondContact O-N 3.08Å; A412-L459 HydrophobicContact CB-CD1 3.8Å
413	D	80.6	Confident	94.5	Very high	141 Å²	141	42.3 Å²	42.3	75%	0.754	24%	0.244	S	C	*	.	S	Bend	trans	-65.6	124.4	171.9	-63.6	-42.9	0	0	0	110.3
414	G	79.8	Confident	94.4	Very high	56 Å²	56	43.2 Å²	43.2	58%	0.577	25%	0.249	S	C	*	.	S	Bend	trans	133.9	177.2	173.7	0	0	0	0	0	114	A412	A412-G414 PolarHBondContact O-N 3.08Å
415	P	85.1	Confident	94.3	Very high	114 Å²	114	50.4 Å²	50.4	74%	0.74	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-69	141.4	175	29.3	-33.1	0	0	0	110.9
416	V	94.4	Very high	94.2	Very high	42 Å²	42	53.8 Å²	53.8	26%	0.255	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-94.9	116.6	170.5	-177.5	0	0	0	0	107.6	V291 S407 C409 T410	V291-V416 HydrophobicContact CG1-CB 4.2Å; V291-V416 HydrophobicContact CG1-CG1 3.86Å; S407-V416 WeakPolarHBondContact O-CG1 3.19Å; C409-V416 WeakPolarHBondContact O-CG2 3.37Å; T410-V416 HydrophobicContact CG2-CG2 4.27Å
417	D	93.3	Very high	94.2	Very high	77 Å²	77	55 Å²	55	41%	0.412	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-69.5	164	-178.4	-61.8	-37	0	0	0	111.9	R408 R450	R408-D417 PolarHBondContact NH1-O 2.98Å; D417-R450 IonicContact OD2-CZ 3.92Å; D417-R450 IonicContact OD2-NH1 2.95Å; D417-R450 PolarHBondContact OD2-NH1 2.94Å; D417-R450 IonicContact OD2-NH2 2.87Å; D417-R450 PolarHBondContact OD2-NH2 3.48Å
418	E	95.9	Very high	94.1	Very high	175 Å²	175	56 Å²	56	82%	0.818	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-54.2	150.5	172.2	-65.1	-169.2	168.5	0	0	111.8	M420	E418-M420 PolarHBondContact O-N 3.36Å
419	Y	97.6	Very high	94	Very high	23 Å²	23	60.6 Å²	60.6	9%	0.09	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-63.2	129.5	179.3	171.4	-89.5	0	0	0	111.2	T284 L287 K288 S333 E404 R408 L421	T284-Y419 HydrophobicContact CG2-CE1 4Å; L287-Y419 HydrophobicContact CB-CD2 3.67Å; L287-Y419 HydrophobicContact CB-CE2 3.94Å; L287-Y419 HydrophobicContact CD1-CE2 4.25Å; K288-Y419 HydrophobicContact CD-CD1 4.17Å; K288-Y419 HydrophobicContact CD-CE1 4.37Å; K288-Y419 HydrophobicContact CG-CD1 3.31Å; K288-Y419 HydrophobicContact CG-CE1 3.86Å; K288-Y419 HydrophobicContact CG-CG 3.81Å; S333-Y419 PolarHBondContact OG-OH 2.71Å; E404-Y419 HydrophobicContact CB-CE2 4.35Å; E404-Y419 HydrophobicContact CG-CE2 4.42Å; E404-Y419 WeakPolarHBondContact OE2-CE2 3.3Å; E404-Y419 PolarHBondContact OE2-OH 3.39Å; R408-Y419 HydrophobicContact CG-CD2 4.15Å; Y419-L421 HydrophobicContact CE1-CD2 4.2Å; Y419-L421 HydrophobicContact CE1-CG 4.28Å; Y419-L421 WeakPolarHBondContact OH-CD2 3.34Å
420	M	97.3	Very high	93.8	Very high	59 Å²	59	68.6 Å²	68.6	29%	0.291	38%	0.377	S	S	.	.			trans	-124.5	145.8	171.6	-66.4	-168.2	-66.6	0	0	109.9	E418 E424	E418-M420 PolarHBondContact O-N 3.36Å; M420-E424 HydrophobicContact CB-CB 4.3Å
421	L	98.1	Very high	93.8	Very high	35 Å²	35	65.7 Å²	65.7	18%	0.183	36%	0.359	C	S	.	.			trans	-68.5	153.3	171.3	-67.7	161.4	0	0	0	110.4	Y419 F423 E424	Y419-L421 HydrophobicContact CE1-CD2 4.2Å; Y419-L421 HydrophobicContact CE1-CG 4.28Å; Y419-L421 WeakPolarHBondContact OH-CD2 3.34Å; L421-F423 PolarHBondContact O-N 3.32Å; L421-E424 HydrophobicContact CB-CB 4.11Å; L421-E424 WeakPolarHBondContact CB-OE2 3.42Å; L421-E424 PolarHBondContact N-OE2 3.49Å; L421-E424 WeakPolarHBondContact O-CB 3.47Å; L421-E424 PolarHBondContact O-N 3.49Å
422	P	98.5	Very high	94	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	128.1	173.5	-21.8	31.9	0	0	0	110.1	R372 Y373 L400 W403 E404 E424 P447	R372-P422 PolarHBondContact NH1-O 3.45Å; Y373-P422 HydrophobicContact CE1-CG 3.89Å; Y373-P422 WeakPolarHBondContact OH-CD 3.5Å; L400-P422 HydrophobicContact CB-CB 4.09Å; L400-P422 HydrophobicContact CB-CG 3.94Å; L400-P422 HydrophobicContact CD1-CB 4.49Å; L400-P422 HydrophobicContact CD2-CB 3.98Å; L400-P422 HydrophobicContact CG-CB 4.42Å; W403-P422 HydrophobicContact CE3-CB 4.3Å; W403-P422 HydrophobicContact CE3-CG 4.11Å; W403-P422 HydrophobicContact CZ3-CB 4.36Å; W403-P422 HydrophobicContact CZ3-CG 4.24Å; E404-P422 HydrophobicContact CG-CG 3.67Å; P422-E424 VanDerWaalsContact C-N 3.32Å; P422-P447 HydrophobicContact CB-CG 3.96Å
423	F	98.5	Very high	94.4	Very high	1 Å²	1	68.4 Å²	68.4	0%	0.004	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	8.1	-173.9	-47.8	-78.3	0	0	0	116.4	R372 L400 L421 E425 E426 V427 M436 V439 V440 P447	R372-F423 WeakPolarHBondContact O-CD2 3.41Å; R372-F423 WeakPolarHBondContact O-CE2 3.3Å; L400-F423 HydrophobicContact CD1-CE2 3.98Å; L400-F423 HydrophobicContact CD2-CE2 3.69Å; L400-F423 HydrophobicContact CD2-CZ 4.05Å; L421-F423 PolarHBondContact O-N 3.32Å; F423-E425 VanDerWaalsContact C-N 3.29Å; F423-E425 PolarHBondContact O-N 3.2Å; F423-E426 WeakPolarHBondContact CA-OE2 3.2Å; F423-E426 PolarHBondContact O-N 3.22Å; F423-V427 HydrophobicContact CB-CG2 3.94Å; F423-V427 WeakPolarHBondContact O-CG2 3.31Å; F423-V427 PolarHBondContact O-N 3.24Å; F423-M436 HydrophobicContact CD2-CE 3.75Å; F423-M436 HydrophobicContact CE2-CE 4.07Å; F423-M436 HydrophobicContact CG-CE 4.1Å; F423-V439 HydrophobicContact CD1-CG2 4.43Å; F423-V440 HydrophobicContact CD1-CG2 4.46Å; F423-V440 HydrophobicContact CE1-CG2 3.74Å; F423-V440 HydrophobicContact CE2-CG2 3.97Å; F423-V440 HydrophobicContact CZ-CG2 3.46Å; F423-V440 VanDerWaalsContact CZ-CG2 3.46Å; F423-P447 HydrophobicContact CD1-CG 4.35Å; F423-P447 HydrophobicContact CD2-CG 4.49Å; F423-P447 HydrophobicContact CE1-CG 4.21Å; F423-P447 HydrophobicContact CE2-CG 4.35Å; F423-P447 HydrophobicContact CZ-CG 4.21Å
424	E	98	Very high	95.2	Very high	39 Å²	39	68.8 Å²	68.8	18%	0.182	37%	0.369	C	S	.	.	H	α-helix	trans	-65.1	-32.5	-179.9	-174.8	167.7	174.1	0	0	113.1	M420 L421 P422 E426 G428 Q429	M420-E424 HydrophobicContact CB-CB 4.3Å; L421-E424 HydrophobicContact CB-CB 4.11Å; L421-E424 WeakPolarHBondContact CB-OE2 3.42Å; L421-E424 PolarHBondContact N-OE2 3.49Å; L421-E424 WeakPolarHBondContact O-CB 3.47Å; L421-E424 PolarHBondContact O-N 3.49Å; P422-E424 VanDerWaalsContact C-N 3.32Å; E424-E426 VanDerWaalsContact C-N 3.34Å; E424-G428 WeakPolarHBondContact O-CA 3.44Å; E424-G428 PolarHBondContact O-N 3.42Å; E424-Q429 HydrophobicContact CG-CG 4.15Å; E424-Q429 WeakPolarHBondContact OE1-CG 3.41Å; E424-Q429 PolarHBondContact OE1-NE2 3.46Å
425	E	95.6	Very high	96.1	Very high	150 Å²	150	69.5 Å²	69.5	70%	0.701	36%	0.359	S	S	*	.	H	α-helix	trans	-68.5	-35.6	178.7	-172.5	171.8	178.4	0	0	111.7	F423	F423-E425 VanDerWaalsContact C-N 3.29Å; F423-E425 PolarHBondContact O-N 3.2Å
426	E	97.1	Very high	96.7	Very high	74 Å²	74	64.1 Å²	64.1	35%	0.346	32%	0.324	S	S	.	.	H	α-helix	trans	-87.4	-38.1	-174.3	-60.1	85	163.4	0	0	113.1	F423 E424 V439	F423-E426 WeakPolarHBondContact CA-OE2 3.2Å; F423-E426 PolarHBondContact O-N 3.22Å; E424-E426 VanDerWaalsContact C-N 3.34Å; E426-V439 HydrophobicContact CB-CG1 4.41Å
427	V	97.4	Very high	96.9	Very high	28 Å²	28	64.5 Å²	64.5	17%	0.17	32%	0.323	C	S	.	.	H	α-helix	trans	-129.2	7.4	-173	-59.9	0	0	0	0	114.1	F423 P431 D435 M436 V439	F423-V427 HydrophobicContact CB-CG2 3.94Å; F423-V427 WeakPolarHBondContact O-CG2 3.31Å; F423-V427 PolarHBondContact O-N 3.24Å; V427-P431 HydrophobicContact CB-CB 3.97Å; V427-P431 HydrophobicContact CG2-CB 3.59Å; V427-P431 HydrophobicContact CG2-CG 3.95Å; V427-D435 HydrophobicContact CB-CB 4.24Å; V427-D435 HydrophobicContact CG1-CB 4.02Å; V427-M436 HydrophobicContact CG2-SD 3.9Å; V427-V439 HydrophobicContact CG1-CB 4.37Å; V427-V439 HydrophobicContact CG1-CG1 3.6Å; V427-V439 HydrophobicContact CG1-CG2 3.82Å
428	G	97.1	Very high	97.2	Very high	30 Å²	30	64.6 Å²	64.6	31%	0.309	32%	0.321	S	S	.	.			trans	70.2	-165.6	180	0	0	0	0	0	113.9	R372 E424	R372-G428 PolarHBondContact NH2-O 3.38Å; E424-G428 WeakPolarHBondContact O-CA 3.44Å; E424-G428 PolarHBondContact O-N 3.42Å
429	Q	94	Very high	97.3	Very high	117 Å²	117	56.8 Å²	56.8	55%	0.547	29%	0.285	S	S	.	.	S	Bend	trans	-78.1	-30.8	-171.2	-72.1	-178.9	-0.5	0	0	114.5	R372 E424 P431	R372-Q429 VanDerWaalsContact NH2-C 3.25Å; R372-Q429 PolarHBondContact NH2-O 3.19Å; E424-Q429 HydrophobicContact CG-CG 4.15Å; E424-Q429 WeakPolarHBondContact OE1-CG 3.41Å; E424-Q429 PolarHBondContact OE1-NE2 3.46Å; Q429-P431 VanDerWaalsContact C-CD 3.48Å; Q429-P431 WeakPolarHBondContact O-CD 3.46Å
430	H	94.3	Very high	97.3	Very high	172 Å²	172	55.7 Å²	55.7	80%	0.796	28%	0.281	S	S	*	.	S	Bend	trans	-128	66	-171.5	-61.6	-54.2	0	0	0	112.2
431	P	96.8	Very high	97.4	Very high	10 Å²	10	53.2 Å²	53.2	7%	0.065	27%	0.269	C	S	.	.			trans	-66.8	143.9	-178.2	28.2	-35.5	0	0	0	112.2	R371 R372 V427 Q429 D435 M436	R371-P431 PolarHBondContact NH1-O 2.94Å; R372-P431 HydrophobicContact CB-CG 4.34Å; R372-P431 VanDerWaalsContact NH2-CD 3.27Å; V427-P431 HydrophobicContact CB-CB 3.97Å; V427-P431 HydrophobicContact CG2-CB 3.59Å; V427-P431 HydrophobicContact CG2-CG 3.95Å; Q429-P431 VanDerWaalsContact C-CD 3.48Å; Q429-P431 WeakPolarHBondContact O-CD 3.46Å; P431-D435 HydrophobicContact CB-CB 4.09Å; P431-M436 HydrophobicContact CB-CG 4Å; P431-M436 HydrophobicContact CB-SD 3.85Å; P431-M436 HydrophobicContact CG-CG 4.15Å; P431-M436 HydrophobicContact CG-SD 3.76Å
432	S	97.3	Very high	97.4	Very high	40 Å²	40	57.7 Å²	57.7	28%	0.28	29%	0.289	S	S	.	.			trans	-71.7	174.4	164.9	72.8	0	0	0	0	110.8	E434 D435 M436	S432-E434 VanDerWaalsContact C-N 3.32Å; S432-E434 PolarHBondContact OG-N 3Å; S432-D435 VanDerWaalsContact CB-OD2 3.27Å; S432-D435 WeakPolarHBondContact CB-OD2 3.37Å; S432-D435 PolarHBondContact N-OD2 3.17Å; S432-D435 PolarHBondContact OG-N 3.23Å; S432-D435 VanDerWaalsContact OG-N 3.1Å; S432-D435 PolarHBondContact OG-OD2 2.87Å; S432-M436 WeakPolarHBondContact O-CG 3.48Å; S432-M436 PolarHBondContact O-N 3.29Å
433	L	96	Very high	97.3	Very high	53 Å²	53	63.2 Å²	63.2	28%	0.277	31%	0.313	S	S	.	.	H	α-helix	trans	-66.3	-39.8	172.6	-178.3	64.1	0	0	0	110.7	L379 M436 Q437	L379-L433 HydrophobicContact CD2-CD1 3.6Å; L433-M436 PolarHBondContact O-N 2.92Å; L433-Q437 HydrophobicContact CG-CG 4.48Å; L433-Q437 WeakPolarHBondContact O-CG 3.41Å; L433-Q437 PolarHBondContact O-N 3.02Å
434	E	97.6	Very high	97.3	Very high	149 Å²	149	69.1 Å²	69.1	70%	0.696	34%	0.339	S	S	*	.	H	α-helix	trans	-65	-42.2	-179	-65.9	173	-168.2	0	0	111.5	S432 M436 Q437 E438	S432-E434 VanDerWaalsContact C-N 3.32Å; S432-E434 PolarHBondContact OG-N 3Å; E434-M436 VanDerWaalsContact C-N 3.28Å; E434-M436 PolarHBondContact O-N 2.8Å; E434-Q437 PolarHBondContact O-N 3.07Å; E434-E438 WeakPolarHBondContact O-CB 3.36Å; E434-E438 PolarHBondContact O-N 2.91Å
435	D	98.2	Very high	97.3	Very high	72 Å²	72	70.8 Å²	70.8	39%	0.385	35%	0.349	S	S	.	.	H	α-helix	trans	-57.1	-45.7	175.2	-60.9	-46.5	0	0	0	110.8	V427 P431 S432 E438 V439	V427-D435 HydrophobicContact CB-CB 4.24Å; V427-D435 HydrophobicContact CG1-CB 4.02Å; P431-D435 HydrophobicContact CB-CB 4.09Å; S432-D435 VanDerWaalsContact CB-OD2 3.27Å; S432-D435 WeakPolarHBondContact CB-OD2 3.37Å; S432-D435 PolarHBondContact N-OD2 3.17Å; S432-D435 PolarHBondContact OG-N 3.23Å; S432-D435 VanDerWaalsContact OG-N 3.1Å; S432-D435 PolarHBondContact OG-OD2 2.87Å; D435-E438 PolarHBondContact O-N 3.21Å; D435-V439 VanDerWaalsContact O-CG2 3.31Å; D435-V439 WeakPolarHBondContact O-CG2 3.4Å; D435-V439 PolarHBondContact O-N 2.68Å
436	M	98.5	Very high	97.5	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.2	-40.2	179.2	-67.5	-54.6	-47.1	0	0	112.3	R371 R372 L379 F423 V427 P431 S432 L433 E434 E438 V439 V440	R371-M436 HydrophobicContact CB-CG 4.22Å; R372-M436 HydrophobicContact CB-CE 4.38Å; R372-M436 HydrophobicContact CB-SD 4.1Å; L379-M436 HydrophobicContact CD1-CB 4.02Å; L379-M436 HydrophobicContact CD2-CB 3.67Å; F423-M436 HydrophobicContact CD2-CE 3.75Å; F423-M436 HydrophobicContact CE2-CE 4.07Å; F423-M436 HydrophobicContact CG-CE 4.1Å; V427-M436 HydrophobicContact CG2-SD 3.9Å; P431-M436 HydrophobicContact CB-CG 4Å; P431-M436 HydrophobicContact CB-SD 3.85Å; P431-M436 HydrophobicContact CG-CG 4.15Å; P431-M436 HydrophobicContact CG-SD 3.76Å; S432-M436 WeakPolarHBondContact O-CG 3.48Å; S432-M436 PolarHBondContact O-N 3.29Å; L433-M436 PolarHBondContact O-N 2.92Å; E434-M436 VanDerWaalsContact C-N 3.28Å; E434-M436 PolarHBondContact O-N 2.8Å; M436-E438 VanDerWaalsContact C-N 3.33Å; M436-V439 HydrophobicContact CE-CG2 4.21Å; M436-V439 PolarHBondContact O-N 3.2Å; M436-V439 HydrophobicContact SD-CG2 4.45Å; M436-V440 HydrophobicContact CE-CG2 3.57Å; M436-V440 VanDerWaalsContact O-CB 3.28Å; M436-V440 WeakPolarHBondContact O-CB 3.03Å; M436-V440 PolarHBondContact O-N 3.13Å
437	Q	98.3	Very high	97.5	Very high	51 Å²	51	62.2 Å²	62.2	24%	0.238	31%	0.307	C	S	.	.	I	π-helix	trans	-59.6	-46.3	174	-74.5	171.1	-34.6	0	0	110.7	L379 L433 E434 V439 V441 H442	L379-Q437 HydrophobicContact CB-CG 3.96Å; L379-Q437 PolarHBondContact O-NE2 2.8Å; L433-Q437 HydrophobicContact CG-CG 4.48Å; L433-Q437 WeakPolarHBondContact O-CG 3.41Å; L433-Q437 PolarHBondContact O-N 3.02Å; E434-Q437 PolarHBondContact O-N 3.07Å; Q437-V439 PolarHBondContact O-N 2.94Å; Q437-V441 WeakPolarHBondContact O-CA 3.44Å; Q437-V441 WeakPolarHBondContact O-CB 3.15Å; Q437-V441 PolarHBondContact O-N 3.05Å; Q437-H442 PolarHBondContact O-N 3.2Å
438	E	98.4	Very high	97.5	Very high	79 Å²	79	64.6 Å²	64.6	37%	0.369	32%	0.324	S	S	.	.	I	π-helix	trans	-58.9	-49.1	178.4	178.8	61.1	-167.4	0	0	111.9	E434 D435 M436 H442 K443	E434-E438 WeakPolarHBondContact O-CB 3.36Å; E434-E438 PolarHBondContact O-N 2.91Å; D435-E438 PolarHBondContact O-N 3.21Å; M436-E438 VanDerWaalsContact C-N 3.33Å; E438-H442 IonicContact OE2-CD2 3.55Å; E438-K443 HydrophobicContact CG-CD 4.43Å; E438-K443 WeakPolarHBondContact O-CB 3.31Å; E438-K443 WeakPolarHBondContact O-CG 3.19Å; E438-K443 PolarHBondContact O-N 2.85Å; E438-K443 WeakPolarHBondContact OE1-CE 3.44Å; E438-K443 IonicContact OE1-NZ 3.27Å; E438-K443 PolarHBondContact OE1-NZ 3.39Å
439	V	98.4	Very high	97.5	Very high	10 Å²	10	64.7 Å²	64.7	6%	0.061	32%	0.317	C	S	.	.	I	π-helix	trans	-76.9	-45.3	-177.3	-64.7	0	0	0	0	113.5	F423 E426 V427 D435 M436 Q437 K444 L445	F423-V439 HydrophobicContact CD1-CG2 4.43Å; E426-V439 HydrophobicContact CB-CG1 4.41Å; V427-V439 HydrophobicContact CG1-CB 4.37Å; V427-V439 HydrophobicContact CG1-CG1 3.6Å; V427-V439 HydrophobicContact CG1-CG2 3.82Å; D435-V439 VanDerWaalsContact O-CG2 3.31Å; D435-V439 WeakPolarHBondContact O-CG2 3.4Å; D435-V439 PolarHBondContact O-N 2.68Å; M436-V439 HydrophobicContact CE-CG2 4.21Å; M436-V439 PolarHBondContact O-N 3.2Å; M436-V439 HydrophobicContact SD-CG2 4.45Å; Q437-V439 PolarHBondContact O-N 2.94Å; V439-K444 PolarHBondContact O-N 2.83Å; V439-L445 HydrophobicContact CB-CD1 4.48Å; V439-L445 HydrophobicContact CG1-CD1 4.48Å; V439-L445 WeakPolarHBondContact O-CB 3.32Å; V439-L445 PolarHBondContact O-N 3.11Å
440	V	98.5	Very high	97.5	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.302	C	S	.	.	I	π-helix	trans	-87.1	-37.9	-170.6	168.9	0	0	0	0	112.5	P376 L379 Y396 F423 M436 K444 R446	P376-V440 HydrophobicContact CB-CG1 4.31Å; P376-V440 HydrophobicContact CG-CG1 3.77Å; L379-V440 HydrophobicContact CD1-CB 3.69Å; L379-V440 HydrophobicContact CD1-CG1 3.71Å; L379-V440 HydrophobicContact CD1-CG2 4.28Å; Y396-V440 WeakPolarHBondContact OH-CG1 3.12Å; F423-V440 HydrophobicContact CD1-CG2 4.46Å; F423-V440 HydrophobicContact CE1-CG2 3.74Å; F423-V440 HydrophobicContact CE2-CG2 3.97Å; F423-V440 HydrophobicContact CZ-CG2 3.46Å; F423-V440 VanDerWaalsContact CZ-CG2 3.46Å; M436-V440 HydrophobicContact CE-CG2 3.57Å; M436-V440 VanDerWaalsContact O-CB 3.28Å; M436-V440 WeakPolarHBondContact O-CB 3.03Å; M436-V440 PolarHBondContact O-N 3.13Å; V440-K444 WeakPolarHBondContact O-CA 3.25Å; V440-R446 PolarHBondContact O-NH1 2.87Å
441	V	98.2	Very high	97.4	Very high	8 Å²	8	60.4 Å²	60.4	5%	0.048	30%	0.299	C	S	.	.	I	π-helix	trans	-93.4	-59	-174.7	-176.5	0	0	0	0	110.1	P376 L379 E380 Q437 K444	P376-V441 HydrophobicContact CB-CG2 4.21Å; L379-V441 HydrophobicContact CB-CG2 3.86Å; L379-V441 HydrophobicContact CD1-CG2 4.14Å; E380-V441 VanDerWaalsContact CD-CG1 3.44Å; E380-V441 HydrophobicContact CG-CB 4.43Å; E380-V441 HydrophobicContact CG-CG1 3.62Å; E380-V441 HydrophobicContact CG-CG2 3.98Å; E380-V441 VanDerWaalsContact OE1-CG1 3.31Å; E380-V441 WeakPolarHBondContact OE1-CG1 3.35Å; Q437-V441 WeakPolarHBondContact O-CA 3.44Å; Q437-V441 WeakPolarHBondContact O-CB 3.15Å; Q437-V441 PolarHBondContact O-N 3.05Å; V441-K444 WeakPolarHBondContact O-CG 3.37Å
442	H	97.9	Very high	97.2	Very high	129 Å²	129	61.8 Å²	61.8	60%	0.597	31%	0.309	S	S	*	.	I	π-helix	trans	-75.4	-48.7	-172.1	-62.2	-41.8	0	0	0	112.5	Q437 E438	Q437-H442 PolarHBondContact O-N 3.2Å; E438-H442 IonicContact OE2-CD2 3.55Å
443	K	98.2	Very high	97.1	Very high	116 Å²	116	60.2 Å²	60.2	50%	0.504	30%	0.297	S	S	.	.	S	Bend	trans	-85.3	-12.2	178.3	-65.6	175	173	146.2	0	113.8	E438 L445	E438-K443 HydrophobicContact CG-CD 4.43Å; E438-K443 WeakPolarHBondContact O-CB 3.31Å; E438-K443 WeakPolarHBondContact O-CG 3.19Å; E438-K443 PolarHBondContact O-N 2.85Å; E438-K443 WeakPolarHBondContact OE1-CE 3.44Å; E438-K443 IonicContact OE1-NZ 3.27Å; E438-K443 PolarHBondContact OE1-NZ 3.39Å; K443-L445 HydrophobicContact CB-CD1 3.95Å; K443-L445 HydrophobicContact CB-CG 3.73Å; K443-L445 HydrophobicContact CD-CD1 3.98Å; K443-L445 PolarHBondContact O-N 3.26Å; K443-L445 VanDerWaalsContact O-N 3.15Å
444	K	98.3	Very high	97	Very high	125 Å²	125	61.7 Å²	61.7	54%	0.543	30%	0.302	S	S	.	.			trans	52.1	32.9	-176.4	-58.2	-172.9	176.1	-168.5	0	113.2	V439 V440 V441	V439-K444 PolarHBondContact O-N 2.83Å; V440-K444 WeakPolarHBondContact O-CA 3.25Å; V441-K444 WeakPolarHBondContact O-CG 3.37Å
445	L	98.1	Very high	96.7	Very high	74 Å²	74	62.4 Å²	62.4	39%	0.387	30%	0.303	S	S	.	.			trans	-74.3	152	177.2	-63.8	174.3	0	0	0	110.7	V439 K443	V439-L445 HydrophobicContact CB-CD1 4.48Å; V439-L445 HydrophobicContact CG1-CD1 4.48Å; V439-L445 WeakPolarHBondContact O-CB 3.32Å; V439-L445 PolarHBondContact O-N 3.11Å; K443-L445 HydrophobicContact CB-CD1 3.95Å; K443-L445 HydrophobicContact CB-CG 3.73Å; K443-L445 HydrophobicContact CD-CD1 3.98Å; K443-L445 PolarHBondContact O-N 3.26Å; K443-L445 VanDerWaalsContact O-N 3.15Å
446	R	98.6	Very high	96.4	Very high	41 Å²	41	61 Å²	61	16%	0.155	29%	0.294	C	S	.	.			trans	-136	157.2	172.2	-63.9	-63.8	-177.6	-87.3	-2.2	108.1	V440 C448 W470	V440-R446 PolarHBondContact O-NH1 2.87Å; R446-C448 PolarHBondContact O-N 3.34Å; R446-W470 HydrophobicContact CB-CD2 4.05Å; R446-W470 HydrophobicContact CB-CE3 4.4Å; R446-W470 HydrophobicContact CB-CH2 4.09Å; R446-W470 HydrophobicContact CB-CZ2 3.71Å; R446-W470 HydrophobicContact CB-CZ3 4.42Å; R446-W470 HydrophobicContact CG-CD2 3.98Å; R446-W470 HydrophobicContact CG-CG 4.08Å; R446-W470 HydrophobicContact CG-CZ2 4.33Å; R446-W470 PolarHBondContact NE-O 3.43Å; R446-W470 PolarHBondContact NH2-O 2.87Å
447	P	98.3	Very high	96.2	Very high	3 Å²	3	65.5 Å²	65.5	2%	0.019	32%	0.322	C	S	.	.			trans	-53.3	138.4	174.4	-25.3	35.1	0	0	0	111.4	L400 W403 P422 F423 L449 W470	L400-P447 HydrophobicContact CD2-CG 3.76Å; W403-P447 HydrophobicContact CD2-CB 3.56Å; W403-P447 HydrophobicContact CD2-CG 4.28Å; W403-P447 HydrophobicContact CE3-CB 4.14Å; W403-P447 HydrophobicContact CG-CB 3.91Å; W403-P447 HydrophobicContact CH2-CB 4.23Å; W403-P447 HydrophobicContact CZ2-CB 3.67Å; W403-P447 HydrophobicContact CZ3-CB 4.45Å; P422-P447 HydrophobicContact CB-CG 3.96Å; F423-P447 HydrophobicContact CD1-CG 4.35Å; F423-P447 HydrophobicContact CD2-CG 4.49Å; F423-P447 HydrophobicContact CE1-CG 4.21Å; F423-P447 HydrophobicContact CE2-CG 4.35Å; F423-P447 HydrophobicContact CZ-CG 4.21Å; P447-L449 PolarHBondContact O-N 3.08Å; P447-W470 HydrophobicContact CB-CH2 4.38Å; P447-W470 HydrophobicContact CB-CZ3 4.22Å; P447-W470 HydrophobicContact CG-CZ3 4.04Å; P447-W470 VanDerWaalsContact O-CH2 3.27Å; P447-W470 WeakPolarHBondContact O-CH2 3.44Å
448	C	96.4	Very high	96	Very high	78 Å²	78	63.1 Å²	63.1	53%	0.527	31%	0.311	S	S	.	.			trans	-60.3	127.9	-174.2	-178.1	0	0	0	0	112.2	W403 R446	W403-C448 PolarHBondContact NE1-O 3.42Å; R446-C448 PolarHBondContact O-N 3.34Å
449	L	96.7	Very high	95.9	Very high	31 Å²	31	59.4 Å²	59.4	16%	0.162	29%	0.293	C	S	.	.			trans	-89.5	113.9	166.6	-61.5	176.9	0	0	0	108.3	P447 W453 C463 I466 E467 W470	P447-L449 PolarHBondContact O-N 3.08Å; L449-W453 HydrophobicContact CD2-CE3 4.2Å; L449-W453 HydrophobicContact CD2-CZ3 3.86Å; L449-C463 HydrophobicContact CD1-CB 4.05Å; L449-C463 HydrophobicContact CD2-CB 4.49Å; L449-I466 HydrophobicContact CD2-CD1 4.41Å; L449-I466 HydrophobicContact CD2-CG2 4.32Å; L449-E467 HydrophobicContact CD1-CG 3.58Å; L449-W470 HydrophobicContact CD1-CH2 4.5Å; L449-W470 HydrophobicContact CD1-CZ2 3.95Å; L449-W470 HydrophobicContact CD2-CH2 3.81Å; L449-W470 HydrophobicContact CD2-CZ2 4.09Å; L449-W470 HydrophobicContact CG-CH2 4.08Å; L449-W470 HydrophobicContact CG-CZ2 3.96Å
450	R	94.4	Very high	95.8	Very high	59 Å²	59	60.1 Å²	60.1	22%	0.223	30%	0.299	C	S	.	.			trans	-71.3	138.2	-171.7	-55.9	-178.5	-172.2	-153.5	-10.2	111.4	D417 C452 W453	D417-R450 IonicContact OD2-CZ 3.92Å; D417-R450 IonicContact OD2-NH1 2.95Å; D417-R450 PolarHBondContact OD2-NH1 2.94Å; D417-R450 IonicContact OD2-NH2 2.87Å; D417-R450 PolarHBondContact OD2-NH2 3.48Å; R450-C452 PolarHBondContact O-N 2.98Å; R450-C452 VanDerWaalsContact O-N 3.1Å; R450-W453 HydrophobicContact CB-CD2 3.91Å; R450-W453 HydrophobicContact CB-CE3 4.47Å; R450-W453 HydrophobicContact CB-CG 4.06Å; R450-W453 HydrophobicContact CB-CZ2 4.25Å; R450-W453 HydrophobicContact CG-CD2 4.24Å; R450-W453 HydrophobicContact CG-CH2 4.18Å; R450-W453 HydrophobicContact CG-CZ2 3.66Å; R450-W453 VanDerWaalsContact O-CB 3.3Å; R450-W453 WeakPolarHBondContact O-CB 3.26Å; R450-W453 PolarHBondContact O-N 3.07Å
451	D	92.9	Very high	95.7	Very high	140 Å²	140	62 Å²	62	75%	0.749	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-31.5	176.1	-65.1	-26	0	0	0	113	W453 Q454	D451-W453 PolarHBondContact O-N 3.49Å; D451-Q454 WeakPolarHBondContact O-CB 3.33Å; D451-Q454 PolarHBondContact O-N 3.25Å
452	C	92	Very high	95.7	Very high	39 Å²	39	61.7 Å²	61.7	26%	0.264	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-26.6	177.3	62.5	0	0	0	0	113.1	R450 Q454 K455	R450-C452 PolarHBondContact O-N 2.98Å; R450-C452 VanDerWaalsContact O-N 3.1Å; C452-Q454 VanDerWaalsContact C-N 3.29Å; C452-Q454 PolarHBondContact O-N 3.45Å; C452-K455 PolarHBondContact O-N 3.18Å
453	W	94.7	Very high	95.7	Very high	7 Å²	7	55.5 Å²	55.5	3%	0.027	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-68.7	-31	177.5	-61.9	-10.1	0	0	0	111.9	W403 A406 L449 R450 D451 K455 H456 L459 S460	W403-W453 AromaticContact CD1-CZ3 3.98Å; W403-W453 AromaticContact NE1-CH2 3.83Å; A406-W453 HydrophobicContact CB-CE3 4.2Å; A406-W453 HydrophobicContact CB-CH2 4.07Å; A406-W453 HydrophobicContact CB-CZ3 3.89Å; L449-W453 HydrophobicContact CD2-CE3 4.2Å; L449-W453 HydrophobicContact CD2-CZ3 3.86Å; R450-W453 HydrophobicContact CB-CD2 3.91Å; R450-W453 HydrophobicContact CB-CE3 4.47Å; R450-W453 HydrophobicContact CB-CG 4.06Å; R450-W453 HydrophobicContact CB-CZ2 4.25Å; R450-W453 HydrophobicContact CG-CD2 4.24Å; R450-W453 HydrophobicContact CG-CH2 4.18Å; R450-W453 HydrophobicContact CG-CZ2 3.66Å; R450-W453 VanDerWaalsContact O-CB 3.3Å; R450-W453 WeakPolarHBondContact O-CB 3.26Å; R450-W453 PolarHBondContact O-N 3.07Å; D451-W453 PolarHBondContact O-N 3.49Å; W453-K455 PolarHBondContact O-N 3.46Å; W453-H456 PolarHBondContact O-N 2.78Å; W453-L459 HydrophobicContact CB-CB 4.1Å; W453-L459 HydrophobicContact CB-CD1 4.36Å; W453-L459 HydrophobicContact CG-CD1 4.37Å; W453-L459 WeakPolarHBondContact O-CB 3.38Å; W453-S460 PolarHBondContact O-N 3.49Å
454	Q	93.5	Very high	95.7	Very high	84 Å²	84	55 Å²	55	39%	0.393	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-66.6	-18.9	178.7	-59.2	-62	-12	0	0	113.1	D451 C452 S460	D451-Q454 WeakPolarHBondContact O-CB 3.33Å; D451-Q454 PolarHBondContact O-N 3.25Å; C452-Q454 VanDerWaalsContact C-N 3.29Å; C452-Q454 PolarHBondContact O-N 3.45Å; Q454-S460 PolarHBondContact OE1-OG 2.88Å
455	K	92.4	Very high	95.8	Very high	165 Å²	165	49.1 Å²	49.1	72%	0.717	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-74.5	-26.8	177.2	-59.2	-178.4	-177.3	175.2	0	112.8	C452 W453	C452-K455 PolarHBondContact O-N 3.18Å; W453-K455 PolarHBondContact O-N 3.46Å
456	H	92.7	Very high	95.8	Very high	43 Å²	43	45.6 Å²	45.6	20%	0.199	23%	0.233	C	C	.	.	S	Bend	trans	-95	117.1	177.4	178.1	-90.2	0	0	0	109.4	W294 W453 G458 L459 S460	W294-H456 AromaticContact CD2-CE1 3.58Å; W294-H456 AromaticContact CE2-CE1 3.89Å; W294-H456 AromaticContact CE3-CE1 3.82Å; W294-H456 AromaticContact CG-CE1 3.9Å; W453-H456 PolarHBondContact O-N 2.78Å; H456-G458 VanDerWaalsContact C-N 3.26Å; H456-G458 PolarHBondContact ND1-N 2.94Å; H456-G458 PolarHBondContact O-N 3.4Å; H456-G458 VanDerWaalsContact O-N 3.13Å; H456-L459 HydrophobicContact CB-CB 4.13Å; H456-L459 HydrophobicContact CB-CD1 4.13Å; H456-L459 HydrophobicContact CB-CG 4.38Å; H456-L459 PolarHBondContact ND1-N 3.23Å; H456-L459 PolarHBondContact O-N 2.96Å; H456-S460 PolarHBondContact O-N 3.09Å
457	T	93.1	Very high	95.8	Very high	94 Å²	94	48.1 Å²	48.1	58%	0.577	25%	0.247	S	C	*	.	H	α-helix	trans	-51.7	-42.6	-173.9	-49	0	0	0	0	113.1	M461	T457-M461 HydrophobicContact CG2-CE 4.29Å; T457-M461 WeakPolarHBondContact O-CG 3.33Å; T457-M461 PolarHBondContact O-N 3.37Å
458	G	94.9	Very high	95.8	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-66.2	-40.8	177.4	0	0	0	0	0	113.6	W294 H456 M461 L462	W294-G458 VanDerWaalsContact CH2-CA 3.41Å; W294-G458 WeakPolarHBondContact CH2-O 3.39Å; W294-G458 VanDerWaalsContact CZ2-CA 3.41Å; H456-G458 VanDerWaalsContact C-N 3.26Å; H456-G458 PolarHBondContact ND1-N 2.94Å; H456-G458 PolarHBondContact O-N 3.4Å; H456-G458 VanDerWaalsContact O-N 3.13Å; G458-M461 PolarHBondContact O-N 2.89Å; G458-L462 PolarHBondContact O-N 3.49Å
459	L	95.7	Very high	96	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-73.9	-33.3	-178.3	-80	174	0	0	0	110.6	W294 L297 A406 C409 A411 A412 W453 H456 L462 C463	W294-L459 HydrophobicContact CE3-CD2 4.11Å; W294-L459 HydrophobicContact CE3-CG 4.09Å; W294-L459 HydrophobicContact CZ3-CD2 3.8Å; W294-L459 HydrophobicContact CZ3-CG 3.94Å; L297-L459 HydrophobicContact CD1-CD2 4.47Å; A406-L459 HydrophobicContact CB-CD2 4.46Å; C409-L459 HydrophobicContact CB-CD2 4.31Å; A411-L459 HydrophobicContact CB-CD1 3.87Å; A411-L459 HydrophobicContact CB-CG 4.3Å; A412-L459 HydrophobicContact CB-CD1 3.8Å; W453-L459 HydrophobicContact CB-CB 4.1Å; W453-L459 HydrophobicContact CB-CD1 4.36Å; W453-L459 HydrophobicContact CG-CD1 4.37Å; W453-L459 WeakPolarHBondContact O-CB 3.38Å; H456-L459 HydrophobicContact CB-CB 4.13Å; H456-L459 HydrophobicContact CB-CD1 4.13Å; H456-L459 HydrophobicContact CB-CG 4.38Å; H456-L459 PolarHBondContact ND1-N 3.23Å; H456-L459 PolarHBondContact O-N 2.96Å; L459-L462 HydrophobicContact CD2-CD2 4.1Å; L459-L462 WeakPolarHBondContact O-CB 3.23Å; L459-L462 PolarHBondContact O-N 2.96Å; L459-C463 PolarHBondContact O-N 2.93Å; L459-C463 PolarHBondContact O-SG 3.43Å
460	S	96.1	Very high	96	Very high	26 Å²	26	46.1 Å²	46.1	18%	0.182	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-49.7	171.3	-173.9	0	0	0	0	111.5	W453 Q454 H456 L462 C463 E464	W453-S460 PolarHBondContact O-N 3.49Å; Q454-S460 PolarHBondContact OE1-OG 2.88Å; H456-S460 PolarHBondContact O-N 3.09Å; S460-L462 VanDerWaalsContact C-N 3.28Å; S460-L462 PolarHBondContact O-N 3.44Å; S460-C463 VanDerWaalsContact O-CB 3.32Å; S460-C463 WeakPolarHBondContact O-CB 3.38Å; S460-C463 PolarHBondContact O-N 2.88Å; S460-C463 VanDerWaalsContact O-N 3.09Å; S460-E464 PolarHBondContact O-N 3.16Å; S460-E464 VanDerWaalsContact O-N 3.12Å
461	M	97.1	Very high	96.3	Very high	38 Å²	38	46.1 Å²	46.1	19%	0.187	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-34.3	174.4	-68.3	-173.6	-71.5	0	0	113	T457 G458 T465 M490	T457-M461 HydrophobicContact CG2-CE 4.29Å; T457-M461 WeakPolarHBondContact O-CG 3.33Å; T457-M461 PolarHBondContact O-N 3.37Å; G458-M461 PolarHBondContact O-N 2.89Å; M461-T465 PolarHBondContact O-N 3.43Å; M461-T465 VanDerWaalsContact O-N 3.11Å; M461-T465 PolarHBondContact O-OG1 2.86Å; M461-M490 VanDerWaalsContact C-CE 3.5Å; M461-M490 HydrophobicContact CB-CE 3.89Å; M461-M490 HydrophobicContact CB-CG 3.79Å; M461-M490 HydrophobicContact CB-SD 3.88Å; M461-M490 HydrophobicContact CE-CB 3.98Å; M461-M490 HydrophobicContact CE-CG 3.8Å; M461-M490 VanDerWaalsContact O-CE 3.23Å; M461-M490 WeakPolarHBondContact O-CE 3.5Å; M461-M490 HydrophobicContact SD-CG 4.11Å
462	L	98.2	Very high	96.5	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-66.7	-40.3	174.1	-177.5	67.4	0	0	0	111.3	W294 L297 A406 G458 L459 S460 T465 I466 M490	W294-L462 HydrophobicContact CZ3-CD2 4.46Å; L297-L462 HydrophobicContact CD1-CD2 3.99Å; L297-L462 HydrophobicContact CD2-CD2 3.67Å; L297-L462 HydrophobicContact CG-CD2 4.47Å; A406-L462 HydrophobicContact CB-CD2 4Å; G458-L462 PolarHBondContact O-N 3.49Å; L459-L462 HydrophobicContact CD2-CD2 4.1Å; L459-L462 WeakPolarHBondContact O-CB 3.23Å; L459-L462 PolarHBondContact O-N 2.96Å; S460-L462 VanDerWaalsContact C-N 3.28Å; S460-L462 PolarHBondContact O-N 3.44Å; L462-T465 CarbonylContact O-C 3.52Å; L462-T465 WeakPolarHBondContact O-CB 3.4Å; L462-T465 PolarHBondContact O-N 3.08Å; L462-T465 VanDerWaalsContact O-N 3.16Å; L462-I466 HydrophobicContact CD2-CD1 4.47Å; L462-I466 HydrophobicContact CG-CD1 3.95Å; L462-I466 HydrophobicContact CG-CG1 4.42Å; L462-I466 VanDerWaalsContact O-CG1 3.28Å; L462-I466 WeakPolarHBondContact O-CG1 3.48Å; L462-I466 PolarHBondContact O-N 2.92Å; L462-M490 HydrophobicContact CB-SD 4.14Å
463	C	98.4	Very high	96.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.3	-48.4	175.4	-70.1	0	0	0	0	111	L449 L459 S460 T465 I466 E467	L449-C463 HydrophobicContact CD1-CB 4.05Å; L449-C463 HydrophobicContact CD2-CB 4.49Å; L459-C463 PolarHBondContact O-N 2.93Å; L459-C463 PolarHBondContact O-SG 3.43Å; S460-C463 VanDerWaalsContact O-CB 3.32Å; S460-C463 WeakPolarHBondContact O-CB 3.38Å; S460-C463 PolarHBondContact O-N 2.88Å; S460-C463 VanDerWaalsContact O-N 3.09Å; C463-T465 VanDerWaalsContact C-N 3.26Å; C463-T465 PolarHBondContact O-N 2.97Å; C463-I466 WeakPolarHBondContact O-CB 3.42Å; C463-I466 PolarHBondContact O-N 3.04Å; C463-I466 VanDerWaalsContact O-N 3.12Å; C463-E467 WeakPolarHBondContact O-CG 3.31Å; C463-E467 PolarHBondContact O-N 3.34Å
464	E	98.3	Very high	96.9	Very high	106 Å²	106	45.8 Å²	45.8	50%	0.495	23%	0.227	S	C	.	.	H	α-helix	trans	-58.4	-39.7	175.2	-65.2	175.2	-172.9	0	0	111.8	S460 E467 D468	S460-E464 PolarHBondContact O-N 3.16Å; S460-E464 VanDerWaalsContact O-N 3.12Å; E464-E467 PolarHBondContact O-N 3.49Å; E464-D468 PolarHBondContact O-N 3.06Å
465	T	98.7	Very high	97.1	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-68.8	-36.6	177.6	-60.4	0	0	0	0	112.4	L402 M461 L462 C463 C469 L478 V483 R486 M490	L402-T465 HydrophobicContact CD1-CG2 4.41Å; M461-T465 PolarHBondContact O-N 3.43Å; M461-T465 VanDerWaalsContact O-N 3.11Å; M461-T465 PolarHBondContact O-OG1 2.86Å; L462-T465 CarbonylContact O-C 3.52Å; L462-T465 WeakPolarHBondContact O-CB 3.4Å; L462-T465 PolarHBondContact O-N 3.08Å; L462-T465 VanDerWaalsContact O-N 3.16Å; C463-T465 VanDerWaalsContact C-N 3.26Å; C463-T465 PolarHBondContact O-N 2.97Å; T465-C469 WeakPolarHBondContact O-CB 3.27Å; T465-C469 PolarHBondContact O-N 2.76Å; T465-C469 VanDerWaalsContact O-N 3.07Å; T465-C469 PolarHBondContact O-SG 3.32Å; T465-L478 HydrophobicContact CG2-CD1 3.94Å; T465-V483 HydrophobicContact CG2-CG1 4.07Å; T465-V483 HydrophobicContact CG2-CG2 4.21Å; T465-R486 WeakPolarHBondContact OG1-CD 3.35Å; T465-R486 PolarHBondContact OG1-NH1 3.43Å; T465-M490 WeakPolarHBondContact OG1-CE 3.42Å
466	I	98.9	Very high	97.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-44.8	172.9	-71.3	162.8	0	0	0	109.7	L402 W403 A406 L449 L462 C463 C469 W470	L402-I466 HydrophobicContact CB-CD1 4.13Å; L402-I466 HydrophobicContact CB-CG1 3.6Å; L402-I466 HydrophobicContact CD1-CG1 4.42Å; W403-I466 HydrophobicContact CB-CD1 4.33Å; W403-I466 HydrophobicContact CB-CG2 4.35Å; A406-I466 HydrophobicContact CB-CD1 4.36Å; L449-I466 HydrophobicContact CD2-CD1 4.41Å; L449-I466 HydrophobicContact CD2-CG2 4.32Å; L462-I466 HydrophobicContact CD2-CD1 4.47Å; L462-I466 HydrophobicContact CG-CD1 3.95Å; L462-I466 HydrophobicContact CG-CG1 4.42Å; L462-I466 VanDerWaalsContact O-CG1 3.28Å; L462-I466 WeakPolarHBondContact O-CG1 3.48Å; L462-I466 PolarHBondContact O-N 2.92Å; C463-I466 WeakPolarHBondContact O-CB 3.42Å; C463-I466 PolarHBondContact O-N 3.04Å; C463-I466 VanDerWaalsContact O-N 3.12Å; I466-C469 WeakPolarHBondContact O-CB 3.19Å; I466-C469 PolarHBondContact O-N 3.09Å; I466-C469 VanDerWaalsContact O-N 3.08Å; I466-W470 HydrophobicContact CG2-CD2 3.64Å; I466-W470 HydrophobicContact CG2-CE3 3.42Å; I466-W470 VanDerWaalsContact CG2-CE3 3.42Å; I466-W470 HydrophobicContact CG2-CH2 3.33Å; I466-W470 HydrophobicContact CG2-CZ2 3.54Å; I466-W470 HydrophobicContact CG2-CZ3 3.27Å; I466-W470 PolarHBondContact O-N 3.29Å
467	E	98.8	Very high	97.6	Very high	94 Å²	94	41.5 Å²	41.5	44%	0.439	22%	0.218	S	C	.	.	H	α-helix	trans	-59.6	-48.4	178.3	-71.1	-179.5	119.7	0	0	112.5	L449 C463 E464 C469 W470 D471	L449-E467 HydrophobicContact CD1-CG 3.58Å; C463-E467 WeakPolarHBondContact O-CG 3.31Å; C463-E467 PolarHBondContact O-N 3.34Å; E464-E467 PolarHBondContact O-N 3.49Å; E467-C469 PolarHBondContact O-N 3.2Å; E467-W470 HydrophobicContact CG-CZ2 4.41Å; E467-W470 VanDerWaalsContact O-CD1 3.23Å; E467-W470 PolarHBondContact O-N 2.86Å; E467-D471 PolarHBondContact O-N 3.27Å
468	D	98.8	Very high	97.9	Very high	55 Å²	55	38.1 Å²	38.1	29%	0.294	20%	0.196	S	C	.	.	H	α-helix	trans	-66.5	-23.7	175.9	-65.7	-19.4	0	0	0	112.3	E464 R477 L478 R486	E464-D468 PolarHBondContact O-N 3.06Å; D468-R477 VanDerWaalsContact O-CA 3.24Å; D468-R477 WeakPolarHBondContact O-CA 3.47Å; D468-L478 HydrophobicContact CB-CD1 3.67Å; D468-L478 HydrophobicContact CB-CD2 4.02Å; D468-L478 HydrophobicContact CB-CG 3.57Å; D468-L478 PolarHBondContact O-N 3.37Å; D468-R486 IonicContact OD2-CZ 3.43Å; D468-R486 IonicContact OD2-NH1 3.6Å; D468-R486 PolarHBondContact OD2-NH1 2.89Å; D468-R486 IonicContact OD2-NH2 3.47Å; D468-R486 PolarHBondContact OD2-NH2 3.41Å
469	C	98.9	Very high	98	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-77.7	-41.6	175.8	-73.4	0	0	0	0	112.2	Y396 T465 I466 E467 R477 V483	Y396-C469 VanDerWaalsContact CA-O 3.32Å; Y396-C469 WeakPolarHBondContact CA-O 3.44Å; T465-C469 WeakPolarHBondContact O-CB 3.27Å; T465-C469 PolarHBondContact O-N 2.76Å; T465-C469 VanDerWaalsContact O-N 3.07Å; T465-C469 PolarHBondContact O-SG 3.32Å; I466-C469 WeakPolarHBondContact O-CB 3.19Å; I466-C469 PolarHBondContact O-N 3.09Å; I466-C469 VanDerWaalsContact O-N 3.08Å; E467-C469 PolarHBondContact O-N 3.2Å; C469-R477 VanDerWaalsContact O-CD 3.25Å; C469-R477 WeakPolarHBondContact O-CD 3.47Å; C469-R477 WeakPolarHBondContact O-CG 3.43Å; C469-V483 VanDerWaalsContact SG-CG2 3.53Å
470	W	98.6	Very high	98.2	Very high	14 Å²	14	41 Å²	41	5%	0.053	22%	0.217	C	C	.	.	S	Bend	trans	-97.6	18.3	-174.6	69.7	20.8	0	0	0	114.1	Y396 L400 W403 R446 P447 L449 I466 E467 H472	Y396-W470 HydrophobicContact CD2-CB 3.9Å; Y396-W470 HydrophobicContact CE2-CB 3.88Å; L400-W470 HydrophobicContact CD2-CE3 3.73Å; L400-W470 HydrophobicContact CD2-CZ3 4.13Å; W403-W470 HydrophobicContact CB-CH2 4.45Å; W403-W470 HydrophobicContact CB-CZ3 3.87Å; W403-W470 AromaticContact CD1-CH2 3.93Å; W403-W470 HydrophobicContact CG-CH2 4.38Å; W403-W470 HydrophobicContact CG-CZ3 4.09Å; R446-W470 HydrophobicContact CB-CD2 4.05Å; R446-W470 HydrophobicContact CB-CE3 4.4Å; R446-W470 HydrophobicContact CB-CH2 4.09Å; R446-W470 HydrophobicContact CB-CZ2 3.71Å; R446-W470 HydrophobicContact CB-CZ3 4.42Å; R446-W470 HydrophobicContact CG-CD2 3.98Å; R446-W470 HydrophobicContact CG-CG 4.08Å; R446-W470 HydrophobicContact CG-CZ2 4.33Å; R446-W470 PolarHBondContact NE-O 3.43Å; R446-W470 PolarHBondContact NH2-O 2.87Å; P447-W470 HydrophobicContact CB-CH2 4.38Å; P447-W470 HydrophobicContact CB-CZ3 4.22Å; P447-W470 HydrophobicContact CG-CZ3 4.04Å; P447-W470 VanDerWaalsContact O-CH2 3.27Å; P447-W470 WeakPolarHBondContact O-CH2 3.44Å; L449-W470 HydrophobicContact CD1-CH2 4.5Å; L449-W470 HydrophobicContact CD1-CZ2 3.95Å; L449-W470 HydrophobicContact CD2-CH2 3.81Å; L449-W470 HydrophobicContact CD2-CZ2 4.09Å; L449-W470 HydrophobicContact CG-CH2 4.08Å; L449-W470 HydrophobicContact CG-CZ2 3.96Å; I466-W470 HydrophobicContact CG2-CD2 3.64Å; I466-W470 HydrophobicContact CG2-CE3 3.42Å; I466-W470 VanDerWaalsContact CG2-CE3 3.42Å; I466-W470 HydrophobicContact CG2-CH2 3.33Å; I466-W470 HydrophobicContact CG2-CZ2 3.54Å; I466-W470 HydrophobicContact CG2-CZ3 3.27Å; I466-W470 PolarHBondContact O-N 3.29Å; E467-W470 HydrophobicContact CG-CZ2 4.41Å; E467-W470 VanDerWaalsContact O-CD1 3.23Å; E467-W470 PolarHBondContact O-N 2.86Å; W470-H472 PolarHBondContact O-N 3.41Å
471	D	98.8	Very high	98.3	Very high	59 Å²	59	41.3 Å²	41.3	32%	0.316	22%	0.224	S	C	.	.			trans	-50.6	141.6	176.8	-161.1	-58.9	0	0	0	110.2	E467 E473 A476 R477	E467-D471 PolarHBondContact O-N 3.27Å; D471-E473 VanDerWaalsContact C-N 3.29Å; D471-E473 PolarHBondContact OD1-N 3.31Å; D471-A476 HydrophobicContact CB-CB 4.12Å; D471-R477 HydrophobicContact CB-CG 4.16Å; D471-R477 PolarHBondContact O-NE 3.23Å; D471-R477 PolarHBondContact O-NH2 2.88Å
472	H	98.2	Very high	98.4	Very high	55 Å²	55	42.5 Å²	42.5	26%	0.255	24%	0.235	S	C	.	.	S	Bend	trans	-62.7	-40.8	177.6	-174.5	84	0	0	0	110.8	W470 R477	W470-H472 PolarHBondContact O-N 3.41Å; H472-R477 PolarHBondContact O-NH2 2.89Å
473	E	97.8	Very high	98.4	Very high	109 Å²	109	42.4 Å²	42.4	51%	0.509	23%	0.234	S	C	.	.	S	Bend	trans	-79.3	119.2	175.4	-173.3	53.1	-117.8	0	0	110.3	D471 E475 A476	D471-E473 VanDerWaalsContact C-N 3.29Å; D471-E473 PolarHBondContact OD1-N 3.31Å; E473-E475 HydrophobicContact CG-CB 4.33Å; E473-E475 HydrophobicContact CG-CG 4.5Å; E473-E475 PolarHBondContact O-N 3.35Å; E473-A476 HydrophobicContact CB-CB 4.35Å; E473-A476 PolarHBondContact O-N 3.05Å
474	A	97.4	Very high	98.4	Very high	16 Å²	16	44.4 Å²	44.4	13%	0.132	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-61.8	-31.5	-176	0	0	0	0	0	112.1	R392 A476 R477	R392-A474 HydrophobicContact CB-CB 4.24Å; R392-A474 WeakPolarHBondContact CD-O 3.36Å; R392-A474 VanDerWaalsContact CG-O 3.29Å; R392-A474 WeakPolarHBondContact CG-O 3.07Å; R392-A474 PolarHBondContact NE-O 3.15Å; A474-A476 VanDerWaalsContact C-N 3.31Å; A474-A476 PolarHBondContact O-N 2.97Å; A474-R477 PolarHBondContact O-N 2.94Å
475	E	96.7	Very high	98.4	Very high	134 Å²	134	43.6 Å²	43.6	63%	0.626	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-70.7	-25.4	-178	-45.9	-133	113.2	0	0	114.5	R392 E473 R477	R392-E475 VanDerWaalsContact CZ-CA 3.47Å; R392-E475 IonicContact CZ-OE1 2.83Å; R392-E475 VanDerWaalsContact NH1-CG 3.35Å; R392-E475 IonicContact NH1-OE1 3.05Å; R392-E475 PolarHBondContact NH1-OE1 3.06Å; R392-E475 IonicContact NH2-OE1 3.34Å; E473-E475 HydrophobicContact CG-CB 4.33Å; E473-E475 HydrophobicContact CG-CG 4.5Å; E473-E475 PolarHBondContact O-N 3.35Å; E475-R477 PolarHBondContact O-N 3.34Å
476	A	97.9	Very high	98.3	Very high	52 Å²	52	47.2 Å²	47.2	43%	0.43	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-77.1	-14.4	178.2	0	0	0	0	0	112.4	D471 E473 A474	D471-A476 HydrophobicContact CB-CB 4.12Å; E473-A476 HydrophobicContact CB-CB 4.35Å; E473-A476 PolarHBondContact O-N 3.05Å; A474-A476 VanDerWaalsContact C-N 3.31Å; A474-A476 PolarHBondContact O-N 2.97Å
477	R	98.7	Very high	98.3	Very high	15 Å²	15	47.3 Å²	47.3	6%	0.057	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-70.4	139.7	-172.2	-60.1	179.3	-165.2	143.5	13.6	113	E377 R392 D468 C469 D471 H472 A474 E475	E377-R477 IonicContact OE1-CZ 3.53Å; E377-R477 IonicContact OE1-NH1 3.68Å; E377-R477 PolarHBondContact OE1-NH1 3.36Å; E377-R477 IonicContact OE1-NH2 2.68Å; E377-R477 PolarHBondContact OE1-NH2 3.18Å; E377-R477 IonicContact OE2-CZ 3.55Å; E377-R477 IonicContact OE2-NH1 3.37Å; E377-R477 IonicContact OE2-NH2 2.71Å; E377-R477 PolarHBondContact OE2-NH2 3.3Å; R392-R477 WeakPolarHBondContact O-CD 3.26Å; R392-R477 PolarHBondContact O-NH1 3.05Å; D468-R477 VanDerWaalsContact O-CA 3.24Å; D468-R477 WeakPolarHBondContact O-CA 3.47Å; C469-R477 VanDerWaalsContact O-CD 3.25Å; C469-R477 WeakPolarHBondContact O-CD 3.47Å; C469-R477 WeakPolarHBondContact O-CG 3.43Å; D471-R477 HydrophobicContact CB-CG 4.16Å; D471-R477 PolarHBondContact O-NE 3.23Å; D471-R477 PolarHBondContact O-NH2 2.88Å; H472-R477 PolarHBondContact O-NH2 2.89Å; A474-R477 PolarHBondContact O-N 2.94Å; E475-R477 PolarHBondContact O-N 3.34Å
478	L	98.6	Very high	98.1	Very high	23 Å²	23	44.1 Å²	44.1	12%	0.12	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-62.2	149.8	174.2	-57.9	177.4	0	0	0	111.6	M395 T465 D468 C482 V483	M395-L478 WeakPolarHBondContact CB-O 3.44Å; M395-L478 WeakPolarHBondContact CE-O 3.38Å; M395-L478 WeakPolarHBondContact CG-O 3.33Å; T465-L478 HydrophobicContact CG2-CD1 3.94Å; D468-L478 HydrophobicContact CB-CD1 3.67Å; D468-L478 HydrophobicContact CB-CD2 4.02Å; D468-L478 HydrophobicContact CB-CG 3.57Å; D468-L478 PolarHBondContact O-N 3.37Å; L478-C482 HydrophobicContact CB-CB 4.37Å; L478-V483 HydrophobicContact CB-CG2 3.75Å; L478-V483 HydrophobicContact CD1-CG2 3.81Å; L478-V483 HydrophobicContact CG-CG2 4.46Å
479	S	98.8	Very high	97.8	Very high	61 Å²	61	45.2 Å²	45.2	43%	0.427	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-77.7	157	164.3	77.2	0	0	0	0	111.2	G481 C482 V483	S479-G481 VanDerWaalsContact C-N 3.27Å; S479-G481 PolarHBondContact O-N 2.9Å; S479-C482 WeakPolarHBondContact O-CB 3.25Å; S479-C482 PolarHBondContact O-N 3.49Å; S479-C482 VanDerWaalsContact O-N 3.09Å; S479-C482 PolarHBondContact OG-N 3.05Å; S479-C482 PolarHBondContact OG-SG 2.83Å; S479-V483 PolarHBondContact O-N 2.73Å
480	A	98.7	Very high	97.5	Very high	2 Å²	2	45.4 Å²	45.4	2%	0.017	25%	0.247	C	C	.	.	H	α-helix	trans	-57.8	-38.5	177.1	0	0	0	0	0	112.9	L308 A309 M395 V483 E484	L308-A480 HydrophobicContact CB-CB 4.08Å; L308-A480 HydrophobicContact CD2-CB 4.27Å; L308-A480 HydrophobicContact CG-CB 3.91Å; A309-A480 HydrophobicContact CB-CB 3.8Å; M395-A480 HydrophobicContact CE-CB 4.3Å; M395-A480 VanDerWaalsContact SD-CA 3.55Å; M395-A480 HydrophobicContact SD-CB 3.6Å; M395-A480 PolarHBondContact SD-N 3.37Å; A480-V483 PolarHBondContact O-N 3.23Å; A480-E484 PolarHBondContact O-N 3.43Å
481	G	98.4	Very high	97	Very high	32 Å²	32	48 Å²	48	33%	0.33	26%	0.26	S	S	.	.	H	α-helix	trans	-65.9	-37.9	175.9	0	0	0	0	0	112.8	S479 V483 E484 E485	S479-G481 VanDerWaalsContact C-N 3.27Å; S479-G481 PolarHBondContact O-N 2.9Å; G481-V483 VanDerWaalsContact C-N 3.33Å; G481-V483 PolarHBondContact O-N 2.86Å; G481-E484 PolarHBondContact O-N 3.37Å; G481-E485 PolarHBondContact O-N 3.22Å; G481-E485 VanDerWaalsContact O-N 3.09Å
482	C	98.6	Very high	96.4	Very high	62 Å²	62	53.2 Å²	53.2	42%	0.419	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-41.6	173	-67.6	0	0	0	0	111.5	L478 S479 E485 R486	L478-C482 HydrophobicContact CB-CB 4.37Å; S479-C482 WeakPolarHBondContact O-CB 3.25Å; S479-C482 PolarHBondContact O-N 3.49Å; S479-C482 VanDerWaalsContact O-N 3.09Å; S479-C482 PolarHBondContact OG-N 3.05Å; S479-C482 PolarHBondContact OG-SG 2.83Å; C482-E485 PolarHBondContact O-N 3.18Å; C482-R486 WeakPolarHBondContact O-CG 3.33Å; C482-R486 PolarHBondContact O-N 2.92Å
483	V	98.8	Very high	95.2	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.4	-43.2	177.4	176.5	0	0	0	0	111.4	A305 M395 F398 L402 T465 C469 L478 S479 A480 G481 E485 R486 I487	A305-V483 HydrophobicContact CB-CG1 4.23Å; M395-V483 HydrophobicContact CE-CB 4.34Å; M395-V483 HydrophobicContact CE-CG2 3.57Å; F398-V483 HydrophobicContact CD1-CG1 4.23Å; F398-V483 HydrophobicContact CE1-CG1 3.76Å; L402-V483 HydrophobicContact CD1-CG1 3.95Å; T465-V483 HydrophobicContact CG2-CG1 4.07Å; T465-V483 HydrophobicContact CG2-CG2 4.21Å; C469-V483 VanDerWaalsContact SG-CG2 3.53Å; L478-V483 HydrophobicContact CB-CG2 3.75Å; L478-V483 HydrophobicContact CD1-CG2 3.81Å; L478-V483 HydrophobicContact CG-CG2 4.46Å; S479-V483 PolarHBondContact O-N 2.73Å; A480-V483 PolarHBondContact O-N 3.23Å; G481-V483 VanDerWaalsContact C-N 3.33Å; G481-V483 PolarHBondContact O-N 2.86Å; V483-E485 VanDerWaalsContact C-N 3.34Å; V483-E485 PolarHBondContact O-N 2.72Å; V483-R486 PolarHBondContact O-N 2.96Å; V483-I487 HydrophobicContact CG1-CD1 3.71Å; V483-I487 HydrophobicContact CG1-CG1 4.41Å; V483-I487 WeakPolarHBondContact O-CD1 3.35Å; V483-I487 VanDerWaalsContact O-CG1 3.3Å; V483-I487 WeakPolarHBondContact O-CG1 3.39Å; V483-I487 PolarHBondContact O-N 3.4Å
484	E	98.3	Very high	93.7	Very high	42 Å²	42	52 Å²	52	20%	0.196	27%	0.271	C	S	.	.	H	α-helix	trans	-55.7	-48.1	174.7	-173.2	-166.8	173.3	0	0	111.6	Q302 A305 R306 A480 G481 I487 S488	Q302-E484 HydrophobicContact CG-CG 3.96Å; A305-E484 HydrophobicContact CB-CB 3.95Å; R306-E484 HydrophobicContact CB-CG 4.25Å; R306-E484 IonicContact CZ-OE1 2.73Å; R306-E484 IonicContact NE-OE1 2.67Å; R306-E484 PolarHBondContact NE-OE1 3Å; R306-E484 IonicContact NH2-OE1 2.77Å; R306-E484 PolarHBondContact NH2-OE1 3.12Å; A480-E484 PolarHBondContact O-N 3.43Å; G481-E484 PolarHBondContact O-N 3.37Å; E484-I487 PolarHBondContact O-N 3.47Å; E484-S488 WeakPolarHBondContact O-CB 3.15Å; E484-S488 PolarHBondContact O-N 2.77Å
485	E	97.7	Very high	91.5	Very high	90 Å²	90	55.9 Å²	55.9	42%	0.421	30%	0.295	S	S	.	.	H	α-helix	trans	-66.2	-41.7	-179.6	-179	56.4	-148.1	0	0	111.6	G481 C482 V483 I487 S488 Q489 R492	G481-E485 PolarHBondContact O-N 3.22Å; G481-E485 VanDerWaalsContact O-N 3.09Å; C482-E485 PolarHBondContact O-N 3.18Å; V483-E485 VanDerWaalsContact C-N 3.34Å; V483-E485 PolarHBondContact O-N 2.72Å; E485-I487 PolarHBondContact O-N 2.92Å; E485-S488 VanDerWaalsContact O-CB 3.32Å; E485-S488 WeakPolarHBondContact O-CB 3.48Å; E485-S488 PolarHBondContact O-N 2.84Å; E485-Q489 WeakPolarHBondContact O-CG 3.44Å; E485-Q489 PolarHBondContact O-N 3.43Å; E485-Q489 WeakPolarHBondContact OE1-CG 3.22Å; E485-Q489 PolarHBondContact OE1-NE2 2.94Å; E485-R492 IonicContact OE1-NH2 3.47Å; E485-R492 PolarHBondContact OE1-NH2 2.8Å; E485-R492 VanDerWaalsContact OE1-NH2 3.16Å
486	R	97.7	Very high	89.1	Confident	76 Å²	76	55 Å²	55	29%	0.287	30%	0.299	S	S	.	.	H	α-helix	trans	-58.4	-48.4	175	-76.3	-170.2	-178.8	-168.3	5.4	111.1	T465 D468 C482 V483 S488 Q489 M490	T465-R486 WeakPolarHBondContact OG1-CD 3.35Å; T465-R486 PolarHBondContact OG1-NH1 3.43Å; D468-R486 IonicContact OD2-CZ 3.43Å; D468-R486 IonicContact OD2-NH1 3.6Å; D468-R486 PolarHBondContact OD2-NH1 2.89Å; D468-R486 IonicContact OD2-NH2 3.47Å; D468-R486 PolarHBondContact OD2-NH2 3.41Å; C482-R486 WeakPolarHBondContact O-CG 3.33Å; C482-R486 PolarHBondContact O-N 2.92Å; V483-R486 PolarHBondContact O-N 2.96Å; R486-S488 VanDerWaalsContact C-N 3.31Å; R486-S488 PolarHBondContact O-N 3.45Å; R486-Q489 WeakPolarHBondContact O-CB 3.14Å; R486-Q489 PolarHBondContact O-N 3.47Å; R486-Q489 VanDerWaalsContact O-N 3.1Å; R486-M490 HydrophobicContact CB-CE 3.98Å; R486-M490 VanDerWaalsContact O-CG 3.27Å; R486-M490 WeakPolarHBondContact O-CG 2.98Å; R486-M490 PolarHBondContact O-N 2.76Å
487	I	97.4	Very high	86.6	Confident	2 Å²	2	60 Å²	60	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-40.7	178.2	-62.4	159.7	0	0	0	111	C298 A301 Q302 A305 L402 V483 E484 E485 Q489 M490 Q491	C298-I487 HydrophobicContact CB-CG2 4.17Å; C298-I487 WeakPolarHBondContact O-CG2 3.44Å; A301-I487 HydrophobicContact CB-CD1 3.64Å; A301-I487 HydrophobicContact CB-CG1 4.42Å; A301-I487 HydrophobicContact CB-CG2 4.32Å; Q302-I487 HydrophobicContact CB-CB 4.4Å; Q302-I487 HydrophobicContact CB-CG2 3.81Å; A305-I487 HydrophobicContact CB-CD1 4.32Å; L402-I487 HydrophobicContact CD2-CD1 4.32Å; V483-I487 HydrophobicContact CG1-CD1 3.71Å; V483-I487 HydrophobicContact CG1-CG1 4.41Å; V483-I487 WeakPolarHBondContact O-CD1 3.35Å; V483-I487 VanDerWaalsContact O-CG1 3.3Å; V483-I487 WeakPolarHBondContact O-CG1 3.39Å; V483-I487 PolarHBondContact O-N 3.4Å; E484-I487 PolarHBondContact O-N 3.47Å; E485-I487 PolarHBondContact O-N 2.92Å; I487-Q489 VanDerWaalsContact C-N 3.28Å; I487-Q489 PolarHBondContact O-N 3.21Å; I487-M490 PolarHBondContact O-N 2.99Å; I487-Q491 PolarHBondContact O-N 2.9Å
488	S	94.8	Very high	83.4	Confident	28 Å²	28	61.2 Å²	61.2	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-58.7	-37.4	174.5	-170.8	0	0	0	0	112.8	Q302 E484 E485 R486 R492	Q302-S488 VanDerWaalsContact NE2-CB 3.29Å; Q302-S488 PolarHBondContact NE2-OG 2.64Å; E484-S488 WeakPolarHBondContact O-CB 3.15Å; E484-S488 PolarHBondContact O-N 2.77Å; E485-S488 VanDerWaalsContact O-CB 3.32Å; E485-S488 WeakPolarHBondContact O-CB 3.48Å; E485-S488 PolarHBondContact O-N 2.84Å; R486-S488 VanDerWaalsContact C-N 3.31Å; R486-S488 PolarHBondContact O-N 3.45Å; S488-R492 WeakPolarHBondContact O-CG 3.2Å; S488-R492 PolarHBondContact O-N 3.28Å; S488-R492 PolarHBondContact O-NE 3.18Å; S488-R492 VanDerWaalsContact O-NE 3.08Å
489	Q	93.5	Very high	81	Confident	77 Å²	77	66.2 Å²	66.2	36%	0.36	37%	0.367	S	S	.	.	H	α-helix	trans	-72	-45	175.6	-69.9	173.8	16.5	0	0	111.7	E485 R486 I487 Q491 R492 Q493	E485-Q489 WeakPolarHBondContact O-CG 3.44Å; E485-Q489 PolarHBondContact O-N 3.43Å; E485-Q489 WeakPolarHBondContact OE1-CG 3.22Å; E485-Q489 PolarHBondContact OE1-NE2 2.94Å; R486-Q489 WeakPolarHBondContact O-CB 3.14Å; R486-Q489 PolarHBondContact O-N 3.47Å; R486-Q489 VanDerWaalsContact O-N 3.1Å; I487-Q489 VanDerWaalsContact C-N 3.28Å; I487-Q489 PolarHBondContact O-N 3.21Å; Q489-Q491 VanDerWaalsContact C-N 3.28Å; Q489-Q491 PolarHBondContact O-N 3.12Å; Q489-R492 VanDerWaalsContact CG-NH2 3.34Å; Q489-R492 PolarHBondContact O-N 3.37Å; Q489-R492 VanDerWaalsContact O-N 3.08Å; Q489-Q493 WeakPolarHBondContact O-CG 3.18Å; Q489-Q493 PolarHBondContact O-N 3.35Å
490	M	92.5	Very high	78.3	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.025	38%	0.384	C	S	.	.	H	α-helix	trans	-58.4	-40.8	177.9	-62.4	174.7	-157.4	0	0	111.9	W294 M461 L462 T465 R486 I487 R492 Q493 A494	W294-M490 HydrophobicContact CH2-CB 4.4Å; W294-M490 HydrophobicContact CH2-SD 4.38Å; W294-M490 HydrophobicContact CZ2-CB 3.99Å; M461-M490 VanDerWaalsContact C-CE 3.5Å; M461-M490 HydrophobicContact CB-CE 3.89Å; M461-M490 HydrophobicContact CB-CG 3.79Å; M461-M490 HydrophobicContact CB-SD 3.88Å; M461-M490 HydrophobicContact CE-CB 3.98Å; M461-M490 HydrophobicContact CE-CG 3.8Å; M461-M490 VanDerWaalsContact O-CE 3.23Å; M461-M490 WeakPolarHBondContact O-CE 3.5Å; M461-M490 HydrophobicContact SD-CG 4.11Å; L462-M490 HydrophobicContact CB-SD 4.14Å; T465-M490 WeakPolarHBondContact OG1-CE 3.42Å; R486-M490 HydrophobicContact CB-CE 3.98Å; R486-M490 VanDerWaalsContact O-CG 3.27Å; R486-M490 WeakPolarHBondContact O-CG 2.98Å; R486-M490 PolarHBondContact O-N 2.76Å; I487-M490 PolarHBondContact O-N 2.99Å; M490-R492 VanDerWaalsContact C-N 3.3Å; M490-R492 PolarHBondContact O-N 3.29Å; M490-Q493 PolarHBondContact O-N 2.75Å; M490-A494 WeakPolarHBondContact O-CB 3.25Å; M490-A494 PolarHBondContact O-N 2.78Å
491	Q	88.5	Confident	75.2	Confident	69 Å²	69	79.7 Å²	79.7	32%	0.322	42%	0.423	S	S	.	.	H	α-helix	trans	-64.7	-33.7	177.9	-168.5	178.3	18.5	0	0	112.6	C298 I487 Q489	C298-Q491 HydrophobicContact CB-CB 4.17Å; C298-Q491 HydrophobicContact CB-CG 4.15Å; I487-Q491 PolarHBondContact O-N 2.9Å; Q489-Q491 VanDerWaalsContact C-N 3.28Å; Q489-Q491 PolarHBondContact O-N 3.12Å
492	R	85.1	Confident	72.3	Confident	167 Å²	167	84.8 Å²	84.8	63%	0.63	44%	0.441	S	S	*	.	H	α-helix	trans	-77	-28.5	177.4	-73.7	-179.7	-77.2	172.3	-5.4	113.2	E485 S488 Q489 M490	E485-R492 IonicContact OE1-NH2 3.47Å; E485-R492 PolarHBondContact OE1-NH2 2.8Å; E485-R492 VanDerWaalsContact OE1-NH2 3.16Å; S488-R492 WeakPolarHBondContact O-CG 3.2Å; S488-R492 PolarHBondContact O-N 3.28Å; S488-R492 PolarHBondContact O-NE 3.18Å; S488-R492 VanDerWaalsContact O-NE 3.08Å; Q489-R492 VanDerWaalsContact CG-NH2 3.34Å; Q489-R492 PolarHBondContact O-N 3.37Å; Q489-R492 VanDerWaalsContact O-N 3.08Å; M490-R492 VanDerWaalsContact C-N 3.3Å; M490-R492 PolarHBondContact O-N 3.29Å
493	Q	74.1	Confident	69.2	Low	127 Å²	127	86.8 Å²	86.8	59%	0.593	45%	0.452	S	S	*	.	H	α-helix	trans	-96.6	-22	-173	-68.7	177.3	5.8	0	0	113.8	Q489 M490	Q489-Q493 WeakPolarHBondContact O-CG 3.18Å; Q489-Q493 PolarHBondContact O-N 3.35Å; M490-Q493 PolarHBondContact O-N 2.75Å
494	A	64.9	Low	66.1	Low	11 Å²	11	92 Å²	92	9%	0.091	48%	0.483	C	S	.	.	S	Bend	trans	-68.8	126.9	175.2	0	0	0	0	0	109.9	W294 M490 V496	W294-A494 HydrophobicContact CZ2-CB 4.47Å; M490-A494 WeakPolarHBondContact O-CB 3.25Å; M490-A494 PolarHBondContact O-N 2.78Å; A494-V496 PolarHBondContact O-N 2.77Å; A494-V496 VanDerWaalsContact O-N 3.13Å
495	P	52.3	Low	63	Low	98 Å²	98	95.9 Å²	95.9	64%	0.636	51%	0.51	S	S	*	.			trans	-59.9	122.9	175.9	22.9	-29.8	0	0	0	108.8	I497	P495-I497 VanDerWaalsContact C-N 3.29Å; P495-I497 PolarHBondContact O-N 2.67Å
496	V	46.8	Very low	59.9	Low	117 Å²	117	96.9 Å²	96.9	71%	0.709	52%	0.522	S	S	*	.			trans	-63.8	97.2	166.3	-179.7	0	0	0	0	105.9	A494 G498	A494-V496 PolarHBondContact O-N 2.77Å; A494-V496 VanDerWaalsContact O-N 3.13Å; V496-G498 PolarHBondContact O-N 3.27Å
497	I	43.5	Very low	57	Low	157 Å²	157	98.8 Å²	98.8	81%	0.805	54%	0.542	S	S	*	.			trans	-69.6	90.7	161.5	-56.9	176.7	0	0	0	104.6	P495	P495-I497 VanDerWaalsContact C-N 3.29Å; P495-I497 PolarHBondContact O-N 2.67Å
498	G	33.3	Very low	53.9	Low	39 Å²	39	106.9 Å²	106.9	40%	0.402	58%	0.582	S	S	.	*			trans	-61.4	152	170.6	0	0	0	0	0	109.7	V496 E500	V496-G498 PolarHBondContact O-N 3.27Å; G498-E500 PolarHBondContact O-N 3.08Å
499	P	46.5	Very low	51.1	Low	129 Å²	129	111.5 Å²	111.5	84%	0.838	61%	0.608	S	S	*	*	S	Bend	trans	-69.1	130.1	168.8	30.2	-28.6	0	0	0	108.2
500	E	42.2	Very low	48.4	Very low	166 Å²	166	113.1 Å²	113.1	78%	0.776	62%	0.624	S	S	*	*			trans	83.3	85.1	172.5	-52.2	-161.3	167.9	0	0	118.7	G498	G498-E500 PolarHBondContact O-N 3.08Å
501	E	33.8	Very low	45.6	Very low	180 Å²	180	120.4 Å²	120.4	84%	0.841	66%	0.663	S	S	*	*				-120.6	77.5	121.8	-91.2	-168.8	167.1	0	0	108.2	V503	E501-V503 HydrophobicContact CB-CG2 4.46Å; E501-V503 PolarHBondContact O-N 3.26Å
502	I	39	Very low	43.3	Very low	138 Å²	138	122.7 Å²	122.7	71%	0.708	68%	0.681	S	S	*	*			trans	-71.9	87.1	152.7	-60.3	171.6	0	0	0	104.6	T504	I502-T504 PolarHBondContact O-N 3.07Å
503	V	32.5	Very low	40.9	Very low	105 Å²	105	122.2 Å²	122.2	64%	0.636	69%	0.691	S	S	*	*			trans	-65.9	97.4	160.1	179	0	0	0	0	105.3	E501 V505	E501-V503 HydrophobicContact CB-CG2 4.46Å; E501-V503 PolarHBondContact O-N 3.26Å; V503-V505 VanDerWaalsContact C-N 3.34Å; V503-V505 PolarHBondContact O-N 3.38Å
504	T	33.8	Very low	39.2	Very low	109 Å²	109	123.8 Å²	123.8	67%	0.669	70%	0.703	S	S	*	*			trans	-49.5	106.1	158.1	15.4	0	0	0	0	106.8	I502 V506	I502-T504 PolarHBondContact O-N 3.07Å; T504-V506 PolarHBondContact O-N 2.98Å
505	V	32.8	Very low	38.1	Very low	124 Å²	124	128.3 Å²	128.3	75%	0.752	73%	0.732	S	S	*	*			trans	-64.5	86.3	160.4	179.4	0	0	0	0	105.2	V503 T507	V503-V505 VanDerWaalsContact C-N 3.34Å; V503-V505 PolarHBondContact O-N 3.38Å; V505-T507 VanDerWaalsContact C-N 3.32Å; V505-T507 PolarHBondContact O-N 3.44Å
506	V	32.8	Very low	37.4	Very low	110 Å²	110	129.8 Å²	129.8	67%	0.667	74%	0.741	S	S	*	*			trans	-62.7	104.9	161.9	178.1	0	0	0	0	104.4	T504 M508	T504-V506 PolarHBondContact O-N 2.98Å; V506-M508 VanDerWaalsContact C-N 3.31Å; V506-M508 PolarHBondContact O-N 3.4Å
507	T	36.9	Very low	36.9	Very low	117 Å²	117	134.1 Å²	134.1	72%	0.718	75%	0.75	S	S	*	*			trans	-60.2	100.7	168	-8	0	0	0	0	105.7	V505 V509	V505-T507 VanDerWaalsContact C-N 3.32Å; V505-T507 PolarHBondContact O-N 3.44Å; T507-V509 VanDerWaalsContact C-N 3.29Å; T507-V509 PolarHBondContact O-N 3.46Å
508	M	32.8	Very low	36.9	Very low	172 Å²	172	135.3 Å²	135.3	85%	0.847	75%	0.752	S	S	*	*			trans	-61.5	99	165.7	-75.5	-88.3	-169.5	0	0	106.1	V506 T510	V506-M508 VanDerWaalsContact C-N 3.31Å; V506-M508 PolarHBondContact O-N 3.4Å; M508-T510 PolarHBondContact O-N 3.3Å; M508-T510 VanDerWaalsContact O-N 3.15Å
509	V	34.6	Very low	37	Very low	124 Å²	124	138.7 Å²	138.7	75%	0.752	77%	0.77	S	S	*	*			trans	-62.9	114.3	169.1	-178.4	0	0	0	0	106.1	T507 N511	T507-V509 VanDerWaalsContact C-N 3.29Å; T507-V509 PolarHBondContact O-N 3.46Å; V509-N511 PolarHBondContact O-N 2.97Å; V509-N511 VanDerWaalsContact O-N 3.17Å
510	T	37.8	Very low	36.8	Very low	112 Å²	112	137.8 Å²	137.8	69%	0.687	77%	0.767	S	S	*	*			trans	-62.4	114.1	170.5	41.1	0	0	0	0	108.1	M508 V512	M508-T510 PolarHBondContact O-N 3.3Å; M508-T510 VanDerWaalsContact O-N 3.15Å; T510-V512 VanDerWaalsContact C-N 3.33Å; T510-V512 PolarHBondContact O-N 2.65Å
511	N	34	Very low	36.4	Very low	158 Å²	158	141.9 Å²	141.9	85%	0.845	79%	0.792	S	S	*	*			trans	-62.3	100.6	163.3	-83.9	-19.4	0	0	0	107.4	V509	V509-N511 PolarHBondContact O-N 2.97Å; V509-N511 VanDerWaalsContact O-N 3.17Å
512	V	40.1	Very low	36.6	Very low	117 Å²	117	140 Å²	140	71%	0.709	79%	0.79	S	S	*	*			trans	-82.8	115.5	164.6	178.3	0	0	0	0	106.4	T510 L514	T510-V512 VanDerWaalsContact C-N 3.33Å; T510-V512 PolarHBondContact O-N 2.65Å; V512-L514 PolarHBondContact O-N 3.41Å
513	D	35.3	Very low	36.4	Very low	156 Å²	156	140.1 Å²	140.1	83%	0.834	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-54.4	116.7	170.6	-70.8	-48.6	0	0	0	110.4
514	L	38.4	Very low	36.7	Very low	160 Å²	160	142 Å²	142	84%	0.838	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83.5	137.3	167.9	-83.9	155.5	0	0	0	109.3	V512	V512-L514 PolarHBondContact O-N 3.41Å
515	P	40.7	Very low	36.8	Very low	107 Å²	107	143.9 Å²	143.9	70%	0.695	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-75.4	155.7	178.9	31.3	-32.6	0	0	0	111.5	K517	P515-K517 PolarHBondContact O-N 2.93Å
516	P	38.1	Very low	37.1	Very low	129 Å²	129	145.2 Å²	145.2	84%	0.838	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-74.3	128.6	-175.6	30.3	-31.3	0	0	0	110.4
517	K	36.6	Very low	37.4	Very low	207 Å²	207	147.5 Å²	147.5	90%	0.9	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-88.5	117.7	161.5	-88.8	-175.8	174.2	179.2	0	109	P515	P515-K517 PolarHBondContact O-N 2.93Å
518	E	42	Very low	37.4	Very low	182 Å²	182	149.7 Å²	149.7	85%	0.85	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-55.5	147	158.6	-62.7	178	148.5	0	0	111
519	S	36	Very low	37.7	Very low	110 Å²	110	148 Å²	148	77%	0.769	83%	0.831	S	S	*	*			trans	155.5	103.9	141.2	-65.3	0	0	0	0	108.9
520	S	42.2	Very low	38	Very low	110 Å²	110	150 Å²	150	77%	0.769	84%	0.838	S	S	*	*				77.8	93.1	95.8	-54.2	0	0	0	0	114.4
521	L	35	Very low	38	Very low	252 Å²	252	153.5 Å²	153.5	100%	1.319	85%	0.852	S	S	*	*				168.6	0	118.6	-92.2	160.7	0	0	0	111

Retrieved 521 of 521 residues in 279.5 ms (Link to these results)

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