A0A077ZN92_TRITR Loading...

Rab3 GTPase-activating protein catalytic subunit

AlphaFold DB , UniProt , Accession A0A077ZN92, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 805 aa.

						>A0A077ZN92_TRITR|A0A077ZN92
MESEDPPEILDYTNATDWERFISNIEAVFRRWRADGLERPDCKNEHNELAACFHTSLEYKGNLFNASYFCPRNATYKTDESSIENDGSERLFSPAVSKMQCKTTSQELLEPLDLSLLFALNEYLAVTPVDCNEEDFEKEKQAIISAFLVASTNVDWQIPVMFAYPVGASAVEVSDPIYVGFCRNDSFYTHFEMARLPLSCLNCHYLSDWVDIFRTEVATLEASPESVVVSARRTYELVGHSSRPLLMQNILYWCVKHCGEAAENFKKLAPSCFDFPCSFELMIVWQNRNEEMLMETASYSDLNASTTPHWYLKLASADFELESSPFTKLIFLIESSELVSEWLDPSVRSFSGMDNEISNLTNYIFHERESNDMLKRNSAWFTGFDRIQKMIADYRSSKCGLMCERIGIAVLRLLIDCTPRFYQTNVKRALALLWDELLYELRSRWLNGILLDDKQISLPKVVSWPLHQNIEMLNFGIAHERTNRLLEFDEATADADNSSCEDDFFDCKESVTTSKDDGLPEGRLAIAEGLFQLENENEPLYTPIYQETVPFIAESGGEHPFDKRSLDTLAEDVEQSKRYSRAVLFSDMQAFKAANPGSCFQDFLRLHSPRDVVESVDETTGKRTYSLSPRMSAEENLWRSLWEKARPIAAACQRPLVHHARKPDKELDKAVLDLETKVHMYETVALTLKSHCRGSVSEEVEKFAYQLVSLKKEKVVGGAASPVGRMIDNLFSLSKPSERPDHENYVVAQNDSALINERYILRWFVARPSNLSCRSPQRMCIELRHKEGYFVSSASLTEDTDFFLE
					

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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	39.2	Very low	43.3	Very low	243 Å²	243	150.1 Å²	150.1	100%	1.197	80%	0.795	S	S	*	*				0	90.7	0	-81.1	-172.3	-90.4	0	0	104.6	S3	M1-S3 PolarHBondContact O-N 2.75Å
2	E	39.2	Very low	44.3	Very low	193 Å²	193	155.3 Å²	155.3	90%	0.902	80%	0.798	S	S	*	*			trans	-62	116.4	171.1	-72.8	169.9	165.5	0	0	105.7	E4	E2-E4 PolarHBondContact O-N 2.98Å; E2-E4 VanDerWaalsContact O-N 3.08Å
3	S	40.1	Very low	45.5	Very low	106 Å²	106	151.5 Å²	151.5	74%	0.741	79%	0.787	S	S	*	*			trans	-64	105.4	175.5	44.9	0	0	0	0	107.3	M1 D5	M1-S3 PolarHBondContact O-N 2.75Å; S3-D5 PolarHBondContact O-N 2.97Å; S3-D5 VanDerWaalsContact O-N 3.09Å
4	E	42.8	Very low	46.2	Very low	189 Å²	189	143.1 Å²	143.1	88%	0.883	74%	0.743	S	S	*	*			trans	-59.3	109.4	167.5	-73.5	178.5	156.4	0	0	107.6	E2	E2-E4 PolarHBondContact O-N 2.98Å; E2-E4 VanDerWaalsContact O-N 3.08Å
5	D	40.9	Very low	47.8	Very low	143 Å²	143	139.3 Å²	139.3	77%	0.765	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-56.7	136.1	168.2	-76	-43.3	0	0	0	108.7	S3	S3-D5 PolarHBondContact O-N 2.97Å; S3-D5 VanDerWaalsContact O-N 3.09Å
6	P	41.7	Very low	50.1	Low	111 Å²	111	134.8 Å²	134.8	72%	0.721	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-60.9	135.8	-172	23.1	-31.3	0	0	0	110.3	E8	P6-E8 PolarHBondContact O-N 3.3Å
7	P	42.1	Very low	52.2	Low	120 Å²	120	132 Å²	132	78%	0.779	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-62.3	121.8	-172.4	23.8	-33.1	0	0	0	110.8	I9	P7-I9 PolarHBondContact O-N 3.04Å; P7-I9 VanDerWaalsContact O-N 3.11Å
8	E	46.3	Very low	54.2	Low	172 Å²	172	129 Å²	129	80%	0.804	68%	0.683	S	S	*	*			trans	-60	110	172.6	-159.6	173.2	-152.9	0	0	108.7	P6 L10	P6-E8 PolarHBondContact O-N 3.3Å; E8-L10 VanDerWaalsContact C-N 3.34Å; E8-L10 PolarHBondContact O-N 3.24Å
9	I	49.3	Very low	56.1	Low	161 Å²	161	125.8 Å²	125.8	83%	0.826	66%	0.664	S	S	*	*			trans	-70.8	93.9	179.1	-60.2	172.3	0	0	0	107.3	P7 D11	P7-I9 PolarHBondContact O-N 3.04Å; P7-I9 VanDerWaalsContact O-N 3.11Å; I9-D11 PolarHBondContact O-N 3.31Å; I9-D11 VanDerWaalsContact O-N 3.16Å
10	L	44.4	Very low	57.8	Low	119 Å²	119	126 Å²	126	62%	0.623	66%	0.655	S	S	*	*			trans	-73.2	100.6	170.2	-78.7	159.4	0	0	0	108.9	E8 Y12	E8-L10 VanDerWaalsContact C-N 3.34Å; E8-L10 PolarHBondContact O-N 3.24Å; L10-Y12 HydrophobicContact CB-CE2 4.29Å; L10-Y12 WeakPolarHBondContact O-CD2 3.09Å; L10-Y12 WeakPolarHBondContact O-CE2 3.4Å; L10-Y12 PolarHBondContact O-N 3.47Å
11	D	50.2	Low	59.4	Low	94 Å²	94	120.1 Å²	120.1	50%	0.503	63%	0.625	S	S	.	*			trans	-71.5	110.6	171.7	-168.1	-12.8	0	0	0	110	I9 T13	I9-D11 PolarHBondContact O-N 3.31Å; I9-D11 VanDerWaalsContact O-N 3.16Å; D11-T13 PolarHBondContact O-N 2.99Å; D11-T13 WeakPolarHBondContact OD1-CB 3.19Å; D11-T13 WeakPolarHBondContact OD1-CG2 3.4Å; D11-T13 PolarHBondContact OD1-N 3.04Å; D11-T13 PolarHBondContact OD1-OG1 3.34Å; D11-T13 PolarHBondContact OD2-OG1 3.24Å
12	Y	55.4	Low	62	Low	212 Å²	212	109.1 Å²	109.1	83%	0.831	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	6.3	178.7	-68	-86.5	0	0	0	113.3	L10	L10-Y12 HydrophobicContact CB-CE2 4.29Å; L10-Y12 WeakPolarHBondContact O-CD2 3.09Å; L10-Y12 WeakPolarHBondContact O-CE2 3.4Å; L10-Y12 PolarHBondContact O-N 3.47Å
13	T	60	Low	64.6	Low	107 Å²	107	101.7 Å²	101.7	66%	0.656	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-12.6	177.9	61.7	0	0	0	0	114.5	D11 A15	D11-T13 PolarHBondContact O-N 2.99Å; D11-T13 WeakPolarHBondContact OD1-CB 3.19Å; D11-T13 WeakPolarHBondContact OD1-CG2 3.4Å; D11-T13 PolarHBondContact OD1-N 3.04Å; D11-T13 PolarHBondContact OD1-OG1 3.34Å; D11-T13 PolarHBondContact OD2-OG1 3.24Å; T13-A15 PolarHBondContact O-N 3.13Å
14	N	55.1	Low	67.1	Low	33 Å²	33	100.7 Å²	100.7	18%	0.176	53%	0.526	C	S	.	.			trans	-77.9	100.2	174.9	-71	-17.6	0	0	0	110.9	E19 R20 S23	N14-E19 HydrophobicContact CB-CB 4.06Å; N14-R20 HydrophobicContact CB-CG 3.74Å; N14-S23 PolarHBondContact ND2-OG 2.75Å
15	A	69.9	Low	69.5	Low	87 Å²	87	91.7 Å²	91.7	72%	0.719	48%	0.484	S	S	*	.			trans	-77.9	-22.8	-174.5	0	0	0	0	0	113.1	T13 E19	T13-A15 PolarHBondContact O-N 3.13Å; A15-E19 WeakPolarHBondContact CA-OE2 3.06Å; A15-E19 PolarHBondContact N-OE2 3.12Å
16	T	85.7	Confident	72.1	Confident	66 Å²	66	85.9 Å²	85.9	41%	0.405	45%	0.452	S	S	.	.	S	Bend	trans	-125	154.4	-175.5	65.2	0	0	0	0	113.3	W18 E19 R20	T16-W18 PolarHBondContact O-N 2.74Å; T16-E19 PolarHBondContact N-OE2 3.28Å; T16-E19 PolarHBondContact O-N 3.22Å; T16-E19 VanDerWaalsContact O-N 3.16Å; T16-E19 VanDerWaalsContact OG1-CG 3.3Å; T16-E19 WeakPolarHBondContact OG1-CG 3.49Å; T16-E19 PolarHBondContact OG1-N 3.3Å; T16-E19 PolarHBondContact OG1-OE2 3.28Å; T16-E19 VanDerWaalsContact OG1-OE2 3.12Å; T16-R20 PolarHBondContact O-N 3.23Å; T16-R20 VanDerWaalsContact O-N 3.17Å
17	D	85	Confident	74.5	Confident	88 Å²	88	83.1 Å²	83.1	47%	0.471	44%	0.439	S	S	.	.	H	α-helix	trans	-59.4	-30.2	175.9	-63.8	-33.6	0	0	0	112.3	R20 F21	D17-R20 IonicContact OD1-NH1 3.75Å; D17-R20 PolarHBondContact OD1-NH1 3.14Å; D17-F21 WeakPolarHBondContact O-CB 3.31Å; D17-F21 PolarHBondContact O-N 3.18Å
18	W	88.6	Confident	76.8	Confident	78 Å²	78	78.3 Å²	78.3	30%	0.295	41%	0.407	S	S	.	.	H	α-helix	trans	-67.7	-42.8	176	-174.9	75.3	0	0	0	112.2	T16 F21 I22 Y59 A142 S145 V149	T16-W18 PolarHBondContact O-N 2.74Å; W18-F21 WeakPolarHBondContact O-CB 2.98Å; W18-F21 PolarHBondContact O-N 3.36Å; W18-I22 HydrophobicContact CD2-CD1 3.74Å; W18-I22 HydrophobicContact CE3-CD1 3.59Å; W18-I22 HydrophobicContact CH2-CD1 3.52Å; W18-I22 HydrophobicContact CZ2-CD1 3.65Å; W18-I22 HydrophobicContact CZ3-CD1 3.49Å; W18-I22 VanDerWaalsContact CZ3-CD1 3.49Å; W18-I22 WeakPolarHBondContact O-CG1 3.42Å; W18-I22 PolarHBondContact O-N 2.75Å; W18-Y59 HydrophobicContact CB-CE2 4.22Å; W18-A142 PolarHBondContact NE1-O 3.18Å; W18-S145 WeakPolarHBondContact CZ2-OG 3.39Å; W18-S145 PolarHBondContact NE1-OG 2.81Å; W18-V149 HydrophobicContact CH2-CG2 4.09Å; W18-V149 HydrophobicContact CZ2-CG2 4.31Å
19	E	90.5	Very high	78.9	Confident	69 Å²	69	70.2 Å²	70.2	32%	0.322	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-40.4	175.2	-72.3	163	160.3	0	0	112	N14 A15 T16 F21 I22 S23	N14-E19 HydrophobicContact CB-CB 4.06Å; A15-E19 WeakPolarHBondContact CA-OE2 3.06Å; A15-E19 PolarHBondContact N-OE2 3.12Å; T16-E19 PolarHBondContact N-OE2 3.28Å; T16-E19 PolarHBondContact O-N 3.22Å; T16-E19 VanDerWaalsContact O-N 3.16Å; T16-E19 VanDerWaalsContact OG1-CG 3.3Å; T16-E19 WeakPolarHBondContact OG1-CG 3.49Å; T16-E19 PolarHBondContact OG1-N 3.3Å; T16-E19 PolarHBondContact OG1-OE2 3.28Å; T16-E19 VanDerWaalsContact OG1-OE2 3.12Å; E19-F21 VanDerWaalsContact C-N 3.3Å; E19-F21 PolarHBondContact O-N 2.61Å; E19-I22 PolarHBondContact O-N 2.84Å; E19-S23 PolarHBondContact O-N 3.38Å; E19-S23 PolarHBondContact O-OG 3.01Å
20	R	89.2	Confident	80.8	Confident	129 Å²	129	68.9 Å²	68.9	49%	0.487	35%	0.354	S	S	.	.	H	α-helix	trans	-61.2	-41.4	173.9	-66.8	-174.8	-168.8	135.7	3.4	111.8	N14 T16 D17 S23 N24	N14-R20 HydrophobicContact CB-CG 3.74Å; T16-R20 PolarHBondContact O-N 3.23Å; T16-R20 VanDerWaalsContact O-N 3.17Å; D17-R20 IonicContact OD1-NH1 3.75Å; D17-R20 PolarHBondContact OD1-NH1 3.14Å; R20-S23 PolarHBondContact O-N 3.28Å; R20-N24 VanDerWaalsContact O-CG 3.31Å; R20-N24 PolarHBondContact O-N 3.16Å
21	F	92.7	Very high	82.7	Confident	3 Å²	3	71.9 Å²	71.9	1%	0.013	36%	0.357	C	S	.	.	H	α-helix	trans	-62.6	-42.8	177.5	-174.3	-123.5	0	0	0	111.9	D17 W18 E19 S23 N24 I25 L57 E58 Y59 I143 A146 F147	D17-F21 WeakPolarHBondContact O-CB 3.31Å; D17-F21 PolarHBondContact O-N 3.18Å; W18-F21 WeakPolarHBondContact O-CB 2.98Å; W18-F21 PolarHBondContact O-N 3.36Å; E19-F21 VanDerWaalsContact C-N 3.3Å; E19-F21 PolarHBondContact O-N 2.61Å; F21-S23 PolarHBondContact O-N 2.8Å; F21-N24 PolarHBondContact O-N 3.02Å; F21-I25 HydrophobicContact CD1-CD1 3.83Å; F21-I25 HydrophobicContact CE1-CD1 3.61Å; F21-I25 HydrophobicContact CE2-CD1 4.36Å; F21-I25 HydrophobicContact CG-CD1 4.28Å; F21-I25 HydrophobicContact CZ-CD1 3.91Å; F21-I25 HydrophobicContact CZ-CG1 4.44Å; F21-I25 WeakPolarHBondContact O-CG1 3.23Å; F21-I25 PolarHBondContact O-N 3.32Å; F21-L57 HydrophobicContact CE2-CB 4.03Å; F21-E58 VanDerWaalsContact CD2-O 3.3Å; F21-E58 WeakPolarHBondContact CD2-O 3.46Å; F21-Y59 HydrophobicContact CB-CD2 3.78Å; F21-Y59 HydrophobicContact CB-CE2 4.44Å; F21-Y59 AromaticContact CD1-CD2 3.98Å; F21-Y59 HydrophobicContact CD1-CD2 3.98Å; F21-Y59 HydrophobicContact CD1-CG 4.06Å; F21-Y59 HydrophobicContact CD2-CD2 4.41Å; F21-Y59 HydrophobicContact CD2-CG 4.43Å; F21-Y59 HydrophobicContact CE1-CG 4.34Å; F21-Y59 AromaticContact CG-CD2 3.82Å; F21-Y59 HydrophobicContact CG-CD2 3.82Å; F21-Y59 HydrophobicContact CG-CG 4.12Å; F21-I143 HydrophobicContact CE1-CG1 4.45Å; F21-I143 HydrophobicContact CE1-CG2 4.22Å; F21-I143 HydrophobicContact CZ-CG2 4.46Å; F21-A146 HydrophobicContact CD1-CB 3.51Å; F21-A146 HydrophobicContact CE1-CB 3.85Å; F21-F147 HydrophobicContact CE1-CD2 4.49Å; F21-F147 HydrophobicContact CE1-CE2 4.27Å; F21-F147 HydrophobicContact CZ-CE2 4.04Å
22	I	93.9	Very high	84.3	Confident	11 Å²	11	68 Å²	68	6%	0.056	34%	0.336	C	S	.	.	H	α-helix	trans	-57.7	-50	172.8	-68.3	165.6	0	0	0	110.7	W18 E19 N24 I25 E26 A146 V149 A150	W18-I22 HydrophobicContact CD2-CD1 3.74Å; W18-I22 HydrophobicContact CE3-CD1 3.59Å; W18-I22 HydrophobicContact CH2-CD1 3.52Å; W18-I22 HydrophobicContact CZ2-CD1 3.65Å; W18-I22 HydrophobicContact CZ3-CD1 3.49Å; W18-I22 VanDerWaalsContact CZ3-CD1 3.49Å; W18-I22 WeakPolarHBondContact O-CG1 3.42Å; W18-I22 PolarHBondContact O-N 2.75Å; E19-I22 PolarHBondContact O-N 2.84Å; I22-N24 VanDerWaalsContact C-N 3.26Å; I22-N24 PolarHBondContact O-N 2.9Å; I22-I25 PolarHBondContact O-N 3.02Å; I22-I25 VanDerWaalsContact O-N 3.12Å; I22-E26 HydrophobicContact CG2-CG 4.28Å; I22-E26 WeakPolarHBondContact CG2-OE1 3.43Å; I22-E26 WeakPolarHBondContact O-CG 3.29Å; I22-E26 PolarHBondContact O-N 3.12Å; I22-A146 HydrophobicContact CG1-CB 3.72Å; I22-V149 HydrophobicContact CD1-CB 4.2Å; I22-V149 HydrophobicContact CD1-CG1 4.01Å; I22-V149 HydrophobicContact CG2-CG1 4.13Å; I22-A150 HydrophobicContact CG2-CB 4.18Å
23	S	92.2	Very high	85.1	Confident	37 Å²	37	62.7 Å²	62.7	26%	0.259	31%	0.314	S	S	.	.	H	α-helix	trans	-59.2	-37.2	179.5	-61.3	0	0	0	0	112.9	N14 E19 R20 F21 E26 A27	N14-S23 PolarHBondContact ND2-OG 2.75Å; E19-S23 PolarHBondContact O-N 3.38Å; E19-S23 PolarHBondContact O-OG 3.01Å; R20-S23 PolarHBondContact O-N 3.28Å; F21-S23 PolarHBondContact O-N 2.8Å; S23-E26 PolarHBondContact O-N 2.85Å; S23-A27 WeakPolarHBondContact O-CB 3.49Å; S23-A27 PolarHBondContact O-N 2.86Å
24	N	92.8	Very high	85	Confident	85 Å²	85	60 Å²	60	46%	0.455	30%	0.303	S	S	.	.	H	α-helix	trans	-65.4	-44.3	175.5	-69.9	-11.4	0	0	0	111.7	R20 F21 I22 A27 V28 L57	R20-N24 VanDerWaalsContact O-CG 3.31Å; R20-N24 PolarHBondContact O-N 3.16Å; F21-N24 PolarHBondContact O-N 3.02Å; I22-N24 VanDerWaalsContact C-N 3.26Å; I22-N24 PolarHBondContact O-N 2.9Å; N24-A27 PolarHBondContact O-N 3.04Å; N24-V28 WeakPolarHBondContact O-CG2 3.41Å; N24-V28 PolarHBondContact O-N 2.87Å; N24-V28 VanDerWaalsContact O-N 3.09Å; N24-L57 HydrophobicContact CB-CD2 4.36Å
25	I	94.4	Very high	84.9	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.7	-45.5	176.1	-63.8	161.4	0	0	0	110.5	F21 I22 A27 V28 F29 L57 A146 F147 A150	F21-I25 HydrophobicContact CD1-CD1 3.83Å; F21-I25 HydrophobicContact CE1-CD1 3.61Å; F21-I25 HydrophobicContact CE2-CD1 4.36Å; F21-I25 HydrophobicContact CG-CD1 4.28Å; F21-I25 HydrophobicContact CZ-CD1 3.91Å; F21-I25 HydrophobicContact CZ-CG1 4.44Å; F21-I25 WeakPolarHBondContact O-CG1 3.23Å; F21-I25 PolarHBondContact O-N 3.32Å; I22-I25 PolarHBondContact O-N 3.02Å; I22-I25 VanDerWaalsContact O-N 3.12Å; I25-A27 VanDerWaalsContact C-N 3.3Å; I25-A27 PolarHBondContact O-N 3.44Å; I25-V28 WeakPolarHBondContact O-CB 3.34Å; I25-V28 PolarHBondContact O-N 3.09Å; I25-V28 VanDerWaalsContact O-N 3.14Å; I25-F29 HydrophobicContact CG2-CD1 4.31Å; I25-F29 HydrophobicContact CG2-CD2 4.01Å; I25-F29 HydrophobicContact CG2-CE1 3.89Å; I25-F29 HydrophobicContact CG2-CE2 3.56Å; I25-F29 HydrophobicContact CG2-CG 4.38Å; I25-F29 HydrophobicContact CG2-CZ 3.53Å; I25-F29 WeakPolarHBondContact O-CG 3.5Å; I25-F29 PolarHBondContact O-N 3.47Å; I25-L57 HydrophobicContact CG1-CD1 4.06Å; I25-A146 HydrophobicContact CD1-CB 4.04Å; I25-F147 HydrophobicContact CD1-CD1 4.3Å; I25-F147 HydrophobicContact CD1-CD2 3.67Å; I25-F147 HydrophobicContact CD1-CE1 4.35Å; I25-F147 HydrophobicContact CD1-CE2 3.74Å; I25-F147 HydrophobicContact CD1-CG 3.97Å; I25-F147 HydrophobicContact CD1-CZ 4.09Å; I25-F147 HydrophobicContact CG1-CE1 4.3Å; I25-F147 HydrophobicContact CG1-CE2 4.28Å; I25-F147 HydrophobicContact CG1-CZ 4.14Å; I25-F147 HydrophobicContact CG2-CD1 3.85Å; I25-F147 HydrophobicContact CG2-CE1 3.92Å; I25-F147 HydrophobicContact CG2-CG 4.45Å; I25-A150 HydrophobicContact CB-CB 3.84Å; I25-A150 HydrophobicContact CG2-CB 3.51Å
26	E	94.4	Very high	83.8	Confident	21 Å²	21	66 Å²	66	10%	0.098	34%	0.342	C	S	.	.	H	α-helix	trans	-61	-39.1	177.6	-69.3	178.7	-176	0	0	112.4	I22 S23 V28 F29 R30 A150 N153 V154	I22-E26 HydrophobicContact CG2-CG 4.28Å; I22-E26 WeakPolarHBondContact CG2-OE1 3.43Å; I22-E26 WeakPolarHBondContact O-CG 3.29Å; I22-E26 PolarHBondContact O-N 3.12Å; S23-E26 PolarHBondContact O-N 2.85Å; E26-V28 VanDerWaalsContact C-N 3.33Å; E26-F29 PolarHBondContact O-N 2.92Å; E26-R30 WeakPolarHBondContact O-CB 3.31Å; E26-R30 VanDerWaalsContact O-CG 3.27Å; E26-R30 WeakPolarHBondContact O-CG 3.44Å; E26-R30 PolarHBondContact O-N 3.5Å; E26-R30 IonicContact OE2-CZ 3.83Å; E26-R30 IonicContact OE2-NH1 2.67Å; E26-R30 IonicContact OE2-NH2 2.71Å; E26-R30 PolarHBondContact OE2-NH2 3.34Å; E26-A150 HydrophobicContact CG-CB 3.75Å; E26-N153 VanDerWaalsContact OE1-CB 3.26Å; E26-N153 WeakPolarHBondContact OE1-CB 3.34Å; E26-N153 PolarHBondContact OE1-ND2 3.22Å; E26-V154 HydrophobicContact CB-CG1 3.9Å; E26-V154 HydrophobicContact CG-CG1 3.94Å
27	A	91.4	Very high	82.1	Confident	54 Å²	54	66.2 Å²	66.2	45%	0.446	34%	0.34	S	S	.	.	H	α-helix	trans	-61.9	-41.8	175.3	0	0	0	0	0	111.5	S23 N24 I25 R31	S23-A27 WeakPolarHBondContact O-CB 3.49Å; S23-A27 PolarHBondContact O-N 2.86Å; N24-A27 PolarHBondContact O-N 3.04Å; I25-A27 VanDerWaalsContact C-N 3.3Å; I25-A27 PolarHBondContact O-N 3.44Å; A27-R31 WeakPolarHBondContact O-CB 3.25Å; A27-R31 PolarHBondContact O-N 3.11Å
28	V	91.5	Very high	80.5	Confident	18 Å²	18	70.7 Å²	70.7	11%	0.109	36%	0.358	C	S	.	.	H	α-helix	trans	-62.1	-48.6	174	170.8	0	0	0	0	111.1	N24 I25 E26 R30 R31 W32 T55 L57	N24-V28 WeakPolarHBondContact O-CG2 3.41Å; N24-V28 PolarHBondContact O-N 2.87Å; N24-V28 VanDerWaalsContact O-N 3.09Å; I25-V28 WeakPolarHBondContact O-CB 3.34Å; I25-V28 PolarHBondContact O-N 3.09Å; I25-V28 VanDerWaalsContact O-N 3.14Å; E26-V28 VanDerWaalsContact C-N 3.33Å; V28-R30 PolarHBondContact O-N 3.36Å; V28-R31 WeakPolarHBondContact O-CB 3.46Å; V28-R31 PolarHBondContact O-N 2.96Å; V28-R31 VanDerWaalsContact O-N 3.16Å; V28-W32 HydrophobicContact CG1-CD2 3.72Å; V28-W32 HydrophobicContact CG1-CE3 3.78Å; V28-W32 HydrophobicContact CG1-CG 4.5Å; V28-W32 HydrophobicContact CG1-CH2 3.66Å; V28-W32 HydrophobicContact CG1-CZ2 3.59Å; V28-W32 HydrophobicContact CG1-CZ3 3.73Å; V28-W32 PolarHBondContact O-N 3.32Å; V28-T55 HydrophobicContact CB-CG2 4.44Å; V28-T55 HydrophobicContact CG1-CG2 3.71Å; V28-T55 HydrophobicContact CG2-CG2 3.84Å; V28-L57 HydrophobicContact CG2-CD2 4.12Å
29	F	91.1	Very high	79.1	Confident	2 Å²	2	71 Å²	71	1%	0.009	36%	0.359	C	S	.	.	H	α-helix	trans	-61.9	-44.5	179.8	-70.2	-7.9	0	0	0	112.3	I25 E26 R31 W32 R33 L124 F147 A150 S151 V154 W156 V160	I25-F29 HydrophobicContact CG2-CD1 4.31Å; I25-F29 HydrophobicContact CG2-CD2 4.01Å; I25-F29 HydrophobicContact CG2-CE1 3.89Å; I25-F29 HydrophobicContact CG2-CE2 3.56Å; I25-F29 HydrophobicContact CG2-CG 4.38Å; I25-F29 HydrophobicContact CG2-CZ 3.53Å; I25-F29 WeakPolarHBondContact O-CG 3.5Å; I25-F29 PolarHBondContact O-N 3.47Å; E26-F29 PolarHBondContact O-N 2.92Å; F29-R31 VanDerWaalsContact C-N 3.29Å; F29-R31 PolarHBondContact O-N 2.98Å; F29-W32 PolarHBondContact O-N 3.5Å; F29-R33 VanDerWaalsContact O-CB 3.31Å; F29-R33 WeakPolarHBondContact O-CB 3.16Å; F29-R33 PolarHBondContact O-N 3.42Å; F29-L124 HydrophobicContact CE1-CD2 3.5Å; F29-L124 HydrophobicContact CZ-CD2 3.97Å; F29-F147 HydrophobicContact CE1-CE1 4.48Å; F29-F147 AromaticContact CZ-CD1 3.86Å; F29-F147 HydrophobicContact CZ-CD1 3.86Å; F29-F147 HydrophobicContact CZ-CE1 4.2Å; F29-A150 HydrophobicContact CD2-CB 4.46Å; F29-A150 HydrophobicContact CE2-CB 4.23Å; F29-S151 WeakPolarHBondContact CE2-OG 3.41Å; F29-V154 HydrophobicContact CB-CG2 3.71Å; F29-V154 HydrophobicContact CD2-CG2 3.6Å; F29-V154 HydrophobicContact CG-CG2 4.16Å; F29-W156 HydrophobicContact CB-CD2 4.28Å; F29-W156 HydrophobicContact CB-CE3 3.72Å; F29-W156 HydrophobicContact CB-CZ3 4.14Å; F29-W156 HydrophobicContact CD1-CD2 4Å; F29-W156 HydrophobicContact CD1-CE3 4.09Å; F29-W156 HydrophobicContact CD1-CH2 4.43Å; F29-W156 HydrophobicContact CD1-CZ2 4.35Å; F29-W156 HydrophobicContact CD1-CZ3 4.3Å; F29-W156 HydrophobicContact CD2-CB 3.87Å; F29-W156 HydrophobicContact CD2-CD2 4Å; F29-W156 HydrophobicContact CD2-CE3 4.29Å; F29-W156 AromaticContact CD2-CG 3.83Å; F29-W156 HydrophobicContact CD2-CG 3.83Å; F29-W156 HydrophobicContact CE1-CD2 4.28Å; F29-W156 HydrophobicContact CE1-CZ2 4.45Å; F29-W156 HydrophobicContact CE2-CB 4.09Å; F29-W156 HydrophobicContact CE2-CD2 4.28Å; F29-W156 AromaticContact CE2-CG 3.86Å; F29-W156 HydrophobicContact CE2-CG 3.86Å; F29-W156 AromaticContact CG-CD2 3.84Å; F29-W156 HydrophobicContact CG-CD2 3.84Å; F29-W156 AromaticContact CG-CE3 3.79Å; F29-W156 HydrophobicContact CG-CE3 3.79Å; F29-W156 HydrophobicContact CG-CG 4.19Å; F29-W156 HydrophobicContact CG-CZ3 4.34Å; F29-W156 HydrophobicContact CZ-CD2 4.38Å; F29-W156 HydrophobicContact CZ-CG 4.22Å; F29-V160 HydrophobicContact CZ-CG2 4.45Å
30	R	88.3	Confident	77.3	Confident	133 Å²	133	71.2 Å²	71.2	50%	0.502	37%	0.367	S	S	.	.	H	α-helix	trans	-60.2	-41.2	174.7	-71.4	178.1	-163.8	113.8	5.1	111.4	E26 V28 R33 A34 V154	E26-R30 WeakPolarHBondContact O-CB 3.31Å; E26-R30 VanDerWaalsContact O-CG 3.27Å; E26-R30 WeakPolarHBondContact O-CG 3.44Å; E26-R30 PolarHBondContact O-N 3.5Å; E26-R30 IonicContact OE2-CZ 3.83Å; E26-R30 IonicContact OE2-NH1 2.67Å; E26-R30 IonicContact OE2-NH2 2.71Å; E26-R30 PolarHBondContact OE2-NH2 3.34Å; V28-R30 PolarHBondContact O-N 3.36Å; R30-R33 PolarHBondContact O-N 3.43Å; R30-A34 PolarHBondContact O-N 2.77Å; R30-V154 HydrophobicContact CG-CG1 4.05Å
31	R	84.9	Confident	75.6	Confident	183 Å²	183	70.4 Å²	70.4	69%	0.691	37%	0.372	S	S	*	.	H	α-helix	trans	-60.7	-49.6	176.2	-178.8	179.5	177.9	170.9	-0.4	110.7	A27 V28 F29 R33 A34 L37	A27-R31 WeakPolarHBondContact O-CB 3.25Å; A27-R31 PolarHBondContact O-N 3.11Å; V28-R31 WeakPolarHBondContact O-CB 3.46Å; V28-R31 PolarHBondContact O-N 2.96Å; V28-R31 VanDerWaalsContact O-N 3.16Å; F29-R31 VanDerWaalsContact C-N 3.29Å; F29-R31 PolarHBondContact O-N 2.98Å; R31-R33 VanDerWaalsContact C-N 3.34Å; R31-R33 PolarHBondContact O-N 2.94Å; R31-A34 WeakPolarHBondContact O-CB 3.22Å; R31-A34 PolarHBondContact O-N 3.06Å; R31-L37 WeakPolarHBondContact O-CD1 3.45Å
32	W	82.7	Confident	73.6	Confident	13 Å²	13	71.5 Å²	71.5	5%	0.049	38%	0.379	C	S	.	.	H	α-helix	trans	-73.9	-22.9	-177.2	-64	-14.9	0	0	0	114.1	V28 F29 A34 F53 T55 A66 Y68 L124 W156	V28-W32 HydrophobicContact CG1-CD2 3.72Å; V28-W32 HydrophobicContact CG1-CE3 3.78Å; V28-W32 HydrophobicContact CG1-CG 4.5Å; V28-W32 HydrophobicContact CG1-CH2 3.66Å; V28-W32 HydrophobicContact CG1-CZ2 3.59Å; V28-W32 HydrophobicContact CG1-CZ3 3.73Å; V28-W32 PolarHBondContact O-N 3.32Å; F29-W32 PolarHBondContact O-N 3.5Å; W32-A34 VanDerWaalsContact C-N 3.34Å; W32-F53 HydrophobicContact CB-CD2 4.34Å; W32-F53 AromaticContact CD1-CD2 3.99Å; W32-F53 AromaticContact CD1-CG 3.89Å; W32-F53 HydrophobicContact CD2-CB 4.09Å; W32-F53 HydrophobicContact CG-CB 4.27Å; W32-F53 HydrophobicContact CG-CD2 4.06Å; W32-F53 HydrophobicContact CG-CG 4.33Å; W32-F53 HydrophobicContact CZ2-CB 3.92Å; W32-F53 AromaticContact NE1-CG 3.95Å; W32-T55 HydrophobicContact CH2-CG2 3.86Å; W32-T55 HydrophobicContact CZ2-CG2 3.64Å; W32-A66 HydrophobicContact CH2-CB 4.08Å; W32-A66 WeakPolarHBondContact CH2-O 2.99Å; W32-Y68 HydrophobicContact CE3-CG 4.49Å; W32-L124 HydrophobicContact CH2-CD1 3.98Å; W32-L124 HydrophobicContact CZ3-CD1 3.54Å; W32-L124 HydrophobicContact CZ3-CD2 4.24Å; W32-W156 HydrophobicContact CB-CH2 4.26Å; W32-W156 HydrophobicContact CB-CZ3 4.43Å; W32-W156 HydrophobicContact CE3-CH2 4.19Å
33	R	73.1	Confident	71.3	Confident	99 Å²	99	77.7 Å²	77.7	37%	0.374	41%	0.406	S	S	.	.	H	α-helix	trans	-77.2	-15.7	173.9	-166.1	175.4	-176.3	170.9	6.7	113.3	F29 R30 R31 D35 V154 D155	F29-R33 VanDerWaalsContact O-CB 3.31Å; F29-R33 WeakPolarHBondContact O-CB 3.16Å; F29-R33 PolarHBondContact O-N 3.42Å; R30-R33 PolarHBondContact O-N 3.43Å; R31-R33 VanDerWaalsContact C-N 3.34Å; R31-R33 PolarHBondContact O-N 2.94Å; R33-D35 PolarHBondContact O-N 2.74Å; R33-D35 VanDerWaalsContact O-N 3.15Å; R33-V154 PolarHBondContact NH1-O 2.91Å; R33-D155 IonicContact CZ-OD2 3.56Å; R33-D155 PolarHBondContact NH1-O 3.36Å; R33-D155 IonicContact NH1-OD2 3.6Å; R33-D155 PolarHBondContact NH1-OD2 3.3Å; R33-D155 IonicContact NH2-OD2 3.64Å; R33-D155 PolarHBondContact NH2-OD2 3.47Å
34	A	58	Low	69.1	Low	51 Å²	51	83.9 Å²	83.9	42%	0.421	44%	0.436	S	S	.	.			trans	-56.4	120.8	-170.7	0	0	0	0	0	112.6	R30 R31 W32 G36 L37	R30-A34 PolarHBondContact O-N 2.77Å; R31-A34 WeakPolarHBondContact O-CB 3.22Å; R31-A34 PolarHBondContact O-N 3.06Å; W32-A34 VanDerWaalsContact C-N 3.34Å; A34-G36 PolarHBondContact O-N 2.98Å; A34-L37 HydrophobicContact CB-CD1 3.93Å; A34-L37 PolarHBondContact O-N 3.45Å
35	D	51.6	Low	66.7	Low	166 Å²	166	85.5 Å²	85.5	89%	0.888	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	119.2	178	-66.6	-39.1	0	0	0	110	R33	R33-D35 PolarHBondContact O-N 2.74Å; R33-D35 VanDerWaalsContact O-N 3.15Å
36	G	47.8	Very low	64.4	Low	80 Å²	80	89.8 Å²	89.8	83%	0.825	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.2	4.5	177.9	0	0	0	0	0	116.3	A34 E38	A34-G36 PolarHBondContact O-N 2.98Å; G36-E38 PolarHBondContact O-N 3.32Å
37	L	50.8	Low	62.2	Low	71 Å²	71	93.3 Å²	93.3	37%	0.372	48%	0.48	S	S	.	.			trans	-65.8	117.4	165.3	-89.9	157.2	0	0	0	110.5	R31 A34 R39 F53	R31-L37 WeakPolarHBondContact O-CD1 3.45Å; A34-L37 HydrophobicContact CB-CD1 3.93Å; A34-L37 PolarHBondContact O-N 3.45Å; L37-R39 PolarHBondContact O-N 2.84Å; L37-F53 HydrophobicContact CB-CZ 4.19Å; L37-F53 HydrophobicContact CD2-CE1 4.36Å; L37-F53 HydrophobicContact CD2-CZ 4.39Å
38	E	50.7	Low	60.2	Low	182 Å²	182	95.7 Å²	95.7	85%	0.85	48%	0.482	S	S	*	.			trans	-61.3	116.6	165.2	-73.4	-172.9	169.4	0	0	108.3	G36 P40	G36-E38 PolarHBondContact O-N 3.32Å; E38-P40 WeakPolarHBondContact O-CD 3.33Å
39	R	58.9	Low	58.2	Low	84 Å²	84	103 Å²	103	32%	0.317	52%	0.52	S	S	.	.			trans	-85.3	113.3	177.4	-63.9	177.6	-175.9	176.4	-6.5	107.7	L37 F53 A74	L37-R39 PolarHBondContact O-N 2.84Å; R39-F53 HydrophobicContact CG-CE2 4.08Å; R39-F53 HydrophobicContact CG-CZ 4.08Å; R39-A74 PolarHBondContact NH1-O 3.02Å; R39-A74 VanDerWaalsContact NH1-O 3.15Å
40	P	53	Low	56.6	Low	74 Å²	74	103.4 Å²	103.4	48%	0.481	52%	0.523	S	S	.	.			trans	-62.9	150.5	179.5	-17.9	30.7	0	0	0	111.4	E38 C42 C52	E38-P40 WeakPolarHBondContact O-CD 3.33Å; P40-C42 PolarHBondContact O-N 2.89Å; P40-C42 VanDerWaalsContact O-N 3.07Å; P40-C52 WeakPolarHBondContact CD-O 3.23Å; P40-C52 PolarHBondContact O-SG 2.8Å; P40-C52 VanDerWaalsContact O-SG 3.41Å
41	D	52.9	Low	55.3	Low	112 Å²	112	97.9 Å²	97.9	60%	0.599	51%	0.507	S	S	*	.			trans	-61.2	105.6	179.3	-169.4	19.9	0	0	0	110.6	K43	D41-K43 PolarHBondContact O-N 3.36Å; D41-K43 VanDerWaalsContact O-N 3.15Å
42	C	51	Low	54.7	Low	25 Å²	25	89.6 Å²	89.6	17%	0.169	48%	0.477	C	S	.	.			trans	-73.3	102.2	163	60.1	0	0	0	0	106.9	P40 A50 C70	P40-C42 PolarHBondContact O-N 2.89Å; P40-C42 VanDerWaalsContact O-N 3.07Å; C42-A50 VanDerWaalsContact CA-O 3.22Å; C42-A50 WeakPolarHBondContact CA-O 3.32Å; C42-A50 WeakPolarHBondContact CB-O 3.08Å; C42-C70 PolarHBondContact SG-O 3.31Å
43	K	46.1	Very low	54.7	Low	142 Å²	142	90.5 Å²	90.5	62%	0.617	48%	0.481	S	S	*	.			trans	-51	152.4	164.6	-69.5	-177.9	178.9	178	0	108.1	D41 E45	D41-K43 PolarHBondContact O-N 3.36Å; D41-K43 VanDerWaalsContact O-N 3.15Å; K43-E45 PolarHBondContact O-N 2.93Å
44	N	46	Very low	55.3	Low	167 Å²	167	89.6 Å²	89.6	89%	0.893	48%	0.481	S	S	*	.	S	Bend	trans	-62	24.5	177	-67.6	-21.4	0	0	0	114.1
45	E	42	Very low	56.8	Low	119 Å²	119	89 Å²	89	56%	0.556	47%	0.472	S	S	*	.			trans	-103.4	114.9	176.3	-67.6	177	-177.1	0	0	107	K43 N47 A50	K43-E45 PolarHBondContact O-N 2.93Å; E45-N47 PolarHBondContact O-N 3.3Å; E45-A50 WeakPolarHBondContact O-CB 3.34Å
46	H	46	Very low	58.7	Low	90 Å²	90	84 Å²	84	42%	0.417	45%	0.45	S	S	.	.			trans	-79.3	51.7	178.4	-68.7	-67.9	0	0	0	112.2	D113 Y123	H46-D113 IonicContact CD2-OD2 3.58Å; H46-D113 PolarHBondContact CD2-OD2 3.4Å; H46-D113 IonicContact NE2-OD2 2.75Å; H46-D113 PolarHBondContact NE2-OD2 3.46Å; H46-D113 VanDerWaalsContact NE2-OD2 3.13Å; H46-Y123 PolarHBondContact ND1-OH 2.94Å
47	N	49.4	Very low	60.8	Low	94 Å²	94	80.7 Å²	80.7	50%	0.503	41%	0.413	S	S	.	.	S	Bend	trans	-101.3	155.5	173.6	-71.3	-13.2	0	0	0	109.7	E45 L49 A50	E45-N47 PolarHBondContact O-N 3.3Å; N47-L49 PolarHBondContact O-N 2.78Å; N47-A50 WeakPolarHBondContact O-CB 3.37Å; N47-A50 PolarHBondContact O-N 3.33Å
48	E	48	Very low	62.6	Low	105 Å²	105	83.2 Å²	83.2	49%	0.491	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-52.4	-31.5	174.9	-66.5	-172.9	148.6	0	0	112	A50 A51 N65	E48-A50 PolarHBondContact O-N 3.37Å; E48-A51 WeakPolarHBondContact O-CB 3.18Å; E48-A51 PolarHBondContact O-N 3Å; E48-N65 PolarHBondContact OE1-ND2 3.46Å
49	L	48.9	Very low	64.4	Low	171 Å²	171	75 Å²	75	90%	0.895	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-64.7	-18	175.5	-68.1	169.6	0	0	0	114.7	N47	N47-L49 PolarHBondContact O-N 2.78Å
50	A	57.7	Low	65.6	Low	10 Å²	10	76.4 Å²	76.4	8%	0.083	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-102.5	-2.6	179.2	0	0	0	0	0	113.1	C42 E45 N47 E48 C52	C42-A50 VanDerWaalsContact CA-O 3.22Å; C42-A50 WeakPolarHBondContact CA-O 3.32Å; C42-A50 WeakPolarHBondContact CB-O 3.08Å; E45-A50 WeakPolarHBondContact O-CB 3.34Å; N47-A50 WeakPolarHBondContact O-CB 3.37Å; N47-A50 PolarHBondContact O-N 3.33Å; E48-A50 PolarHBondContact O-N 3.37Å; A50-C52 PolarHBondContact O-N 3Å
51	A	62.4	Low	66.9	Low	18 Å²	18	75.5 Å²	75.5	15%	0.149	40%	0.397	C	S	.	.			trans	-62	137.9	175.4	0	0	0	0	0	110.1	E48 F53 F69	E48-A51 WeakPolarHBondContact O-CB 3.18Å; E48-A51 PolarHBondContact O-N 3Å; A51-F53 VanDerWaalsContact C-N 3.28Å; A51-F53 PolarHBondContact O-N 2.72Å; A51-F69 HydrophobicContact CB-CD1 4.38Å; A51-F69 HydrophobicContact CB-CE1 3.87Å; A51-F69 HydrophobicContact CB-CE2 4.4Å; A51-F69 HydrophobicContact CB-CZ 3.88Å
52	C	72.2	Confident	68.3	Low	9 Å²	9	71.3 Å²	71.3	6%	0.061	37%	0.374	C	S	.	.	S	Bend	trans	-62.9	-41.6	176.6	-65.8	0	0	0	0	110.5	P40 A50 Y68	P40-C52 WeakPolarHBondContact CD-O 3.23Å; P40-C52 PolarHBondContact O-SG 2.8Å; P40-C52 VanDerWaalsContact O-SG 3.41Å; A50-C52 PolarHBondContact O-N 3Å; C52-Y68 HydrophobicContact CB-CD1 4.05Å; C52-Y68 HydrophobicContact CB-CE1 4.39Å; C52-Y68 PolarHBondContact N-O 3.02Å
53	F	81.2	Confident	70.1	Confident	32 Å²	32	73.2 Å²	73.2	14%	0.14	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	146.3	174	-55.2	-60.2	0	0	0	110.2	W32 L37 R39 A51 Y68	W32-F53 HydrophobicContact CB-CD2 4.34Å; W32-F53 AromaticContact CD1-CD2 3.99Å; W32-F53 AromaticContact CD1-CG 3.89Å; W32-F53 HydrophobicContact CD2-CB 4.09Å; W32-F53 HydrophobicContact CG-CB 4.27Å; W32-F53 HydrophobicContact CG-CD2 4.06Å; W32-F53 HydrophobicContact CG-CG 4.33Å; W32-F53 HydrophobicContact CZ2-CB 3.92Å; W32-F53 AromaticContact NE1-CG 3.95Å; L37-F53 HydrophobicContact CB-CZ 4.19Å; L37-F53 HydrophobicContact CD2-CE1 4.36Å; L37-F53 HydrophobicContact CD2-CZ 4.39Å; R39-F53 HydrophobicContact CG-CE2 4.08Å; R39-F53 HydrophobicContact CG-CZ 4.08Å; A51-F53 VanDerWaalsContact C-N 3.28Å; A51-F53 PolarHBondContact O-N 2.72Å; F53-Y68 HydrophobicContact CB-CD1 4.43Å; F53-Y68 AromaticContact CD2-CD1 3.47Å; F53-Y68 HydrophobicContact CD2-CD1 3.47Å; F53-Y68 VanDerWaalsContact CD2-CD1 3.47Å; F53-Y68 AromaticContact CD2-CE1 3.86Å; F53-Y68 HydrophobicContact CD2-CE1 3.86Å; F53-Y68 HydrophobicContact CE2-CD1 4.16Å; F53-Y68 HydrophobicContact CE2-CE1 4.08Å; F53-Y68 HydrophobicContact CG-CD1 4.37Å; F53-Y68 PolarHBondContact O-N 2.74Å
54	H	85.8	Confident	72.1	Confident	79 Å²	79	66.5 Å²	66.5	37%	0.366	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	141.9	178.9	-176.8	93.9	0	0	0	109.5	N65 A66 S67	H54-N65 VanDerWaalsContact CE1-CB 3.46Å; H54-N65 WeakPolarHBondContact CE1-CB 2.99Å; H54-N65 PolarHBondContact CE1-ND2 3.22Å; H54-N65 PolarHBondContact NE2-OD1 2.97Å; H54-A66 WeakPolarHBondContact CA-O 3.43Å; H54-S67 PolarHBondContact ND1-OG 3.08Å
55	T	91.1	Very high	74.2	Confident	38 Å²	38	59.4 Å²	59.4	23%	0.233	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	149	170.6	-168.3	0	0	0	0	110.3	V28 W32 L57 A66	V28-T55 HydrophobicContact CB-CG2 4.44Å; V28-T55 HydrophobicContact CG1-CG2 3.71Å; V28-T55 HydrophobicContact CG2-CG2 3.84Å; W32-T55 HydrophobicContact CH2-CG2 3.86Å; W32-T55 HydrophobicContact CZ2-CG2 3.64Å; T55-L57 HydrophobicContact CG2-CG 4.29Å; T55-A66 HydrophobicContact CG2-CB 3.96Å; T55-A66 PolarHBondContact N-O 3.24Å; T55-A66 PolarHBondContact O-N 3.12Å
56	S	91.3	Very high	76.6	Confident	61 Å²	61	53.7 Å²	53.7	43%	0.427	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	140.5	169.4	-52	0	0	0	0	109.9	F64 N65	S56-F64 CarbonylContact C-O 3.18Å; S56-F64 VanDerWaalsContact CA-O 3.26Å; S56-F64 WeakPolarHBondContact CA-O 3.26Å; S56-N65 PolarHBondContact OG-OD1 3.06Å
57	L	91.4	Very high	78.7	Confident	12 Å²	12	49.6 Å²	49.6	6%	0.063	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.8	-179	-70.8	170.7	0	0	0	108.4	F21 N24 I25 V28 T55 L63 F64 A66 F147	F21-L57 HydrophobicContact CE2-CB 4.03Å; N24-L57 HydrophobicContact CB-CD2 4.36Å; I25-L57 HydrophobicContact CG1-CD1 4.06Å; V28-L57 HydrophobicContact CG2-CD2 4.12Å; T55-L57 HydrophobicContact CG2-CG 4.29Å; L57-L63 CarbonylContact O-C 3.48Å; L57-L63 WeakPolarHBondContact O-CA 3.5Å; L57-F64 PolarHBondContact N-O 3.17Å; L57-F64 PolarHBondContact O-N 3.21Å; L57-A66 HydrophobicContact CD1-CB 4.02Å; L57-F147 HydrophobicContact CD1-CE1 4.42Å; L57-F147 HydrophobicContact CD1-CZ 3.75Å
58	E	88.7	Confident	80.5	Confident	123 Å²	123	45.2 Å²	45.2	58%	0.575	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	134.2	-179.5	-169.3	-170.5	152.5	0	0	110.7	F21 G61 N62 L63	F21-E58 VanDerWaalsContact CD2-O 3.3Å; F21-E58 WeakPolarHBondContact CD2-O 3.46Å; E58-G61 WeakPolarHBondContact OE1-CA 3.38Å; E58-G61 PolarHBondContact OE1-N 3.43Å; E58-N62 WeakPolarHBondContact CA-O 3.23Å; E58-L63 HydrophobicContact CB-CD1 4.36Å
59	Y	88.7	Confident	82.2	Confident	11 Å²	11	41.2 Å²	41.2	4%	0.043	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	115.4	171.1	177.3	-116.4	0	0	0	110.3	W18 F21 G61 N62 E139 A142 I143	W18-Y59 HydrophobicContact CB-CE2 4.22Å; F21-Y59 HydrophobicContact CB-CD2 3.78Å; F21-Y59 HydrophobicContact CB-CE2 4.44Å; F21-Y59 AromaticContact CD1-CD2 3.98Å; F21-Y59 HydrophobicContact CD1-CD2 3.98Å; F21-Y59 HydrophobicContact CD1-CG 4.06Å; F21-Y59 HydrophobicContact CD2-CD2 4.41Å; F21-Y59 HydrophobicContact CD2-CG 4.43Å; F21-Y59 HydrophobicContact CE1-CG 4.34Å; F21-Y59 AromaticContact CG-CD2 3.82Å; F21-Y59 HydrophobicContact CG-CD2 3.82Å; F21-Y59 HydrophobicContact CG-CG 4.12Å; Y59-G61 PolarHBondContact O-N 3.23Å; Y59-N62 PolarHBondContact N-O 3.37Å; Y59-N62 WeakPolarHBondContact O-CB 3.44Å; Y59-N62 PolarHBondContact O-N 3.5Å; Y59-E139 HydrophobicContact CD1-CB 4.49Å; Y59-E139 HydrophobicContact CE1-CB 4.11Å; Y59-E139 HydrophobicContact CE1-CG 4.31Å; Y59-E139 WeakPolarHBondContact CE1-OE2 2.9Å; Y59-E139 PolarHBondContact OH-OE2 2.97Å; Y59-E139 VanDerWaalsContact OH-OE2 3.14Å; Y59-A142 HydrophobicContact CE1-CB 4.15Å; Y59-I143 HydrophobicContact CD1-CD1 4.33Å; Y59-I143 HydrophobicContact CD1-CG1 3.76Å; Y59-I143 HydrophobicContact CE1-CG1 4.25Å
60	K	84.4	Confident	83.4	Confident	112 Å²	112	33.4 Å²	33.4	49%	0.487	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	41.5	-177.8	-63	177.8	176.6	166.9	0	113.6	N62 E139	K60-N62 VanDerWaalsContact C-N 3.3Å; K60-N62 PolarHBondContact O-N 3.25Å; K60-E139 IonicContact NZ-OE1 2.86Å; K60-E139 PolarHBondContact NZ-OE1 2.78Å; K60-E139 IonicContact NZ-OE2 3.98Å; K60-E139 PolarHBondContact NZ-OE2 2.83Å
61	G	79.8	Confident	83.7	Confident	55 Å²	55	35.4 Å²	35.4	57%	0.567	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.9	-7.6	-179.4	0	0	0	0	0	115.5	E58 Y59	E58-G61 WeakPolarHBondContact OE1-CA 3.38Å; E58-G61 PolarHBondContact OE1-N 3.43Å; Y59-G61 PolarHBondContact O-N 3.23Å
62	N	82.9	Confident	83.2	Confident	24 Å²	24	44.1 Å²	44.1	13%	0.128	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127.1	171.3	-63.4	-58.1	0	0	0	109.7	E58 Y59 K60 F64	E58-N62 WeakPolarHBondContact CA-O 3.23Å; Y59-N62 PolarHBondContact N-O 3.37Å; Y59-N62 WeakPolarHBondContact O-CB 3.44Å; Y59-N62 PolarHBondContact O-N 3.5Å; K60-N62 VanDerWaalsContact C-N 3.3Å; K60-N62 PolarHBondContact O-N 3.25Å; N62-F64 HydrophobicContact CB-CE2 3.59Å; N62-F64 HydrophobicContact CB-CZ 3.5Å; N62-F64 WeakPolarHBondContact O-CD2 3.42Å; N62-F64 VanDerWaalsContact O-CE2 3.24Å; N62-F64 WeakPolarHBondContact O-CE2 3.1Å
63	L	87.8	Confident	81.9	Confident	65 Å²	65	50.8 Å²	50.8	34%	0.34	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	139.3	179.6	-167.7	72.7	0	0	0	110.4	L57 E58 V129	L57-L63 CarbonylContact O-C 3.48Å; L57-L63 WeakPolarHBondContact O-CA 3.5Å; E58-L63 HydrophobicContact CB-CD1 4.36Å; L63-V129 HydrophobicContact CB-CB 4.09Å; L63-V129 HydrophobicContact CD2-CB 4.01Å; L63-V129 HydrophobicContact CD2-CG1 3.99Å; L63-V129 HydrophobicContact CD2-CG2 4.3Å; L63-V129 HydrophobicContact CG-CB 4.16Å; L63-V129 HydrophobicContact CG-CG2 4.31Å; L63-V129 PolarHBondContact O-N 2.94Å
64	F	88	Confident	80	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138.3	179.4	-55.4	-80.3	0	0	0	109.9	S56 L57 N62 V126 T127 P128 F136 I143	S56-F64 CarbonylContact C-O 3.18Å; S56-F64 VanDerWaalsContact CA-O 3.26Å; S56-F64 WeakPolarHBondContact CA-O 3.26Å; L57-F64 PolarHBondContact N-O 3.17Å; L57-F64 PolarHBondContact O-N 3.21Å; N62-F64 HydrophobicContact CB-CE2 3.59Å; N62-F64 HydrophobicContact CB-CZ 3.5Å; N62-F64 WeakPolarHBondContact O-CD2 3.42Å; N62-F64 VanDerWaalsContact O-CE2 3.24Å; N62-F64 WeakPolarHBondContact O-CE2 3.1Å; F64-V126 HydrophobicContact CB-CG1 4.21Å; F64-T127 CarbonylContact C-O 3.56Å; F64-T127 WeakPolarHBondContact CA-O 3.29Å; F64-P128 HydrophobicContact CD1-CB 4.01Å; F64-P128 HydrophobicContact CE1-CB 3.96Å; F64-F136 AromaticContact CE1-CD2 3.9Å; F64-F136 HydrophobicContact CE1-CD2 3.9Å; F64-F136 AromaticContact CE1-CE2 3.66Å; F64-F136 HydrophobicContact CE1-CE2 3.66Å; F64-F136 HydrophobicContact CZ-CD2 4.42Å; F64-F136 HydrophobicContact CZ-CE2 4.45Å; F64-I143 HydrophobicContact CE1-CD1 3.92Å; F64-I143 HydrophobicContact CE2-CD1 3.84Å; F64-I143 HydrophobicContact CE2-CG1 4.42Å; F64-I143 HydrophobicContact CZ-CD1 3.29Å; F64-I143 HydrophobicContact CZ-CG1 4.31Å
65	N	90.5	Very high	77.7	Confident	17 Å²	17	52.1 Å²	52.1	9%	0.091	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	121.5	170.8	-81.3	-6.4	0	0	0	109.1	E48 H54 S56 V126 T127 V129	E48-N65 PolarHBondContact OE1-ND2 3.46Å; H54-N65 VanDerWaalsContact CE1-CB 3.46Å; H54-N65 WeakPolarHBondContact CE1-CB 2.99Å; H54-N65 PolarHBondContact CE1-ND2 3.22Å; H54-N65 PolarHBondContact NE2-OD1 2.97Å; S56-N65 PolarHBondContact OG-OD1 3.06Å; N65-V126 CarbonylContact O-C 3.56Å; N65-V126 WeakPolarHBondContact O-CA 3.47Å; N65-T127 WeakPolarHBondContact CB-OG1 3.38Å; N65-T127 PolarHBondContact N-O 2.94Å; N65-T127 PolarHBondContact O-N 2.88Å; N65-T127 PolarHBondContact O-OG1 3.42Å; N65-V129 HydrophobicContact CB-CG2 4Å; N65-V129 WeakPolarHBondContact ND2-CG2 3.47Å; N65-V129 WeakPolarHBondContact OD1-CG2 3.27Å
66	A	91.8	Very high	75.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	111.9	173.1	0	0	0	0	0	108	W32 H54 T55 L57 L124 A125	W32-A66 HydrophobicContact CH2-CB 4.08Å; W32-A66 WeakPolarHBondContact CH2-O 2.99Å; H54-A66 WeakPolarHBondContact CA-O 3.43Å; T55-A66 HydrophobicContact CG2-CB 3.96Å; T55-A66 PolarHBondContact N-O 3.24Å; T55-A66 PolarHBondContact O-N 3.12Å; L57-A66 HydrophobicContact CD1-CB 4.02Å; A66-L124 HydrophobicContact CB-CD1 4.07Å; A66-A125 WeakPolarHBondContact CA-O 3.44Å
67	S	90.1	Very high	72.5	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	118	-175.5	-62.4	0	0	0	0	110.5	H54 F69 L124 A125	H54-S67 PolarHBondContact ND1-OG 3.08Å; S67-F69 WeakPolarHBondContact O-CD2 3.49Å; S67-F69 WeakPolarHBondContact O-CE2 3.23Å; S67-L124 WeakPolarHBondContact O-CD1 3.39Å; S67-A125 PolarHBondContact N-O 2.68Å; S67-A125 PolarHBondContact O-N 3.05Å
68	Y	87.6	Confident	69.8	Low	2 Å²	2	62.7 Å²	62.7	1%	0.008	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	130.5	-177	167.8	-108	0	0	0	111.9	W32 C52 F53 C70 E122 W156 I158	W32-Y68 HydrophobicContact CE3-CG 4.49Å; C52-Y68 HydrophobicContact CB-CD1 4.05Å; C52-Y68 HydrophobicContact CB-CE1 4.39Å; C52-Y68 PolarHBondContact N-O 3.02Å; F53-Y68 HydrophobicContact CB-CD1 4.43Å; F53-Y68 AromaticContact CD2-CD1 3.47Å; F53-Y68 HydrophobicContact CD2-CD1 3.47Å; F53-Y68 VanDerWaalsContact CD2-CD1 3.47Å; F53-Y68 AromaticContact CD2-CE1 3.86Å; F53-Y68 HydrophobicContact CD2-CE1 3.86Å; F53-Y68 HydrophobicContact CE2-CD1 4.16Å; F53-Y68 HydrophobicContact CE2-CE1 4.08Å; F53-Y68 HydrophobicContact CG-CD1 4.37Å; F53-Y68 PolarHBondContact O-N 2.74Å; Y68-C70 HydrophobicContact CE1-CB 4.04Å; Y68-E122 HydrophobicContact CE2-CG 3.63Å; Y68-E122 VanDerWaalsContact CE2-OE1 3.23Å; Y68-E122 WeakPolarHBondContact CE2-OE1 3.41Å; Y68-E122 VanDerWaalsContact OH-CD 3.28Å; Y68-E122 PolarHBondContact OH-OE1 2.92Å; Y68-W156 HydrophobicContact CD2-CZ2 4.4Å; Y68-I158 HydrophobicContact CE2-CD1 3.9Å; Y68-I158 HydrophobicContact CE2-CG2 4.18Å
69	F	84.2	Confident	67.1	Low	21 Å²	21	62.5 Å²	62.5	9%	0.092	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131.2	-175.8	-60.7	-89.8	0	0	0	110.7	A51 S67 E122 Y123 A125	A51-F69 HydrophobicContact CB-CD1 4.38Å; A51-F69 HydrophobicContact CB-CE1 3.87Å; A51-F69 HydrophobicContact CB-CE2 4.4Å; A51-F69 HydrophobicContact CB-CZ 3.88Å; S67-F69 WeakPolarHBondContact O-CD2 3.49Å; S67-F69 WeakPolarHBondContact O-CE2 3.23Å; F69-E122 WeakPolarHBondContact O-CA 3.47Å; F69-E122 WeakPolarHBondContact O-CG 3.33Å; F69-Y123 HydrophobicContact CB-CD1 4.45Å; F69-Y123 HydrophobicContact CB-CD2 4.48Å; F69-Y123 HydrophobicContact CB-CE1 4.11Å; F69-Y123 HydrophobicContact CB-CE2 4.13Å; F69-Y123 AromaticContact CD2-CD2 3.97Å; F69-Y123 HydrophobicContact CD2-CD2 3.97Å; F69-Y123 AromaticContact CD2-CE2 3.43Å; F69-Y123 HydrophobicContact CD2-CE2 3.43Å; F69-Y123 VanDerWaalsContact CD2-CE2 3.43Å; F69-Y123 AromaticContact CD2-CZ 3.95Å; F69-Y123 HydrophobicContact CE2-CE2 4.07Å; F69-Y123 AromaticContact CG-CE2 3.96Å; F69-Y123 HydrophobicContact CG-CE2 3.96Å; F69-Y123 AromaticContact CG-CZ 3.99Å; F69-Y123 PolarHBondContact N-O 3.17Å; F69-Y123 PolarHBondContact O-N 3.34Å; F69-A125 HydrophobicContact CD2-CB 4.49Å; F69-A125 HydrophobicContact CE2-CB 3.99Å
70	C	73.8	Confident	64.4	Low	7 Å²	7	71 Å²	71	5%	0.047	37%	0.369	C	S	.	.			trans	-141.3	140.2	-175.4	174.7	0	0	0	0	111	C42 Y68 E122	C42-C70 PolarHBondContact SG-O 3.31Å; Y68-C70 HydrophobicContact CE1-CB 4.04Å; C70-E122 HydrophobicContact CB-CG 4.15Å
71	P	64.1	Low	61.9	Low	52 Å²	52	69.4 Å²	69.4	34%	0.338	37%	0.372	S	S	.	.			trans	-65.6	154.1	179	-14.5	27.5	0	0	0	113.4	N73 A74 N121	P71-N73 PolarHBondContact O-N 2.94Å; P71-A74 HydrophobicContact CB-CB 4.49Å; P71-A74 WeakPolarHBondContact O-CB 3.24Å; P71-A74 PolarHBondContact O-N 3.45Å; P71-N121 WeakPolarHBondContact CD-O 3.43Å; P71-N121 HydrophobicContact CG-CB 4.04Å; P71-N121 WeakPolarHBondContact CG-O 3.29Å
72	R	52.4	Low	59.4	Low	201 Å²	201	72 Å²	72	76%	0.758	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	131.6	170.1	-169.9	174.8	-179.2	167.2	3.3	110.9	A74	R72-A74 PolarHBondContact O-N 2.92Å
73	N	44.1	Very low	56.9	Low	150 Å²	150	77.4 Å²	77.4	80%	0.802	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	15.9	178.7	-62.9	-14.1	0	0	0	116.5	P71 T75	P71-N73 PolarHBondContact O-N 2.94Å; N73-T75 PolarHBondContact O-N 2.79Å
74	A	42.6	Very low	54.2	Low	38 Å²	38	83.2 Å²	83.2	31%	0.314	43%	0.434	S	S	.	.			trans	-71.7	86.3	167.3	0	0	0	0	0	109	R39 P71 R72 Y76	R39-A74 PolarHBondContact NH1-O 3.02Å; R39-A74 VanDerWaalsContact NH1-O 3.15Å; P71-A74 HydrophobicContact CB-CB 4.49Å; P71-A74 WeakPolarHBondContact O-CB 3.24Å; P71-A74 PolarHBondContact O-N 3.45Å; R72-A74 PolarHBondContact O-N 2.92Å; A74-Y76 PolarHBondContact O-N 3.03Å
75	T	36.8	Very low	51.5	Low	101 Å²	101	89.2 Å²	89.2	62%	0.62	47%	0.466	S	S	*	.			trans	-64.6	118.6	157.8	52.7	0	0	0	0	105.9	N73 K77	N73-T75 PolarHBondContact O-N 2.79Å; T75-K77 PolarHBondContact O-N 2.89Å
76	Y	37.8	Very low	48.8	Very low	81 Å²	81	96.5 Å²	96.5	32%	0.318	51%	0.505	S	S	.	.			trans	-61.3	92	166.9	-170.1	-86.1	0	0	0	107	A74	A74-Y76 PolarHBondContact O-N 3.03Å
77	K	35.4	Very low	46.1	Very low	145 Å²	145	99 Å²	99	63%	0.63	53%	0.531	S	S	*	.			trans	-114.4	109.3	166.5	-73.6	-173.3	178.3	-176	0	103.9	T75 D79	T75-K77 PolarHBondContact O-N 2.89Å; K77-D79 VanDerWaalsContact C-N 3.33Å; K77-D79 PolarHBondContact O-N 3.19Å
78	T	34.5	Very low	43.7	Very low	106 Å²	106	104.2 Å²	104.2	65%	0.65	57%	0.568	S	S	*	*			trans	-50	111.7	148.5	-7.7	0	0	0	0	104.7	E80	T78-E80 VanDerWaalsContact C-N 3.33Å; T78-E80 PolarHBondContact O-N 3.24Å
79	D	32.6	Very low	41.8	Very low	119 Å²	119	111.5 Å²	111.5	64%	0.636	60%	0.601	S	S	*	*			trans	-58.5	96.2	-176	-82.2	-38.8	0	0	0	109.3	K77 S81	K77-D79 VanDerWaalsContact C-N 3.33Å; K77-D79 PolarHBondContact O-N 3.19Å; D79-S81 PolarHBondContact O-N 2.96Å
80	E	30.3	Very low	40.4	Very low	189 Å²	189	114.6 Å²	114.6	88%	0.883	61%	0.612	S	S	*	*			trans	-79	16.6	160.5	-73.1	-162.6	164	0	0	111	T78 S82	T78-E80 VanDerWaalsContact C-N 3.33Å; T78-E80 PolarHBondContact O-N 3.24Å; E80-S82 PolarHBondContact O-N 3.41Å
81	S	32.2	Very low	39.8	Very low	79 Å²	79	120.2 Å²	120.2	55%	0.552	64%	0.642	S	S	*	*			trans	-76.4	84.5	167.8	60.7	0	0	0	0	109	D79 I83	D79-S81 PolarHBondContact O-N 2.96Å; S81-I83 VanDerWaalsContact C-N 3.29Å; S81-I83 PolarHBondContact O-N 2.96Å
82	S	27.7	Very low	39.9	Very low	109 Å²	109	119.5 Å²	119.5	76%	0.762	63%	0.633	S	S	*	*			trans	-52.2	91.1	162.3	56.8	0	0	0	0	109.9	E80 E84	E80-S82 PolarHBondContact O-N 3.41Å; S82-E84 PolarHBondContact O-N 3.38Å
83	I	30.6	Very low	40.6	Very low	138 Å²	138	110.2 Å²	110.2	71%	0.708	60%	0.599	S	S	*	*			trans	-77.4	111.1	151.8	-63.1	176	0	0	0	103.8	S81 N85	S81-I83 VanDerWaalsContact C-N 3.29Å; S81-I83 PolarHBondContact O-N 2.96Å; I83-N85 VanDerWaalsContact C-N 3.26Å; I83-N85 PolarHBondContact O-N 2.92Å
84	E	30.3	Very low	41.7	Very low	188 Å²	188	106.4 Å²	106.4	88%	0.879	58%	0.582	S	S	*	*			trans	-56	92.9	170.2	-69.8	-179.9	160.3	0	0	108.6	S82	S82-E84 PolarHBondContact O-N 3.38Å
85	N	33.1	Very low	42.9	Very low	128 Å²	128	104.7 Å²	104.7	68%	0.684	57%	0.568	S	S	*	*			trans	-142.1	133.4	160.4	-97.4	-20	0	0	0	108.7	I83	I83-N85 VanDerWaalsContact C-N 3.26Å; I83-N85 PolarHBondContact O-N 2.92Å
86	D	33.5	Very low	44.5	Very low	170 Å²	170	100.1 Å²	100.1	91%	0.909	54%	0.54	S	S	*	.	S	Bend	trans	-61.3	133.6	-168.3	-158.2	6.9	0	0	0	112.3
87	G	34.2	Very low	46.4	Very low	52 Å²	52	98.2 Å²	98.2	54%	0.536	54%	0.539	S	S	.	.	S	Bend	trans	83.3	85.6	166.7	0	0	0	0	0	117	E89	G87-E89 PolarHBondContact O-N 2.98Å
88	S	40.2	Very low	48.6	Very low	113 Å²	113	93.1 Å²	93.1	79%	0.79	52%	0.517	S	S	*	.			trans	23.7	67.6	156.9	66.4	0	0	0	0	116.1	R90	S88-R90 PolarHBondContact O-N 3.28Å
89	E	47.3	Very low	51	Low	154 Å²	154	88.2 Å²	88.2	72%	0.72	49%	0.486	S	S	*	.			trans	-65.4	105.7	169.6	-75	-172.9	163.5	0	0	107.8	G87 L91	G87-E89 PolarHBondContact O-N 2.98Å; E89-L91 PolarHBondContact O-N 3.16Å
90	R	55.7	Low	53.3	Low	86 Å²	86	86.5 Å²	86.5	33%	0.325	47%	0.474	S	S	.	.			trans	-62	108.6	176.5	-63.3	-175.2	-172.7	165.9	-1.8	108.2	S88 F187 C773 D799 D801 E805	S88-R90 PolarHBondContact O-N 3.28Å; R90-F187 HydrophobicContact CB-CE2 4.4Å; R90-C773 PolarHBondContact NH1-SG 3.03Å; R90-D799 IonicContact NH1-OD1 3.88Å; R90-D799 IonicContact NH1-OD2 3.94Å; R90-D801 IonicContact CZ-OD2 3.88Å; R90-D801 IonicContact NE-OD2 3.77Å; R90-D801 IonicContact NH1-OD2 2.71Å; R90-E805 IonicContact NH2-OE1 3.49Å; R90-E805 PolarHBondContact NH2-OE1 3.49Å
91	L	60.6	Low	55.9	Low	126 Å²	126	80.7 Å²	80.7	66%	0.66	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-81.1	133.6	-173.1	-70.3	164.5	0	0	0	111.3	E89 N184	E89-L91 PolarHBondContact O-N 3.16Å; L91-N184 PolarHBondContact O-ND2 3.33Å
92	F	66.1	Low	58.5	Low	36 Å²	36	84.3 Å²	84.3	16%	0.158	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-71.4	150.3	170.3	-69.1	-93.7	0	0	0	110.2	F187 R774 P776 T797	F92-F187 AromaticContact CD1-CD2 3.72Å; F92-F187 HydrophobicContact CD1-CD2 3.72Å; F92-F187 AromaticContact CD1-CE2 3.87Å; F92-F187 HydrophobicContact CD1-CE2 3.87Å; F92-F187 HydrophobicContact CD1-CG 4.09Å; F92-F187 HydrophobicContact CD1-CZ 4.37Å; F92-F187 HydrophobicContact CD2-CE2 4.16Å; F92-F187 AromaticContact CE1-CD1 3.82Å; F92-F187 HydrophobicContact CE1-CD1 3.82Å; F92-F187 AromaticContact CE1-CD2 3.66Å; F92-F187 HydrophobicContact CE1-CD2 3.66Å; F92-F187 AromaticContact CE1-CE1 3.73Å; F92-F187 HydrophobicContact CE1-CE1 3.73Å; F92-F187 AromaticContact CE1-CE2 3.55Å; F92-F187 HydrophobicContact CE1-CE2 3.55Å; F92-F187 AromaticContact CE1-CG 3.79Å; F92-F187 HydrophobicContact CE1-CG 3.79Å; F92-F187 AromaticContact CE1-CZ 3.59Å; F92-F187 HydrophobicContact CE1-CZ 3.59Å; F92-F187 AromaticContact CE2-CE2 3.94Å; F92-F187 HydrophobicContact CE2-CE2 3.94Å; F92-F187 AromaticContact CE2-CZ 3.95Å; F92-F187 HydrophobicContact CE2-CZ 3.95Å; F92-F187 HydrophobicContact CG-CD2 4.26Å; F92-F187 HydrophobicContact CG-CE2 4.16Å; F92-F187 HydrophobicContact CZ-CD1 4.34Å; F92-F187 HydrophobicContact CZ-CD2 4.2Å; F92-F187 AromaticContact CZ-CE1 3.77Å; F92-F187 HydrophobicContact CZ-CE1 3.77Å; F92-F187 AromaticContact CZ-CE2 3.59Å; F92-F187 HydrophobicContact CZ-CE2 3.59Å; F92-F187 AromaticContact CZ-CZ 3.35Å; F92-F187 HydrophobicContact CZ-CZ 3.35Å; F92-R774 WeakPolarHBondContact CZ-O 3.14Å; F92-P776 HydrophobicContact CD1-CG 4.43Å; F92-P776 HydrophobicContact CE1-CG 4.19Å; F92-T797 HydrophobicContact CE1-CG2 4.3Å
93	S	67.8	Low	61.4	Low	7 Å²	7	79.3 Å²	79.3	5%	0.049	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-54.4	130.8	172.3	167.6	0	0	0	0	109.7	A95 V96 S97 Q157 N184	S93-A95 PolarHBondContact O-N 3.32Å; S93-A95 PolarHBondContact OG-N 2.98Å; S93-V96 WeakPolarHBondContact O-CG2 3.3Å; S93-V96 PolarHBondContact O-N 3.24Å; S93-S97 PolarHBondContact O-N 3.27Å; S93-Q157 PolarHBondContact OG-O 3.26Å; S93-N184 PolarHBondContact N-ND2 3.29Å
94	P	66.2	Low	64.1	Low	69 Å²	69	75.9 Å²	75.9	45%	0.448	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-52.5	-28.1	176.7	-28.3	35.1	0	0	0	113.2	V96 S97 N121	P94-V96 VanDerWaalsContact C-N 3.31Å; P94-V96 PolarHBondContact O-N 2.96Å; P94-S97 WeakPolarHBondContact O-CB 3.32Å; P94-S97 PolarHBondContact O-N 2.96Å; P94-S97 PolarHBondContact O-OG 3.34Å; P94-N121 PolarHBondContact O-ND2 3.42Å
95	A	67.1	Low	66.6	Low	2 Å²	2	68.4 Å²	68.4	2%	0.017	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-65.6	-30.4	179.6	0	0	0	0	0	113.6	S93 N121 E122 P159	S93-A95 PolarHBondContact O-N 3.32Å; S93-A95 PolarHBondContact OG-N 2.98Å; A95-N121 PolarHBondContact O-N 3.07Å; A95-E122 HydrophobicContact CB-CB 4.2Å; A95-P159 HydrophobicContact CB-CG 4.13Å
96	V	72.4	Confident	69	Low	5 Å²	5	68.1 Å²	68.1	3%	0.03	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-106	3.3	178.4	-61.8	0	0	0	0	113.4	S93 P94 K98 M99 L120 P159 C182 F191	S93-V96 WeakPolarHBondContact O-CG2 3.3Å; S93-V96 PolarHBondContact O-N 3.24Å; P94-V96 VanDerWaalsContact C-N 3.31Å; P94-V96 PolarHBondContact O-N 2.96Å; V96-K98 PolarHBondContact O-N 3.46Å; V96-K98 VanDerWaalsContact O-N 3.11Å; V96-M99 HydrophobicContact CB-SD 4.09Å; V96-M99 HydrophobicContact CG1-SD 4.5Å; V96-M99 VanDerWaalsContact O-CB 3.31Å; V96-M99 WeakPolarHBondContact O-CB 3.45Å; V96-M99 PolarHBondContact O-N 3.41Å; V96-L120 HydrophobicContact CG1-CD2 4.2Å; V96-P159 HydrophobicContact CG1-CG 3.85Å; V96-C182 HydrophobicContact CG1-CB 4.37Å; V96-F191 HydrophobicContact CG1-CZ 3.95Å
97	S	76.6	Confident	71.5	Confident	41 Å²	41	61.2 Å²	61.2	29%	0.287	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-55.6	-30.3	179.2	61.8	0	0	0	0	113.4	S93 P94 M99 Q100 N121	S93-S97 PolarHBondContact O-N 3.27Å; P94-S97 WeakPolarHBondContact O-CB 3.32Å; P94-S97 PolarHBondContact O-N 2.96Å; P94-S97 PolarHBondContact O-OG 3.34Å; S97-M99 PolarHBondContact O-N 3Å; S97-Q100 WeakPolarHBondContact O-CB 3.43Å; S97-Q100 PolarHBondContact O-N 3.01Å; S97-N121 PolarHBondContact OG-ND2 2.92Å; S97-N121 VanDerWaalsContact OG-ND2 3.08Å
98	K	82.1	Confident	74.1	Confident	39 Å²	39	58.7 Å²	58.7	17%	0.17	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-61.2	-23.3	176.7	-175.8	179.3	-179.8	-179.3	0	113.1	V96 Q100 C101 E107 S115 A119 N121	V96-K98 PolarHBondContact O-N 3.46Å; V96-K98 VanDerWaalsContact O-N 3.11Å; K98-Q100 PolarHBondContact O-N 3.46Å; K98-C101 WeakPolarHBondContact O-CB 3.23Å; K98-C101 PolarHBondContact O-N 2.99Å; K98-C101 VanDerWaalsContact O-N 3.15Å; K98-E107 WeakPolarHBondContact CE-OE1 3.31Å; K98-E107 IonicContact NZ-OE1 2.97Å; K98-S115 PolarHBondContact NZ-OG 3.34Å; K98-A119 HydrophobicContact CB-CB 4.45Å; K98-A119 WeakPolarHBondContact CB-O 3.4Å; K98-A119 HydrophobicContact CD-CB 4.48Å; K98-A119 HydrophobicContact CG-CB 4.12Å; K98-N121 WeakPolarHBondContact CB-OD1 3.34Å; K98-N121 WeakPolarHBondContact CD-OD1 3.48Å
99	M	84	Confident	76.4	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.01	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-61.2	-28.1	172.6	-68.2	177.8	55.5	0	0	112.8	V96 S97 A119 T189 F191 P776 R778 S795	V96-M99 HydrophobicContact CB-SD 4.09Å; V96-M99 HydrophobicContact CG1-SD 4.5Å; V96-M99 VanDerWaalsContact O-CB 3.31Å; V96-M99 WeakPolarHBondContact O-CB 3.45Å; V96-M99 PolarHBondContact O-N 3.41Å; S97-M99 PolarHBondContact O-N 3Å; M99-A119 HydrophobicContact CG-CB 3.94Å; M99-T189 HydrophobicContact CE-CG2 4.44Å; M99-T189 HydrophobicContact SD-CG2 4.25Å; M99-F191 HydrophobicContact SD-CE1 4.39Å; M99-P776 HydrophobicContact CB-CB 4.04Å; M99-P776 HydrophobicContact CB-CG 4.03Å; M99-P776 HydrophobicContact CE-CB 4.44Å; M99-P776 HydrophobicContact CE-CG 4.3Å; M99-P776 WeakPolarHBondContact CE-O 3.38Å; M99-R778 HydrophobicContact CE-CB 4.43Å; M99-S795 VanDerWaalsContact CE-CB 3.45Å; M99-S795 WeakPolarHBondContact CE-O 3.41Å
100	Q	81	Confident	78.1	Confident	83 Å²	83	50 Å²	50	39%	0.388	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-24.4	178.5	-56.5	177.1	5	0	0	112.3	S97 K98 P776	S97-Q100 WeakPolarHBondContact O-CB 3.43Å; S97-Q100 PolarHBondContact O-N 3.01Å; K98-Q100 PolarHBondContact O-N 3.46Å; Q100-P776 HydrophobicContact CG-CB 4.06Å; Q100-P776 HydrophobicContact CG-CG 3.83Å
101	C	84.4	Confident	79.3	Confident	67 Å²	67	50.9 Å²	50.9	45%	0.453	27%	0.274	S	S	.	.	S	Bend	trans	-67.1	148.2	-176.4	-61.7	0	0	0	0	111.6	K98 R762	K98-C101 WeakPolarHBondContact O-CB 3.23Å; K98-C101 PolarHBondContact O-N 2.99Å; K98-C101 VanDerWaalsContact O-N 3.15Å; C101-R762 VanDerWaalsContact O-CZ 3.28Å; C101-R762 PolarHBondContact O-NE 2.9Å; C101-R762 PolarHBondContact O-NH1 3.07Å
102	K	87.9	Confident	80.4	Confident	156 Å²	156	46.3 Å²	46.3	68%	0.678	25%	0.25	S	S	*	.	P	Polyproline II helix	trans	-65.5	139.8	170.6	-71.4	-174.5	-177.9	179.2	0	109.8	T104	K102-T104 PolarHBondContact O-N 2.92Å
103	T	88.9	Confident	81.3	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.025	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-63.2	129.7	177.4	-49.5	0	0	0	0	109.6	E107 L108 S230 N287 I760 R762	T103-E107 VanDerWaalsContact CA-OE2 3.25Å; T103-E107 WeakPolarHBondContact CA-OE2 3.41Å; T103-E107 HydrophobicContact CG2-CB 4.35Å; T103-E107 WeakPolarHBondContact CG2-OE2 3.47Å; T103-L108 HydrophobicContact CG2-CD1 4.01Å; T103-L108 HydrophobicContact CG2-CD2 4.31Å; T103-L108 HydrophobicContact CG2-CG 3.91Å; T103-S230 VanDerWaalsContact CB-OG 3.27Å; T103-S230 WeakPolarHBondContact CB-OG 2.83Å; T103-S230 PolarHBondContact OG1-OG 3.47Å; T103-N287 PolarHBondContact N-OD1 3.31Å; T103-N287 PolarHBondContact O-ND2 3.28Å; T103-I760 HydrophobicContact CG2-CB 4.44Å; T103-I760 HydrophobicContact CG2-CD1 3.75Å; T103-I760 HydrophobicContact CG2-CG2 4.41Å; T103-R762 PolarHBondContact OG1-NE 3.18Å
104	T	87.3	Confident	82.1	Confident	65 Å²	65	46.7 Å²	46.7	40%	0.399	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-91	165.8	-179.2	72.3	0	0	0	0	111.8	K102 Q106 E107	K102-T104 PolarHBondContact O-N 2.92Å; T104-Q106 PolarHBondContact O-N 3.38Å; T104-Q106 PolarHBondContact OG1-N 3.02Å; T104-E107 PolarHBondContact N-OE2 2.91Å; T104-E107 WeakPolarHBondContact OG1-CG 3.4Å; T104-E107 PolarHBondContact OG1-N 2.97Å
105	S	83.2	Confident	83	Confident	31 Å²	31	44.3 Å²	44.3	22%	0.217	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-37.9	172.1	-54.8	0	0	0	0	111.7	L108 L109 Q286	S105-L108 PolarHBondContact O-N 3.04Å; S105-L109 WeakPolarHBondContact O-CD1 3.17Å; S105-L109 VanDerWaalsContact O-CG 3.23Å; S105-L109 WeakPolarHBondContact O-CG 3.4Å; S105-L109 PolarHBondContact O-N 3.17Å; S105-Q286 VanDerWaalsContact CB-NE2 3.27Å; S105-Q286 PolarHBondContact OG-NE2 2.78Å; S105-Q286 PolarHBondContact OG-OE1 2.91Å
106	Q	83.8	Confident	84	Confident	122 Å²	122	44.4 Å²	44.4	57%	0.57	24%	0.238	S	C	*	.	H	α-helix	trans	-69	-43.8	-173.2	-176.1	165.3	-3.3	0	0	111.3	T104 L108 L109 E110	T104-Q106 PolarHBondContact O-N 3.38Å; T104-Q106 PolarHBondContact OG1-N 3.02Å; Q106-L108 PolarHBondContact O-N 3.28Å; Q106-L109 PolarHBondContact O-N 3.31Å; Q106-E110 HydrophobicContact CG-CG 4.23Å; Q106-E110 WeakPolarHBondContact CG-OE1 3.42Å; Q106-E110 PolarHBondContact NE2-OE1 3.41Å; Q106-E110 WeakPolarHBondContact O-CG 3.3Å; Q106-E110 PolarHBondContact O-N 3.37Å
107	E	84.2	Confident	84.8	Confident	25 Å²	25	44.7 Å²	44.7	12%	0.117	24%	0.24	C	C	.	.	H	α-helix	trans	-55.5	-36	172.4	-75.7	176.7	165.8	0	0	113.1	K98 T103 T104 L109 L116 R758	K98-E107 WeakPolarHBondContact CE-OE1 3.31Å; K98-E107 IonicContact NZ-OE1 2.97Å; T103-E107 VanDerWaalsContact CA-OE2 3.25Å; T103-E107 WeakPolarHBondContact CA-OE2 3.41Å; T103-E107 HydrophobicContact CG2-CB 4.35Å; T103-E107 WeakPolarHBondContact CG2-OE2 3.47Å; T104-E107 PolarHBondContact N-OE2 2.91Å; T104-E107 WeakPolarHBondContact OG1-CG 3.4Å; T104-E107 PolarHBondContact OG1-N 2.97Å; E107-L109 VanDerWaalsContact C-N 3.32Å; E107-L116 HydrophobicContact CB-CD1 3.54Å; E107-L116 HydrophobicContact CG-CD1 3.75Å; E107-L116 WeakPolarHBondContact O-CD2 3.39Å; E107-R758 PolarHBondContact O-NH1 2.88Å; E107-R758 VanDerWaalsContact O-NH1 3.11Å
108	L	89.4	Confident	85.5	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-75.7	-22.3	176.6	-70.7	162	0	0	0	112	T103 S105 Q106 R232 V284 Q286 R758 I760	T103-L108 HydrophobicContact CG2-CD1 4.01Å; T103-L108 HydrophobicContact CG2-CD2 4.31Å; T103-L108 HydrophobicContact CG2-CG 3.91Å; S105-L108 PolarHBondContact O-N 3.04Å; Q106-L108 PolarHBondContact O-N 3.28Å; L108-R232 HydrophobicContact CD2-CB 4.47Å; L108-R232 WeakPolarHBondContact O-CD 3.38Å; L108-R232 PolarHBondContact O-NE 3.37Å; L108-R232 PolarHBondContact O-NH1 3.13Å; L108-V284 HydrophobicContact CB-CG1 3.93Å; L108-V284 HydrophobicContact CD1-CG1 3.31Å; L108-V284 HydrophobicContact CG-CG1 4.21Å; L108-Q286 HydrophobicContact CD1-CG 3.63Å; L108-R758 PolarHBondContact O-NH1 2.97Å; L108-I760 HydrophobicContact CD2-CD1 3.82Å; L108-I760 HydrophobicContact CD2-CG1 4.33Å
109	L	88.1	Confident	85.9	Confident	18 Å²	18	41 Å²	41	9%	0.094	22%	0.219	C	C	.	.	H	α-helix	trans	-97.4	-18.5	-175.7	-65.5	168.3	0	0	0	114.2	S105 Q106 E107 M282 V284 Y311	S105-L109 WeakPolarHBondContact O-CD1 3.17Å; S105-L109 VanDerWaalsContact O-CG 3.23Å; S105-L109 WeakPolarHBondContact O-CG 3.4Å; S105-L109 PolarHBondContact O-N 3.17Å; Q106-L109 PolarHBondContact O-N 3.31Å; E107-L109 VanDerWaalsContact C-N 3.32Å; L109-M282 HydrophobicContact CD2-CB 4.01Å; L109-M282 HydrophobicContact CD2-CG 4.5Å; L109-M282 HydrophobicContact CD2-SD 3.72Å; L109-V284 HydrophobicContact CD2-CG2 4.13Å; L109-Y311 HydrophobicContact CD1-CD1 3.63Å; L109-Y311 HydrophobicContact CD1-CD2 3.91Å; L109-Y311 HydrophobicContact CD1-CE1 3.49Å; L109-Y311 VanDerWaalsContact CD1-CE1 3.49Å; L109-Y311 HydrophobicContact CD1-CE2 3.81Å; L109-Y311 HydrophobicContact CD1-CG 3.83Å; L109-Y311 HydrophobicContact CD2-CD1 4.33Å; L109-Y311 HydrophobicContact CD2-CD2 3.64Å; L109-Y311 HydrophobicContact CD2-CE2 4.23Å; L109-Y311 HydrophobicContact CD2-CG 3.71Å; L109-Y311 HydrophobicContact CG-CD2 4.32Å; L109-Y311 HydrophobicContact CG-CE2 4.46Å; L109-Y311 HydrophobicContact CG-CG 4.43Å
110	E	83.7	Confident	86.1	Confident	66 Å²	66	41 Å²	41	31%	0.308	22%	0.219	S	C	.	.	S	Bend	trans	-79.8	153.5	-179.3	-77.2	172.6	175.5	0	0	111.8	Q106 R758	Q106-E110 HydrophobicContact CG-CG 4.23Å; Q106-E110 WeakPolarHBondContact CG-OE1 3.42Å; Q106-E110 PolarHBondContact NE2-OE1 3.41Å; Q106-E110 WeakPolarHBondContact O-CG 3.3Å; Q106-E110 PolarHBondContact O-N 3.37Å; E110-R758 VanDerWaalsContact O-CZ 3.32Å; E110-R758 PolarHBondContact O-NH1 2.71Å; E110-R758 PolarHBondContact O-NH2 3.04Å
111	P	81.6	Confident	86.1	Confident	104 Å²	104	39.8 Å²	39.8	68%	0.675	22%	0.215	S	C	*	.			trans	-57.7	151.6	168.6	25.8	-32.7	0	0	0	110.6	D113	P111-D113 PolarHBondContact O-N 3.48Å
112	L	82.1	Confident	86.2	Confident	31 Å²	31	37.2 Å²	37.2	16%	0.162	20%	0.197	C	C	.	.			trans	-74.2	107.2	176.5	-82.3	172.8	0	0	0	110	L116 L117 E782	L112-L116 HydrophobicContact CD2-CB 4.41Å; L112-L116 HydrophobicContact CD2-CD2 3.84Å; L112-L116 HydrophobicContact CD2-CG 3.88Å; L112-L117 HydrophobicContact CB-CD2 4.32Å; L112-L117 HydrophobicContact CB-CG 4.28Å; L112-L117 HydrophobicContact CD1-CD2 4.01Å; L112-L117 HydrophobicContact CD2-CD2 3.96Å; L112-L117 HydrophobicContact CD2-CG 4.16Å; L112-L117 HydrophobicContact CG-CD2 4.33Å; L112-E782 HydrophobicContact CD1-CB 3.52Å; L112-E782 HydrophobicContact CD1-CG 4Å; L112-E782 WeakPolarHBondContact CD1-OE1 3.2Å; L112-E782 WeakPolarHBondContact CD1-OE2 3.47Å
113	D	84.8	Confident	86.3	Confident	37 Å²	37	30.1 Å²	30.1	20%	0.198	17%	0.165	C	C	.	.			trans	-101.6	177.6	163.4	61.7	38.5	0	0	0	111	H46 P111 S115 L116 L117	H46-D113 IonicContact CD2-OD2 3.58Å; H46-D113 PolarHBondContact CD2-OD2 3.4Å; H46-D113 IonicContact NE2-OD2 2.75Å; H46-D113 PolarHBondContact NE2-OD2 3.46Å; H46-D113 VanDerWaalsContact NE2-OD2 3.13Å; P111-D113 PolarHBondContact O-N 3.48Å; D113-S115 VanDerWaalsContact C-N 3.32Å; D113-S115 PolarHBondContact O-N 3.03Å; D113-S115 WeakPolarHBondContact OD1-CA 3.41Å; D113-S115 VanDerWaalsContact OD1-CB 3.31Å; D113-S115 WeakPolarHBondContact OD1-CB 3.33Å; D113-S115 PolarHBondContact OD1-N 2.89Å; D113-L116 PolarHBondContact O-N 2.92Å; D113-L116 WeakPolarHBondContact OD1-CB 3.37Å; D113-L116 PolarHBondContact OD1-N 3.12Å; D113-L117 WeakPolarHBondContact O-CB 3.47Å; D113-L117 VanDerWaalsContact O-CG 3.22Å; D113-L117 WeakPolarHBondContact O-CG 3.4Å; D113-L117 PolarHBondContact O-N 2.88Å
114	L	84.9	Confident	86.4	Confident	14 Å²	14	29.9 Å²	29.9	7%	0.073	16%	0.164	C	C	.	.	H	α-helix	trans	-58.2	-39.4	176.5	-95.2	172.2	0	0	0	113.6	L116 F118 Y123 A125 M161 Y178	L114-L116 VanDerWaalsContact C-N 3.31Å; L114-L116 PolarHBondContact O-N 3.4Å; L114-F118 HydrophobicContact CD2-CD2 3.85Å; L114-F118 HydrophobicContact CD2-CE2 3.78Å; L114-F118 PolarHBondContact O-N 2.82Å; L114-Y123 HydrophobicContact CB-CE1 4.43Å; L114-Y123 HydrophobicContact CB-CE2 4.01Å; L114-Y123 HydrophobicContact CD1-CD2 4.31Å; L114-Y123 HydrophobicContact CD1-CE2 3.68Å; L114-A125 HydrophobicContact CD1-CB 4.35Å; L114-M161 HydrophobicContact CD2-CB 4.49Å; L114-M161 HydrophobicContact CD2-CE 4.09Å; L114-M161 HydrophobicContact CD2-CG 4.49Å; L114-Y178 HydrophobicContact CD1-CD1 4.06Å; L114-Y178 HydrophobicContact CD1-CE1 3.58Å; L114-Y178 HydrophobicContact CD1-CE2 4.22Å; L114-Y178 HydrophobicContact CD2-CD1 3.75Å; L114-Y178 HydrophobicContact CD2-CD2 3.72Å; L114-Y178 HydrophobicContact CD2-CE1 4.09Å; L114-Y178 HydrophobicContact CD2-CE2 4.07Å; L114-Y178 HydrophobicContact CD2-CG 3.54Å; L114-Y178 HydrophobicContact CG-CD1 4.31Å; L114-Y178 HydrophobicContact CG-CD2 4.16Å; L114-Y178 HydrophobicContact CG-CE1 4.13Å; L114-Y178 HydrophobicContact CG-CE2 3.98Å; L114-Y178 HydrophobicContact CG-CG 4.31Å
115	S	85.4	Confident	86.7	Confident	19 Å²	19	27 Å²	27	13%	0.133	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-42.3	179.5	174.9	0	0	0	0	110.7	K98 D113 A119 L120	K98-S115 PolarHBondContact NZ-OG 3.34Å; D113-S115 VanDerWaalsContact C-N 3.32Å; D113-S115 PolarHBondContact O-N 3.03Å; D113-S115 WeakPolarHBondContact OD1-CA 3.41Å; D113-S115 VanDerWaalsContact OD1-CB 3.31Å; D113-S115 WeakPolarHBondContact OD1-CB 3.33Å; D113-S115 PolarHBondContact OD1-N 2.89Å; S115-A119 CarbonylContact O-C 3.57Å; S115-A119 WeakPolarHBondContact O-CA 3.44Å; S115-A119 PolarHBondContact O-N 2.9Å; S115-L120 WeakPolarHBondContact CB-O 3.43Å; S115-L120 PolarHBondContact O-N 3.23Å; S115-L120 PolarHBondContact OG-O 3.37Å
116	L	87.5	Confident	87.1	Confident	4 Å²	4	25.7 Å²	25.7	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-80.6	-35.5	-178.4	-176.2	61.9	0	0	0	112.4	E107 L112 D113 L114 F118 I760 R778	E107-L116 HydrophobicContact CB-CD1 3.54Å; E107-L116 HydrophobicContact CG-CD1 3.75Å; E107-L116 WeakPolarHBondContact O-CD2 3.39Å; L112-L116 HydrophobicContact CD2-CB 4.41Å; L112-L116 HydrophobicContact CD2-CD2 3.84Å; L112-L116 HydrophobicContact CD2-CG 3.88Å; D113-L116 PolarHBondContact O-N 2.92Å; D113-L116 WeakPolarHBondContact OD1-CB 3.37Å; D113-L116 PolarHBondContact OD1-N 3.12Å; L114-L116 VanDerWaalsContact C-N 3.31Å; L114-L116 PolarHBondContact O-N 3.4Å; L116-F118 VanDerWaalsContact C-N 3.27Å; L116-F118 PolarHBondContact O-N 2.88Å; L116-I760 HydrophobicContact CD1-CD1 4.48Å; L116-R778 VanDerWaalsContact O-CZ 3.32Å; L116-R778 PolarHBondContact O-NH1 3.44Å; L116-R778 PolarHBondContact O-NH2 3.31Å
117	L	90.3	Very high	87.4	Confident	11 Å²	11	21.3 Å²	21.3	6%	0.058	12%	0.119	C	C	.	.	H	α-helix	trans	-58.1	-41.2	176.3	-81.2	166.7	0	0	0	111.4	L112 D113 M193 R778 V791 S793	L112-L117 HydrophobicContact CB-CD2 4.32Å; L112-L117 HydrophobicContact CB-CG 4.28Å; L112-L117 HydrophobicContact CD1-CD2 4.01Å; L112-L117 HydrophobicContact CD2-CD2 3.96Å; L112-L117 HydrophobicContact CD2-CG 4.16Å; L112-L117 HydrophobicContact CG-CD2 4.33Å; D113-L117 WeakPolarHBondContact O-CB 3.47Å; D113-L117 VanDerWaalsContact O-CG 3.22Å; D113-L117 WeakPolarHBondContact O-CG 3.4Å; D113-L117 PolarHBondContact O-N 2.88Å; L117-M193 HydrophobicContact CD1-CE 4.23Å; L117-M193 HydrophobicContact CD1-SD 4.38Å; L117-R778 PolarHBondContact O-NH1 3.27Å; L117-V791 HydrophobicContact CD2-CG1 4.24Å; L117-S793 PolarHBondContact O-OG 3.21Å
118	F	92.1	Very high	87.5	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-115.9	-0.8	-173.2	-63.9	-74.2	0	0	0	114.9	L114 L116 L120 M161 F191 E192 M193 S795	L114-F118 HydrophobicContact CD2-CD2 3.85Å; L114-F118 HydrophobicContact CD2-CE2 3.78Å; L114-F118 PolarHBondContact O-N 2.82Å; L116-F118 VanDerWaalsContact C-N 3.27Å; L116-F118 PolarHBondContact O-N 2.88Å; F118-L120 HydrophobicContact CB-CD1 3.85Å; F118-L120 HydrophobicContact CB-CD2 4.06Å; F118-L120 HydrophobicContact CB-CG 3.68Å; F118-M161 HydrophobicContact CD1-CE 4.37Å; F118-M161 HydrophobicContact CD2-CE 3.44Å; F118-M161 VanDerWaalsContact CD2-CE 3.44Å; F118-M161 HydrophobicContact CE1-CE 4.26Å; F118-M161 HydrophobicContact CE2-CE 3.32Å; F118-M161 HydrophobicContact CG-CE 3.96Å; F118-M161 HydrophobicContact CZ-CE 3.74Å; F118-F191 HydrophobicContact CB-CD1 3.96Å; F118-F191 HydrophobicContact CB-CE1 4.33Å; F118-F191 HydrophobicContact CD1-CB 3.74Å; F118-F191 AromaticContact CD1-CD1 3.7Å; F118-F191 HydrophobicContact CD1-CD1 3.7Å; F118-F191 HydrophobicContact CD1-CG 4.11Å; F118-F191 HydrophobicContact CE1-CB 3.69Å; F118-F191 HydrophobicContact CE1-CD1 4.49Å; F118-F191 HydrophobicContact CG-CB 4.39Å; F118-F191 HydrophobicContact CG-CD1 4.08Å; F118-F191 HydrophobicContact CZ-CB 4.32Å; F118-E192 WeakPolarHBondContact CE1-O 3.49Å; F118-M193 HydrophobicContact CZ-CB 3.97Å; F118-S795 WeakPolarHBondContact CA-OG 3.38Å; F118-S795 PolarHBondContact O-OG 3.36Å
119	A	89.4	Confident	87.2	Confident	3 Å²	3	23.3 Å²	23.3	3%	0.025	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	55.1	-173.1	0	0	0	0	0	112.9	K98 M99 S115 R778	K98-A119 HydrophobicContact CB-CB 4.45Å; K98-A119 WeakPolarHBondContact CB-O 3.4Å; K98-A119 HydrophobicContact CD-CB 4.48Å; K98-A119 HydrophobicContact CG-CB 4.12Å; M99-A119 HydrophobicContact CG-CB 3.94Å; S115-A119 CarbonylContact O-C 3.57Å; S115-A119 WeakPolarHBondContact O-CA 3.44Å; S115-A119 PolarHBondContact O-N 2.9Å; A119-R778 VanDerWaalsContact CB-CD 3.43Å
120	L	88.3	Confident	86.3	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.171	C	C	.	.			trans	-104.8	133.9	179.7	-50.5	178.8	0	0	0	110	V96 S115 F118 Y123 P159 M161 F191	V96-L120 HydrophobicContact CG1-CD2 4.2Å; S115-L120 WeakPolarHBondContact CB-O 3.43Å; S115-L120 PolarHBondContact O-N 3.23Å; S115-L120 PolarHBondContact OG-O 3.37Å; F118-L120 HydrophobicContact CB-CD1 3.85Å; F118-L120 HydrophobicContact CB-CD2 4.06Å; F118-L120 HydrophobicContact CB-CG 3.68Å; L120-Y123 HydrophobicContact CB-CD1 4.03Å; L120-Y123 HydrophobicContact CD1-CD1 4.36Å; L120-Y123 HydrophobicContact CD1-CG 4.24Å; L120-P159 HydrophobicContact CD1-CB 4.07Å; L120-P159 HydrophobicContact CD1-CG 4.47Å; L120-P159 HydrophobicContact CD2-CB 4.27Å; L120-P159 HydrophobicContact CD2-CG 3.9Å; L120-M161 HydrophobicContact CD1-CG 4.02Å; L120-M161 HydrophobicContact CD1-SD 3.83Å; L120-F191 HydrophobicContact CD2-CE1 3.64Å; L120-F191 HydrophobicContact CD2-CE2 4.47Å; L120-F191 HydrophobicContact CD2-CZ 3.63Å
121	N	81.6	Confident	85.4	Confident	58 Å²	58	28.3 Å²	28.3	31%	0.31	17%	0.165	S	C	.	.	S	Bend	trans	-82.3	-39.8	168.5	-70.8	-32.3	0	0	0	110.6	P71 P94 A95 S97 K98	P71-N121 WeakPolarHBondContact CD-O 3.43Å; P71-N121 HydrophobicContact CG-CB 4.04Å; P71-N121 WeakPolarHBondContact CG-O 3.29Å; P94-N121 PolarHBondContact O-ND2 3.42Å; A95-N121 PolarHBondContact O-N 3.07Å; S97-N121 PolarHBondContact OG-ND2 2.92Å; S97-N121 VanDerWaalsContact OG-ND2 3.08Å; K98-N121 WeakPolarHBondContact CB-OD1 3.34Å; K98-N121 WeakPolarHBondContact CD-OD1 3.48Å
122	E	85.5	Confident	84.8	Confident	14 Å²	14	28.7 Å²	28.7	7%	0.065	16%	0.161	C	C	.	.	S	Bend	trans	-140.5	136.8	-170.5	-176.2	-178.3	161	0	0	107.8	Y68 F69 C70 A95 I158 P159	Y68-E122 HydrophobicContact CE2-CG 3.63Å; Y68-E122 VanDerWaalsContact CE2-OE1 3.23Å; Y68-E122 WeakPolarHBondContact CE2-OE1 3.41Å; Y68-E122 VanDerWaalsContact OH-CD 3.28Å; Y68-E122 PolarHBondContact OH-OE1 2.92Å; F69-E122 WeakPolarHBondContact O-CA 3.47Å; F69-E122 WeakPolarHBondContact O-CG 3.33Å; C70-E122 HydrophobicContact CB-CG 4.15Å; A95-E122 HydrophobicContact CB-CB 4.2Å; E122-I158 HydrophobicContact CG-CG1 4.42Å; E122-I158 HydrophobicContact CG-CG2 4.1Å; E122-I158 WeakPolarHBondContact OE1-CD1 3.49Å; E122-I158 WeakPolarHBondContact OE1-CG1 3.17Å; E122-P159 WeakPolarHBondContact O-CD 3.5Å
123	Y	89.7	Confident	84.3	Confident	6 Å²	6	32.3 Å²	32.3	2%	0.024	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	157.5	-177.3	60.8	-88.4	0	0	0	112.2	H46 F69 L114 L120 A125 P159 M161	H46-Y123 PolarHBondContact ND1-OH 2.94Å; F69-Y123 HydrophobicContact CB-CD1 4.45Å; F69-Y123 HydrophobicContact CB-CD2 4.48Å; F69-Y123 HydrophobicContact CB-CE1 4.11Å; F69-Y123 HydrophobicContact CB-CE2 4.13Å; F69-Y123 AromaticContact CD2-CD2 3.97Å; F69-Y123 HydrophobicContact CD2-CD2 3.97Å; F69-Y123 AromaticContact CD2-CE2 3.43Å; F69-Y123 HydrophobicContact CD2-CE2 3.43Å; F69-Y123 VanDerWaalsContact CD2-CE2 3.43Å; F69-Y123 AromaticContact CD2-CZ 3.95Å; F69-Y123 HydrophobicContact CE2-CE2 4.07Å; F69-Y123 AromaticContact CG-CE2 3.96Å; F69-Y123 HydrophobicContact CG-CE2 3.96Å; F69-Y123 AromaticContact CG-CZ 3.99Å; F69-Y123 PolarHBondContact N-O 3.17Å; F69-Y123 PolarHBondContact O-N 3.34Å; L114-Y123 HydrophobicContact CB-CE1 4.43Å; L114-Y123 HydrophobicContact CB-CE2 4.01Å; L114-Y123 HydrophobicContact CD1-CD2 4.31Å; L114-Y123 HydrophobicContact CD1-CE2 3.68Å; L120-Y123 HydrophobicContact CB-CD1 4.03Å; L120-Y123 HydrophobicContact CD1-CD1 4.36Å; L120-Y123 HydrophobicContact CD1-CG 4.24Å; Y123-A125 HydrophobicContact CD2-CB 4.42Å; Y123-A125 HydrophobicContact CE2-CB 4.35Å; Y123-P159 WeakPolarHBondContact CA-O 3.25Å; Y123-M161 HydrophobicContact CD2-CG 4.47Å
124	L	92.2	Very high	83.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.4	168.6	174.5	58.2	0	0	0	109	F29 W32 A66 S67 V126 F147 P159 V160 M161	F29-L124 HydrophobicContact CE1-CD2 3.5Å; F29-L124 HydrophobicContact CZ-CD2 3.97Å; W32-L124 HydrophobicContact CH2-CD1 3.98Å; W32-L124 HydrophobicContact CZ3-CD1 3.54Å; W32-L124 HydrophobicContact CZ3-CD2 4.24Å; A66-L124 HydrophobicContact CB-CD1 4.07Å; S67-L124 WeakPolarHBondContact O-CD1 3.39Å; L124-V126 HydrophobicContact CD2-CG2 4.43Å; L124-V126 HydrophobicContact CG-CG2 4.22Å; L124-F147 HydrophobicContact CD2-CE1 4.2Å; L124-P159 PolarHBondContact N-O 3.46Å; L124-V160 HydrophobicContact CB-CG2 4.48Å; L124-V160 HydrophobicContact CD2-CG1 4.15Å; L124-V160 HydrophobicContact CD2-CG2 4.22Å; L124-V160 HydrophobicContact CG-CG1 4.4Å; L124-M161 PolarHBondContact O-N 2.82Å
125	A	92.1	Very high	83.3	Confident	5 Å²	5	40 Å²	40	4%	0.041	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126.4	170.4	0	0	0	0	0	110.2	A66 S67 F69 L114 Y123 M161	A66-A125 WeakPolarHBondContact CA-O 3.44Å; S67-A125 PolarHBondContact N-O 2.68Å; S67-A125 PolarHBondContact O-N 3.05Å; F69-A125 HydrophobicContact CD2-CB 4.49Å; F69-A125 HydrophobicContact CE2-CB 3.99Å; L114-A125 HydrophobicContact CD1-CB 4.35Å; Y123-A125 HydrophobicContact CD2-CB 4.42Å; Y123-A125 HydrophobicContact CE2-CB 4.35Å; A125-M161 CarbonylContact C-O 3.52Å; A125-M161 WeakPolarHBondContact CA-O 3.46Å
126	V	92.8	Very high	82.9	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.018	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	110.1	175.4	-176.9	0	0	0	0	108	F64 N65 L124 F147 V160 M161 F162 A163	F64-V126 HydrophobicContact CB-CG1 4.21Å; N65-V126 CarbonylContact O-C 3.56Å; N65-V126 WeakPolarHBondContact O-CA 3.47Å; L124-V126 HydrophobicContact CD2-CG2 4.43Å; L124-V126 HydrophobicContact CG-CG2 4.22Å; V126-F147 HydrophobicContact CG1-CE2 4.15Å; V126-F147 HydrophobicContact CG1-CZ 4.02Å; V126-F147 HydrophobicContact CG2-CD1 4.4Å; V126-F147 HydrophobicContact CG2-CE1 3.73Å; V126-F147 HydrophobicContact CG2-CE2 4.32Å; V126-F147 HydrophobicContact CG2-CZ 3.68Å; V126-V160 HydrophobicContact CG2-CG1 3.88Å; V126-M161 PolarHBondContact N-O 3Å; V126-F162 HydrophobicContact CB-CD1 3.73Å; V126-F162 HydrophobicContact CB-CE1 3.98Å; V126-F162 HydrophobicContact CG1-CD1 3.92Å; V126-F162 HydrophobicContact CG1-CE1 4.06Å; V126-F162 HydrophobicContact CG2-CD1 4.22Å; V126-F162 HydrophobicContact CG2-CE1 3.99Å; V126-A163 PolarHBondContact O-N 3.04Å
127	T	89.4	Confident	82.5	Confident	29 Å²	29	44.3 Å²	44.3	18%	0.178	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.4	-177.6	47.2	0	0	0	0	110.2	F64 N65 A163	F64-T127 CarbonylContact C-O 3.56Å; F64-T127 WeakPolarHBondContact CA-O 3.29Å; N65-T127 WeakPolarHBondContact CB-OG1 3.38Å; N65-T127 PolarHBondContact N-O 2.94Å; N65-T127 PolarHBondContact O-N 2.88Å; N65-T127 PolarHBondContact O-OG1 3.42Å; T127-A163 HydrophobicContact CG2-CB 3.63Å
128	P	86.7	Confident	82	Confident	30 Å²	30	50.3 Å²	50.3	20%	0.195	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	141.8	172.3	26.3	-30.5	0	0	0	111	F64 C131 F136 A163 P165	F64-P128 HydrophobicContact CD1-CB 4.01Å; F64-P128 HydrophobicContact CE1-CB 3.96Å; P128-C131 HydrophobicContact CB-CB 3.76Å; P128-F136 HydrophobicContact CB-CD2 4.24Å; P128-F136 HydrophobicContact CB-CE2 4.12Å; P128-F136 HydrophobicContact CG-CE2 4.24Å; P128-A163 VanDerWaalsContact CD-O 3.24Å; P128-A163 WeakPolarHBondContact CD-O 3.45Å; P128-P165 HydrophobicContact CG-CG 4.01Å
129	V	83.1	Confident	81.7	Confident	37 Å²	37	52.4 Å²	52.4	22%	0.224	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121.2	173.6	-174.8	0	0	0	0	107.9	L63 N65 C131	L63-V129 HydrophobicContact CB-CB 4.09Å; L63-V129 HydrophobicContact CD2-CB 4.01Å; L63-V129 HydrophobicContact CD2-CG1 3.99Å; L63-V129 HydrophobicContact CD2-CG2 4.3Å; L63-V129 HydrophobicContact CG-CB 4.16Å; L63-V129 HydrophobicContact CG-CG2 4.31Å; L63-V129 PolarHBondContact O-N 2.94Å; N65-V129 HydrophobicContact CB-CG2 4Å; N65-V129 WeakPolarHBondContact ND2-CG2 3.47Å; N65-V129 WeakPolarHBondContact OD1-CG2 3.27Å; V129-C131 VanDerWaalsContact C-N 3.28Å; V129-C131 PolarHBondContact O-N 3.15Å; V129-C131 VanDerWaalsContact O-N 3.15Å
130	D	69	Low	81.4	Confident	163 Å²	163	54.6 Å²	54.6	87%	0.872	28%	0.275	S	S	*	.	S	Bend	trans	47	45	175.3	-64.7	-27.6	0	0	0	114.6
131	C	65.1	Low	81.4	Confident	27 Å²	27	60.5 Å²	60.5	18%	0.182	30%	0.303	C	S	.	.			trans	-90.9	132.6	-173.5	-167.6	0	0	0	0	112.8	P128 V129 E133 F136	P128-C131 HydrophobicContact CB-CB 3.76Å; V129-C131 VanDerWaalsContact C-N 3.28Å; V129-C131 PolarHBondContact O-N 3.15Å; V129-C131 VanDerWaalsContact O-N 3.15Å; C131-E133 PolarHBondContact O-N 2.94Å; C131-F136 WeakPolarHBondContact SG-CB 3.3Å
132	N	69.5	Low	81.8	Confident	111 Å²	111	58.9 Å²	58.9	59%	0.594	30%	0.297	S	S	*	.			trans	-67.1	120.5	166.4	-72.5	-25.4	0	0	0	109.5	E134 D135 F136	N132-E134 VanDerWaalsContact C-N 3.26Å; N132-E134 PolarHBondContact O-N 3.43Å; N132-E134 VanDerWaalsContact O-N 3.16Å; N132-D135 HydrophobicContact CB-CB 4.24Å; N132-D135 PolarHBondContact O-N 3.2Å; N132-F136 PolarHBondContact O-N 3.31Å
133	E	71.8	Confident	82	Confident	108 Å²	108	58.4 Å²	58.4	51%	0.505	30%	0.295	S	S	.	.	H	α-helix	trans	-51.9	-41	-177.6	-70.6	177.8	-171.3	0	0	113.6	C131 D135 F136 E137 G167	C131-E133 PolarHBondContact O-N 2.94Å; E133-D135 VanDerWaalsContact C-N 3.31Å; E133-D135 PolarHBondContact O-N 3.29Å; E133-F136 PolarHBondContact O-N 3.46Å; E133-E137 WeakPolarHBondContact O-CB 3.35Å; E133-E137 WeakPolarHBondContact O-CG 3.48Å; E133-E137 PolarHBondContact O-N 3.47Å; E133-G167 WeakPolarHBondContact OE1-CA 2.71Å; E133-G167 PolarHBondContact OE1-N 3.37Å
134	E	74.5	Confident	82.1	Confident	153 Å²	153	59.5 Å²	59.5	72%	0.715	30%	0.301	S	S	*	.	H	α-helix	trans	-64.9	-33.6	179	-68.7	-170.3	178.4	0	0	113.4	N132 K138	N132-E134 VanDerWaalsContact C-N 3.26Å; N132-E134 PolarHBondContact O-N 3.43Å; N132-E134 VanDerWaalsContact O-N 3.16Å; E134-K138 WeakPolarHBondContact O-CD 3.15Å; E134-K138 WeakPolarHBondContact O-CE 3.29Å; E134-K138 WeakPolarHBondContact O-CG 3.15Å
135	D	73.5	Confident	82.1	Confident	59 Å²	59	61.4 Å²	61.4	32%	0.316	32%	0.315	S	S	.	.	H	α-helix	trans	-82.4	-37.8	-179.8	-67.2	-30.2	0	0	0	110.6	N132 E133 E137 K138 E139	N132-D135 HydrophobicContact CB-CB 4.24Å; N132-D135 PolarHBondContact O-N 3.2Å; E133-D135 VanDerWaalsContact C-N 3.31Å; E133-D135 PolarHBondContact O-N 3.29Å; D135-E137 PolarHBondContact O-N 3.06Å; D135-K138 PolarHBondContact O-N 3.04Å; D135-K138 IonicContact OD1-NZ 2.75Å; D135-K138 PolarHBondContact OD1-NZ 2.93Å; D135-K138 VanDerWaalsContact OD1-NZ 3.09Å; D135-E139 PolarHBondContact O-N 3.37Å
136	F	76.2	Confident	82.3	Confident	14 Å²	14	61.2 Å²	61.2	6%	0.061	31%	0.313	C	S	.	.	H	α-helix	trans	-56.6	-48.9	171	-169.6	-104.3	0	0	0	111.7	F64 P128 C131 N132 E133 K138 E139 K140 Y164	F64-F136 AromaticContact CE1-CD2 3.9Å; F64-F136 HydrophobicContact CE1-CD2 3.9Å; F64-F136 AromaticContact CE1-CE2 3.66Å; F64-F136 HydrophobicContact CE1-CE2 3.66Å; F64-F136 HydrophobicContact CZ-CD2 4.42Å; F64-F136 HydrophobicContact CZ-CE2 4.45Å; P128-F136 HydrophobicContact CB-CD2 4.24Å; P128-F136 HydrophobicContact CB-CE2 4.12Å; P128-F136 HydrophobicContact CG-CE2 4.24Å; C131-F136 WeakPolarHBondContact SG-CB 3.3Å; N132-F136 PolarHBondContact O-N 3.31Å; E133-F136 PolarHBondContact O-N 3.46Å; F136-K138 VanDerWaalsContact C-N 3.27Å; F136-K138 PolarHBondContact O-N 3.3Å; F136-E139 PolarHBondContact O-N 2.72Å; F136-E139 VanDerWaalsContact O-N 3.13Å; F136-K140 HydrophobicContact CE1-CB 4.24Å; F136-K140 WeakPolarHBondContact O-CB 2.93Å; F136-K140 PolarHBondContact O-N 3.37Å; F136-Y164 HydrophobicContact CD1-CD1 4.45Å; F136-Y164 AromaticContact CE1-CD1 3.43Å; F136-Y164 HydrophobicContact CE1-CD1 3.43Å; F136-Y164 VanDerWaalsContact CE1-CD1 3.43Å; F136-Y164 AromaticContact CE1-CE1 3.53Å; F136-Y164 HydrophobicContact CE1-CE1 3.53Å; F136-Y164 HydrophobicContact CE1-CG 4.36Å; F136-Y164 HydrophobicContact CZ-CD1 4.1Å; F136-Y164 AromaticContact CZ-CE1 3.97Å; F136-Y164 HydrophobicContact CZ-CE1 3.97Å
137	E	79.1	Confident	82.4	Confident	99 Å²	99	61.1 Å²	61.1	46%	0.463	31%	0.312	S	S	.	.	H	α-helix	trans	-61.2	-34	-177.8	-87.6	-66.2	140.4	0	0	113.2	E133 D135 K140	E133-E137 WeakPolarHBondContact O-CB 3.35Å; E133-E137 WeakPolarHBondContact O-CG 3.48Å; E133-E137 PolarHBondContact O-N 3.47Å; D135-E137 PolarHBondContact O-N 3.06Å; E137-K140 IonicContact OE1-NZ 2.84Å; E137-K140 PolarHBondContact OE1-NZ 2.7Å; E137-K140 WeakPolarHBondContact OE2-CE 3.33Å; E137-K140 IonicContact OE2-NZ 2.82Å; E137-K140 PolarHBondContact OE2-NZ 2.56Å
138	K	80.8	Confident	82.6	Confident	137 Å²	137	62 Å²	62	60%	0.596	32%	0.316	S	S	*	.	H	α-helix	trans	-69.4	-37.5	176.1	-69.9	167.5	-160.4	150.5	0	112.4	E134 D135 F136	E134-K138 WeakPolarHBondContact O-CD 3.15Å; E134-K138 WeakPolarHBondContact O-CE 3.29Å; E134-K138 WeakPolarHBondContact O-CG 3.15Å; D135-K138 PolarHBondContact O-N 3.04Å; D135-K138 IonicContact OD1-NZ 2.75Å; D135-K138 PolarHBondContact OD1-NZ 2.93Å; D135-K138 VanDerWaalsContact OD1-NZ 3.09Å; F136-K138 VanDerWaalsContact C-N 3.27Å; F136-K138 PolarHBondContact O-N 3.3Å
139	E	84.3	Confident	82.9	Confident	44 Å²	44	62.9 Å²	62.9	21%	0.206	32%	0.32	C	S	.	.	H	α-helix	trans	-101.9	-8.5	-171.3	-62.9	-69.1	166.6	0	0	113.4	Y59 K60 D135 F136 Q141 A142 I143	Y59-E139 HydrophobicContact CD1-CB 4.49Å; Y59-E139 HydrophobicContact CE1-CB 4.11Å; Y59-E139 HydrophobicContact CE1-CG 4.31Å; Y59-E139 WeakPolarHBondContact CE1-OE2 2.9Å; Y59-E139 PolarHBondContact OH-OE2 2.97Å; Y59-E139 VanDerWaalsContact OH-OE2 3.14Å; K60-E139 IonicContact NZ-OE1 2.86Å; K60-E139 PolarHBondContact NZ-OE1 2.78Å; K60-E139 IonicContact NZ-OE2 3.98Å; K60-E139 PolarHBondContact NZ-OE2 2.83Å; D135-E139 PolarHBondContact O-N 3.37Å; F136-E139 PolarHBondContact O-N 2.72Å; F136-E139 VanDerWaalsContact O-N 3.13Å; E139-Q141 VanDerWaalsContact C-N 3.29Å; E139-Q141 PolarHBondContact O-N 2.97Å; E139-Q141 VanDerWaalsContact O-N 3.16Å; E139-A142 WeakPolarHBondContact O-CA 3.14Å; E139-A142 WeakPolarHBondContact O-CB 3.48Å; E139-A142 PolarHBondContact O-N 3.03Å; E139-I143 HydrophobicContact CB-CD1 4.23Å; E139-I143 WeakPolarHBondContact O-CG1 3.24Å; E139-I143 PolarHBondContact O-N 2.83Å
140	K	84.1	Confident	83.5	Confident	49 Å²	49	61.1 Å²	61.1	21%	0.213	31%	0.31	C	S	.	.	H	α-helix	trans	-51.4	-44.2	-175.6	73.8	-176	179.8	-174.5	0	113.6	F136 E137 A142 I143 I144 Y164	F136-K140 HydrophobicContact CE1-CB 4.24Å; F136-K140 WeakPolarHBondContact O-CB 2.93Å; F136-K140 PolarHBondContact O-N 3.37Å; E137-K140 IonicContact OE1-NZ 2.84Å; E137-K140 PolarHBondContact OE1-NZ 2.7Å; E137-K140 WeakPolarHBondContact OE2-CE 3.33Å; E137-K140 IonicContact OE2-NZ 2.82Å; E137-K140 PolarHBondContact OE2-NZ 2.56Å; K140-A142 VanDerWaalsContact C-N 3.32Å; K140-A142 PolarHBondContact O-N 2.74Å; K140-I143 PolarHBondContact O-N 3.21Å; K140-I144 VanDerWaalsContact O-CG1 3.27Å; K140-I144 WeakPolarHBondContact O-CG1 3.32Å; K140-I144 PolarHBondContact O-N 3.09Å; K140-Y164 HydrophobicContact CB-CE1 4.3Å; K140-Y164 HydrophobicContact CD-CE1 4.07Å
141	Q	88.3	Confident	84.6	Confident	125 Å²	125	53.6 Å²	53.6	58%	0.584	27%	0.27	S	S	*	.	H	α-helix	trans	-68.7	-33.1	-179.2	-67.3	-60.9	-22.7	0	0	111.9	E139 S145	E139-Q141 VanDerWaalsContact C-N 3.29Å; E139-Q141 PolarHBondContact O-N 2.97Å; E139-Q141 VanDerWaalsContact O-N 3.16Å; Q141-S145 VanDerWaalsContact O-CB 3.26Å; Q141-S145 WeakPolarHBondContact O-CB 3.29Å; Q141-S145 PolarHBondContact O-N 2.93Å; Q141-S145 PolarHBondContact O-OG 3.1Å
142	A	89.3	Confident	85.8	Confident	23 Å²	23	55.5 Å²	55.5	19%	0.19	28%	0.28	C	S	.	.	H	α-helix	trans	-71.6	-35.2	175.6	0	0	0	0	0	111.8	W18 Y59 E139 K140 S145 A146	W18-A142 PolarHBondContact NE1-O 3.18Å; Y59-A142 HydrophobicContact CE1-CB 4.15Å; E139-A142 WeakPolarHBondContact O-CA 3.14Å; E139-A142 WeakPolarHBondContact O-CB 3.48Å; E139-A142 PolarHBondContact O-N 3.03Å; K140-A142 VanDerWaalsContact C-N 3.32Å; K140-A142 PolarHBondContact O-N 2.74Å; A142-S145 WeakPolarHBondContact CA-OG 3.31Å; A142-S145 PolarHBondContact O-OG 3.27Å; A142-A146 WeakPolarHBondContact O-CB 3.39Å; A142-A146 PolarHBondContact O-N 2.89Å
143	I	89.9	Confident	86.8	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-69.1	-51.8	176.8	-65.1	158.2	0	0	0	110.2	F21 Y59 F64 E139 K140 S145 A146 F147 F162	F21-I143 HydrophobicContact CE1-CG1 4.45Å; F21-I143 HydrophobicContact CE1-CG2 4.22Å; F21-I143 HydrophobicContact CZ-CG2 4.46Å; Y59-I143 HydrophobicContact CD1-CD1 4.33Å; Y59-I143 HydrophobicContact CD1-CG1 3.76Å; Y59-I143 HydrophobicContact CE1-CG1 4.25Å; F64-I143 HydrophobicContact CE1-CD1 3.92Å; F64-I143 HydrophobicContact CE2-CD1 3.84Å; F64-I143 HydrophobicContact CE2-CG1 4.42Å; F64-I143 HydrophobicContact CZ-CD1 3.29Å; F64-I143 HydrophobicContact CZ-CG1 4.31Å; E139-I143 HydrophobicContact CB-CD1 4.23Å; E139-I143 WeakPolarHBondContact O-CG1 3.24Å; E139-I143 PolarHBondContact O-N 2.83Å; K140-I143 PolarHBondContact O-N 3.21Å; I143-S145 VanDerWaalsContact C-N 3.27Å; I143-S145 PolarHBondContact O-N 3.45Å; I143-A146 WeakPolarHBondContact O-CB 3.4Å; I143-A146 PolarHBondContact O-N 3.42Å; I143-A146 VanDerWaalsContact O-N 3.13Å; I143-F147 HydrophobicContact CG2-CD2 4.07Å; I143-F147 HydrophobicContact CG2-CE2 4.07Å; I143-F147 WeakPolarHBondContact O-CD2 3.33Å; I143-F147 PolarHBondContact O-N 3.34Å; I143-F147 VanDerWaalsContact O-N 3.09Å; I143-F162 HydrophobicContact CG2-CE1 4.2Å
144	I	91.9	Very high	87.6	Confident	29 Å²	29	50.5 Å²	50.5	15%	0.149	26%	0.258	C	S	.	.	H	α-helix	trans	-57.4	-43.9	177.9	-62.4	164.1	0	0	0	110.4	K140 A146 F147 L148 F162 Y164 F181	K140-I144 VanDerWaalsContact O-CG1 3.27Å; K140-I144 WeakPolarHBondContact O-CG1 3.32Å; K140-I144 PolarHBondContact O-N 3.09Å; I144-A146 VanDerWaalsContact C-N 3.34Å; I144-A146 PolarHBondContact O-N 2.65Å; I144-F147 PolarHBondContact O-N 3.45Å; I144-L148 WeakPolarHBondContact O-CB 3.4Å; I144-L148 PolarHBondContact O-N 2.69Å; I144-F162 HydrophobicContact CG1-CD1 4.47Å; I144-F162 HydrophobicContact CG1-CD2 4.18Å; I144-F162 HydrophobicContact CG1-CE2 4.27Å; I144-F162 HydrophobicContact CG1-CG 4.3Å; I144-F162 HydrophobicContact CG1-CZ 4.45Å; I144-F162 HydrophobicContact CG2-CE2 4.32Å; I144-Y164 WeakPolarHBondContact CD1-OH 3.35Å; I144-F181 HydrophobicContact CG2-CD1 4.28Å; I144-F181 HydrophobicContact CG2-CE1 4.21Å
145	S	93.3	Very high	88.2	Confident	41 Å²	41	45.9 Å²	45.9	29%	0.287	24%	0.238	S	C	.	.	H	α-helix	trans	-64.9	-37	179.1	71.8	0	0	0	0	112.5	W18 Q141 A142 I143 L148 V149	W18-S145 WeakPolarHBondContact CZ2-OG 3.39Å; W18-S145 PolarHBondContact NE1-OG 2.81Å; Q141-S145 VanDerWaalsContact O-CB 3.26Å; Q141-S145 WeakPolarHBondContact O-CB 3.29Å; Q141-S145 PolarHBondContact O-N 2.93Å; Q141-S145 PolarHBondContact O-OG 3.1Å; A142-S145 WeakPolarHBondContact CA-OG 3.31Å; A142-S145 PolarHBondContact O-OG 3.27Å; I143-S145 VanDerWaalsContact C-N 3.27Å; I143-S145 PolarHBondContact O-N 3.45Å; S145-L148 PolarHBondContact O-N 3.26Å; S145-V149 VanDerWaalsContact O-CG2 3.28Å; S145-V149 WeakPolarHBondContact O-CG2 3.48Å; S145-V149 PolarHBondContact O-N 3.47Å
146	A	94.7	Very high	89	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-46.8	175.7	0	0	0	0	0	111.7	F21 I22 I25 A142 I143 I144 L148 V149 A150	F21-A146 HydrophobicContact CD1-CB 3.51Å; F21-A146 HydrophobicContact CE1-CB 3.85Å; I22-A146 HydrophobicContact CG1-CB 3.72Å; I25-A146 HydrophobicContact CD1-CB 4.04Å; A142-A146 WeakPolarHBondContact O-CB 3.39Å; A142-A146 PolarHBondContact O-N 2.89Å; I143-A146 WeakPolarHBondContact O-CB 3.4Å; I143-A146 PolarHBondContact O-N 3.42Å; I143-A146 VanDerWaalsContact O-N 3.13Å; I144-A146 VanDerWaalsContact C-N 3.34Å; I144-A146 PolarHBondContact O-N 2.65Å; A146-L148 VanDerWaalsContact C-N 3.35Å; A146-L148 PolarHBondContact O-N 3.37Å; A146-V149 PolarHBondContact O-N 2.78Å; A146-A150 WeakPolarHBondContact O-CB 3.28Å; A146-A150 PolarHBondContact O-N 3.25Å
147	F	95.1	Very high	89.5	Confident	1 Å²	1	44.3 Å²	44.3	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-62.4	-41.7	175.2	-86.9	-91.3	0	0	0	111.9	F21 I25 F29 L57 L124 V126 I143 I144 V149 A150 S151 V160 F162 F181	F21-F147 HydrophobicContact CE1-CD2 4.49Å; F21-F147 HydrophobicContact CE1-CE2 4.27Å; F21-F147 HydrophobicContact CZ-CE2 4.04Å; I25-F147 HydrophobicContact CD1-CD1 4.3Å; I25-F147 HydrophobicContact CD1-CD2 3.67Å; I25-F147 HydrophobicContact CD1-CE1 4.35Å; I25-F147 HydrophobicContact CD1-CE2 3.74Å; I25-F147 HydrophobicContact CD1-CG 3.97Å; I25-F147 HydrophobicContact CD1-CZ 4.09Å; I25-F147 HydrophobicContact CG1-CE1 4.3Å; I25-F147 HydrophobicContact CG1-CE2 4.28Å; I25-F147 HydrophobicContact CG1-CZ 4.14Å; I25-F147 HydrophobicContact CG2-CD1 3.85Å; I25-F147 HydrophobicContact CG2-CE1 3.92Å; I25-F147 HydrophobicContact CG2-CG 4.45Å; F29-F147 HydrophobicContact CE1-CE1 4.48Å; F29-F147 AromaticContact CZ-CD1 3.86Å; F29-F147 HydrophobicContact CZ-CD1 3.86Å; F29-F147 HydrophobicContact CZ-CE1 4.2Å; L57-F147 HydrophobicContact CD1-CE1 4.42Å; L57-F147 HydrophobicContact CD1-CZ 3.75Å; L124-F147 HydrophobicContact CD2-CE1 4.2Å; V126-F147 HydrophobicContact CG1-CE2 4.15Å; V126-F147 HydrophobicContact CG1-CZ 4.02Å; V126-F147 HydrophobicContact CG2-CD1 4.4Å; V126-F147 HydrophobicContact CG2-CE1 3.73Å; V126-F147 HydrophobicContact CG2-CE2 4.32Å; V126-F147 HydrophobicContact CG2-CZ 3.68Å; I143-F147 HydrophobicContact CG2-CD2 4.07Å; I143-F147 HydrophobicContact CG2-CE2 4.07Å; I143-F147 WeakPolarHBondContact O-CD2 3.33Å; I143-F147 PolarHBondContact O-N 3.34Å; I143-F147 VanDerWaalsContact O-N 3.09Å; I144-F147 PolarHBondContact O-N 3.45Å; F147-V149 PolarHBondContact O-N 3.07Å; F147-A150 PolarHBondContact O-N 3.28Å; F147-S151 VanDerWaalsContact O-CB 3.29Å; F147-S151 WeakPolarHBondContact O-CB 3.4Å; F147-S151 PolarHBondContact O-N 3.47Å; F147-S151 PolarHBondContact O-OG 3.46Å; F147-V160 HydrophobicContact CD1-CG1 3.86Å; F147-V160 HydrophobicContact CE1-CG1 4.39Å; F147-V160 HydrophobicContact CG-CG1 4.38Å; F147-F162 HydrophobicContact CB-CE1 4.28Å; F147-F162 HydrophobicContact CB-CZ 3.61Å; F147-F162 HydrophobicContact CD1-CZ 4.29Å; F147-F162 AromaticContact CD2-CE1 3.56Å; F147-F162 HydrophobicContact CD2-CE1 3.56Å; F147-F162 AromaticContact CD2-CZ 3.81Å; F147-F162 HydrophobicContact CD2-CZ 3.81Å; F147-F162 AromaticContact CE2-CE1 3.96Å; F147-F162 HydrophobicContact CE2-CE1 3.96Å; F147-F162 AromaticContact CG-CE1 3.88Å; F147-F162 HydrophobicContact CG-CE1 3.88Å; F147-F162 AromaticContact CG-CZ 3.65Å; F147-F162 HydrophobicContact CG-CZ 3.65Å; F147-F181 HydrophobicContact CB-CE1 4.28Å; F147-F181 HydrophobicContact CB-CZ 4.05Å
148	L	93.8	Very high	90	Very high	48 Å²	48	40.2 Å²	40.2	25%	0.251	21%	0.21	S	C	.	.	H	α-helix	trans	-62.5	-42.7	178.5	179.6	64.1	0	0	0	112.2	I144 S145 A146 T152 F181 Y188	I144-L148 WeakPolarHBondContact O-CB 3.4Å; I144-L148 PolarHBondContact O-N 2.69Å; S145-L148 PolarHBondContact O-N 3.26Å; A146-L148 VanDerWaalsContact C-N 3.35Å; A146-L148 PolarHBondContact O-N 3.37Å; L148-T152 WeakPolarHBondContact O-CB 3.45Å; L148-T152 PolarHBondContact O-N 2.94Å; L148-T152 PolarHBondContact O-OG1 3.46Å; L148-F181 HydrophobicContact CB-CE1 4.03Å; L148-F181 HydrophobicContact CB-CE2 4.18Å; L148-F181 HydrophobicContact CB-CZ 3.78Å; L148-F181 HydrophobicContact CD1-CD2 3.63Å; L148-F181 HydrophobicContact CD1-CE2 3.58Å; L148-F181 HydrophobicContact CD1-CG 4.18Å; L148-F181 HydrophobicContact CD1-CZ 4.06Å; L148-Y188 HydrophobicContact CD1-CE2 3.9Å
149	V	94.3	Very high	90.6	Very high	49 Å²	49	33.7 Å²	33.7	30%	0.297	18%	0.182	S	C	.	.	H	α-helix	trans	-65.8	-49.1	176.1	172.6	0	0	0	0	110.4	W18 I22 S145 A146 F147 S151 T152 N153	W18-V149 HydrophobicContact CH2-CG2 4.09Å; W18-V149 HydrophobicContact CZ2-CG2 4.31Å; I22-V149 HydrophobicContact CD1-CB 4.2Å; I22-V149 HydrophobicContact CD1-CG1 4.01Å; I22-V149 HydrophobicContact CG2-CG1 4.13Å; S145-V149 VanDerWaalsContact O-CG2 3.28Å; S145-V149 WeakPolarHBondContact O-CG2 3.48Å; S145-V149 PolarHBondContact O-N 3.47Å; A146-V149 PolarHBondContact O-N 2.78Å; F147-V149 PolarHBondContact O-N 3.07Å; V149-S151 VanDerWaalsContact C-N 3.32Å; V149-S151 PolarHBondContact O-N 2.9Å; V149-T152 PolarHBondContact O-N 3.46Å; V149-T152 VanDerWaalsContact O-N 3.11Å; V149-N153 WeakPolarHBondContact O-CB 3.26Å; V149-N153 VanDerWaalsContact O-CG 3.23Å; V149-N153 PolarHBondContact O-N 2.82Å; V149-N153 PolarHBondContact O-OD1 3Å
150	A	94	Very high	91.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.8	-45.5	177.3	0	0	0	0	0	111.5	I22 I25 E26 F29 A146 F147 T152 N153 V154	I22-A150 HydrophobicContact CG2-CB 4.18Å; I25-A150 HydrophobicContact CB-CB 3.84Å; I25-A150 HydrophobicContact CG2-CB 3.51Å; E26-A150 HydrophobicContact CG-CB 3.75Å; F29-A150 HydrophobicContact CD2-CB 4.46Å; F29-A150 HydrophobicContact CE2-CB 4.23Å; A146-A150 WeakPolarHBondContact O-CB 3.28Å; A146-A150 PolarHBondContact O-N 3.25Å; F147-A150 PolarHBondContact O-N 3.28Å; A150-T152 VanDerWaalsContact C-N 3.29Å; A150-T152 PolarHBondContact O-N 3.48Å; A150-N153 PolarHBondContact O-N 3.45Å; A150-V154 WeakPolarHBondContact O-CG2 3.33Å; A150-V154 PolarHBondContact O-N 3.28Å; A150-V154 VanDerWaalsContact O-N 3.09Å
151	S	92.4	Very high	91.6	Very high	5 Å²	5	29.3 Å²	29.3	4%	0.035	16%	0.162	C	C	.	.	H	α-helix	trans	-60.1	-39.9	176.7	-69.5	0	0	0	0	112.1	F29 F147 V149 D155 W156	F29-S151 WeakPolarHBondContact CE2-OG 3.41Å; F147-S151 VanDerWaalsContact O-CB 3.29Å; F147-S151 WeakPolarHBondContact O-CB 3.4Å; F147-S151 PolarHBondContact O-N 3.47Å; F147-S151 PolarHBondContact O-OG 3.46Å; V149-S151 VanDerWaalsContact C-N 3.32Å; V149-S151 PolarHBondContact O-N 2.9Å; S151-D155 WeakPolarHBondContact O-CA 3.45Å; S151-D155 PolarHBondContact O-N 3.41Å; S151-D155 VanDerWaalsContact O-N 3.07Å; S151-W156 PolarHBondContact O-N 3.11Å
152	T	89.9	Confident	91.8	Very high	66 Å²	66	23.7 Å²	23.7	41%	0.405	14%	0.135	S	C	.	.	H	α-helix	trans	-68.2	-41.7	176.9	-54.9	0	0	0	0	111.3	L148 V149 A150 V154 D155	L148-T152 WeakPolarHBondContact O-CB 3.45Å; L148-T152 PolarHBondContact O-N 2.94Å; L148-T152 PolarHBondContact O-OG1 3.46Å; V149-T152 PolarHBondContact O-N 3.46Å; V149-T152 VanDerWaalsContact O-N 3.11Å; A150-T152 VanDerWaalsContact C-N 3.29Å; A150-T152 PolarHBondContact O-N 3.48Å; T152-V154 VanDerWaalsContact C-N 3.35Å; T152-V154 PolarHBondContact O-N 3.16Å; T152-D155 PolarHBondContact O-N 3.44Å
153	N	91.5	Very high	91.8	Very high	96 Å²	96	22.8 Å²	22.8	51%	0.513	13%	0.128	S	C	.	.	H	α-helix	trans	-68.4	-31	-176.6	-70.6	-10.6	0	0	0	113.6	E26 V149 A150	E26-N153 VanDerWaalsContact OE1-CB 3.26Å; E26-N153 WeakPolarHBondContact OE1-CB 3.34Å; E26-N153 PolarHBondContact OE1-ND2 3.22Å; V149-N153 WeakPolarHBondContact O-CB 3.26Å; V149-N153 VanDerWaalsContact O-CG 3.23Å; V149-N153 PolarHBondContact O-N 2.82Å; V149-N153 PolarHBondContact O-OD1 3Å; A150-N153 PolarHBondContact O-N 3.45Å
154	V	89.7	Confident	91.5	Very high	19 Å²	19	24 Å²	24	12%	0.115	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	10.1	-179.9	-60.9	0	0	0	0	113.8	E26 F29 R30 R33 A150 T152 W156	E26-V154 HydrophobicContact CB-CG1 3.9Å; E26-V154 HydrophobicContact CG-CG1 3.94Å; F29-V154 HydrophobicContact CB-CG2 3.71Å; F29-V154 HydrophobicContact CD2-CG2 3.6Å; F29-V154 HydrophobicContact CG-CG2 4.16Å; R30-V154 HydrophobicContact CG-CG1 4.05Å; R33-V154 PolarHBondContact NH1-O 2.91Å; A150-V154 WeakPolarHBondContact O-CG2 3.33Å; A150-V154 PolarHBondContact O-N 3.28Å; A150-V154 VanDerWaalsContact O-N 3.09Å; T152-V154 VanDerWaalsContact C-N 3.35Å; T152-V154 PolarHBondContact O-N 3.16Å; V154-W156 HydrophobicContact CG2-CB 4.06Å; V154-W156 PolarHBondContact O-N 2.68Å
155	D	86.3	Confident	90.6	Very high	56 Å²	56	25.4 Å²	25.4	30%	0.299	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	53.9	-177.7	172.8	49.9	0	0	0	111.9	R33 S151 T152 Q157	R33-D155 IonicContact CZ-OD2 3.56Å; R33-D155 PolarHBondContact NH1-O 3.36Å; R33-D155 IonicContact NH1-OD2 3.6Å; R33-D155 PolarHBondContact NH1-OD2 3.3Å; R33-D155 IonicContact NH2-OD2 3.64Å; R33-D155 PolarHBondContact NH2-OD2 3.47Å; S151-D155 WeakPolarHBondContact O-CA 3.45Å; S151-D155 PolarHBondContact O-N 3.41Å; S151-D155 VanDerWaalsContact O-N 3.07Å; T152-D155 PolarHBondContact O-N 3.44Å; D155-Q157 PolarHBondContact O-N 2.99Å; D155-Q157 WeakPolarHBondContact OD1-CG 3.47Å; D155-Q157 PolarHBondContact OD1-NE2 3.05Å
156	W	89.8	Confident	89.2	Confident	10 Å²	10	25.6 Å²	25.6	4%	0.038	14%	0.143	C	C	.	.			trans	-85.7	99	177.6	-175.7	-94.8	0	0	0	110.1	F29 W32 Y68 S151 V154 I158	F29-W156 HydrophobicContact CB-CD2 4.28Å; F29-W156 HydrophobicContact CB-CE3 3.72Å; F29-W156 HydrophobicContact CB-CZ3 4.14Å; F29-W156 HydrophobicContact CD1-CD2 4Å; F29-W156 HydrophobicContact CD1-CE3 4.09Å; F29-W156 HydrophobicContact CD1-CH2 4.43Å; F29-W156 HydrophobicContact CD1-CZ2 4.35Å; F29-W156 HydrophobicContact CD1-CZ3 4.3Å; F29-W156 HydrophobicContact CD2-CB 3.87Å; F29-W156 HydrophobicContact CD2-CD2 4Å; F29-W156 HydrophobicContact CD2-CE3 4.29Å; F29-W156 AromaticContact CD2-CG 3.83Å; F29-W156 HydrophobicContact CD2-CG 3.83Å; F29-W156 HydrophobicContact CE1-CD2 4.28Å; F29-W156 HydrophobicContact CE1-CZ2 4.45Å; F29-W156 HydrophobicContact CE2-CB 4.09Å; F29-W156 HydrophobicContact CE2-CD2 4.28Å; F29-W156 AromaticContact CE2-CG 3.86Å; F29-W156 HydrophobicContact CE2-CG 3.86Å; F29-W156 AromaticContact CG-CD2 3.84Å; F29-W156 HydrophobicContact CG-CD2 3.84Å; F29-W156 AromaticContact CG-CE3 3.79Å; F29-W156 HydrophobicContact CG-CE3 3.79Å; F29-W156 HydrophobicContact CG-CG 4.19Å; F29-W156 HydrophobicContact CG-CZ3 4.34Å; F29-W156 HydrophobicContact CZ-CD2 4.38Å; F29-W156 HydrophobicContact CZ-CG 4.22Å; W32-W156 HydrophobicContact CB-CH2 4.26Å; W32-W156 HydrophobicContact CB-CZ3 4.43Å; W32-W156 HydrophobicContact CE3-CH2 4.19Å; Y68-W156 HydrophobicContact CD2-CZ2 4.4Å; S151-W156 PolarHBondContact O-N 3.11Å; V154-W156 HydrophobicContact CG2-CB 4.06Å; V154-W156 PolarHBondContact O-N 2.68Å; W156-I158 VanDerWaalsContact C-N 3.33Å; W156-I158 VanDerWaalsContact CD1-O 3.23Å; W156-I158 HydrophobicContact CD2-CD1 4.39Å; W156-I158 HydrophobicContact CE3-CD1 4.44Å; W156-I158 HydrophobicContact CH2-CD1 3.59Å; W156-I158 HydrophobicContact CZ2-CB 3.9Å; W156-I158 HydrophobicContact CZ2-CD1 3.52Å; W156-I158 HydrophobicContact CZ2-CG1 4.32Å; W156-I158 HydrophobicContact CZ2-CG2 4.18Å; W156-I158 HydrophobicContact CZ3-CD1 4.07Å; W156-I158 PolarHBondContact NE1-O 3.34Å; W156-I158 VanDerWaalsContact NE1-O 3.14Å; W156-I158 PolarHBondContact O-N 3.34Å
157	Q	87.4	Confident	87.3	Confident	30 Å²	30	26.8 Å²	26.8	14%	0.14	16%	0.155	C	C	.	.			trans	-93.3	17.6	-175.1	-54.4	-171.1	-4.9	0	0	114.2	S93 D155 C182 R183 N184	S93-Q157 PolarHBondContact OG-O 3.26Å; D155-Q157 PolarHBondContact O-N 2.99Å; D155-Q157 WeakPolarHBondContact OD1-CG 3.47Å; D155-Q157 PolarHBondContact OD1-NE2 3.05Å; Q157-C182 PolarHBondContact O-SG 2.96Å; Q157-C182 VanDerWaalsContact O-SG 3.37Å; Q157-R183 WeakPolarHBondContact CA-O 3.19Å; Q157-N184 HydrophobicContact CB-CB 4.33Å; Q157-N184 HydrophobicContact CG-CB 4.02Å
158	I	89.4	Confident	84.8	Confident	13 Å²	13	31.9 Å²	31.9	7%	0.067	20%	0.198	C	C	.	.	S	Bend	trans	-100.8	134.4	178.4	-65	152.3	0	0	0	108.9	Y68 E122 W156 V160	Y68-I158 HydrophobicContact CE2-CD1 3.9Å; Y68-I158 HydrophobicContact CE2-CG2 4.18Å; E122-I158 HydrophobicContact CG-CG1 4.42Å; E122-I158 HydrophobicContact CG-CG2 4.1Å; E122-I158 WeakPolarHBondContact OE1-CD1 3.49Å; E122-I158 WeakPolarHBondContact OE1-CG1 3.17Å; W156-I158 VanDerWaalsContact C-N 3.33Å; W156-I158 VanDerWaalsContact CD1-O 3.23Å; W156-I158 HydrophobicContact CD2-CD1 4.39Å; W156-I158 HydrophobicContact CE3-CD1 4.44Å; W156-I158 HydrophobicContact CH2-CD1 3.59Å; W156-I158 HydrophobicContact CZ2-CB 3.9Å; W156-I158 HydrophobicContact CZ2-CD1 3.52Å; W156-I158 HydrophobicContact CZ2-CG1 4.32Å; W156-I158 HydrophobicContact CZ2-CG2 4.18Å; W156-I158 HydrophobicContact CZ3-CD1 4.07Å; W156-I158 PolarHBondContact NE1-O 3.34Å; W156-I158 VanDerWaalsContact NE1-O 3.14Å; W156-I158 PolarHBondContact O-N 3.34Å; I158-V160 PolarHBondContact O-N 3.38Å
159	P	92.9	Very high	82.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.201	C	C	.	.			trans	-51.1	130.4	175.7	-27.5	32.5	0	0	0	113.4	A95 V96 L120 E122 Y123 L124 M161 F181 C182 F191	A95-P159 HydrophobicContact CB-CG 4.13Å; V96-P159 HydrophobicContact CG1-CG 3.85Å; L120-P159 HydrophobicContact CD1-CB 4.07Å; L120-P159 HydrophobicContact CD1-CG 4.47Å; L120-P159 HydrophobicContact CD2-CB 4.27Å; L120-P159 HydrophobicContact CD2-CG 3.9Å; E122-P159 WeakPolarHBondContact O-CD 3.5Å; Y123-P159 WeakPolarHBondContact CA-O 3.25Å; L124-P159 PolarHBondContact N-O 3.46Å; P159-M161 HydrophobicContact CB-SD 4.48Å; P159-F181 WeakPolarHBondContact CA-O 3.48Å; P159-C182 HydrophobicContact CB-CB 4.18Å; P159-C182 HydrophobicContact CG-CB 3.96Å; P159-F191 HydrophobicContact CB-CE2 3.81Å; P159-F191 HydrophobicContact CB-CZ 4.25Å; P159-F191 HydrophobicContact CG-CE2 4.26Å; P159-F191 HydrophobicContact CG-CZ 4.27Å
160	V	94.9	Very high	80.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	116.6	172.5	-173.4	0	0	0	0	108.4	F29 L124 V126 F147 I158 F162 G180 F181	F29-V160 HydrophobicContact CZ-CG2 4.45Å; L124-V160 HydrophobicContact CB-CG2 4.48Å; L124-V160 HydrophobicContact CD2-CG1 4.15Å; L124-V160 HydrophobicContact CD2-CG2 4.22Å; L124-V160 HydrophobicContact CG-CG1 4.4Å; V126-V160 HydrophobicContact CG2-CG1 3.88Å; F147-V160 HydrophobicContact CD1-CG1 3.86Å; F147-V160 HydrophobicContact CE1-CG1 4.39Å; F147-V160 HydrophobicContact CG-CG1 4.38Å; I158-V160 PolarHBondContact O-N 3.38Å; V160-F162 HydrophobicContact CB-CE2 4.29Å; V160-F162 HydrophobicContact CG1-CD2 4.49Å; V160-F162 HydrophobicContact CG1-CE1 4.26Å; V160-F162 HydrophobicContact CG1-CE2 3.67Å; V160-F162 HydrophobicContact CG1-CZ 3.53Å; V160-G180 CarbonylContact O-C 3.55Å; V160-G180 WeakPolarHBondContact O-CA 3.18Å; V160-F181 HydrophobicContact CB-CE1 4.37Å; V160-F181 HydrophobicContact CB-CZ 4.16Å; V160-F181 HydrophobicContact CG2-CE2 4.44Å; V160-F181 HydrophobicContact CG2-CZ 4.29Å; V160-F181 PolarHBondContact N-O 3.36Å; V160-F181 PolarHBondContact O-N 3.17Å
161	M	94.9	Very high	78.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	119.9	-175.2	-55.3	-57.2	-60.8	0	0	109.5	L114 F118 L120 Y123 L124 A125 V126 P159 Y178 F191	L114-M161 HydrophobicContact CD2-CB 4.49Å; L114-M161 HydrophobicContact CD2-CE 4.09Å; L114-M161 HydrophobicContact CD2-CG 4.49Å; F118-M161 HydrophobicContact CD1-CE 4.37Å; F118-M161 HydrophobicContact CD2-CE 3.44Å; F118-M161 VanDerWaalsContact CD2-CE 3.44Å; F118-M161 HydrophobicContact CE1-CE 4.26Å; F118-M161 HydrophobicContact CE2-CE 3.32Å; F118-M161 HydrophobicContact CG-CE 3.96Å; F118-M161 HydrophobicContact CZ-CE 3.74Å; L120-M161 HydrophobicContact CD1-CG 4.02Å; L120-M161 HydrophobicContact CD1-SD 3.83Å; Y123-M161 HydrophobicContact CD2-CG 4.47Å; L124-M161 PolarHBondContact O-N 2.82Å; A125-M161 CarbonylContact C-O 3.52Å; A125-M161 WeakPolarHBondContact CA-O 3.46Å; V126-M161 PolarHBondContact N-O 3Å; P159-M161 HydrophobicContact CB-SD 4.48Å; M161-Y178 HydrophobicContact CB-CD1 4.4Å; M161-F191 HydrophobicContact CE-CB 3.72Å; M161-F191 HydrophobicContact CE-CD2 4.44Å; M161-F191 HydrophobicContact CE-CG 4.15Å; M161-F191 HydrophobicContact SD-CB 4.03Å; M161-F191 HydrophobicContact SD-CD2 3.63Å; M161-F191 HydrophobicContact SD-CE2 4.29Å; M161-F191 HydrophobicContact SD-CG 3.9Å
162	F	92.6	Very high	76.9	Confident	7 Å²	7	43.9 Å²	43.9	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125.6	178.2	-60.6	-88.8	0	0	0	109.9	V126 I143 I144 F147 V160 Y164 Y178 V179 F181	V126-F162 HydrophobicContact CB-CD1 3.73Å; V126-F162 HydrophobicContact CB-CE1 3.98Å; V126-F162 HydrophobicContact CG1-CD1 3.92Å; V126-F162 HydrophobicContact CG1-CE1 4.06Å; V126-F162 HydrophobicContact CG2-CD1 4.22Å; V126-F162 HydrophobicContact CG2-CE1 3.99Å; I143-F162 HydrophobicContact CG2-CE1 4.2Å; I144-F162 HydrophobicContact CG1-CD1 4.47Å; I144-F162 HydrophobicContact CG1-CD2 4.18Å; I144-F162 HydrophobicContact CG1-CE2 4.27Å; I144-F162 HydrophobicContact CG1-CG 4.3Å; I144-F162 HydrophobicContact CG1-CZ 4.45Å; I144-F162 HydrophobicContact CG2-CE2 4.32Å; F147-F162 HydrophobicContact CB-CE1 4.28Å; F147-F162 HydrophobicContact CB-CZ 3.61Å; F147-F162 HydrophobicContact CD1-CZ 4.29Å; F147-F162 AromaticContact CD2-CE1 3.56Å; F147-F162 HydrophobicContact CD2-CE1 3.56Å; F147-F162 AromaticContact CD2-CZ 3.81Å; F147-F162 HydrophobicContact CD2-CZ 3.81Å; F147-F162 AromaticContact CE2-CE1 3.96Å; F147-F162 HydrophobicContact CE2-CE1 3.96Å; F147-F162 AromaticContact CG-CE1 3.88Å; F147-F162 HydrophobicContact CG-CE1 3.88Å; F147-F162 AromaticContact CG-CZ 3.65Å; F147-F162 HydrophobicContact CG-CZ 3.65Å; V160-F162 HydrophobicContact CB-CE2 4.29Å; V160-F162 HydrophobicContact CG1-CD2 4.49Å; V160-F162 HydrophobicContact CG1-CE1 4.26Å; V160-F162 HydrophobicContact CG1-CE2 3.67Å; V160-F162 HydrophobicContact CG1-CZ 3.53Å; F162-Y164 HydrophobicContact CB-CE2 3.73Å; F162-Y164 WeakPolarHBondContact O-CD2 3.24Å; F162-Y164 WeakPolarHBondContact O-CE2 2.94Å; F162-Y178 VanDerWaalsContact O-CA 3.31Å; F162-Y178 WeakPolarHBondContact O-CA 3.22Å; F162-V179 WeakPolarHBondContact CB-O 2.98Å; F162-V179 WeakPolarHBondContact CD2-O 2.76Å; F162-V179 PolarHBondContact N-O 2.89Å; F162-V179 PolarHBondContact O-N 3.22Å; F162-V179 VanDerWaalsContact O-N 3.11Å; F162-F181 HydrophobicContact CE2-CD1 4.08Å; F162-F181 AromaticContact CE2-CE1 3.67Å; F162-F181 HydrophobicContact CE2-CE1 3.67Å; F162-F181 HydrophobicContact CZ-CE1 4.09Å
163	A	89.7	Confident	75.4	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.033	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	127.4	173.8	0	0	0	0	0	110.3	V126 T127 P128 P176 Y178	V126-A163 PolarHBondContact O-N 3.04Å; T127-A163 HydrophobicContact CG2-CB 3.63Å; P128-A163 VanDerWaalsContact CD-O 3.24Å; P128-A163 WeakPolarHBondContact CD-O 3.45Å; A163-P176 HydrophobicContact CB-CB 4Å; A163-P176 HydrophobicContact CB-CG 4.25Å; A163-Y178 HydrophobicContact CB-CD1 3.99Å; A163-Y178 HydrophobicContact CB-CE1 3.45Å; A163-Y178 VanDerWaalsContact CB-CE1 3.45Å
164	Y	82.8	Confident	74.1	Confident	29 Å²	29	43.3 Å²	43.3	11%	0.114	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	113	174.4	-66.4	-95.4	0	0	0	108	F136 K140 I144 F162 V166 P176 I177 V179	F136-Y164 HydrophobicContact CD1-CD1 4.45Å; F136-Y164 AromaticContact CE1-CD1 3.43Å; F136-Y164 HydrophobicContact CE1-CD1 3.43Å; F136-Y164 VanDerWaalsContact CE1-CD1 3.43Å; F136-Y164 AromaticContact CE1-CE1 3.53Å; F136-Y164 HydrophobicContact CE1-CE1 3.53Å; F136-Y164 HydrophobicContact CE1-CG 4.36Å; F136-Y164 HydrophobicContact CZ-CD1 4.1Å; F136-Y164 AromaticContact CZ-CE1 3.97Å; F136-Y164 HydrophobicContact CZ-CE1 3.97Å; K140-Y164 HydrophobicContact CB-CE1 4.3Å; K140-Y164 HydrophobicContact CD-CE1 4.07Å; I144-Y164 WeakPolarHBondContact CD1-OH 3.35Å; F162-Y164 HydrophobicContact CB-CE2 3.73Å; F162-Y164 WeakPolarHBondContact O-CD2 3.24Å; F162-Y164 WeakPolarHBondContact O-CE2 2.94Å; Y164-V166 PolarHBondContact O-N 2.82Å; Y164-P176 CarbonylContact O-C 3.27Å; Y164-P176 VanDerWaalsContact O-CA 3.24Å; Y164-P176 WeakPolarHBondContact O-CA 3.15Å; Y164-P176 VanDerWaalsContact O-CB 3.29Å; Y164-P176 WeakPolarHBondContact O-CB 3.36Å; Y164-I177 PolarHBondContact N-O 2.92Å; Y164-I177 PolarHBondContact O-N 3.31Å; Y164-V179 HydrophobicContact CD2-CB 4.46Å; Y164-V179 HydrophobicContact CD2-CG2 4.18Å; Y164-V179 HydrophobicContact CE2-CB 3.72Å; Y164-V179 HydrophobicContact CE2-CG2 3.8Å
165	P	72.3	Confident	73.6	Confident	60 Å²	60	46.1 Å²	46.1	39%	0.39	29%	0.29	S	S	.	.			trans	-63.5	121.2	170.2	26.2	-30.7	0	0	0	107.5	P128 G167	P128-P165 HydrophobicContact CG-CG 4.01Å; P165-G167 PolarHBondContact O-N 3.31Å
166	V	63.9	Low	73.5	Confident	44 Å²	44	45.2 Å²	45.2	27%	0.267	29%	0.287	S	S	.	.			trans	-84.8	100.3	176.6	-177	0	0	0	0	107.2	Y164 S169 I177	Y164-V166 PolarHBondContact O-N 2.82Å; V166-S169 VanDerWaalsContact CG1-CB 3.48Å; V166-I177 HydrophobicContact CG2-CB 4.07Å; V166-I177 HydrophobicContact CG2-CD1 3.47Å; V166-I177 VanDerWaalsContact CG2-CD1 3.47Å; V166-I177 HydrophobicContact CG2-CG1 3.51Å
167	G	54.9	Low	73.4	Confident	25 Å²	25	46.2 Å²	46.2	26%	0.258	29%	0.293	S	S	.	.			trans	-57.4	146	165.6	0	0	0	0	0	110.4	E133 P165 S169	E133-G167 WeakPolarHBondContact OE1-CA 2.71Å; E133-G167 PolarHBondContact OE1-N 3.37Å; P165-G167 PolarHBondContact O-N 3.31Å; G167-S169 PolarHBondContact O-N 2.75Å
168	A	44.4	Very low	73.6	Confident	109 Å²	109	46.6 Å²	46.6	90%	0.901	29%	0.293	S	S	*	.	S	Bend	trans	-20.4	76	-174.1	0	0	0	0	0	114.2
169	S	47.1	Very low	73.8	Confident	45 Å²	45	48.3 Å²	48.3	32%	0.315	30%	0.304	S	S	.	.			trans	-68.8	169	173	175.8	0	0	0	0	106.6	V166 G167 V171	V166-S169 VanDerWaalsContact CG1-CB 3.48Å; G167-S169 PolarHBondContact O-N 2.75Å; S169-V171 PolarHBondContact O-N 3.47Å
170	A	51.2	Low	73.9	Confident	94 Å²	94	48.6 Å²	48.6	78%	0.777	31%	0.308	S	S	*	.	S	Bend	trans	-56.1	-10	172	0	0	0	0	0	113.2	P197	A170-P197 HydrophobicContact CB-CG 3.94Å
171	V	53.1	Low	73.9	Confident	18 Å²	18	49 Å²	49	11%	0.109	31%	0.309	C	S	.	.	S	Bend	trans	-116.2	110.6	177.2	-173.6	0	0	0	0	108.6	S169 V173 P197 Y789	S169-V171 PolarHBondContact O-N 3.47Å; V171-V173 HydrophobicContact CG1-CB 4.25Å; V171-V173 HydrophobicContact CG1-CG2 3.66Å; V171-V173 PolarHBondContact O-N 2.79Å; V171-P197 HydrophobicContact CG2-CB 4.41Å; V171-P197 HydrophobicContact CG2-CG 3.88Å; V171-Y789 HydrophobicContact CG1-CD1 3.52Å; V171-Y789 HydrophobicContact CG1-CE1 4.11Å; V171-Y789 HydrophobicContact CG1-CG 3.74Å
172	E	55.7	Low	73.8	Confident	197 Å²	197	49.2 Å²	49.2	92%	0.921	31%	0.311	S	S	*	.			trans	-72.3	68.5	177.2	-68.6	-176.1	168.9	0	0	111.6
173	V	58.8	Low	73.5	Confident	34 Å²	34	54 Å²	54	21%	0.206	33%	0.329	C	S	.	.			trans	-124.7	124.7	177.1	173	0	0	0	0	109.1	V171 D175 Y789	V171-V173 HydrophobicContact CG1-CB 4.25Å; V171-V173 HydrophobicContact CG1-CG2 3.66Å; V171-V173 PolarHBondContact O-N 2.79Å; V173-D175 VanDerWaalsContact C-N 3.29Å; V173-D175 HydrophobicContact CG1-CB 4.08Å; V173-D175 PolarHBondContact O-N 3.27Å; V173-Y789 HydrophobicContact CG2-CD1 4.39Å; V173-Y789 HydrophobicContact CG2-CE1 3.69Å
174	S	65.5	Low	73.1	Confident	116 Å²	116	54.5 Å²	54.5	81%	0.811	33%	0.331	S	S	*	.			trans	-72.4	-15.1	-174.5	53.3	0	0	0	0	114.9
175	D	78.5	Confident	72.9	Confident	78 Å²	78	58.9 Å²	58.9	42%	0.417	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-65.3	134.5	-175.3	-64	-20.4	0	0	0	111.1	V173 R195	V173-D175 VanDerWaalsContact C-N 3.29Å; V173-D175 HydrophobicContact CG1-CB 4.08Å; V173-D175 PolarHBondContact O-N 3.27Å; D175-R195 VanDerWaalsContact O-CZ 3.27Å; D175-R195 PolarHBondContact O-NH1 3.37Å; D175-R195 PolarHBondContact O-NH2 3.49Å
176	P	83.6	Confident	73.4	Confident	36 Å²	36	56.8 Å²	56.8	23%	0.234	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-67.5	164.1	177.9	27.7	-34.1	0	0	0	112.4	A163 Y164 Y178 R195	A163-P176 HydrophobicContact CB-CB 4Å; A163-P176 HydrophobicContact CB-CG 4.25Å; Y164-P176 CarbonylContact O-C 3.27Å; Y164-P176 VanDerWaalsContact O-CA 3.24Å; Y164-P176 WeakPolarHBondContact O-CA 3.15Å; Y164-P176 VanDerWaalsContact O-CB 3.29Å; Y164-P176 WeakPolarHBondContact O-CB 3.36Å; P176-Y178 HydrophobicContact CB-CE2 4.41Å; P176-Y178 HydrophobicContact CG-CE2 3.72Å; P176-Y178 WeakPolarHBondContact CG-OH 3.24Å; P176-R195 PolarHBondContact O-NH2 3.47Å
177	I	88.5	Confident	74.5	Confident	31 Å²	31	55 Å²	55	16%	0.159	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	148	164.2	-73.6	171	0	0	0	108.1	Y164 V166 M193 R195	Y164-I177 PolarHBondContact N-O 2.92Å; Y164-I177 PolarHBondContact O-N 3.31Å; V166-I177 HydrophobicContact CG2-CB 4.07Å; V166-I177 HydrophobicContact CG2-CD1 3.47Å; V166-I177 VanDerWaalsContact CG2-CD1 3.47Å; V166-I177 HydrophobicContact CG2-CG1 3.51Å; I177-M193 HydrophobicContact CG2-CB 4.01Å; I177-M193 HydrophobicContact CG2-CG 4.26Å; I177-M193 WeakPolarHBondContact CG2-O 3.44Å; I177-M193 HydrophobicContact CG2-SD 4.47Å; I177-R195 HydrophobicContact CD1-CB 4.16Å; I177-R195 HydrophobicContact CG1-CB 4.38Å
178	Y	91.7	Very high	76.2	Confident	38 Å²	38	55.5 Å²	55.5	15%	0.149	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.8	-179.9	-68.5	-86.5	0	0	0	112.7	L114 M161 F162 A163 P176 M193	L114-Y178 HydrophobicContact CD1-CD1 4.06Å; L114-Y178 HydrophobicContact CD1-CE1 3.58Å; L114-Y178 HydrophobicContact CD1-CE2 4.22Å; L114-Y178 HydrophobicContact CD2-CD1 3.75Å; L114-Y178 HydrophobicContact CD2-CD2 3.72Å; L114-Y178 HydrophobicContact CD2-CE1 4.09Å; L114-Y178 HydrophobicContact CD2-CE2 4.07Å; L114-Y178 HydrophobicContact CD2-CG 3.54Å; L114-Y178 HydrophobicContact CG-CD1 4.31Å; L114-Y178 HydrophobicContact CG-CD2 4.16Å; L114-Y178 HydrophobicContact CG-CE1 4.13Å; L114-Y178 HydrophobicContact CG-CE2 3.98Å; L114-Y178 HydrophobicContact CG-CG 4.31Å; M161-Y178 HydrophobicContact CB-CD1 4.4Å; F162-Y178 VanDerWaalsContact O-CA 3.31Å; F162-Y178 WeakPolarHBondContact O-CA 3.22Å; A163-Y178 HydrophobicContact CB-CD1 3.99Å; A163-Y178 HydrophobicContact CB-CE1 3.45Å; A163-Y178 VanDerWaalsContact CB-CE1 3.45Å; P176-Y178 HydrophobicContact CB-CE2 4.41Å; P176-Y178 HydrophobicContact CG-CE2 3.72Å; P176-Y178 WeakPolarHBondContact CG-OH 3.24Å; Y178-M193 HydrophobicContact CD2-SD 4.09Å; Y178-M193 PolarHBondContact N-SD 2.99Å; Y178-M193 WeakPolarHBondContact O-CB 3.23Å; Y178-M193 PolarHBondContact O-N 2.75Å
179	V	93	Very high	78.5	Confident	49 Å²	49	50.5 Å²	50.5	30%	0.297	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	144.2	167.1	-177.1	0	0	0	0	107.2	F162 Y164 F191	F162-V179 WeakPolarHBondContact CB-O 2.98Å; F162-V179 WeakPolarHBondContact CD2-O 2.76Å; F162-V179 PolarHBondContact N-O 2.89Å; F162-V179 PolarHBondContact O-N 3.22Å; F162-V179 VanDerWaalsContact O-N 3.11Å; Y164-V179 HydrophobicContact CD2-CB 4.46Å; Y164-V179 HydrophobicContact CD2-CG2 4.18Å; Y164-V179 HydrophobicContact CE2-CB 3.72Å; Y164-V179 HydrophobicContact CE2-CG2 3.8Å; V179-F191 CarbonylContact C-O 3.56Å; V179-F191 VanDerWaalsContact CA-O 3.27Å; V179-F191 WeakPolarHBondContact CA-O 3.19Å; V179-F191 WeakPolarHBondContact CG1-O 3.1Å
180	G	94.8	Very high	80.7	Confident	7 Å²	7	51.2 Å²	51.2	7%	0.072	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	176.5	-178.2	0	0	0	0	0	113.4	V160 F191	V160-G180 CarbonylContact O-C 3.55Å; V160-G180 WeakPolarHBondContact O-CA 3.18Å; G180-F191 PolarHBondContact N-O 3.01Å; G180-F191 PolarHBondContact O-N 3.15Å
181	F	94.8	Very high	82.8	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.035	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	158.4	172.5	65.8	-93	0	0	0	110.9	I144 F147 L148 P159 V160 F162 Y188 T189	I144-F181 HydrophobicContact CG2-CD1 4.28Å; I144-F181 HydrophobicContact CG2-CE1 4.21Å; F147-F181 HydrophobicContact CB-CE1 4.28Å; F147-F181 HydrophobicContact CB-CZ 4.05Å; L148-F181 HydrophobicContact CB-CE1 4.03Å; L148-F181 HydrophobicContact CB-CE2 4.18Å; L148-F181 HydrophobicContact CB-CZ 3.78Å; L148-F181 HydrophobicContact CD1-CD2 3.63Å; L148-F181 HydrophobicContact CD1-CE2 3.58Å; L148-F181 HydrophobicContact CD1-CG 4.18Å; L148-F181 HydrophobicContact CD1-CZ 4.06Å; P159-F181 WeakPolarHBondContact CA-O 3.48Å; V160-F181 HydrophobicContact CB-CE1 4.37Å; V160-F181 HydrophobicContact CB-CZ 4.16Å; V160-F181 HydrophobicContact CG2-CE2 4.44Å; V160-F181 HydrophobicContact CG2-CZ 4.29Å; V160-F181 PolarHBondContact N-O 3.36Å; V160-F181 PolarHBondContact O-N 3.17Å; F162-F181 HydrophobicContact CE2-CD1 4.08Å; F162-F181 AromaticContact CE2-CE1 3.67Å; F162-F181 HydrophobicContact CE2-CE1 3.67Å; F162-F181 HydrophobicContact CZ-CE1 4.09Å; F181-Y188 HydrophobicContact CB-CE1 4.27Å; F181-Y188 WeakPolarHBondContact CB-OH 3.36Å; F181-T189 CarbonylContact C-O 3.59Å; F181-T189 VanDerWaalsContact CA-O 3.25Å; F181-T189 WeakPolarHBondContact CA-O 3.47Å
182	C	92.6	Very high	84.7	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.034	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	132.8	167.4	-178.6	0	0	0	0	108.3	V96 Q157 P159 T189 F191	V96-C182 HydrophobicContact CG1-CB 4.37Å; Q157-C182 PolarHBondContact O-SG 2.96Å; Q157-C182 VanDerWaalsContact O-SG 3.37Å; P159-C182 HydrophobicContact CB-CB 4.18Å; P159-C182 HydrophobicContact CG-CB 3.96Å; C182-T189 PolarHBondContact N-O 2.91Å; C182-T189 PolarHBondContact O-N 2.74Å; C182-F191 HydrophobicContact CB-CE2 3.75Å; C182-F191 HydrophobicContact CB-CZ 4.16Å
183	R	86.7	Confident	86.4	Confident	107 Å²	107	41.9 Å²	41.9	40%	0.404	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132.4	177.8	-177.6	177.7	-178.9	163.5	3.4	109.7	Q157 Y188	Q157-R183 WeakPolarHBondContact CA-O 3.19Å; R183-Y188 HydrophobicContact CB-CD2 3.86Å; R183-Y188 HydrophobicContact CB-CE2 4.21Å; R183-Y188 HydrophobicContact CG-CD2 3.96Å
184	N	82.2	Confident	87.9	Confident	14 Å²	14	42 Å²	42	8%	0.075	23%	0.227	C	C	.	.			trans	-121.3	-168	160.5	71.5	-3.6	0	0	0	108.9	L91 S93 Q157 S186 F187	L91-N184 PolarHBondContact O-ND2 3.33Å; S93-N184 PolarHBondContact N-ND2 3.29Å; Q157-N184 HydrophobicContact CB-CB 4.33Å; Q157-N184 HydrophobicContact CG-CB 4.02Å; N184-S186 VanDerWaalsContact C-N 3.34Å; N184-S186 PolarHBondContact O-N 3.14Å; N184-S186 PolarHBondContact OD1-N 2.65Å; N184-F187 PolarHBondContact N-O 3.39Å; N184-F187 WeakPolarHBondContact OD1-CA 3.3Å; N184-F187 WeakPolarHBondContact OD1-CB 3.08Å; N184-F187 PolarHBondContact OD1-N 2.98Å; N184-F187 PolarHBondContact OD1-O 3.11Å; N184-F187 VanDerWaalsContact OD1-O 3.08Å
185	D	78.4	Confident	89	Confident	121 Å²	121	37.5 Å²	37.5	65%	0.647	19%	0.192	S	C	*	.	S	Bend	trans	-62.3	-40.1	-176.8	-64.3	-35.8	0	0	0	112.8	T800	D185-T800 PolarHBondContact O-OG1 2.99Å
186	S	82.1	Confident	89.4	Confident	17 Å²	17	37.6 Å²	37.6	12%	0.119	19%	0.192	C	C	.	.	S	Bend	trans	-103.2	-20.7	-172.6	-64.4	0	0	0	0	115.2	N184 D799 T800 D801	N184-S186 VanDerWaalsContact C-N 3.34Å; N184-S186 PolarHBondContact O-N 3.14Å; N184-S186 PolarHBondContact OD1-N 2.65Å; S186-D799 VanDerWaalsContact O-OD1 3.11Å; S186-T800 PolarHBondContact O-N 2.74Å; S186-T800 PolarHBondContact O-OG1 3.01Å; S186-T800 VanDerWaalsContact O-OG1 3.13Å; S186-D801 WeakPolarHBondContact CA-OD2 3.36Å; S186-D801 VanDerWaalsContact CB-OD2 3.23Å; S186-D801 WeakPolarHBondContact CB-OD2 3.29Å; S186-D801 PolarHBondContact OG-OD2 3.37Å
187	F	87.5	Confident	89.6	Confident	5 Å²	5	36.9 Å²	36.9	2%	0.022	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	144.9	-170.4	-61.6	-74.5	0	0	0	112.5	R90 F92 N184 C773 T797 E798 D799 T800	R90-F187 HydrophobicContact CB-CE2 4.4Å; F92-F187 AromaticContact CD1-CD2 3.72Å; F92-F187 HydrophobicContact CD1-CD2 3.72Å; F92-F187 AromaticContact CD1-CE2 3.87Å; F92-F187 HydrophobicContact CD1-CE2 3.87Å; F92-F187 HydrophobicContact CD1-CG 4.09Å; F92-F187 HydrophobicContact CD1-CZ 4.37Å; F92-F187 HydrophobicContact CD2-CE2 4.16Å; F92-F187 AromaticContact CE1-CD1 3.82Å; F92-F187 HydrophobicContact CE1-CD1 3.82Å; F92-F187 AromaticContact CE1-CD2 3.66Å; F92-F187 HydrophobicContact CE1-CD2 3.66Å; F92-F187 AromaticContact CE1-CE1 3.73Å; F92-F187 HydrophobicContact CE1-CE1 3.73Å; F92-F187 AromaticContact CE1-CE2 3.55Å; F92-F187 HydrophobicContact CE1-CE2 3.55Å; F92-F187 AromaticContact CE1-CG 3.79Å; F92-F187 HydrophobicContact CE1-CG 3.79Å; F92-F187 AromaticContact CE1-CZ 3.59Å; F92-F187 HydrophobicContact CE1-CZ 3.59Å; F92-F187 AromaticContact CE2-CE2 3.94Å; F92-F187 HydrophobicContact CE2-CE2 3.94Å; F92-F187 AromaticContact CE2-CZ 3.95Å; F92-F187 HydrophobicContact CE2-CZ 3.95Å; F92-F187 HydrophobicContact CG-CD2 4.26Å; F92-F187 HydrophobicContact CG-CE2 4.16Å; F92-F187 HydrophobicContact CZ-CD1 4.34Å; F92-F187 HydrophobicContact CZ-CD2 4.2Å; F92-F187 AromaticContact CZ-CE1 3.77Å; F92-F187 HydrophobicContact CZ-CE1 3.77Å; F92-F187 AromaticContact CZ-CE2 3.59Å; F92-F187 HydrophobicContact CZ-CE2 3.59Å; F92-F187 AromaticContact CZ-CZ 3.35Å; F92-F187 HydrophobicContact CZ-CZ 3.35Å; N184-F187 PolarHBondContact N-O 3.39Å; N184-F187 WeakPolarHBondContact OD1-CA 3.3Å; N184-F187 WeakPolarHBondContact OD1-CB 3.08Å; N184-F187 PolarHBondContact OD1-N 2.98Å; N184-F187 PolarHBondContact OD1-O 3.11Å; N184-F187 VanDerWaalsContact OD1-O 3.08Å; F187-C773 HydrophobicContact CE1-CB 4.09Å; F187-C773 HydrophobicContact CZ-CB 4Å; F187-T797 HydrophobicContact CB-CG2 3.85Å; F187-T797 HydrophobicContact CD1-CG2 3.93Å; F187-T797 HydrophobicContact CG-CG2 4.16Å; F187-E798 CarbonylContact C-O 3.59Å; F187-E798 VanDerWaalsContact CA-O 3.28Å; F187-E798 WeakPolarHBondContact CA-O 3.42Å; F187-D799 HydrophobicContact CD1-CB 4.3Å; F187-D799 HydrophobicContact CE1-CB 4.14Å; F187-T800 PolarHBondContact N-OG1 2.99Å
188	Y	90.5	Very high	89.5	Confident	37 Å²	37	37.1 Å²	37.1	15%	0.145	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.5	170.5	-169.6	-78.8	0	0	0	109.6	L148 F181 R183 H190 T797 E798	L148-Y188 HydrophobicContact CD1-CE2 3.9Å; F181-Y188 HydrophobicContact CB-CE1 4.27Å; F181-Y188 WeakPolarHBondContact CB-OH 3.36Å; R183-Y188 HydrophobicContact CB-CD2 3.86Å; R183-Y188 HydrophobicContact CB-CE2 4.21Å; R183-Y188 HydrophobicContact CG-CD2 3.96Å; Y188-H190 AromaticContact CD1-CE1 3.2Å; Y188-H190 WeakPolarHBondContact CD1-CE1 3.49Å; Y188-H190 AromaticContact CD1-ND1 3.4Å; Y188-H190 WeakPolarHBondContact CD1-ND1 3.45Å; Y188-H190 AromaticContact CD1-NE2 3.72Å; Y188-H190 AromaticContact CE1-CD2 3.48Å; Y188-H190 VanDerWaalsContact CE1-CD2 3.48Å; Y188-H190 WeakPolarHBondContact CE1-CD2 3.25Å; Y188-H190 AromaticContact CE1-CE1 3.16Å; Y188-H190 WeakPolarHBondContact CE1-CE1 3.14Å; Y188-H190 AromaticContact CE1-CG 3.66Å; Y188-H190 AromaticContact CE1-ND1 3.47Å; Y188-H190 WeakPolarHBondContact CE1-ND1 3.27Å; Y188-H190 AromaticContact CE1-NE2 3.14Å; Y188-H190 WeakPolarHBondContact CE1-NE2 3.04Å; Y188-T797 CarbonylContact O-C 3.51Å; Y188-T797 WeakPolarHBondContact O-CA 3.28Å; Y188-E798 PolarHBondContact N-O 3.48Å; Y188-E798 PolarHBondContact O-N 3.31Å
189	T	92.2	Very high	89	Confident	4 Å²	4	40.6 Å²	40.6	3%	0.025	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.6	178.9	-53.4	0	0	0	0	110.4	M99 F181 C182 F191 L796 T797	M99-T189 HydrophobicContact CE-CG2 4.44Å; M99-T189 HydrophobicContact SD-CG2 4.25Å; F181-T189 CarbonylContact C-O 3.59Å; F181-T189 VanDerWaalsContact CA-O 3.25Å; F181-T189 WeakPolarHBondContact CA-O 3.47Å; C182-T189 PolarHBondContact N-O 2.91Å; C182-T189 PolarHBondContact O-N 2.74Å; T189-F191 HydrophobicContact CG2-CD1 4.18Å; T189-F191 HydrophobicContact CG2-CE1 3.51Å; T189-F191 HydrophobicContact CG2-CE2 4.14Å; T189-F191 HydrophobicContact CG2-CZ 3.48Å; T189-F191 VanDerWaalsContact CG2-CZ 3.48Å; T189-L796 CarbonylContact C-O 3.5Å; T189-L796 WeakPolarHBondContact CA-O 3.24Å; T189-T797 WeakPolarHBondContact CG2-OG1 3.23Å; T189-T797 WeakPolarHBondContact OG1-CG2 3.26Å; T189-T797 PolarHBondContact OG1-OG1 3.41Å
190	H	93.3	Very high	88.4	Confident	59 Å²	59	42 Å²	42	27%	0.273	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	138.5	171.1	-62	86.1	0	0	0	109.5	Y188 S795 L796 E798	Y188-H190 AromaticContact CD1-CE1 3.2Å; Y188-H190 WeakPolarHBondContact CD1-CE1 3.49Å; Y188-H190 AromaticContact CD1-ND1 3.4Å; Y188-H190 WeakPolarHBondContact CD1-ND1 3.45Å; Y188-H190 AromaticContact CD1-NE2 3.72Å; Y188-H190 AromaticContact CE1-CD2 3.48Å; Y188-H190 VanDerWaalsContact CE1-CD2 3.48Å; Y188-H190 WeakPolarHBondContact CE1-CD2 3.25Å; Y188-H190 AromaticContact CE1-CE1 3.16Å; Y188-H190 WeakPolarHBondContact CE1-CE1 3.14Å; Y188-H190 AromaticContact CE1-CG 3.66Å; Y188-H190 AromaticContact CE1-ND1 3.47Å; Y188-H190 WeakPolarHBondContact CE1-ND1 3.27Å; Y188-H190 AromaticContact CE1-NE2 3.14Å; Y188-H190 WeakPolarHBondContact CE1-NE2 3.04Å; H190-S795 WeakPolarHBondContact O-CA 3.23Å; H190-L796 PolarHBondContact N-O 3.33Å; H190-L796 PolarHBondContact O-N 3.45Å; H190-E798 IonicContact CE1-OE1 2.81Å; H190-E798 IonicContact ND1-OE1 3.79Å
191	F	94.9	Very high	87.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124.2	173.8	-55.9	-71.5	0	0	0	109.3	V96 M99 F118 L120 P159 M161 V179 G180 C182 T189 A794 S795	V96-F191 HydrophobicContact CG1-CZ 3.95Å; M99-F191 HydrophobicContact SD-CE1 4.39Å; F118-F191 HydrophobicContact CB-CD1 3.96Å; F118-F191 HydrophobicContact CB-CE1 4.33Å; F118-F191 HydrophobicContact CD1-CB 3.74Å; F118-F191 AromaticContact CD1-CD1 3.7Å; F118-F191 HydrophobicContact CD1-CD1 3.7Å; F118-F191 HydrophobicContact CD1-CG 4.11Å; F118-F191 HydrophobicContact CE1-CB 3.69Å; F118-F191 HydrophobicContact CE1-CD1 4.49Å; F118-F191 HydrophobicContact CG-CB 4.39Å; F118-F191 HydrophobicContact CG-CD1 4.08Å; F118-F191 HydrophobicContact CZ-CB 4.32Å; L120-F191 HydrophobicContact CD2-CE1 3.64Å; L120-F191 HydrophobicContact CD2-CE2 4.47Å; L120-F191 HydrophobicContact CD2-CZ 3.63Å; P159-F191 HydrophobicContact CB-CE2 3.81Å; P159-F191 HydrophobicContact CB-CZ 4.25Å; P159-F191 HydrophobicContact CG-CE2 4.26Å; P159-F191 HydrophobicContact CG-CZ 4.27Å; M161-F191 HydrophobicContact CE-CB 3.72Å; M161-F191 HydrophobicContact CE-CD2 4.44Å; M161-F191 HydrophobicContact CE-CG 4.15Å; M161-F191 HydrophobicContact SD-CB 4.03Å; M161-F191 HydrophobicContact SD-CD2 3.63Å; M161-F191 HydrophobicContact SD-CE2 4.29Å; M161-F191 HydrophobicContact SD-CG 3.9Å; V179-F191 CarbonylContact C-O 3.56Å; V179-F191 VanDerWaalsContact CA-O 3.27Å; V179-F191 WeakPolarHBondContact CA-O 3.19Å; V179-F191 WeakPolarHBondContact CG1-O 3.1Å; G180-F191 PolarHBondContact N-O 3.01Å; G180-F191 PolarHBondContact O-N 3.15Å; C182-F191 HydrophobicContact CB-CE2 3.75Å; C182-F191 HydrophobicContact CB-CZ 4.16Å; T189-F191 HydrophobicContact CG2-CD1 4.18Å; T189-F191 HydrophobicContact CG2-CE1 3.51Å; T189-F191 HydrophobicContact CG2-CE2 4.14Å; T189-F191 HydrophobicContact CG2-CZ 3.48Å; T189-F191 VanDerWaalsContact CG2-CZ 3.48Å; F191-A794 WeakPolarHBondContact CA-O 3.34Å; F191-S795 WeakPolarHBondContact CD1-OG 3.21Å
192	E	93	Very high	86.9	Confident	90 Å²	90	49.5 Å²	49.5	42%	0.421	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	145	-177.9	-62.2	-173.3	175.5	0	0	110.6	F118 S793 A794	F118-E192 WeakPolarHBondContact CE1-O 3.49Å; E192-S793 CarbonylContact O-C 3.53Å; E192-S793 WeakPolarHBondContact O-CA 3.49Å; E192-A794 PolarHBondContact N-O 3.36Å; E192-A794 PolarHBondContact O-N 3.35Å
193	M	92.9	Very high	86.3	Confident	24 Å²	24	50.1 Å²	50.1	12%	0.118	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	140.9	176.8	-179.4	-173.4	-179	0	0	110	L117 F118 I177 Y178 V791 S792	L117-M193 HydrophobicContact CD1-CE 4.23Å; L117-M193 HydrophobicContact CD1-SD 4.38Å; F118-M193 HydrophobicContact CZ-CB 3.97Å; I177-M193 HydrophobicContact CG2-CB 4.01Å; I177-M193 HydrophobicContact CG2-CG 4.26Å; I177-M193 WeakPolarHBondContact CG2-O 3.44Å; I177-M193 HydrophobicContact CG2-SD 4.47Å; Y178-M193 HydrophobicContact CD2-SD 4.09Å; Y178-M193 PolarHBondContact N-SD 2.99Å; Y178-M193 WeakPolarHBondContact O-CB 3.23Å; Y178-M193 PolarHBondContact O-N 2.75Å; M193-V791 HydrophobicContact CE-CG1 3.41Å; M193-V791 VanDerWaalsContact CE-CG1 3.41Å; M193-V791 HydrophobicContact CG-CG1 4.27Å; M193-S792 CarbonylContact C-O 3.59Å; M193-S792 VanDerWaalsContact CA-O 3.26Å; M193-S792 WeakPolarHBondContact CA-O 3.4Å
194	A	89.1	Confident	85.9	Confident	37 Å²	37	51.6 Å²	51.6	31%	0.306	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	147	172.6	0	0	0	0	0	110	V791 S792	A194-V791 WeakPolarHBondContact O-CA 3.22Å; A194-S792 PolarHBondContact N-O 2.65Å; A194-S792 PolarHBondContact O-N 2.7Å
195	R	88.6	Confident	86	Confident	20 Å²	20	54.7 Å²	54.7	8%	0.075	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123.5	171.4	-173.2	-175.6	-56.3	125.7	3.5	108.9	D175 P176 I177 Y789 F790 V791	D175-R195 VanDerWaalsContact O-CZ 3.27Å; D175-R195 PolarHBondContact O-NH1 3.37Å; D175-R195 PolarHBondContact O-NH2 3.49Å; P176-R195 PolarHBondContact O-NH2 3.47Å; I177-R195 HydrophobicContact CD1-CB 4.16Å; I177-R195 HydrophobicContact CG1-CB 4.38Å; R195-Y789 HydrophobicContact CG-CD2 3.79Å; R195-Y789 HydrophobicContact CG-CE2 4.22Å; R195-F790 WeakPolarHBondContact CA-O 3.5Å; R195-V791 HydrophobicContact CG-CG2 4.07Å
196	L	87.4	Confident	86.5	Confident	81 Å²	81	49.2 Å²	49.2	42%	0.424	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	150.8	-174.4	-66.9	169.2	0	0	0	110.6	Y789 F790	L196-Y789 WeakPolarHBondContact O-CA 3.21Å; L196-Y789 WeakPolarHBondContact O-CB 3.32Å; L196-F790 HydrophobicContact CB-CD1 4.24Å; L196-F790 HydrophobicContact CB-CE1 3.54Å; L196-F790 HydrophobicContact CB-CZ 3.72Å; L196-F790 HydrophobicContact CD1-CE1 4.37Å; L196-F790 HydrophobicContact CD1-CZ 3.79Å; L196-F790 HydrophobicContact CG-CZ 4.28Å; L196-F790 PolarHBondContact N-O 3.03Å; L196-F790 VanDerWaalsContact N-O 3.11Å; L196-F790 WeakPolarHBondContact O-CD1 3.25Å; L196-F790 PolarHBondContact O-N 3.43Å
197	P	87.9	Confident	86.8	Confident	21 Å²	21	51.2 Å²	51.2	14%	0.136	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	143.6	170.6	-21.7	32	0	0	0	111.5	A170 V171 S199 C200	A170-P197 HydrophobicContact CB-CG 3.94Å; V171-P197 HydrophobicContact CG2-CB 4.41Å; V171-P197 HydrophobicContact CG2-CG 3.88Å; P197-S199 WeakPolarHBondContact CB-OG 3.25Å; P197-S199 PolarHBondContact O-N 2.57Å; P197-C200 WeakPolarHBondContact O-CB 3.43Å; P197-C200 PolarHBondContact O-N 2.8Å
198	L	86.2	Confident	86.8	Confident	36 Å²	36	53.1 Å²	53.1	19%	0.188	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-61.1	-25.5	174.8	-77	171.3	0	0	0	112.2	C200 L201 L783 G788 F790	L198-C200 PolarHBondContact O-N 3.17Å; L198-L201 HydrophobicContact CD2-CD2 4.16Å; L198-L201 WeakPolarHBondContact O-CB 3.31Å; L198-L201 PolarHBondContact O-N 3.35Å; L198-L783 HydrophobicContact CD2-CB 4.39Å; L198-L783 HydrophobicContact CD2-CD2 4.32Å; L198-G788 PolarHBondContact N-O 2.89Å; L198-F790 HydrophobicContact CD2-CB 3.97Å; L198-F790 HydrophobicContact CD2-CD1 4.2Å
199	S	80.8	Confident	86.8	Confident	111 Å²	111	51.7 Å²	51.7	78%	0.776	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-64.7	-19.5	175.3	58.3	0	0	0	0	114	P197 L201	P197-S199 WeakPolarHBondContact CB-OG 3.25Å; P197-S199 PolarHBondContact O-N 2.57Å; S199-L201 VanDerWaalsContact C-N 3.32Å
200	C	81	Confident	86.7	Confident	79 Å²	79	51.7 Å²	51.7	53%	0.534	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-87.4	-5.6	175.7	-61.7	0	0	0	0	112.3	P197 L198 N202	P197-C200 WeakPolarHBondContact O-CB 3.43Å; P197-C200 PolarHBondContact O-N 2.8Å; L198-C200 PolarHBondContact O-N 3.17Å; C200-N202 PolarHBondContact O-N 2.83Å
201	L	77.3	Confident	86.5	Confident	29 Å²	29	52.5 Å²	52.5	15%	0.152	29%	0.291	C	S	.	.			trans	-81.7	111.2	-173.6	-166.7	74.1	0	0	0	111	L198 S199 C203 W209 L783 F790	L198-L201 HydrophobicContact CD2-CD2 4.16Å; L198-L201 WeakPolarHBondContact O-CB 3.31Å; L198-L201 PolarHBondContact O-N 3.35Å; S199-L201 VanDerWaalsContact C-N 3.32Å; L201-C203 VanDerWaalsContact C-N 3.31Å; L201-C203 HydrophobicContact CD1-CB 3.93Å; L201-C203 HydrophobicContact CD2-CB 4.39Å; L201-C203 VanDerWaalsContact CD2-O 3.3Å; L201-C203 WeakPolarHBondContact CD2-O 3.1Å; L201-C203 HydrophobicContact CG-CB 3.95Å; L201-W209 HydrophobicContact CD1-CH2 3.32Å; L201-W209 HydrophobicContact CD1-CZ2 3.36Å; L201-W209 HydrophobicContact CD1-CZ3 4.4Å; L201-W209 HydrophobicContact CD2-CZ2 3.87Å; L201-W209 HydrophobicContact CG-CZ2 4.18Å; L201-L783 HydrophobicContact CD2-CD2 4.36Å; L201-F790 HydrophobicContact CB-CD1 4.48Å; L201-F790 HydrophobicContact CB-CE1 4.19Å; L201-F790 HydrophobicContact CD1-CD1 3.94Å; L201-F790 HydrophobicContact CD1-CE1 3.53Å; L201-F790 HydrophobicContact CD1-CE2 4.27Å; L201-F790 HydrophobicContact CD1-CG 4.43Å; L201-F790 HydrophobicContact CD1-CZ 3.71Å; L201-F790 HydrophobicContact CG-CE1 4.43Å
202	N	79.4	Confident	86.2	Confident	143 Å²	143	55.1 Å²	55.1	77%	0.765	30%	0.304	S	S	*	.			trans	-90.9	6.6	169.1	-72.7	-19.8	0	0	0	112.8	C200	C200-N202 PolarHBondContact O-N 2.83Å
203	C	80.9	Confident	86.1	Confident	17 Å²	17	50.8 Å²	50.8	12%	0.115	28%	0.284	C	S	.	.			trans	-93.1	120.2	175.7	-54.9	0	0	0	0	109.3	L201 D208 W209 I212	L201-C203 VanDerWaalsContact C-N 3.31Å; L201-C203 HydrophobicContact CD1-CB 3.93Å; L201-C203 HydrophobicContact CD2-CB 4.39Å; L201-C203 VanDerWaalsContact CD2-O 3.3Å; L201-C203 WeakPolarHBondContact CD2-O 3.1Å; L201-C203 HydrophobicContact CG-CB 3.95Å; C203-D208 HydrophobicContact CB-CB 3.74Å; C203-W209 HydrophobicContact CB-CD2 4.34Å; C203-W209 HydrophobicContact CB-CZ2 4.08Å; C203-I212 WeakPolarHBondContact SG-CD1 3.25Å
204	H	78.7	Confident	85.9	Confident	138 Å²	138	54 Å²	54	64%	0.639	30%	0.295	S	S	*	.			trans	-107.9	-24.8	-178.1	-62.4	-50.4	0	0	0	112.4	D208	H204-D208 PolarHBondContact N-OD2 2.95Å
205	Y	84.7	Confident	85.8	Confident	79 Å²	79	57.1 Å²	57.1	31%	0.31	31%	0.31	S	S	.	.	S	Bend	trans	-134.1	162.8	-174	-51.5	-68.2	0	0	0	112	S207 D208 E295 A297	Y205-S207 PolarHBondContact O-N 3.48Å; Y205-D208 PolarHBondContact N-OD2 3.47Å; Y205-D208 WeakPolarHBondContact O-CB 3.41Å; Y205-D208 PolarHBondContact O-N 3.04Å; Y205-E295 HydrophobicContact CD1-CB 4.38Å; Y205-A297 VanDerWaalsContact CE1-N 3.26Å; Y205-A297 WeakPolarHBondContact OH-CB 3.35Å; Y205-A297 PolarHBondContact OH-N 3.37Å
206	L	87.9	Confident	85.7	Confident	6 Å²	6	60.7 Å²	60.7	3%	0.031	33%	0.327	C	S	.	.	H	α-helix	trans	-52.4	-35.7	174.4	175.8	63.5	0	0	0	113.3	D208 W209 V210 V229 L293 E295 Y759 L761	L206-D208 PolarHBondContact O-N 2.8Å; L206-W209 WeakPolarHBondContact O-CB 3.47Å; L206-W209 PolarHBondContact O-N 2.9Å; L206-V210 HydrophobicContact CD1-CG2 4.47Å; L206-V210 HydrophobicContact CG-CG2 4.48Å; L206-V210 WeakPolarHBondContact O-CG2 3.35Å; L206-V210 PolarHBondContact O-N 2.94Å; L206-V229 HydrophobicContact CD1-CG1 3.75Å; L206-V229 HydrophobicContact CD1-CG2 4.36Å; L206-V229 HydrophobicContact CD2-CG1 3.94Å; L206-V229 HydrophobicContact CD2-CG2 4.29Å; L206-V229 HydrophobicContact CG-CG1 4.48Å; L206-L293 HydrophobicContact CD2-CB 3.96Å; L206-L293 HydrophobicContact CD2-CD1 3.58Å; L206-L293 HydrophobicContact CD2-CG 4.43Å; L206-E295 HydrophobicContact CB-CG 4.26Å; L206-E295 WeakPolarHBondContact CB-OE2 3.44Å; L206-E295 PolarHBondContact N-OE2 3.25Å; L206-Y759 HydrophobicContact CD1-CD1 3.71Å; L206-Y759 HydrophobicContact CD1-CE1 3.95Å; L206-Y759 HydrophobicContact CD1-CG 4.43Å; L206-L761 HydrophobicContact CD1-CD2 4.18Å
207	S	87.9	Confident	85.7	Confident	59 Å²	59	56.8 Å²	56.8	41%	0.413	31%	0.307	S	S	.	.	H	α-helix	trans	-58.7	-36.9	177.2	53.1	0	0	0	0	112.5	Y205 W209 V210 D211	Y205-S207 PolarHBondContact O-N 3.48Å; S207-W209 VanDerWaalsContact C-N 3.32Å; S207-W209 PolarHBondContact O-N 3.43Å; S207-V210 WeakPolarHBondContact O-CB 3.15Å; S207-V210 PolarHBondContact O-N 3.29Å; S207-D211 WeakPolarHBondContact O-CB 3.28Å; S207-D211 VanDerWaalsContact O-CG 3.28Å; S207-D211 PolarHBondContact O-N 2.91Å
208	D	89.5	Confident	85	Confident	46 Å²	46	59.2 Å²	59.2	25%	0.246	33%	0.329	C	S	.	.	H	α-helix	trans	-68.4	-37.1	-178.7	-51.8	-34.4	0	0	0	110.6	C203 H204 Y205 L206 D211 I212	C203-D208 HydrophobicContact CB-CB 3.74Å; H204-D208 PolarHBondContact N-OD2 2.95Å; Y205-D208 PolarHBondContact N-OD2 3.47Å; Y205-D208 WeakPolarHBondContact O-CB 3.41Å; Y205-D208 PolarHBondContact O-N 3.04Å; L206-D208 PolarHBondContact O-N 2.8Å; D208-D211 PolarHBondContact O-N 3.36Å; D208-I212 WeakPolarHBondContact O-CG1 3.42Å; D208-I212 PolarHBondContact O-N 3.36Å
209	W	90.1	Very high	84	Confident	7 Å²	7	59 Å²	59	3%	0.027	33%	0.329	C	S	.	.	H	α-helix	trans	-68.8	-39.5	175	-69.8	112	0	0	0	112.8	L201 C203 L206 S207 D211 I212 F213 L761 M779 I781 L783 F790	L201-W209 HydrophobicContact CD1-CH2 3.32Å; L201-W209 HydrophobicContact CD1-CZ2 3.36Å; L201-W209 HydrophobicContact CD1-CZ3 4.4Å; L201-W209 HydrophobicContact CD2-CZ2 3.87Å; L201-W209 HydrophobicContact CG-CZ2 4.18Å; C203-W209 HydrophobicContact CB-CD2 4.34Å; C203-W209 HydrophobicContact CB-CZ2 4.08Å; L206-W209 WeakPolarHBondContact O-CB 3.47Å; L206-W209 PolarHBondContact O-N 2.9Å; S207-W209 VanDerWaalsContact C-N 3.32Å; S207-W209 PolarHBondContact O-N 3.43Å; W209-D211 VanDerWaalsContact C-N 3.31Å; W209-I212 HydrophobicContact CE3-CD1 4.25Å; W209-I212 HydrophobicContact CZ3-CD1 4.36Å; W209-I212 PolarHBondContact O-N 3Å; W209-F213 WeakPolarHBondContact O-CB 3.41Å; W209-F213 PolarHBondContact O-N 2.93Å; W209-L761 HydrophobicContact CB-CD1 4.38Å; W209-M779 HydrophobicContact CE3-CE 4.37Å; W209-I781 HydrophobicContact CB-CD1 3.81Å; W209-I781 HydrophobicContact CD2-CD1 3.64Å; W209-I781 HydrophobicContact CD2-CG1 4.24Å; W209-I781 HydrophobicContact CD2-CG2 4.13Å; W209-I781 HydrophobicContact CE3-CD1 3.4Å; W209-I781 VanDerWaalsContact CE3-CD1 3.4Å; W209-I781 HydrophobicContact CE3-CG1 3.76Å; W209-I781 HydrophobicContact CE3-CG2 4.13Å; W209-I781 HydrophobicContact CG-CD1 3.84Å; W209-I781 HydrophobicContact CH2-CG2 3.79Å; W209-I781 HydrophobicContact CZ2-CG2 3.81Å; W209-I781 HydrophobicContact CZ3-CD1 4.16Å; W209-I781 HydrophobicContact CZ3-CG1 3.99Å; W209-I781 HydrophobicContact CZ3-CG2 3.97Å; W209-L783 HydrophobicContact CH2-CD2 4.31Å; W209-L783 HydrophobicContact CZ2-CD2 3.62Å; W209-F790 AromaticContact CH2-CD2 3.74Å; W209-F790 HydrophobicContact CH2-CD2 3.74Å; W209-F790 AromaticContact CH2-CE2 3.69Å; W209-F790 HydrophobicContact CH2-CE2 3.69Å; W209-F790 HydrophobicContact CH2-CG 4.37Å; W209-F790 HydrophobicContact CH2-CZ 4.26Å; W209-F790 HydrophobicContact CZ3-CD2 4.49Å; W209-F790 HydrophobicContact CZ3-CE2 4.21Å
210	V	90.2	Very high	82.9	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.024	33%	0.328	C	S	.	.	H	α-helix	trans	-61	-43.4	172.3	161.9	0	0	0	0	110.6	L206 S207 F213 R214 V227 E290	L206-V210 HydrophobicContact CD1-CG2 4.47Å; L206-V210 HydrophobicContact CG-CG2 4.48Å; L206-V210 WeakPolarHBondContact O-CG2 3.35Å; L206-V210 PolarHBondContact O-N 2.94Å; S207-V210 WeakPolarHBondContact O-CB 3.15Å; S207-V210 PolarHBondContact O-N 3.29Å; V210-F213 WeakPolarHBondContact O-CB 3.31Å; V210-F213 PolarHBondContact O-N 3.29Å; V210-R214 WeakPolarHBondContact O-CG 3.39Å; V210-R214 PolarHBondContact O-N 2.88Å; V210-V227 HydrophobicContact CG1-CG2 4.32Å; V210-E290 WeakPolarHBondContact CG1-OE2 3.41Å
211	D	87.9	Confident	81.8	Confident	76 Å²	76	62.8 Å²	62.8	41%	0.406	33%	0.331	S	S	.	.	H	α-helix	trans	-69.5	-37.7	-179.4	-72.2	-20.8	0	0	0	112.1	S207 D208 W209 R214 T215	S207-D211 WeakPolarHBondContact O-CB 3.28Å; S207-D211 VanDerWaalsContact O-CG 3.28Å; S207-D211 PolarHBondContact O-N 2.91Å; D208-D211 PolarHBondContact O-N 3.36Å; W209-D211 VanDerWaalsContact C-N 3.31Å; D211-R214 PolarHBondContact O-N 3.23Å; D211-R214 IonicContact OD1-CZ 2.96Å; D211-R214 IonicContact OD1-NH1 2.97Å; D211-R214 PolarHBondContact OD1-NH1 3.27Å; D211-T215 WeakPolarHBondContact O-CB 3.06Å; D211-T215 PolarHBondContact O-N 3.36Å; D211-T215 PolarHBondContact O-OG1 3.25Å
212	I	88.8	Confident	80.8	Confident	54 Å²	54	66.4 Å²	66.4	28%	0.277	36%	0.364	S	S	.	.	H	α-helix	trans	-58.6	-49.8	168.1	-72.7	174.8	0	0	0	109.8	C203 D208 W209 R214 T215 E216 M779	C203-I212 WeakPolarHBondContact SG-CD1 3.25Å; D208-I212 WeakPolarHBondContact O-CG1 3.42Å; D208-I212 PolarHBondContact O-N 3.36Å; W209-I212 HydrophobicContact CE3-CD1 4.25Å; W209-I212 HydrophobicContact CZ3-CD1 4.36Å; W209-I212 PolarHBondContact O-N 3Å; I212-R214 VanDerWaalsContact C-N 3.31Å; I212-R214 PolarHBondContact O-N 3.03Å; I212-T215 CarbonylContact O-C 3.52Å; I212-T215 WeakPolarHBondContact O-CA 3.38Å; I212-T215 WeakPolarHBondContact O-CB 3.33Å; I212-T215 PolarHBondContact O-N 2.78Å; I212-E216 HydrophobicContact CG2-CG 4.15Å; I212-E216 WeakPolarHBondContact O-CG 3.45Å; I212-E216 PolarHBondContact O-N 2.55Å; I212-M779 HydrophobicContact CG2-CE 3.99Å
213	F	91.3	Very high	80.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-59.6	-41.9	-178.5	-177.5	-140.6	0	0	0	112.2	W209 V210 T215 E216 V217 V227 L761 W763 Q777 M779 L796	W209-F213 WeakPolarHBondContact O-CB 3.41Å; W209-F213 PolarHBondContact O-N 2.93Å; V210-F213 WeakPolarHBondContact O-CB 3.31Å; V210-F213 PolarHBondContact O-N 3.29Å; F213-T215 VanDerWaalsContact C-N 3.33Å; F213-T215 PolarHBondContact O-N 2.86Å; F213-E216 PolarHBondContact O-N 3.27Å; F213-V217 HydrophobicContact CD2-CG2 4.01Å; F213-V217 HydrophobicContact CE2-CG2 3.76Å; F213-V217 HydrophobicContact CZ-CG2 4.29Å; F213-V217 WeakPolarHBondContact O-CB 3.4Å; F213-V217 WeakPolarHBondContact O-CG2 2.93Å; F213-V217 PolarHBondContact O-N 3.31Å; F213-V227 HydrophobicContact CD1-CG1 4.09Å; F213-V227 HydrophobicContact CD1-CG2 4.33Å; F213-V227 HydrophobicContact CE1-CG1 4.16Å; F213-L761 HydrophobicContact CB-CD1 3.94Å; F213-L761 HydrophobicContact CD1-CB 3.83Å; F213-L761 HydrophobicContact CD1-CD1 4.13Å; F213-L761 HydrophobicContact CE1-CB 3.95Å; F213-L761 HydrophobicContact CG-CB 4.49Å; F213-L761 HydrophobicContact CG-CD1 4.24Å; F213-W763 HydrophobicContact CE1-CB 3.64Å; F213-W763 HydrophobicContact CE1-CE3 4.45Å; F213-W763 HydrophobicContact CZ-CB 4.11Å; F213-Q777 HydrophobicContact CE2-CB 4.07Å; F213-Q777 HydrophobicContact CZ-CB 3.63Å; F213-M779 HydrophobicContact CB-SD 3.76Å; F213-M779 HydrophobicContact CD2-CB 3.56Å; F213-M779 HydrophobicContact CD2-CG 4.36Å; F213-M779 HydrophobicContact CD2-SD 4.03Å; F213-M779 HydrophobicContact CE2-CB 3.76Å; F213-M779 HydrophobicContact CG-CB 4.04Å; F213-M779 HydrophobicContact CG-SD 4.17Å; F213-M779 HydrophobicContact CZ-CB 4.36Å; F213-L796 HydrophobicContact CE2-CD2 4.15Å
214	R	88.4	Confident	79.2	Confident	92 Å²	92	66.5 Å²	66.5	35%	0.347	37%	0.373	S	S	.	.	H	α-helix	trans	-63.2	-39.6	173.5	-70.8	174.5	-174.5	147.9	-5.3	112.3	V210 D211 I212 V217 A218 E290 W763	V210-R214 WeakPolarHBondContact O-CG 3.39Å; V210-R214 PolarHBondContact O-N 2.88Å; D211-R214 PolarHBondContact O-N 3.23Å; D211-R214 IonicContact OD1-CZ 2.96Å; D211-R214 IonicContact OD1-NH1 2.97Å; D211-R214 PolarHBondContact OD1-NH1 3.27Å; I212-R214 VanDerWaalsContact C-N 3.31Å; I212-R214 PolarHBondContact O-N 3.03Å; R214-V217 PolarHBondContact O-N 2.75Å; R214-A218 PolarHBondContact O-N 3.17Å; R214-A218 VanDerWaalsContact O-N 3.11Å; R214-E290 IonicContact CZ-OE1 3.92Å; R214-E290 IonicContact CZ-OE2 3.82Å; R214-E290 IonicContact NH2-OE1 2.71Å; R214-E290 PolarHBondContact NH2-OE1 3.06Å; R214-E290 IonicContact NH2-OE2 3.94Å; R214-E290 PolarHBondContact NH2-OE2 3.34Å; R214-W763 HydrophobicContact CB-CZ3 4.41Å; R214-W763 HydrophobicContact CG-CH2 4.03Å; R214-W763 HydrophobicContact CG-CZ3 3.98Å
215	T	87.7	Confident	79.1	Confident	101 Å²	101	63.9 Å²	63.9	62%	0.62	36%	0.361	S	S	*	.	H	α-helix	trans	-65.3	-43.5	178.2	-56.6	0	0	0	0	111.4	D211 I212 F213 A218	D211-T215 WeakPolarHBondContact O-CB 3.06Å; D211-T215 PolarHBondContact O-N 3.36Å; D211-T215 PolarHBondContact O-OG1 3.25Å; I212-T215 CarbonylContact O-C 3.52Å; I212-T215 WeakPolarHBondContact O-CA 3.38Å; I212-T215 WeakPolarHBondContact O-CB 3.33Å; I212-T215 PolarHBondContact O-N 2.78Å; F213-T215 VanDerWaalsContact C-N 3.33Å; F213-T215 PolarHBondContact O-N 2.86Å; T215-A218 WeakPolarHBondContact O-CA 3.32Å; T215-A218 WeakPolarHBondContact O-CB 3.37Å; T215-A218 PolarHBondContact O-N 3Å
216	E	86.2	Confident	79.2	Confident	95 Å²	95	61 Å²	61	44%	0.444	35%	0.352	S	S	.	.	H	α-helix	trans	-65.9	-39.1	177.3	-69.3	-60.2	155	0	0	112.3	I212 F213 A218 L796	I212-E216 HydrophobicContact CG2-CG 4.15Å; I212-E216 WeakPolarHBondContact O-CG 3.45Å; I212-E216 PolarHBondContact O-N 2.55Å; F213-E216 PolarHBondContact O-N 3.27Å; E216-A218 PolarHBondContact O-N 2.92Å; E216-L796 HydrophobicContact CB-CD1 4.39Å
217	V	86	Confident	79.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65.9	-29.3	175.3	170.3	0	0	0	0	111.5	F213 R214 T219 W763 V765 R767 Q777 L796	F213-V217 HydrophobicContact CD2-CG2 4.01Å; F213-V217 HydrophobicContact CE2-CG2 3.76Å; F213-V217 HydrophobicContact CZ-CG2 4.29Å; F213-V217 WeakPolarHBondContact O-CB 3.4Å; F213-V217 WeakPolarHBondContact O-CG2 2.93Å; F213-V217 PolarHBondContact O-N 3.31Å; R214-V217 PolarHBondContact O-N 2.75Å; V217-T219 VanDerWaalsContact C-N 3.34Å; V217-T219 HydrophobicContact CG1-CG2 3.62Å; V217-T219 PolarHBondContact O-N 3.37Å; V217-W763 HydrophobicContact CB-CE3 4.31Å; V217-W763 HydrophobicContact CB-CZ3 3.93Å; V217-W763 HydrophobicContact CG1-CE3 4.07Å; V217-W763 HydrophobicContact CG1-CZ3 3.69Å; V217-W763 HydrophobicContact CG2-CE3 4.1Å; V217-W763 HydrophobicContact CG2-CZ3 4.21Å; V217-V765 HydrophobicContact CG1-CG1 3.87Å; V217-R767 PolarHBondContact O-NE 3.37Å; V217-Q777 HydrophobicContact CG1-CG 4.37Å; V217-Q777 HydrophobicContact CG2-CB 4.14Å; V217-Q777 HydrophobicContact CG2-CG 4.13Å; V217-L796 HydrophobicContact CG2-CD2 3.77Å
218	A	73.8	Confident	79.7	Confident	71 Å²	71	59.7 Å²	59.7	59%	0.587	34%	0.342	S	S	*	.			trans	47.2	44	170	0	0	0	0	0	115.2	R214 T215 E216	R214-A218 PolarHBondContact O-N 3.17Å; R214-A218 VanDerWaalsContact O-N 3.11Å; T215-A218 WeakPolarHBondContact O-CA 3.32Å; T215-A218 WeakPolarHBondContact O-CB 3.37Å; T215-A218 PolarHBondContact O-N 3Å; E216-A218 PolarHBondContact O-N 2.92Å
219	T	64.8	Low	79.9	Confident	32 Å²	32	57.5 Å²	57.5	20%	0.196	33%	0.331	C	S	.	.			trans	-71	141.9	178.6	57.5	0	0	0	0	111.6	V217 E221 V765 R767	V217-T219 VanDerWaalsContact C-N 3.34Å; V217-T219 HydrophobicContact CG1-CG2 3.62Å; V217-T219 PolarHBondContact O-N 3.37Å; T219-E221 PolarHBondContact O-N 2.82Å; T219-E221 PolarHBondContact OG1-O 3.39Å; T219-V765 HydrophobicContact CG2-CG1 4.18Å; T219-V765 HydrophobicContact CG2-CG2 3.7Å; T219-R767 HydrophobicContact CG2-CB 4.45Å; T219-R767 HydrophobicContact CG2-CG 4.45Å
220	L	58.8	Low	80.2	Confident	145 Å²	145	57.2 Å²	57.2	76%	0.759	33%	0.33	S	S	*	.	S	Bend	trans	-61	-25.4	179.5	-83	155.7	0	0	0	113.7
221	E	58.5	Low	80.4	Confident	125 Å²	125	57.1 Å²	57.1	58%	0.584	33%	0.329	S	S	*	.	S	Bend	trans	-140.3	155	179.7	-68.2	-172.8	164.7	0	0	111.8	T219 S223 N770	T219-E221 PolarHBondContact O-N 2.82Å; T219-E221 PolarHBondContact OG1-O 3.39Å; E221-S223 PolarHBondContact O-N 2.8Å; E221-N770 PolarHBondContact OE2-ND2 2.81Å
222	A	55.4	Low	80.7	Confident	104 Å²	104	54.3 Å²	54.3	86%	0.86	31%	0.313	S	S	*	.			trans	-71.7	116.4	-178.9	0	0	0	0	0	110.9
223	S	63.8	Low	81	Confident	32 Å²	32	53.2 Å²	53.2	22%	0.224	31%	0.305	C	S	.	.			trans	-72.5	146.3	170.4	97	0	0	0	0	110.5	E221 E225 W763	E221-S223 PolarHBondContact O-N 2.8Å; S223-E225 VanDerWaalsContact C-N 3.3Å; S223-E225 PolarHBondContact O-N 2.78Å; S223-W763 WeakPolarHBondContact OG-CZ2 3.42Å; S223-W763 PolarHBondContact OG-NE1 3.21Å
224	P	62.8	Low	81.1	Confident	130 Å²	130	53.4 Å²	53.4	84%	0.844	31%	0.307	S	S	*	.	S	Bend	trans	-77.9	-10.6	-179.9	31.2	-35.3	0	0	0	114.1
225	E	77	Confident	81.3	Confident	83 Å²	83	50.9 Å²	50.9	39%	0.388	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-87.5	136.3	-177.2	-76.7	-173.3	-161	0	0	111.8	S223 W763 R774	S223-E225 VanDerWaalsContact C-N 3.3Å; S223-E225 PolarHBondContact O-N 2.78Å; E225-W763 PolarHBondContact O-NE1 3.5Å; E225-R774 IonicContact OE1-CZ 3.7Å; E225-R774 IonicContact OE1-NH1 3.21Å; E225-R774 PolarHBondContact OE1-NH1 2.93Å; E225-R774 IonicContact OE1-NH2 3.24Å; E225-R774 PolarHBondContact OE1-NH2 2.8Å; E225-R774 IonicContact OE2-CZ 2.76Å; E225-R774 IonicContact OE2-NH2 3.27Å; E225-R774 PolarHBondContact OE2-NH2 3.29Å
226	S	86.6	Confident	81.3	Confident	18 Å²	18	47.2 Å²	47.2	13%	0.126	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-77.6	149	176.1	8.8	0	0	0	0	112	N289 E290 E291	S226-N289 WeakPolarHBondContact CB-ND2 3.34Å; S226-N289 WeakPolarHBondContact CB-OD1 3.49Å; S226-N289 PolarHBondContact OG-ND2 3.4Å; S226-N289 PolarHBondContact OG-OD1 3.22Å; S226-N289 VanDerWaalsContact OG-OD1 3.07Å; S226-E290 WeakPolarHBondContact CA-OE1 3.24Å; S226-E291 VanDerWaalsContact CB-OE1 3.22Å; S226-E291 WeakPolarHBondContact CB-OE1 3.41Å; S226-E291 PolarHBondContact OG-OE1 2.78Å
227	V	91.5	Very high	81.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-64.6	136.3	172.5	-177.3	0	0	0	0	109.7	V210 F213 V229 E290 L761 W763	V210-V227 HydrophobicContact CG1-CG2 4.32Å; F213-V227 HydrophobicContact CD1-CG1 4.09Å; F213-V227 HydrophobicContact CD1-CG2 4.33Å; F213-V227 HydrophobicContact CE1-CG1 4.16Å; V227-V229 HydrophobicContact CG1-CG2 4.43Å; V227-E290 HydrophobicContact CB-CB 4.4Å; V227-E290 HydrophobicContact CB-CG 4.35Å; V227-E290 WeakPolarHBondContact CB-OE2 3.41Å; V227-E290 WeakPolarHBondContact CG2-OE2 3.11Å; V227-E290 VanDerWaalsContact N-CD 3.26Å; V227-E290 PolarHBondContact N-OE1 3.43Å; V227-E290 WeakPolarHBondContact O-CB 3.46Å; V227-E290 PolarHBondContact O-N 3.2Å; V227-L761 HydrophobicContact CG1-CB 3.92Å; V227-L761 HydrophobicContact CG1-CD2 4.46Å; V227-W763 HydrophobicContact CG2-CB 4.35Å; V227-W763 HydrophobicContact CG2-CD2 4.22Å; V227-W763 HydrophobicContact CG2-CG 4.1Å
228	V	94.3	Very high	80.6	Confident	38 Å²	38	47.1 Å²	47.1	23%	0.23	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.4	172.4	179.5	0	0	0	0	108.8	N287 R288 L761 R762	V228-N287 HydrophobicContact CG1-CB 3.96Å; V228-R288 CarbonylContact C-O 3.59Å; V228-R288 WeakPolarHBondContact CA-O 3.46Å; V228-L761 WeakPolarHBondContact O-CA 3.46Å; V228-R762 PolarHBondContact N-O 2.98Å; V228-R762 PolarHBondContact O-N 2.84Å
229	V	94.8	Very high	80	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128.4	-176.9	-175.6	0	0	0	0	110.3	L206 V227 N287 R288 E290 L293 Y759 L761	L206-V229 HydrophobicContact CD1-CG1 3.75Å; L206-V229 HydrophobicContact CD1-CG2 4.36Å; L206-V229 HydrophobicContact CD2-CG1 3.94Å; L206-V229 HydrophobicContact CD2-CG2 4.29Å; L206-V229 HydrophobicContact CG-CG1 4.48Å; V227-V229 HydrophobicContact CG1-CG2 4.43Å; V229-N287 PolarHBondContact O-N 2.91Å; V229-R288 PolarHBondContact N-O 2.95Å; V229-R288 PolarHBondContact O-N 3.01Å; V229-E290 HydrophobicContact CG2-CB 4.19Å; V229-L293 HydrophobicContact CB-CD1 3.73Å; V229-L293 HydrophobicContact CG1-CD1 3.99Å; V229-L293 HydrophobicContact CG2-CD1 4.13Å; V229-Y759 HydrophobicContact CG1-CD1 4.45Å; V229-L761 HydrophobicContact CB-CD2 4.21Å; V229-L761 HydrophobicContact CG1-CD2 3.9Å; V229-L761 HydrophobicContact CG2-CD2 3.78Å
230	S	95.6	Very high	79.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	136.1	161.1	-59.2	0	0	0	0	109.3	T103 W285 N287 Y759 I760	T103-S230 VanDerWaalsContact CB-OG 3.27Å; T103-S230 WeakPolarHBondContact CB-OG 2.83Å; T103-S230 PolarHBondContact OG1-OG 3.47Å; S230-W285 CarbonylContact C-O 3.52Å; S230-W285 VanDerWaalsContact CA-O 3.24Å; S230-W285 WeakPolarHBondContact CA-O 2.92Å; S230-N287 PolarHBondContact OG-N 3.32Å; S230-Y759 CarbonylContact O-C 3.5Å; S230-Y759 WeakPolarHBondContact O-CA 3.39Å; S230-I760 PolarHBondContact N-O 3.13Å; S230-I760 PolarHBondContact O-N 3.22Å
231	A	94.9	Very high	79.2	Confident	2 Å²	2	41 Å²	41	2%	0.017	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	148.9	-175.7	0	0	0	0	0	111.9	V284 W285 L302 R758 Y759	A231-V284 WeakPolarHBondContact O-CA 3.34Å; A231-W285 HydrophobicContact CB-CE3 4.23Å; A231-W285 PolarHBondContact N-O 3.45Å; A231-W285 PolarHBondContact O-N 2.84Å; A231-L302 HydrophobicContact CB-CD1 3.9Å; A231-R758 CarbonylContact C-O 3.57Å; A231-R758 WeakPolarHBondContact CA-O 3.4Å; A231-Y759 HydrophobicContact CB-CD1 3.85Å; A231-Y759 HydrophobicContact CB-CE1 4.01Å
232	R	94.8	Very high	78.5	Confident	18 Å²	18	36.5 Å²	36.5	7%	0.068	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.9	165.4	176.9	-169.9	65.5	-173.7	14.1	109.3	L108 T234 M282 I283 V284 N756 E757 R758 E782	L108-R232 HydrophobicContact CD2-CB 4.47Å; L108-R232 WeakPolarHBondContact O-CD 3.38Å; L108-R232 PolarHBondContact O-NE 3.37Å; L108-R232 PolarHBondContact O-NH1 3.13Å; R232-T234 PolarHBondContact NE-OG1 3.27Å; R232-M282 HydrophobicContact CG-CB 4.49Å; R232-I283 CarbonylContact C-O 3.46Å; R232-I283 VanDerWaalsContact CA-O 3.24Å; R232-I283 WeakPolarHBondContact CA-O 3.34Å; R232-V284 HydrophobicContact CG-CG2 4.32Å; R232-N756 PolarHBondContact NH2-OD1 2.92Å; R232-E757 CarbonylContact O-C 3.58Å; R232-E757 WeakPolarHBondContact O-CA 3.47Å; R232-R758 HydrophobicContact CB-CB 4.28Å; R232-R758 PolarHBondContact N-O 3.44Å; R232-R758 VanDerWaalsContact NH2-CZ 3.34Å; R232-R758 PolarHBondContact O-N 3.33Å; R232-E782 IonicContact NH2-OE1 3.21Å; R232-E782 PolarHBondContact NH2-OE1 2.92Å
233	R	93.5	Very high	77.8	Confident	30 Å²	30	41.4 Å²	41.4	11%	0.113	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	134.9	163.9	-67.5	-174.5	164.7	140	2.5	109.7	Y235 M282 I283 W285 E295 S300 L302 L754 E757	R233-Y235 HydrophobicContact CB-CE2 3.83Å; R233-M282 WeakPolarHBondContact O-CA 3.45Å; R233-I283 PolarHBondContact N-O 3.07Å; R233-I283 PolarHBondContact O-N 2.93Å; R233-W285 HydrophobicContact CB-CH2 4.46Å; R233-W285 HydrophobicContact CB-CZ3 4.15Å; R233-W285 HydrophobicContact CG-CH2 4.34Å; R233-W285 HydrophobicContact CG-CZ3 3.95Å; R233-E295 IonicContact CZ-OE1 3.04Å; R233-E295 IonicContact NH1-OE1 3.27Å; R233-E295 IonicContact NH2-OE1 3.85Å; R233-E295 PolarHBondContact NH2-OE1 2.85Å; R233-E295 IonicContact NH2-OE2 2.77Å; R233-S300 PolarHBondContact NH1-OG 3.47Å; R233-L302 PolarHBondContact NH1-O 3.35Å; R233-L754 HydrophobicContact CB-CD1 4.04Å; R233-L754 HydrophobicContact CG-CD1 4.43Å; R233-E757 HydrophobicContact CG-CG 4.16Å; R233-E757 IonicContact CZ-OE2 3.62Å; R233-E757 IonicContact NE-OE2 3.27Å; R233-E757 PolarHBondContact NE-OE2 3.49Å; R233-E757 IonicContact NH2-OE2 2.98Å; R233-E757 PolarHBondContact NH2-OE2 2.85Å
234	T	93.8	Very high	76.6	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.3	179	-45.1	0	0	0	0	109.7	R232 E280 L281 M282 I755 N756	R232-T234 PolarHBondContact NE-OG1 3.27Å; T234-E280 HydrophobicContact CG2-CB 4.18Å; T234-E280 HydrophobicContact CG2-CG 4.29Å; T234-L281 CarbonylContact C-O 3.5Å; T234-L281 WeakPolarHBondContact CA-O 3.28Å; T234-M282 HydrophobicContact CG2-CG 3.74Å; T234-I755 HydrophobicContact CG2-CD1 4.03Å; T234-I755 HydrophobicContact CG2-CG1 4.08Å; T234-I755 VanDerWaalsContact O-CG1 3.29Å; T234-I755 WeakPolarHBondContact O-CG1 3.42Å; T234-I755 PolarHBondContact O-N 2.86Å; T234-N756 PolarHBondContact N-O 3.01Å; T234-N756 PolarHBondContact O-N 3.25Å
235	Y	92	Very high	75.8	Confident	39 Å²	39	36.2 Å²	36.2	15%	0.153	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	134.2	176.1	-58.3	-92.4	0	0	0	109	R233 E280 L281 I283 F731 L733 A753 L754	R233-Y235 HydrophobicContact CB-CE2 3.83Å; Y235-E280 CarbonylContact O-C 3.34Å; Y235-E280 VanDerWaalsContact O-CA 3.28Å; Y235-E280 WeakPolarHBondContact O-CA 3.31Å; Y235-L281 PolarHBondContact N-O 3.28Å; Y235-L281 PolarHBondContact O-N 2.83Å; Y235-I283 HydrophobicContact CD2-CD1 4.41Å; Y235-I283 HydrophobicContact CE2-CD1 4.04Å; Y235-F731 WeakPolarHBondContact O-CE1 3.28Å; Y235-L733 HydrophobicContact CD1-CD2 4.06Å; Y235-L733 HydrophobicContact CD2-CD2 4.24Å; Y235-L733 HydrophobicContact CE1-CD2 4.02Å; Y235-L733 HydrophobicContact CE2-CD2 4.21Å; Y235-L733 HydrophobicContact CG-CD2 4.17Å; Y235-A753 CarbonylContact C-O 3.13Å; Y235-A753 VanDerWaalsContact CA-O 3.27Å; Y235-A753 WeakPolarHBondContact CA-O 3.1Å; Y235-L754 HydrophobicContact CD1-CB 4.1Å; Y235-L754 HydrophobicContact CD1-CD1 4.13Å; Y235-L754 HydrophobicContact CE1-CB 4.01Å; Y235-L754 HydrophobicContact CE1-CD1 3.79Å; Y235-L754 HydrophobicContact CE1-CG 4.44Å; Y235-L754 HydrophobicContact CE2-CD1 4.35Å
236	E	88.6	Confident	74.1	Confident	23 Å²	23	37.2 Å²	37.2	11%	0.107	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.6	173.3	-169.6	-177.7	-165.4	0	0	109.5	V238 F279 S752 A753 I755 K786	E236-V238 HydrophobicContact CG-CG2 3.75Å; E236-V238 WeakPolarHBondContact OE1-CG2 3.3Å; E236-F279 CarbonylContact C-O 3.49Å; E236-F279 WeakPolarHBondContact CA-O 3.46Å; E236-S752 WeakPolarHBondContact O-CA 3.45Å; E236-A753 PolarHBondContact N-O 2.62Å; E236-A753 PolarHBondContact O-N 2.75Å; E236-I755 HydrophobicContact CB-CB 4.41Å; E236-I755 HydrophobicContact CB-CD1 3.9Å; E236-I755 HydrophobicContact CB-CG1 4.03Å; E236-I755 HydrophobicContact CB-CG2 3.51Å; E236-I755 WeakPolarHBondContact OE2-CG2 3.35Å; E236-K786 VanDerWaalsContact CD-NZ 3.31Å; E236-K786 IonicContact OE1-NZ 3.53Å; E236-K786 PolarHBondContact OE1-NZ 2.76Å; E236-K786 IonicContact OE2-NZ 3.21Å; E236-K786 PolarHBondContact OE2-NZ 2.91Å
237	L	84.5	Confident	71.7	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	106.9	172.7	-171.8	76.5	0	0	0	108.3	H240 S278 F279 L730 F731 N750	L237-H240 WeakPolarHBondContact CD1-NE2 3.25Å; L237-H240 WeakPolarHBondContact CD2-CD2 3.45Å; L237-H240 WeakPolarHBondContact CD2-NE2 3.45Å; L237-H240 WeakPolarHBondContact CG-CD2 3.35Å; L237-H240 WeakPolarHBondContact CG-NE2 3Å; L237-S278 CarbonylContact O-C 3.57Å; L237-S278 VanDerWaalsContact O-CA 3.25Å; L237-S278 WeakPolarHBondContact O-CA 3.43Å; L237-F279 HydrophobicContact CB-CB 4.43Å; L237-F279 HydrophobicContact CD2-CD2 4.49Å; L237-F279 PolarHBondContact N-O 3.49Å; L237-F279 PolarHBondContact O-N 3.43Å; L237-L730 HydrophobicContact CD2-CD1 3.67Å; L237-L730 HydrophobicContact CD2-CD2 4.16Å; L237-L730 HydrophobicContact CD2-CG 3.56Å; L237-F731 HydrophobicContact CB-CD1 4.12Å; L237-F731 HydrophobicContact CB-CE1 3.54Å; L237-F731 HydrophobicContact CB-CE2 4.45Å; L237-F731 HydrophobicContact CB-CZ 3.73Å; L237-F731 HydrophobicContact CD2-CE2 4.38Å; L237-F731 HydrophobicContact CD2-CZ 4.46Å; L237-N750 HydrophobicContact CD1-CB 4.29Å
238	V	74	Confident	69.3	Low	93 Å²	93	40.4 Å²	40.4	56%	0.564	21%	0.212	S	C	*	.			trans	-96.8	138.2	-173.8	-176.4	0	0	0	0	110.8	E236	E236-V238 HydrophobicContact CG-CG2 3.75Å; E236-V238 WeakPolarHBondContact OE1-CG2 3.3Å
239	G	60.3	Low	66.6	Low	43 Å²	43	41.2 Å²	41.2	44%	0.443	22%	0.215	S	C	.	.			trans	79.8	29.1	159.4	0	0	0	0	0	115.9	S241	G239-S241 PolarHBondContact O-N 3.11Å; G239-S241 VanDerWaalsContact O-N 3.1Å
240	H	56.8	Low	63.9	Low	31 Å²	31	43.2 Å²	43.2	14%	0.144	23%	0.225	C	C	.	.			trans	-82.2	87.8	172	-74.5	-86.1	0	0	0	110.7	L237 C277 T687 N750	L237-H240 WeakPolarHBondContact CD1-NE2 3.25Å; L237-H240 WeakPolarHBondContact CD2-CD2 3.45Å; L237-H240 WeakPolarHBondContact CD2-NE2 3.45Å; L237-H240 WeakPolarHBondContact CG-CD2 3.35Å; L237-H240 WeakPolarHBondContact CG-NE2 3Å; H240-C277 PolarHBondContact N-O 3.49Å; H240-T687 HydrophobicContact CB-CG2 3.88Å; H240-N750 PolarHBondContact CE1-OD1 3.02Å; H240-N750 VanDerWaalsContact CE1-OD1 3.24Å
241	S	49.6	Very low	61.3	Low	44 Å²	44	46 Å²	46	31%	0.308	24%	0.24	S	C	.	.			trans	-83.6	112.7	154.6	89.8	0	0	0	0	107.6	G239 D274	G239-S241 PolarHBondContact O-N 3.11Å; G239-S241 VanDerWaalsContact O-N 3.1Å; S241-D274 WeakPolarHBondContact CB-OD1 3.34Å; S241-D274 PolarHBondContact OG-OD1 3Å
242	S	44.8	Very low	58.7	Low	31 Å²	31	50 Å²	50	22%	0.217	26%	0.256	C	S	.	.			trans	-67.3	133.8	157.5	45.4	0	0	0	0	106.8	L686 T687	S242-L686 WeakPolarHBondContact OG-CB 3.29Å; S242-T687 PolarHBondContact OG-N 3.23Å; S242-T687 PolarHBondContact OG-OG1 3.28Å; S242-T687 VanDerWaalsContact OG-OG1 3.13Å
243	R	40.2	Very low	55.8	Low	207 Å²	207	53.5 Å²	53.5	78%	0.781	27%	0.269	S	S	*	.			trans	-38.6	138.4	-179.3	-70.2	177.4	177	155.4	1.4	110.7	L245	R243-L245 PolarHBondContact O-N 2.97Å
244	P	37.8	Very low	53.1	Low	31 Å²	31	53 Å²	53	20%	0.201	27%	0.269	C	S	.	.	S	Bend	trans	-48	139.8	-176.3	14.7	-27.8	0	0	0	111.2	Q248 N249	P244-Q248 HydrophobicContact CB-CB 4.04Å; P244-N249 PolarHBondContact O-ND2 3.46Å; P244-N249 PolarHBondContact O-OD1 3.45Å
245	L	47.3	Very low	50.5	Low	22 Å²	22	53.2 Å²	53.2	12%	0.115	27%	0.271	C	S	.	.			trans	-32.4	160.2	-170.5	-75.7	135.7	0	0	0	115.8	R243 M247 Q248 N249 L686	R243-L245 PolarHBondContact O-N 2.97Å; L245-M247 VanDerWaalsContact C-N 3.29Å; L245-M247 PolarHBondContact O-N 3.1Å; L245-Q248 HydrophobicContact CB-CB 3.71Å; L245-Q248 HydrophobicContact CB-CG 3.87Å; L245-Q248 HydrophobicContact CD1-CB 4.46Å; L245-Q248 HydrophobicContact CD1-CG 3.68Å; L245-Q248 HydrophobicContact CG-CG 4.37Å; L245-Q248 CarbonylContact O-C 3.52Å; L245-Q248 VanDerWaalsContact O-C 3.29Å; L245-Q248 PolarHBondContact O-N 2.75Å; L245-N249 VanDerWaalsContact O-CA 3.31Å; L245-N249 WeakPolarHBondContact O-CA 3.37Å; L245-N249 WeakPolarHBondContact O-CB 3.17Å; L245-N249 PolarHBondContact O-N 3.02Å; L245-N249 PolarHBondContact O-ND2 2.79Å; L245-L686 HydrophobicContact CD2-CD1 3.56Å; L245-L686 HydrophobicContact CD2-CG 4.5Å; L245-L686 HydrophobicContact CG-CD1 3.69Å
246	L	39.5	Very low	47.8	Very low	104 Å²	104	57.2 Å²	57.2	55%	0.545	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-33.5	173.2	-167.5	71.1	0	0	0	113.2	N249 I250 M390	L246-N249 CarbonylContact O-C 3.52Å; L246-N249 WeakPolarHBondContact O-CA 3.39Å; L246-N249 VanDerWaalsContact O-CB 3.28Å; L246-N249 WeakPolarHBondContact O-CB 3.18Å; L246-N249 PolarHBondContact O-N 3.03Å; L246-I250 WeakPolarHBondContact O-CG1 3.42Å; L246-I250 PolarHBondContact O-N 3.07Å; L246-M390 HydrophobicContact CD2-CE 3.66Å; L246-M390 HydrophobicContact CD2-CG 4.21Å; L246-M390 HydrophobicContact CD2-SD 3.85Å; L246-M390 HydrophobicContact CG-CE 4.49Å
247	M	36.5	Very low	45.3	Very low	45 Å²	45	59.5 Å²	59.5	22%	0.222	30%	0.299	C	S	.	.	H	α-helix	trans	-88.9	-28.7	175.2	-157.8	148.4	75.2	0	0	112.8	L245 N249 I250 L251 Y394 L466	L245-M247 VanDerWaalsContact C-N 3.29Å; L245-M247 PolarHBondContact O-N 3.1Å; M247-N249 PolarHBondContact O-N 3.18Å; M247-I250 HydrophobicContact CG-CD1 4.41Å; M247-I250 PolarHBondContact O-N 2.54Å; M247-L251 WeakPolarHBondContact O-CB 3.3Å; M247-L251 PolarHBondContact O-N 3.25Å; M247-Y394 HydrophobicContact CE-CE1 4.49Å; M247-Y394 HydrophobicContact SD-CE1 4.35Å; M247-Y394 PolarHBondContact SD-OH 3.05Å; M247-L466 HydrophobicContact CE-CB 3.65Å; M247-L466 HydrophobicContact CE-CD2 3.43Å; M247-L466 VanDerWaalsContact CE-CD2 3.43Å; M247-L466 HydrophobicContact CE-CG 4.17Å
248	Q	41.9	Very low	43	Very low	40 Å²	40	60.6 Å²	60.6	19%	0.187	31%	0.307	C	S	.	.	H	α-helix	trans	-65.4	-18.8	157	-70.5	176.4	-12.3	0	0	111.1	P244 L245 L251 Y252	P244-Q248 HydrophobicContact CB-CB 4.04Å; L245-Q248 HydrophobicContact CB-CB 3.71Å; L245-Q248 HydrophobicContact CB-CG 3.87Å; L245-Q248 HydrophobicContact CD1-CB 4.46Å; L245-Q248 HydrophobicContact CD1-CG 3.68Å; L245-Q248 HydrophobicContact CG-CG 4.37Å; L245-Q248 CarbonylContact O-C 3.52Å; L245-Q248 VanDerWaalsContact O-C 3.29Å; L245-Q248 PolarHBondContact O-N 2.75Å; Q248-L251 CarbonylContact O-C 3.56Å; Q248-Y252 WeakPolarHBondContact O-CA 3.35Å; Q248-Y252 WeakPolarHBondContact O-CB 3.4Å; Q248-Y252 PolarHBondContact O-N 3.33Å
249	N	37.6	Very low	41.6	Very low	56 Å²	56	58.5 Å²	58.5	30%	0.299	30%	0.304	S	S	.	.	H	α-helix	trans	-84.1	-29.5	173.2	-80.9	-47.1	0	0	0	108.2	P244 L245 L246 M247 W253	P244-N249 PolarHBondContact O-ND2 3.46Å; P244-N249 PolarHBondContact O-OD1 3.45Å; L245-N249 VanDerWaalsContact O-CA 3.31Å; L245-N249 WeakPolarHBondContact O-CA 3.37Å; L245-N249 WeakPolarHBondContact O-CB 3.17Å; L245-N249 PolarHBondContact O-N 3.02Å; L245-N249 PolarHBondContact O-ND2 2.79Å; L246-N249 CarbonylContact O-C 3.52Å; L246-N249 WeakPolarHBondContact O-CA 3.39Å; L246-N249 VanDerWaalsContact O-CB 3.28Å; L246-N249 WeakPolarHBondContact O-CB 3.18Å; L246-N249 PolarHBondContact O-N 3.03Å; M247-N249 PolarHBondContact O-N 3.18Å; N249-W253 VanDerWaalsContact O-CA 3.24Å; N249-W253 WeakPolarHBondContact O-CA 3.16Å; N249-W253 WeakPolarHBondContact O-CB 3.46Å; N249-W253 PolarHBondContact O-N 3.29Å
250	I	38.7	Very low	40.7	Very low	42 Å²	42	64.6 Å²	64.6	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-67.2	-49.1	166.8	-67	168.3	0	0	0	108.4	L246 M247 W253 C254 V410	L246-I250 WeakPolarHBondContact O-CG1 3.42Å; L246-I250 PolarHBondContact O-N 3.07Å; M247-I250 HydrophobicContact CG-CD1 4.41Å; M247-I250 PolarHBondContact O-N 2.54Å; I250-W253 PolarHBondContact O-N 2.8Å; I250-C254 VanDerWaalsContact O-CB 3.31Å; I250-C254 WeakPolarHBondContact O-CB 3.46Å; I250-C254 PolarHBondContact O-N 3.48Å; I250-C254 PolarHBondContact O-SG 3.15Å; I250-V410 HydrophobicContact CG2-CG1 4.13Å
251	L	40.7	Very low	39.9	Very low	59 Å²	59	63.4 Å²	63.4	31%	0.309	32%	0.317	S	S	.	.	H	α-helix	trans	-63.4	-42.4	175.4	-95.5	127.6	0	0	0	112.6	M247 Q248 C254 V255	M247-L251 WeakPolarHBondContact O-CB 3.3Å; M247-L251 PolarHBondContact O-N 3.25Å; Q248-L251 CarbonylContact O-C 3.56Å; L251-C254 CarbonylContact O-C 3.48Å; L251-C254 VanDerWaalsContact O-CB 3.29Å; L251-C254 WeakPolarHBondContact O-CB 3.33Å; L251-C254 PolarHBondContact O-N 3.35Å; L251-V255 VanDerWaalsContact O-CB 3.32Å; L251-V255 WeakPolarHBondContact O-CB 3.43Å; L251-V255 WeakPolarHBondContact O-CG2 3.36Å; L251-V255 PolarHBondContact O-N 3.45Å
252	Y	38.9	Very low	39.5	Very low	87 Å²	87	62.1 Å²	62.1	34%	0.341	31%	0.308	S	S	.	.	H	α-helix	trans	-74.1	-32.8	177.3	172	-96.1	0	0	0	110.6	Q248 V255 K256	Q248-Y252 WeakPolarHBondContact O-CA 3.35Å; Q248-Y252 WeakPolarHBondContact O-CB 3.4Å; Q248-Y252 PolarHBondContact O-N 3.33Å; Y252-V255 PolarHBondContact O-N 2.88Å; Y252-K256 HydrophobicContact CD1-CB 4.31Å; Y252-K256 HydrophobicContact CD1-CD 4.39Å; Y252-K256 HydrophobicContact CE1-CB 4.13Å; Y252-K256 HydrophobicContact CE1-CD 3.55Å; Y252-K256 HydrophobicContact CE1-CG 4.36Å; Y252-K256 HydrophobicContact CE2-CB 4.37Å; Y252-K256 WeakPolarHBondContact O-CA 3.34Å; Y252-K256 WeakPolarHBondContact O-CB 3.27Å; Y252-K256 PolarHBondContact O-N 2.81Å; Y252-K256 PolarHBondContact OH-NZ 3.16Å; Y252-K256 VanDerWaalsContact OH-NZ 3.11Å
253	W	34.3	Very low	39.4	Very low	91 Å²	91	66.9 Å²	66.9	35%	0.345	33%	0.327	S	S	.	.	H	α-helix	trans	-69.6	-40.2	171.2	-174	96.5	0	0	0	109.3	N249 I250 H257 V426 L430	N249-W253 VanDerWaalsContact O-CA 3.24Å; N249-W253 WeakPolarHBondContact O-CA 3.16Å; N249-W253 WeakPolarHBondContact O-CB 3.46Å; N249-W253 PolarHBondContact O-N 3.29Å; I250-W253 PolarHBondContact O-N 2.8Å; W253-H257 AromaticContact CD1-CD2 3.3Å; W253-H257 AromaticContact CD1-NE2 3.34Å; W253-H257 VanDerWaalsContact CD1-NE2 3.34Å; W253-H257 AromaticContact CD2-CD2 3.73Å; W253-H257 AromaticContact CE2-CD2 3.67Å; W253-H257 AromaticContact CG-CD2 3.49Å; W253-H257 VanDerWaalsContact CG-CD2 3.49Å; W253-H257 AromaticContact NE1-CD2 3.39Å; W253-H257 PolarHBondContact NE1-CD2 3.38Å; W253-H257 AromaticContact NE1-NE2 3.37Å; W253-H257 PolarHBondContact NE1-NE2 3.49Å; W253-H257 WeakPolarHBondContact O-CB 3.48Å; W253-H257 PolarHBondContact O-CD2 3.36Å; W253-H257 PolarHBondContact O-N 2.78Å; W253-H257 VanDerWaalsContact O-N 3.09Å; W253-V426 HydrophobicContact CH2-CG1 4.08Å; W253-V426 HydrophobicContact CZ3-CG1 4Å; W253-L430 HydrophobicContact CZ3-CD1 4.43Å
254	C	38.1	Very low	39.4	Very low	18 Å²	18	58.9 Å²	58.9	12%	0.122	30%	0.3	C	S	.	.	H	α-helix	trans	-56.1	-61.2	165.8	-67.8	0	0	0	0	109.5	I250 L251 H257 C258 L430	I250-C254 VanDerWaalsContact O-CB 3.31Å; I250-C254 WeakPolarHBondContact O-CB 3.46Å; I250-C254 PolarHBondContact O-N 3.48Å; I250-C254 PolarHBondContact O-SG 3.15Å; L251-C254 CarbonylContact O-C 3.48Å; L251-C254 VanDerWaalsContact O-CB 3.29Å; L251-C254 WeakPolarHBondContact O-CB 3.33Å; L251-C254 PolarHBondContact O-N 3.35Å; C254-H257 CarbonylContact O-C 3.57Å; C254-H257 PolarHBondContact O-N 3.3Å; C254-C258 WeakPolarHBondContact O-CA 3.47Å; C254-C258 WeakPolarHBondContact O-CB 3.46Å; C254-C258 PolarHBondContact O-N 2.88Å; C254-C258 PolarHBondContact O-SG 3.17Å; C254-L430 WeakPolarHBondContact SG-CD1 3.29Å
255	V	38.1	Very low	39.5	Very low	10 Å²	10	58.1 Å²	58.1	6%	0.061	29%	0.294	C	S	.	.	H	α-helix	trans	-54.7	-61.4	-178.7	173.8	0	0	0	0	112.3	L251 Y252 H257 C258 A262 F265 K266	L251-V255 VanDerWaalsContact O-CB 3.32Å; L251-V255 WeakPolarHBondContact O-CB 3.43Å; L251-V255 WeakPolarHBondContact O-CG2 3.36Å; L251-V255 PolarHBondContact O-N 3.45Å; Y252-V255 PolarHBondContact O-N 2.88Å; V255-H257 PolarHBondContact O-N 3.47Å; V255-C258 PolarHBondContact O-N 2.86Å; V255-C258 VanDerWaalsContact O-N 3.1Å; V255-A262 HydrophobicContact CG1-CB 3.65Å; V255-A262 WeakPolarHBondContact O-CB 3.41Å; V255-F265 HydrophobicContact CB-CB 4.47Å; V255-F265 HydrophobicContact CG2-CB 3.53Å; V255-F265 HydrophobicContact CG2-CG 4.35Å; V255-K266 HydrophobicContact CG1-CG 4.24Å
256	K	34.8	Very low	39.2	Very low	123 Å²	123	63.7 Å²	63.7	54%	0.535	32%	0.317	S	S	.	.	H	α-helix	trans	-55.8	-37.5	-178.4	-175.5	-176	-164.4	152.8	0	111.8	Y252	Y252-K256 HydrophobicContact CD1-CB 4.31Å; Y252-K256 HydrophobicContact CD1-CD 4.39Å; Y252-K256 HydrophobicContact CE1-CB 4.13Å; Y252-K256 HydrophobicContact CE1-CD 3.55Å; Y252-K256 HydrophobicContact CE1-CG 4.36Å; Y252-K256 HydrophobicContact CE2-CB 4.37Å; Y252-K256 WeakPolarHBondContact O-CA 3.34Å; Y252-K256 WeakPolarHBondContact O-CB 3.27Å; Y252-K256 PolarHBondContact O-N 2.81Å; Y252-K256 PolarHBondContact OH-NZ 3.16Å; Y252-K256 VanDerWaalsContact OH-NZ 3.11Å
257	H	37.6	Very low	39.3	Very low	71 Å²	71	64.9 Å²	64.9	33%	0.329	32%	0.318	S	S	.	.	H	α-helix	trans	-93.7	-13.4	-178.9	-60.4	-69.6	0	0	0	113.2	W253 C254 V255 G259 K427	W253-H257 AromaticContact CD1-CD2 3.3Å; W253-H257 AromaticContact CD1-NE2 3.34Å; W253-H257 VanDerWaalsContact CD1-NE2 3.34Å; W253-H257 AromaticContact CD2-CD2 3.73Å; W253-H257 AromaticContact CE2-CD2 3.67Å; W253-H257 AromaticContact CG-CD2 3.49Å; W253-H257 VanDerWaalsContact CG-CD2 3.49Å; W253-H257 AromaticContact NE1-CD2 3.39Å; W253-H257 PolarHBondContact NE1-CD2 3.38Å; W253-H257 AromaticContact NE1-NE2 3.37Å; W253-H257 PolarHBondContact NE1-NE2 3.49Å; W253-H257 WeakPolarHBondContact O-CB 3.48Å; W253-H257 PolarHBondContact O-CD2 3.36Å; W253-H257 PolarHBondContact O-N 2.78Å; W253-H257 VanDerWaalsContact O-N 3.09Å; C254-H257 CarbonylContact O-C 3.57Å; C254-H257 PolarHBondContact O-N 3.3Å; V255-H257 PolarHBondContact O-N 3.47Å; H257-G259 VanDerWaalsContact C-N 3.29Å; H257-G259 PolarHBondContact O-N 3.24Å; H257-K427 HydrophobicContact CB-CD 3.97Å; H257-K427 WeakPolarHBondContact O-CD 3.31Å; H257-K427 VanDerWaalsContact O-CE 3.27Å; H257-K427 WeakPolarHBondContact O-CE 3.43Å; H257-K427 PolarHBondContact O-NZ 2.8Å
258	C	36.3	Very low	39.4	Very low	24 Å²	24	64.1 Å²	64.1	16%	0.162	31%	0.314	C	S	.	.	S	Bend	trans	-79	4.2	178.5	-81	0	0	0	0	115	C254 V255 A261	C254-C258 WeakPolarHBondContact O-CA 3.47Å; C254-C258 WeakPolarHBondContact O-CB 3.46Å; C254-C258 PolarHBondContact O-N 2.88Å; C254-C258 PolarHBondContact O-SG 3.17Å; V255-C258 PolarHBondContact O-N 2.86Å; V255-C258 VanDerWaalsContact O-N 3.1Å; C258-A261 HydrophobicContact CB-CB 4.17Å
259	G	43.5	Very low	39.2	Very low	49 Å²	49	63 Å²	63	51%	0.505	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	-136.2	174.4	0	0	0	0	0	112.6	H257 A261 A262	H257-G259 VanDerWaalsContact C-N 3.29Å; H257-G259 PolarHBondContact O-N 3.24Å; G259-A261 PolarHBondContact O-N 3.35Å; G259-A262 WeakPolarHBondContact O-CB 3.45Å; G259-A262 PolarHBondContact O-N 2.72Å
260	E	41.2	Very low	39.3	Very low	172 Å²	172	62.5 Å²	62.5	80%	0.804	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.3	-177.8	-74	-179.9	169.9	0	0	114	A262 E263	E260-A262 PolarHBondContact O-N 3.08Å; E260-E263 PolarHBondContact O-N 3.22Å
261	A	40.4	Very low	39.2	Very low	6 Å²	6	62 Å²	62	5%	0.05	31%	0.312	C	S	.	.	H	α-helix	trans	-60	-17.9	171.5	0	0	0	0	0	112.4	C258 G259 E263 N264 F265	C258-A261 HydrophobicContact CB-CB 4.17Å; G259-A261 PolarHBondContact O-N 3.35Å; A261-E263 VanDerWaalsContact C-N 3.26Å; A261-E263 PolarHBondContact O-N 2.71Å; A261-N264 PolarHBondContact O-N 2.79Å; A261-F265 HydrophobicContact CB-CD2 4.19Å; A261-F265 HydrophobicContact CB-CE2 4.39Å; A261-F265 VanDerWaalsContact O-CD2 3.32Å; A261-F265 WeakPolarHBondContact O-CD2 3.49Å; A261-F265 PolarHBondContact O-N 2.92Å
262	A	41.4	Very low	39.1	Very low	16 Å²	16	61.5 Å²	61.5	13%	0.132	31%	0.313	C	S	.	.	H	α-helix	trans	-56.3	-34.4	175.8	0	0	0	0	0	113.7	V255 G259 E260 K266	V255-A262 HydrophobicContact CG1-CB 3.65Å; V255-A262 WeakPolarHBondContact O-CB 3.41Å; G259-A262 WeakPolarHBondContact O-CB 3.45Å; G259-A262 PolarHBondContact O-N 2.72Å; E260-A262 PolarHBondContact O-N 3.08Å; A262-K266 VanDerWaalsContact O-CB 3.24Å; A262-K266 WeakPolarHBondContact O-CB 3.32Å; A262-K266 WeakPolarHBondContact O-CG 3.44Å; A262-K266 PolarHBondContact O-N 2.9Å
263	E	41.8	Very low	39.3	Very low	131 Å²	131	65.8 Å²	65.8	61%	0.612	33%	0.334	S	S	*	.	H	α-helix	trans	-68	-41.3	178.9	-76.7	-131.8	146.1	0	0	112.1	E260 A261 K266 K267	E260-E263 PolarHBondContact O-N 3.22Å; A261-E263 VanDerWaalsContact C-N 3.26Å; A261-E263 PolarHBondContact O-N 2.71Å; E263-K266 WeakPolarHBondContact O-CB 3.39Å; E263-K266 PolarHBondContact O-N 3.09Å; E263-K267 PolarHBondContact O-N 3.18Å
264	N	41	Very low	39.9	Very low	40 Å²	40	66.9 Å²	66.9	21%	0.214	35%	0.346	C	S	.	.	H	α-helix	trans	-71.4	-38.7	177.2	-67.8	-24.1	0	0	0	111.2	A261 K267 L268 W342	A261-N264 PolarHBondContact O-N 2.79Å; N264-K267 WeakPolarHBondContact O-CB 3.42Å; N264-K267 PolarHBondContact O-N 3.17Å; N264-L268 PolarHBondContact O-N 3.09Å; N264-W342 HydrophobicContact CB-CB 4.16Å; N264-W342 HydrophobicContact CB-CE3 4.15Å; N264-W342 PolarHBondContact ND2-O 3.24Å
265	F	39.4	Very low	40.5	Very low	15 Å²	15	66.5 Å²	66.5	7%	0.066	34%	0.342	C	S	.	.	H	α-helix	trans	-70	-28.4	173.1	-82.5	-80.3	0	0	0	113.4	V255 A261 K267 L268 A269 L343 A431 W434	V255-F265 HydrophobicContact CB-CB 4.47Å; V255-F265 HydrophobicContact CG2-CB 3.53Å; V255-F265 HydrophobicContact CG2-CG 4.35Å; A261-F265 HydrophobicContact CB-CD2 4.19Å; A261-F265 HydrophobicContact CB-CE2 4.39Å; A261-F265 VanDerWaalsContact O-CD2 3.32Å; A261-F265 WeakPolarHBondContact O-CD2 3.49Å; A261-F265 PolarHBondContact O-N 2.92Å; F265-K267 VanDerWaalsContact C-N 3.25Å; F265-K267 PolarHBondContact O-N 3.33Å; F265-L268 HydrophobicContact CD1-CD1 4.26Å; F265-L268 PolarHBondContact O-N 2.84Å; F265-L268 VanDerWaalsContact O-N 3.16Å; F265-A269 WeakPolarHBondContact O-CB 3.34Å; F265-A269 PolarHBondContact O-N 2.95Å; F265-L343 HydrophobicContact CE2-CD2 3.92Å; F265-L343 HydrophobicContact CZ-CD2 4.19Å; F265-A431 HydrophobicContact CZ-CB 4.47Å; F265-W434 AromaticContact CE1-CD1 3.54Å; F265-W434 HydrophobicContact CE1-CG 4.13Å; F265-W434 AromaticContact CE1-NE1 3.95Å
266	K	41.9	Very low	41.5	Very low	139 Å²	139	69.4 Å²	69.4	60%	0.604	36%	0.362	S	S	*	.	H	α-helix	trans	-64.1	-30	169.8	-83.6	173.3	-178.4	-177.3	0	112.1	V255 A262 E263 L268	V255-K266 HydrophobicContact CG1-CG 4.24Å; A262-K266 VanDerWaalsContact O-CB 3.24Å; A262-K266 WeakPolarHBondContact O-CB 3.32Å; A262-K266 WeakPolarHBondContact O-CG 3.44Å; A262-K266 PolarHBondContact O-N 2.9Å; E263-K266 WeakPolarHBondContact O-CB 3.39Å; E263-K266 PolarHBondContact O-N 3.09Å; K266-L268 VanDerWaalsContact C-N 3.34Å
267	K	41.8	Very low	43	Very low	129 Å²	129	63.5 Å²	63.5	56%	0.561	34%	0.336	S	S	*	.	H	α-helix	trans	-71.1	-31.1	172.6	-65	173.2	-177.7	171.5	0	112.2	E263 N264 F265	E263-K267 PolarHBondContact O-N 3.18Å; N264-K267 WeakPolarHBondContact O-CB 3.42Å; N264-K267 PolarHBondContact O-N 3.17Å; F265-K267 VanDerWaalsContact C-N 3.25Å; F265-K267 PolarHBondContact O-N 3.33Å
268	L	38.2	Very low	44.9	Very low	28 Å²	28	60.9 Å²	60.9	15%	0.147	33%	0.325	C	S	.	.	H	α-helix	trans	-84	-32.7	179.3	-81.4	152	0	0	0	113.6	N264 F265 K266 P270 L332 W342 L438	N264-L268 PolarHBondContact O-N 3.09Å; F265-L268 HydrophobicContact CD1-CD1 4.26Å; F265-L268 PolarHBondContact O-N 2.84Å; F265-L268 VanDerWaalsContact O-N 3.16Å; K266-L268 VanDerWaalsContact C-N 3.34Å; L268-P270 WeakPolarHBondContact O-CD 3.46Å; L268-L332 HydrophobicContact CD2-CD1 3.3Å; L268-L332 HydrophobicContact CD2-CD2 4.35Å; L268-L332 HydrophobicContact CD2-CG 4.37Å; L268-L332 HydrophobicContact CG-CD1 3.95Å; L268-W342 HydrophobicContact CD1-CE3 4.43Å; L268-W342 HydrophobicContact CD1-CZ3 4.48Å; L268-L438 HydrophobicContact CD2-CD1 4.22Å
269	A	38.7	Very low	47.3	Very low	16 Å²	16	59.7 Å²	59.7	13%	0.132	32%	0.318	C	S	.	.	S	Bend	trans	-77.8	118.3	179.6	0	0	0	0	0	109.1	F265 S271	F265-A269 WeakPolarHBondContact O-CB 3.34Å; F265-A269 PolarHBondContact O-N 2.95Å; A269-S271 PolarHBondContact O-N 3.27Å
270	P	37.8	Very low	49.6	Very low	46 Å²	46	58.9 Å²	58.9	30%	0.299	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.8	118.5	172.8	-27	32.8	0	0	0	109.6	L268 C272 P325	L268-P270 WeakPolarHBondContact O-CD 3.46Å; P270-C272 VanDerWaalsContact C-N 3.31Å; P270-C272 PolarHBondContact O-N 3.45Å; P270-P325 HydrophobicContact CB-CB 3.51Å; P270-P325 HydrophobicContact CB-CG 3.58Å; P270-P325 HydrophobicContact CG-CB 3.68Å; P270-P325 HydrophobicContact CG-CG 4.3Å
271	S	37.3	Very low	52.1	Low	31 Å²	31	50.7 Å²	50.7	22%	0.217	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	3.7	78.5	171.5	47.2	0	0	0	0	113.2	A269 F273 L321	A269-S271 PolarHBondContact O-N 3.27Å; S271-F273 PolarHBondContact O-N 2.8Å; S271-L321 WeakPolarHBondContact OG-CD2 3.43Å
272	C	39.8	Very low	54.7	Low	50 Å²	50	50.7 Å²	50.7	34%	0.338	26%	0.262	S	S	.	.			trans	-75	27.5	-178.6	-158.9	0	0	0	0	111.1	P270	P270-C272 VanDerWaalsContact C-N 3.31Å; P270-C272 PolarHBondContact O-N 3.45Å
273	F	41.2	Very low	57.3	Low	177 Å²	177	50 Å²	50	78%	0.776	26%	0.255	S	S	*	.			trans	-83.8	133.6	-178.8	-67.9	-71.6	0	0	0	108.4	S271 F275	S271-F273 PolarHBondContact O-N 2.8Å; F273-F275 PolarHBondContact O-N 3.23Å
274	D	47.6	Very low	59.8	Low	114 Å²	114	43.7 Å²	43.7	61%	0.61	23%	0.226	S	C	*	.			trans	-45.6	98.7	174	-67.7	-59.4	0	0	0	109.5	S241 P276	S241-D274 WeakPolarHBondContact CB-OD1 3.34Å; S241-D274 PolarHBondContact OG-OD1 3Å; D274-P276 WeakPolarHBondContact O-CD 3.49Å; D274-P276 VanDerWaalsContact O-N 3.16Å
275	F	51.8	Low	62.3	Low	9 Å²	9	42 Å²	42	4%	0.039	22%	0.217	C	C	.	.			trans	-67	113.8	172.8	-177.9	-77.9	0	0	0	106.3	F273 C277 F319 H679 M680 T683	F273-F275 PolarHBondContact O-N 3.23Å; F275-C277 HydrophobicContact CD1-CB 4Å; F275-C277 VanDerWaalsContact CD1-N 3.29Å; F275-C277 WeakPolarHBondContact CD1-SG 3.45Å; F275-C277 HydrophobicContact CE1-CB 4.03Å; F275-C277 WeakPolarHBondContact CE1-SG 3.16Å; F275-C277 PolarHBondContact O-N 3.3Å; F275-F319 AromaticContact CD2-CD1 3.96Å; F275-F319 HydrophobicContact CD2-CD1 3.96Å; F275-F319 HydrophobicContact CD2-CD2 4.31Å; F275-F319 AromaticContact CD2-CE1 3.96Å; F275-F319 HydrophobicContact CD2-CE1 3.96Å; F275-F319 HydrophobicContact CD2-CE2 4.34Å; F275-F319 HydrophobicContact CD2-CG 4.1Å; F275-F319 HydrophobicContact CD2-CZ 4.15Å; F275-F319 HydrophobicContact CE2-CB 3.77Å; F275-F319 AromaticContact CE2-CD1 3.36Å; F275-F319 HydrophobicContact CE2-CD1 3.36Å; F275-F319 HydrophobicContact CE2-CD2 4.04Å; F275-F319 AromaticContact CE2-CE1 3.83Å; F275-F319 HydrophobicContact CE2-CE1 3.83Å; F275-F319 HydrophobicContact CE2-CE2 4.47Å; F275-F319 AromaticContact CE2-CG 3.44Å; F275-F319 HydrophobicContact CE2-CG 3.44Å; F275-F319 VanDerWaalsContact CE2-CG 3.44Å; F275-F319 HydrophobicContact CE2-CZ 4.36Å; F275-F319 HydrophobicContact CZ-CB 4.09Å; F275-F319 HydrophobicContact CZ-CD1 4.4Å; F275-F319 HydrophobicContact CZ-CG 4.25Å; F275-H679 AromaticContact CD2-CD2 3.99Å; F275-M680 HydrophobicContact CZ-CG 4.31Å; F275-T683 HydrophobicContact CB-CG2 3.99Å; F275-T683 HydrophobicContact CD1-CG2 3.93Å; F275-T683 HydrophobicContact CG-CG2 4.21Å
276	P	57.8	Low	64.8	Low	71 Å²	71	43.3 Å²	43.3	46%	0.461	22%	0.223	S	C	.	.			trans	-77	86.3	174.2	31.4	-27.5	0	0	0	107	D274 S278 S316	D274-P276 WeakPolarHBondContact O-CD 3.49Å; D274-P276 VanDerWaalsContact O-N 3.16Å; P276-S278 PolarHBondContact O-N 2.85Å; P276-S278 VanDerWaalsContact O-N 3.08Å; P276-S316 PolarHBondContact O-OG 3.35Å
277	C	66	Low	67.2	Low	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.			trans	-65.1	111.4	164.6	-80.1	0	0	0	0	106.3	H240 F275 F279 T683	H240-C277 PolarHBondContact N-O 3.49Å; F275-C277 HydrophobicContact CD1-CB 4Å; F275-C277 VanDerWaalsContact CD1-N 3.29Å; F275-C277 WeakPolarHBondContact CD1-SG 3.45Å; F275-C277 HydrophobicContact CE1-CB 4.03Å; F275-C277 WeakPolarHBondContact CE1-SG 3.16Å; F275-C277 PolarHBondContact O-N 3.3Å; C277-F279 HydrophobicContact CB-CD2 4.35Å; C277-F279 HydrophobicContact CB-CE2 3.56Å; C277-F279 HydrophobicContact CB-CZ 3.77Å; C277-T683 WeakPolarHBondContact SG-CG2 3.45Å
278	S	78.6	Confident	69.6	Low	15 Å²	15	37.7 Å²	37.7	11%	0.105	20%	0.198	C	C	.	.			trans	-94.2	132	164.2	58.1	0	0	0	0	110	L237 P276 A315 S316	L237-S278 CarbonylContact O-C 3.57Å; L237-S278 VanDerWaalsContact O-CA 3.25Å; L237-S278 WeakPolarHBondContact O-CA 3.43Å; P276-S278 PolarHBondContact O-N 2.85Å; P276-S278 VanDerWaalsContact O-N 3.08Å; S278-A315 PolarHBondContact O-N 3.21Å; S278-A315 VanDerWaalsContact OG-CB 3.25Å; S278-A315 WeakPolarHBondContact OG-CB 3.34Å; S278-S316 WeakPolarHBondContact OG-CB 3.48Å; S278-S316 PolarHBondContact OG-N 3.06Å
279	F	87.3	Confident	72.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	135.6	178.3	-62	-84.1	0	0	0	109.9	E236 L237 C277 L312 K313 L314 V684 T687 L707 F731	E236-F279 CarbonylContact C-O 3.49Å; E236-F279 WeakPolarHBondContact CA-O 3.46Å; L237-F279 HydrophobicContact CB-CB 4.43Å; L237-F279 HydrophobicContact CD2-CD2 4.49Å; L237-F279 PolarHBondContact N-O 3.49Å; L237-F279 PolarHBondContact O-N 3.43Å; C277-F279 HydrophobicContact CB-CD2 4.35Å; C277-F279 HydrophobicContact CB-CE2 3.56Å; C277-F279 HydrophobicContact CB-CZ 3.77Å; F279-L312 HydrophobicContact CB-CD1 4.1Å; F279-L312 HydrophobicContact CD1-CD1 4.37Å; F279-L312 HydrophobicContact CD1-CD2 4.01Å; F279-L312 HydrophobicContact CD1-CG 4.21Å; F279-L312 HydrophobicContact CE1-CD2 4.48Å; F279-K313 WeakPolarHBondContact CA-O 3.42Å; F279-L314 HydrophobicContact CD1-CD2 3.88Å; F279-L314 HydrophobicContact CE1-CD2 3.59Å; F279-L314 HydrophobicContact CZ-CD2 4.43Å; F279-V684 HydrophobicContact CE1-CG1 4.29Å; F279-V684 HydrophobicContact CE1-CG2 4.33Å; F279-V684 HydrophobicContact CZ-CG2 4.36Å; F279-T687 HydrophobicContact CE2-CG2 3.86Å; F279-T687 HydrophobicContact CZ-CG2 4.21Å; F279-L707 HydrophobicContact CE1-CD2 4.29Å; F279-F731 HydrophobicContact CB-CE2 4.18Å; F279-F731 HydrophobicContact CB-CZ 3.73Å
280	E	91.7	Very high	74.6	Confident	32 Å²	32	39 Å²	39	15%	0.15	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	112.5	167.7	-81	172.1	-170.7	0	0	109.1	T234 Y235 K313 A315 I755	T234-E280 HydrophobicContact CG2-CB 4.18Å; T234-E280 HydrophobicContact CG2-CG 4.29Å; Y235-E280 CarbonylContact O-C 3.34Å; Y235-E280 VanDerWaalsContact O-CA 3.28Å; Y235-E280 WeakPolarHBondContact O-CA 3.31Å; E280-K313 HydrophobicContact CB-CB 4.16Å; E280-K313 PolarHBondContact N-O 3Å; E280-K313 PolarHBondContact O-N 2.95Å; E280-K313 IonicContact OE1-NZ 2.65Å; E280-K313 WeakPolarHBondContact OE2-CD 3.22Å; E280-K313 WeakPolarHBondContact OE2-CE 3.3Å; E280-K313 IonicContact OE2-NZ 3.22Å; E280-K313 PolarHBondContact OE2-NZ 3.46Å; E280-A315 HydrophobicContact CG-CB 3.91Å; E280-I755 HydrophobicContact CG-CD1 4.28Å
281	L	93.7	Very high	76.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	112.3	171.9	175	60.9	0	0	0	109.6	T234 Y235 I283 W310 L312 I727 F731 L733	T234-L281 CarbonylContact C-O 3.5Å; T234-L281 WeakPolarHBondContact CA-O 3.28Å; Y235-L281 PolarHBondContact N-O 3.28Å; Y235-L281 PolarHBondContact O-N 2.83Å; L281-I283 HydrophobicContact CD1-CG1 4.34Å; L281-I283 HydrophobicContact CD2-CD1 4.15Å; L281-I283 HydrophobicContact CD2-CG1 4.39Å; L281-I283 HydrophobicContact CG-CD1 4.31Å; L281-I283 HydrophobicContact CG-CG1 4Å; L281-W310 HydrophobicContact CD1-CD2 4.38Å; L281-W310 HydrophobicContact CD1-CE3 3.89Å; L281-W310 HydrophobicContact CD2-CE3 4.32Å; L281-W310 HydrophobicContact CD2-CZ3 4.16Å; L281-L312 HydrophobicContact CB-CD1 4.18Å; L281-L312 HydrophobicContact CD1-CD1 4.43Å; L281-I727 HydrophobicContact CD1-CG2 3.87Å; L281-I727 HydrophobicContact CD2-CG2 3.75Å; L281-I727 HydrophobicContact CG-CG2 4.36Å; L281-F731 HydrophobicContact CB-CD1 4Å; L281-F731 HydrophobicContact CB-CD2 4.13Å; L281-F731 HydrophobicContact CB-CE1 3.58Å; L281-F731 HydrophobicContact CB-CE2 3.74Å; L281-F731 HydrophobicContact CB-CG 4.26Å; L281-F731 HydrophobicContact CB-CZ 3.44Å; L281-F731 VanDerWaalsContact CB-CZ 3.44Å; L281-F731 HydrophobicContact CD2-CB 4.24Å; L281-F731 HydrophobicContact CD2-CD1 4.22Å; L281-F731 HydrophobicContact CD2-CD2 3.87Å; L281-F731 HydrophobicContact CD2-CE2 4.29Å; L281-F731 HydrophobicContact CD2-CG 3.84Å; L281-L733 HydrophobicContact CD2-CD1 3.74Å
282	M	94.8	Very high	79.2	Confident	6 Å²	6	48.8 Å²	48.8	3%	0.03	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	121.4	175.5	-68.3	168.7	-88.9	0	0	110.2	L109 R232 R233 T234 Y311 K313 K712	L109-M282 HydrophobicContact CD2-CB 4.01Å; L109-M282 HydrophobicContact CD2-CG 4.5Å; L109-M282 HydrophobicContact CD2-SD 3.72Å; R232-M282 HydrophobicContact CG-CB 4.49Å; R233-M282 WeakPolarHBondContact O-CA 3.45Å; T234-M282 HydrophobicContact CG2-CG 3.74Å; M282-Y311 PolarHBondContact N-O 2.91Å; M282-Y311 PolarHBondContact O-N 3.24Å; M282-K313 HydrophobicContact CE-CB 3.38Å; M282-K313 HydrophobicContact CE-CD 3.93Å; M282-K313 HydrophobicContact CE-CG 4.29Å; M282-K712 HydrophobicContact CE-CD 4Å; M282-K712 HydrophobicContact CE-CG 4.35Å
283	I	94.8	Very high	81.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.9	178.7	-53.5	-175.1	0	0	0	108.8	R232 R233 Y235 L281 W285 A304 T307 W310 L733	R232-I283 CarbonylContact C-O 3.46Å; R232-I283 VanDerWaalsContact CA-O 3.24Å; R232-I283 WeakPolarHBondContact CA-O 3.34Å; R233-I283 PolarHBondContact N-O 3.07Å; R233-I283 PolarHBondContact O-N 2.93Å; Y235-I283 HydrophobicContact CD2-CD1 4.41Å; Y235-I283 HydrophobicContact CE2-CD1 4.04Å; L281-I283 HydrophobicContact CD1-CG1 4.34Å; L281-I283 HydrophobicContact CD2-CD1 4.15Å; L281-I283 HydrophobicContact CD2-CG1 4.39Å; L281-I283 HydrophobicContact CG-CD1 4.31Å; L281-I283 HydrophobicContact CG-CG1 4Å; I283-W285 HydrophobicContact CB-CH2 3.84Å; I283-W285 HydrophobicContact CB-CZ3 4.08Å; I283-W285 HydrophobicContact CG2-CE3 4.43Å; I283-W285 HydrophobicContact CG2-CH2 3.3Å; I283-W285 HydrophobicContact CG2-CZ2 3.53Å; I283-W285 HydrophobicContact CG2-CZ3 3.79Å; I283-W285 VanDerWaalsContact O-CZ3 3.31Å; I283-W285 WeakPolarHBondContact O-CZ3 3.12Å; I283-A304 HydrophobicContact CD1-CB 3.46Å; I283-A304 VanDerWaalsContact CD1-CB 3.46Å; I283-T307 HydrophobicContact CG2-CG2 3.31Å; I283-W310 HydrophobicContact CD1-CD2 4.41Å; I283-W310 HydrophobicContact CD1-CZ2 4.03Å; I283-W310 HydrophobicContact CG1-CD2 4.4Å; I283-W310 HydrophobicContact CG1-CG 4.43Å; I283-L733 HydrophobicContact CD1-CD1 3.9Å
284	V	95	Very high	83.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	138.5	-167.1	-173.9	0	0	0	0	111.8	L108 L109 A231 R232 Q286 T307 H309 Y311	L108-V284 HydrophobicContact CB-CG1 3.93Å; L108-V284 HydrophobicContact CD1-CG1 3.31Å; L108-V284 HydrophobicContact CG-CG1 4.21Å; L109-V284 HydrophobicContact CD2-CG2 4.13Å; A231-V284 WeakPolarHBondContact O-CA 3.34Å; R232-V284 HydrophobicContact CG-CG2 4.32Å; V284-Q286 HydrophobicContact CG1-CG 4Å; V284-T307 PolarHBondContact O-OG1 3.3Å; V284-H309 HydrophobicContact CB-CB 4.01Å; V284-H309 PolarHBondContact N-O 2.96Å; V284-Y311 HydrophobicContact CG2-CD2 4.13Å; V284-Y311 HydrophobicContact CG2-CE2 4.19Å
285	W	93.9	Very high	84.8	Confident	5 Å²	5	40.7 Å²	40.7	2%	0.019	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	119	169.9	-59.8	-101.4	0	0	0	108.6	S230 A231 R233 I283 R288 L302 T307	S230-W285 CarbonylContact C-O 3.52Å; S230-W285 VanDerWaalsContact CA-O 3.24Å; S230-W285 WeakPolarHBondContact CA-O 2.92Å; A231-W285 HydrophobicContact CB-CE3 4.23Å; A231-W285 PolarHBondContact N-O 3.45Å; A231-W285 PolarHBondContact O-N 2.84Å; R233-W285 HydrophobicContact CB-CH2 4.46Å; R233-W285 HydrophobicContact CB-CZ3 4.15Å; R233-W285 HydrophobicContact CG-CH2 4.34Å; R233-W285 HydrophobicContact CG-CZ3 3.95Å; I283-W285 HydrophobicContact CB-CH2 3.84Å; I283-W285 HydrophobicContact CB-CZ3 4.08Å; I283-W285 HydrophobicContact CG2-CE3 4.43Å; I283-W285 HydrophobicContact CG2-CH2 3.3Å; I283-W285 HydrophobicContact CG2-CZ2 3.53Å; I283-W285 HydrophobicContact CG2-CZ3 3.79Å; I283-W285 VanDerWaalsContact O-CZ3 3.31Å; I283-W285 WeakPolarHBondContact O-CZ3 3.12Å; W285-R288 HydrophobicContact CB-CG 4.31Å; W285-L302 HydrophobicContact CB-CD2 4.01Å; W285-L302 HydrophobicContact CD2-CB 4.35Å; W285-L302 HydrophobicContact CD2-CD2 3.91Å; W285-L302 HydrophobicContact CE3-CD2 4.41Å; W285-L302 HydrophobicContact CG-CD2 3.7Å; W285-L302 HydrophobicContact CH2-CB 4.45Å; W285-L302 WeakPolarHBondContact CH2-O 3.4Å; W285-L302 VanDerWaalsContact CZ2-C 3.43Å; W285-L302 HydrophobicContact CZ2-CB 4.22Å; W285-L302 WeakPolarHBondContact CZ2-O 3.27Å; W285-T307 HydrophobicContact CD2-CG2 4.21Å; W285-T307 HydrophobicContact CZ2-CG2 3.79Å
286	Q	91.6	Very high	85.9	Confident	42 Å²	42	43.3 Å²	43.3	20%	0.196	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	135.1	-174.6	-76.7	155.4	34	0	0	111.5	S105 L108 V284 R288	S105-Q286 VanDerWaalsContact CB-NE2 3.27Å; S105-Q286 PolarHBondContact OG-NE2 2.78Å; S105-Q286 PolarHBondContact OG-OE1 2.91Å; L108-Q286 HydrophobicContact CD1-CG 3.63Å; V284-Q286 HydrophobicContact CG1-CG 4Å; Q286-R288 VanDerWaalsContact C-N 3.27Å; Q286-R288 PolarHBondContact O-N 3.44Å
287	N	92.8	Very high	86.5	Confident	44 Å²	44	44.3 Å²	44.3	24%	0.235	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	49.5	45.1	164.8	-53	-66.5	0	0	0	113.6	T103 V228 V229 S230 R762	T103-N287 PolarHBondContact N-OD1 3.31Å; T103-N287 PolarHBondContact O-ND2 3.28Å; V228-N287 HydrophobicContact CG1-CB 3.96Å; V229-N287 PolarHBondContact O-N 2.91Å; S230-N287 PolarHBondContact OG-N 3.32Å; N287-R762 PolarHBondContact OD1-NH2 3.05Å
288	R	92.1	Very high	86.8	Confident	105 Å²	105	49.9 Å²	49.9	40%	0.396	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	142.3	174.6	-63.9	-60.3	-174.4	173.2	0.5	109.3	V228 V229 W285 Q286 L293	V228-R288 CarbonylContact C-O 3.59Å; V228-R288 WeakPolarHBondContact CA-O 3.46Å; V229-R288 PolarHBondContact N-O 2.95Å; V229-R288 PolarHBondContact O-N 3.01Å; W285-R288 HydrophobicContact CB-CG 4.31Å; Q286-R288 VanDerWaalsContact C-N 3.27Å; Q286-R288 PolarHBondContact O-N 3.44Å; R288-L293 HydrophobicContact CB-CD1 3.82Å; R288-L293 HydrophobicContact CB-CD2 4.1Å; R288-L293 HydrophobicContact CB-CG 4.09Å; R288-L293 HydrophobicContact CG-CD2 4.38Å
289	N	91.6	Very high	86.7	Confident	45 Å²	45	55.2 Å²	55.2	24%	0.241	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	136.1	172.4	-171.5	-64.2	0	0	0	108.9	S226 E291 M292	S226-N289 WeakPolarHBondContact CB-ND2 3.34Å; S226-N289 WeakPolarHBondContact CB-OD1 3.49Å; S226-N289 PolarHBondContact OG-ND2 3.4Å; S226-N289 PolarHBondContact OG-OD1 3.22Å; S226-N289 VanDerWaalsContact OG-OD1 3.07Å; N289-E291 PolarHBondContact O-N 3.33Å; N289-E291 WeakPolarHBondContact OD1-CB 3.37Å; N289-E291 PolarHBondContact OD1-N 3.46Å; N289-M292 HydrophobicContact CB-CG 4.3Å; N289-M292 HydrophobicContact CB-SD 4.39Å; N289-M292 WeakPolarHBondContact O-CB 3.49Å; N289-M292 PolarHBondContact O-N 3.36Å
290	E	89.1	Confident	86.5	Confident	27 Å²	27	56.7 Å²	56.7	13%	0.126	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-55.8	-33.4	179.4	70.8	-178.6	168.2	0	0	113.4	V210 R214 S226 V227 V229 M292 L293	V210-E290 WeakPolarHBondContact CG1-OE2 3.41Å; R214-E290 IonicContact CZ-OE1 3.92Å; R214-E290 IonicContact CZ-OE2 3.82Å; R214-E290 IonicContact NH2-OE1 2.71Å; R214-E290 PolarHBondContact NH2-OE1 3.06Å; R214-E290 IonicContact NH2-OE2 3.94Å; R214-E290 PolarHBondContact NH2-OE2 3.34Å; S226-E290 WeakPolarHBondContact CA-OE1 3.24Å; V227-E290 HydrophobicContact CB-CB 4.4Å; V227-E290 HydrophobicContact CB-CG 4.35Å; V227-E290 WeakPolarHBondContact CB-OE2 3.41Å; V227-E290 WeakPolarHBondContact CG2-OE2 3.11Å; V227-E290 VanDerWaalsContact N-CD 3.26Å; V227-E290 PolarHBondContact N-OE1 3.43Å; V227-E290 WeakPolarHBondContact O-CB 3.46Å; V227-E290 PolarHBondContact O-N 3.2Å; V229-E290 HydrophobicContact CG2-CB 4.19Å; E290-M292 PolarHBondContact O-N 2.92Å; E290-M292 VanDerWaalsContact O-N 3.13Å; E290-L293 PolarHBondContact O-N 3.12Å
291	E	86.7	Confident	86.1	Confident	144 Å²	144	57.2 Å²	57.2	67%	0.673	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-66.1	-18.9	-179	-66	171	-151.4	0	0	112.2	S226 N289	S226-E291 VanDerWaalsContact CB-OE1 3.22Å; S226-E291 WeakPolarHBondContact CB-OE1 3.41Å; S226-E291 PolarHBondContact OG-OE1 2.78Å; N289-E291 PolarHBondContact O-N 3.33Å; N289-E291 WeakPolarHBondContact OD1-CB 3.37Å; N289-E291 PolarHBondContact OD1-N 3.46Å
292	M	86.1	Confident	85.8	Confident	138 Å²	138	57.3 Å²	57.3	68%	0.68	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-94.3	0.9	176.3	-58.2	-177.4	176.6	0	0	112.8	N289 E290	N289-M292 HydrophobicContact CB-CG 4.3Å; N289-M292 HydrophobicContact CB-SD 4.39Å; N289-M292 WeakPolarHBondContact O-CB 3.49Å; N289-M292 PolarHBondContact O-N 3.36Å; E290-M292 PolarHBondContact O-N 2.92Å; E290-M292 VanDerWaalsContact O-N 3.13Å
293	L	85.6	Confident	85.3	Confident	25 Å²	25	60.8 Å²	60.8	13%	0.131	32%	0.322	C	S	.	.			trans	-117.8	109.4	-175.9	-63.8	-180	0	0	0	110.3	L206 V229 R288 E290 D301 L302	L206-L293 HydrophobicContact CD2-CB 3.96Å; L206-L293 HydrophobicContact CD2-CD1 3.58Å; L206-L293 HydrophobicContact CD2-CG 4.43Å; V229-L293 HydrophobicContact CB-CD1 3.73Å; V229-L293 HydrophobicContact CG1-CD1 3.99Å; V229-L293 HydrophobicContact CG2-CD1 4.13Å; R288-L293 HydrophobicContact CB-CD1 3.82Å; R288-L293 HydrophobicContact CB-CD2 4.1Å; R288-L293 HydrophobicContact CB-CG 4.09Å; R288-L293 HydrophobicContact CG-CD2 4.38Å; E290-L293 PolarHBondContact O-N 3.12Å; L293-D301 HydrophobicContact CD2-CB 4.24Å; L293-L302 HydrophobicContact CD1-CD2 4.39Å; L293-L302 HydrophobicContact CD2-CD2 3.68Å; L293-L302 HydrophobicContact CD2-CG 4.38Å
294	M	80.3	Confident	84.8	Confident	121 Å²	121	61.4 Å²	61.4	60%	0.596	33%	0.327	S	S	*	.			trans	-106.8	128.6	167.7	-64	-122.3	-62.7	0	0	110	Y299 S300 D301	M294-Y299 HydrophobicContact CB-CE1 4.46Å; M294-S300 WeakPolarHBondContact O-CA 3.48Å; M294-D301 WeakPolarHBondContact CB-OD2 3.28Å; M294-D301 PolarHBondContact N-OD2 2.92Å; M294-D301 PolarHBondContact O-N 3.44Å
295	E	80.3	Confident	84.3	Confident	25 Å²	25	64.9 Å²	64.9	12%	0.117	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.9	170.1	-64.9	-151.1	127	0	0	110.3	Y205 L206 R233 Y299 S300 L302	Y205-E295 HydrophobicContact CD1-CB 4.38Å; L206-E295 HydrophobicContact CB-CG 4.26Å; L206-E295 WeakPolarHBondContact CB-OE2 3.44Å; L206-E295 PolarHBondContact N-OE2 3.25Å; R233-E295 IonicContact CZ-OE1 3.04Å; R233-E295 IonicContact NH1-OE1 3.27Å; R233-E295 IonicContact NH2-OE1 3.85Å; R233-E295 PolarHBondContact NH2-OE1 2.85Å; R233-E295 IonicContact NH2-OE2 2.77Å; E295-Y299 CarbonylContact C-O 3.51Å; E295-S300 PolarHBondContact OE1-OG 2.92Å; E295-L302 WeakPolarHBondContact OE1-CD1 3.26Å
296	T	73.6	Confident	83.8	Confident	64 Å²	64	68.7 Å²	68.7	39%	0.393	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	165.3	178.5	62.9	0	0	0	0	108.2	S298 Y299	T296-S298 PolarHBondContact O-N 3.41Å; T296-Y299 PolarHBondContact N-O 3.45Å; T296-Y299 PolarHBondContact O-N 2.92Å; T296-Y299 WeakPolarHBondContact OG1-CB 3.42Å; T296-Y299 PolarHBondContact OG1-N 2.88Å; T296-Y299 PolarHBondContact OG1-O 2.83Å
297	A	70.1	Confident	83.5	Confident	92 Å²	92	66.8 Å²	66.8	76%	0.76	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-30.8	177.4	0	0	0	0	0	113.8	Y205	Y205-A297 VanDerWaalsContact CE1-N 3.26Å; Y205-A297 WeakPolarHBondContact OH-CB 3.35Å; Y205-A297 PolarHBondContact OH-N 3.37Å
298	S	72.4	Confident	83.1	Confident	118 Å²	118	67.6 Å²	67.6	83%	0.825	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-14.9	-176.3	52.3	0	0	0	0	114.6	T296	T296-S298 PolarHBondContact O-N 3.41Å
299	Y	76.5	Confident	83	Confident	126 Å²	126	65 Å²	65	49%	0.494	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	134	-171.5	-179.9	-90.1	0	0	0	111.2	M294 E295 T296 D301	M294-Y299 HydrophobicContact CB-CE1 4.46Å; E295-Y299 CarbonylContact C-O 3.51Å; T296-Y299 PolarHBondContact N-O 3.45Å; T296-Y299 PolarHBondContact O-N 2.92Å; T296-Y299 WeakPolarHBondContact OG1-CB 3.42Å; T296-Y299 PolarHBondContact OG1-N 2.88Å; T296-Y299 PolarHBondContact OG1-O 2.83Å; Y299-D301 VanDerWaalsContact CE1-OD1 3.26Å; Y299-D301 WeakPolarHBondContact CE1-OD1 3.24Å; Y299-D301 VanDerWaalsContact CZ-OD1 3.3Å; Y299-D301 PolarHBondContact OH-OD1 2.96Å
300	S	83.1	Confident	83.2	Confident	31 Å²	31	62.9 Å²	62.9	22%	0.217	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	129.7	173.9	168.1	0	0	0	0	109.7	R233 M294 E295 L302	R233-S300 PolarHBondContact NH1-OG 3.47Å; M294-S300 WeakPolarHBondContact O-CA 3.48Å; E295-S300 PolarHBondContact OE1-OG 2.92Å; S300-L302 PolarHBondContact O-N 3.2Å; S300-L302 WeakPolarHBondContact OG-CB 3.12Å; S300-L302 PolarHBondContact OG-N 3.46Å; S300-L302 VanDerWaalsContact OG-N 3.15Å
301	D	84	Confident	83.4	Confident	43 Å²	43	62.7 Å²	62.7	23%	0.23	35%	0.353	C	S	.	.	S	Bend	trans	-69.3	-19.7	171.1	-75.8	-44.5	0	0	0	112.4	L293 M294 Y299 N303	L293-D301 HydrophobicContact CD2-CB 4.24Å; M294-D301 WeakPolarHBondContact CB-OD2 3.28Å; M294-D301 PolarHBondContact N-OD2 2.92Å; M294-D301 PolarHBondContact O-N 3.44Å; Y299-D301 VanDerWaalsContact CE1-OD1 3.26Å; Y299-D301 WeakPolarHBondContact CE1-OD1 3.24Å; Y299-D301 VanDerWaalsContact CZ-OD1 3.3Å; Y299-D301 PolarHBondContact OH-OD1 2.96Å; D301-N303 PolarHBondContact O-N 3.01Å
302	L	86.6	Confident	83.7	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	32%	0.321	C	S	.	.			trans	-77.4	46.4	170.3	-57.7	-177.3	0	0	0	111.1	A231 R233 W285 L293 E295 S300 Y759	A231-L302 HydrophobicContact CB-CD1 3.9Å; R233-L302 PolarHBondContact NH1-O 3.35Å; W285-L302 HydrophobicContact CB-CD2 4.01Å; W285-L302 HydrophobicContact CD2-CB 4.35Å; W285-L302 HydrophobicContact CD2-CD2 3.91Å; W285-L302 HydrophobicContact CE3-CD2 4.41Å; W285-L302 HydrophobicContact CG-CD2 3.7Å; W285-L302 HydrophobicContact CH2-CB 4.45Å; W285-L302 WeakPolarHBondContact CH2-O 3.4Å; W285-L302 VanDerWaalsContact CZ2-C 3.43Å; W285-L302 HydrophobicContact CZ2-CB 4.22Å; W285-L302 WeakPolarHBondContact CZ2-O 3.27Å; L293-L302 HydrophobicContact CD1-CD2 4.39Å; L293-L302 HydrophobicContact CD2-CD2 3.68Å; L293-L302 HydrophobicContact CD2-CG 4.38Å; E295-L302 WeakPolarHBondContact OE1-CD1 3.26Å; S300-L302 PolarHBondContact O-N 3.2Å; S300-L302 WeakPolarHBondContact OG-CB 3.12Å; S300-L302 PolarHBondContact OG-N 3.46Å; S300-L302 VanDerWaalsContact OG-N 3.15Å; L302-Y759 HydrophobicContact CD1-CE1 4.13Å
303	N	84.3	Confident	84	Confident	79 Å²	79	52.7 Å²	52.7	42%	0.422	30%	0.304	S	S	.	.			trans	-77.1	130.4	176.2	-175.6	-31.1	0	0	0	110	D301 S305 T306	D301-N303 PolarHBondContact O-N 3.01Å; N303-S305 VanDerWaalsContact CG-OG 3.25Å; N303-S305 PolarHBondContact O-N 3.04Å; N303-S305 VanDerWaalsContact O-N 3.1Å; N303-S305 PolarHBondContact OD1-N 3.41Å; N303-S305 PolarHBondContact OD1-OG 3.3Å; N303-T306 HydrophobicContact CB-CG2 4.08Å; N303-T306 PolarHBondContact O-N 3.29Å; N303-T306 PolarHBondContact O-OG1 3.17Å
304	A	86	Confident	84	Confident	12 Å²	12	51.7 Å²	51.7	10%	0.099	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-50.6	-37.1	179.6	0	0	0	0	0	113.3	I283 T306 W310 L733	I283-A304 HydrophobicContact CD1-CB 3.46Å; I283-A304 VanDerWaalsContact CD1-CB 3.46Å; A304-T306 VanDerWaalsContact C-N 3.29Å; A304-T306 PolarHBondContact O-N 2.75Å; A304-W310 HydrophobicContact CB-CZ2 3.85Å; A304-W310 WeakPolarHBondContact O-CZ2 3.43Å; A304-W310 PolarHBondContact O-NE1 3.03Å; A304-L733 HydrophobicContact CB-CD1 4.05Å
305	S	83.5	Confident	83.9	Confident	73 Å²	73	47.5 Å²	47.5	51%	0.51	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-69.9	-18.9	-177.7	62.4	0	0	0	0	114.8	N303	N303-S305 VanDerWaalsContact CG-OG 3.25Å; N303-S305 PolarHBondContact O-N 3.04Å; N303-S305 VanDerWaalsContact O-N 3.1Å; N303-S305 PolarHBondContact OD1-N 3.41Å; N303-S305 PolarHBondContact OD1-OG 3.3Å
306	T	83	Confident	83.2	Confident	85 Å²	85	47.8 Å²	47.8	52%	0.521	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-90.2	-13.9	-174.6	65.8	0	0	0	0	113.3	N303 A304	N303-T306 HydrophobicContact CB-CG2 4.08Å; N303-T306 PolarHBondContact O-N 3.29Å; N303-T306 PolarHBondContact O-OG1 3.17Å; A304-T306 VanDerWaalsContact C-N 3.29Å; A304-T306 PolarHBondContact O-N 2.75Å
307	T	86.1	Confident	82.5	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.018	28%	0.275	C	S	.	.			trans	-108	134.6	-179	-179.2	0	0	0	0	112.3	I283 V284 W285 H309 W310	I283-T307 HydrophobicContact CG2-CG2 3.31Å; V284-T307 PolarHBondContact O-OG1 3.3Å; W285-T307 HydrophobicContact CD2-CG2 4.21Å; W285-T307 HydrophobicContact CZ2-CG2 3.79Å; T307-H309 VanDerWaalsContact C-N 3.26Å; T307-H309 PolarHBondContact OG1-CD2 3.17Å; T307-H309 PolarHBondContact OG1-N 3.4Å; T307-W310 PolarHBondContact O-NE1 3.02Å
308	P	84.3	Confident	82	Confident	61 Å²	61	47.6 Å²	47.6	40%	0.396	27%	0.274	S	S	.	.	S	Bend	trans	-82.3	-3	172.4	34.8	-35.7	0	0	0	112.9	W310 G718	P308-W310 PolarHBondContact O-N 3.24Å; P308-G718 PolarHBondContact O-N 2.99Å
309	H	90.8	Very high	81.5	Confident	51 Å²	51	45.8 Å²	45.8	24%	0.236	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	79.9	-172.8	-57.3	-78.9	0	0	0	111.3	V284 T307 Y311	V284-H309 HydrophobicContact CB-CB 4.01Å; V284-H309 PolarHBondContact N-O 2.96Å; T307-H309 VanDerWaalsContact C-N 3.26Å; T307-H309 PolarHBondContact OG1-CD2 3.17Å; T307-H309 PolarHBondContact OG1-N 3.4Å; H309-Y311 HydrophobicContact CB-CE2 4.36Å
310	W	94	Very high	80.8	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	141.9	177.9	-75.5	35.5	0	0	0	109.8	L281 I283 A304 T307 P308 V715 A719 I727 D728 L733	L281-W310 HydrophobicContact CD1-CD2 4.38Å; L281-W310 HydrophobicContact CD1-CE3 3.89Å; L281-W310 HydrophobicContact CD2-CE3 4.32Å; L281-W310 HydrophobicContact CD2-CZ3 4.16Å; I283-W310 HydrophobicContact CD1-CD2 4.41Å; I283-W310 HydrophobicContact CD1-CZ2 4.03Å; I283-W310 HydrophobicContact CG1-CD2 4.4Å; I283-W310 HydrophobicContact CG1-CG 4.43Å; A304-W310 HydrophobicContact CB-CZ2 3.85Å; A304-W310 WeakPolarHBondContact O-CZ2 3.43Å; A304-W310 PolarHBondContact O-NE1 3.03Å; T307-W310 PolarHBondContact O-NE1 3.02Å; P308-W310 PolarHBondContact O-N 3.24Å; W310-V715 HydrophobicContact CB-CB 3.78Å; W310-V715 HydrophobicContact CB-CG1 4.49Å; W310-V715 HydrophobicContact CB-CG2 4.19Å; W310-V715 PolarHBondContact O-N 2.85Å; W310-A719 HydrophobicContact CH2-CB 3.91Å; W310-A719 HydrophobicContact CZ2-CB 3.61Å; W310-I727 HydrophobicContact CE3-CG2 4.16Å; W310-I727 HydrophobicContact CZ3-CB 4.29Å; W310-I727 HydrophobicContact CZ3-CG2 3.93Å; W310-D728 HydrophobicContact CH2-CB 4.07Å; W310-D728 HydrophobicContact CZ3-CB 4.37Å; W310-L733 HydrophobicContact CH2-CD1 3.88Å; W310-L733 HydrophobicContact CZ2-CD1 4.38Å; W310-L733 HydrophobicContact CZ3-CD1 4.49Å
311	Y	94.9	Very high	79.7	Confident	22 Å²	22	45.9 Å²	45.9	9%	0.086	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	132	177.7	-60.8	-97.4	0	0	0	108.7	L109 M282 V284 H309 E713 K714	L109-Y311 HydrophobicContact CD1-CD1 3.63Å; L109-Y311 HydrophobicContact CD1-CD2 3.91Å; L109-Y311 HydrophobicContact CD1-CE1 3.49Å; L109-Y311 VanDerWaalsContact CD1-CE1 3.49Å; L109-Y311 HydrophobicContact CD1-CE2 3.81Å; L109-Y311 HydrophobicContact CD1-CG 3.83Å; L109-Y311 HydrophobicContact CD2-CD1 4.33Å; L109-Y311 HydrophobicContact CD2-CD2 3.64Å; L109-Y311 HydrophobicContact CD2-CE2 4.23Å; L109-Y311 HydrophobicContact CD2-CG 3.71Å; L109-Y311 HydrophobicContact CG-CD2 4.32Å; L109-Y311 HydrophobicContact CG-CE2 4.46Å; L109-Y311 HydrophobicContact CG-CG 4.43Å; M282-Y311 PolarHBondContact N-O 2.91Å; M282-Y311 PolarHBondContact O-N 3.24Å; V284-Y311 HydrophobicContact CG2-CD2 4.13Å; V284-Y311 HydrophobicContact CG2-CE2 4.19Å; H309-Y311 HydrophobicContact CB-CE2 4.36Å; Y311-E713 WeakPolarHBondContact CA-O 3.43Å; Y311-K714 HydrophobicContact CD1-CB 3.81Å; Y311-K714 HydrophobicContact CD1-CG 4.06Å; Y311-K714 HydrophobicContact CE1-CB 3.65Å; Y311-K714 HydrophobicContact CE1-CD 3.95Å; Y311-K714 HydrophobicContact CE1-CG 3.62Å
312	L	93.4	Very high	78.7	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.3	174.8	-165.3	66.1	0	0	0	108.1	F279 L281 L688 F703 L707 K712 E713 V715 I727 F731	F279-L312 HydrophobicContact CB-CD1 4.1Å; F279-L312 HydrophobicContact CD1-CD1 4.37Å; F279-L312 HydrophobicContact CD1-CD2 4.01Å; F279-L312 HydrophobicContact CD1-CG 4.21Å; F279-L312 HydrophobicContact CE1-CD2 4.48Å; L281-L312 HydrophobicContact CB-CD1 4.18Å; L281-L312 HydrophobicContact CD1-CD1 4.43Å; L312-L688 HydrophobicContact CD2-CD2 4.3Å; L312-F703 HydrophobicContact CB-CZ 4.1Å; L312-F703 HydrophobicContact CD2-CE1 3.98Å; L312-F703 HydrophobicContact CD2-CZ 4.33Å; L312-L707 HydrophobicContact CB-CD1 4.37Å; L312-L707 HydrophobicContact CD2-CD2 3.66Å; L312-L707 HydrophobicContact CG-CD2 4.14Å; L312-L707 WeakPolarHBondContact O-CD1 3.27Å; L312-K712 CarbonylContact O-C 3.54Å; L312-K712 WeakPolarHBondContact O-CA 3.36Å; L312-E713 PolarHBondContact N-O 2.94Å; L312-E713 PolarHBondContact O-N 3.48Å; L312-V715 HydrophobicContact CB-CG2 4.38Å; L312-I727 HydrophobicContact CB-CD1 4.48Å; L312-I727 HydrophobicContact CD2-CD1 3.97Å; L312-I727 HydrophobicContact CD2-CG1 4.32Å; L312-F731 HydrophobicContact CD1-CE2 3.86Å; L312-F731 HydrophobicContact CD1-CZ 4.12Å
313	K	91.7	Very high	77.3	Confident	73 Å²	73	55.4 Å²	55.4	32%	0.317	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.8	176.1	171.1	178.4	163.4	-135.1	0	109.7	F279 E280 M282 K711 K712	F279-K313 WeakPolarHBondContact CA-O 3.42Å; E280-K313 HydrophobicContact CB-CB 4.16Å; E280-K313 PolarHBondContact N-O 3Å; E280-K313 PolarHBondContact O-N 2.95Å; E280-K313 IonicContact OE1-NZ 2.65Å; E280-K313 WeakPolarHBondContact OE2-CD 3.22Å; E280-K313 WeakPolarHBondContact OE2-CE 3.3Å; E280-K313 IonicContact OE2-NZ 3.22Å; E280-K313 PolarHBondContact OE2-NZ 3.46Å; M282-K313 HydrophobicContact CE-CB 3.38Å; M282-K313 HydrophobicContact CE-CD 3.93Å; M282-K313 HydrophobicContact CE-CG 4.29Å; K313-K711 WeakPolarHBondContact CA-O 3.48Å; K313-K712 HydrophobicContact CB-CB 4.23Å; K313-K712 HydrophobicContact CB-CG 4.25Å; K313-K712 HydrophobicContact CG-CB 4.43Å
314	L	86.1	Confident	76.1	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	114.8	168.2	-65.3	170	0	0	0	107.7	F279 A317 M680 V684 L707 V708 K711	F279-L314 HydrophobicContact CD1-CD2 3.88Å; F279-L314 HydrophobicContact CE1-CD2 3.59Å; F279-L314 HydrophobicContact CZ-CD2 4.43Å; L314-A317 HydrophobicContact CB-CB 4.29Å; L314-M680 HydrophobicContact CD1-CE 4.41Å; L314-M680 HydrophobicContact CD1-CG 4.48Å; L314-M680 HydrophobicContact CD1-SD 4.12Å; L314-V684 HydrophobicContact CD1-CG2 4.29Å; L314-V684 HydrophobicContact CD2-CG2 3.65Å; L314-L707 HydrophobicContact CD1-CG 4.02Å; L314-L707 HydrophobicContact CD2-CD2 4.16Å; L314-L707 HydrophobicContact CD2-CG 4.29Å; L314-L707 HydrophobicContact CG-CD1 4.15Å; L314-L707 HydrophobicContact CG-CD2 4.27Å; L314-L707 HydrophobicContact CG-CG 3.87Å; L314-V708 HydrophobicContact CD1-CG2 4.23Å; L314-K711 PolarHBondContact N-O 2.89Å
315	A	77.2	Confident	74.7	Confident	33 Å²	33	52.1 Å²	52.1	27%	0.273	28%	0.283	S	S	.	.	S	Bend	trans	-81.9	-30.4	-179.6	0	0	0	0	0	112.1	S278 E280 A317	S278-A315 PolarHBondContact O-N 3.21Å; S278-A315 VanDerWaalsContact OG-CB 3.25Å; S278-A315 WeakPolarHBondContact OG-CB 3.34Å; E280-A315 HydrophobicContact CG-CB 3.91Å; A315-A317 VanDerWaalsContact C-N 3.27Å; A315-A317 PolarHBondContact O-N 3.23Å
316	S	66.2	Low	73.4	Confident	31 Å²	31	49.4 Å²	49.4	22%	0.217	26%	0.262	C	S	.	.	S	Bend	trans	-89.6	39.7	174.8	71.1	0	0	0	0	113.1	P276 S278 D318	P276-S316 PolarHBondContact O-OG 3.35Å; S278-S316 WeakPolarHBondContact OG-CB 3.48Å; S278-S316 PolarHBondContact OG-N 3.06Å; S316-D318 PolarHBondContact O-N 3.31Å
317	A	58.5	Low	72.4	Confident	15 Å²	15	47.6 Å²	47.6	12%	0.124	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-3.4	-169.1	0	0	0	0	0	115.2	L314 A315 K711	L314-A317 HydrophobicContact CB-CB 4.29Å; A315-A317 VanDerWaalsContact C-N 3.27Å; A315-A317 PolarHBondContact O-N 3.23Å; A317-K711 HydrophobicContact CB-CB 4.27Å; A317-K711 HydrophobicContact CB-CD 3.54Å; A317-K711 HydrophobicContact CB-CG 3.86Å; A317-K711 WeakPolarHBondContact O-CE 3.25Å; A317-K711 PolarHBondContact O-NZ 3.26Å
318	D	58.9	Low	71.1	Confident	137 Å²	137	51.6 Å²	51.6	73%	0.733	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	20.5	-178.2	-55.7	-29.2	0	0	0	112	S316 E320 K711	S316-D318 PolarHBondContact O-N 3.31Å; D318-E320 PolarHBondContact O-N 3.4Å; D318-K711 IonicContact OD1-NZ 2.9Å; D318-K711 PolarHBondContact OD1-NZ 2.88Å
319	F	61.7	Low	69.9	Low	80 Å²	80	50 Å²	50	35%	0.351	26%	0.257	S	S	.	.			trans	-69.6	125.7	169.5	176.3	-89.3	0	0	0	110.1	F275 L321 T676	F275-F319 AromaticContact CD2-CD1 3.96Å; F275-F319 HydrophobicContact CD2-CD1 3.96Å; F275-F319 HydrophobicContact CD2-CD2 4.31Å; F275-F319 AromaticContact CD2-CE1 3.96Å; F275-F319 HydrophobicContact CD2-CE1 3.96Å; F275-F319 HydrophobicContact CD2-CE2 4.34Å; F275-F319 HydrophobicContact CD2-CG 4.1Å; F275-F319 HydrophobicContact CD2-CZ 4.15Å; F275-F319 HydrophobicContact CE2-CB 3.77Å; F275-F319 AromaticContact CE2-CD1 3.36Å; F275-F319 HydrophobicContact CE2-CD1 3.36Å; F275-F319 HydrophobicContact CE2-CD2 4.04Å; F275-F319 AromaticContact CE2-CE1 3.83Å; F275-F319 HydrophobicContact CE2-CE1 3.83Å; F275-F319 HydrophobicContact CE2-CE2 4.47Å; F275-F319 AromaticContact CE2-CG 3.44Å; F275-F319 HydrophobicContact CE2-CG 3.44Å; F275-F319 VanDerWaalsContact CE2-CG 3.44Å; F275-F319 HydrophobicContact CE2-CZ 4.36Å; F275-F319 HydrophobicContact CZ-CB 4.09Å; F275-F319 HydrophobicContact CZ-CD1 4.4Å; F275-F319 HydrophobicContact CZ-CG 4.25Å; F319-L321 HydrophobicContact CE1-CD2 3.83Å; F319-L321 HydrophobicContact CE1-CG 3.99Å; F319-L321 HydrophobicContact CZ-CD2 3.96Å; F319-T676 HydrophobicContact CD1-CG2 4.11Å; F319-T676 WeakPolarHBondContact O-CG2 3.23Å
320	E	63	Low	68.4	Low	149 Å²	149	48.6 Å²	48.6	70%	0.696	25%	0.251	S	S	*	.			trans	-117.2	139	165.6	-66.5	-176.7	173.1	0	0	108.4	D318 E322	D318-E320 PolarHBondContact O-N 3.4Å; E320-E322 PolarHBondContact O-N 2.95Å
321	L	60	Low	66.9	Low	9 Å²	9	55.5 Å²	55.5	5%	0.047	28%	0.281	C	S	.	.			trans	-59.9	131.1	169.9	-73.2	167.2	0	0	0	108.9	S271 F319 S323 P325 L672 E675 T676	S271-L321 WeakPolarHBondContact OG-CD2 3.43Å; F319-L321 HydrophobicContact CE1-CD2 3.83Å; F319-L321 HydrophobicContact CE1-CG 3.99Å; F319-L321 HydrophobicContact CZ-CD2 3.96Å; L321-S323 PolarHBondContact O-N 2.91Å; L321-P325 HydrophobicContact CD1-CG 4.49Å; L321-L672 HydrophobicContact CB-CD1 3.62Å; L321-L672 HydrophobicContact CB-CG 4.48Å; L321-L672 WeakPolarHBondContact O-CD1 3.35Å; L321-E675 HydrophobicContact CD1-CB 3.74Å; L321-T676 PolarHBondContact N-OG1 3.47Å
322	E	61.8	Low	65.1	Low	199 Å²	199	55.5 Å²	55.5	93%	0.93	28%	0.282	S	S	*	.	S	Bend	trans	-63.2	-26.2	176.8	-66.8	-176	165	0	0	112.7	E320	E320-E322 PolarHBondContact O-N 2.95Å
323	S	58	Low	63.6	Low	47 Å²	47	55.7 Å²	55.7	33%	0.329	28%	0.283	S	S	.	.	S	Bend	trans	-158.2	141.9	-179.9	45.6	0	0	0	0	110.5	L321 P325 K328	L321-S323 PolarHBondContact O-N 2.91Å; S323-P325 VanDerWaalsContact O-CD 3.26Å; S323-P325 WeakPolarHBondContact O-CD 3.21Å; S323-K328 WeakPolarHBondContact OG-CE 3.31Å; S323-K328 PolarHBondContact OG-NZ 2.84Å
324	S	58.7	Low	62.1	Low	6 Å²	6	57 Å²	57	4%	0.042	29%	0.291	C	S	.	.			trans	-69.1	120.2	-178.1	159.2	0	0	0	0	110.5	F326 T327 K328 V671 L672 E675	S324-F326 PolarHBondContact O-N 3.32Å; S324-F326 WeakPolarHBondContact OG-CB 3.41Å; S324-F326 PolarHBondContact OG-N 2.67Å; S324-T327 WeakPolarHBondContact CB-OG1 3.25Å; S324-T327 PolarHBondContact O-N 3.24Å; S324-T327 VanDerWaalsContact O-N 3.17Å; S324-T327 PolarHBondContact OG-N 2.77Å; S324-T327 PolarHBondContact OG-OG1 2.96Å; S324-K328 PolarHBondContact O-N 3.43Å; S324-V671 VanDerWaalsContact OG-CG1 3.27Å; S324-V671 WeakPolarHBondContact OG-CG1 3.22Å; S324-L672 VanDerWaalsContact N-CD1 3.32Å; S324-E675 WeakPolarHBondContact CA-OE2 3.48Å; S324-E675 WeakPolarHBondContact CB-OE2 3.47Å; S324-E675 PolarHBondContact OG-OE2 2.9Å
325	P	56.6	Low	61	Low	16 Å²	16	57.8 Å²	57.8	10%	0.104	30%	0.297	C	S	.	.	H	α-helix	trans	-55.6	-36.8	170.1	-25.5	33.3	0	0	0	113.1	P270 L321 S323 K328 L329 E675	P270-P325 HydrophobicContact CB-CB 3.51Å; P270-P325 HydrophobicContact CB-CG 3.58Å; P270-P325 HydrophobicContact CG-CB 3.68Å; P270-P325 HydrophobicContact CG-CG 4.3Å; L321-P325 HydrophobicContact CD1-CG 4.49Å; S323-P325 VanDerWaalsContact O-CD 3.26Å; S323-P325 WeakPolarHBondContact O-CD 3.21Å; P325-K328 WeakPolarHBondContact O-CB 3.35Å; P325-K328 PolarHBondContact O-N 2.84Å; P325-L329 PolarHBondContact O-N 2.82Å; P325-E675 WeakPolarHBondContact CD-OE1 3.39Å; P325-E675 VanDerWaalsContact CD-OE2 3.25Å; P325-E675 WeakPolarHBondContact CD-OE2 3.42Å
326	F	57.4	Low	60.1	Low	16 Å²	16	61.3 Å²	61.3	7%	0.07	32%	0.319	C	S	.	.	H	α-helix	trans	-61.3	-46.3	173.1	-178.7	-101.7	0	0	0	112.1	S324 K328 L329 I330 M472 L473 V671 E675	S324-F326 PolarHBondContact O-N 3.32Å; S324-F326 WeakPolarHBondContact OG-CB 3.41Å; S324-F326 PolarHBondContact OG-N 2.67Å; F326-K328 VanDerWaalsContact C-N 3.27Å; F326-K328 PolarHBondContact O-N 3.21Å; F326-L329 CarbonylContact O-C 3.49Å; F326-L329 WeakPolarHBondContact O-CA 3.2Å; F326-L329 WeakPolarHBondContact O-CB 3.33Å; F326-L329 PolarHBondContact O-N 2.79Å; F326-I330 HydrophobicContact CD1-CG1 4.02Å; F326-I330 HydrophobicContact CE1-CD1 4.06Å; F326-I330 HydrophobicContact CE1-CG1 3.61Å; F326-I330 HydrophobicContact CE2-CD1 4.08Å; F326-I330 HydrophobicContact CE2-CG1 4.28Å; F326-I330 HydrophobicContact CZ-CD1 3.66Å; F326-I330 HydrophobicContact CZ-CG1 3.76Å; F326-I330 WeakPolarHBondContact O-CG1 3.24Å; F326-I330 PolarHBondContact O-N 2.73Å; F326-M472 HydrophobicContact CB-CE 3.4Å; F326-M472 VanDerWaalsContact CB-CE 3.4Å; F326-M472 HydrophobicContact CB-SD 4.36Å; F326-M472 HydrophobicContact CD1-CE 3.77Å; F326-M472 HydrophobicContact CD2-CB 3.61Å; F326-M472 HydrophobicContact CD2-CE 3.89Å; F326-M472 HydrophobicContact CD2-SD 4.37Å; F326-M472 HydrophobicContact CE1-CE 4.5Å; F326-M472 VanDerWaalsContact CE2-C 3.44Å; F326-M472 HydrophobicContact CE2-CB 3.47Å; F326-M472 VanDerWaalsContact CE2-CB 3.47Å; F326-M472 HydrophobicContact CG-CB 4.23Å; F326-M472 HydrophobicContact CG-CE 3.4Å; F326-M472 HydrophobicContact CG-SD 4.39Å; F326-M472 HydrophobicContact CZ-CB 3.94Å; F326-M472 WeakPolarHBondContact CZ-O 3.35Å; F326-L473 VanDerWaalsContact CE2-CA 3.48Å; F326-L473 HydrophobicContact CE2-CB 3.91Å; F326-L473 HydrophobicContact CE2-CD1 4.25Å; F326-L473 VanDerWaalsContact CE2-N 3.28Å; F326-L473 HydrophobicContact CZ-CD1 4.46Å; F326-V671 HydrophobicContact CB-CG1 4.02Å; F326-V671 HydrophobicContact CD1-CG1 3.99Å; F326-V671 HydrophobicContact CG-CG1 4.36Å; F326-E675 WeakPolarHBondContact CB-OE1 3.44Å; F326-E675 PolarHBondContact N-OE1 3.45Å
327	T	61.3	Low	59.7	Low	48 Å²	48	64.6 Å²	64.6	29%	0.294	33%	0.331	S	S	.	.	H	α-helix	trans	-61.3	-38.6	177.1	-55.1	0	0	0	0	111.2	S324 I330 F331	S324-T327 WeakPolarHBondContact CB-OG1 3.25Å; S324-T327 PolarHBondContact O-N 3.24Å; S324-T327 VanDerWaalsContact O-N 3.17Å; S324-T327 PolarHBondContact OG-N 2.77Å; S324-T327 PolarHBondContact OG-OG1 2.96Å; T327-I330 PolarHBondContact O-N 2.65Å; T327-F331 WeakPolarHBondContact O-CB 3.36Å; T327-F331 PolarHBondContact O-N 3.36Å
328	K	59.5	Low	59.5	Low	86 Å²	86	68.3 Å²	68.3	37%	0.374	35%	0.348	S	S	.	.	H	α-helix	trans	-62.5	-42.5	171.9	-69.1	175.1	-176.6	165.7	0	111.6	S323 S324 P325 F326 F331 L332	S323-K328 WeakPolarHBondContact OG-CE 3.31Å; S323-K328 PolarHBondContact OG-NZ 2.84Å; S324-K328 PolarHBondContact O-N 3.43Å; P325-K328 WeakPolarHBondContact O-CB 3.35Å; P325-K328 PolarHBondContact O-N 2.84Å; F326-K328 VanDerWaalsContact C-N 3.27Å; F326-K328 PolarHBondContact O-N 3.21Å; K328-F331 PolarHBondContact O-N 3.25Å; K328-L332 WeakPolarHBondContact O-CB 3.4Å; K328-L332 VanDerWaalsContact O-CD1 3.28Å; K328-L332 WeakPolarHBondContact O-CD1 3.36Å; K328-L332 WeakPolarHBondContact O-CG 3.46Å; K328-L332 PolarHBondContact O-N 3.16Å
329	L	58.4	Low	59.2	Low	29 Å²	29	63 Å²	63	15%	0.152	32%	0.321	C	S	.	.	H	α-helix	trans	-63	-42.3	176.6	-177.9	67.1	0	0	0	111.7	P325 F326 L332 I333 L438	P325-L329 PolarHBondContact O-N 2.82Å; F326-L329 CarbonylContact O-C 3.49Å; F326-L329 WeakPolarHBondContact O-CA 3.2Å; F326-L329 WeakPolarHBondContact O-CB 3.33Å; F326-L329 PolarHBondContact O-N 2.79Å; L329-L332 WeakPolarHBondContact O-CB 3.41Å; L329-L332 PolarHBondContact O-N 3.23Å; L329-I333 HydrophobicContact CD1-CD1 4.42Å; L329-I333 HydrophobicContact CG-CD1 4.01Å; L329-I333 WeakPolarHBondContact O-CB 3.41Å; L329-I333 VanDerWaalsContact O-CG1 3.29Å; L329-I333 WeakPolarHBondContact O-CG1 3.18Å; L329-I333 PolarHBondContact O-N 2.88Å; L329-L438 HydrophobicContact CD1-CD2 4.16Å
330	I	59.5	Low	58.8	Low	20 Å²	20	60.7 Å²	60.7	10%	0.103	32%	0.315	C	S	.	.	H	α-helix	trans	-62.8	-48.7	174.2	-64.6	-54.2	0	0	0	110.5	F326 T327 L332 I333 E334 W445 L473	F326-I330 HydrophobicContact CD1-CG1 4.02Å; F326-I330 HydrophobicContact CE1-CD1 4.06Å; F326-I330 HydrophobicContact CE1-CG1 3.61Å; F326-I330 HydrophobicContact CE2-CD1 4.08Å; F326-I330 HydrophobicContact CE2-CG1 4.28Å; F326-I330 HydrophobicContact CZ-CD1 3.66Å; F326-I330 HydrophobicContact CZ-CG1 3.76Å; F326-I330 WeakPolarHBondContact O-CG1 3.24Å; F326-I330 PolarHBondContact O-N 2.73Å; T327-I330 PolarHBondContact O-N 2.65Å; I330-L332 PolarHBondContact O-N 3.42Å; I330-I333 HydrophobicContact CD1-CD1 4.47Å; I330-I333 CarbonylContact O-C 3.55Å; I330-I333 WeakPolarHBondContact O-CA 3.27Å; I330-I333 WeakPolarHBondContact O-CB 3.37Å; I330-I333 PolarHBondContact O-N 3.35Å; I330-E334 HydrophobicContact CG2-CG 4.27Å; I330-E334 WeakPolarHBondContact O-CG 3.22Å; I330-E334 PolarHBondContact O-N 3.09Å; I330-W445 HydrophobicContact CD1-CD2 4.2Å; I330-W445 HydrophobicContact CD1-CE3 3.74Å; I330-W445 HydrophobicContact CD1-CH2 3.66Å; I330-W445 HydrophobicContact CD1-CZ2 4.08Å; I330-W445 HydrophobicContact CD1-CZ3 3.46Å; I330-W445 VanDerWaalsContact CD1-CZ3 3.46Å; I330-W445 HydrophobicContact CG1-CH2 4.32Å; I330-W445 HydrophobicContact CG2-CH2 4.26Å; I330-W445 HydrophobicContact CG2-CZ2 3.79Å; I330-L473 HydrophobicContact CD1-CD1 3.45Å; I330-L473 VanDerWaalsContact CD1-CD1 3.45Å
331	F	62.9	Low	58.4	Low	145 Å²	145	59 Å²	59	64%	0.636	31%	0.307	S	S	*	.	H	α-helix	trans	-56.5	-39.5	176.4	-178.6	-94.2	0	0	0	112.2	T327 K328 E334 S335	T327-F331 WeakPolarHBondContact O-CB 3.36Å; T327-F331 PolarHBondContact O-N 3.36Å; K328-F331 PolarHBondContact O-N 3.25Å; F331-E334 PolarHBondContact O-N 2.86Å; F331-S335 WeakPolarHBondContact O-CB 3.12Å; F331-S335 PolarHBondContact O-N 3.24Å
332	L	57.3	Low	57.9	Low	23 Å²	23	61 Å²	61	12%	0.12	31%	0.313	C	S	.	.	H	α-helix	trans	-65.5	-44	174.7	-75.3	159.6	0	0	0	112.4	L268 K328 L329 I330 E334 S335 W342	L268-L332 HydrophobicContact CD2-CD1 3.3Å; L268-L332 HydrophobicContact CD2-CD2 4.35Å; L268-L332 HydrophobicContact CD2-CG 4.37Å; L268-L332 HydrophobicContact CG-CD1 3.95Å; K328-L332 WeakPolarHBondContact O-CB 3.4Å; K328-L332 VanDerWaalsContact O-CD1 3.28Å; K328-L332 WeakPolarHBondContact O-CD1 3.36Å; K328-L332 WeakPolarHBondContact O-CG 3.46Å; K328-L332 PolarHBondContact O-N 3.16Å; L329-L332 WeakPolarHBondContact O-CB 3.41Å; L329-L332 PolarHBondContact O-N 3.23Å; I330-L332 PolarHBondContact O-N 3.42Å; L332-E334 VanDerWaalsContact C-N 3.28Å; L332-E334 PolarHBondContact O-N 3.32Å; L332-S335 PolarHBondContact O-N 2.66Å; L332-S335 PolarHBondContact O-OG 3.23Å; L332-W342 HydrophobicContact CD2-CH2 3.16Å; L332-W342 HydrophobicContact CD2-CZ2 4.21Å; L332-W342 HydrophobicContact CD2-CZ3 3.34Å
333	I	60.7	Low	57.4	Low	4 Å²	4	51.8 Å²	51.8	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-61.2	-38.7	175.5	-77.3	166.8	0	0	0	110.8	L329 I330 L441 R442 W445 L473	L329-I333 HydrophobicContact CD1-CD1 4.42Å; L329-I333 HydrophobicContact CG-CD1 4.01Å; L329-I333 WeakPolarHBondContact O-CB 3.41Å; L329-I333 VanDerWaalsContact O-CG1 3.29Å; L329-I333 WeakPolarHBondContact O-CG1 3.18Å; L329-I333 PolarHBondContact O-N 2.88Å; I330-I333 HydrophobicContact CD1-CD1 4.47Å; I330-I333 CarbonylContact O-C 3.55Å; I330-I333 WeakPolarHBondContact O-CA 3.27Å; I330-I333 WeakPolarHBondContact O-CB 3.37Å; I330-I333 PolarHBondContact O-N 3.35Å; I333-L441 HydrophobicContact CD1-CB 4.46Å; I333-R442 HydrophobicContact CG2-CB 4.11Å; I333-R442 HydrophobicContact CG2-CG 4.32Å; I333-R442 WeakPolarHBondContact O-CD 3.22Å; I333-R442 WeakPolarHBondContact O-CG 3.4Å; I333-R442 PolarHBondContact O-NE 2.93Å; I333-W445 HydrophobicContact CG2-CB 3.54Å; I333-W445 HydrophobicContact CG2-CD2 4.43Å; I333-W445 HydrophobicContact CG2-CG 3.59Å; I333-L473 HydrophobicContact CD1-CD1 3.92Å; I333-L473 HydrophobicContact CD1-CD2 4.11Å
334	E	60	Low	57.1	Low	100 Å²	100	52 Å²	52	47%	0.467	27%	0.268	S	S	.	.	H	α-helix	trans	-79.5	-26	179.2	-68.8	-178.1	163.9	0	0	113	I330 F331 L332 S336 W445	I330-E334 HydrophobicContact CG2-CG 4.27Å; I330-E334 WeakPolarHBondContact O-CG 3.22Å; I330-E334 PolarHBondContact O-N 3.09Å; F331-E334 PolarHBondContact O-N 2.86Å; L332-E334 VanDerWaalsContact C-N 3.28Å; L332-E334 PolarHBondContact O-N 3.32Å; E334-S336 PolarHBondContact O-N 3.43Å; E334-W445 PolarHBondContact OE1-NE1 3.08Å
335	S	64	Low	57.1	Low	21 Å²	21	56.2 Å²	56.2	15%	0.147	30%	0.296	C	S	.	.			trans	-58.4	135.7	-179.6	78	0	0	0	0	111.6	F331 L332 E337 R442	F331-S335 WeakPolarHBondContact O-CB 3.12Å; F331-S335 PolarHBondContact O-N 3.24Å; L332-S335 PolarHBondContact O-N 2.66Å; L332-S335 PolarHBondContact O-OG 3.23Å; S335-E337 PolarHBondContact O-N 3.49Å; S335-R442 PolarHBondContact O-NH1 3.07Å; S335-R442 PolarHBondContact O-NH2 2.65Å
336	S	57.8	Low	57.1	Low	107 Å²	107	57.3 Å²	57.3	75%	0.748	30%	0.304	S	S	*	.			trans	-75.2	-10.4	177.9	54.3	0	0	0	0	113.7	E334	E334-S336 PolarHBondContact O-N 3.43Å
337	E	57.3	Low	57	Low	99 Å²	99	57.1 Å²	57.1	46%	0.463	30%	0.304	S	S	.	.	S	Bend	trans	-67	134.4	178	-60.7	-171.8	-177.5	0	0	110.4	S335 W342	S335-E337 PolarHBondContact O-N 3.49Å; E337-W342 WeakPolarHBondContact OE2-CZ2 3.43Å; E337-W342 PolarHBondContact OE2-NE1 3.12Å
338	L	55.1	Low	56.7	Low	93 Å²	93	60.7 Å²	60.7	49%	0.487	31%	0.312	S	S	.	.			trans	-77	128.6	174.6	-68.2	164.9	0	0	0	107.8	S340 E341	L338-S340 WeakPolarHBondContact CB-OG 3.49Å; L338-S340 PolarHBondContact O-N 3.36Å; L338-S340 VanDerWaalsContact O-N 3.16Å; L338-E341 HydrophobicContact CB-CG 4.15Å; L338-E341 WeakPolarHBondContact O-CA 3.42Å; L338-E341 WeakPolarHBondContact O-CB 3.15Å; L338-E341 PolarHBondContact O-N 2.91Å
339	V	52.8	Low	56.7	Low	27 Å²	27	60.6 Å²	60.6	16%	0.164	32%	0.322	C	S	.	.	H	α-helix	trans	-58.3	-31.1	176	170	0	0	0	0	111	E341 W342 L343 D435 L438	V339-E341 PolarHBondContact O-N 3.26Å; V339-E341 VanDerWaalsContact O-N 3.14Å; V339-W342 WeakPolarHBondContact O-CA 3.42Å; V339-W342 WeakPolarHBondContact O-CB 3.44Å; V339-W342 PolarHBondContact O-N 2.88Å; V339-L343 PolarHBondContact O-N 3.5Å; V339-D435 WeakPolarHBondContact CB-OD1 2.89Å; V339-D435 WeakPolarHBondContact CG1-OD1 3.3Å; V339-L438 HydrophobicContact CB-CD1 4.43Å; V339-L438 HydrophobicContact CG1-CD1 4.08Å; V339-L438 HydrophobicContact CG2-CB 4.47Å; V339-L438 HydrophobicContact CG2-CD1 3.73Å
340	S	53.5	Low	56.9	Low	31 Å²	31	60.2 Å²	60.2	22%	0.217	32%	0.319	C	S	.	.	H	α-helix	trans	-51.6	-32.4	167.9	70.6	0	0	0	0	113.6	L338 W342 L343 R348 D435	L338-S340 WeakPolarHBondContact CB-OG 3.49Å; L338-S340 PolarHBondContact O-N 3.36Å; L338-S340 VanDerWaalsContact O-N 3.16Å; S340-W342 PolarHBondContact O-N 3.4Å; S340-L343 PolarHBondContact O-N 3.49Å; S340-R348 PolarHBondContact O-NE 2.97Å; S340-R348 PolarHBondContact O-NH2 3.14Å; S340-R348 VanDerWaalsContact O-NH2 3.13Å; S340-D435 PolarHBondContact N-OD1 2.94Å
341	E	54.9	Low	57.1	Low	112 Å²	112	63.9 Å²	63.9	52%	0.523	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-24.2	174.7	-70.1	-178.7	171.6	0	0	113.6	L338 V339 R348	L338-E341 HydrophobicContact CB-CG 4.15Å; L338-E341 WeakPolarHBondContact O-CA 3.42Å; L338-E341 WeakPolarHBondContact O-CB 3.15Å; L338-E341 PolarHBondContact O-N 2.91Å; V339-E341 PolarHBondContact O-N 3.26Å; V339-E341 VanDerWaalsContact O-N 3.14Å; E341-R348 PolarHBondContact O-NH2 2.97Å
342	W	49.6	Very low	57.4	Low	51 Å²	51	59.7 Å²	59.7	19%	0.193	34%	0.344	C	S	.	.	H	α-helix	trans	-92.4	-13.8	-179.7	-61.6	11.4	0	0	0	112.5	N264 L268 L332 E337 V339 S340	N264-W342 HydrophobicContact CB-CB 4.16Å; N264-W342 HydrophobicContact CB-CE3 4.15Å; N264-W342 PolarHBondContact ND2-O 3.24Å; L268-W342 HydrophobicContact CD1-CE3 4.43Å; L268-W342 HydrophobicContact CD1-CZ3 4.48Å; L332-W342 HydrophobicContact CD2-CH2 3.16Å; L332-W342 HydrophobicContact CD2-CZ2 4.21Å; L332-W342 HydrophobicContact CD2-CZ3 3.34Å; E337-W342 WeakPolarHBondContact OE2-CZ2 3.43Å; E337-W342 PolarHBondContact OE2-NE1 3.12Å; V339-W342 WeakPolarHBondContact O-CA 3.42Å; V339-W342 WeakPolarHBondContact O-CB 3.44Å; V339-W342 PolarHBondContact O-N 2.88Å; S340-W342 PolarHBondContact O-N 3.4Å
343	L	49.7	Very low	57.9	Low	6 Å²	6	59 Å²	59	3%	0.031	34%	0.34	C	S	.	.	S	Bend	trans	-78.5	135.2	174.5	-64.4	177.5	0	0	0	110.4	F265 V339 S340 V347 R348 A431 D435	F265-L343 HydrophobicContact CE2-CD2 3.92Å; F265-L343 HydrophobicContact CZ-CD2 4.19Å; V339-L343 PolarHBondContact O-N 3.5Å; S340-L343 PolarHBondContact O-N 3.49Å; L343-V347 HydrophobicContact CB-CB 4.28Å; L343-V347 HydrophobicContact CB-CG1 4.36Å; L343-V347 HydrophobicContact CD1-CG1 4.12Å; L343-R348 HydrophobicContact CB-CG 4.48Å; L343-R348 PolarHBondContact O-NE 3.14Å; L343-R348 PolarHBondContact O-NH2 2.83Å; L343-A431 HydrophobicContact CD2-CB 3.85Å; L343-D435 HydrophobicContact CD1-CB 4.18Å
344	D	52.1	Low	58.5	Low	51 Å²	51	63.3 Å²	63.3	27%	0.273	36%	0.364	S	S	.	.			trans	-47.1	133.3	171.6	179	-61.9	0	0	0	109.5	S346 V347 R348	D344-S346 PolarHBondContact O-N 2.75Å; D344-S346 WeakPolarHBondContact OD1-CA 3.42Å; D344-S346 WeakPolarHBondContact OD1-CB 3.31Å; D344-S346 PolarHBondContact OD1-N 3.36Å; D344-S346 PolarHBondContact OD1-OG 2.93Å; D344-V347 HydrophobicContact CB-CG2 4.07Å; D344-V347 WeakPolarHBondContact O-CA 3.42Å; D344-V347 VanDerWaalsContact O-CB 3.29Å; D344-V347 WeakPolarHBondContact O-CB 3.22Å; D344-V347 PolarHBondContact O-N 2.93Å; D344-R348 PolarHBondContact O-N 2.67Å
345	P	59.5	Low	59.2	Low	96 Å²	96	63.9 Å²	63.9	62%	0.623	37%	0.37	S	S	*	.	H	α-helix	trans	-52.3	-29.3	-178.1	-27.3	34	0	0	0	113.8	V347 R348 S349	P345-V347 VanDerWaalsContact C-N 3.3Å; P345-V347 PolarHBondContact O-N 2.8Å; P345-R348 PolarHBondContact O-N 3.45Å; P345-S349 PolarHBondContact O-N 3.31Å
346	S	56	Low	59.7	Low	39 Å²	39	65.9 Å²	65.9	27%	0.273	38%	0.377	S	S	.	.	H	α-helix	trans	-69.5	-25.9	176.6	81.2	0	0	0	0	113.5	D344 S349 R428	D344-S346 PolarHBondContact O-N 2.75Å; D344-S346 WeakPolarHBondContact OD1-CA 3.42Å; D344-S346 WeakPolarHBondContact OD1-CB 3.31Å; D344-S346 PolarHBondContact OD1-N 3.36Å; D344-S346 PolarHBondContact OD1-OG 2.93Å; S346-S349 PolarHBondContact O-OG 3.49Å; S346-R428 VanDerWaalsContact CB-NH2 3.29Å; S346-R428 PolarHBondContact O-NE 3.44Å; S346-R428 PolarHBondContact OG-NH2 3.49Å
347	V	55.3	Low	60.6	Low	12 Å²	12	61 Å²	61	7%	0.073	34%	0.343	C	S	.	.	H	α-helix	trans	-72.7	-43.9	168.9	-178.5	0	0	0	0	109.8	L343 D344 P345 S349 F350 R428 A431 L432	L343-V347 HydrophobicContact CB-CB 4.28Å; L343-V347 HydrophobicContact CB-CG1 4.36Å; L343-V347 HydrophobicContact CD1-CG1 4.12Å; D344-V347 HydrophobicContact CB-CG2 4.07Å; D344-V347 WeakPolarHBondContact O-CA 3.42Å; D344-V347 VanDerWaalsContact O-CB 3.29Å; D344-V347 WeakPolarHBondContact O-CB 3.22Å; D344-V347 PolarHBondContact O-N 2.93Å; P345-V347 VanDerWaalsContact C-N 3.3Å; P345-V347 PolarHBondContact O-N 2.8Å; V347-S349 VanDerWaalsContact C-N 3.26Å; V347-S349 PolarHBondContact O-N 3.29Å; V347-F350 WeakPolarHBondContact O-CB 3.41Å; V347-F350 PolarHBondContact O-N 2.93Å; V347-R428 HydrophobicContact CB-CG 4.36Å; V347-R428 HydrophobicContact CG1-CB 4.32Å; V347-R428 HydrophobicContact CG1-CG 4.45Å; V347-R428 HydrophobicContact CG2-CG 3.98Å; V347-A431 HydrophobicContact CG1-CB 3.81Å; V347-L432 HydrophobicContact CG1-CD2 4.46Å; V347-L432 HydrophobicContact CG1-CG 4.38Å
348	R	55.7	Low	61.7	Low	122 Å²	122	58.5 Å²	58.5	46%	0.46	34%	0.336	S	S	.	.	H	α-helix	trans	-62	-33.5	178.5	-58.6	-171.5	-148.7	-171.7	4.1	113.2	S340 E341 L343 D344 P345 F350	S340-R348 PolarHBondContact O-NE 2.97Å; S340-R348 PolarHBondContact O-NH2 3.14Å; S340-R348 VanDerWaalsContact O-NH2 3.13Å; E341-R348 PolarHBondContact O-NH2 2.97Å; L343-R348 HydrophobicContact CB-CG 4.48Å; L343-R348 PolarHBondContact O-NE 3.14Å; L343-R348 PolarHBondContact O-NH2 2.83Å; D344-R348 PolarHBondContact O-N 2.67Å; P345-R348 PolarHBondContact O-N 3.45Å; R348-F350 PolarHBondContact O-N 2.78Å
349	S	59.6	Low	62.7	Low	85 Å²	85	58.2 Å²	58.2	59%	0.594	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-5.5	176.3	70.8	0	0	0	0	114	P345 S346 V347 S351	P345-S349 PolarHBondContact O-N 3.31Å; S346-S349 PolarHBondContact O-OG 3.49Å; V347-S349 VanDerWaalsContact C-N 3.26Å; V347-S349 PolarHBondContact O-N 3.29Å; S349-S351 PolarHBondContact O-N 3.16Å
350	F	61.6	Low	64	Low	20 Å²	20	57.3 Å²	57.3	9%	0.088	33%	0.329	C	S	.	.			trans	-77.9	91	-177.6	-171.1	-103.4	0	0	0	110.6	V347 R348 M353 N425 R428 A429 L432	V347-F350 WeakPolarHBondContact O-CB 3.41Å; V347-F350 PolarHBondContact O-N 2.93Å; R348-F350 PolarHBondContact O-N 2.78Å; F350-M353 HydrophobicContact CE1-CB 4.15Å; F350-M353 HydrophobicContact CE1-CG 3.89Å; F350-M353 HydrophobicContact CZ-CG 4.26Å; F350-N425 HydrophobicContact CE2-CB 3.74Å; F350-N425 VanDerWaalsContact CE2-CG 3.47Å; F350-N425 HydrophobicContact CZ-CB 3.93Å; F350-R428 HydrophobicContact CB-CB 4.07Å; F350-R428 HydrophobicContact CB-CG 4.5Å; F350-R428 HydrophobicContact CD1-CB 3.89Å; F350-R428 HydrophobicContact CD2-CB 4.07Å; F350-R428 HydrophobicContact CD2-CG 4.5Å; F350-R428 HydrophobicContact CE1-CB 4.34Å; F350-R428 HydrophobicContact CG-CB 3.73Å; F350-R428 HydrophobicContact CG-CG 4.43Å; F350-A429 HydrophobicContact CE1-CB 4.31Å; F350-L432 HydrophobicContact CB-CD1 4.41Å; F350-L432 HydrophobicContact CD1-CD1 3.72Å
351	S	64.3	Low	65.3	Low	97 Å²	97	56 Å²	56	68%	0.678	32%	0.32	S	S	*	.			trans	-96.6	155.9	176.1	62.1	0	0	0	0	112.2	S349	S349-S351 PolarHBondContact O-N 3.16Å
352	G	67.9	Low	66.5	Low	57 Å²	57	54.1 Å²	54.1	59%	0.588	31%	0.313	S	S	*	.	S	Bend	trans	106.2	6.6	169.7	0	0	0	0	0	115	D354	G352-D354 PolarHBondContact N-OD2 2.88Å
353	M	69.2	Low	67.9	Low	8 Å²	8	54.7 Å²	54.7	4%	0.039	32%	0.316	C	S	.	.			trans	-122.1	7.1	168.7	-72.5	-104	-66.5	0	0	111.9	F350 N355 E356 I357 L413 C417 A429	F350-M353 HydrophobicContact CE1-CB 4.15Å; F350-M353 HydrophobicContact CE1-CG 3.89Å; F350-M353 HydrophobicContact CZ-CG 4.26Å; M353-N355 VanDerWaalsContact C-N 3.25Å; M353-N355 PolarHBondContact O-N 2.78Å; M353-E356 VanDerWaalsContact CA-OE2 3.31Å; M353-E356 WeakPolarHBondContact CA-OE2 3.21Å; M353-E356 PolarHBondContact O-N 3.17Å; M353-E356 VanDerWaalsContact O-N 3.12Å; M353-E356 HydrophobicContact SD-CB 4.49Å; M353-I357 HydrophobicContact CB-CD1 3.96Å; M353-I357 HydrophobicContact CB-CG1 4.48Å; M353-I357 WeakPolarHBondContact O-CB 3.25Å; M353-I357 WeakPolarHBondContact O-CD1 3.26Å; M353-I357 WeakPolarHBondContact O-CG1 3.22Å; M353-I357 PolarHBondContact O-N 3.33Å; M353-L413 HydrophobicContact CE-CD2 3.6Å; M353-C417 WeakPolarHBondContact CE-SG 3.45Å; M353-A429 HydrophobicContact CE-CB 3.43Å; M353-A429 VanDerWaalsContact CE-CB 3.43Å
354	D	73.3	Confident	69.2	Low	96 Å²	96	54.4 Å²	54.4	51%	0.513	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-38.5	-172.3	-49.9	-61.8	0	0	0	111.3	G352 S358	G352-D354 PolarHBondContact N-OD2 2.88Å; D354-S358 VanDerWaalsContact O-CB 3.25Å; D354-S358 WeakPolarHBondContact O-CB 3.17Å; D354-S358 PolarHBondContact O-N 3.1Å
355	N	73.5	Confident	70.4	Confident	112 Å²	112	52.8 Å²	52.8	60%	0.599	31%	0.305	S	S	*	.	H	α-helix	trans	-70.3	-43.1	176.7	-167	28.8	0	0	0	111.3	M353 N359	M353-N355 VanDerWaalsContact C-N 3.25Å; M353-N355 PolarHBondContact O-N 2.78Å; N355-N359 WeakPolarHBondContact O-CB 3.24Å; N355-N359 PolarHBondContact O-N 2.92Å; N355-N359 PolarHBondContact O-ND2 3.27Å; N355-N359 PolarHBondContact OD1-ND2 2.93Å
356	E	74.6	Confident	70.9	Confident	62 Å²	62	53 Å²	53	29%	0.29	30%	0.298	S	S	.	.	H	α-helix	trans	-60.1	-45.5	174.6	-70.9	86.7	165.9	0	0	111.7	M353 N359 L360	M353-E356 VanDerWaalsContact CA-OE2 3.31Å; M353-E356 WeakPolarHBondContact CA-OE2 3.21Å; M353-E356 PolarHBondContact O-N 3.17Å; M353-E356 VanDerWaalsContact O-N 3.12Å; M353-E356 HydrophobicContact SD-CB 4.49Å; E356-N359 PolarHBondContact O-N 3.42Å; E356-L360 WeakPolarHBondContact O-CB 3.4Å; E356-L360 VanDerWaalsContact O-CG 3.23Å; E356-L360 WeakPolarHBondContact O-CG 3.45Å; E356-L360 PolarHBondContact O-N 3.49Å
357	I	78.1	Confident	71.1	Confident	6 Å²	6	58.1 Å²	58.1	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-48.5	179	-69	156.8	0	0	0	110.5	M353 N359 L360 T361 L413 L432 L433 E436	M353-I357 HydrophobicContact CB-CD1 3.96Å; M353-I357 HydrophobicContact CB-CG1 4.48Å; M353-I357 WeakPolarHBondContact O-CB 3.25Å; M353-I357 WeakPolarHBondContact O-CD1 3.26Å; M353-I357 WeakPolarHBondContact O-CG1 3.22Å; M353-I357 PolarHBondContact O-N 3.33Å; I357-N359 VanDerWaalsContact C-N 3.32Å; I357-N359 PolarHBondContact O-N 2.87Å; I357-L360 WeakPolarHBondContact O-CB 3.31Å; I357-L360 PolarHBondContact O-N 3.31Å; I357-L360 VanDerWaalsContact O-N 3.09Å; I357-T361 PolarHBondContact O-N 3.08Å; I357-T361 PolarHBondContact O-OG1 3.03Å; I357-T361 VanDerWaalsContact O-OG1 3.11Å; I357-L413 HydrophobicContact CG1-CD2 4.47Å; I357-L432 HydrophobicContact CD1-CB 3.45Å; I357-L432 VanDerWaalsContact CD1-CB 3.45Å; I357-L432 HydrophobicContact CD1-CD1 3.69Å; I357-L432 HydrophobicContact CD1-CG 4.24Å; I357-L433 HydrophobicContact CG2-CB 4.41Å; I357-L433 HydrophobicContact CG2-CD1 4.32Å; I357-E436 HydrophobicContact CG2-CB 4.12Å; I357-E436 HydrophobicContact CG2-CG 4.49Å
358	S	79.2	Confident	70.6	Confident	45 Å²	45	68.4 Å²	68.4	32%	0.315	36%	0.355	S	S	.	.	H	α-helix	trans	-60.8	-40.2	178.3	-175.1	0	0	0	0	112.3	D354 L360 T361 N362	D354-S358 VanDerWaalsContact O-CB 3.25Å; D354-S358 WeakPolarHBondContact O-CB 3.17Å; D354-S358 PolarHBondContact O-N 3.1Å; S358-L360 VanDerWaalsContact C-N 3.33Å; S358-L360 PolarHBondContact O-N 3.26Å; S358-T361 PolarHBondContact O-N 2.9Å; S358-N362 WeakPolarHBondContact O-CB 3.37Å; S358-N362 PolarHBondContact O-N 3.1Å; S358-N362 PolarHBondContact O-ND2 3.47Å
359	N	77.2	Confident	70.1	Confident	88 Å²	88	68.8 Å²	68.8	47%	0.471	36%	0.362	S	S	.	.	H	α-helix	trans	-64.8	-37.5	175.1	-73.7	-44.1	0	0	0	112.3	N355 E356 I357 Y363	N355-N359 WeakPolarHBondContact O-CB 3.24Å; N355-N359 PolarHBondContact O-N 2.92Å; N355-N359 PolarHBondContact O-ND2 3.27Å; N355-N359 PolarHBondContact OD1-ND2 2.93Å; E356-N359 PolarHBondContact O-N 3.42Å; I357-N359 VanDerWaalsContact C-N 3.32Å; I357-N359 PolarHBondContact O-N 2.87Å; N359-Y363 WeakPolarHBondContact O-CB 3.28Å; N359-Y363 PolarHBondContact O-N 3.49Å
360	L	78.8	Confident	69.2	Low	8 Å²	8	69.1 Å²	69.1	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-69.2	-41.8	176.3	-74.9	177.3	0	0	0	112.3	E356 I357 S358 Y363 I364 A409 R412 L413 L433	E356-L360 WeakPolarHBondContact O-CB 3.4Å; E356-L360 VanDerWaalsContact O-CG 3.23Å; E356-L360 WeakPolarHBondContact O-CG 3.45Å; E356-L360 PolarHBondContact O-N 3.49Å; I357-L360 WeakPolarHBondContact O-CB 3.31Å; I357-L360 PolarHBondContact O-N 3.31Å; I357-L360 VanDerWaalsContact O-N 3.09Å; S358-L360 VanDerWaalsContact C-N 3.33Å; S358-L360 PolarHBondContact O-N 3.26Å; L360-Y363 WeakPolarHBondContact O-CB 3.25Å; L360-Y363 PolarHBondContact O-N 3.04Å; L360-I364 VanDerWaalsContact O-CG1 3.31Å; L360-I364 WeakPolarHBondContact O-CG1 3.46Å; L360-I364 PolarHBondContact O-N 3.28Å; L360-A409 HydrophobicContact CB-CB 4.13Å; L360-A409 HydrophobicContact CD2-CB 3.92Å; L360-A409 HydrophobicContact CG-CB 4.42Å; L360-R412 HydrophobicContact CD2-CB 4.19Å; L360-R412 HydrophobicContact CD2-CG 4.28Å; L360-L413 HydrophobicContact CD1-CD1 4.08Å; L360-L413 HydrophobicContact CD1-CD2 3.62Å; L360-L413 HydrophobicContact CD1-CG 3.44Å; L360-L413 VanDerWaalsContact CD1-CG 3.44Å; L360-L433 HydrophobicContact CB-CD1 4Å
361	T	81.4	Confident	68.4	Low	3 Å²	3	74.1 Å²	74.1	2%	0.018	39%	0.392	C	S	.	.	H	α-helix	trans	-61.9	-46.9	173.8	-55.6	0	0	0	0	110.9	I357 S358 Y363 I364 F365 E436 E440	I357-T361 PolarHBondContact O-N 3.08Å; I357-T361 PolarHBondContact O-OG1 3.03Å; I357-T361 VanDerWaalsContact O-OG1 3.11Å; S358-T361 PolarHBondContact O-N 2.9Å; T361-Y363 VanDerWaalsContact C-N 3.27Å; T361-Y363 PolarHBondContact O-N 3.22Å; T361-I364 WeakPolarHBondContact O-CB 3.22Å; T361-I364 PolarHBondContact O-N 3Å; T361-F365 HydrophobicContact CG2-CD2 3.86Å; T361-F365 HydrophobicContact CG2-CE2 3.97Å; T361-F365 WeakPolarHBondContact O-CD2 3.46Å; T361-F365 PolarHBondContact O-N 3.22Å; T361-E436 HydrophobicContact CG2-CG 3.77Å; T361-E436 VanDerWaalsContact OG1-CG 3.22Å; T361-E436 WeakPolarHBondContact OG1-CG 3.42Å; T361-E440 HydrophobicContact CG2-CB 4.47Å; T361-E440 HydrophobicContact CG2-CG 3.72Å
362	N	80.2	Confident	67.4	Low	73 Å²	73	74.5 Å²	74.5	39%	0.39	39%	0.386	S	S	.	.	H	α-helix	trans	-58.2	-40.5	175.5	-80.4	-48.1	0	0	0	112.2	S358 I364 F365 H366	S358-N362 WeakPolarHBondContact O-CB 3.37Å; S358-N362 PolarHBondContact O-N 3.1Å; S358-N362 PolarHBondContact O-ND2 3.47Å; N362-I364 VanDerWaalsContact C-N 3.34Å; N362-I364 PolarHBondContact O-N 3.02Å; N362-F365 PolarHBondContact O-N 3.44Å; N362-H366 WeakPolarHBondContact O-CB 3.43Å; N362-H366 PolarHBondContact O-N 2.68Å
363	Y	77.8	Confident	66.1	Low	62 Å²	62	75.7 Å²	75.7	24%	0.243	38%	0.377	C	S	.	.	H	α-helix	trans	-60.3	-42.5	174.2	169.5	-104.4	0	0	0	112.3	N359 L360 T361 F365 R405 I408	N359-Y363 WeakPolarHBondContact O-CB 3.28Å; N359-Y363 PolarHBondContact O-N 3.49Å; L360-Y363 WeakPolarHBondContact O-CB 3.25Å; L360-Y363 PolarHBondContact O-N 3.04Å; T361-Y363 VanDerWaalsContact C-N 3.27Å; T361-Y363 PolarHBondContact O-N 3.22Å; Y363-F365 VanDerWaalsContact C-N 3.33Å; Y363-F365 PolarHBondContact O-N 3.19Å; Y363-R405 HydrophobicContact CD1-CB 4.25Å; Y363-R405 HydrophobicContact CD1-CG 4.47Å; Y363-R405 HydrophobicContact CE1-CB 3.78Å; Y363-R405 HydrophobicContact CE1-CG 3.83Å; Y363-R405 HydrophobicContact CE2-CG 4.49Å; Y363-R405 VanDerWaalsContact O-CD 3.26Å; Y363-R405 WeakPolarHBondContact O-CD 3.41Å; Y363-I408 HydrophobicContact CE1-CB 4.02Å; Y363-I408 HydrophobicContact CE1-CG2 3.81Å; Y363-I408 VanDerWaalsContact OH-CD1 3.29Å; Y363-I408 WeakPolarHBondContact OH-CD1 3.48Å
364	I	77.8	Confident	64.8	Low	1 Å²	1	78.9 Å²	78.9	1%	0.005	39%	0.394	C	S	.	.	H	α-helix	trans	-59.5	-42.5	178.5	-67.5	163.4	0	0	0	111.6	L360 T361 N362 M402 R405 I406 A409 L433 L437	L360-I364 VanDerWaalsContact O-CG1 3.31Å; L360-I364 WeakPolarHBondContact O-CG1 3.46Å; L360-I364 PolarHBondContact O-N 3.28Å; T361-I364 WeakPolarHBondContact O-CB 3.22Å; T361-I364 PolarHBondContact O-N 3Å; N362-I364 VanDerWaalsContact C-N 3.34Å; N362-I364 PolarHBondContact O-N 3.02Å; I364-M402 HydrophobicContact CG2-CE 4.02Å; I364-M402 HydrophobicContact CG2-CG 4.1Å; I364-R405 HydrophobicContact CG1-CB 4.37Å; I364-R405 WeakPolarHBondContact O-CD 3.36Å; I364-R405 PolarHBondContact O-NE 3.15Å; I364-R405 PolarHBondContact O-NH1 3.35Å; I364-I406 HydrophobicContact CD1-CG1 4.14Å; I364-I406 HydrophobicContact CG1-CG1 4.24Å; I364-I406 HydrophobicContact CG2-CG1 3.77Å; I364-A409 HydrophobicContact CD1-CB 3.77Å; I364-A409 HydrophobicContact CG1-CB 4.02Å; I364-L433 HydrophobicContact CD1-CD1 4.37Å; I364-L437 HydrophobicContact CD1-CD1 3.84Å; I364-L437 HydrophobicContact CG2-CD1 3.98Å
365	F	77.8	Confident	63.4	Low	17 Å²	17	81 Å²	81	8%	0.075	40%	0.399	C	S	.	.	H	α-helix	trans	-101.8	-28.1	-168.6	-74.3	-74	0	0	0	116.1	T361 N362 Y363 M402 L437 E440 L441 R444 L451	T361-F365 HydrophobicContact CG2-CD2 3.86Å; T361-F365 HydrophobicContact CG2-CE2 3.97Å; T361-F365 WeakPolarHBondContact O-CD2 3.46Å; T361-F365 PolarHBondContact O-N 3.22Å; N362-F365 PolarHBondContact O-N 3.44Å; Y363-F365 VanDerWaalsContact C-N 3.33Å; Y363-F365 PolarHBondContact O-N 3.19Å; F365-M402 HydrophobicContact CD1-CE 4.06Å; F365-M402 HydrophobicContact CE1-CE 3.3Å; F365-M402 HydrophobicContact CE1-SD 4.4Å; F365-M402 HydrophobicContact CZ-CE 3.59Å; F365-L437 HydrophobicContact CE2-CD1 3.94Å; F365-L437 HydrophobicContact CE2-CG 4.44Å; F365-L437 HydrophobicContact CZ-CD1 4.09Å; F365-L437 HydrophobicContact CZ-CG 4.39Å; F365-E440 HydrophobicContact CD2-CB 3.9Å; F365-E440 HydrophobicContact CD2-CG 4.1Å; F365-E440 HydrophobicContact CE1-CB 4.35Å; F365-E440 HydrophobicContact CE2-CB 3.4Å; F365-E440 HydrophobicContact CE2-CG 4.01Å; F365-E440 HydrophobicContact CZ-CB 3.66Å; F365-L441 HydrophobicContact CE1-CD2 3.91Å; F365-L441 HydrophobicContact CZ-CD2 3.92Å; F365-L441 HydrophobicContact CZ-CG 4.08Å; F365-R444 PolarHBondContact O-NH2 2.92Å; F365-L451 HydrophobicContact CE1-CD2 4.19Å
366	H	69.1	Low	62.1	Low	100 Å²	100	86 Å²	86	46%	0.463	41%	0.409	S	S	.	.	H	α-helix	trans	-116.5	9.6	-162.9	-73.7	-63.5	0	0	0	116.9	N362 R368	N362-H366 WeakPolarHBondContact O-CB 3.43Å; N362-H366 PolarHBondContact O-N 2.68Å; H366-R368 PolarHBondContact O-N 3.16Å
367	E	60.5	Low	60.5	Low	147 Å²	147	86 Å²	86	69%	0.687	41%	0.411	S	S	*	.			trans	58.9	-12	170.6	-127.9	-178.3	-165.4	0	0	116.4	E369	E367-E369 PolarHBondContact O-N 2.9Å; E367-E369 VanDerWaalsContact O-N 3.12Å
368	R	44.9	Very low	58.7	Low	228 Å²	228	89.5 Å²	89.5	86%	0.86	44%	0.436	S	S	*	.			trans	-86.8	81.1	-178.3	-75.2	-176.5	177.3	179.6	0.9	110.2	H366	H366-R368 PolarHBondContact O-N 3.16Å
369	E	44.6	Very low	57.2	Low	130 Å²	130	90.9 Å²	90.9	61%	0.607	45%	0.45	S	S	*	.				-172.2	129.6	124.8	-103.2	179.1	-168.8	0	0	112.5	E367	E367-E369 PolarHBondContact O-N 2.9Å; E367-E369 VanDerWaalsContact O-N 3.12Å
370	S	42	Very low	55.5	Low	92 Å²	92	97 Å²	97	64%	0.643	47%	0.467	S	S	*	.			trans	-61.1	158.5	-166.9	-51.1	0	0	0	0	115.5	D372 M373	S370-D372 PolarHBondContact O-N 3.35Å; S370-M373 PolarHBondContact O-N 3.44Å; S370-M373 VanDerWaalsContact O-N 3.11Å
371	N	43.8	Very low	53.6	Low	125 Å²	125	98.2 Å²	98.2	67%	0.668	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-33.5	-14.5	164.2	-90.3	-37.9	0	0	0	117.9	K375	N371-K375 PolarHBondContact O-N 3.14Å
372	D	42.9	Very low	51.8	Low	104 Å²	104	103.9 Å²	103.9	56%	0.556	51%	0.507	S	S	*	.	H	α-helix	trans	-73.6	-26	176.7	-78.4	-20	0	0	0	114	S370 K375	S370-D372 PolarHBondContact O-N 3.35Å; D372-K375 IonicContact OD1-NZ 3.13Å
373	M	40.7	Very low	50.2	Low	82 Å²	82	103.5 Å²	103.5	40%	0.404	52%	0.521	S	S	.	.	H	α-helix	trans	-66.8	-39.7	172.8	-91.3	-77.7	-165.6	0	0	111.9	S370 K375	S370-M373 PolarHBondContact O-N 3.44Å; S370-M373 VanDerWaalsContact O-N 3.11Å; M373-K375 PolarHBondContact O-N 3.2Å
374	L	42	Very low	48.5	Very low	75 Å²	75	105 Å²	105	39%	0.393	53%	0.529	S	S	.	.	H	α-helix	trans	-67.7	-33.3	178.2	-79.9	164	0	0	0	112.6	R376	L374-R376 PolarHBondContact O-N 3.07Å
375	K	45.8	Very low	47	Very low	142 Å²	142	110.6 Å²	110.6	62%	0.617	56%	0.558	S	S	*	*	H	α-helix	trans	-66.4	-33.9	180	-76.2	178.5	-174.4	165	0	113.3	N371 D372 M373 N377 S378	N371-K375 PolarHBondContact O-N 3.14Å; D372-K375 IonicContact OD1-NZ 3.13Å; M373-K375 PolarHBondContact O-N 3.2Å; K375-N377 VanDerWaalsContact C-N 3.3Å; K375-N377 PolarHBondContact O-N 3.31Å; K375-S378 PolarHBondContact O-OG 3.3Å
376	R	45.1	Very low	45.4	Very low	217 Å²	217	120.3 Å²	120.3	82%	0.819	59%	0.594	S	S	*	*	H	α-helix	trans	-70	-26.2	-177.6	-78.3	-173.7	-176.9	169.1	3.9	113.5	L374	L374-R376 PolarHBondContact O-N 3.07Å
377	N	40.9	Very low	44.1	Very low	62 Å²	62	116.7 Å²	116.7	33%	0.332	58%	0.578	S	S	.	*	H	α-helix	trans	-98.4	-9	-174.3	-71.4	-13.8	0	0	0	114.2	K375 A379 W380 F381	K375-N377 VanDerWaalsContact C-N 3.3Å; K375-N377 PolarHBondContact O-N 3.31Å; N377-A379 PolarHBondContact O-N 3.1Å; N377-W380 PolarHBondContact O-N 3.13Å; N377-F381 VanDerWaalsContact C-CE2 3.49Å; N377-F381 HydrophobicContact CB-CE2 3.67Å; N377-F381 HydrophobicContact CB-CZ 4.38Å; N377-F381 WeakPolarHBondContact O-CD2 3.1Å; N377-F381 WeakPolarHBondContact O-CE2 3.16Å
378	S	41.4	Very low	43.4	Very low	78 Å²	78	114.4 Å²	114.4	55%	0.545	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-52	-33	-176.8	72.2	0	0	0	0	113.6	K375 W380 F381	K375-S378 PolarHBondContact O-OG 3.3Å; S378-W380 VanDerWaalsContact C-N 3.3Å; S378-W380 PolarHBondContact O-N 2.72Å; S378-F381 PolarHBondContact O-N 3.23Å
379	A	47	Very low	43.6	Very low	75 Å²	75	110.2 Å²	110.2	62%	0.62	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-69.1	-19.4	-178.7	0	0	0	0	0	114.7	N377	N377-A379 PolarHBondContact O-N 3.1Å
380	W	40.6	Very low	43.7	Very low	215 Å²	215	106 Å²	106	81%	0.814	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-99.1	-2	-178.3	-70.6	0.5	0	0	0	113.8	N377 S378 T382	N377-W380 PolarHBondContact O-N 3.13Å; S378-W380 VanDerWaalsContact C-N 3.3Å; S378-W380 PolarHBondContact O-N 2.72Å; W380-T382 PolarHBondContact O-N 3.4Å
381	F	40.5	Very low	43.8	Very low	34 Å²	34	103 Å²	103	15%	0.149	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-82.1	-7.7	-173.5	-78.4	-82.9	0	0	0	115.8	N377 S378 G383 F384 Q388 I415	N377-F381 VanDerWaalsContact C-CE2 3.49Å; N377-F381 HydrophobicContact CB-CE2 3.67Å; N377-F381 HydrophobicContact CB-CZ 4.38Å; N377-F381 WeakPolarHBondContact O-CD2 3.1Å; N377-F381 WeakPolarHBondContact O-CE2 3.16Å; S378-F381 PolarHBondContact O-N 3.23Å; F381-G383 PolarHBondContact O-N 3Å; F381-G383 VanDerWaalsContact O-N 3.1Å; F381-F384 PolarHBondContact O-N 2.84Å; F381-Q388 HydrophobicContact CB-CG 4.41Å; F381-Q388 HydrophobicContact CD1-CG 4.25Å; F381-I415 HydrophobicContact CE1-CD1 4.24Å
382	T	42.6	Very low	43.9	Very low	122 Å²	122	99.9 Å²	99.9	75%	0.748	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-64	-19.7	-173.1	53.7	0	0	0	0	114.3	W380 F384	W380-T382 PolarHBondContact O-N 3.4Å; T382-F384 VanDerWaalsContact C-N 3.34Å
383	G	45.7	Very low	44.1	Very low	66 Å²	66	99 Å²	99	68%	0.68	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-83.9	-3.8	174.1	0	0	0	0	0	115	F381	F381-G383 PolarHBondContact O-N 3Å; F381-G383 VanDerWaalsContact O-N 3.1Å
384	F	43.2	Very low	44.2	Very low	94 Å²	94	96.5 Å²	96.5	41%	0.412	49%	0.486	S	S	.	.			trans	-131.8	40.2	-167.1	-74.3	-76	0	0	0	112.8	F381 T382 R386 I387 Q388	F381-F384 PolarHBondContact O-N 2.84Å; T382-F384 VanDerWaalsContact C-N 3.34Å; F384-R386 PolarHBondContact O-N 3.29Å; F384-R386 VanDerWaalsContact O-N 3.07Å; F384-I387 HydrophobicContact CB-CB 4.06Å; F384-I387 HydrophobicContact CB-CD1 3.99Å; F384-I387 HydrophobicContact CB-CG1 4.09Å; F384-I387 HydrophobicContact CD1-CD1 3.2Å; F384-I387 HydrophobicContact CD1-CG1 3.83Å; F384-I387 HydrophobicContact CE1-CD1 3.77Å; F384-I387 HydrophobicContact CG-CD1 3.79Å; F384-I387 HydrophobicContact CG-CG1 4.35Å; F384-I387 WeakPolarHBondContact O-CA 3.48Å; F384-I387 WeakPolarHBondContact O-CB 3.17Å; F384-I387 PolarHBondContact O-N 3.25Å; F384-Q388 PolarHBondContact O-N 3.39Å
385	D	46.1	Very low	44.1	Very low	117 Å²	117	99.6 Å²	99.6	63%	0.626	49%	0.492	S	S	*	.	H	α-helix	trans	-50.6	-33.3	173.5	-75.3	-20.9	0	0	0	112.9	I387 Q388 K389	D385-I387 VanDerWaalsContact C-N 3.32Å; D385-I387 PolarHBondContact O-N 2.9Å; D385-Q388 PolarHBondContact O-N 3.39Å; D385-K389 VanDerWaalsContact O-CB 3.28Å; D385-K389 WeakPolarHBondContact O-CB 3.48Å; D385-K389 PolarHBondContact O-N 3.45Å
386	R	43.9	Very low	43.9	Very low	222 Å²	222	95.6 Å²	95.6	84%	0.838	48%	0.482	S	S	*	.	H	α-helix	trans	-61.3	-38.5	172.7	-77.4	-173.5	178.9	-174.7	-0.1	112.8	F384 M390	F384-R386 PolarHBondContact O-N 3.29Å; F384-R386 VanDerWaalsContact O-N 3.07Å; R386-M390 VanDerWaalsContact O-CG 3.31Å; R386-M390 WeakPolarHBondContact O-CG 3.35Å; R386-M390 PolarHBondContact O-N 3.08Å
387	I	43.1	Very low	43.9	Very low	24 Å²	24	91.3 Å²	91.3	12%	0.123	49%	0.485	C	S	.	.	H	α-helix	trans	-77	-40	179.5	-60.4	-175.9	0	0	0	110.6	F384 D385 K389 M390 I391 L411	F384-I387 HydrophobicContact CB-CB 4.06Å; F384-I387 HydrophobicContact CB-CD1 3.99Å; F384-I387 HydrophobicContact CB-CG1 4.09Å; F384-I387 HydrophobicContact CD1-CD1 3.2Å; F384-I387 HydrophobicContact CD1-CG1 3.83Å; F384-I387 HydrophobicContact CE1-CD1 3.77Å; F384-I387 HydrophobicContact CG-CD1 3.79Å; F384-I387 HydrophobicContact CG-CG1 4.35Å; F384-I387 WeakPolarHBondContact O-CA 3.48Å; F384-I387 WeakPolarHBondContact O-CB 3.17Å; F384-I387 PolarHBondContact O-N 3.25Å; D385-I387 VanDerWaalsContact C-N 3.32Å; D385-I387 PolarHBondContact O-N 2.9Å; I387-K389 VanDerWaalsContact C-N 3.28Å; I387-K389 PolarHBondContact O-N 2.98Å; I387-M390 CarbonylContact O-C 3.58Å; I387-M390 WeakPolarHBondContact O-CB 3.49Å; I387-M390 PolarHBondContact O-N 3.49Å; I387-M390 VanDerWaalsContact O-N 3.15Å; I387-I391 HydrophobicContact CG2-CD1 4.13Å; I387-I391 HydrophobicContact CG2-CG1 4.41Å; I387-I391 WeakPolarHBondContact O-CG1 3.24Å; I387-I391 PolarHBondContact O-N 3.23Å; I387-L411 HydrophobicContact CD1-CD2 4.13Å; I387-L411 HydrophobicContact CG1-CD2 4.44Å; I387-L411 HydrophobicContact CG2-CD1 3.75Å; I387-L411 HydrophobicContact CG2-CD2 3.48Å; I387-L411 VanDerWaalsContact CG2-CD2 3.48Å; I387-L411 HydrophobicContact CG2-CG 4.21Å
388	Q	45.4	Very low	44.1	Very low	98 Å²	98	93 Å²	93	46%	0.458	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-39.2	173.1	-76	-139.2	-19.6	0	0	111.7	F381 F384 D385 I391 A392	F381-Q388 HydrophobicContact CB-CG 4.41Å; F381-Q388 HydrophobicContact CD1-CG 4.25Å; F384-Q388 PolarHBondContact O-N 3.39Å; D385-Q388 PolarHBondContact O-N 3.39Å; Q388-I391 PolarHBondContact O-N 2.64Å; Q388-A392 WeakPolarHBondContact O-CB 3.48Å; Q388-A392 PolarHBondContact O-N 3.04Å
389	K	49.2	Very low	44.4	Very low	141 Å²	141	89.8 Å²	89.8	61%	0.613	47%	0.467	S	S	*	.	H	α-helix	trans	-60.7	-45	170.7	-170.6	175.9	178.5	179.2	0	111.3	D385 I387 I391 A392 D393	D385-K389 VanDerWaalsContact O-CB 3.28Å; D385-K389 WeakPolarHBondContact O-CB 3.48Å; D385-K389 PolarHBondContact O-N 3.45Å; I387-K389 VanDerWaalsContact C-N 3.28Å; I387-K389 PolarHBondContact O-N 2.98Å; K389-I391 PolarHBondContact O-N 3.22Å; K389-A392 WeakPolarHBondContact O-CB 3.35Å; K389-A392 PolarHBondContact O-N 2.82Å; K389-D393 WeakPolarHBondContact O-CB 3.33Å; K389-D393 PolarHBondContact O-N 3.34Å
390	M	45.5	Very low	44.8	Very low	41 Å²	41	86.6 Å²	86.6	20%	0.202	44%	0.442	C	S	.	.	H	α-helix	trans	-58	-48.2	173.2	-75.5	170.8	65.1	0	0	112.3	L246 R386 I387 A392 D393 Y394	L246-M390 HydrophobicContact CD2-CE 3.66Å; L246-M390 HydrophobicContact CD2-CG 4.21Å; L246-M390 HydrophobicContact CD2-SD 3.85Å; L246-M390 HydrophobicContact CG-CE 4.49Å; R386-M390 VanDerWaalsContact O-CG 3.31Å; R386-M390 WeakPolarHBondContact O-CG 3.35Å; R386-M390 PolarHBondContact O-N 3.08Å; I387-M390 CarbonylContact O-C 3.58Å; I387-M390 WeakPolarHBondContact O-CB 3.49Å; I387-M390 PolarHBondContact O-N 3.49Å; I387-M390 VanDerWaalsContact O-N 3.15Å; M390-A392 VanDerWaalsContact C-N 3.3Å; M390-A392 PolarHBondContact O-N 3.49Å; M390-D393 WeakPolarHBondContact O-CB 3.34Å; M390-D393 PolarHBondContact O-N 3.18Å; M390-D393 VanDerWaalsContact O-N 3.16Å; M390-Y394 HydrophobicContact CE-CE2 4.4Å; M390-Y394 WeakPolarHBondContact O-CD2 3.43Å; M390-Y394 PolarHBondContact O-N 2.81Å
391	I	43.6	Very low	45.9	Very low	30 Å²	30	80.4 Å²	80.4	15%	0.154	42%	0.424	C	S	.	.	H	α-helix	trans	-61.6	-39.9	177.4	-66	168.2	0	0	0	110.5	I387 Q388 K389 D393 Y394 R395 L411	I387-I391 HydrophobicContact CG2-CD1 4.13Å; I387-I391 HydrophobicContact CG2-CG1 4.41Å; I387-I391 WeakPolarHBondContact O-CG1 3.24Å; I387-I391 PolarHBondContact O-N 3.23Å; Q388-I391 PolarHBondContact O-N 2.64Å; K389-I391 PolarHBondContact O-N 3.22Å; I391-D393 VanDerWaalsContact C-N 3.34Å; I391-Y394 CarbonylContact O-C 3.51Å; I391-Y394 PolarHBondContact O-N 3.41Å; I391-R395 HydrophobicContact CG2-CG 4.3Å; I391-R395 WeakPolarHBondContact O-CB 3.37Å; I391-R395 VanDerWaalsContact O-CG 3.32Å; I391-R395 WeakPolarHBondContact O-CG 3.39Å; I391-R395 PolarHBondContact O-N 2.87Å; I391-L411 HydrophobicContact CD1-CD1 3.83Å; I391-L411 HydrophobicContact CG1-CD1 3.61Å
392	A	47.3	Very low	47.3	Very low	59 Å²	59	79.3 Å²	79.3	49%	0.488	42%	0.42	S	S	.	.	H	α-helix	trans	-64.4	-39.3	175.4	0	0	0	0	0	111.8	Q388 K389 M390 R395 S396	Q388-A392 WeakPolarHBondContact O-CB 3.48Å; Q388-A392 PolarHBondContact O-N 3.04Å; K389-A392 WeakPolarHBondContact O-CB 3.35Å; K389-A392 PolarHBondContact O-N 2.82Å; M390-A392 VanDerWaalsContact C-N 3.3Å; M390-A392 PolarHBondContact O-N 3.49Å; A392-R395 PolarHBondContact O-N 2.81Å; A392-S396 PolarHBondContact O-N 2.93Å
393	D	46.1	Very low	48.3	Very low	84 Å²	84	73.8 Å²	73.8	45%	0.449	39%	0.386	S	S	.	.	H	α-helix	trans	-64.5	-39.9	174.3	-62.9	-22.3	0	0	0	110.6	K389 M390 I391 S396	K389-D393 WeakPolarHBondContact O-CB 3.33Å; K389-D393 PolarHBondContact O-N 3.34Å; M390-D393 WeakPolarHBondContact O-CB 3.34Å; M390-D393 PolarHBondContact O-N 3.18Å; M390-D393 VanDerWaalsContact O-N 3.16Å; I391-D393 VanDerWaalsContact C-N 3.34Å; D393-S396 WeakPolarHBondContact O-CB 3.46Å; D393-S396 PolarHBondContact O-N 3.35Å; D393-S396 PolarHBondContact O-OG 2.84Å
394	Y	42.7	Very low	49	Very low	30 Å²	30	72.9 Å²	72.9	12%	0.118	36%	0.364	C	S	.	.	H	α-helix	trans	-70.6	-27.6	172.8	-79.3	-69.6	0	0	0	114.1	M247 M390 I391 S396 C399	M247-Y394 HydrophobicContact CE-CE1 4.49Å; M247-Y394 HydrophobicContact SD-CE1 4.35Å; M247-Y394 PolarHBondContact SD-OH 3.05Å; M390-Y394 HydrophobicContact CE-CE2 4.4Å; M390-Y394 WeakPolarHBondContact O-CD2 3.43Å; M390-Y394 PolarHBondContact O-N 2.81Å; I391-Y394 CarbonylContact O-C 3.51Å; I391-Y394 PolarHBondContact O-N 3.41Å; Y394-S396 VanDerWaalsContact C-N 3.25Å; Y394-C399 PolarHBondContact O-SG 2.81Å
395	R	41.2	Very low	50.3	Low	141 Å²	141	69.8 Å²	69.8	53%	0.532	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-10.6	174.9	-83.9	179.7	175.5	177.9	1.4	113.1	I391 A392 S397 E404	I391-R395 HydrophobicContact CG2-CG 4.3Å; I391-R395 WeakPolarHBondContact O-CB 3.37Å; I391-R395 VanDerWaalsContact O-CG 3.32Å; I391-R395 WeakPolarHBondContact O-CG 3.39Å; I391-R395 PolarHBondContact O-N 2.87Å; A392-R395 PolarHBondContact O-N 2.81Å; R395-S397 PolarHBondContact O-N 3.14Å; R395-E404 WeakPolarHBondContact CG-OE1 3.27Å; R395-E404 IonicContact NE-OE1 2.65Å; R395-E404 PolarHBondContact NE-OE1 3.43Å
396	S	41.5	Very low	51.4	Low	57 Å²	57	65 Å²	65	40%	0.399	32%	0.324	S	S	.	.	S	Bend	trans	-57	129.9	167.7	73.2	0	0	0	0	107.2	A392 D393 Y394 K398	A392-S396 PolarHBondContact O-N 2.93Å; D393-S396 WeakPolarHBondContact O-CB 3.46Å; D393-S396 PolarHBondContact O-N 3.35Å; D393-S396 PolarHBondContact O-OG 2.84Å; Y394-S396 VanDerWaalsContact C-N 3.25Å; S396-K398 PolarHBondContact O-N 2.8Å
397	S	45.1	Very low	52.3	Low	127 Å²	127	55 Å²	55	89%	0.888	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	11.2	-163.3	48.6	0	0	0	0	117.1	R395	R395-S397 PolarHBondContact O-N 3.14Å
398	K	45.4	Very low	53.4	Low	97 Å²	97	55.3 Å²	55.3	42%	0.422	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-15.7	-172.6	-64.2	-176.4	-179.9	177.8	0	114.4	S396 H467	S396-K398 PolarHBondContact O-N 2.8Å; K398-H467 PolarHBondContact O-ND1 3.45Å
399	C	46.6	Very low	54.6	Low	11 Å²	11	50.6 Å²	50.6	7%	0.074	27%	0.269	C	S	.	.	S	Bend	trans	-101.3	112.5	177.9	-11.7	0	0	0	0	108	Y394 C403 W464	Y394-C399 PolarHBondContact O-SG 2.81Å; C399-C403 HydrophobicContact CB-CB 4.15Å; C399-W464 VanDerWaalsContact SG-CD1 3.5Å
400	G	54.6	Low	55.5	Low	9 Å²	9	45 Å²	45	9%	0.093	25%	0.247	C	C	.	.			trans	-49.6	154.5	-178	0	0	0	0	0	114	M402 C403 H467	G400-M402 PolarHBondContact O-N 3.08Å; G400-C403 WeakPolarHBondContact O-CB 3.47Å; G400-C403 PolarHBondContact O-N 3.32Å; G400-H467 WeakPolarHBondContact CA-NE2 3.46Å; G400-H467 PolarHBondContact N-CD2 2.86Å; G400-H467 PolarHBondContact N-NE2 3.04Å; G400-H467 VanDerWaalsContact N-NE2 3.17Å
401	L	64.2	Low	56.1	Low	85 Å²	85	43.9 Å²	43.9	45%	0.445	24%	0.242	S	C	.	.	H	α-helix	trans	-49.7	-30.1	-172.6	-73.2	160.4	0	0	0	113.7	R405	L401-R405 VanDerWaalsContact O-CG 3.23Å; L401-R405 WeakPolarHBondContact O-CG 3.34Å; L401-R405 PolarHBondContact O-N 3.36Å; L401-R405 PolarHBondContact O-NE 3.36Å
402	M	69.6	Low	57.3	Low	11 Å²	11	47 Å²	47	5%	0.054	25%	0.251	C	S	.	.	H	α-helix	trans	-71.6	-38.8	177.9	-170.6	174.1	173.2	0	0	113.1	I364 F365 G400 R405 I406 L441 L451 I470	I364-M402 HydrophobicContact CG2-CE 4.02Å; I364-M402 HydrophobicContact CG2-CG 4.1Å; F365-M402 HydrophobicContact CD1-CE 4.06Å; F365-M402 HydrophobicContact CE1-CE 3.3Å; F365-M402 HydrophobicContact CE1-SD 4.4Å; F365-M402 HydrophobicContact CZ-CE 3.59Å; G400-M402 PolarHBondContact O-N 3.08Å; M402-R405 PolarHBondContact O-N 3.12Å; M402-I406 HydrophobicContact CE-CD1 4.23Å; M402-I406 HydrophobicContact CG-CD1 4.13Å; M402-I406 WeakPolarHBondContact O-CG1 3.45Å; M402-I406 PolarHBondContact O-N 3.44Å; M402-L441 HydrophobicContact CE-CD2 3.89Å; M402-L451 HydrophobicContact SD-CB 4.31Å; M402-I470 HydrophobicContact CB-CD1 4.3Å; M402-I470 HydrophobicContact CE-CD1 4.45Å; M402-I470 HydrophobicContact CG-CD1 4.04Å; M402-I470 HydrophobicContact SD-CD1 4.02Å; M402-I470 HydrophobicContact SD-CG1 4.39Å; M402-I470 HydrophobicContact SD-CG2 3.96Å
403	C	63.5	Low	58.3	Low	6 Å²	6	44.2 Å²	44.2	4%	0.041	23%	0.229	C	C	.	.	H	α-helix	trans	-63.8	-43.1	177	-77.1	0	0	0	0	111.9	C399 G400 R405 I406 G407 H467	C399-C403 HydrophobicContact CB-CB 4.15Å; G400-C403 WeakPolarHBondContact O-CB 3.47Å; G400-C403 PolarHBondContact O-N 3.32Å; C403-R405 VanDerWaalsContact C-N 3.28Å; C403-R405 PolarHBondContact O-N 3.28Å; C403-I406 PolarHBondContact O-N 3.5Å; C403-G407 PolarHBondContact O-N 3.09Å; C403-H467 WeakPolarHBondContact SG-CA 3.29Å; C403-H467 VanDerWaalsContact SG-CB 3.54Å; C403-H467 PolarHBondContact SG-N 3.41Å; C403-H467 VanDerWaalsContact SG-N 3.36Å
404	E	61.1	Low	59.1	Low	46 Å²	46	42.2 Å²	42.2	22%	0.215	22%	0.218	C	C	.	.	H	α-helix	trans	-58	-45.4	174.6	-174.5	-178.5	179.8	0	0	110.2	R395 G407 I408	R395-E404 WeakPolarHBondContact CG-OE1 3.27Å; R395-E404 IonicContact NE-OE1 2.65Å; R395-E404 PolarHBondContact NE-OE1 3.43Å; E404-G407 PolarHBondContact O-N 3.44Å; E404-I408 HydrophobicContact CG-CD1 3.87Å; E404-I408 VanDerWaalsContact O-CG1 3.3Å; E404-I408 WeakPolarHBondContact O-CG1 3.28Å; E404-I408 PolarHBondContact O-N 3.27Å
405	R	70.6	Confident	59.9	Low	30 Å²	30	43.3 Å²	43.3	11%	0.113	23%	0.225	C	C	.	.	H	α-helix	trans	-64.7	-42.6	179.3	-71.5	179.5	-84	-179.5	-2.6	113.1	Y363 I364 L401 M402 C403 G407 I408 A409	Y363-R405 HydrophobicContact CD1-CB 4.25Å; Y363-R405 HydrophobicContact CD1-CG 4.47Å; Y363-R405 HydrophobicContact CE1-CB 3.78Å; Y363-R405 HydrophobicContact CE1-CG 3.83Å; Y363-R405 HydrophobicContact CE2-CG 4.49Å; Y363-R405 VanDerWaalsContact O-CD 3.26Å; Y363-R405 WeakPolarHBondContact O-CD 3.41Å; I364-R405 HydrophobicContact CG1-CB 4.37Å; I364-R405 WeakPolarHBondContact O-CD 3.36Å; I364-R405 PolarHBondContact O-NE 3.15Å; I364-R405 PolarHBondContact O-NH1 3.35Å; L401-R405 VanDerWaalsContact O-CG 3.23Å; L401-R405 WeakPolarHBondContact O-CG 3.34Å; L401-R405 PolarHBondContact O-N 3.36Å; L401-R405 PolarHBondContact O-NE 3.36Å; M402-R405 PolarHBondContact O-N 3.12Å; C403-R405 VanDerWaalsContact C-N 3.28Å; C403-R405 PolarHBondContact O-N 3.28Å; R405-G407 VanDerWaalsContact C-N 3.34Å; R405-I408 PolarHBondContact O-N 3.07Å; R405-A409 WeakPolarHBondContact O-CB 3.14Å; R405-A409 PolarHBondContact O-N 2.89Å
406	I	69	Low	61	Low	15 Å²	15	39 Å²	39	8%	0.077	21%	0.213	C	C	.	.	H	α-helix	trans	-60.2	-46.4	174.3	-67.8	166.3	0	0	0	110	I364 M402 C403 I408 A409 V410 L437 L466 I470	I364-I406 HydrophobicContact CD1-CG1 4.14Å; I364-I406 HydrophobicContact CG1-CG1 4.24Å; I364-I406 HydrophobicContact CG2-CG1 3.77Å; M402-I406 HydrophobicContact CE-CD1 4.23Å; M402-I406 HydrophobicContact CG-CD1 4.13Å; M402-I406 WeakPolarHBondContact O-CG1 3.45Å; M402-I406 PolarHBondContact O-N 3.44Å; C403-I406 PolarHBondContact O-N 3.5Å; I406-I408 PolarHBondContact O-N 2.96Å; I406-A409 PolarHBondContact O-N 3.31Å; I406-V410 HydrophobicContact CG2-CG2 4.43Å; I406-V410 WeakPolarHBondContact O-CG2 3.15Å; I406-V410 PolarHBondContact O-N 2.82Å; I406-L437 HydrophobicContact CD1-CD1 4.3Å; I406-L437 HydrophobicContact CG1-CD1 4.16Å; I406-L466 HydrophobicContact CD1-CD2 4.12Å; I406-L466 HydrophobicContact CG2-CD2 4.27Å; I406-I470 HydrophobicContact CD1-CD1 3.91Å
407	G	63.3	Low	61.9	Low	12 Å²	12	36.4 Å²	36.4	12%	0.124	19%	0.194	C	C	.	.	H	α-helix	trans	-58.7	-46.4	177.3	0	0	0	0	0	112.4	C403 E404 R405 A409 V410 L411	C403-G407 PolarHBondContact O-N 3.09Å; E404-G407 PolarHBondContact O-N 3.44Å; R405-G407 VanDerWaalsContact C-N 3.34Å; G407-A409 VanDerWaalsContact C-N 3.35Å; G407-A409 PolarHBondContact O-N 3.08Å; G407-V410 PolarHBondContact O-N 2.93Å; G407-L411 WeakPolarHBondContact O-CB 3.36Å; G407-L411 WeakPolarHBondContact O-CG 3.36Å; G407-L411 PolarHBondContact O-N 3.12Å
408	I	65.6	Low	62.4	Low	31 Å²	31	34.5 Å²	34.5	16%	0.159	18%	0.177	C	C	.	.	H	α-helix	trans	-62.6	-40.8	176.6	-69.6	167.9	0	0	0	111.4	Y363 E404 R405 I406 L411 R412	Y363-I408 HydrophobicContact CE1-CB 4.02Å; Y363-I408 HydrophobicContact CE1-CG2 3.81Å; Y363-I408 VanDerWaalsContact OH-CD1 3.29Å; Y363-I408 WeakPolarHBondContact OH-CD1 3.48Å; E404-I408 HydrophobicContact CG-CD1 3.87Å; E404-I408 VanDerWaalsContact O-CG1 3.3Å; E404-I408 WeakPolarHBondContact O-CG1 3.28Å; E404-I408 PolarHBondContact O-N 3.27Å; R405-I408 PolarHBondContact O-N 3.07Å; I406-I408 PolarHBondContact O-N 2.96Å; I408-L411 PolarHBondContact O-N 3.32Å; I408-R412 WeakPolarHBondContact O-CB 3.4Å; I408-R412 PolarHBondContact O-N 3.24Å
409	A	71.1	Confident	62.7	Low	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.3	-47.1	178.4	0	0	0	0	0	112.4	L360 I364 R405 I406 G407 L411 R412 L413 L433	L360-A409 HydrophobicContact CB-CB 4.13Å; L360-A409 HydrophobicContact CD2-CB 3.92Å; L360-A409 HydrophobicContact CG-CB 4.42Å; I364-A409 HydrophobicContact CD1-CB 3.77Å; I364-A409 HydrophobicContact CG1-CB 4.02Å; R405-A409 WeakPolarHBondContact O-CB 3.14Å; R405-A409 PolarHBondContact O-N 2.89Å; I406-A409 PolarHBondContact O-N 3.31Å; G407-A409 VanDerWaalsContact C-N 3.35Å; G407-A409 PolarHBondContact O-N 3.08Å; A409-L411 VanDerWaalsContact C-N 3.34Å; A409-L411 PolarHBondContact O-N 3.37Å; A409-R412 PolarHBondContact O-N 2.87Å; A409-L413 PolarHBondContact O-N 3.36Å; A409-L433 HydrophobicContact CB-CD2 4.22Å
410	V	67.1	Low	63.1	Low	23 Å²	23	42.3 Å²	42.3	14%	0.139	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-44.6	175	169.1	0	0	0	0	110.8	I250 I406 G407 R412 L413 L414 L430 L433	I250-V410 HydrophobicContact CG2-CG1 4.13Å; I406-V410 HydrophobicContact CG2-CG2 4.43Å; I406-V410 WeakPolarHBondContact O-CG2 3.15Å; I406-V410 PolarHBondContact O-N 2.82Å; G407-V410 PolarHBondContact O-N 2.93Å; V410-R412 VanDerWaalsContact C-N 3.35Å; V410-R412 PolarHBondContact O-N 3.19Å; V410-L413 PolarHBondContact O-N 3.03Å; V410-L414 HydrophobicContact CG1-CD1 4.11Å; V410-L414 WeakPolarHBondContact O-CG 3.33Å; V410-L414 PolarHBondContact O-N 3.5Å; V410-L430 HydrophobicContact CB-CD2 4.42Å; V410-L430 HydrophobicContact CG1-CD2 3.89Å; V410-L430 HydrophobicContact CG2-CD2 4.33Å; V410-L433 HydrophobicContact CG2-CD2 4.16Å
411	L	59.9	Low	62.8	Low	17 Å²	17	46 Å²	46	9%	0.089	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-41.2	177.9	-75.4	171.3	0	0	0	112.4	I387 I391 G407 I408 A409 L414 I415	I387-L411 HydrophobicContact CD1-CD2 4.13Å; I387-L411 HydrophobicContact CG1-CD2 4.44Å; I387-L411 HydrophobicContact CG2-CD1 3.75Å; I387-L411 HydrophobicContact CG2-CD2 3.48Å; I387-L411 VanDerWaalsContact CG2-CD2 3.48Å; I387-L411 HydrophobicContact CG2-CG 4.21Å; I391-L411 HydrophobicContact CD1-CD1 3.83Å; I391-L411 HydrophobicContact CG1-CD1 3.61Å; G407-L411 WeakPolarHBondContact O-CB 3.36Å; G407-L411 WeakPolarHBondContact O-CG 3.36Å; G407-L411 PolarHBondContact O-N 3.12Å; I408-L411 PolarHBondContact O-N 3.32Å; A409-L411 VanDerWaalsContact C-N 3.34Å; A409-L411 PolarHBondContact O-N 3.37Å; L411-L414 HydrophobicContact CD2-CD1 4.42Å; L411-L414 PolarHBondContact O-N 2.94Å; L411-I415 VanDerWaalsContact O-CG1 3.29Å; L411-I415 WeakPolarHBondContact O-CG1 3.48Å; L411-I415 PolarHBondContact O-N 3.48Å
412	R	66.9	Low	62.3	Low	95 Å²	95	51.9 Å²	51.9	36%	0.358	25%	0.248	S	C	.	.	H	α-helix	trans	-63.7	-42.6	176.1	-177.7	161.4	176.3	-179.7	-0.5	111.4	L360 I408 A409 V410 L414 I415 D416	L360-R412 HydrophobicContact CD2-CB 4.19Å; L360-R412 HydrophobicContact CD2-CG 4.28Å; I408-R412 WeakPolarHBondContact O-CB 3.4Å; I408-R412 PolarHBondContact O-N 3.24Å; A409-R412 PolarHBondContact O-N 2.87Å; V410-R412 VanDerWaalsContact C-N 3.35Å; V410-R412 PolarHBondContact O-N 3.19Å; R412-L414 VanDerWaalsContact C-N 3.34Å; R412-L414 PolarHBondContact O-N 2.72Å; R412-I415 PolarHBondContact O-N 3.14Å; R412-D416 VanDerWaalsContact CG-OD2 3.24Å; R412-D416 WeakPolarHBondContact CG-OD2 3.3Å; R412-D416 IonicContact NE-OD2 3.09Å; R412-D416 VanDerWaalsContact O-CB 3.3Å; R412-D416 WeakPolarHBondContact O-CB 3.14Å; R412-D416 VanDerWaalsContact O-CG 3.32Å; R412-D416 PolarHBondContact O-N 3.05Å
413	L	69.2	Low	61.5	Low	2 Å²	2	58 Å²	58	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-59.7	-44.4	172.4	-75.7	176.3	0	0	0	112.1	M353 I357 L360 A409 V410 I415 C417 A429 L430 L433	M353-L413 HydrophobicContact CE-CD2 3.6Å; I357-L413 HydrophobicContact CG1-CD2 4.47Å; L360-L413 HydrophobicContact CD1-CD1 4.08Å; L360-L413 HydrophobicContact CD1-CD2 3.62Å; L360-L413 HydrophobicContact CD1-CG 3.44Å; L360-L413 VanDerWaalsContact CD1-CG 3.44Å; A409-L413 PolarHBondContact O-N 3.36Å; V410-L413 PolarHBondContact O-N 3.03Å; L413-I415 VanDerWaalsContact C-N 3.35Å; L413-I415 PolarHBondContact O-N 2.93Å; L413-C417 WeakPolarHBondContact O-CB 3.23Å; L413-C417 PolarHBondContact O-N 3.23Å; L413-C417 PolarHBondContact O-SG 2.86Å; L413-A429 HydrophobicContact CD2-CB 4.31Å; L413-L430 HydrophobicContact CB-CD2 4.28Å; L413-L430 HydrophobicContact CD1-CD2 4.06Å; L413-L433 HydrophobicContact CD1-CB 3.6Å; L413-L433 HydrophobicContact CD1-CD2 3.4Å; L413-L433 HydrophobicContact CD1-CG 4Å; L413-L433 HydrophobicContact CG-CD2 4.49Å
414	L	63.2	Low	61	Low	42 Å²	42	61.3 Å²	61.3	22%	0.22	30%	0.297	C	S	.	.	H	α-helix	trans	-59.2	-47.5	176.8	-70.2	169.9	0	0	0	110.7	V410 L411 R412 T418 V426 L430	V410-L414 HydrophobicContact CG1-CD1 4.11Å; V410-L414 WeakPolarHBondContact O-CG 3.33Å; V410-L414 PolarHBondContact O-N 3.5Å; L411-L414 HydrophobicContact CD2-CD1 4.42Å; L411-L414 PolarHBondContact O-N 2.94Å; R412-L414 VanDerWaalsContact C-N 3.34Å; R412-L414 PolarHBondContact O-N 2.72Å; L414-T418 VanDerWaalsContact O-CB 3.3Å; L414-T418 WeakPolarHBondContact O-CB 3.49Å; L414-T418 PolarHBondContact O-N 3.28Å; L414-T418 PolarHBondContact O-OG1 3.03Å; L414-V426 HydrophobicContact CD2-CG1 3.52Å; L414-L430 HydrophobicContact CD2-CD1 4.18Å
415	I	59.3	Low	61	Low	53 Å²	53	60.2 Å²	60.2	27%	0.272	29%	0.293	S	S	.	.	H	α-helix	trans	-66.8	-46.6	-179.2	-67.7	166.1	0	0	0	111.7	F381 L411 R412 L413 C417 P419	F381-I415 HydrophobicContact CE1-CD1 4.24Å; L411-I415 VanDerWaalsContact O-CG1 3.29Å; L411-I415 WeakPolarHBondContact O-CG1 3.48Å; L411-I415 PolarHBondContact O-N 3.48Å; R412-I415 PolarHBondContact O-N 3.14Å; L413-I415 VanDerWaalsContact C-N 3.35Å; L413-I415 PolarHBondContact O-N 2.93Å; I415-C417 VanDerWaalsContact C-N 3.32Å; I415-C417 PolarHBondContact O-N 3.07Å; I415-P419 WeakPolarHBondContact O-CD 3.34Å
416	D	63.7	Low	60.6	Low	51 Å²	51	59.1 Å²	59.1	27%	0.273	29%	0.289	S	S	.	.	H	α-helix	trans	-70.5	-30.5	-176.7	-70.1	-20.3	0	0	0	111.4	R412	R412-D416 VanDerWaalsContact CG-OD2 3.24Å; R412-D416 WeakPolarHBondContact CG-OD2 3.3Å; R412-D416 IonicContact NE-OD2 3.09Å; R412-D416 VanDerWaalsContact O-CB 3.3Å; R412-D416 WeakPolarHBondContact O-CB 3.14Å; R412-D416 VanDerWaalsContact O-CG 3.32Å; R412-D416 PolarHBondContact O-N 3.05Å
417	C	61.1	Low	60.1	Low	1 Å²	1	59.9 Å²	59.9	1%	0.007	29%	0.292	C	S	.	.	H	α-helix	trans	-83.4	-33.7	178	-65.9	0	0	0	0	114	M353 L413 I415 R420 F421 V426	M353-C417 WeakPolarHBondContact CE-SG 3.45Å; L413-C417 WeakPolarHBondContact O-CB 3.23Å; L413-C417 PolarHBondContact O-N 3.23Å; L413-C417 PolarHBondContact O-SG 2.86Å; I415-C417 VanDerWaalsContact C-N 3.32Å; I415-C417 PolarHBondContact O-N 3.07Å; C417-R420 PolarHBondContact O-N 2.95Å; C417-R420 VanDerWaalsContact O-N 3.17Å; C417-F421 PolarHBondContact O-N 2.94Å; C417-V426 HydrophobicContact CB-CB 4.36Å; C417-V426 HydrophobicContact CB-CG2 3.59Å
418	T	55	Low	60.2	Low	88 Å²	88	62.4 Å²	62.4	54%	0.54	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-45.6	-171.8	-61.6	0	0	0	0	113.9	L414	L414-T418 VanDerWaalsContact O-CB 3.3Å; L414-T418 WeakPolarHBondContact O-CB 3.49Å; L414-T418 PolarHBondContact O-N 3.28Å; L414-T418 PolarHBondContact O-OG1 3.03Å
419	P	52.6	Low	60.4	Low	110 Å²	110	61 Å²	61	71%	0.714	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-24.6	176.9	18.3	-14.2	0	0	0	113.2	I415	I415-P419 WeakPolarHBondContact O-CD 3.34Å
420	R	53.7	Low	60.2	Low	161 Å²	161	61.6 Å²	61.6	61%	0.608	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-29.1	-173.6	-68.7	-174.8	177.1	177.1	1.9	113.1	C417	C417-R420 PolarHBondContact O-N 2.95Å; C417-R420 VanDerWaalsContact O-N 3.17Å
421	F	49.3	Very low	60.2	Low	88 Å²	88	60.8 Å²	60.8	39%	0.386	29%	0.289	S	S	.	.	S	Bend	trans	-150.7	141.5	-168.2	-59.8	-73	0	0	0	114.5	C417 N425	C417-F421 PolarHBondContact O-N 2.94Å; F421-N425 HydrophobicContact CB-CB 3.43Å; F421-N425 VanDerWaalsContact CB-CB 3.43Å; F421-N425 VanDerWaalsContact CB-ND2 3.31Å; F421-N425 WeakPolarHBondContact CB-ND2 3.5Å; F421-N425 WeakPolarHBondContact CD1-ND2 3.27Å; F421-N425 HydrophobicContact CD2-CB 4.49Å; F421-N425 HydrophobicContact CG-CB 3.94Å; F421-N425 WeakPolarHBondContact CG-ND2 3.39Å
422	Y	53.9	Low	60.7	Low	208 Å²	208	61.1 Å²	61.1	82%	0.816	29%	0.291	S	S	*	.			trans	-51.3	157.3	171.6	-76.6	-90	0	0	0	112.2	T424 N425	Y422-T424 PolarHBondContact O-N 2.82Å; Y422-N425 PolarHBondContact O-N 3.27Å
423	Q	52.8	Low	61	Low	138 Å²	138	57 Å²	57	65%	0.645	28%	0.276	S	S	*	.	H	α-helix	trans	-42.3	-28.5	-176.4	-71.7	178.8	-9	0	0	115.4	K427	Q423-K427 VanDerWaalsContact O-CE 3.26Å; Q423-K427 WeakPolarHBondContact O-CE 3.25Å; Q423-K427 WeakPolarHBondContact O-CG 3.37Å
424	T	53.6	Low	61.1	Low	76 Å²	76	59.7 Å²	59.7	47%	0.466	29%	0.286	S	S	.	.	H	α-helix	trans	-65	-32.4	177.7	41.4	0	0	0	0	114.8	Y422 R428	Y422-T424 PolarHBondContact O-N 2.82Å; T424-R428 WeakPolarHBondContact O-CG 3.4Å
425	N	61.2	Low	61.3	Low	24 Å²	24	59.4 Å²	59.4	13%	0.128	29%	0.285	C	S	.	.	H	α-helix	trans	-85.4	-30.6	-175.1	-71.8	-3.2	0	0	0	113.1	F350 F421 Y422 K427 R428 A429	F350-N425 HydrophobicContact CE2-CB 3.74Å; F350-N425 VanDerWaalsContact CE2-CG 3.47Å; F350-N425 HydrophobicContact CZ-CB 3.93Å; F421-N425 HydrophobicContact CB-CB 3.43Å; F421-N425 VanDerWaalsContact CB-CB 3.43Å; F421-N425 VanDerWaalsContact CB-ND2 3.31Å; F421-N425 WeakPolarHBondContact CB-ND2 3.5Å; F421-N425 WeakPolarHBondContact CD1-ND2 3.27Å; F421-N425 HydrophobicContact CD2-CB 4.49Å; F421-N425 HydrophobicContact CG-CB 3.94Å; F421-N425 WeakPolarHBondContact CG-ND2 3.39Å; Y422-N425 PolarHBondContact O-N 3.27Å; N425-K427 PolarHBondContact O-N 2.99Å; N425-R428 PolarHBondContact O-N 3.3Å; N425-R428 VanDerWaalsContact O-N 3.16Å; N425-A429 WeakPolarHBondContact O-CB 3.34Å; N425-A429 PolarHBondContact O-N 3.01Å
426	V	61.3	Low	62.1	Low	7 Å²	7	60 Å²	60	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-53.9	-44.2	171	176.5	0	0	0	0	110.2	W253 L414 C417 A429 L430	W253-V426 HydrophobicContact CH2-CG1 4.08Å; W253-V426 HydrophobicContact CZ3-CG1 4Å; L414-V426 HydrophobicContact CD2-CG1 3.52Å; C417-V426 HydrophobicContact CB-CB 4.36Å; C417-V426 HydrophobicContact CB-CG2 3.59Å; V426-A429 PolarHBondContact O-N 3.41Å; V426-L430 HydrophobicContact CG1-CD1 3.94Å; V426-L430 WeakPolarHBondContact O-CG 3.43Å; V426-L430 PolarHBondContact O-N 3.35Å
427	K	58	Low	62.6	Low	31 Å²	31	57.8 Å²	57.8	14%	0.135	28%	0.275	C	S	.	.	H	α-helix	trans	-61.7	-45	178.4	-61.7	171.3	-161.8	-179.4	0	112.4	H257 Q423 N425 L430 A431	H257-K427 HydrophobicContact CB-CD 3.97Å; H257-K427 WeakPolarHBondContact O-CD 3.31Å; H257-K427 VanDerWaalsContact O-CE 3.27Å; H257-K427 WeakPolarHBondContact O-CE 3.43Å; H257-K427 PolarHBondContact O-NZ 2.8Å; Q423-K427 VanDerWaalsContact O-CE 3.26Å; Q423-K427 WeakPolarHBondContact O-CE 3.25Å; Q423-K427 WeakPolarHBondContact O-CG 3.37Å; N425-K427 PolarHBondContact O-N 2.99Å; K427-L430 PolarHBondContact O-N 2.99Å; K427-A431 WeakPolarHBondContact O-CB 3.47Å; K427-A431 PolarHBondContact O-N 3.41Å
428	R	65.8	Low	63	Low	65 Å²	65	58.2 Å²	58.2	25%	0.245	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-44.3	178.3	-67.5	173.3	173	173.1	-3.7	111	S346 V347 F350 T424 N425 A431 L432	S346-R428 VanDerWaalsContact CB-NH2 3.29Å; S346-R428 PolarHBondContact O-NE 3.44Å; S346-R428 PolarHBondContact OG-NH2 3.49Å; V347-R428 HydrophobicContact CB-CG 4.36Å; V347-R428 HydrophobicContact CG1-CB 4.32Å; V347-R428 HydrophobicContact CG1-CG 4.45Å; V347-R428 HydrophobicContact CG2-CG 3.98Å; F350-R428 HydrophobicContact CB-CB 4.07Å; F350-R428 HydrophobicContact CB-CG 4.5Å; F350-R428 HydrophobicContact CD1-CB 3.89Å; F350-R428 HydrophobicContact CD2-CB 4.07Å; F350-R428 HydrophobicContact CD2-CG 4.5Å; F350-R428 HydrophobicContact CE1-CB 4.34Å; F350-R428 HydrophobicContact CG-CB 3.73Å; F350-R428 HydrophobicContact CG-CG 4.43Å; T424-R428 WeakPolarHBondContact O-CG 3.4Å; N425-R428 PolarHBondContact O-N 3.3Å; N425-R428 VanDerWaalsContact O-N 3.16Å; R428-A431 PolarHBondContact O-N 3.42Å; R428-L432 WeakPolarHBondContact O-CG 3.3Å; R428-L432 PolarHBondContact O-N 2.88Å
429	A	68.9	Low	63.7	Low	0 Å²	0	60.7 Å²	60.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.4	-43.1	177.2	0	0	0	0	0	112.6	F350 M353 L413 N425 V426 A431 L432 L433	F350-A429 HydrophobicContact CE1-CB 4.31Å; M353-A429 HydrophobicContact CE-CB 3.43Å; M353-A429 VanDerWaalsContact CE-CB 3.43Å; L413-A429 HydrophobicContact CD2-CB 4.31Å; N425-A429 WeakPolarHBondContact O-CB 3.34Å; N425-A429 PolarHBondContact O-N 3.01Å; V426-A429 PolarHBondContact O-N 3.41Å; A429-A431 VanDerWaalsContact C-N 3.34Å; A429-L432 PolarHBondContact O-N 2.95Å; A429-L433 PolarHBondContact O-N 2.92Å
430	L	67.8	Low	64.9	Low	14 Å²	14	57.4 Å²	57.4	7%	0.073	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-37.8	175.9	-70.4	170	0	0	0	112.1	W253 C254 V410 L413 L414 V426 K427 L433 W434	W253-L430 HydrophobicContact CZ3-CD1 4.43Å; C254-L430 WeakPolarHBondContact SG-CD1 3.29Å; V410-L430 HydrophobicContact CB-CD2 4.42Å; V410-L430 HydrophobicContact CG1-CD2 3.89Å; V410-L430 HydrophobicContact CG2-CD2 4.33Å; L413-L430 HydrophobicContact CB-CD2 4.28Å; L413-L430 HydrophobicContact CD1-CD2 4.06Å; L414-L430 HydrophobicContact CD2-CD1 4.18Å; V426-L430 HydrophobicContact CG1-CD1 3.94Å; V426-L430 WeakPolarHBondContact O-CG 3.43Å; V426-L430 PolarHBondContact O-N 3.35Å; K427-L430 PolarHBondContact O-N 2.99Å; L430-L433 PolarHBondContact O-N 2.98Å; L430-W434 WeakPolarHBondContact O-CB 3.33Å; L430-W434 PolarHBondContact O-N 2.87Å
431	A	66.5	Low	65.8	Low	5 Å²	5	50.3 Å²	50.3	4%	0.041	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-41.5	175.8	0	0	0	0	0	112.4	F265 L343 V347 K427 R428 A429 W434 D435	F265-A431 HydrophobicContact CZ-CB 4.47Å; L343-A431 HydrophobicContact CD2-CB 3.85Å; V347-A431 HydrophobicContact CG1-CB 3.81Å; K427-A431 WeakPolarHBondContact O-CB 3.47Å; K427-A431 PolarHBondContact O-N 3.41Å; R428-A431 PolarHBondContact O-N 3.42Å; A429-A431 VanDerWaalsContact C-N 3.34Å; A431-W434 PolarHBondContact O-N 2.85Å; A431-D435 PolarHBondContact O-N 3.27Å
432	L	71.7	Confident	66.7	Low	25 Å²	25	49 Å²	49	13%	0.131	22%	0.219	C	C	.	.	H	α-helix	trans	-68.4	-38.4	175.6	-67.9	172.3	0	0	0	112.6	V347 F350 I357 R428 A429 W434 D435 E436	V347-L432 HydrophobicContact CG1-CD2 4.46Å; V347-L432 HydrophobicContact CG1-CG 4.38Å; F350-L432 HydrophobicContact CB-CD1 4.41Å; F350-L432 HydrophobicContact CD1-CD1 3.72Å; I357-L432 HydrophobicContact CD1-CB 3.45Å; I357-L432 VanDerWaalsContact CD1-CB 3.45Å; I357-L432 HydrophobicContact CD1-CD1 3.69Å; I357-L432 HydrophobicContact CD1-CG 4.24Å; R428-L432 WeakPolarHBondContact O-CG 3.3Å; R428-L432 PolarHBondContact O-N 2.88Å; A429-L432 PolarHBondContact O-N 2.95Å; L432-W434 VanDerWaalsContact C-N 3.28Å; L432-W434 PolarHBondContact O-N 3.46Å; L432-D435 WeakPolarHBondContact O-CB 3.32Å; L432-D435 PolarHBondContact O-N 3.42Å; L432-E436 PolarHBondContact O-N 2.92Å
433	L	73.5	Confident	67.6	Low	9 Å²	9	40.9 Å²	40.9	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-61.4	-40.4	172.6	178.4	68.1	0	0	0	111.4	I357 L360 I364 A409 V410 L413 A429 L430 E436 L437	I357-L433 HydrophobicContact CG2-CB 4.41Å; I357-L433 HydrophobicContact CG2-CD1 4.32Å; L360-L433 HydrophobicContact CB-CD1 4Å; I364-L433 HydrophobicContact CD1-CD1 4.37Å; A409-L433 HydrophobicContact CB-CD2 4.22Å; V410-L433 HydrophobicContact CG2-CD2 4.16Å; L413-L433 HydrophobicContact CD1-CB 3.6Å; L413-L433 HydrophobicContact CD1-CD2 3.4Å; L413-L433 HydrophobicContact CD1-CG 4Å; L413-L433 HydrophobicContact CG-CD2 4.49Å; A429-L433 PolarHBondContact O-N 2.92Å; L430-L433 PolarHBondContact O-N 2.98Å; L433-E436 PolarHBondContact O-N 2.81Å; L433-L437 VanDerWaalsContact O-CB 3.3Å; L433-L437 WeakPolarHBondContact O-CB 3.33Å; L433-L437 PolarHBondContact O-N 3.5Å
434	W	71	Confident	68.7	Low	58 Å²	58	35.3 Å²	35.3	22%	0.22	17%	0.165	C	C	.	.	H	α-helix	trans	-66.4	-40.3	177.6	-170.6	-105.9	0	0	0	112.4	F265 L430 A431 L432 L437 L438	F265-W434 AromaticContact CE1-CD1 3.54Å; F265-W434 HydrophobicContact CE1-CG 4.13Å; F265-W434 AromaticContact CE1-NE1 3.95Å; L430-W434 WeakPolarHBondContact O-CB 3.33Å; L430-W434 PolarHBondContact O-N 2.87Å; A431-W434 PolarHBondContact O-N 2.85Å; L432-W434 VanDerWaalsContact C-N 3.28Å; L432-W434 PolarHBondContact O-N 3.46Å; W434-L437 HydrophobicContact CE3-CD2 3.68Å; W434-L437 HydrophobicContact CH2-CD2 4.08Å; W434-L437 HydrophobicContact CZ3-CD2 3.41Å; W434-L437 VanDerWaalsContact CZ3-CD2 3.41Å; W434-L437 PolarHBondContact O-N 2.74Å; W434-L438 HydrophobicContact CZ2-CD2 4.26Å; W434-L438 HydrophobicContact CZ2-CG 4.47Å; W434-L438 VanDerWaalsContact NE1-CD1 3.34Å; W434-L438 WeakPolarHBondContact O-CB 3.33Å; W434-L438 WeakPolarHBondContact O-CG 3.4Å; W434-L438 PolarHBondContact O-N 2.83Å
435	D	67.6	Low	69.5	Low	35 Å²	35	32.4 Å²	32.4	19%	0.187	15%	0.146	C	C	.	.	H	α-helix	trans	-58.3	-49.6	174.1	-167.5	46.1	0	0	0	111	V339 S340 L343 A431 L432 L437 L438 Y439	V339-D435 WeakPolarHBondContact CB-OD1 2.89Å; V339-D435 WeakPolarHBondContact CG1-OD1 3.3Å; S340-D435 PolarHBondContact N-OD1 2.94Å; L343-D435 HydrophobicContact CD1-CB 4.18Å; A431-D435 PolarHBondContact O-N 3.27Å; L432-D435 WeakPolarHBondContact O-CB 3.32Å; L432-D435 PolarHBondContact O-N 3.42Å; D435-L437 PolarHBondContact O-N 3.27Å; D435-L438 PolarHBondContact O-N 2.9Å; D435-Y439 PolarHBondContact O-N 3Å
436	E	75.7	Confident	69.7	Low	65 Å²	65	34.9 Å²	34.9	30%	0.304	16%	0.159	S	C	.	.	H	α-helix	trans	-65.9	-38	178.9	-164.3	71.4	-168.7	0	0	112.3	I357 T361 L432 L433 Y439 E440	I357-E436 HydrophobicContact CG2-CB 4.12Å; I357-E436 HydrophobicContact CG2-CG 4.49Å; T361-E436 HydrophobicContact CG2-CG 3.77Å; T361-E436 VanDerWaalsContact OG1-CG 3.22Å; T361-E436 WeakPolarHBondContact OG1-CG 3.42Å; L432-E436 PolarHBondContact O-N 2.92Å; L433-E436 PolarHBondContact O-N 2.81Å; E436-Y439 PolarHBondContact O-N 3.02Å; E436-E440 PolarHBondContact O-N 3.23Å
437	L	73.8	Confident	70.3	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-62.8	-46.2	174.5	-174	101	0	0	0	111.3	I364 F365 I406 L433 W434 D435 Y439 E440 L441	I364-L437 HydrophobicContact CD1-CD1 3.84Å; I364-L437 HydrophobicContact CG2-CD1 3.98Å; F365-L437 HydrophobicContact CE2-CD1 3.94Å; F365-L437 HydrophobicContact CE2-CG 4.44Å; F365-L437 HydrophobicContact CZ-CD1 4.09Å; F365-L437 HydrophobicContact CZ-CG 4.39Å; I406-L437 HydrophobicContact CD1-CD1 4.3Å; I406-L437 HydrophobicContact CG1-CD1 4.16Å; L433-L437 VanDerWaalsContact O-CB 3.3Å; L433-L437 WeakPolarHBondContact O-CB 3.33Å; L433-L437 PolarHBondContact O-N 3.5Å; W434-L437 HydrophobicContact CE3-CD2 3.68Å; W434-L437 HydrophobicContact CH2-CD2 4.08Å; W434-L437 HydrophobicContact CZ3-CD2 3.41Å; W434-L437 VanDerWaalsContact CZ3-CD2 3.41Å; W434-L437 PolarHBondContact O-N 2.74Å; D435-L437 PolarHBondContact O-N 3.27Å; L437-Y439 VanDerWaalsContact C-N 3.33Å; L437-E440 PolarHBondContact O-N 3.44Å; L437-L441 HydrophobicContact CD2-CD1 4.12Å; L437-L441 HydrophobicContact CG-CD1 4.32Å; L437-L441 WeakPolarHBondContact O-CG 3.26Å; L437-L441 PolarHBondContact O-N 3.37Å
438	L	68.6	Low	70.9	Confident	10 Å²	10	38.6 Å²	38.6	5%	0.052	18%	0.182	C	C	.	.	H	α-helix	trans	-64.9	-38.8	178.3	-76.5	179.3	0	0	0	111.6	L268 L329 V339 W434 D435 E440 L441 R442	L268-L438 HydrophobicContact CD2-CD1 4.22Å; L329-L438 HydrophobicContact CD1-CD2 4.16Å; V339-L438 HydrophobicContact CB-CD1 4.43Å; V339-L438 HydrophobicContact CG1-CD1 4.08Å; V339-L438 HydrophobicContact CG2-CB 4.47Å; V339-L438 HydrophobicContact CG2-CD1 3.73Å; W434-L438 HydrophobicContact CZ2-CD2 4.26Å; W434-L438 HydrophobicContact CZ2-CG 4.47Å; W434-L438 VanDerWaalsContact NE1-CD1 3.34Å; W434-L438 WeakPolarHBondContact O-CB 3.33Å; W434-L438 WeakPolarHBondContact O-CG 3.4Å; W434-L438 PolarHBondContact O-N 2.83Å; D435-L438 PolarHBondContact O-N 2.9Å; L438-E440 PolarHBondContact O-N 3.34Å; L438-L441 HydrophobicContact CD2-CD1 4.49Å; L438-L441 PolarHBondContact O-N 3.18Å; L438-R442 VanDerWaalsContact O-CB 3.23Å; L438-R442 WeakPolarHBondContact O-CB 3.4Å; L438-R442 PolarHBondContact O-N 2.9Å
439	Y	70.8	Confident	71.4	Confident	140 Å²	140	39.3 Å²	39.3	55%	0.549	19%	0.19	S	C	.	.	H	α-helix	trans	-58.5	-46.7	173.8	179.8	-94.8	0	0	0	111.7	D435 E436 L437 R442 S443	D435-Y439 PolarHBondContact O-N 3Å; E436-Y439 PolarHBondContact O-N 3.02Å; L437-Y439 VanDerWaalsContact C-N 3.33Å; Y439-R442 PolarHBondContact O-N 2.79Å; Y439-S443 WeakPolarHBondContact O-CB 3.45Å; Y439-S443 PolarHBondContact O-N 2.88Å
440	E	77.6	Confident	71.7	Confident	40 Å²	40	40.2 Å²	40.2	19%	0.187	19%	0.194	C	C	.	.	H	α-helix	trans	-66.7	-43.2	177.1	-80.5	-60.9	150	0	0	113	T361 F365 E436 L437 L438 R442 S443 R444	T361-E440 HydrophobicContact CG2-CB 4.47Å; T361-E440 HydrophobicContact CG2-CG 3.72Å; F365-E440 HydrophobicContact CD2-CB 3.9Å; F365-E440 HydrophobicContact CD2-CG 4.1Å; F365-E440 HydrophobicContact CE1-CB 4.35Å; F365-E440 HydrophobicContact CE2-CB 3.4Å; F365-E440 HydrophobicContact CE2-CG 4.01Å; F365-E440 HydrophobicContact CZ-CB 3.66Å; E436-E440 PolarHBondContact O-N 3.23Å; L437-E440 PolarHBondContact O-N 3.44Å; L438-E440 PolarHBondContact O-N 3.34Å; E440-R442 VanDerWaalsContact C-N 3.27Å; E440-R442 PolarHBondContact O-N 3.05Å; E440-S443 PolarHBondContact O-N 2.8Å; E440-R444 WeakPolarHBondContact O-CB 3.43Å; E440-R444 WeakPolarHBondContact O-CG 3.5Å; E440-R444 PolarHBondContact O-N 3.46Å
441	L	72.9	Confident	72	Confident	12 Å²	12	40.3 Å²	40.3	6%	0.063	20%	0.195	C	C	.	.	H	α-helix	trans	-59	-41.2	174.4	-72.4	178	0	0	0	111.4	I333 F365 M402 L437 L438 R444 W445 L451 L473	I333-L441 HydrophobicContact CD1-CB 4.46Å; F365-L441 HydrophobicContact CE1-CD2 3.91Å; F365-L441 HydrophobicContact CZ-CD2 3.92Å; F365-L441 HydrophobicContact CZ-CG 4.08Å; M402-L441 HydrophobicContact CE-CD2 3.89Å; L437-L441 HydrophobicContact CD2-CD1 4.12Å; L437-L441 HydrophobicContact CG-CD1 4.32Å; L437-L441 WeakPolarHBondContact O-CG 3.26Å; L437-L441 PolarHBondContact O-N 3.37Å; L438-L441 HydrophobicContact CD2-CD1 4.49Å; L438-L441 PolarHBondContact O-N 3.18Å; L441-R444 PolarHBondContact O-N 2.58Å; L441-W445 PolarHBondContact O-N 3.4Å; L441-L451 HydrophobicContact CD2-CD1 4.15Å; L441-L451 HydrophobicContact CD2-CD2 3.67Å; L441-L473 HydrophobicContact CB-CD2 4.41Å; L441-L473 HydrophobicContact CD1-CD2 4.28Å; L441-L473 HydrophobicContact CD2-CD2 3.76Å; L441-L473 HydrophobicContact CG-CD2 4.37Å
442	R	67.9	Low	72.1	Confident	61 Å²	61	41.6 Å²	41.6	23%	0.23	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-47.4	176.4	172	172.3	-170.5	-166.3	-1.7	112.6	I333 S335 L438 Y439 E440 R444 W445 L446	I333-R442 HydrophobicContact CG2-CB 4.11Å; I333-R442 HydrophobicContact CG2-CG 4.32Å; I333-R442 WeakPolarHBondContact O-CD 3.22Å; I333-R442 WeakPolarHBondContact O-CG 3.4Å; I333-R442 PolarHBondContact O-NE 2.93Å; S335-R442 PolarHBondContact O-NH1 3.07Å; S335-R442 PolarHBondContact O-NH2 2.65Å; L438-R442 VanDerWaalsContact O-CB 3.23Å; L438-R442 WeakPolarHBondContact O-CB 3.4Å; L438-R442 PolarHBondContact O-N 2.9Å; Y439-R442 PolarHBondContact O-N 2.79Å; E440-R442 VanDerWaalsContact C-N 3.27Å; E440-R442 PolarHBondContact O-N 3.05Å; R442-R444 PolarHBondContact O-N 3.22Å; R442-W445 PolarHBondContact O-N 3.49Å; R442-L446 HydrophobicContact CG-CD1 3.83Å; R442-L446 HydrophobicContact CG-CG 4.34Å; R442-L446 WeakPolarHBondContact O-CB 3.49Å; R442-L446 WeakPolarHBondContact O-CG 3.44Å; R442-L446 PolarHBondContact O-N 2.91Å
443	S	73.1	Confident	71.8	Confident	37 Å²	37	46.6 Å²	46.6	26%	0.259	23%	0.228	S	C	.	.	H	α-helix	trans	-54.8	-43.2	174.6	-179	0	0	0	0	110.7	Y439 E440 N447	Y439-S443 WeakPolarHBondContact O-CB 3.45Å; Y439-S443 PolarHBondContact O-N 2.88Å; E440-S443 PolarHBondContact O-N 2.8Å; S443-N447 VanDerWaalsContact O-CB 3.23Å; S443-N447 WeakPolarHBondContact O-CB 3.46Å; S443-N447 VanDerWaalsContact O-CG 3.26Å; S443-N447 PolarHBondContact O-N 2.87Å; S443-N447 PolarHBondContact O-ND2 2.84Å; S443-N447 PolarHBondContact OG-ND2 2.97Å
444	R	76	Confident	71.3	Confident	21 Å²	21	54.9 Å²	54.9	8%	0.079	26%	0.264	C	S	.	.	H	α-helix	trans	-69.1	-42.2	179.2	-72.7	-175.1	177.7	-122.1	1.4	113.7	F365 E440 L441 R442 N447 G448 I449 L450 L451	F365-R444 PolarHBondContact O-NH2 2.92Å; E440-R444 WeakPolarHBondContact O-CB 3.43Å; E440-R444 WeakPolarHBondContact O-CG 3.5Å; E440-R444 PolarHBondContact O-N 3.46Å; L441-R444 PolarHBondContact O-N 2.58Å; R442-R444 PolarHBondContact O-N 3.22Å; R444-N447 PolarHBondContact O-N 3.29Å; R444-G448 PolarHBondContact O-N 2.79Å; R444-I449 HydrophobicContact CB-CB 4.24Å; R444-I449 WeakPolarHBondContact CB-O 2.84Å; R444-I449 HydrophobicContact CG-CB 4.1Å; R444-I449 HydrophobicContact CG-CG2 4.25Å; R444-I449 PolarHBondContact O-N 3.25Å; R444-L450 PolarHBondContact NH1-O 3.11Å; R444-L451 HydrophobicContact CB-CD2 4.4Å
445	W	69.6	Low	70.8	Confident	16 Å²	16	55 Å²	55	6%	0.061	27%	0.267	C	S	.	.	H	α-helix	trans	-58.3	-53.8	172.7	179.1	-97.7	0	0	0	111.8	I330 I333 E334 L441 R442 N447 G448 L473 G476 I477 E480	I330-W445 HydrophobicContact CD1-CD2 4.2Å; I330-W445 HydrophobicContact CD1-CE3 3.74Å; I330-W445 HydrophobicContact CD1-CH2 3.66Å; I330-W445 HydrophobicContact CD1-CZ2 4.08Å; I330-W445 HydrophobicContact CD1-CZ3 3.46Å; I330-W445 VanDerWaalsContact CD1-CZ3 3.46Å; I330-W445 HydrophobicContact CG1-CH2 4.32Å; I330-W445 HydrophobicContact CG2-CH2 4.26Å; I330-W445 HydrophobicContact CG2-CZ2 3.79Å; I333-W445 HydrophobicContact CG2-CB 3.54Å; I333-W445 HydrophobicContact CG2-CD2 4.43Å; I333-W445 HydrophobicContact CG2-CG 3.59Å; E334-W445 PolarHBondContact OE1-NE1 3.08Å; L441-W445 PolarHBondContact O-N 3.4Å; R442-W445 PolarHBondContact O-N 3.49Å; W445-N447 PolarHBondContact O-N 3.44Å; W445-G448 PolarHBondContact O-N 2.8Å; W445-G448 VanDerWaalsContact O-N 3.15Å; W445-L473 HydrophobicContact CE3-CD1 3.62Å; W445-L473 HydrophobicContact CZ3-CD1 3.96Å; W445-G476 VanDerWaalsContact CZ3-C 3.45Å; W445-I477 HydrophobicContact CD2-CG1 4.41Å; W445-I477 HydrophobicContact CE3-CD1 4.46Å; W445-I477 HydrophobicContact CE3-CG1 3.48Å; W445-I477 VanDerWaalsContact CE3-CG1 3.48Å; W445-I477 HydrophobicContact CZ3-CG1 4.03Å; W445-E480 HydrophobicContact CH2-CB 4.37Å; W445-E480 HydrophobicContact CZ2-CB 4.4Å; W445-E480 HydrophobicContact CZ2-CG 4.38Å
446	L	66.8	Low	70.5	Confident	76 Å²	76	56.6 Å²	56.6	40%	0.398	27%	0.274	S	S	.	.	H	α-helix	trans	-63.4	-30	-178.4	-69	175.6	0	0	0	112.7	R442 R484	R442-L446 HydrophobicContact CG-CD1 3.83Å; R442-L446 HydrophobicContact CG-CG 4.34Å; R442-L446 WeakPolarHBondContact O-CB 3.49Å; R442-L446 WeakPolarHBondContact O-CG 3.44Å; R442-L446 PolarHBondContact O-N 2.91Å; L446-R484 PolarHBondContact O-NH1 3.36Å
447	N	72.1	Confident	69.6	Low	107 Å²	107	56 Å²	56	57%	0.572	28%	0.278	S	S	*	.	H	α-helix	trans	-96.1	0.5	179.1	-65.6	-51.6	0	0	0	114	S443 R444 W445 I449	S443-N447 VanDerWaalsContact O-CB 3.23Å; S443-N447 WeakPolarHBondContact O-CB 3.46Å; S443-N447 VanDerWaalsContact O-CG 3.26Å; S443-N447 PolarHBondContact O-N 2.87Å; S443-N447 PolarHBondContact O-ND2 2.84Å; S443-N447 PolarHBondContact OG-ND2 2.97Å; R444-N447 PolarHBondContact O-N 3.29Å; W445-N447 PolarHBondContact O-N 3.44Å; N447-I449 VanDerWaalsContact C-N 3.27Å; N447-I449 HydrophobicContact CB-CD1 3.72Å; N447-I449 HydrophobicContact CB-CG1 3.81Å; N447-I449 PolarHBondContact O-N 3.21Å
448	G	70.7	Confident	68.9	Low	8 Å²	8	59.6 Å²	59.6	8%	0.082	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	28.2	-177.9	0	0	0	0	0	114.1	R444 W445	R444-G448 PolarHBondContact O-N 2.79Å; W445-G448 PolarHBondContact O-N 2.8Å; W445-G448 VanDerWaalsContact O-N 3.15Å
449	I	77.1	Confident	68.3	Low	81 Å²	81	59.5 Å²	59.5	42%	0.415	30%	0.296	S	S	.	.			trans	-91.8	116.7	-177.3	-58.2	171.5	0	0	0	108.8	R444 N447	R444-I449 HydrophobicContact CB-CB 4.24Å; R444-I449 WeakPolarHBondContact CB-O 2.84Å; R444-I449 HydrophobicContact CG-CB 4.1Å; R444-I449 HydrophobicContact CG-CG2 4.25Å; R444-I449 PolarHBondContact O-N 3.25Å; N447-I449 VanDerWaalsContact C-N 3.27Å; N447-I449 HydrophobicContact CB-CD1 3.72Å; N447-I449 HydrophobicContact CB-CG1 3.81Å; N447-I449 PolarHBondContact O-N 3.21Å
450	L	75.4	Confident	67.7	Low	19 Å²	19	59.9 Å²	59.9	10%	0.099	30%	0.301	C	S	.	.			trans	-60.3	147.8	178.9	-63.4	173.8	0	0	0	111.9	R444 I456 N474 I477 A478	R444-L450 PolarHBondContact NH1-O 3.11Å; L450-I456 HydrophobicContact CD1-CD1 3.65Å; L450-I456 HydrophobicContact CD1-CG1 4.24Å; L450-N474 WeakPolarHBondContact CA-OD1 3.37Å; L450-N474 WeakPolarHBondContact CB-OD1 3.5Å; L450-I477 HydrophobicContact CD2-CB 4.33Å; L450-I477 HydrophobicContact CD2-CG2 3.97Å; L450-A478 HydrophobicContact CD2-CB 3.84Å
451	L	73.5	Confident	66.5	Low	16 Å²	16	59.3 Å²	59.3	8%	0.084	30%	0.3	C	S	.	.	S	Bend	trans	-78.2	-38	173.7	-58.1	177.4	0	0	0	111.1	F365 M402 L441 R444 I470 L473 N474 I477	F365-L451 HydrophobicContact CE1-CD2 4.19Å; M402-L451 HydrophobicContact SD-CB 4.31Å; L441-L451 HydrophobicContact CD2-CD1 4.15Å; L441-L451 HydrophobicContact CD2-CD2 3.67Å; R444-L451 HydrophobicContact CB-CD2 4.4Å; L451-I470 HydrophobicContact CD1-CG2 4.01Å; L451-L473 HydrophobicContact CD1-CB 3.97Å; L451-L473 HydrophobicContact CD1-CD2 3.81Å; L451-L473 HydrophobicContact CD1-CG 3.87Å; L451-N474 HydrophobicContact CB-CB 4.32Å; L451-N474 HydrophobicContact CD1-CB 4.42Å; L451-N474 PolarHBondContact N-OD1 3.41Å; L451-I477 HydrophobicContact CD1-CD1 4.47Å; L451-I477 HydrophobicContact CD2-CD1 4.4Å; L451-I477 HydrophobicContact CG-CD1 4.05Å
452	D	69.5	Low	65.5	Low	32 Å²	32	61.7 Å²	61.7	17%	0.171	32%	0.315	C	S	.	.			trans	-146.9	115.7	174.6	-169	-23	0	0	0	110	K454 Q455 N474	D452-K454 PolarHBondContact O-N 2.88Å; D452-K454 VanDerWaalsContact O-N 3.13Å; D452-K454 WeakPolarHBondContact OD1-CB 3.22Å; D452-K454 PolarHBondContact OD1-N 3.33Å; D452-Q455 HydrophobicContact CB-CB 4.49Å; D452-Q455 PolarHBondContact O-N 3.03Å; D452-N474 PolarHBondContact N-OD1 3.08Å; D452-N474 PolarHBondContact O-ND2 3.11Å
453	D	65.5	Low	64.8	Low	129 Å²	129	59.3 Å²	59.3	69%	0.69	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.8	-179.7	-66.3	-29.2	0	0	0	113
454	K	62.5	Low	63.8	Low	184 Å²	184	62.1 Å²	62.1	80%	0.8	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-11.9	-176.1	-62	178.4	-178	171.5	0	114.1	D452	D452-K454 PolarHBondContact O-N 2.88Å; D452-K454 VanDerWaalsContact O-N 3.13Å; D452-K454 WeakPolarHBondContact OD1-CB 3.22Å; D452-K454 PolarHBondContact OD1-N 3.33Å
455	Q	60.1	Low	62.7	Low	61 Å²	61	62.7 Å²	62.7	29%	0.285	32%	0.319	S	S	.	.			trans	-126.3	67.4	-172.1	-66.9	-167.7	-20.9	0	0	112.2	D452 H467 N474	D452-Q455 HydrophobicContact CB-CB 4.49Å; D452-Q455 PolarHBondContact O-N 3.03Å; Q455-H467 PolarHBondContact OE1-NE2 3.34Å; Q455-H467 VanDerWaalsContact OE1-NE2 3.09Å; Q455-N474 PolarHBondContact O-ND2 2.9Å
456	I	60.8	Low	61.9	Low	68 Å²	68	63.8 Å²	63.8	35%	0.349	33%	0.325	S	S	.	.			trans	-101.9	65.9	173.4	-46.2	172.5	0	0	0	108.7	L450 A478	L450-I456 HydrophobicContact CD1-CD1 3.65Å; L450-I456 HydrophobicContact CD1-CG1 4.24Å; I456-A478 HydrophobicContact CG2-CB 3.5Å; I456-A478 VanDerWaalsContact CG2-CB 3.5Å
457	S	58	Low	61.5	Low	53 Å²	53	60.4 Å²	60.4	37%	0.371	31%	0.308	S	S	.	.	S	Bend	trans	-135.9	155.9	174.9	61.9	0	0	0	0	110
458	L	58.2	Low	60.7	Low	80 Å²	80	55.5 Å²	55.5	42%	0.419	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-55.1	145.6	168	-79.8	163.8	0	0	0	110	F475	L458-F475 HydrophobicContact CD2-CD1 4.31Å; L458-F475 HydrophobicContact CD2-CE1 4.19Å; L458-F475 HydrophobicContact CD2-CZ 4.38Å; L458-F475 HydrophobicContact CG-CE2 4.27Å; L458-F475 HydrophobicContact CG-CZ 4.3Å
459	P	55.7	Low	60.1	Low	9 Å²	9	56.8 Å²	56.8	6%	0.058	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-61.7	144.8	-176.8	-14.7	21.3	0	0	0	112.8	Q468 E471 M472 L674	P459-Q468 HydrophobicContact CB-CB 3.76Å; P459-Q468 HydrophobicContact CB-CG 3.73Å; P459-Q468 HydrophobicContact CG-CB 4.29Å; P459-E471 VanDerWaalsContact CA-OE2 3.3Å; P459-E471 WeakPolarHBondContact CA-OE2 2.83Å; P459-E471 HydrophobicContact CB-CB 4.2Å; P459-E471 HydrophobicContact CG-CB 4.12Å; P459-M472 HydrophobicContact CG-CB 4.35Å; P459-M472 HydrophobicContact CG-CG 3.19Å; P459-M472 HydrophobicContact CG-SD 4.12Å; P459-L674 HydrophobicContact CB-CD2 4.11Å; P459-L674 HydrophobicContact CG-CD2 3.69Å
460	K	58.3	Low	59.5	Low	147 Å²	147	53.8 Å²	53.8	64%	0.639	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-82.7	129.7	171.6	-64.1	-179.6	-176.3	177	0	109.1	V462 S463 Q468	K460-V462 PolarHBondContact O-N 2.75Å; K460-S463 PolarHBondContact O-N 3.04Å; K460-S463 PolarHBondContact O-OG 2.84Å; K460-Q468 PolarHBondContact O-NE2 3.17Å
461	V	53	Low	59	Low	28 Å²	28	53.3 Å²	53.3	17%	0.17	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-25.8	-179.3	176.4	0	0	0	0	113.8	Q468 L674 V678 Y681 Y705	V461-Q468 VanDerWaalsContact C-NE2 3.34Å; V461-Q468 PolarHBondContact O-NE2 2.87Å; V461-Q468 VanDerWaalsContact O-NE2 3.12Å; V461-L674 HydrophobicContact CG2-CD1 3.92Å; V461-V678 HydrophobicContact CG1-CG2 4.42Å; V461-Y681 HydrophobicContact CG1-CG 4.36Å; V461-Y705 HydrophobicContact CB-CE2 3.9Å; V461-Y705 HydrophobicContact CG1-CD2 4.11Å; V461-Y705 HydrophobicContact CG1-CE2 3.79Å
462	V	51.1	Low	58.5	Low	62 Å²	62	53 Å²	53	38%	0.376	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-10.6	-179	-165.2	0	0	0	0	113.3	K460 Y705	K460-V462 PolarHBondContact O-N 2.75Å; V462-Y705 HydrophobicContact CG2-CD2 4.05Å; V462-Y705 HydrophobicContact CG2-CE2 4.12Å
463	S	53.2	Low	58.3	Low	11 Å²	11	51.6 Å²	51.6	8%	0.077	26%	0.259	C	S	.	.	S	Bend	trans	-76.9	164.1	174.6	51.3	0	0	0	0	111.9	K460 H467 Q468 E471	K460-S463 PolarHBondContact O-N 3.04Å; K460-S463 PolarHBondContact O-OG 2.84Å; S463-H467 VanDerWaalsContact CB-ND1 3.29Å; S463-H467 WeakPolarHBondContact CB-ND1 3.18Å; S463-Q468 VanDerWaalsContact O-CD 3.23Å; S463-Q468 PolarHBondContact O-NE2 3.42Å; S463-Q468 WeakPolarHBondContact OG-CG 3.39Å; S463-Q468 PolarHBondContact OG-NE2 2.8Å; S463-E471 PolarHBondContact OG-OE2 2.89Å
464	W	53.2	Low	58.6	Low	97 Å²	97	45.5 Å²	45.5	37%	0.367	23%	0.226	S	C	.	.			trans	-73.3	153.9	179.5	-65	85.9	0	0	0	110.8	C399 L466 H467 Q468	C399-W464 VanDerWaalsContact SG-CD1 3.5Å; W464-L466 VanDerWaalsContact C-N 3.32Å; W464-L466 PolarHBondContact O-N 2.87Å; W464-H467 HydrophobicContact CB-CB 4.48Å; W464-H467 CarbonylContact O-C 3.54Å; W464-H467 WeakPolarHBondContact O-CA 3.22Å; W464-H467 WeakPolarHBondContact O-CB 3.29Å; W464-H467 PolarHBondContact O-N 3.3Å; W464-Q468 WeakPolarHBondContact O-CG 3.35Å; W464-Q468 PolarHBondContact O-N 3.03Å
465	P	51.8	Low	58.9	Low	32 Å²	32	39.3 Å²	39.3	21%	0.208	20%	0.199	C	C	.	.	H	α-helix	trans	-64.8	-36.6	-170.3	-23.1	35.7	0	0	0	112.9	H467 Q468 N469 E682	P465-H467 VanDerWaalsContact C-N 3.29Å; P465-H467 PolarHBondContact O-N 2.89Å; P465-Q468 PolarHBondContact O-N 3.13Å; P465-N469 WeakPolarHBondContact O-CB 3.42Å; P465-N469 PolarHBondContact O-N 2.77Å; P465-N469 PolarHBondContact O-OD1 2.89Å; P465-E682 WeakPolarHBondContact CD-OE1 3.5Å; P465-E682 HydrophobicContact CG-CG 4.34Å; P465-E682 WeakPolarHBondContact CG-OE1 3.42Å; P465-E682 WeakPolarHBondContact CG-OE2 3.35Å
466	L	52.6	Low	59.1	Low	39 Å²	39	36.6 Å²	36.6	20%	0.204	19%	0.188	C	C	.	.	H	α-helix	trans	-64.5	-39.7	174.7	-178.4	64.7	0	0	0	110.7	M247 I406 W464 I470	M247-L466 HydrophobicContact CE-CB 3.65Å; M247-L466 HydrophobicContact CE-CD2 3.43Å; M247-L466 VanDerWaalsContact CE-CD2 3.43Å; M247-L466 HydrophobicContact CE-CG 4.17Å; I406-L466 HydrophobicContact CD1-CD2 4.12Å; I406-L466 HydrophobicContact CG2-CD2 4.27Å; W464-L466 VanDerWaalsContact C-N 3.32Å; W464-L466 PolarHBondContact O-N 2.87Å; L466-I470 HydrophobicContact CD1-CD1 4.29Å; L466-I470 HydrophobicContact CG-CD1 4.05Å; L466-I470 WeakPolarHBondContact O-CB 3.4Å; L466-I470 WeakPolarHBondContact O-CD1 3.26Å; L466-I470 VanDerWaalsContact O-CG1 3.23Å; L466-I470 WeakPolarHBondContact O-CG1 3.43Å; L466-I470 PolarHBondContact O-N 2.96Å
467	H	58.2	Low	59.4	Low	6 Å²	6	33.4 Å²	33.4	3%	0.028	17%	0.172	C	C	.	.	H	α-helix	trans	-68.3	-40	178.2	-177.9	-131.9	0	0	0	110.6	K398 G400 C403 Q455 S463 W464 P465 I470 E471	K398-H467 PolarHBondContact O-ND1 3.45Å; G400-H467 WeakPolarHBondContact CA-NE2 3.46Å; G400-H467 PolarHBondContact N-CD2 2.86Å; G400-H467 PolarHBondContact N-NE2 3.04Å; G400-H467 VanDerWaalsContact N-NE2 3.17Å; C403-H467 WeakPolarHBondContact SG-CA 3.29Å; C403-H467 VanDerWaalsContact SG-CB 3.54Å; C403-H467 PolarHBondContact SG-N 3.41Å; C403-H467 VanDerWaalsContact SG-N 3.36Å; Q455-H467 PolarHBondContact OE1-NE2 3.34Å; Q455-H467 VanDerWaalsContact OE1-NE2 3.09Å; S463-H467 VanDerWaalsContact CB-ND1 3.29Å; S463-H467 WeakPolarHBondContact CB-ND1 3.18Å; W464-H467 HydrophobicContact CB-CB 4.48Å; W464-H467 CarbonylContact O-C 3.54Å; W464-H467 WeakPolarHBondContact O-CA 3.22Å; W464-H467 WeakPolarHBondContact O-CB 3.29Å; W464-H467 PolarHBondContact O-N 3.3Å; P465-H467 VanDerWaalsContact C-N 3.29Å; P465-H467 PolarHBondContact O-N 2.89Å; H467-I470 CarbonylContact O-C 3.56Å; H467-I470 PolarHBondContact O-N 3.21Å; H467-E471 IonicContact CE1-OE1 3.24Å; H467-E471 PolarHBondContact CE1-OE1 2.82Å; H467-E471 IonicContact CE1-OE2 3.84Å; H467-E471 IonicContact ND1-OE1 3.47Å; H467-E471 IonicContact ND1-OE2 3.49Å; H467-E471 IonicContact NE2-OE1 3.98Å; H467-E471 PolarHBondContact NE2-OE1 3.16Å; H467-E471 WeakPolarHBondContact O-CG 3.38Å; H467-E471 PolarHBondContact O-N 2.87Å
468	Q	55.3	Low	59.9	Low	3 Å²	3	31.7 Å²	31.7	1%	0.014	16%	0.161	C	C	.	.	H	α-helix	trans	-64.4	-46.5	174.5	-67.1	164.9	-30	0	0	111.7	P459 K460 V461 S463 W464 P465 I470 E471 M472	P459-Q468 HydrophobicContact CB-CB 3.76Å; P459-Q468 HydrophobicContact CB-CG 3.73Å; P459-Q468 HydrophobicContact CG-CB 4.29Å; K460-Q468 PolarHBondContact O-NE2 3.17Å; V461-Q468 VanDerWaalsContact C-NE2 3.34Å; V461-Q468 PolarHBondContact O-NE2 2.87Å; V461-Q468 VanDerWaalsContact O-NE2 3.12Å; S463-Q468 VanDerWaalsContact O-CD 3.23Å; S463-Q468 PolarHBondContact O-NE2 3.42Å; S463-Q468 WeakPolarHBondContact OG-CG 3.39Å; S463-Q468 PolarHBondContact OG-NE2 2.8Å; W464-Q468 WeakPolarHBondContact O-CG 3.35Å; W464-Q468 PolarHBondContact O-N 3.03Å; P465-Q468 PolarHBondContact O-N 3.13Å; Q468-I470 PolarHBondContact O-N 2.73Å; Q468-E471 CarbonylContact O-C 3.57Å; Q468-E471 PolarHBondContact O-N 3.27Å; Q468-E471 VanDerWaalsContact O-N 3.08Å; Q468-M472 WeakPolarHBondContact O-CB 3.37Å; Q468-M472 VanDerWaalsContact O-CG 3.25Å; Q468-M472 WeakPolarHBondContact O-CG 3.42Å; Q468-M472 PolarHBondContact O-N 3.3Å
469	N	59.5	Low	60.2	Low	35 Å²	35	30.2 Å²	30.2	19%	0.187	15%	0.151	C	C	.	.	H	α-helix	trans	-59.8	-35.5	175.7	-70.5	-7.1	0	0	0	111.6	P465 L473	P465-N469 WeakPolarHBondContact O-CB 3.42Å; P465-N469 PolarHBondContact O-N 2.77Å; P465-N469 PolarHBondContact O-OD1 2.89Å; N469-L473 WeakPolarHBondContact O-CB 3.24Å; N469-L473 PolarHBondContact O-N 3.16Å
470	I	64.5	Low	60.5	Low	18 Å²	18	32 Å²	32	9%	0.092	16%	0.159	C	C	.	.	H	α-helix	trans	-70.7	-42.4	173.8	-71.3	167.7	0	0	0	111.1	M402 I406 L451 L466 H467 Q468 L473 N474	M402-I470 HydrophobicContact CB-CD1 4.3Å; M402-I470 HydrophobicContact CE-CD1 4.45Å; M402-I470 HydrophobicContact CG-CD1 4.04Å; M402-I470 HydrophobicContact SD-CD1 4.02Å; M402-I470 HydrophobicContact SD-CG1 4.39Å; M402-I470 HydrophobicContact SD-CG2 3.96Å; I406-I470 HydrophobicContact CD1-CD1 3.91Å; L451-I470 HydrophobicContact CD1-CG2 4.01Å; L466-I470 HydrophobicContact CD1-CD1 4.29Å; L466-I470 HydrophobicContact CG-CD1 4.05Å; L466-I470 WeakPolarHBondContact O-CB 3.4Å; L466-I470 WeakPolarHBondContact O-CD1 3.26Å; L466-I470 VanDerWaalsContact O-CG1 3.23Å; L466-I470 WeakPolarHBondContact O-CG1 3.43Å; L466-I470 PolarHBondContact O-N 2.96Å; H467-I470 CarbonylContact O-C 3.56Å; H467-I470 PolarHBondContact O-N 3.21Å; Q468-I470 PolarHBondContact O-N 2.73Å; I470-L473 PolarHBondContact O-N 2.95Å; I470-N474 VanDerWaalsContact O-CB 3.25Å; I470-N474 WeakPolarHBondContact O-CB 3Å; I470-N474 PolarHBondContact O-N 3.07Å
471	E	64.5	Low	60.9	Low	10 Å²	10	31.3 Å²	31.3	5%	0.047	15%	0.152	C	C	.	.	H	α-helix	trans	-61.6	-43.4	174.1	-75.1	179.3	148.7	0	0	110.9	P459 S463 H467 Q468 N474 F475	P459-E471 VanDerWaalsContact CA-OE2 3.3Å; P459-E471 WeakPolarHBondContact CA-OE2 2.83Å; P459-E471 HydrophobicContact CB-CB 4.2Å; P459-E471 HydrophobicContact CG-CB 4.12Å; S463-E471 PolarHBondContact OG-OE2 2.89Å; H467-E471 IonicContact CE1-OE1 3.24Å; H467-E471 PolarHBondContact CE1-OE1 2.82Å; H467-E471 IonicContact CE1-OE2 3.84Å; H467-E471 IonicContact ND1-OE1 3.47Å; H467-E471 IonicContact ND1-OE2 3.49Å; H467-E471 IonicContact NE2-OE1 3.98Å; H467-E471 PolarHBondContact NE2-OE1 3.16Å; H467-E471 WeakPolarHBondContact O-CG 3.38Å; H467-E471 PolarHBondContact O-N 2.87Å; Q468-E471 CarbonylContact O-C 3.57Å; Q468-E471 PolarHBondContact O-N 3.27Å; Q468-E471 VanDerWaalsContact O-N 3.08Å; E471-N474 PolarHBondContact O-N 3.31Å; E471-F475 VanDerWaalsContact O-CB 3.25Å; E471-F475 WeakPolarHBondContact O-CB 3.5Å; E471-F475 PolarHBondContact O-N 2.72Å
472	M	63.5	Low	61.3	Low	8 Å²	8	32.3 Å²	32.3	4%	0.039	16%	0.159	C	C	.	.	H	α-helix	trans	-63.3	-42.9	173.9	-68.8	174	68.9	0	0	111.5	F326 P459 Q468 N474 F475 G476 V671 E675	F326-M472 HydrophobicContact CB-CE 3.4Å; F326-M472 VanDerWaalsContact CB-CE 3.4Å; F326-M472 HydrophobicContact CB-SD 4.36Å; F326-M472 HydrophobicContact CD1-CE 3.77Å; F326-M472 HydrophobicContact CD2-CB 3.61Å; F326-M472 HydrophobicContact CD2-CE 3.89Å; F326-M472 HydrophobicContact CD2-SD 4.37Å; F326-M472 HydrophobicContact CE1-CE 4.5Å; F326-M472 VanDerWaalsContact CE2-C 3.44Å; F326-M472 HydrophobicContact CE2-CB 3.47Å; F326-M472 VanDerWaalsContact CE2-CB 3.47Å; F326-M472 HydrophobicContact CG-CB 4.23Å; F326-M472 HydrophobicContact CG-CE 3.4Å; F326-M472 HydrophobicContact CG-SD 4.39Å; F326-M472 HydrophobicContact CZ-CB 3.94Å; F326-M472 WeakPolarHBondContact CZ-O 3.35Å; P459-M472 HydrophobicContact CG-CB 4.35Å; P459-M472 HydrophobicContact CG-CG 3.19Å; P459-M472 HydrophobicContact CG-SD 4.12Å; Q468-M472 WeakPolarHBondContact O-CB 3.37Å; Q468-M472 VanDerWaalsContact O-CG 3.25Å; Q468-M472 WeakPolarHBondContact O-CG 3.42Å; Q468-M472 PolarHBondContact O-N 3.3Å; M472-N474 VanDerWaalsContact C-N 3.34Å; M472-F475 PolarHBondContact O-N 3.4Å; M472-G476 PolarHBondContact O-N 2.74Å; M472-V671 HydrophobicContact CE-CB 3.92Å; M472-V671 HydrophobicContact CE-CG1 3.19Å; M472-V671 HydrophobicContact CE-CG2 3.79Å; M472-E675 HydrophobicContact CE-CG 3.91Å; M472-E675 HydrophobicContact SD-CG 4.03Å
473	L	65.5	Low	61.6	Low	3 Å²	3	31.4 Å²	31.4	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-66.3	-42.7	178.8	-173.8	58.5	0	0	0	110	F326 I330 I333 L441 W445 L451 N469 I470 G476 I477	F326-L473 VanDerWaalsContact CE2-CA 3.48Å; F326-L473 HydrophobicContact CE2-CB 3.91Å; F326-L473 HydrophobicContact CE2-CD1 4.25Å; F326-L473 VanDerWaalsContact CE2-N 3.28Å; F326-L473 HydrophobicContact CZ-CD1 4.46Å; I330-L473 HydrophobicContact CD1-CD1 3.45Å; I330-L473 VanDerWaalsContact CD1-CD1 3.45Å; I333-L473 HydrophobicContact CD1-CD1 3.92Å; I333-L473 HydrophobicContact CD1-CD2 4.11Å; L441-L473 HydrophobicContact CB-CD2 4.41Å; L441-L473 HydrophobicContact CD1-CD2 4.28Å; L441-L473 HydrophobicContact CD2-CD2 3.76Å; L441-L473 HydrophobicContact CG-CD2 4.37Å; W445-L473 HydrophobicContact CE3-CD1 3.62Å; W445-L473 HydrophobicContact CZ3-CD1 3.96Å; L451-L473 HydrophobicContact CD1-CB 3.97Å; L451-L473 HydrophobicContact CD1-CD2 3.81Å; L451-L473 HydrophobicContact CD1-CG 3.87Å; N469-L473 WeakPolarHBondContact O-CB 3.24Å; N469-L473 PolarHBondContact O-N 3.16Å; I470-L473 PolarHBondContact O-N 2.95Å; L473-G476 PolarHBondContact O-N 3.5Å; L473-I477 HydrophobicContact CG-CD1 4.14Å; L473-I477 WeakPolarHBondContact O-CB 3.12Å; L473-I477 WeakPolarHBondContact O-CG1 3.43Å; L473-I477 PolarHBondContact O-N 2.95Å
474	N	71.5	Confident	62	Low	2 Å²	2	35.1 Å²	35.1	1%	0.011	16%	0.164	C	C	.	.	H	α-helix	trans	-64.1	-41.2	176.3	-159.2	45.3	0	0	0	111.9	L450 L451 D452 Q455 I470 E471 M472 I477 A478	L450-N474 WeakPolarHBondContact CA-OD1 3.37Å; L450-N474 WeakPolarHBondContact CB-OD1 3.5Å; L451-N474 HydrophobicContact CB-CB 4.32Å; L451-N474 HydrophobicContact CD1-CB 4.42Å; L451-N474 PolarHBondContact N-OD1 3.41Å; D452-N474 PolarHBondContact N-OD1 3.08Å; D452-N474 PolarHBondContact O-ND2 3.11Å; Q455-N474 PolarHBondContact O-ND2 2.9Å; I470-N474 VanDerWaalsContact O-CB 3.25Å; I470-N474 WeakPolarHBondContact O-CB 3Å; I470-N474 PolarHBondContact O-N 3.07Å; E471-N474 PolarHBondContact O-N 3.31Å; M472-N474 VanDerWaalsContact C-N 3.34Å; N474-I477 PolarHBondContact O-N 2.95Å; N474-A478 WeakPolarHBondContact O-CB 3.24Å; N474-A478 PolarHBondContact O-N 2.83Å
475	F	67.5	Low	62.1	Low	53 Å²	53	35.9 Å²	35.9	23%	0.232	18%	0.175	C	C	.	.	H	α-helix	trans	-63.1	-45.5	173.1	-179.6	-93.9	0	0	0	111.6	L458 E471 M472 A478 H479 L667	L458-F475 HydrophobicContact CD2-CD1 4.31Å; L458-F475 HydrophobicContact CD2-CE1 4.19Å; L458-F475 HydrophobicContact CD2-CZ 4.38Å; L458-F475 HydrophobicContact CG-CE2 4.27Å; L458-F475 HydrophobicContact CG-CZ 4.3Å; E471-F475 VanDerWaalsContact O-CB 3.25Å; E471-F475 WeakPolarHBondContact O-CB 3.5Å; E471-F475 PolarHBondContact O-N 2.72Å; M472-F475 PolarHBondContact O-N 3.4Å; F475-A478 WeakPolarHBondContact O-CB 3.47Å; F475-A478 PolarHBondContact O-N 2.77Å; F475-H479 WeakPolarHBondContact O-CB 3.14Å; F475-H479 PolarHBondContact O-N 3.27Å; F475-L667 HydrophobicContact CE1-CD1 4.09Å
476	G	65.4	Low	61.9	Low	5 Å²	5	37.1 Å²	37.1	5%	0.052	18%	0.179	C	C	.	.	H	α-helix	trans	-62.3	-41.7	176.2	0	0	0	0	0	112.4	W445 M472 L473 A478 H479 E480	W445-G476 VanDerWaalsContact CZ3-C 3.45Å; M472-G476 PolarHBondContact O-N 2.74Å; L473-G476 PolarHBondContact O-N 3.5Å; G476-A478 VanDerWaalsContact C-N 3.35Å; G476-A478 PolarHBondContact O-N 2.76Å; G476-H479 PolarHBondContact O-N 2.89Å; G476-E480 VanDerWaalsContact O-CB 3.25Å; G476-E480 WeakPolarHBondContact O-CB 3.23Å; G476-E480 PolarHBondContact O-N 3.47Å
477	I	67.1	Low	61.6	Low	1 Å²	1	42 Å²	42	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-43.9	173.7	-68.6	168.5	0	0	0	110.6	W445 L450 L451 L473 N474 H479 R481	W445-I477 HydrophobicContact CD2-CG1 4.41Å; W445-I477 HydrophobicContact CE3-CD1 4.46Å; W445-I477 HydrophobicContact CE3-CG1 3.48Å; W445-I477 VanDerWaalsContact CE3-CG1 3.48Å; W445-I477 HydrophobicContact CZ3-CG1 4.03Å; L450-I477 HydrophobicContact CD2-CB 4.33Å; L450-I477 HydrophobicContact CD2-CG2 3.97Å; L451-I477 HydrophobicContact CD1-CD1 4.47Å; L451-I477 HydrophobicContact CD2-CD1 4.4Å; L451-I477 HydrophobicContact CG-CD1 4.05Å; L473-I477 HydrophobicContact CG-CD1 4.14Å; L473-I477 WeakPolarHBondContact O-CB 3.12Å; L473-I477 WeakPolarHBondContact O-CG1 3.43Å; L473-I477 PolarHBondContact O-N 2.95Å; N474-I477 PolarHBondContact O-N 2.95Å; I477-H479 VanDerWaalsContact C-N 3.33Å; I477-R481 WeakPolarHBondContact O-CB 3.29Å; I477-R481 PolarHBondContact O-N 3.24Å
478	A	67.7	Low	60.7	Low	16 Å²	16	49.1 Å²	49.1	13%	0.132	23%	0.232	C	C	.	.	H	α-helix	trans	-62.7	-41.6	176.6	0	0	0	0	0	111.5	L450 I456 N474 F475 G476 T482	L450-A478 HydrophobicContact CD2-CB 3.84Å; I456-A478 HydrophobicContact CG2-CB 3.5Å; I456-A478 VanDerWaalsContact CG2-CB 3.5Å; N474-A478 WeakPolarHBondContact O-CB 3.24Å; N474-A478 PolarHBondContact O-N 2.83Å; F475-A478 WeakPolarHBondContact O-CB 3.47Å; F475-A478 PolarHBondContact O-N 2.77Å; G476-A478 VanDerWaalsContact C-N 3.35Å; G476-A478 PolarHBondContact O-N 2.76Å; A478-T482 PolarHBondContact O-N 3.16Å; A478-T482 VanDerWaalsContact O-N 3.14Å; A478-T482 PolarHBondContact O-OG1 2.82Å
479	H	64.9	Low	59.9	Low	49 Å²	49	52.1 Å²	52.1	23%	0.227	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-50.4	177	-173.3	73.6	0	0	0	111.9	F475 G476 I477 R481 T482 N483	F475-H479 WeakPolarHBondContact O-CB 3.14Å; F475-H479 PolarHBondContact O-N 3.27Å; G476-H479 PolarHBondContact O-N 2.89Å; I477-H479 VanDerWaalsContact C-N 3.33Å; H479-R481 PolarHBondContact O-N 3.45Å; H479-T482 CarbonylContact O-C 3.56Å; H479-T482 WeakPolarHBondContact O-CA 3.34Å; H479-T482 VanDerWaalsContact O-CB 3.24Å; H479-T482 WeakPolarHBondContact O-CB 3.46Å; H479-T482 PolarHBondContact O-N 2.85Å; H479-N483 PolarHBondContact CD2-ND2 2.88Å; H479-N483 PolarHBondContact NE2-ND2 3.34Å; H479-N483 VanDerWaalsContact NE2-ND2 3.17Å; H479-N483 PolarHBondContact O-N 3.39Å
480	E	62.8	Low	58.7	Low	48 Å²	48	57.3 Å²	57.3	22%	0.224	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-41.2	178.7	177.1	60.8	-169.6	0	0	112	W445 G476 T482 N483 R484	W445-E480 HydrophobicContact CH2-CB 4.37Å; W445-E480 HydrophobicContact CZ2-CB 4.4Å; W445-E480 HydrophobicContact CZ2-CG 4.38Å; G476-E480 VanDerWaalsContact O-CB 3.25Å; G476-E480 WeakPolarHBondContact O-CB 3.23Å; G476-E480 PolarHBondContact O-N 3.47Å; E480-T482 PolarHBondContact O-N 3.27Å; E480-N483 PolarHBondContact O-N 2.91Å; E480-R484 WeakPolarHBondContact O-CG 3.46Å; E480-R484 PolarHBondContact O-N 2.82Å; E480-R484 IonicContact OE1-CZ 3.31Å; E480-R484 VanDerWaalsContact OE1-CZ 3.31Å; E480-R484 IonicContact OE1-NE 2.8Å; E480-R484 PolarHBondContact OE1-NE 2.62Å; E480-R484 IonicContact OE1-NH2 3Å; E480-R484 PolarHBondContact OE1-NH2 2.86Å
481	R	66	Low	57.5	Low	131 Å²	131	60.1 Å²	60.1	49%	0.494	30%	0.297	S	S	.	.	H	α-helix	trans	-58.3	-36.3	171.9	-177.4	179.6	-179.1	-179.8	-1.5	111.6	I477 H479 L485	I477-R481 WeakPolarHBondContact O-CB 3.29Å; I477-R481 PolarHBondContact O-N 3.24Å; H479-R481 PolarHBondContact O-N 3.45Å; R481-L485 WeakPolarHBondContact O-CD1 3.5Å; R481-L485 VanDerWaalsContact O-CG 3.29Å; R481-L485 WeakPolarHBondContact O-CG 3.36Å; R481-L485 PolarHBondContact O-N 3.22Å
482	T	61.8	Low	56.4	Low	50 Å²	50	63.7 Å²	63.7	31%	0.307	32%	0.32	S	S	.	.	H	α-helix	trans	-70.9	-44.6	176.8	-52.2	0	0	0	0	110.8	A478 H479 E480 R484 L485 L486	A478-T482 PolarHBondContact O-N 3.16Å; A478-T482 VanDerWaalsContact O-N 3.14Å; A478-T482 PolarHBondContact O-OG1 2.82Å; H479-T482 CarbonylContact O-C 3.56Å; H479-T482 WeakPolarHBondContact O-CA 3.34Å; H479-T482 VanDerWaalsContact O-CB 3.24Å; H479-T482 WeakPolarHBondContact O-CB 3.46Å; H479-T482 PolarHBondContact O-N 2.85Å; E480-T482 PolarHBondContact O-N 3.27Å; T482-R484 PolarHBondContact O-N 2.85Å; T482-L485 PolarHBondContact O-N 2.78Å; T482-L486 WeakPolarHBondContact O-CG 3.42Å; T482-L486 PolarHBondContact O-N 2.92Å
483	N	58	Low	54.9	Low	43 Å²	43	66.2 Å²	66.2	23%	0.23	34%	0.342	C	S	.	.	H	α-helix	trans	-60.3	-44.2	177	-71.9	-16	0	0	0	112.4	H479 E480 L485 L486 E487	H479-N483 PolarHBondContact CD2-ND2 2.88Å; H479-N483 PolarHBondContact NE2-ND2 3.34Å; H479-N483 VanDerWaalsContact NE2-ND2 3.17Å; H479-N483 PolarHBondContact O-N 3.39Å; E480-N483 PolarHBondContact O-N 2.91Å; N483-L485 VanDerWaalsContact C-N 3.32Å; N483-L485 PolarHBondContact O-N 3.26Å; N483-L486 WeakPolarHBondContact O-CB 3.24Å; N483-L486 PolarHBondContact O-N 2.82Å; N483-E487 PolarHBondContact O-N 2.83Å
484	R	60.1	Low	53.3	Low	88 Å²	88	72.3 Å²	72.3	33%	0.332	38%	0.375	S	S	.	.	H	α-helix	trans	-65.2	-32.5	178.6	-70.4	-178.4	-170	169.6	7	114.1	L446 E480 T482 L486 F488	L446-R484 PolarHBondContact O-NH1 3.36Å; E480-R484 WeakPolarHBondContact O-CG 3.46Å; E480-R484 PolarHBondContact O-N 2.82Å; E480-R484 IonicContact OE1-CZ 3.31Å; E480-R484 VanDerWaalsContact OE1-CZ 3.31Å; E480-R484 IonicContact OE1-NE 2.8Å; E480-R484 PolarHBondContact OE1-NE 2.62Å; E480-R484 IonicContact OE1-NH2 3Å; E480-R484 PolarHBondContact OE1-NH2 2.86Å; T482-R484 PolarHBondContact O-N 2.85Å; R484-L486 PolarHBondContact O-N 2.84Å; R484-F488 PolarHBondContact O-N 3.23Å
485	L	56.3	Low	51.8	Low	113 Å²	113	75.9 Å²	75.9	59%	0.592	41%	0.405	S	S	*	.	H	α-helix	trans	-67.3	-30.1	174.1	-71.8	168.5	0	0	0	111.1	R481 T482 N483 D489	R481-L485 WeakPolarHBondContact O-CD1 3.5Å; R481-L485 VanDerWaalsContact O-CG 3.29Å; R481-L485 WeakPolarHBondContact O-CG 3.36Å; R481-L485 PolarHBondContact O-N 3.22Å; T482-L485 PolarHBondContact O-N 2.78Å; N483-L485 VanDerWaalsContact C-N 3.32Å; N483-L485 PolarHBondContact O-N 3.26Å; L485-D489 PolarHBondContact O-N 2.82Å
486	L	46.4	Very low	50.1	Low	58 Å²	58	80.5 Å²	80.5	30%	0.304	43%	0.432	S	S	.	.	H	α-helix	trans	-76.8	-41.4	177.1	-65.4	169.7	0	0	0	113	T482 N483 R484 F488 D489 E490	T482-L486 WeakPolarHBondContact O-CG 3.42Å; T482-L486 PolarHBondContact O-N 2.92Å; N483-L486 WeakPolarHBondContact O-CB 3.24Å; N483-L486 PolarHBondContact O-N 2.82Å; R484-L486 PolarHBondContact O-N 2.84Å; L486-F488 PolarHBondContact O-N 3.38Å; L486-D489 PolarHBondContact O-N 3.26Å; L486-E490 PolarHBondContact O-N 3.37Å
487	E	47.3	Very low	48.3	Very low	142 Å²	142	87.1 Å²	87.1	66%	0.664	47%	0.466	S	S	*	.	H	α-helix	trans	-58.8	-32.7	175.6	-71.5	-173.5	162.1	0	0	112	N483 A491	N483-E487 PolarHBondContact O-N 2.83Å; E487-A491 WeakPolarHBondContact O-CB 3.31Å; E487-A491 PolarHBondContact O-N 3.15Å
488	F	39.9	Very low	46.4	Very low	155 Å²	155	92.1 Å²	92.1	68%	0.68	50%	0.501	S	S	*	.	H	α-helix	trans	-70.6	-37.1	176.1	-148.9	-88.9	0	0	0	112.3	R484 L486 T492	R484-F488 PolarHBondContact O-N 3.23Å; L486-F488 PolarHBondContact O-N 3.38Å; F488-T492 PolarHBondContact O-N 2.84Å
489	D	38	Very low	44.6	Very low	66 Å²	66	96.6 Å²	96.6	35%	0.353	53%	0.532	S	S	.	.	H	α-helix	trans	-73.7	-40	178.7	-81.7	-15	0	0	0	111.6	L485 L486 T492 A493	L485-D489 PolarHBondContact O-N 2.82Å; L486-D489 PolarHBondContact O-N 3.26Å; D489-T492 PolarHBondContact O-N 3.29Å; D489-T492 PolarHBondContact O-OG1 3.02Å; D489-A493 PolarHBondContact O-N 2.68Å; D489-A493 VanDerWaalsContact O-N 3.08Å
490	E	34.9	Very low	42.8	Very low	145 Å²	145	99.6 Å²	99.6	68%	0.678	56%	0.556	S	S	*	*	H	α-helix	trans	-65.3	-39.3	176	-74.7	-171.7	169.3	0	0	112.5	L486 T492 A493 D494	L486-E490 PolarHBondContact O-N 3.37Å; E490-T492 PolarHBondContact O-N 2.89Å; E490-A493 PolarHBondContact O-N 2.96Å; E490-D494 PolarHBondContact O-N 3.46Å
491	A	38.1	Very low	41.3	Very low	76 Å²	76	105.5 Å²	105.5	63%	0.628	58%	0.584	S	S	*	*	H	α-helix	trans	-63.6	-23.7	175.4	0	0	0	0	0	113	E487	E487-A491 WeakPolarHBondContact O-CB 3.31Å; E487-A491 PolarHBondContact O-N 3.15Å
492	T	42	Very low	39.7	Very low	86 Å²	86	106.6 Å²	106.6	53%	0.528	60%	0.6	S	S	.	*	H	α-helix	trans	-85.1	-27.5	172	60	0	0	0	0	113.3	F488 D489 E490	F488-T492 PolarHBondContact O-N 2.84Å; D489-T492 PolarHBondContact O-N 3.29Å; D489-T492 PolarHBondContact O-OG1 3.02Å; E490-T492 PolarHBondContact O-N 2.89Å
493	A	32.3	Very low	38.3	Very low	60 Å²	60	111.6 Å²	111.6	50%	0.496	63%	0.625	S	S	.	*	H	α-helix	trans	-74.6	-32	-178.5	0	0	0	0	0	113.4	D489 E490 A495 D496	D489-A493 PolarHBondContact O-N 2.68Å; D489-A493 VanDerWaalsContact O-N 3.08Å; E490-A493 PolarHBondContact O-N 2.96Å; A493-A495 PolarHBondContact O-N 3.42Å; A493-A495 VanDerWaalsContact O-N 3.12Å; A493-D496 PolarHBondContact O-N 3.27Å
494	D	31.5	Very low	37.5	Very low	132 Å²	132	115.6 Å²	115.6	71%	0.706	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-11.2	177.8	-96.7	-15.9	0	0	0	114	E490	E490-D494 PolarHBondContact O-N 3.46Å
495	A	40.7	Very low	36.3	Very low	77 Å²	77	118.5 Å²	118.5	64%	0.636	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-23.1	177	0	0	0	0	0	113.8	A493	A493-A495 PolarHBondContact O-N 3.42Å; A493-A495 VanDerWaalsContact O-N 3.12Å
496	D	31.2	Very low	35.1	Very low	149 Å²	149	119.9 Å²	119.9	80%	0.797	66%	0.664	S	S	*	*			trans	-125.9	55.8	-172.8	-80.6	-30.2	0	0	0	112	A493 S498	A493-D496 PolarHBondContact O-N 3.27Å; D496-S498 PolarHBondContact O-N 3.24Å
497	N	26.8	Very low	34.4	Very low	144 Å²	144	119.9 Å²	119.9	77%	0.77	67%	0.668	S	S	*	*			trans	-76.2	84.1	171.2	-106.6	-36.1	0	0	0	111.1
498	S	27.5	Very low	33.6	Very low	107 Å²	107	122.9 Å²	122.9	75%	0.748	68%	0.679	S	S	*	*			trans	-150.2	105.8	168.8	148.4	0	0	0	0	111.8	D496	D496-S498 PolarHBondContact O-N 3.24Å
499	S	29.3	Very low	33.2	Very low	110 Å²	110	120.4 Å²	120.4	77%	0.769	67%	0.669	S	S	*	*			trans	68.9	95.7	148	176	0	0	0	0	119.6
500	C	27.3	Very low	32.8	Very low	111 Å²	111	122.1 Å²	122.1	75%	0.75	69%	0.686	S	S	*	*				51.3	107.2	128.1	-156.4	0	0	0	0	119.8
501	E	32.2	Very low	32.4	Very low	173 Å²	173	120.9 Å²	120.9	81%	0.808	69%	0.688	S	S	*	*	S	Bend	trans	62.8	97.4	152	-59.9	-161.4	175.9	0	0	118.7
502	D	31.3	Very low	31.9	Very low	153 Å²	153	123.6 Å²	123.6	82%	0.818	70%	0.697	S	S	*	*				168	15.2	129.4	-94.7	-23	0	0	0	115.3	F504	D502-F504 PolarHBondContact O-N 3.25Å
503	D	32.6	Very low	31.3	Very low	155 Å²	155	124.6 Å²	124.6	83%	0.829	70%	0.703	S	S	*	*			trans	-89.7	76.1	-177.7	-64.7	-36.9	0	0	0	112.9	F505	D503-F505 VanDerWaalsContact C-N 3.34Å; D503-F505 PolarHBondContact O-N 2.83Å
504	F	41	Very low	31.4	Very low	127 Å²	127	126.9 Å²	126.9	56%	0.557	72%	0.716	S	S	*	*			trans	-54.3	105.6	147.5	175.3	-100.6	0	0	0	107	D502 D506 K644	D502-F504 PolarHBondContact O-N 3.25Å; F504-D506 PolarHBondContact O-N 3.47Å; F504-K644 HydrophobicContact CE1-CD 4.13Å; F504-K644 HydrophobicContact CE2-CD 4.41Å; F504-K644 HydrophobicContact CZ-CD 3.8Å
505	F	35.7	Very low	31.6	Very low	149 Å²	149	129.9 Å²	129.9	65%	0.654	72%	0.723	S	S	*	*			trans	-47.2	94.8	-177.4	-114.3	-106.8	0	0	0	111.6	D503 C507	D503-F505 VanDerWaalsContact C-N 3.34Å; D503-F505 PolarHBondContact O-N 2.83Å; F505-C507 PolarHBondContact O-N 3.15Å
506	D	32	Very low	31.6	Very low	143 Å²	143	132.5 Å²	132.5	77%	0.765	73%	0.726	S	S	*	*			trans	-72.2	67.7	166.7	-91.6	-12.8	0	0	0	108.5	F504 K508	F504-D506 PolarHBondContact O-N 3.47Å; D506-K508 PolarHBondContact O-N 3.45Å
507	C	31.1	Very low	32.5	Very low	58 Å²	58	133.8 Å²	133.8	39%	0.392	73%	0.732	S	S	.	*			trans	-63.5	106.6	170	-104.4	0	0	0	0	107.8	F505 E509	F505-C507 PolarHBondContact O-N 3.15Å; C507-E509 PolarHBondContact O-N 3.07Å
508	K	29.9	Very low	34	Very low	205 Å²	205	129.3 Å²	129.3	89%	0.891	72%	0.72	S	S	*	*			trans	-60.9	88.1	162.2	-67.8	179	-177.1	171.5	0	107.4	D506 S510	D506-K508 PolarHBondContact O-N 3.45Å; K508-S510 PolarHBondContact O-N 2.84Å
509	E	31.4	Very low	36.2	Very low	103 Å²	103	129.8 Å²	129.8	48%	0.481	71%	0.714	S	S	.	*			trans	-45.5	112.4	166.7	-78.9	176.8	173.7	0	0	107.1	C507 V511 R646	C507-E509 PolarHBondContact O-N 3.07Å; E509-V511 PolarHBondContact O-N 3.09Å; E509-R646 IonicContact OE2-CZ 3.51Å; E509-R646 IonicContact OE2-NH1 3.58Å; E509-R646 PolarHBondContact OE2-NH1 3.25Å
510	S	29.4	Very low	38.7	Very low	101 Å²	101	126.8 Å²	126.8	71%	0.706	69%	0.692	S	S	*	*			trans	-52.7	117.7	179.1	49.3	0	0	0	0	107.4	K508 T512	K508-S510 PolarHBondContact O-N 2.84Å; S510-T512 PolarHBondContact O-N 3.19Å
511	V	26.4	Very low	41.1	Very low	119 Å²	119	127.1 Å²	127.1	72%	0.721	68%	0.682	S	S	*	*			trans	-58.3	84.4	-177	-179.8	0	0	0	0	109.4	E509 T513	E509-V511 PolarHBondContact O-N 3.09Å; V511-T513 HydrophobicContact CG1-CG2 3.28Å; V511-T513 PolarHBondContact O-N 3.3Å; V511-T513 VanDerWaalsContact O-N 3.12Å
512	T	28.9	Very low	43.3	Very low	133 Å²	133	120.1 Å²	120.1	82%	0.816	66%	0.657	S	S	*	*			trans	-81	77	154.4	52	0	0	0	0	106.1	S510	S510-T512 PolarHBondContact O-N 3.19Å
513	T	27.8	Very low	45.8	Very low	107 Å²	107	116.4 Å²	116.4	66%	0.656	63%	0.632	S	S	*	*			trans	-48.2	143.1	165.8	36	0	0	0	0	110.9	V511	V511-T513 HydrophobicContact CG1-CG2 3.28Å; V511-T513 PolarHBondContact O-N 3.3Å; V511-T513 VanDerWaalsContact O-N 3.12Å
514	S	34.4	Very low	47.9	Very low	108 Å²	108	114.9 Å²	114.9	76%	0.755	62%	0.623	S	S	*	*			trans	90.3	94.9	169.6	75.5	0	0	0	0	116.4
515	K	36.8	Very low	50	Low	196 Å²	196	111.1 Å²	111.1	85%	0.852	62%	0.615	S	S	*	*	S	Bend	trans	-171.9	117.1	133.5	-96.7	155.6	-173.8	-172.5	0	108	D517	K515-D517 PolarHBondContact O-N 3.08Å
516	D	41.4	Very low	52.4	Low	132 Å²	132	108.7 Å²	108.7	71%	0.706	61%	0.608	S	S	*	*			trans	-7	102.7	173.6	-83.8	-40.2	0	0	0	116.6	G518 L519	D516-G518 PolarHBondContact O-N 3.02Å; D516-L519 HydrophobicContact CB-CD1 3.83Å; D516-L519 PolarHBondContact O-N 3.13Å
517	D	50	Low	54.8	Low	175 Å²	175	102.2 Å²	102.2	94%	0.936	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	26.2	177.6	-73.2	-38.1	0	0	0	115	K515	K515-D517 PolarHBondContact O-N 3.08Å
518	G	57.1	Low	57.2	Low	50 Å²	50	108.3 Å²	108.3	52%	0.515	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-144.5	-4.1	-176.1	0	0	0	0	0	116.2	D516	D516-G518 PolarHBondContact O-N 3.02Å
519	L	74.5	Confident	59.7	Low	118 Å²	118	102 Å²	102	62%	0.618	59%	0.59	S	S	*	*	S	Bend	trans	-82.8	126.3	176.3	-86.7	148.3	0	0	0	109.8	D516	D516-L519 HydrophobicContact CB-CD1 3.83Å; D516-L519 PolarHBondContact O-N 3.13Å
520	P	82.2	Confident	62.3	Low	47 Å²	47	99.1 Å²	99.1	31%	0.305	58%	0.578	S	S	.	*			trans	-73.4	135.1	-177.4	28.1	-34.1	0	0	0	112.2	R523 A593 P596	P520-R523 VanDerWaalsContact CG-NH2 3.33Å; P520-A593 WeakPolarHBondContact CA-O 3.39Å; P520-P596 HydrophobicContact CB-CG 3.93Å
521	E	77.8	Confident	65.1	Low	117 Å²	117	99.1 Å²	99.1	55%	0.547	57%	0.565	S	S	.	*			trans	-129.9	156.4	179.9	-68.6	-170.3	168.9	0	0	112	A593 A594 A649	E521-A593 PolarHBondContact N-O 3.08Å; E521-A593 CarbonylContact O-C 3.29Å; E521-A593 VanDerWaalsContact O-C 3.27Å; E521-A594 WeakPolarHBondContact O-CA 3.42Å; E521-A594 PolarHBondContact O-N 2.66Å; E521-A594 VanDerWaalsContact O-N 3.16Å; E521-A649 HydrophobicContact CB-CB 4.25Å
522	G	77.3	Confident	68.1	Low	27 Å²	27	93.6 Å²	93.6	28%	0.278	53%	0.531	S	S	.	.			trans	72.7	29	173.8	0	0	0	0	0	115.7	P543 I544	G522-P543 CarbonylContact O-C 3.4Å; G522-P543 VanDerWaalsContact O-CA 3.24Å; G522-P543 WeakPolarHBondContact O-CA 3.1Å; G522-I544 PolarHBondContact O-N 2.89Å
523	R	85.3	Confident	70.9	Confident	75 Å²	75	89 Å²	89	28%	0.283	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.9	177.2	-67.2	173.6	168.7	178.5	-1.7	111.5	P520 E538 Y541 A594	P520-R523 VanDerWaalsContact CG-NH2 3.33Å; R523-E538 IonicContact NH2-OE1 3.73Å; R523-Y541 HydrophobicContact CB-CD1 4.12Å; R523-Y541 HydrophobicContact CB-CG 4.48Å; R523-Y541 HydrophobicContact CG-CD1 3.98Å; R523-Y541 HydrophobicContact CG-CG 3.91Å; R523-Y541 VanDerWaalsContact CZ-CD2 3.43Å; R523-A594 HydrophobicContact CG-CB 3.93Å; R523-A594 PolarHBondContact NE-O 2.77Å; R523-A594 PolarHBondContact NH2-O 3.27Å
524	L	75.6	Confident	73.6	Confident	122 Å²	122	91.4 Å²	91.4	64%	0.639	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	-54.9	172.4	179.8	65.7	0	0	0	111.1	T542 I544	L524-T542 WeakPolarHBondContact CB-O 3.45Å; L524-T542 PolarHBondContact N-O 3.44Å; L524-I544 HydrophobicContact CB-CG1 3.82Å; L524-I544 HydrophobicContact CD1-CG1 4.28Å
525	A	84.3	Confident	76	Confident	49 Å²	49	89.3 Å²	89.3	41%	0.405	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	163.3	-176.2	0	0	0	0	0	111.6	Y541 T542	A525-Y541 CarbonylContact O-C 3.5Å; A525-Y541 WeakPolarHBondContact O-CA 3.47Å; A525-T542 PolarHBondContact N-O 3.22Å; A525-T542 PolarHBondContact O-N 3.24Å
526	I	86.2	Confident	78	Confident	97 Å²	97	87.3 Å²	87.3	50%	0.497	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	133.1	169.8	-64.6	166.4	0	0	0	108.1	E528 P539 Y541	I526-E528 PolarHBondContact O-N 2.62Å; I526-P539 HydrophobicContact CG2-CB 4.2Å; I526-Y541 HydrophobicContact CB-CE1 4.46Å; I526-Y541 HydrophobicContact CD1-CE1 4.22Å; I526-Y541 HydrophobicContact CG1-CD1 3.82Å; I526-Y541 HydrophobicContact CG1-CE1 3.33Å
527	A	84.2	Confident	79.9	Confident	7 Å²	7	88.1 Å²	88.1	6%	0.058	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	105.9	172.7	0	0	0	0	0	109.2	G529 L530 L540 L606	A527-G529 PolarHBondContact O-N 2.86Å; A527-L530 HydrophobicContact CB-CB 4.24Å; A527-L530 HydrophobicContact CB-CD1 4.12Å; A527-L530 PolarHBondContact O-N 2.92Å; A527-L530 VanDerWaalsContact O-N 3.16Å; A527-L540 HydrophobicContact CB-CB 4.35Å; A527-L540 WeakPolarHBondContact CB-O 3.34Å; A527-L540 PolarHBondContact N-O 3.18Å; A527-L606 HydrophobicContact CB-CD2 3.88Å
528	E	80.4	Confident	81.7	Confident	187 Å²	187	82.6 Å²	82.6	87%	0.874	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.9	126.4	-172.6	-67.2	-173.1	167.8	0	0	112.4	I526 L530	I526-E528 PolarHBondContact O-N 2.62Å; E528-L530 VanDerWaalsContact C-N 3.27Å; E528-L530 PolarHBondContact O-N 2.85Å
529	G	81.7	Confident	83.2	Confident	72 Å²	72	81.8 Å²	81.8	74%	0.742	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	76.2	3.3	177.1	0	0	0	0	0	115.8	A527	A527-G529 PolarHBondContact O-N 2.86Å
530	L	86.6	Confident	84	Confident	43 Å²	43	76.2 Å²	76.2	23%	0.225	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.1	-179.9	-60.8	176	0	0	0	111.2	A527 E528 L540 L606	A527-L530 HydrophobicContact CB-CB 4.24Å; A527-L530 HydrophobicContact CB-CD1 4.12Å; A527-L530 PolarHBondContact O-N 2.92Å; A527-L530 VanDerWaalsContact O-N 3.16Å; E528-L530 VanDerWaalsContact C-N 3.27Å; E528-L530 PolarHBondContact O-N 2.85Å; L530-L540 HydrophobicContact CB-CB 4Å; L530-L540 HydrophobicContact CB-CD2 4.24Å; L530-L540 HydrophobicContact CD1-CD2 4.42Å; L530-L540 PolarHBondContact O-N 2.85Å; L530-L606 HydrophobicContact CD1-CD2 3.59Å
531	F	89.1	Confident	84.5	Confident	100 Å²	100	76.2 Å²	76.2	44%	0.439	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	153.5	172.9	-64	-93.2	0	0	0	109	E536 E538 P539 R605	F531-E536 VanDerWaalsContact CD1-O 3.24Å; F531-E536 WeakPolarHBondContact CD1-O 3.34Å; F531-E536 WeakPolarHBondContact CG-O 3.34Å; F531-E538 WeakPolarHBondContact CA-O 3.24Å; F531-P539 HydrophobicContact CD1-CB 4.29Å; F531-P539 HydrophobicContact CE1-CB 4.23Å; F531-R605 PolarHBondContact O-NH1 3.49Å
532	Q	89.7	Confident	85	Confident	3 Å²	3	72.5 Å²	72.5	1%	0.014	39%	0.389	C	S	.	.			trans	-60.6	139.8	176.6	-64.1	-171.6	0.8	0	0	110.6	N535 E536 E538 L540 P596	Q532-N535 CarbonylContact O-C 3.44Å; Q532-N535 PolarHBondContact O-N 3.08Å; Q532-E536 PolarHBondContact O-N 3.29Å; Q532-E538 HydrophobicContact CG-CB 4.43Å; Q532-E538 PolarHBondContact N-O 3.26Å; Q532-L540 HydrophobicContact CG-CD1 3.96Å; Q532-P596 PolarHBondContact NE2-O 2.97Å
533	L	86.3	Confident	85.5	Confident	38 Å²	38	71.3 Å²	71.3	20%	0.199	38%	0.376	C	S	.	.	S	Bend	trans	-70.5	-33.6	-174.6	-72.5	176.7	0	0	0	113.5	Q601 D602 Y625	L533-Q601 HydrophobicContact CD1-CB 3.56Å; L533-Q601 HydrophobicContact CD1-CG 4.49Å; L533-D602 WeakPolarHBondContact CG-OD1 3.06Å; L533-D602 PolarHBondContact N-OD1 3.45Å; L533-D602 PolarHBondContact N-OD2 2.94Å; L533-Y625 HydrophobicContact CD1-CD2 4.13Å; L533-Y625 HydrophobicContact CD1-CG 4Å; L533-Y625 HydrophobicContact CD2-CD1 4.21Å; L533-Y625 HydrophobicContact CD2-CD2 3.26Å; L533-Y625 HydrophobicContact CD2-CE1 4.17Å; L533-Y625 HydrophobicContact CD2-CE2 3.2Å; L533-Y625 HydrophobicContact CD2-CG 3.77Å; L533-Y625 HydrophobicContact CG-CD2 4.29Å
534	E	84.2	Confident	85.1	Confident	156 Å²	156	71.8 Å²	71.8	73%	0.729	38%	0.383	S	S	*	.	S	Bend	trans	-86.2	-19.1	179.1	-62.7	-171.2	-178.9	0	0	112.4
535	N	84.7	Confident	85.4	Confident	64 Å²	64	69.2 Å²	69.2	34%	0.342	37%	0.366	S	S	.	.			trans	-137.4	83.7	177.6	-173.3	8.9	0	0	0	110.7	Q532 N537 E538	Q532-N535 CarbonylContact O-C 3.44Å; Q532-N535 PolarHBondContact O-N 3.08Å; N535-N537 PolarHBondContact O-N 3.19Å; N535-E538 HydrophobicContact CB-CB 4.34Å; N535-E538 PolarHBondContact ND2-OE2 2.89Å; N535-E538 VanDerWaalsContact ND2-OE2 3.14Å; N535-E538 PolarHBondContact O-N 3.41Å
536	E	79.6	Confident	84.6	Confident	154 Å²	154	68.2 Å²	68.2	72%	0.72	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-12.5	-176.5	-64	-177.3	174.1	0	0	114.2	F531 Q532	F531-E536 VanDerWaalsContact CD1-O 3.24Å; F531-E536 WeakPolarHBondContact CD1-O 3.34Å; F531-E536 WeakPolarHBondContact CG-O 3.34Å; Q532-E536 PolarHBondContact O-N 3.29Å
537	N	82.2	Confident	83.5	Confident	150 Å²	150	71 Å²	71	80%	0.802	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-13.3	175.2	-64.2	-44	0	0	0	113.1	N535	N535-N537 PolarHBondContact O-N 3.19Å
538	E	87.1	Confident	82.4	Confident	58 Å²	58	74 Å²	74	27%	0.271	38%	0.381	S	S	.	.	S	Bend	trans	-101.8	116.9	-176.6	-168.8	156.6	-172.5	0	0	110.4	R523 F531 Q532 N535	R523-E538 IonicContact NH2-OE1 3.73Å; F531-E538 WeakPolarHBondContact CA-O 3.24Å; Q532-E538 HydrophobicContact CG-CB 4.43Å; Q532-E538 PolarHBondContact N-O 3.26Å; N535-E538 HydrophobicContact CB-CB 4.34Å; N535-E538 PolarHBondContact ND2-OE2 2.89Å; N535-E538 VanDerWaalsContact ND2-OE2 3.14Å; N535-E538 PolarHBondContact O-N 3.41Å
539	P	89.5	Confident	81	Confident	34 Å²	34	68.8 Å²	68.8	22%	0.221	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	145.3	178.6	27.3	-32	0	0	0	110	I526 F531 Y541	I526-P539 HydrophobicContact CG2-CB 4.2Å; F531-P539 HydrophobicContact CD1-CB 4.29Å; F531-P539 HydrophobicContact CE1-CB 4.23Å; P539-Y541 HydrophobicContact CB-CE2 4.49Å; P539-Y541 HydrophobicContact CG-CE2 3.81Å; P539-Y541 VanDerWaalsContact O-CD2 3.27Å; P539-Y541 WeakPolarHBondContact O-CD2 3.35Å; P539-Y541 WeakPolarHBondContact O-CE2 3.26Å
540	L	90.9	Very high	79.3	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	137.4	173.8	-161.2	70.6	0	0	0	109.4	A527 L530 Q532 F591 N595 D602 L606	A527-L540 HydrophobicContact CB-CB 4.35Å; A527-L540 WeakPolarHBondContact CB-O 3.34Å; A527-L540 PolarHBondContact N-O 3.18Å; L530-L540 HydrophobicContact CB-CB 4Å; L530-L540 HydrophobicContact CB-CD2 4.24Å; L530-L540 HydrophobicContact CD1-CD2 4.42Å; L530-L540 PolarHBondContact O-N 2.85Å; Q532-L540 HydrophobicContact CG-CD1 3.96Å; L540-F591 HydrophobicContact CD1-CE2 4.37Å; L540-F591 HydrophobicContact CD1-CZ 3.86Å; L540-F591 HydrophobicContact CD2-CE2 4.44Å; L540-F591 HydrophobicContact CD2-CZ 4.36Å; L540-F591 HydrophobicContact CG-CE2 4.49Å; L540-F591 HydrophobicContact CG-CZ 4.41Å; L540-N595 HydrophobicContact CD1-CB 4.29Å; L540-D602 HydrophobicContact CD1-CB 4.01Å; L540-L606 HydrophobicContact CD2-CD1 4.09Å; L540-L606 HydrophobicContact CD2-CD2 4.17Å; L540-L606 HydrophobicContact CD2-CG 3.87Å
541	Y	91.2	Very high	77.3	Confident	47 Å²	47	72.3 Å²	72.3	18%	0.184	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	138.9	177.9	-70.3	-95	0	0	0	110.8	R523 A525 I526 P539 P543 N595	R523-Y541 HydrophobicContact CB-CD1 4.12Å; R523-Y541 HydrophobicContact CB-CG 4.48Å; R523-Y541 HydrophobicContact CG-CD1 3.98Å; R523-Y541 HydrophobicContact CG-CG 3.91Å; R523-Y541 VanDerWaalsContact CZ-CD2 3.43Å; A525-Y541 CarbonylContact O-C 3.5Å; A525-Y541 WeakPolarHBondContact O-CA 3.47Å; I526-Y541 HydrophobicContact CB-CE1 4.46Å; I526-Y541 HydrophobicContact CD1-CE1 4.22Å; I526-Y541 HydrophobicContact CG1-CD1 3.82Å; I526-Y541 HydrophobicContact CG1-CE1 3.33Å; P539-Y541 HydrophobicContact CB-CE2 4.49Å; P539-Y541 HydrophobicContact CG-CE2 3.81Å; P539-Y541 VanDerWaalsContact O-CD2 3.27Å; P539-Y541 WeakPolarHBondContact O-CD2 3.35Å; P539-Y541 WeakPolarHBondContact O-CE2 3.26Å; Y541-P543 WeakPolarHBondContact O-CD 3.36Å; Y541-N595 PolarHBondContact N-OD1 2.75Å; Y541-N595 PolarHBondContact O-ND2 3.2Å; Y541-N595 PolarHBondContact O-OD1 2.99Å
542	T	88.9	Confident	75	Confident	40 Å²	40	74.3 Å²	74.3	25%	0.245	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	120.5	165.2	-53	0	0	0	0	108	L524 A525 Y545	L524-T542 WeakPolarHBondContact CB-O 3.45Å; L524-T542 PolarHBondContact N-O 3.44Å; A525-T542 PolarHBondContact N-O 3.22Å; A525-T542 PolarHBondContact O-N 3.24Å; T542-Y545 HydrophobicContact CG2-CE2 4.38Å
543	P	87.3	Confident	72.7	Confident	1 Å²	1	76.2 Å²	76.2	1%	0.006	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	166.2	176.1	34	-39.8	0	0	0	112	G522 Y541 Y545 A590 F591 A594	G522-P543 CarbonylContact O-C 3.4Å; G522-P543 VanDerWaalsContact O-CA 3.24Å; G522-P543 WeakPolarHBondContact O-CA 3.1Å; Y541-P543 WeakPolarHBondContact O-CD 3.36Å; P543-Y545 HydrophobicContact CB-CE1 4.4Å; P543-Y545 WeakPolarHBondContact CD-OH 3.4Å; P543-Y545 HydrophobicContact CG-CD1 4.1Å; P543-Y545 HydrophobicContact CG-CE1 3.3Å; P543-Y545 HydrophobicContact CG-CE2 4.02Å; P543-Y545 WeakPolarHBondContact CG-OH 3.35Å; P543-A590 HydrophobicContact CB-CB 4.27Å; P543-A590 WeakPolarHBondContact CB-O 3.46Å; P543-F591 HydrophobicContact CG-CB 4.24Å; P543-F591 HydrophobicContact CG-CD2 4.36Å; P543-A594 HydrophobicContact CB-CB 3.62Å
544	I	76.8	Confident	70.3	Confident	85 Å²	85	82.7 Å²	82.7	44%	0.436	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-80.8	121.3	163.3	-59.7	170.9	0	0	0	107.1	G522 L524 A650	G522-I544 PolarHBondContact O-N 2.89Å; L524-I544 HydrophobicContact CB-CG1 3.82Å; L524-I544 HydrophobicContact CD1-CG1 4.28Å; I544-A650 WeakPolarHBondContact O-CB 3.49Å
545	Y	82.8	Confident	68	Low	68 Å²	68	79.1 Å²	79.1	27%	0.267	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-94.8	164.2	175.6	-57.3	-69.8	0	0	0	111.3	T542 P543 D587 A590 H607	T542-Y545 HydrophobicContact CG2-CE2 4.38Å; P543-Y545 HydrophobicContact CB-CE1 4.4Å; P543-Y545 WeakPolarHBondContact CD-OH 3.4Å; P543-Y545 HydrophobicContact CG-CD1 4.1Å; P543-Y545 HydrophobicContact CG-CE1 3.3Å; P543-Y545 HydrophobicContact CG-CE2 4.02Å; P543-Y545 WeakPolarHBondContact CG-OH 3.35Å; Y545-D587 HydrophobicContact CD1-CB 3.94Å; Y545-D587 VanDerWaalsContact CD1-OD1 3.27Å; Y545-D587 WeakPolarHBondContact CD1-OD1 3.49Å; Y545-D587 HydrophobicContact CE1-CB 3.93Å; Y545-A590 HydrophobicContact CD1-CB 4.24Å; Y545-H607 AromaticContact CE1-CE1 3.56Å; Y545-H607 AromaticContact CE1-NE2 3.8Å; Y545-H607 AromaticContact CZ-CE1 3.3Å; Y545-H607 AromaticContact CZ-NE2 3.51Å; Y545-H607 PolarHBondContact OH-CE1 2.81Å; Y545-H607 PolarHBondContact OH-NE2 2.81Å
546	Q	67.8	Low	65.4	Low	28 Å²	28	79.5 Å²	79.5	13%	0.131	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-69.7	146.7	165.7	-68.7	-165.7	7.9	0	0	110.8	T548 A650 R654 P655 L656	Q546-T548 PolarHBondContact O-N 2.79Å; Q546-A650 HydrophobicContact CG-CB 3.96Å; Q546-R654 PolarHBondContact NE2-O 3.15Å; Q546-R654 PolarHBondContact OE1-O 2.89Å; Q546-P655 VanDerWaalsContact OE1-CA 3.29Å; Q546-L656 HydrophobicContact CB-CD1 3.89Å; Q546-L656 VanDerWaalsContact OE1-CG 3.28Å
547	E	61.8	Low	63.1	Low	157 Å²	157	75.6 Å²	75.6	73%	0.734	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-71.8	128.3	175.9	-162.9	162.7	-159.5	0	0	109.4
548	T	62.7	Low	60.7	Low	70 Å²	70	77 Å²	77	43%	0.429	44%	0.44	S	S	.	.			trans	-111.9	134.7	-177.5	53.4	0	0	0	0	109.9	Q546 V583 L656	Q546-T548 PolarHBondContact O-N 2.79Å; T548-V583 HydrophobicContact CG2-CB 4.47Å; T548-V583 HydrophobicContact CG2-CG1 3.74Å; T548-V583 HydrophobicContact CG2-CG2 3.91Å; T548-L656 HydrophobicContact CG2-CD1 3.87Å
549	V	51.1	Low	58.1	Low	77 Å²	77	83 Å²	83	47%	0.467	47%	0.468	S	S	.	.			trans	-95.7	137.2	171.9	-160.7	0	0	0	0	107.6	F551 Y579 V657	V549-F551 PolarHBondContact O-N 3.4Å; V549-Y579 PolarHBondContact N-OH 3.09Å; V549-Y579 PolarHBondContact O-OH 3.46Å; V549-V657 HydrophobicContact CG2-CG2 4.13Å
550	P	44.8	Very low	55.6	Low	106 Å²	106	86.6 Å²	86.6	69%	0.688	49%	0.491	S	S	*	.			trans	-55.1	128.5	170.8	-22.6	32.3	0	0	0	109.8	I552	P550-I552 PolarHBondContact O-N 2.85Å; P550-I552 VanDerWaalsContact O-N 3.14Å
551	F	44.4	Very low	52.9	Low	82 Å²	82	96.4 Å²	96.4	36%	0.36	53%	0.534	S	S	.	.			trans	-64.2	114.2	176	179	-97.6	0	0	0	109.4	V549 A553 Q575 Y579	V549-F551 PolarHBondContact O-N 3.4Å; F551-A553 HydrophobicContact CE1-CB 4.07Å; F551-Q575 HydrophobicContact CE2-CB 4.47Å; F551-Q575 HydrophobicContact CE2-CG 3.97Å; F551-Q575 HydrophobicContact CZ-CB 4.19Å; F551-Q575 HydrophobicContact CZ-CG 4.15Å; F551-Y579 HydrophobicContact CB-CD1 4.19Å; F551-Y579 HydrophobicContact CB-CE1 4.46Å
552	I	40.7	Very low	50.3	Low	142 Å²	142	100.8 Å²	100.8	73%	0.728	56%	0.561	S	S	*	*			trans	-97.3	110	172.7	-57.7	175	0	0	0	106.4	P550 E554	P550-I552 PolarHBondContact O-N 2.85Å; P550-I552 VanDerWaalsContact O-N 3.14Å; I552-E554 PolarHBondContact O-N 3.22Å
553	A	41.3	Very low	48.1	Very low	44 Å²	44	108.7 Å²	108.7	36%	0.364	59%	0.592	S	S	.	*			trans	-63.9	121.1	169.1	0	0	0	0	0	108.1	F551 S555 D572	F551-A553 HydrophobicContact CE1-CB 4.07Å; A553-S555 PolarHBondContact O-N 2.75Å; A553-D572 HydrophobicContact CB-CB 4.46Å
554	E	36.7	Very low	45.8	Very low	173 Å²	173	118.5 Å²	118.5	81%	0.808	63%	0.628	S	S	*	*			trans	-71	60.8	174.3	-73.6	-165.4	139.2	0	0	110.8	I552	I552-E554 PolarHBondContact O-N 3.22Å
555	S	36.3	Very low	44.2	Very low	81 Å²	81	118.3 Å²	118.3	57%	0.566	64%	0.635	S	S	*	*			trans	-116.3	75.1	172.8	-79.8	0	0	0	0	108.4	A553 D572	A553-S555 PolarHBondContact O-N 2.75Å; S555-D572 PolarHBondContact OG-OD2 3.25Å; S555-D572 VanDerWaalsContact OG-OD2 3.1Å
556	G	29.7	Very low	42.1	Very low	72 Å²	72	121.7 Å²	121.7	74%	0.742	66%	0.656	S	S	*	*			trans	-169.7	1.3	178.5	0	0	0	0	0	117.2	E558	G556-E558 PolarHBondContact O-N 3.13Å; G556-E558 VanDerWaalsContact O-N 3.14Å
557	G	31.1	Very low	41.2	Very low	73 Å²	73	126.3 Å²	126.3	75%	0.753	68%	0.682	S	S	*	*	S	Bend	trans	-75.4	97.9	171	0	0	0	0	0	111.1	H559	G557-H559 PolarHBondContact O-N 3.13Å
558	E	32.4	Very low	40.4	Very low	179 Å²	179	121.7 Å²	121.7	84%	0.836	67%	0.665	S	S	*	*	S	Bend	trans	-0.5	79.7	159.2	-60.6	-179.4	159	0	0	117.6	G556	G556-E558 PolarHBondContact O-N 3.13Å; G556-E558 VanDerWaalsContact O-N 3.14Å
559	H	32	Very low	39.7	Very low	185 Å²	185	123.5 Å²	123.5	86%	0.856	67%	0.671	S	S	*	*			trans	-145.3	106.4	153.6	-79.2	-53.1	0	0	0	109.9	G557	G557-H559 PolarHBondContact O-N 3.13Å
560	P	37	Very low	39.9	Very low	109 Å²	109	122.9 Å²	122.9	71%	0.708	67%	0.674	S	S	*	*			trans	-79.7	139.4	-177.2	34.6	-33.1	0	0	0	109.9
561	F	34	Very low	40.5	Very low	206 Å²	206	124.6 Å²	124.6	90%	0.904	67%	0.673	S	S	*	*			trans	64.7	78.4	169.8	-57.9	-80.3	0	0	0	117
562	D	36.9	Very low	41	Very low	139 Å²	139	122.4 Å²	122.4	74%	0.743	67%	0.665	S	S	*	*			trans	-148.2	142.3	145.8	-133.3	-17.4	0	0	0	112.8	R564	D562-R564 PolarHBondContact O-N 3.37Å
563	K	41.9	Very low	41.9	Very low	206 Å²	206	119.1 Å²	119.1	90%	0.896	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	14.4	-168.3	-95.2	174.7	175.5	173.9	0	116.1	S565	K563-S565 VanDerWaalsContact C-N 3.34Å
564	R	39.3	Very low	43	Very low	207 Å²	207	120.4 Å²	120.4	78%	0.781	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-3.3	176.5	-75.3	-177.3	175.7	170.9	-0.7	114.4	D562 L566	D562-R564 PolarHBondContact O-N 3.37Å; R564-L566 VanDerWaalsContact C-N 3.3Å; R564-L566 PolarHBondContact O-N 2.7Å
565	S	44	Very low	43.9	Very low	81 Å²	81	116 Å²	116	57%	0.566	63%	0.629	S	S	*	*	H	α-helix	trans	-69.7	-15.9	-175.4	53.1	0	0	0	0	116	K563 T568	K563-S565 VanDerWaalsContact C-N 3.34Å; S565-T568 WeakPolarHBondContact CA-OG1 3.3Å; S565-T568 PolarHBondContact O-OG1 2.75Å; S565-T568 VanDerWaalsContact O-OG1 3.12Å
566	L	39	Very low	45	Very low	138 Å²	138	114.6 Å²	114.6	72%	0.723	62%	0.619	S	S	*	*	H	α-helix	trans	-81.4	-36.8	-178.7	-107.5	156.5	0	0	0	113	R564	R564-L566 VanDerWaalsContact C-N 3.3Å; R564-L566 PolarHBondContact O-N 2.7Å
567	D	47.3	Very low	46.7	Very low	126 Å²	126	116.8 Å²	116.8	67%	0.674	61%	0.608	S	S	*	*	H	α-helix	trans	-74.7	-37.5	178.8	-69.3	-23.2	0	0	0	111.2	L569 A570 E571	D567-L569 VanDerWaalsContact C-N 3.32Å; D567-L569 PolarHBondContact O-N 2.72Å; D567-A570 PolarHBondContact O-N 2.84Å; D567-E571 PolarHBondContact O-N 2.93Å; D567-E571 VanDerWaalsContact O-N 3.17Å
568	T	45.8	Very low	48.4	Very low	60 Å²	60	120.2 Å²	120.2	37%	0.368	60%	0.599	S	S	.	*	H	α-helix	trans	-62.4	-38	176.6	51.9	0	0	0	0	112.1	S565 A570 E571 D572	S565-T568 WeakPolarHBondContact CA-OG1 3.3Å; S565-T568 PolarHBondContact O-OG1 2.75Å; S565-T568 VanDerWaalsContact O-OG1 3.12Å; T568-A570 VanDerWaalsContact C-N 3.32Å; T568-A570 PolarHBondContact O-N 3.27Å; T568-E571 PolarHBondContact O-N 2.71Å; T568-D572 WeakPolarHBondContact O-CB 3.37Å; T568-D572 VanDerWaalsContact O-CG 3.24Å; T568-D572 PolarHBondContact O-N 3.16Å
569	L	47.6	Very low	50.1	Low	108 Å²	108	114 Å²	114	57%	0.565	57%	0.568	S	S	*	*	H	α-helix	trans	-66.1	-34.8	178.9	-158.8	82.1	0	0	0	112.2	D567 V573	D567-L569 VanDerWaalsContact C-N 3.32Å; D567-L569 PolarHBondContact O-N 2.72Å; L569-V573 VanDerWaalsContact O-CG2 3.23Å; L569-V573 WeakPolarHBondContact O-CG2 3.43Å; L569-V573 PolarHBondContact O-N 3.2Å; L569-V573 VanDerWaalsContact O-N 3.1Å
570	A	55.6	Low	51.9	Low	63 Å²	63	108.8 Å²	108.8	52%	0.521	55%	0.552	S	S	.	*	H	α-helix	trans	-71	-41.3	177.6	0	0	0	0	0	111.6	D567 T568 V573 E574	D567-A570 PolarHBondContact O-N 2.84Å; T568-A570 VanDerWaalsContact C-N 3.32Å; T568-A570 PolarHBondContact O-N 3.27Å; A570-V573 PolarHBondContact O-N 2.96Å; A570-E574 WeakPolarHBondContact O-CB 3.41Å; A570-E574 PolarHBondContact O-N 3.39Å
571	E	56.7	Low	53.7	Low	142 Å²	142	109.1 Å²	109.1	66%	0.664	54%	0.539	S	S	*	.	H	α-helix	trans	-62.4	-44	173.4	-71.1	-175.1	166.9	0	0	111.5	D567 T568 V573 E574 Q575	D567-E571 PolarHBondContact O-N 2.93Å; D567-E571 VanDerWaalsContact O-N 3.17Å; T568-E571 PolarHBondContact O-N 2.71Å; E571-V573 PolarHBondContact O-N 2.86Å; E571-E574 PolarHBondContact O-N 3.28Å; E571-Q575 VanDerWaalsContact O-CB 3.31Å; E571-Q575 WeakPolarHBondContact O-CB 3.45Å; E571-Q575 PolarHBondContact O-N 3.18Å
572	D	56	Low	55.7	Low	37 Å²	37	101.2 Å²	101.2	20%	0.198	51%	0.512	C	S	.	.	H	α-helix	trans	-61	-43.1	177.8	-75.6	-14.1	0	0	0	112.1	A553 S555 T568 S576	A553-D572 HydrophobicContact CB-CB 4.46Å; S555-D572 PolarHBondContact OG-OD2 3.25Å; S555-D572 VanDerWaalsContact OG-OD2 3.1Å; T568-D572 WeakPolarHBondContact O-CB 3.37Å; T568-D572 VanDerWaalsContact O-CG 3.24Å; T568-D572 PolarHBondContact O-N 3.16Å; D572-S576 VanDerWaalsContact O-CB 3.27Å; D572-S576 WeakPolarHBondContact O-CB 3.13Å; D572-S576 PolarHBondContact O-N 2.97Å
573	V	59.4	Low	57.6	Low	73 Å²	73	95.9 Å²	95.9	44%	0.442	48%	0.484	S	S	.	.	H	α-helix	trans	-65.9	-41.7	177.2	169.8	0	0	0	0	111.1	L569 A570 E571 K577	L569-V573 VanDerWaalsContact O-CG2 3.23Å; L569-V573 WeakPolarHBondContact O-CG2 3.43Å; L569-V573 PolarHBondContact O-N 3.2Å; L569-V573 VanDerWaalsContact O-N 3.1Å; A570-V573 PolarHBondContact O-N 2.96Å; E571-V573 PolarHBondContact O-N 2.86Å; V573-K577 HydrophobicContact CG1-CD 4.47Å; V573-K577 WeakPolarHBondContact O-CG 3.34Å; V573-K577 PolarHBondContact O-N 2.74Å
574	E	64	Low	59.8	Low	71 Å²	71	86.8 Å²	86.8	33%	0.332	45%	0.446	S	S	.	.	H	α-helix	trans	-68.5	-40.2	178.7	-174.4	54.5	-151.1	0	0	111.5	A570 E571 K577 R578	A570-E574 WeakPolarHBondContact O-CB 3.41Å; A570-E574 PolarHBondContact O-N 3.39Å; E571-E574 PolarHBondContact O-N 3.28Å; E574-K577 WeakPolarHBondContact O-CB 3.3Å; E574-K577 PolarHBondContact O-N 3.11Å; E574-R578 WeakPolarHBondContact O-CG 3.14Å; E574-R578 PolarHBondContact O-N 3.27Å; E574-R578 IonicContact OE1-NE 3.68Å; E574-R578 PolarHBondContact OE1-NE 2.89Å
575	Q	55.3	Low	62	Low	81 Å²	81	79.5 Å²	79.5	38%	0.379	42%	0.42	S	S	.	.	H	α-helix	trans	-65.6	-41.3	176.4	-165.9	67.5	-3.5	0	0	111.7	F551 E571 K577 R578 Y579	F551-Q575 HydrophobicContact CE2-CB 4.47Å; F551-Q575 HydrophobicContact CE2-CG 3.97Å; F551-Q575 HydrophobicContact CZ-CB 4.19Å; F551-Q575 HydrophobicContact CZ-CG 4.15Å; E571-Q575 VanDerWaalsContact O-CB 3.31Å; E571-Q575 WeakPolarHBondContact O-CB 3.45Å; E571-Q575 PolarHBondContact O-N 3.18Å; Q575-K577 VanDerWaalsContact C-N 3.35Å; Q575-K577 PolarHBondContact O-N 2.95Å; Q575-R578 PolarHBondContact O-N 3.18Å; Q575-Y579 PolarHBondContact O-N 3.26Å
576	S	59.9	Low	63.9	Low	51 Å²	51	75.9 Å²	75.9	36%	0.357	39%	0.394	S	S	.	.	H	α-helix	trans	-60	-42.7	173.3	-178.7	0	0	0	0	112	D572 Y579 S580	D572-S576 VanDerWaalsContact O-CB 3.27Å; D572-S576 WeakPolarHBondContact O-CB 3.13Å; D572-S576 PolarHBondContact O-N 2.97Å; S576-Y579 PolarHBondContact O-N 3.23Å; S576-S580 WeakPolarHBondContact O-CB 3.38Å; S576-S580 PolarHBondContact O-N 2.97Å
577	K	66	Low	66.3	Low	117 Å²	117	70.4 Å²	70.4	51%	0.509	37%	0.366	S	S	.	.	H	α-helix	trans	-62.9	-42.6	173.8	-74.1	173.4	-175.5	171.8	0	112	V573 E574 Q575 S580 R581	V573-K577 HydrophobicContact CG1-CD 4.47Å; V573-K577 WeakPolarHBondContact O-CG 3.34Å; V573-K577 PolarHBondContact O-N 2.74Å; E574-K577 WeakPolarHBondContact O-CB 3.3Å; E574-K577 PolarHBondContact O-N 3.11Å; Q575-K577 VanDerWaalsContact C-N 3.35Å; Q575-K577 PolarHBondContact O-N 2.95Å; K577-S580 PolarHBondContact O-N 3.3Å; K577-R581 WeakPolarHBondContact O-CB 3.24Å; K577-R581 WeakPolarHBondContact O-CD 3.27Å; K577-R581 WeakPolarHBondContact O-CG 3.26Å; K577-R581 PolarHBondContact O-N 3.48Å
578	R	67	Low	68.5	Low	146 Å²	146	64.4 Å²	64.4	55%	0.551	33%	0.333	S	S	*	.	H	α-helix	trans	-63.2	-45	177.5	-73.1	174.3	-178.1	-173.4	-3.2	111.8	E574 Q575 R581 A582	E574-R578 WeakPolarHBondContact O-CG 3.14Å; E574-R578 PolarHBondContact O-N 3.27Å; E574-R578 IonicContact OE1-NE 3.68Å; E574-R578 PolarHBondContact OE1-NE 2.89Å; Q575-R578 PolarHBondContact O-N 3.18Å; R578-R581 WeakPolarHBondContact O-CB 3.45Å; R578-R581 PolarHBondContact O-N 2.98Å; R578-A582 PolarHBondContact O-N 2.97Å
579	Y	66.8	Low	70.7	Confident	48 Å²	48	62.6 Å²	62.6	19%	0.188	32%	0.321	C	S	.	.	H	α-helix	trans	-62.2	-49.1	176.1	-178.4	-107.7	0	0	0	111.3	V549 F551 Q575 S576 R581 A582 V583	V549-Y579 PolarHBondContact N-OH 3.09Å; V549-Y579 PolarHBondContact O-OH 3.46Å; F551-Y579 HydrophobicContact CB-CD1 4.19Å; F551-Y579 HydrophobicContact CB-CE1 4.46Å; Q575-Y579 PolarHBondContact O-N 3.26Å; S576-Y579 PolarHBondContact O-N 3.23Å; Y579-R581 PolarHBondContact O-N 3.41Å; Y579-A582 WeakPolarHBondContact O-CB 3.33Å; Y579-A582 PolarHBondContact O-N 2.75Å; Y579-V583 HydrophobicContact CD1-CG2 4.15Å; Y579-V583 HydrophobicContact CE1-CG2 3.83Å; Y579-V583 HydrophobicContact CE2-CG2 4.2Å; Y579-V583 HydrophobicContact CG-CG2 4.5Å; Y579-V583 WeakPolarHBondContact O-CG2 3.44Å; Y579-V583 PolarHBondContact O-N 2.93Å
580	S	69.8	Low	72.6	Confident	76 Å²	76	57.5 Å²	57.5	53%	0.531	29%	0.294	S	S	.	.	H	α-helix	trans	-56.6	-37.8	176.7	-178.7	0	0	0	0	112.6	S576 K577 L584	S576-S580 WeakPolarHBondContact O-CB 3.38Å; S576-S580 PolarHBondContact O-N 2.97Å; K577-S580 PolarHBondContact O-N 3.3Å; S580-L584 WeakPolarHBondContact O-CB 3.29Å; S580-L584 PolarHBondContact O-N 3.35Å
581	R	74.6	Confident	74.5	Confident	116 Å²	116	54.5 Å²	54.5	44%	0.438	27%	0.27	S	S	.	.	H	α-helix	trans	-66.7	-41.9	174.3	-73.2	168.5	81.1	161.9	8	112.6	K577 R578 Y579 F585 L637	K577-R581 WeakPolarHBondContact O-CB 3.24Å; K577-R581 WeakPolarHBondContact O-CD 3.27Å; K577-R581 WeakPolarHBondContact O-CG 3.26Å; K577-R581 PolarHBondContact O-N 3.48Å; R578-R581 WeakPolarHBondContact O-CB 3.45Å; R578-R581 PolarHBondContact O-N 2.98Å; Y579-R581 PolarHBondContact O-N 3.41Å; R581-F585 WeakPolarHBondContact O-CB 3.31Å; R581-F585 PolarHBondContact O-N 2.96Å; R581-L637 HydrophobicContact CG-CD1 4.38Å; R581-L637 HydrophobicContact CG-CD2 3.63Å
582	A	76.1	Confident	76.3	Confident	40 Å²	40	49.5 Å²	49.5	33%	0.331	25%	0.246	S	C	.	.	H	α-helix	trans	-64.7	-46.7	178.8	0	0	0	0	0	111.5	R578 Y579 L584 F585 S586 L656	R578-A582 PolarHBondContact O-N 2.97Å; Y579-A582 WeakPolarHBondContact O-CB 3.33Å; Y579-A582 PolarHBondContact O-N 2.75Å; A582-L584 VanDerWaalsContact C-N 3.33Å; A582-L584 PolarHBondContact O-N 2.76Å; A582-F585 PolarHBondContact O-N 2.78Å; A582-F585 VanDerWaalsContact O-N 3.17Å; A582-S586 PolarHBondContact O-N 2.83Å; A582-L656 HydrophobicContact CB-CD2 3.77Å; A582-L656 WeakPolarHBondContact O-CD2 3.41Å
583	V	77.7	Confident	78	Confident	26 Å²	26	48.1 Å²	48.1	16%	0.158	24%	0.239	C	C	.	.	H	α-helix	trans	-55.2	-51	176.4	177	0	0	0	0	110.2	T548 Y579 F585 S586 D587 L656	T548-V583 HydrophobicContact CG2-CB 4.47Å; T548-V583 HydrophobicContact CG2-CG1 3.74Å; T548-V583 HydrophobicContact CG2-CG2 3.91Å; Y579-V583 HydrophobicContact CD1-CG2 4.15Å; Y579-V583 HydrophobicContact CE1-CG2 3.83Å; Y579-V583 HydrophobicContact CE2-CG2 4.2Å; Y579-V583 HydrophobicContact CG-CG2 4.5Å; Y579-V583 WeakPolarHBondContact O-CG2 3.44Å; Y579-V583 PolarHBondContact O-N 2.93Å; V583-F585 VanDerWaalsContact C-N 3.3Å; V583-F585 PolarHBondContact O-N 3.13Å; V583-S586 WeakPolarHBondContact O-CB 3.2Å; V583-S586 PolarHBondContact O-N 2.86Å; V583-D587 PolarHBondContact O-N 3.23Å; V583-L656 HydrophobicContact CB-CD1 4.3Å; V583-L656 HydrophobicContact CG1-CD1 4.39Å; V583-L656 HydrophobicContact CG2-CD1 4.09Å; V583-L656 HydrophobicContact CG2-CD2 4.41Å
584	L	86.9	Confident	79.5	Confident	16 Å²	16	44.6 Å²	44.6	8%	0.084	22%	0.218	C	C	.	.	H	α-helix	trans	-59.9	-40.6	-179.9	-177.9	64.2	0	0	0	112.4	S580 A582 D587 M588 F603 W638 L641	S580-L584 WeakPolarHBondContact O-CB 3.29Å; S580-L584 PolarHBondContact O-N 3.35Å; A582-L584 VanDerWaalsContact C-N 3.33Å; A582-L584 PolarHBondContact O-N 2.76Å; L584-D587 PolarHBondContact O-N 3.42Å; L584-M588 HydrophobicContact CD1-CE 3.79Å; L584-M588 HydrophobicContact CD2-CE 3.99Å; L584-M588 HydrophobicContact CG-CE 3.71Å; L584-M588 HydrophobicContact CG-SD 4.31Å; L584-M588 VanDerWaalsContact O-CG 3.22Å; L584-M588 WeakPolarHBondContact O-CG 3.26Å; L584-M588 PolarHBondContact O-N 3.45Å; L584-F603 HydrophobicContact CD1-CE1 4.15Å; L584-F603 HydrophobicContact CD1-CZ 4.02Å; L584-W638 HydrophobicContact CD1-CD2 4.05Å; L584-W638 HydrophobicContact CD1-CE3 3.92Å; L584-W638 HydrophobicContact CD1-CH2 3.75Å; L584-W638 HydrophobicContact CD1-CZ2 3.87Å; L584-W638 HydrophobicContact CD1-CZ3 3.78Å; L584-W638 HydrophobicContact CD2-CB 4.46Å; L584-W638 HydrophobicContact CD2-CD2 3.57Å; L584-W638 VanDerWaalsContact CD2-CE2 3.44Å; L584-W638 HydrophobicContact CD2-CE3 4.26Å; L584-W638 HydrophobicContact CD2-CG 3.65Å; L584-W638 HydrophobicContact CD2-CZ2 4.03Å; L584-W638 HydrophobicContact CG-CD2 4.43Å; L584-L641 HydrophobicContact CD2-CD1 3.9Å; L584-L641 HydrophobicContact CG-CD1 4.36Å
585	F	87.6	Confident	80.9	Confident	54 Å²	54	41.2 Å²	41.2	24%	0.237	20%	0.202	C	C	.	.	H	α-helix	trans	-65.6	-43.9	178.3	-174.1	-105.2	0	0	0	112.2	R581 A582 V583 D587 M588 Q589 L641 K644 A645	R581-F585 WeakPolarHBondContact O-CB 3.31Å; R581-F585 PolarHBondContact O-N 2.96Å; A582-F585 PolarHBondContact O-N 2.78Å; A582-F585 VanDerWaalsContact O-N 3.17Å; V583-F585 VanDerWaalsContact C-N 3.3Å; V583-F585 PolarHBondContact O-N 3.13Å; F585-D587 VanDerWaalsContact C-N 3.34Å; F585-D587 PolarHBondContact O-N 2.94Å; F585-M588 PolarHBondContact O-N 2.77Å; F585-Q589 HydrophobicContact CD1-CG 4.46Å; F585-Q589 HydrophobicContact CE1-CG 4.2Å; F585-Q589 VanDerWaalsContact CE1-NE2 3.28Å; F585-Q589 HydrophobicContact CZ-CG 4.43Å; F585-Q589 WeakPolarHBondContact O-CG 3.19Å; F585-Q589 PolarHBondContact O-N 2.77Å; F585-L641 HydrophobicContact CB-CD2 4.33Å; F585-L641 HydrophobicContact CD2-CB 4.21Å; F585-L641 HydrophobicContact CD2-CD2 3.82Å; F585-L641 HydrophobicContact CG-CD2 4.41Å; F585-K644 HydrophobicContact CE2-CB 3.96Å; F585-A645 HydrophobicContact CD2-CB 4.3Å; F585-A645 HydrophobicContact CE2-CB 3.97Å
586	S	82.7	Confident	82.6	Confident	4 Å²	4	39 Å²	39	3%	0.028	19%	0.194	C	C	.	.	H	α-helix	trans	-56.7	-47	172.8	153.6	0	0	0	0	111.5	A582 V583 M588 Q589 A590 Q653	A582-S586 PolarHBondContact O-N 2.83Å; V583-S586 WeakPolarHBondContact O-CB 3.2Å; V583-S586 PolarHBondContact O-N 2.86Å; S586-M588 VanDerWaalsContact C-N 3.33Å; S586-M588 PolarHBondContact O-N 3.18Å; S586-Q589 PolarHBondContact O-N 3.44Å; S586-A590 PolarHBondContact O-N 2.82Å; S586-Q653 PolarHBondContact O-NE2 3.18Å; S586-Q653 PolarHBondContact O-OE1 2.69Å; S586-Q653 PolarHBondContact OG-OE1 2.99Å
587	D	89.5	Confident	83.9	Confident	23 Å²	23	39.5 Å²	39.5	12%	0.123	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-41.2	179.2	-70.9	-4.4	0	0	0	111.9	Y545 V583 L584 F585 A590 F591 F603	Y545-D587 HydrophobicContact CD1-CB 3.94Å; Y545-D587 VanDerWaalsContact CD1-OD1 3.27Å; Y545-D587 WeakPolarHBondContact CD1-OD1 3.49Å; Y545-D587 HydrophobicContact CE1-CB 3.93Å; V583-D587 PolarHBondContact O-N 3.23Å; L584-D587 PolarHBondContact O-N 3.42Å; F585-D587 VanDerWaalsContact C-N 3.34Å; F585-D587 PolarHBondContact O-N 2.94Å; D587-A590 PolarHBondContact O-N 2.87Å; D587-F591 VanDerWaalsContact O-CB 3.26Å; D587-F591 WeakPolarHBondContact O-CB 3.47Å; D587-F591 PolarHBondContact O-N 2.78Å; D587-F603 HydrophobicContact CB-CE2 4.45Å
588	M	93.9	Very high	85.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-40.8	176.2	-71	174.6	173.7	0	0	112.3	L584 F585 S586 K592 F600 F603 W638 L641 W642 A645	L584-M588 HydrophobicContact CD1-CE 3.79Å; L584-M588 HydrophobicContact CD2-CE 3.99Å; L584-M588 HydrophobicContact CG-CE 3.71Å; L584-M588 HydrophobicContact CG-SD 4.31Å; L584-M588 VanDerWaalsContact O-CG 3.22Å; L584-M588 WeakPolarHBondContact O-CG 3.26Å; L584-M588 PolarHBondContact O-N 3.45Å; F585-M588 PolarHBondContact O-N 2.77Å; S586-M588 VanDerWaalsContact C-N 3.33Å; S586-M588 PolarHBondContact O-N 3.18Å; M588-K592 WeakPolarHBondContact O-CG 3.33Å; M588-K592 PolarHBondContact O-N 2.97Å; M588-F600 HydrophobicContact CE-CE2 4.22Å; M588-F603 HydrophobicContact CB-CE2 4.49Å; M588-F603 HydrophobicContact CE-CD1 4.24Å; M588-F603 HydrophobicContact CE-CE1 3.61Å; M588-F603 HydrophobicContact CE-CZ 4.15Å; M588-F603 HydrophobicContact CG-CD1 4.4Å; M588-F603 HydrophobicContact CG-CD2 4.44Å; M588-F603 HydrophobicContact CG-CE1 3.83Å; M588-F603 HydrophobicContact CG-CE2 3.86Å; M588-F603 HydrophobicContact CG-CZ 3.53Å; M588-W638 HydrophobicContact CE-CB 4.14Å; M588-W638 HydrophobicContact CE-CD2 4.43Å; M588-W638 HydrophobicContact CE-CE3 4.13Å; M588-W638 HydrophobicContact CE-CG 4.49Å; M588-W638 VanDerWaalsContact CE-O 3.25Å; M588-W638 WeakPolarHBondContact CE-O 3.38Å; M588-L641 HydrophobicContact CE-CB 4.43Å; M588-L641 HydrophobicContact SD-CB 3.73Å; M588-W642 HydrophobicContact CB-CE3 4.02Å; M588-W642 HydrophobicContact CB-CZ3 4.43Å; M588-W642 HydrophobicContact CE-CB 4.23Å; M588-W642 HydrophobicContact CG-CE3 3.89Å; M588-W642 VanDerWaalsContact SD-CA 3.53Å; M588-W642 HydrophobicContact SD-CB 3.89Å; M588-W642 HydrophobicContact SD-CE3 4.37Å; M588-W642 PolarHBondContact SD-N 2.92Å; M588-A645 HydrophobicContact CB-CB 3.79Å
589	Q	91.4	Very high	86.4	Confident	23 Å²	23	28.5 Å²	28.5	11%	0.107	17%	0.168	C	C	.	.	H	α-helix	trans	-63.5	-45.8	175.7	-71.7	-175.9	-36.8	0	0	111.3	F585 S586 F591 K592 A593 A645 R646 I648 Q653	F585-Q589 HydrophobicContact CD1-CG 4.46Å; F585-Q589 HydrophobicContact CE1-CG 4.2Å; F585-Q589 VanDerWaalsContact CE1-NE2 3.28Å; F585-Q589 HydrophobicContact CZ-CG 4.43Å; F585-Q589 WeakPolarHBondContact O-CG 3.19Å; F585-Q589 PolarHBondContact O-N 2.77Å; S586-Q589 PolarHBondContact O-N 3.44Å; Q589-F591 VanDerWaalsContact C-N 3.33Å; Q589-F591 PolarHBondContact O-N 2.81Å; Q589-K592 PolarHBondContact O-N 2.86Å; Q589-A593 PolarHBondContact O-N 2.86Å; Q589-A645 HydrophobicContact CG-CB 3.88Å; Q589-R646 VanDerWaalsContact CA-O 3.27Å; Q589-R646 WeakPolarHBondContact CA-O 3.39Å; Q589-R646 WeakPolarHBondContact CB-O 3.21Å; Q589-R646 WeakPolarHBondContact CG-O 3.17Å; Q589-I648 CarbonylContact C-O 3.57Å; Q589-I648 HydrophobicContact CB-CB 4.37Å; Q589-I648 PolarHBondContact O-N 3.03Å; Q589-I648 VanDerWaalsContact O-O 3.08Å; Q589-Q653 VanDerWaalsContact CB-NE2 3.28Å
590	A	88.2	Confident	87.7	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-64.2	-41.1	-179.7	0	0	0	0	0	110.9	P543 Y545 S586 D587 A593 A594 I648 A650	P543-A590 HydrophobicContact CB-CB 4.27Å; P543-A590 WeakPolarHBondContact CB-O 3.46Å; Y545-A590 HydrophobicContact CD1-CB 4.24Å; S586-A590 PolarHBondContact O-N 2.82Å; D587-A590 PolarHBondContact O-N 2.87Å; A590-A593 PolarHBondContact O-N 2.85Å; A590-A594 PolarHBondContact O-N 3.17Å; A590-A594 VanDerWaalsContact O-N 3.08Å; A590-I648 WeakPolarHBondContact CA-O 3.4Å; A590-I648 PolarHBondContact N-O 3.06Å; A590-A650 HydrophobicContact CB-CB 4.47Å
591	F	94.7	Very high	88.8	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.9	-44.6	177	-177.7	-88.9	0	0	0	112.4	L540 P543 D587 Q589 A593 A594 N595 S598 D602 F603 L606 W642	L540-F591 HydrophobicContact CD1-CE2 4.37Å; L540-F591 HydrophobicContact CD1-CZ 3.86Å; L540-F591 HydrophobicContact CD2-CE2 4.44Å; L540-F591 HydrophobicContact CD2-CZ 4.36Å; L540-F591 HydrophobicContact CG-CE2 4.49Å; L540-F591 HydrophobicContact CG-CZ 4.41Å; P543-F591 HydrophobicContact CG-CB 4.24Å; P543-F591 HydrophobicContact CG-CD2 4.36Å; D587-F591 VanDerWaalsContact O-CB 3.26Å; D587-F591 WeakPolarHBondContact O-CB 3.47Å; D587-F591 PolarHBondContact O-N 2.78Å; Q589-F591 VanDerWaalsContact C-N 3.33Å; Q589-F591 PolarHBondContact O-N 2.81Å; F591-A593 VanDerWaalsContact C-N 3.3Å; F591-A593 PolarHBondContact O-N 3.41Å; F591-A594 PolarHBondContact O-N 3.26Å; F591-N595 HydrophobicContact CE1-CB 4.31Å; F591-N595 WeakPolarHBondContact CE2-ND2 3.43Å; F591-N595 HydrophobicContact CZ-CB 4.46Å; F591-N595 WeakPolarHBondContact O-CB 3.22Å; F591-N595 PolarHBondContact O-N 2.81Å; F591-N595 PolarHBondContact O-ND2 2.99Å; F591-S598 VanDerWaalsContact CE1-OG 3.3Å; F591-S598 WeakPolarHBondContact CE1-OG 3.35Å; F591-D602 HydrophobicContact CE1-CB 4.43Å; F591-D602 HydrophobicContact CZ-CB 4.11Å; F591-F603 HydrophobicContact CB-CD2 3.73Å; F591-F603 HydrophobicContact CB-CE2 4.07Å; F591-F603 HydrophobicContact CD1-CB 3.94Å; F591-F603 AromaticContact CD1-CD2 3.81Å; F591-F603 HydrophobicContact CD1-CD2 3.81Å; F591-F603 HydrophobicContact CD1-CG 4.37Å; F591-F603 AromaticContact CD2-CD2 3.93Å; F591-F603 HydrophobicContact CD2-CD2 3.93Å; F591-F603 HydrophobicContact CE1-CB 3.72Å; F591-F603 HydrophobicContact CE1-CD2 4.36Å; F591-F603 HydrophobicContact CE2-CD2 4.48Å; F591-F603 HydrophobicContact CG-CB 4.44Å; F591-F603 AromaticContact CG-CD2 3.55Å; F591-F603 HydrophobicContact CG-CD2 3.55Å; F591-F603 HydrophobicContact CG-CE2 4.34Å; F591-F603 HydrophobicContact CG-CG 4.48Å; F591-F603 VanDerWaalsContact CZ-CA 3.43Å; F591-F603 HydrophobicContact CZ-CB 4.06Å; F591-L606 HydrophobicContact CD2-CD1 4.12Å; F591-L606 HydrophobicContact CE2-CD1 3.57Å; F591-L606 HydrophobicContact CE2-CG 4.24Å; F591-W642 AromaticContact CD1-CH2 3.66Å; F591-W642 HydrophobicContact CD1-CH2 3.66Å; F591-W642 AromaticContact CD1-CZ3 3.79Å; F591-W642 HydrophobicContact CD1-CZ3 3.79Å; F591-W642 AromaticContact CE1-CH2 3.87Å; F591-W642 HydrophobicContact CE1-CH2 3.87Å; F591-W642 HydrophobicContact CE1-CZ3 4.31Å
592	K	95.3	Very high	89.6	Confident	37 Å²	37	20 Å²	20	16%	0.161	13%	0.127	C	C	.	.	H	α-helix	trans	-63.3	-35.2	176.3	-77.2	-172.9	179.6	-173.2	0	112.6	M588 Q589 N595 W642 A645 P647	M588-K592 WeakPolarHBondContact O-CG 3.33Å; M588-K592 PolarHBondContact O-N 2.97Å; Q589-K592 PolarHBondContact O-N 2.86Å; K592-N595 CarbonylContact O-C 3.59Å; K592-W642 HydrophobicContact CD-CH2 4.33Å; K592-W642 HydrophobicContact CD-CZ2 4.42Å; K592-W642 VanDerWaalsContact CE-CE2 3.42Å; K592-W642 VanDerWaalsContact CE-CZ2 3.49Å; K592-W642 WeakPolarHBondContact CE-O 3.09Å; K592-W642 HydrophobicContact CG-CH2 3.6Å; K592-W642 HydrophobicContact CG-CZ2 4.09Å; K592-W642 HydrophobicContact CG-CZ3 3.88Å; K592-W642 PolarHBondContact NZ-O 2.9Å; K592-A645 HydrophobicContact CD-CB 4.46Å; K592-A645 VanDerWaalsContact CD-O 3.32Å; K592-A645 WeakPolarHBondContact CD-O 3.24Å; K592-A645 WeakPolarHBondContact CE-O 3.4Å; K592-A645 PolarHBondContact NZ-O 2.92Å; K592-P647 HydrophobicContact CB-CB 3.91Å
593	A	91	Very high	90.5	Very high	7 Å²	7	18.1 Å²	18.1	6%	0.058	11%	0.111	C	C	.	.	H	α-helix	trans	-66.9	-41.3	175.7	0	0	0	0	0	112.6	P520 E521 Q589 A590 F591 I648 A649	P520-A593 WeakPolarHBondContact CA-O 3.39Å; E521-A593 PolarHBondContact N-O 3.08Å; E521-A593 CarbonylContact O-C 3.29Å; E521-A593 VanDerWaalsContact O-C 3.27Å; Q589-A593 PolarHBondContact O-N 2.86Å; A590-A593 PolarHBondContact O-N 2.85Å; F591-A593 VanDerWaalsContact C-N 3.3Å; F591-A593 PolarHBondContact O-N 3.41Å; A593-I648 VanDerWaalsContact CB-C 3.5Å; A593-A649 HydrophobicContact CB-CB 4.18Å
594	A	91.1	Very high	91.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-75.8	-29.9	179.2	0	0	0	0	0	113.1	E521 R523 P543 A590 F591 P596	E521-A594 WeakPolarHBondContact O-CA 3.42Å; E521-A594 PolarHBondContact O-N 2.66Å; E521-A594 VanDerWaalsContact O-N 3.16Å; R523-A594 HydrophobicContact CG-CB 3.93Å; R523-A594 PolarHBondContact NE-O 2.77Å; R523-A594 PolarHBondContact NH2-O 3.27Å; P543-A594 HydrophobicContact CB-CB 3.62Å; A590-A594 PolarHBondContact O-N 3.17Å; A590-A594 VanDerWaalsContact O-N 3.08Å; F591-A594 PolarHBondContact O-N 3.26Å; A594-P596 VanDerWaalsContact C-CD 3.46Å; A594-P596 WeakPolarHBondContact O-CD 3.02Å
595	N	93.9	Very high	91.4	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	-123.8	72.5	-177.9	-56	-73.1	0	0	0	111.5	L540 Y541 F591 K592 G597 S598	L540-N595 HydrophobicContact CD1-CB 4.29Å; Y541-N595 PolarHBondContact N-OD1 2.75Å; Y541-N595 PolarHBondContact O-ND2 3.2Å; Y541-N595 PolarHBondContact O-OD1 2.99Å; F591-N595 HydrophobicContact CE1-CB 4.31Å; F591-N595 WeakPolarHBondContact CE2-ND2 3.43Å; F591-N595 HydrophobicContact CZ-CB 4.46Å; F591-N595 WeakPolarHBondContact O-CB 3.22Å; F591-N595 PolarHBondContact O-N 2.81Å; F591-N595 PolarHBondContact O-ND2 2.99Å; K592-N595 CarbonylContact O-C 3.59Å; N595-G597 PolarHBondContact O-N 3.03Å; N595-S598 VanDerWaalsContact O-CB 3.25Å; N595-S598 WeakPolarHBondContact O-CB 3.4Å; N595-S598 PolarHBondContact O-N 3.38Å; N595-S598 VanDerWaalsContact O-N 3.15Å; N595-S598 PolarHBondContact O-OG 3.23Å
596	P	91.2	Very high	91.3	Very high	33 Å²	33	17.6 Å²	17.6	21%	0.214	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	137.7	170.9	-23.2	33.8	0	0	0	110.6	P520 Q532 A594 S598	P520-P596 HydrophobicContact CB-CG 3.93Å; Q532-P596 PolarHBondContact NE2-O 2.97Å; A594-P596 VanDerWaalsContact C-CD 3.46Å; A594-P596 WeakPolarHBondContact O-CD 3.02Å; P596-S598 VanDerWaalsContact C-N 3.25Å; P596-S598 PolarHBondContact O-N 3.02Å
597	G	87.6	Confident	91.5	Very high	62 Å²	62	20.1 Å²	20.1	64%	0.639	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	79	-3.3	-178.8	0	0	0	0	0	115.6	N595	N595-G597 PolarHBondContact O-N 3.03Å
598	S	91.8	Very high	91.5	Very high	17 Å²	17	20 Å²	20	12%	0.119	12%	0.118	C	C	.	.			trans	-65.6	144.6	176.8	59.4	0	0	0	0	113	F591 N595 P596	F591-S598 VanDerWaalsContact CE1-OG 3.3Å; F591-S598 WeakPolarHBondContact CE1-OG 3.35Å; N595-S598 VanDerWaalsContact O-CB 3.25Å; N595-S598 WeakPolarHBondContact O-CB 3.4Å; N595-S598 PolarHBondContact O-N 3.38Å; N595-S598 VanDerWaalsContact O-N 3.15Å; N595-S598 PolarHBondContact O-OG 3.23Å; P596-S598 VanDerWaalsContact C-N 3.25Å; P596-S598 PolarHBondContact O-N 3.02Å
599	C	92.6	Very high	91.1	Very high	16 Å²	16	23.9 Å²	23.9	11%	0.108	14%	0.144	C	C	.	.			trans	-94.7	171.1	175.2	70.8	0	0	0	0	111.8	Q601 D602 F603	C599-Q601 PolarHBondContact O-N 3.31Å; C599-D602 PolarHBondContact N-OD2 2.87Å; C599-D602 WeakPolarHBondContact O-CB 3.31Å; C599-D602 PolarHBondContact O-N 3.42Å; C599-D602 VanDerWaalsContact O-N 3.08Å; C599-D602 PolarHBondContact SG-OD2 3.05Å; C599-F603 PolarHBondContact O-N 3.1Å
600	F	93.6	Very high	90.7	Very high	12 Å²	12	33.9 Å²	33.9	5%	0.053	18%	0.181	C	C	.	.	H	α-helix	trans	-60	-36	-179	-177.3	-129.2	0	0	0	112.6	M588 D602 F603 L604 L627 M631 W638 R639 W642	M588-F600 HydrophobicContact CE-CE2 4.22Å; F600-D602 VanDerWaalsContact C-N 3.3Å; F600-D602 PolarHBondContact O-N 2.87Å; F600-F603 HydrophobicContact CE2-CD1 4.43Å; F600-F603 WeakPolarHBondContact O-CB 3.35Å; F600-F603 PolarHBondContact O-N 3.35Å; F600-L604 HydrophobicContact CD1-CD1 4.01Å; F600-L604 HydrophobicContact CE1-CD1 3.72Å; F600-L604 HydrophobicContact CE1-CG 4.35Å; F600-L604 HydrophobicContact CE2-CD2 4.27Å; F600-L604 HydrophobicContact CE2-CG 4.36Å; F600-L604 HydrophobicContact CZ-CD1 4.05Å; F600-L604 HydrophobicContact CZ-CD2 4.15Å; F600-L604 HydrophobicContact CZ-CG 4.26Å; F600-L604 WeakPolarHBondContact O-CG 3.18Å; F600-L604 PolarHBondContact O-N 2.84Å; F600-L604 VanDerWaalsContact O-N 3.09Å; F600-L627 HydrophobicContact CD1-CD1 4.2Å; F600-L627 HydrophobicContact CD1-CD2 4.23Å; F600-L627 HydrophobicContact CE1-CD1 4.31Å; F600-L627 HydrophobicContact CE1-CD2 4.41Å; F600-M631 HydrophobicContact CE1-CE 3.79Å; F600-M631 HydrophobicContact CE2-CE 4.47Å; F600-M631 HydrophobicContact CZ-CE 3.41Å; F600-M631 VanDerWaalsContact CZ-CE 3.41Å; F600-W638 HydrophobicContact CE2-CB 4.34Å; F600-W638 HydrophobicContact CZ-CB 3.88Å; F600-R639 HydrophobicContact CE1-CB 4.16Å; F600-R639 HydrophobicContact CZ-CB 4.23Å; F600-W642 HydrophobicContact CB-CD2 4.34Å; F600-W642 HydrophobicContact CB-CG 4.2Å; F600-W642 HydrophobicContact CD2-CB 3.6Å; F600-W642 AromaticContact CD2-CD1 3.81Å; F600-W642 AromaticContact CD2-CD2 3.65Å; F600-W642 HydrophobicContact CD2-CD2 3.65Å; F600-W642 HydrophobicContact CD2-CE3 4.14Å; F600-W642 AromaticContact CD2-CG 3.37Å; F600-W642 HydrophobicContact CD2-CG 3.37Å; F600-W642 HydrophobicContact CE2-CB 3.73Å; F600-W642 HydrophobicContact CE2-CD2 4.48Å; F600-W642 HydrophobicContact CE2-CG 4.04Å; F600-W642 HydrophobicContact CG-CD2 4.45Å; F600-W642 HydrophobicContact CG-CG 4.1Å
601	Q	92.6	Very high	90.7	Very high	50 Å²	50	34.5 Å²	34.5	23%	0.234	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-33.8	177.4	-66.6	87.5	-31.8	0	0	111.9	L533 C599 L604 R605 L627	L533-Q601 HydrophobicContact CD1-CB 3.56Å; L533-Q601 HydrophobicContact CD1-CG 4.49Å; C599-Q601 PolarHBondContact O-N 3.31Å; Q601-L604 PolarHBondContact O-N 2.92Å; Q601-R605 VanDerWaalsContact O-CG 3.27Å; Q601-R605 WeakPolarHBondContact O-CG 3.39Å; Q601-R605 PolarHBondContact O-N 2.95Å; Q601-L627 HydrophobicContact CG-CD2 3.88Å; Q601-L627 HydrophobicContact CG-CG 4.5Å
602	D	93.3	Very high	90.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-40.9	175.1	-76.4	-42.4	0	0	0	111.6	L533 L540 F591 C599 F600 R605	L533-D602 WeakPolarHBondContact CG-OD1 3.06Å; L533-D602 PolarHBondContact N-OD1 3.45Å; L533-D602 PolarHBondContact N-OD2 2.94Å; L540-D602 HydrophobicContact CD1-CB 4.01Å; F591-D602 HydrophobicContact CE1-CB 4.43Å; F591-D602 HydrophobicContact CZ-CB 4.11Å; C599-D602 PolarHBondContact N-OD2 2.87Å; C599-D602 WeakPolarHBondContact O-CB 3.31Å; C599-D602 PolarHBondContact O-N 3.42Å; C599-D602 VanDerWaalsContact O-N 3.08Å; C599-D602 PolarHBondContact SG-OD2 3.05Å; F600-D602 VanDerWaalsContact C-N 3.3Å; F600-D602 PolarHBondContact O-N 2.87Å; D602-R605 PolarHBondContact O-N 2.73Å; D602-R605 IonicContact OD1-NH1 3.78Å; D602-R605 PolarHBondContact OD1-NH1 3.19Å
603	F	94.4	Very high	90	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.5	-47.1	172.8	176.2	-101.2	0	0	0	111.5	L584 D587 M588 F591 C599 F600 R605 L606 H607 W638 W642	L584-F603 HydrophobicContact CD1-CE1 4.15Å; L584-F603 HydrophobicContact CD1-CZ 4.02Å; D587-F603 HydrophobicContact CB-CE2 4.45Å; M588-F603 HydrophobicContact CB-CE2 4.49Å; M588-F603 HydrophobicContact CE-CD1 4.24Å; M588-F603 HydrophobicContact CE-CE1 3.61Å; M588-F603 HydrophobicContact CE-CZ 4.15Å; M588-F603 HydrophobicContact CG-CD1 4.4Å; M588-F603 HydrophobicContact CG-CD2 4.44Å; M588-F603 HydrophobicContact CG-CE1 3.83Å; M588-F603 HydrophobicContact CG-CE2 3.86Å; M588-F603 HydrophobicContact CG-CZ 3.53Å; F591-F603 HydrophobicContact CB-CD2 3.73Å; F591-F603 HydrophobicContact CB-CE2 4.07Å; F591-F603 HydrophobicContact CD1-CB 3.94Å; F591-F603 AromaticContact CD1-CD2 3.81Å; F591-F603 HydrophobicContact CD1-CD2 3.81Å; F591-F603 HydrophobicContact CD1-CG 4.37Å; F591-F603 AromaticContact CD2-CD2 3.93Å; F591-F603 HydrophobicContact CD2-CD2 3.93Å; F591-F603 HydrophobicContact CE1-CB 3.72Å; F591-F603 HydrophobicContact CE1-CD2 4.36Å; F591-F603 HydrophobicContact CE2-CD2 4.48Å; F591-F603 HydrophobicContact CG-CB 4.44Å; F591-F603 AromaticContact CG-CD2 3.55Å; F591-F603 HydrophobicContact CG-CD2 3.55Å; F591-F603 HydrophobicContact CG-CE2 4.34Å; F591-F603 HydrophobicContact CG-CG 4.48Å; F591-F603 VanDerWaalsContact CZ-CA 3.43Å; F591-F603 HydrophobicContact CZ-CB 4.06Å; C599-F603 PolarHBondContact O-N 3.1Å; F600-F603 HydrophobicContact CE2-CD1 4.43Å; F600-F603 WeakPolarHBondContact O-CB 3.35Å; F600-F603 PolarHBondContact O-N 3.35Å; F603-R605 VanDerWaalsContact C-N 3.28Å; F603-R605 PolarHBondContact O-N 2.95Å; F603-L606 PolarHBondContact O-N 3.11Å; F603-L606 VanDerWaalsContact O-N 3.12Å; F603-H607 AromaticContact CD2-CD2 3.42Å; F603-H607 VanDerWaalsContact CD2-CD2 3.42Å; F603-H607 WeakPolarHBondContact CD2-CD2 3.47Å; F603-H607 AromaticContact CD2-NE2 3.72Å; F603-H607 HydrophobicContact CE1-CB 4.21Å; F603-H607 AromaticContact CE2-CD2 3.15Å; F603-H607 WeakPolarHBondContact CE2-CD2 3.5Å; F603-H607 AromaticContact CE2-CE1 3.91Å; F603-H607 AromaticContact CE2-CG 3.83Å; F603-H607 AromaticContact CE2-NE2 3.22Å; F603-H607 WeakPolarHBondContact CE2-NE2 3.34Å; F603-H607 HydrophobicContact CZ-CB 4.18Å; F603-H607 AromaticContact CZ-CD2 3.54Å; F603-H607 AromaticContact CZ-CG 3.74Å; F603-H607 AromaticContact CZ-NE2 3.88Å; F603-H607 PolarHBondContact O-CD2 2.92Å; F603-H607 PolarHBondContact O-N 2.77Å; F603-H607 VanDerWaalsContact O-N 3.08Å; F603-W638 AromaticContact CE1-CE3 3.99Å; F603-W638 HydrophobicContact CE1-CE3 3.99Å; F603-W638 AromaticContact CE1-CZ3 3.81Å; F603-W638 HydrophobicContact CE1-CZ3 3.81Å; F603-W642 HydrophobicContact CB-CE3 4.09Å; F603-W642 HydrophobicContact CB-CH2 3.91Å; F603-W642 HydrophobicContact CB-CZ3 3.52Å; F603-W642 HydrophobicContact CD1-CE3 4.39Å; F603-W642 HydrophobicContact CD1-CZ3 4.48Å; F603-W642 HydrophobicContact CD2-CE3 4.48Å; F603-W642 AromaticContact CD2-CZ3 3.91Å; F603-W642 HydrophobicContact CD2-CZ3 3.91Å; F603-W642 HydrophobicContact CG-CE3 4.07Å; F603-W642 AromaticContact CG-CZ3 3.73Å; F603-W642 HydrophobicContact CG-CZ3 3.73Å
604	L	91.8	Very high	89.7	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-31.6	-179.9	-64.6	178.5	0	0	0	113	F600 Q601 L606 H607 S608 P609 V612 L627 M631 W638	F600-L604 HydrophobicContact CD1-CD1 4.01Å; F600-L604 HydrophobicContact CE1-CD1 3.72Å; F600-L604 HydrophobicContact CE1-CG 4.35Å; F600-L604 HydrophobicContact CE2-CD2 4.27Å; F600-L604 HydrophobicContact CE2-CG 4.36Å; F600-L604 HydrophobicContact CZ-CD1 4.05Å; F600-L604 HydrophobicContact CZ-CD2 4.15Å; F600-L604 HydrophobicContact CZ-CG 4.26Å; F600-L604 WeakPolarHBondContact O-CG 3.18Å; F600-L604 PolarHBondContact O-N 2.84Å; F600-L604 VanDerWaalsContact O-N 3.09Å; Q601-L604 PolarHBondContact O-N 2.92Å; L604-L606 PolarHBondContact O-N 2.73Å; L604-H607 PolarHBondContact O-N 2.81Å; L604-S608 CarbonylContact O-C 3.56Å; L604-S608 WeakPolarHBondContact O-CA 3.43Å; L604-S608 PolarHBondContact O-N 2.8Å; L604-S608 VanDerWaalsContact O-O 3.04Å; L604-P609 VanDerWaalsContact O-N 3.16Å; L604-V612 HydrophobicContact CB-CG2 3.43Å; L604-V612 VanDerWaalsContact CB-CG2 3.43Å; L604-V612 HydrophobicContact CD1-CG2 4.28Å; L604-L627 HydrophobicContact CD1-CD2 3.42Å; L604-L627 VanDerWaalsContact CD1-CD2 3.42Å; L604-M631 HydrophobicContact CD1-CE 3.77Å; L604-M631 HydrophobicContact CD1-CG 4.33Å; L604-M631 HydrophobicContact CD2-CE 3.5Å; L604-M631 VanDerWaalsContact CD2-CE 3.5Å; L604-M631 HydrophobicContact CG-CE 4.26Å; L604-W638 HydrophobicContact CD2-CE3 3.65Å; L604-W638 HydrophobicContact CD2-CZ3 3.8Å
605	R	90.7	Very high	89.4	Confident	39 Å²	39	43.4 Å²	43.4	15%	0.147	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-22.9	175.9	-73	165.5	72.2	-157	8	113.5	F531 Q601 D602 F603 V612	F531-R605 PolarHBondContact O-NH1 3.49Å; Q601-R605 VanDerWaalsContact O-CG 3.27Å; Q601-R605 WeakPolarHBondContact O-CG 3.39Å; Q601-R605 PolarHBondContact O-N 2.95Å; D602-R605 PolarHBondContact O-N 2.73Å; D602-R605 IonicContact OD1-NH1 3.78Å; D602-R605 PolarHBondContact OD1-NH1 3.19Å; F603-R605 VanDerWaalsContact C-N 3.28Å; F603-R605 PolarHBondContact O-N 2.95Å; R605-V612 HydrophobicContact CG-CB 4.29Å; R605-V612 HydrophobicContact CG-CG1 4.2Å; R605-V612 HydrophobicContact CG-CG2 4.09Å
606	L	85.9	Confident	88.9	Confident	46 Å²	46	47.4 Å²	47.4	24%	0.241	26%	0.261	C	S	.	.	H	α-helix	trans	-92.6	-45.4	172	-66.3	-170.9	0	0	0	112.8	A527 L530 L540 F591 F603 L604	A527-L606 HydrophobicContact CB-CD2 3.88Å; L530-L606 HydrophobicContact CD1-CD2 3.59Å; L540-L606 HydrophobicContact CD2-CD1 4.09Å; L540-L606 HydrophobicContact CD2-CD2 4.17Å; L540-L606 HydrophobicContact CD2-CG 3.87Å; F591-L606 HydrophobicContact CD2-CD1 4.12Å; F591-L606 HydrophobicContact CE2-CD1 3.57Å; F591-L606 HydrophobicContact CE2-CG 4.24Å; F603-L606 PolarHBondContact O-N 3.11Å; F603-L606 VanDerWaalsContact O-N 3.12Å; L604-L606 PolarHBondContact O-N 2.73Å
607	H	87.5	Confident	88.3	Confident	56 Å²	56	48.8 Å²	48.8	26%	0.259	27%	0.266	S	S	.	.	H	α-helix	trans	-95	-28.2	-168.6	-68.6	-91.7	0	0	0	114.7	Y545 F603 L604 W638	Y545-H607 AromaticContact CE1-CE1 3.56Å; Y545-H607 AromaticContact CE1-NE2 3.8Å; Y545-H607 AromaticContact CZ-CE1 3.3Å; Y545-H607 AromaticContact CZ-NE2 3.51Å; Y545-H607 PolarHBondContact OH-CE1 2.81Å; Y545-H607 PolarHBondContact OH-NE2 2.81Å; F603-H607 AromaticContact CD2-CD2 3.42Å; F603-H607 VanDerWaalsContact CD2-CD2 3.42Å; F603-H607 WeakPolarHBondContact CD2-CD2 3.47Å; F603-H607 AromaticContact CD2-NE2 3.72Å; F603-H607 HydrophobicContact CE1-CB 4.21Å; F603-H607 AromaticContact CE2-CD2 3.15Å; F603-H607 WeakPolarHBondContact CE2-CD2 3.5Å; F603-H607 AromaticContact CE2-CE1 3.91Å; F603-H607 AromaticContact CE2-CG 3.83Å; F603-H607 AromaticContact CE2-NE2 3.22Å; F603-H607 WeakPolarHBondContact CE2-NE2 3.34Å; F603-H607 HydrophobicContact CZ-CB 4.18Å; F603-H607 AromaticContact CZ-CD2 3.54Å; F603-H607 AromaticContact CZ-CG 3.74Å; F603-H607 AromaticContact CZ-NE2 3.88Å; F603-H607 PolarHBondContact O-CD2 2.92Å; F603-H607 PolarHBondContact O-N 2.77Å; F603-H607 VanDerWaalsContact O-N 3.08Å; L604-H607 PolarHBondContact O-N 2.81Å; H607-W638 HydrophobicContact CB-CZ3 4.44Å
608	S	89.3	Confident	87.9	Confident	20 Å²	20	55 Å²	55	14%	0.14	28%	0.279	C	S	.	.			trans	-145.5	72.1	174.1	-165.1	0	0	0	0	110.7	L604 R610 D611	L604-S608 CarbonylContact O-C 3.56Å; L604-S608 WeakPolarHBondContact O-CA 3.43Å; L604-S608 PolarHBondContact O-N 2.8Å; L604-S608 VanDerWaalsContact O-O 3.04Å; S608-R610 PolarHBondContact O-N 2.84Å; S608-D611 WeakPolarHBondContact CB-OD2 3.34Å; S608-D611 WeakPolarHBondContact O-CB 3.39Å; S608-D611 PolarHBondContact O-N 2.65Å; S608-D611 PolarHBondContact OG-OD2 3.46Å
609	P	84.4	Confident	87	Confident	82 Å²	82	60.1 Å²	60.1	53%	0.532	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-58.4	-28.8	-173.2	-22.2	30.3	0	0	0	113.2	L604 D611 V612	L604-P609 VanDerWaalsContact O-N 3.16Å; P609-D611 PolarHBondContact O-N 2.96Å; P609-V612 PolarHBondContact O-N 3.28Å
610	R	83.9	Confident	86.2	Confident	234 Å²	234	63.7 Å²	63.7	88%	0.883	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-68.3	-17.3	177.9	-64.1	-174.4	179.6	-171.9	0.6	113.5	S608	S608-R610 PolarHBondContact O-N 2.84Å
611	D	88.3	Confident	85.4	Confident	14 Å²	14	65.6 Å²	65.6	8%	0.075	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-92	1.6	-178.1	-79.2	-45.6	0	0	0	113.7	S608 P609 S628 R630 M631	S608-D611 WeakPolarHBondContact CB-OD2 3.34Å; S608-D611 WeakPolarHBondContact O-CB 3.39Å; S608-D611 PolarHBondContact O-N 2.65Å; S608-D611 PolarHBondContact OG-OD2 3.46Å; P609-D611 PolarHBondContact O-N 2.96Å; D611-S628 PolarHBondContact O-N 2.93Å; D611-S628 WeakPolarHBondContact OD1-CB 3.46Å; D611-S628 PolarHBondContact OD1-OG 3Å; D611-R630 IonicContact OD2-NH1 3.53Å; D611-R630 PolarHBondContact OD2-NH1 2.75Å; D611-M631 HydrophobicContact CB-CG 3.52Å
612	V	88.4	Confident	84.7	Confident	20 Å²	20	70.1 Å²	70.1	12%	0.121	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	114.6	173.8	-174.8	0	0	0	0	109.1	L604 R605 P609 Y625	L604-V612 HydrophobicContact CB-CG2 3.43Å; L604-V612 VanDerWaalsContact CB-CG2 3.43Å; L604-V612 HydrophobicContact CD1-CG2 4.28Å; R605-V612 HydrophobicContact CG-CB 4.29Å; R605-V612 HydrophobicContact CG-CG1 4.2Å; R605-V612 HydrophobicContact CG-CG2 4.09Å; P609-V612 PolarHBondContact O-N 3.28Å; V612-Y625 HydrophobicContact CG1-CD1 4.09Å
613	V	86.8	Confident	84	Confident	69 Å²	69	77.2 Å²	77.2	42%	0.418	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	110.7	-179.5	-179.1	0	0	0	0	108.9	S626	V613-S626 PolarHBondContact N-O 2.91Å; V613-S626 PolarHBondContact O-N 3.14Å; V613-S626 PolarHBondContact O-OG 3.41Å
614	E	85.4	Confident	83.4	Confident	90 Å²	90	80.3 Å²	80.3	42%	0.421	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	124.9	172.5	-174.2	178.7	178.9	0	0	109.8	R623 Y625	E614-R623 WeakPolarHBondContact OE1-CD 3.4Å; E614-R623 IonicContact OE1-CZ 2.96Å; E614-R623 IonicContact OE1-NE 2.77Å; E614-R623 IonicContact OE1-NH1 3.93Å; E614-R623 PolarHBondContact OE1-NH1 2.96Å; E614-Y625 HydrophobicContact CB-CD1 4.09Å; E614-Y625 HydrophobicContact CB-CE1 4.04Å; E614-Y625 HydrophobicContact CG-CD1 4.16Å; E614-Y625 HydrophobicContact CG-CE1 3.75Å
615	S	83.3	Confident	83.2	Confident	52 Å²	52	83.3 Å²	83.3	36%	0.364	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	138.9	169.4	47.4	0	0	0	0	109.9	T624	S615-T624 PolarHBondContact N-O 3.27Å; S615-T624 PolarHBondContact O-N 3.41Å; S615-T624 PolarHBondContact O-OG1 2.72Å; S615-T624 PolarHBondContact OG-O 3.28Å; S615-T624 PolarHBondContact OG-OG1 2.77Å
616	V	83.6	Confident	83.1	Confident	83 Å²	83	84 Å²	84	50%	0.503	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.7	175.3	-172.4	0	0	0	0	107.7	E618 R623	V616-E618 PolarHBondContact O-N 3.47Å; V616-E618 VanDerWaalsContact O-N 3.13Å; V616-R623 HydrophobicContact CG2-CG 4.21Å
617	D	79.5	Confident	83.2	Confident	62 Å²	62	82.7 Å²	82.7	33%	0.332	43%	0.434	S	S	.	.			trans	-70	107.8	171.6	177.7	-0	0	0	0	108.7	T619 T620 G621 K622	D617-T619 PolarHBondContact O-N 2.84Å; D617-T619 VanDerWaalsContact O-N 3.08Å; D617-T619 PolarHBondContact OD1-N 3.37Å; D617-T619 PolarHBondContact OD1-OG1 3.13Å; D617-T619 PolarHBondContact OD2-OG1 3.29Å; D617-T620 WeakPolarHBondContact CB-OG1 3.16Å; D617-T620 PolarHBondContact O-N 3.29Å; D617-T620 WeakPolarHBondContact OD2-CG2 3.13Å; D617-T620 PolarHBondContact OD2-OG1 3.11Å; D617-G621 VanDerWaalsContact O-CA 3.29Å; D617-G621 WeakPolarHBondContact O-CA 3.43Å; D617-G621 PolarHBondContact O-N 2.82Å; D617-K622 PolarHBondContact N-O 2.86Å
618	E	79.3	Confident	83.2	Confident	193 Å²	193	80.5 Å²	80.5	90%	0.902	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-25.1	-178.4	-63.7	-174.9	171.2	0	0	112.8	V616	V616-E618 PolarHBondContact O-N 3.47Å; V616-E618 VanDerWaalsContact O-N 3.13Å
619	T	73.5	Confident	83	Confident	124 Å²	124	85.1 Å²	85.1	76%	0.761	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-34.8	-176.9	66.3	0	0	0	0	113.4	D617	D617-T619 PolarHBondContact O-N 2.84Å; D617-T619 VanDerWaalsContact O-N 3.08Å; D617-T619 PolarHBondContact OD1-N 3.37Å; D617-T619 PolarHBondContact OD1-OG1 3.13Å; D617-T619 PolarHBondContact OD2-OG1 3.29Å
620	T	75.8	Confident	83	Confident	91 Å²	91	88.9 Å²	88.9	56%	0.558	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-12.6	-177.3	61	0	0	0	0	113.2	D617 K622	D617-T620 WeakPolarHBondContact CB-OG1 3.16Å; D617-T620 PolarHBondContact O-N 3.29Å; D617-T620 WeakPolarHBondContact OD2-CG2 3.13Å; D617-T620 PolarHBondContact OD2-OG1 3.11Å; T620-K622 PolarHBondContact O-N 3.45Å; T620-K622 VanDerWaalsContact OG1-CB 3.25Å; T620-K622 WeakPolarHBondContact OG1-CB 3.45Å; T620-K622 PolarHBondContact OG1-N 3.3Å
621	G	75.7	Confident	83.2	Confident	52 Å²	52	77.8 Å²	77.8	54%	0.536	42%	0.416	S	S	.	.			trans	65.6	5.2	-168.3	0	0	0	0	0	113.4	D617	D617-G621 VanDerWaalsContact O-CA 3.29Å; D617-G621 WeakPolarHBondContact O-CA 3.43Å; D617-G621 PolarHBondContact O-N 2.82Å
622	K	77.4	Confident	83	Confident	145 Å²	145	80 Å²	80	63%	0.63	43%	0.433	S	S	*	.			trans	-78.5	128.5	-175.1	-168	176.3	-179.1	-179.9	0	109.8	D617 T620	D617-K622 PolarHBondContact N-O 2.86Å; T620-K622 PolarHBondContact O-N 3.45Å; T620-K622 VanDerWaalsContact OG1-CB 3.25Å; T620-K622 WeakPolarHBondContact OG1-CB 3.45Å; T620-K622 PolarHBondContact OG1-N 3.3Å
623	R	80.3	Confident	82.8	Confident	150 Å²	150	81.4 Å²	81.4	57%	0.566	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	129.1	173.3	-64.9	167.3	-179.1	-135.8	12.7	109.1	E614 V616 Y625	E614-R623 WeakPolarHBondContact OE1-CD 3.4Å; E614-R623 IonicContact OE1-CZ 2.96Å; E614-R623 IonicContact OE1-NE 2.77Å; E614-R623 IonicContact OE1-NH1 3.93Å; E614-R623 PolarHBondContact OE1-NH1 2.96Å; V616-R623 HydrophobicContact CG2-CG 4.21Å; R623-Y625 HydrophobicContact CB-CE2 4.04Å
624	T	81.8	Confident	82	Confident	65 Å²	65	87.9 Å²	87.9	40%	0.399	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136.8	175	51.2	0	0	0	0	108.7	S615	S615-T624 PolarHBondContact N-O 3.27Å; S615-T624 PolarHBondContact O-N 3.41Å; S615-T624 PolarHBondContact O-OG1 2.72Å; S615-T624 PolarHBondContact OG-O 3.28Å; S615-T624 PolarHBondContact OG-OG1 2.77Å
625	Y	86.5	Confident	81.7	Confident	62 Å²	62	92.8 Å²	92.8	24%	0.243	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	114.9	-176.9	-60.9	-92.1	0	0	0	108.8	L533 V612 E614 R623	L533-Y625 HydrophobicContact CD1-CD2 4.13Å; L533-Y625 HydrophobicContact CD1-CG 4Å; L533-Y625 HydrophobicContact CD2-CD1 4.21Å; L533-Y625 HydrophobicContact CD2-CD2 3.26Å; L533-Y625 HydrophobicContact CD2-CE1 4.17Å; L533-Y625 HydrophobicContact CD2-CE2 3.2Å; L533-Y625 HydrophobicContact CD2-CG 3.77Å; L533-Y625 HydrophobicContact CG-CD2 4.29Å; V612-Y625 HydrophobicContact CG1-CD1 4.09Å; E614-Y625 HydrophobicContact CB-CD1 4.09Å; E614-Y625 HydrophobicContact CB-CE1 4.04Å; E614-Y625 HydrophobicContact CG-CD1 4.16Å; E614-Y625 HydrophobicContact CG-CE1 3.75Å; R623-Y625 HydrophobicContact CB-CE2 4.04Å
626	S	87.9	Confident	81.7	Confident	53 Å²	53	91.3 Å²	91.3	37%	0.371	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	157.4	179.8	61.6	0	0	0	0	110.7	V613	V613-S626 PolarHBondContact N-O 2.91Å; V613-S626 PolarHBondContact O-N 3.14Å; V613-S626 PolarHBondContact O-OG 3.41Å
627	L	89.2	Confident	81.7	Confident	20 Å²	20	90.1 Å²	90.1	11%	0.105	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	147.8	178.1	-66.6	177.9	0	0	0	110.4	F600 Q601 L604 M631 S632	F600-L627 HydrophobicContact CD1-CD1 4.2Å; F600-L627 HydrophobicContact CD1-CD2 4.23Å; F600-L627 HydrophobicContact CE1-CD1 4.31Å; F600-L627 HydrophobicContact CE1-CD2 4.41Å; Q601-L627 HydrophobicContact CG-CD2 3.88Å; Q601-L627 HydrophobicContact CG-CG 4.5Å; L604-L627 HydrophobicContact CD1-CD2 3.42Å; L604-L627 VanDerWaalsContact CD1-CD2 3.42Å; L627-M631 HydrophobicContact CB-CB 4.21Å; L627-M631 HydrophobicContact CD2-CB 4.45Å; L627-S632 VanDerWaalsContact CB-OG 3.29Å; L627-S632 WeakPolarHBondContact CB-OG 3.33Å; L627-S632 PolarHBondContact O-OG 3.04Å
628	S	87.6	Confident	82.2	Confident	9 Å²	9	89.7 Å²	89.7	6%	0.063	47%	0.467	C	S	.	.			trans	-60.3	161.4	171.7	75.3	0	0	0	0	111.8	D611 R630 M631 S632	D611-S628 PolarHBondContact O-N 2.93Å; D611-S628 WeakPolarHBondContact OD1-CB 3.46Å; D611-S628 PolarHBondContact OD1-OG 3Å; S628-R630 VanDerWaalsContact C-N 3.25Å; S628-R630 PolarHBondContact O-N 2.75Å; S628-M631 PolarHBondContact O-N 2.61Å; S628-M631 VanDerWaalsContact O-N 3.07Å; S628-M631 PolarHBondContact OG-N 3.17Å; S628-S632 VanDerWaalsContact O-CB 3.31Å; S628-S632 WeakPolarHBondContact O-CB 3.23Å; S628-S632 PolarHBondContact O-N 3.03Å; S628-S632 PolarHBondContact O-OG 3.25Å
629	P	85.5	Confident	82.5	Confident	117 Å²	117	85.1 Å²	85.1	76%	0.76	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-38.6	175.3	-26.6	35.2	0	0	0	113.1	M631 S632 A633	P629-M631 VanDerWaalsContact C-N 3.34Å; P629-M631 PolarHBondContact O-N 2.81Å; P629-S632 PolarHBondContact O-N 3.21Å; P629-A633 PolarHBondContact O-N 3.43Å
630	R	84.3	Confident	83.1	Confident	161 Å²	161	81.4 Å²	81.4	61%	0.608	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-45.4	175.2	179.5	-171.5	177	-150.3	3.6	110.9	D611 S628 S632	D611-R630 IonicContact OD2-NH1 3.53Å; D611-R630 PolarHBondContact OD2-NH1 2.75Å; S628-R630 VanDerWaalsContact C-N 3.25Å; S628-R630 PolarHBondContact O-N 2.75Å; R630-S632 VanDerWaalsContact C-N 3.33Å
631	M	87.4	Confident	83.7	Confident	1 Å²	1	78 Å²	78	1%	0.005	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-16.9	-177.2	-66.8	-56.9	-75.1	0	0	114.2	F600 L604 D611 L627 S628 P629 N636 W638	F600-M631 HydrophobicContact CE1-CE 3.79Å; F600-M631 HydrophobicContact CE2-CE 4.47Å; F600-M631 HydrophobicContact CZ-CE 3.41Å; F600-M631 VanDerWaalsContact CZ-CE 3.41Å; L604-M631 HydrophobicContact CD1-CE 3.77Å; L604-M631 HydrophobicContact CD1-CG 4.33Å; L604-M631 HydrophobicContact CD2-CE 3.5Å; L604-M631 VanDerWaalsContact CD2-CE 3.5Å; L604-M631 HydrophobicContact CG-CE 4.26Å; D611-M631 HydrophobicContact CB-CG 3.52Å; L627-M631 HydrophobicContact CB-CB 4.21Å; L627-M631 HydrophobicContact CD2-CB 4.45Å; S628-M631 PolarHBondContact O-N 2.61Å; S628-M631 VanDerWaalsContact O-N 3.07Å; S628-M631 PolarHBondContact OG-N 3.17Å; P629-M631 VanDerWaalsContact C-N 3.34Å; P629-M631 PolarHBondContact O-N 2.81Å; M631-N636 WeakPolarHBondContact CA-ND2 3.49Å; M631-N636 WeakPolarHBondContact CE-ND2 3.43Å; M631-N636 PolarHBondContact O-ND2 2.44Å; M631-N636 PolarHBondContact SD-ND2 3.26Å; M631-W638 HydrophobicContact CE-CB 3.59Å; M631-W638 HydrophobicContact CE-CD2 3.98Å; M631-W638 HydrophobicContact CE-CE3 3.9Å; M631-W638 HydrophobicContact CE-CG 3.89Å; M631-W638 HydrophobicContact SD-CG 4.42Å
632	S	84.8	Confident	84.5	Confident	60 Å²	60	76.7 Å²	76.7	42%	0.42	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.4	178.2	-56.5	0	0	0	0	114	L627 S628 P629 R630	L627-S632 VanDerWaalsContact CB-OG 3.29Å; L627-S632 WeakPolarHBondContact CB-OG 3.33Å; L627-S632 PolarHBondContact O-OG 3.04Å; S628-S632 VanDerWaalsContact O-CB 3.31Å; S628-S632 WeakPolarHBondContact O-CB 3.23Å; S628-S632 PolarHBondContact O-N 3.03Å; S628-S632 PolarHBondContact O-OG 3.25Å; P629-S632 PolarHBondContact O-N 3.21Å; R630-S632 VanDerWaalsContact C-N 3.33Å
633	A	82.6	Confident	85.1	Confident	50 Å²	50	76.5 Å²	76.5	41%	0.413	38%	0.38	S	S	.	.	S	Bend	trans	-60.1	144.4	177.7	0	0	0	0	0	111.8	P629 E635 N636	P629-A633 PolarHBondContact O-N 3.43Å; A633-E635 VanDerWaalsContact C-N 3.31Å; A633-E635 PolarHBondContact O-N 3.5Å; A633-N636 PolarHBondContact O-N 3.26Å
634	E	71.9	Confident	85.5	Confident	205 Å²	205	74.2 Å²	74.2	96%	0.958	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-40.5	-173.4	-69.7	-178.7	169.5	0	0	112.8
635	E	77.9	Confident	85.9	Confident	194 Å²	194	71.3 Å²	71.3	91%	0.907	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	50.8	179.1	-65.2	-172.1	170.1	0	0	112.4	A633 L637	A633-E635 VanDerWaalsContact C-N 3.31Å; A633-E635 PolarHBondContact O-N 3.5Å; E635-L637 PolarHBondContact O-N 3.28Å
636	N	84.1	Confident	86.1	Confident	21 Å²	21	74.8 Å²	74.8	11%	0.112	37%	0.369	C	S	.	.			trans	-75.9	109.7	176.7	-174.5	-5.3	0	0	0	112	M631 A633 W638 R639 S640	M631-N636 WeakPolarHBondContact CA-ND2 3.49Å; M631-N636 WeakPolarHBondContact CE-ND2 3.43Å; M631-N636 PolarHBondContact O-ND2 2.44Å; M631-N636 PolarHBondContact SD-ND2 3.26Å; A633-N636 PolarHBondContact O-N 3.26Å; N636-W638 PolarHBondContact O-N 3.01Å; N636-W638 VanDerWaalsContact O-N 3.16Å; N636-W638 WeakPolarHBondContact OD1-CB 3.41Å; N636-W638 PolarHBondContact OD1-N 3.29Å; N636-R639 HydrophobicContact CB-CB 4.32Å; N636-R639 PolarHBondContact O-N 3.04Å; N636-R639 VanDerWaalsContact O-N 3.07Å; N636-S640 PolarHBondContact O-N 3.12Å; N636-S640 VanDerWaalsContact O-N 3.14Å
637	L	82.4	Confident	86.2	Confident	58 Å²	58	76.2 Å²	76.2	30%	0.304	38%	0.377	S	S	.	.	H	α-helix	trans	-46.4	-43.4	173.2	175.8	64.7	0	0	0	113.3	R581 E635 R639 S640 L641	R581-L637 HydrophobicContact CG-CD1 4.38Å; R581-L637 HydrophobicContact CG-CD2 3.63Å; E635-L637 PolarHBondContact O-N 3.28Å; L637-R639 PolarHBondContact O-N 3.41Å; L637-S640 PolarHBondContact O-N 2.86Å; L637-S640 PolarHBondContact O-OG 3.09Å; L637-L641 HydrophobicContact CD1-CD1 3.92Å; L637-L641 HydrophobicContact CD1-CG 4.03Å; L637-L641 HydrophobicContact CG-CD1 3.94Å; L637-L641 HydrophobicContact CG-CG 4.42Å; L637-L641 WeakPolarHBondContact O-CB 3.47Å; L637-L641 WeakPolarHBondContact O-CG 3.39Å; L637-L641 PolarHBondContact O-N 3.14Å
638	W	90.5	Very high	85.8	Confident	52 Å²	52	77 Å²	77	20%	0.197	38%	0.381	C	S	.	.	H	α-helix	trans	-64.3	-41.2	-177.8	-75.7	49	0	0	0	112.2	L584 M588 F600 F603 L604 H607 M631 N636 L641 W642	L584-W638 HydrophobicContact CD1-CD2 4.05Å; L584-W638 HydrophobicContact CD1-CE3 3.92Å; L584-W638 HydrophobicContact CD1-CH2 3.75Å; L584-W638 HydrophobicContact CD1-CZ2 3.87Å; L584-W638 HydrophobicContact CD1-CZ3 3.78Å; L584-W638 HydrophobicContact CD2-CB 4.46Å; L584-W638 HydrophobicContact CD2-CD2 3.57Å; L584-W638 VanDerWaalsContact CD2-CE2 3.44Å; L584-W638 HydrophobicContact CD2-CE3 4.26Å; L584-W638 HydrophobicContact CD2-CG 3.65Å; L584-W638 HydrophobicContact CD2-CZ2 4.03Å; L584-W638 HydrophobicContact CG-CD2 4.43Å; M588-W638 HydrophobicContact CE-CB 4.14Å; M588-W638 HydrophobicContact CE-CD2 4.43Å; M588-W638 HydrophobicContact CE-CE3 4.13Å; M588-W638 HydrophobicContact CE-CG 4.49Å; M588-W638 VanDerWaalsContact CE-O 3.25Å; M588-W638 WeakPolarHBondContact CE-O 3.38Å; F600-W638 HydrophobicContact CE2-CB 4.34Å; F600-W638 HydrophobicContact CZ-CB 3.88Å; F603-W638 AromaticContact CE1-CE3 3.99Å; F603-W638 HydrophobicContact CE1-CE3 3.99Å; F603-W638 AromaticContact CE1-CZ3 3.81Å; F603-W638 HydrophobicContact CE1-CZ3 3.81Å; L604-W638 HydrophobicContact CD2-CE3 3.65Å; L604-W638 HydrophobicContact CD2-CZ3 3.8Å; H607-W638 HydrophobicContact CB-CZ3 4.44Å; M631-W638 HydrophobicContact CE-CB 3.59Å; M631-W638 HydrophobicContact CE-CD2 3.98Å; M631-W638 HydrophobicContact CE-CE3 3.9Å; M631-W638 HydrophobicContact CE-CG 3.89Å; M631-W638 HydrophobicContact SD-CG 4.42Å; N636-W638 PolarHBondContact O-N 3.01Å; N636-W638 VanDerWaalsContact O-N 3.16Å; N636-W638 WeakPolarHBondContact OD1-CB 3.41Å; N636-W638 PolarHBondContact OD1-N 3.29Å; W638-L641 PolarHBondContact O-N 2.99Å; W638-W642 VanDerWaalsContact O-CB 3.31Å; W638-W642 WeakPolarHBondContact O-CB 2.89Å; W638-W642 PolarHBondContact O-N 3.28Å
639	R	85.8	Confident	85.4	Confident	97 Å²	97	77 Å²	77	37%	0.366	38%	0.382	S	S	.	.	H	α-helix	trans	-67.9	-42.7	179	-174.5	-179.8	-101.2	173.6	-12.7	110.6	F600 N636 L637 L641 W642 E643	F600-R639 HydrophobicContact CE1-CB 4.16Å; F600-R639 HydrophobicContact CZ-CB 4.23Å; N636-R639 HydrophobicContact CB-CB 4.32Å; N636-R639 PolarHBondContact O-N 3.04Å; N636-R639 VanDerWaalsContact O-N 3.07Å; L637-R639 PolarHBondContact O-N 3.41Å; R639-L641 PolarHBondContact O-N 3.3Å; R639-W642 WeakPolarHBondContact O-CB 3.45Å; R639-W642 PolarHBondContact O-N 3.37Å; R639-E643 WeakPolarHBondContact O-CG 3.36Å; R639-E643 PolarHBondContact O-N 3.47Å
640	S	86.4	Confident	84.8	Confident	47 Å²	47	72 Å²	72	33%	0.329	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-40.2	176.7	71	0	0	0	0	112.9	N636 L637 K644	N636-S640 PolarHBondContact O-N 3.12Å; N636-S640 VanDerWaalsContact O-N 3.14Å; L637-S640 PolarHBondContact O-N 2.86Å; L637-S640 PolarHBondContact O-OG 3.09Å; S640-K644 WeakPolarHBondContact O-CG 3.46Å; S640-K644 PolarHBondContact O-N 3.15Å
641	L	88.7	Confident	83.7	Confident	20 Å²	20	68.3 Å²	68.3	11%	0.105	35%	0.354	C	S	.	.	H	α-helix	trans	-66.9	-41.6	174.6	-72.4	175.2	0	0	0	111.2	L584 F585 M588 L637 W638 R639 E643 K644 A645	L584-L641 HydrophobicContact CD2-CD1 3.9Å; L584-L641 HydrophobicContact CG-CD1 4.36Å; F585-L641 HydrophobicContact CB-CD2 4.33Å; F585-L641 HydrophobicContact CD2-CB 4.21Å; F585-L641 HydrophobicContact CD2-CD2 3.82Å; F585-L641 HydrophobicContact CG-CD2 4.41Å; M588-L641 HydrophobicContact CE-CB 4.43Å; M588-L641 HydrophobicContact SD-CB 3.73Å; L637-L641 HydrophobicContact CD1-CD1 3.92Å; L637-L641 HydrophobicContact CD1-CG 4.03Å; L637-L641 HydrophobicContact CG-CD1 3.94Å; L637-L641 HydrophobicContact CG-CG 4.42Å; L637-L641 WeakPolarHBondContact O-CB 3.47Å; L637-L641 WeakPolarHBondContact O-CG 3.39Å; L637-L641 PolarHBondContact O-N 3.14Å; W638-L641 PolarHBondContact O-N 2.99Å; R639-L641 PolarHBondContact O-N 3.3Å; L641-E643 PolarHBondContact O-N 3.16Å; L641-K644 PolarHBondContact O-N 3.27Å; L641-A645 WeakPolarHBondContact O-CB 3.37Å; L641-A645 PolarHBondContact O-N 3.18Å
642	W	92.5	Very high	82.5	Confident	23 Å²	23	72.6 Å²	72.6	9%	0.087	38%	0.383	C	S	.	.	H	α-helix	trans	-60.7	-44.4	177.5	174.1	-96.2	0	0	0	112	M588 F591 K592 F600 F603 W638 R639 K644 A645	M588-W642 HydrophobicContact CB-CE3 4.02Å; M588-W642 HydrophobicContact CB-CZ3 4.43Å; M588-W642 HydrophobicContact CE-CB 4.23Å; M588-W642 HydrophobicContact CG-CE3 3.89Å; M588-W642 VanDerWaalsContact SD-CA 3.53Å; M588-W642 HydrophobicContact SD-CB 3.89Å; M588-W642 HydrophobicContact SD-CE3 4.37Å; M588-W642 PolarHBondContact SD-N 2.92Å; F591-W642 AromaticContact CD1-CH2 3.66Å; F591-W642 HydrophobicContact CD1-CH2 3.66Å; F591-W642 AromaticContact CD1-CZ3 3.79Å; F591-W642 HydrophobicContact CD1-CZ3 3.79Å; F591-W642 AromaticContact CE1-CH2 3.87Å; F591-W642 HydrophobicContact CE1-CH2 3.87Å; F591-W642 HydrophobicContact CE1-CZ3 4.31Å; K592-W642 HydrophobicContact CD-CH2 4.33Å; K592-W642 HydrophobicContact CD-CZ2 4.42Å; K592-W642 VanDerWaalsContact CE-CE2 3.42Å; K592-W642 VanDerWaalsContact CE-CZ2 3.49Å; K592-W642 WeakPolarHBondContact CE-O 3.09Å; K592-W642 HydrophobicContact CG-CH2 3.6Å; K592-W642 HydrophobicContact CG-CZ2 4.09Å; K592-W642 HydrophobicContact CG-CZ3 3.88Å; K592-W642 PolarHBondContact NZ-O 2.9Å; F600-W642 HydrophobicContact CB-CD2 4.34Å; F600-W642 HydrophobicContact CB-CG 4.2Å; F600-W642 HydrophobicContact CD2-CB 3.6Å; F600-W642 AromaticContact CD2-CD1 3.81Å; F600-W642 AromaticContact CD2-CD2 3.65Å; F600-W642 HydrophobicContact CD2-CD2 3.65Å; F600-W642 HydrophobicContact CD2-CE3 4.14Å; F600-W642 AromaticContact CD2-CG 3.37Å; F600-W642 HydrophobicContact CD2-CG 3.37Å; F600-W642 HydrophobicContact CE2-CB 3.73Å; F600-W642 HydrophobicContact CE2-CD2 4.48Å; F600-W642 HydrophobicContact CE2-CG 4.04Å; F600-W642 HydrophobicContact CG-CD2 4.45Å; F600-W642 HydrophobicContact CG-CG 4.1Å; F603-W642 HydrophobicContact CB-CE3 4.09Å; F603-W642 HydrophobicContact CB-CH2 3.91Å; F603-W642 HydrophobicContact CB-CZ3 3.52Å; F603-W642 HydrophobicContact CD1-CE3 4.39Å; F603-W642 HydrophobicContact CD1-CZ3 4.48Å; F603-W642 HydrophobicContact CD2-CE3 4.48Å; F603-W642 AromaticContact CD2-CZ3 3.91Å; F603-W642 HydrophobicContact CD2-CZ3 3.91Å; F603-W642 HydrophobicContact CG-CE3 4.07Å; F603-W642 AromaticContact CG-CZ3 3.73Å; F603-W642 HydrophobicContact CG-CZ3 3.73Å; W638-W642 VanDerWaalsContact O-CB 3.31Å; W638-W642 WeakPolarHBondContact O-CB 2.89Å; W638-W642 PolarHBondContact O-N 3.28Å; R639-W642 WeakPolarHBondContact O-CB 3.45Å; R639-W642 PolarHBondContact O-N 3.37Å; W642-K644 VanDerWaalsContact C-N 3.28Å; W642-K644 PolarHBondContact O-N 3.27Å; W642-A645 PolarHBondContact O-N 3.35Å
643	E	89.6	Confident	81.8	Confident	141 Å²	141	70.6 Å²	70.6	66%	0.659	37%	0.367	S	S	*	.	H	α-helix	trans	-62.9	-36.2	178.2	-74.1	171.5	-174.4	0	0	111.9	R639 L641	R639-E643 WeakPolarHBondContact O-CG 3.36Å; R639-E643 PolarHBondContact O-N 3.47Å; L641-E643 PolarHBondContact O-N 3.16Å
644	K	88.5	Confident	80.6	Confident	103 Å²	103	76.7 Å²	76.7	45%	0.448	38%	0.38	S	S	.	.	H	α-helix	trans	-77.1	-27.7	177.4	-69.6	178.6	177.1	-165.6	0	113.8	F504 F585 S640 L641 W642 R646	F504-K644 HydrophobicContact CE1-CD 4.13Å; F504-K644 HydrophobicContact CE2-CD 4.41Å; F504-K644 HydrophobicContact CZ-CD 3.8Å; F585-K644 HydrophobicContact CE2-CB 3.96Å; S640-K644 WeakPolarHBondContact O-CG 3.46Å; S640-K644 PolarHBondContact O-N 3.15Å; L641-K644 PolarHBondContact O-N 3.27Å; W642-K644 VanDerWaalsContact C-N 3.28Å; W642-K644 PolarHBondContact O-N 3.27Å; K644-R646 PolarHBondContact O-N 3.11Å
645	A	90.8	Very high	79.9	Confident	4 Å²	4	70.2 Å²	70.2	3%	0.033	36%	0.355	C	S	.	.			trans	-66.5	128.5	-175.6	0	0	0	0	0	111.7	F585 M588 Q589 K592 L641 W642	F585-A645 HydrophobicContact CD2-CB 4.3Å; F585-A645 HydrophobicContact CE2-CB 3.97Å; M588-A645 HydrophobicContact CB-CB 3.79Å; Q589-A645 HydrophobicContact CG-CB 3.88Å; K592-A645 HydrophobicContact CD-CB 4.46Å; K592-A645 VanDerWaalsContact CD-O 3.32Å; K592-A645 WeakPolarHBondContact CD-O 3.24Å; K592-A645 WeakPolarHBondContact CE-O 3.4Å; K592-A645 PolarHBondContact NZ-O 2.92Å; L641-A645 WeakPolarHBondContact O-CB 3.37Å; L641-A645 PolarHBondContact O-N 3.18Å; W642-A645 PolarHBondContact O-N 3.35Å
646	R	89.5	Confident	78.9	Confident	135 Å²	135	61.7 Å²	61.7	51%	0.509	32%	0.316	S	S	.	.			trans	-93.9	154	173.1	-65.6	-178.5	-176.5	-177.8	0.5	110.5	E509 Q589 K644 I648	E509-R646 IonicContact OE2-CZ 3.51Å; E509-R646 IonicContact OE2-NH1 3.58Å; E509-R646 PolarHBondContact OE2-NH1 3.25Å; Q589-R646 VanDerWaalsContact CA-O 3.27Å; Q589-R646 WeakPolarHBondContact CA-O 3.39Å; Q589-R646 WeakPolarHBondContact CB-O 3.21Å; Q589-R646 WeakPolarHBondContact CG-O 3.17Å; K644-R646 PolarHBondContact O-N 3.11Å; R646-I648 HydrophobicContact CB-CD1 4.13Å; R646-I648 HydrophobicContact CB-CG1 4.09Å; R646-I648 PolarHBondContact O-N 3.26Å
647	P	90.6	Very high	77.2	Confident	82 Å²	82	63.6 Å²	63.6	53%	0.532	33%	0.328	S	S	.	.			trans	-70.1	89.7	176.8	29.3	-34.1	0	0	0	110.8	K592	K592-P647 HydrophobicContact CB-CB 3.91Å
648	I	81.3	Confident	75.2	Confident	37 Å²	37	67 Å²	67	19%	0.19	34%	0.342	C	S	.	.			trans	-127.2	121.9	180	-53.2	177.6	0	0	0	108.5	Q589 A590 A593 R646 C652 Q653	Q589-I648 CarbonylContact C-O 3.57Å; Q589-I648 HydrophobicContact CB-CB 4.37Å; Q589-I648 PolarHBondContact O-N 3.03Å; Q589-I648 VanDerWaalsContact O-O 3.08Å; A590-I648 WeakPolarHBondContact CA-O 3.4Å; A590-I648 PolarHBondContact N-O 3.06Å; A593-I648 VanDerWaalsContact CB-C 3.5Å; R646-I648 HydrophobicContact CB-CD1 4.13Å; R646-I648 HydrophobicContact CB-CG1 4.09Å; R646-I648 PolarHBondContact O-N 3.26Å; I648-C652 HydrophobicContact CG2-CB 3.73Å; I648-Q653 HydrophobicContact CB-CG 4.15Å; I648-Q653 HydrophobicContact CG2-CG 3.76Å; I648-Q653 PolarHBondContact O-NE2 3.45Å
649	A	78.3	Confident	72.5	Confident	9 Å²	9	69.4 Å²	69.4	7%	0.074	36%	0.355	C	S	.	.			trans	-67.1	149.3	177.9	0	0	0	0	0	111.5	E521 A593 A651 C652 Q653	E521-A649 HydrophobicContact CB-CB 4.25Å; A593-A649 HydrophobicContact CB-CB 4.18Å; A649-A651 PolarHBondContact O-N 2.88Å; A649-C652 WeakPolarHBondContact O-CA 3.33Å; A649-C652 PolarHBondContact O-N 2.75Å; A649-Q653 WeakPolarHBondContact O-CG 3.41Å; A649-Q653 PolarHBondContact O-N 3.44Å
650	A	72.8	Confident	70	Confident	13 Å²	13	68.5 Å²	68.5	11%	0.107	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-52.3	-35.1	-176.1	0	0	0	0	0	114.4	I544 Q546 A590 C652 Q653	I544-A650 WeakPolarHBondContact O-CB 3.49Å; Q546-A650 HydrophobicContact CG-CB 3.96Å; A590-A650 HydrophobicContact CB-CB 4.47Å; A650-C652 PolarHBondContact O-N 2.74Å; A650-Q653 PolarHBondContact O-N 3.01Å
651	A	61.2	Low	67.6	Low	82 Å²	82	77.8 Å²	77.8	68%	0.678	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-65.7	-20.7	176.9	0	0	0	0	0	114.2	A649	A649-A651 PolarHBondContact O-N 2.88Å
652	C	63	Low	65.3	Low	92 Å²	92	84.4 Å²	84.4	62%	0.622	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-104.9	-3.5	179.4	-61.3	0	0	0	0	112.6	I648 A649 A650	I648-C652 HydrophobicContact CG2-CB 3.73Å; A649-C652 WeakPolarHBondContact O-CA 3.33Å; A649-C652 PolarHBondContact O-N 2.75Å; A650-C652 PolarHBondContact O-N 2.74Å
653	Q	68.4	Low	62.9	Low	18 Å²	18	85.2 Å²	85.2	8%	0.084	43%	0.433	C	S	.	.	S	Bend	trans	-84.6	161.7	178.7	-70.2	171.4	6.7	0	0	111.1	S586 Q589 I648 A649 A650	S586-Q653 PolarHBondContact O-NE2 3.18Å; S586-Q653 PolarHBondContact O-OE1 2.69Å; S586-Q653 PolarHBondContact OG-OE1 2.99Å; Q589-Q653 VanDerWaalsContact CB-NE2 3.28Å; I648-Q653 HydrophobicContact CB-CG 4.15Å; I648-Q653 HydrophobicContact CG2-CG 3.76Å; I648-Q653 PolarHBondContact O-NE2 3.45Å; A649-Q653 WeakPolarHBondContact O-CG 3.41Å; A649-Q653 PolarHBondContact O-N 3.44Å; A650-Q653 PolarHBondContact O-N 3.01Å
654	R	57.7	Low	61.1	Low	178 Å²	178	83.8 Å²	83.8	67%	0.672	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-71.1	132.7	171.3	-62.9	-178	-176.4	-172.6	-1.3	109.5	Q546	Q546-R654 PolarHBondContact NE2-O 3.15Å; Q546-R654 PolarHBondContact OE1-O 2.89Å
655	P	57.1	Low	59.6	Low	68 Å²	68	86.5 Å²	86.5	44%	0.442	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-58.3	135.3	178.4	-26.4	35.2	0	0	0	113.2	Q546 V657	Q546-P655 VanDerWaalsContact OE1-CA 3.29Å; P655-V657 VanDerWaalsContact C-N 3.34Å; P655-V657 PolarHBondContact O-N 2.8Å
656	L	57.6	Low	57.8	Low	16 Å²	16	90.4 Å²	90.4	8%	0.084	46%	0.459	C	S	.	.	S	Bend	trans	-71	-24.2	-177.8	-75.1	165.4	0	0	0	114.8	Q546 T548 A582 V583 H658	Q546-L656 HydrophobicContact CB-CD1 3.89Å; Q546-L656 VanDerWaalsContact OE1-CG 3.28Å; T548-L656 HydrophobicContact CG2-CD1 3.87Å; A582-L656 HydrophobicContact CB-CD2 3.77Å; A582-L656 WeakPolarHBondContact O-CD2 3.41Å; V583-L656 HydrophobicContact CB-CD1 4.3Å; V583-L656 HydrophobicContact CG1-CD1 4.39Å; V583-L656 HydrophobicContact CG2-CD1 4.09Å; V583-L656 HydrophobicContact CG2-CD2 4.41Å; L656-H658 VanDerWaalsContact C-N 3.35Å; L656-H658 PolarHBondContact O-N 2.82Å
657	V	48.2	Very low	56.2	Low	61 Å²	61	86.2 Å²	86.2	37%	0.37	45%	0.447	S	S	.	.			trans	-78.3	87.2	-173.9	-174.6	0	0	0	0	109.3	V549 P655 H659	V549-V657 HydrophobicContact CG2-CG2 4.13Å; P655-V657 VanDerWaalsContact C-N 3.34Å; P655-V657 PolarHBondContact O-N 2.8Å; V657-H659 VanDerWaalsContact CG1-CD2 3.4Å; V657-H659 WeakPolarHBondContact CG1-CD2 3.45Å
658	H	40.1	Very low	54.8	Low	130 Å²	130	85.4 Å²	85.4	60%	0.602	44%	0.438	S	S	*	.			trans	-100.1	77.4	179.6	-126.4	-53.5	0	0	0	109.5	L656 A660	L656-H658 VanDerWaalsContact C-N 3.35Å; L656-H658 PolarHBondContact O-N 2.82Å; H658-A660 VanDerWaalsContact C-N 3.27Å; H658-A660 PolarHBondContact O-N 2.78Å
659	H	34.3	Very low	54	Low	102 Å²	102	91.2 Å²	91.2	47%	0.472	46%	0.462	S	S	.	.			trans	-80.2	80.4	165.9	-69.6	-78.6	0	0	0	108.9	V657 R661 E666	V657-H659 VanDerWaalsContact CG1-CD2 3.4Å; V657-H659 WeakPolarHBondContact CG1-CD2 3.45Å; H659-R661 PolarHBondContact O-N 2.86Å; H659-E666 IonicContact CD2-OE2 2.87Å; H659-E666 IonicContact CE1-OE2 3.61Å; H659-E666 IonicContact CG-OE2 3.56Å; H659-E666 VanDerWaalsContact CG-OE2 3.22Å; H659-E666 IonicContact ND1-OE2 3.42Å; H659-E666 PolarHBondContact ND1-OE2 3.17Å; H659-E666 IonicContact NE2-OE2 3.45Å
660	A	33.8	Very low	53.1	Low	78 Å²	78	93.6 Å²	93.6	65%	0.645	48%	0.481	S	S	*	.			trans	-64.3	122.2	166.2	0	0	0	0	0	108.7	H658	H658-A660 VanDerWaalsContact C-N 3.27Å; H658-A660 PolarHBondContact O-N 2.78Å
661	R	35.1	Very low	52.6	Low	242 Å²	242	93.5 Å²	93.5	91%	0.913	48%	0.479	S	S	*	.	S	Bend	trans	88.4	85.7	179.6	-60.1	-179.7	171.5	166.1	0	115.7	H659	H659-R661 PolarHBondContact O-N 2.86Å
662	K	40.9	Very low	53	Low	158 Å²	158	91.4 Å²	91.4	69%	0.687	46%	0.457	S	S	*	.			trans	92.7	50.6	170.6	-55.8	177.2	-179.1	170.2	0	116.2	D664 K665	K662-D664 PolarHBondContact O-N 2.78Å; K662-D664 VanDerWaalsContact O-N 3.15Å; K662-K665 PolarHBondContact O-N 2.79Å
663	P	42.7	Very low	53.1	Low	41 Å²	41	90.7 Å²	90.7	27%	0.266	45%	0.446	S	S	.	.	H	α-helix	trans	-54.1	-33.1	177.3	23.4	-33.6	0	0	0	113.4	K665 E666 L667	P663-K665 PolarHBondContact O-N 3.32Å; P663-E666 PolarHBondContact O-N 3.42Å; P663-L667 VanDerWaalsContact O-CB 3.25Å; P663-L667 WeakPolarHBondContact O-CB 3.27Å; P663-L667 PolarHBondContact O-N 3.2Å
664	D	52	Low	53	Low	111 Å²	111	91.3 Å²	91.3	59%	0.594	45%	0.45	S	S	*	.	H	α-helix	trans	-57.8	-46.2	-174.4	-56.1	-18.6	0	0	0	112.5	K662 D668	K662-D664 PolarHBondContact O-N 2.78Å; K662-D664 VanDerWaalsContact O-N 3.15Å; D664-D668 WeakPolarHBondContact O-CB 3.24Å; D664-D668 PolarHBondContact O-N 2.95Å; D664-D668 VanDerWaalsContact O-OD2 3.13Å
665	K	56.8	Low	53.3	Low	159 Å²	159	83.4 Å²	83.4	69%	0.691	42%	0.421	S	S	*	.	H	α-helix	trans	-72.7	-37.1	-173.8	-72	-167.3	176.6	-168.1	0	114.1	K662 P663 K669	K662-K665 PolarHBondContact O-N 2.79Å; P663-K665 PolarHBondContact O-N 3.32Å; K665-K669 VanDerWaalsContact O-CB 3.31Å; K665-K669 WeakPolarHBondContact O-CB 3.37Å; K665-K669 PolarHBondContact O-N 2.9Å
666	E	52.2	Low	54	Low	86 Å²	86	80.7 Å²	80.7	40%	0.402	40%	0.403	S	S	.	.	H	α-helix	trans	-77.1	-40.1	-179.8	-69.4	-169.8	149.7	0	0	111.2	H659 P663 K669 A670	H659-E666 IonicContact CD2-OE2 2.87Å; H659-E666 IonicContact CE1-OE2 3.61Å; H659-E666 IonicContact CG-OE2 3.56Å; H659-E666 VanDerWaalsContact CG-OE2 3.22Å; H659-E666 IonicContact ND1-OE2 3.42Å; H659-E666 PolarHBondContact ND1-OE2 3.17Å; H659-E666 IonicContact NE2-OE2 3.45Å; P663-E666 PolarHBondContact O-N 3.42Å; E666-K669 PolarHBondContact O-N 2.81Å; E666-A670 WeakPolarHBondContact O-CB 3.35Å; E666-A670 PolarHBondContact O-N 2.73Å
667	L	56.2	Low	54.6	Low	48 Å²	48	84.2 Å²	84.2	25%	0.251	42%	0.417	S	S	.	.	H	α-helix	trans	-60.9	-47.4	170.9	-178.6	62.7	0	0	0	110	F475 P663 K669 A670 V671	F475-L667 HydrophobicContact CE1-CD1 4.09Å; P663-L667 VanDerWaalsContact O-CB 3.25Å; P663-L667 WeakPolarHBondContact O-CB 3.27Å; P663-L667 PolarHBondContact O-N 3.2Å; L667-K669 VanDerWaalsContact C-N 3.29Å; L667-K669 PolarHBondContact O-N 2.7Å; L667-A670 PolarHBondContact O-N 3.33Å; L667-V671 HydrophobicContact CD1-CG2 4.07Å; L667-V671 HydrophobicContact CG-CG2 4.24Å; L667-V671 WeakPolarHBondContact O-CB 3.2Å; L667-V671 WeakPolarHBondContact O-CG2 3.37Å; L667-V671 PolarHBondContact O-N 3.33Å
668	D	61.6	Low	55.5	Low	65 Å²	65	81.9 Å²	81.9	35%	0.348	40%	0.403	S	S	.	.	H	α-helix	trans	-56.7	-43.5	176	-74.3	-16.3	0	0	0	111.3	D664 L672	D664-D668 WeakPolarHBondContact O-CB 3.24Å; D664-D668 PolarHBondContact O-N 2.95Å; D664-D668 VanDerWaalsContact O-OD2 3.13Å; D668-L672 WeakPolarHBondContact O-CB 3.49Å; D668-L672 PolarHBondContact O-N 3.16Å
669	K	64.1	Low	56.9	Low	159 Å²	159	76.9 Å²	76.9	69%	0.691	38%	0.38	S	S	*	.	H	α-helix	trans	-67	-44.1	178.1	-172.9	179.9	179.7	-177.9	0	112.2	K665 E666 L667 L672 D673	K665-K669 VanDerWaalsContact O-CB 3.31Å; K665-K669 WeakPolarHBondContact O-CB 3.37Å; K665-K669 PolarHBondContact O-N 2.9Å; E666-K669 PolarHBondContact O-N 2.81Å; L667-K669 VanDerWaalsContact C-N 3.29Å; L667-K669 PolarHBondContact O-N 2.7Å; K669-L672 PolarHBondContact O-N 2.84Å; K669-D673 PolarHBondContact O-N 2.8Å
670	A	59.8	Low	58.8	Low	59 Å²	59	72.8 Å²	72.8	49%	0.488	36%	0.362	S	S	.	.	H	α-helix	trans	-65.6	-41.2	178.4	0	0	0	0	0	111.6	E666 L667 L674	E666-A670 WeakPolarHBondContact O-CB 3.35Å; E666-A670 PolarHBondContact O-N 2.73Å; L667-A670 PolarHBondContact O-N 3.33Å; A670-L674 WeakPolarHBondContact O-CB 3.37Å; A670-L674 PolarHBondContact O-N 2.71Å
671	V	62.3	Low	60.7	Low	10 Å²	10	69.9 Å²	69.9	6%	0.061	33%	0.334	C	S	.	.	H	α-helix	trans	-59.8	-48.7	172.1	156.5	0	0	0	0	110.3	S324 F326 M472 L667 D673 L674 E675	S324-V671 VanDerWaalsContact OG-CG1 3.27Å; S324-V671 WeakPolarHBondContact OG-CG1 3.22Å; F326-V671 HydrophobicContact CB-CG1 4.02Å; F326-V671 HydrophobicContact CD1-CG1 3.99Å; F326-V671 HydrophobicContact CG-CG1 4.36Å; M472-V671 HydrophobicContact CE-CB 3.92Å; M472-V671 HydrophobicContact CE-CG1 3.19Å; M472-V671 HydrophobicContact CE-CG2 3.79Å; L667-V671 HydrophobicContact CD1-CG2 4.07Å; L667-V671 HydrophobicContact CG-CG2 4.24Å; L667-V671 WeakPolarHBondContact O-CB 3.2Å; L667-V671 WeakPolarHBondContact O-CG2 3.37Å; L667-V671 PolarHBondContact O-N 3.33Å; V671-D673 PolarHBondContact O-N 2.99Å; V671-L674 PolarHBondContact O-N 2.85Å; V671-E675 HydrophobicContact CG1-CG 4.48Å; V671-E675 WeakPolarHBondContact O-CB 3.45Å; V671-E675 WeakPolarHBondContact O-CG 3.47Å; V671-E675 PolarHBondContact O-N 3.36Å
672	L	67.9	Low	62.3	Low	39 Å²	39	59.2 Å²	59.2	20%	0.204	29%	0.294	C	S	.	.	H	α-helix	trans	-60.6	-44.1	179.7	-172.8	67.7	0	0	0	112.4	L321 S324 D668 K669 T676	L321-L672 HydrophobicContact CB-CD1 3.62Å; L321-L672 HydrophobicContact CB-CG 4.48Å; L321-L672 WeakPolarHBondContact O-CD1 3.35Å; S324-L672 VanDerWaalsContact N-CD1 3.32Å; D668-L672 WeakPolarHBondContact O-CB 3.49Å; D668-L672 PolarHBondContact O-N 3.16Å; K669-L672 PolarHBondContact O-N 2.84Å; L672-T676 VanDerWaalsContact O-CB 3.3Å; L672-T676 WeakPolarHBondContact O-CB 3.22Å; L672-T676 PolarHBondContact O-N 2.86Å; L672-T676 PolarHBondContact O-OG1 2.73Å
673	D	66.8	Low	63.8	Low	76 Å²	76	52.4 Å²	52.4	41%	0.406	27%	0.266	S	S	.	.	H	α-helix	trans	-64.4	-42.7	177	178.8	50.1	0	0	0	111.5	K669 V671 T676 K677	K669-D673 PolarHBondContact O-N 2.8Å; V671-D673 PolarHBondContact O-N 2.99Å; D673-T676 PolarHBondContact O-N 3.06Å; D673-K677 WeakPolarHBondContact O-CG 3.47Å; D673-K677 PolarHBondContact O-N 3.28Å; D673-K677 WeakPolarHBondContact OD1-CE 3.25Å; D673-K677 IonicContact OD1-NZ 3.79Å; D673-K677 PolarHBondContact OD1-NZ 2.85Å; D673-K677 WeakPolarHBondContact OD2-CE 3.37Å; D673-K677 IonicContact OD2-NZ 2.73Å; D673-K677 PolarHBondContact OD2-NZ 2.94Å
674	L	64.9	Low	65.5	Low	31 Å²	31	50.5 Å²	50.5	16%	0.162	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-47.7	176.7	-174.6	67.9	0	0	0	111.7	P459 V461 A670 V671 T676 K677 V678	P459-L674 HydrophobicContact CB-CD2 4.11Å; P459-L674 HydrophobicContact CG-CD2 3.69Å; V461-L674 HydrophobicContact CG2-CD1 3.92Å; A670-L674 WeakPolarHBondContact O-CB 3.37Å; A670-L674 PolarHBondContact O-N 2.71Å; V671-L674 PolarHBondContact O-N 2.85Å; L674-T676 VanDerWaalsContact C-N 3.28Å; L674-T676 PolarHBondContact O-N 3.33Å; L674-K677 PolarHBondContact O-N 3.14Å; L674-V678 WeakPolarHBondContact O-CB 3.38Å; L674-V678 VanDerWaalsContact O-CG2 3.28Å; L674-V678 WeakPolarHBondContact O-CG2 3.27Å; L674-V678 PolarHBondContact O-N 2.94Å
675	E	65.6	Low	66.6	Low	13 Å²	13	45.3 Å²	45.3	6%	0.061	23%	0.227	C	C	.	.	H	α-helix	trans	-61.2	-38.4	177.1	-73.8	-178.7	124.9	0	0	111.7	L321 S324 P325 F326 M472 V671 V678 H679	L321-E675 HydrophobicContact CD1-CB 3.74Å; S324-E675 WeakPolarHBondContact CA-OE2 3.48Å; S324-E675 WeakPolarHBondContact CB-OE2 3.47Å; S324-E675 PolarHBondContact OG-OE2 2.9Å; P325-E675 WeakPolarHBondContact CD-OE1 3.39Å; P325-E675 VanDerWaalsContact CD-OE2 3.25Å; P325-E675 WeakPolarHBondContact CD-OE2 3.42Å; F326-E675 WeakPolarHBondContact CB-OE1 3.44Å; F326-E675 PolarHBondContact N-OE1 3.45Å; M472-E675 HydrophobicContact CE-CG 3.91Å; M472-E675 HydrophobicContact SD-CG 4.03Å; V671-E675 HydrophobicContact CG1-CG 4.48Å; V671-E675 WeakPolarHBondContact O-CB 3.45Å; V671-E675 WeakPolarHBondContact O-CG 3.47Å; V671-E675 PolarHBondContact O-N 3.36Å; E675-V678 PolarHBondContact O-N 3.35Å; E675-H679 VanDerWaalsContact O-CB 3.24Å; E675-H679 WeakPolarHBondContact O-CB 3.26Å; E675-H679 PolarHBondContact O-N 3.03Å
676	T	70.5	Confident	67.3	Low	10 Å²	10	40.4 Å²	40.4	6%	0.061	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-48.8	175.7	-61.8	0	0	0	0	110.8	F319 L321 L672 D673 L674 V678 H679 M680	F319-T676 HydrophobicContact CD1-CG2 4.11Å; F319-T676 WeakPolarHBondContact O-CG2 3.23Å; L321-T676 PolarHBondContact N-OG1 3.47Å; L672-T676 VanDerWaalsContact O-CB 3.3Å; L672-T676 WeakPolarHBondContact O-CB 3.22Å; L672-T676 PolarHBondContact O-N 2.86Å; L672-T676 PolarHBondContact O-OG1 2.73Å; D673-T676 PolarHBondContact O-N 3.06Å; L674-T676 VanDerWaalsContact C-N 3.28Å; L674-T676 PolarHBondContact O-N 3.33Å; T676-V678 PolarHBondContact O-N 2.98Å; T676-H679 PolarHBondContact O-N 2.93Å; T676-M680 WeakPolarHBondContact O-CB 3.27Å; T676-M680 PolarHBondContact O-N 3.4Å
677	K	70.1	Confident	68.4	Low	90 Å²	90	36.3 Å²	36.3	39%	0.391	19%	0.189	S	C	.	.	H	α-helix	trans	-62.5	-42.7	178	-76.3	169.4	-179.8	160.5	0	112.6	D673 L674 M680 Y681	D673-K677 WeakPolarHBondContact O-CG 3.47Å; D673-K677 PolarHBondContact O-N 3.28Å; D673-K677 WeakPolarHBondContact OD1-CE 3.25Å; D673-K677 IonicContact OD1-NZ 3.79Å; D673-K677 PolarHBondContact OD1-NZ 2.85Å; D673-K677 WeakPolarHBondContact OD2-CE 3.37Å; D673-K677 IonicContact OD2-NZ 2.73Å; D673-K677 PolarHBondContact OD2-NZ 2.94Å; L674-K677 PolarHBondContact O-N 3.14Å; K677-M680 PolarHBondContact O-N 3.49Å; K677-Y681 WeakPolarHBondContact O-CB 3.44Å; K677-Y681 PolarHBondContact O-N 2.9Å
678	V	67.5	Low	69.4	Low	12 Å²	12	34 Å²	34	7%	0.073	18%	0.177	C	C	.	.	H	α-helix	trans	-58.9	-53.5	174.6	159.4	0	0	0	0	110.4	V461 L674 E675 T676 M680 Y681 E682	V461-V678 HydrophobicContact CG1-CG2 4.42Å; L674-V678 WeakPolarHBondContact O-CB 3.38Å; L674-V678 VanDerWaalsContact O-CG2 3.28Å; L674-V678 WeakPolarHBondContact O-CG2 3.27Å; L674-V678 PolarHBondContact O-N 2.94Å; E675-V678 PolarHBondContact O-N 3.35Å; T676-V678 PolarHBondContact O-N 2.98Å; V678-M680 VanDerWaalsContact C-N 3.26Å; V678-M680 PolarHBondContact O-N 3.46Å; V678-Y681 WeakPolarHBondContact O-CB 2.93Å; V678-Y681 PolarHBondContact O-N 2.91Å; V678-Y681 VanDerWaalsContact O-N 3.09Å; V678-E682 WeakPolarHBondContact O-CG 3.46Å; V678-E682 PolarHBondContact O-N 3.04Å
679	H	69.4	Low	70	Confident	26 Å²	26	33.3 Å²	33.3	12%	0.12	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-39.2	-176.9	-172	67.1	0	0	0	111.5	F275 E675 T676 T683	F275-H679 AromaticContact CD2-CD2 3.99Å; E675-H679 VanDerWaalsContact O-CB 3.24Å; E675-H679 WeakPolarHBondContact O-CB 3.26Å; E675-H679 PolarHBondContact O-N 3.03Å; T676-H679 PolarHBondContact O-N 2.93Å; H679-T683 WeakPolarHBondContact O-CB 3.45Å; H679-T683 PolarHBondContact O-N 3.09Å; H679-T683 PolarHBondContact O-OG1 2.8Å
680	M	73.5	Confident	70.3	Confident	16 Å²	16	29.4 Å²	29.4	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-63.7	-46.9	173.3	-172.1	167.1	69.8	0	0	111.5	F275 L314 T676 K677 V678 E682 T683 V684 V708	F275-M680 HydrophobicContact CZ-CG 4.31Å; L314-M680 HydrophobicContact CD1-CE 4.41Å; L314-M680 HydrophobicContact CD1-CG 4.48Å; L314-M680 HydrophobicContact CD1-SD 4.12Å; T676-M680 WeakPolarHBondContact O-CB 3.27Å; T676-M680 PolarHBondContact O-N 3.4Å; K677-M680 PolarHBondContact O-N 3.49Å; V678-M680 VanDerWaalsContact C-N 3.26Å; V678-M680 PolarHBondContact O-N 3.46Å; M680-E682 VanDerWaalsContact C-N 3.34Å; M680-E682 PolarHBondContact O-N 3.13Å; M680-T683 PolarHBondContact O-N 3.48Å; M680-V684 HydrophobicContact CG-CG2 4.41Å; M680-V684 WeakPolarHBondContact O-CB 3.44Å; M680-V684 VanDerWaalsContact O-CG2 3.22Å; M680-V684 WeakPolarHBondContact O-CG2 3.47Å; M680-V684 PolarHBondContact O-N 3.39Å; M680-V708 HydrophobicContact CB-CG1 4.2Å; M680-V708 HydrophobicContact CE-CB 4.19Å; M680-V708 HydrophobicContact CE-CG1 3.43Å; M680-V708 VanDerWaalsContact CE-CG1 3.43Å; M680-V708 WeakPolarHBondContact CE-O 2.96Å; M680-V708 HydrophobicContact CG-CG1 4.13Å; M680-V708 HydrophobicContact CG-CG2 4.2Å
681	Y	74.7	Confident	70.9	Confident	16 Å²	16	28.4 Å²	28.4	6%	0.063	15%	0.148	C	C	.	.	H	α-helix	trans	-54.5	-49.9	176.4	169.6	-108.5	0	0	0	112	V461 K677 V678 V684 A685 A704 Y705	V461-Y681 HydrophobicContact CG1-CG 4.36Å; K677-Y681 WeakPolarHBondContact O-CB 3.44Å; K677-Y681 PolarHBondContact O-N 2.9Å; V678-Y681 WeakPolarHBondContact O-CB 2.93Å; V678-Y681 PolarHBondContact O-N 2.91Å; V678-Y681 VanDerWaalsContact O-N 3.09Å; Y681-V684 PolarHBondContact O-N 3.01Å; Y681-A685 HydrophobicContact CE2-CB 4.36Å; Y681-A685 WeakPolarHBondContact O-CB 3.33Å; Y681-A685 PolarHBondContact O-N 3.08Å; Y681-A704 HydrophobicContact CD2-CB 4.34Å; Y681-A704 HydrophobicContact CE2-CB 3.97Å; Y681-Y705 HydrophobicContact CD2-CD2 4.26Å; Y681-Y705 HydrophobicContact CE2-CD2 4.33Å
682	E	69.1	Low	71.3	Confident	18 Å²	18	29.6 Å²	29.6	8%	0.084	16%	0.156	C	C	.	.	H	α-helix	trans	-63.6	-48.2	-178.9	-69	-157.4	116.1	0	0	112.8	P465 V678 M680 V684 A685 L686	P465-E682 WeakPolarHBondContact CD-OE1 3.5Å; P465-E682 HydrophobicContact CG-CG 4.34Å; P465-E682 WeakPolarHBondContact CG-OE1 3.42Å; P465-E682 WeakPolarHBondContact CG-OE2 3.35Å; V678-E682 WeakPolarHBondContact O-CG 3.46Å; V678-E682 PolarHBondContact O-N 3.04Å; M680-E682 VanDerWaalsContact C-N 3.34Å; M680-E682 PolarHBondContact O-N 3.13Å; E682-V684 VanDerWaalsContact C-N 3.28Å; E682-V684 PolarHBondContact O-N 3.39Å; E682-A685 PolarHBondContact O-N 3.02Å; E682-L686 WeakPolarHBondContact O-CB 3.29Å; E682-L686 VanDerWaalsContact O-CG 3.24Å; E682-L686 WeakPolarHBondContact O-CG 3.3Å; E682-L686 PolarHBondContact O-N 3.35Å
683	T	71.9	Confident	71.1	Confident	16 Å²	16	37.6 Å²	37.6	10%	0.098	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-44	-178.4	-55.6	0	0	0	0	110.2	F275 C277 H679 M680 T687	F275-T683 HydrophobicContact CB-CG2 3.99Å; F275-T683 HydrophobicContact CD1-CG2 3.93Å; F275-T683 HydrophobicContact CG-CG2 4.21Å; C277-T683 WeakPolarHBondContact SG-CG2 3.45Å; H679-T683 WeakPolarHBondContact O-CB 3.45Å; H679-T683 PolarHBondContact O-N 3.09Å; H679-T683 PolarHBondContact O-OG1 2.8Å; M680-T683 PolarHBondContact O-N 3.48Å; T683-T687 VanDerWaalsContact O-CB 3.26Å; T683-T687 WeakPolarHBondContact O-CB 3.39Å; T683-T687 PolarHBondContact O-N 2.89Å; T683-T687 PolarHBondContact O-OG1 3.26Å
684	V	77.8	Confident	70.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-52.5	174.8	170.9	0	0	0	0	110.4	F279 L314 M680 Y681 E682 L686 T687 L688 A704 L707 V708	F279-V684 HydrophobicContact CE1-CG1 4.29Å; F279-V684 HydrophobicContact CE1-CG2 4.33Å; F279-V684 HydrophobicContact CZ-CG2 4.36Å; L314-V684 HydrophobicContact CD1-CG2 4.29Å; L314-V684 HydrophobicContact CD2-CG2 3.65Å; M680-V684 HydrophobicContact CG-CG2 4.41Å; M680-V684 WeakPolarHBondContact O-CB 3.44Å; M680-V684 VanDerWaalsContact O-CG2 3.22Å; M680-V684 WeakPolarHBondContact O-CG2 3.47Å; M680-V684 PolarHBondContact O-N 3.39Å; Y681-V684 PolarHBondContact O-N 3.01Å; E682-V684 VanDerWaalsContact C-N 3.28Å; E682-V684 PolarHBondContact O-N 3.39Å; V684-L686 VanDerWaalsContact C-N 3.34Å; V684-L686 PolarHBondContact O-N 3.12Å; V684-T687 PolarHBondContact O-N 3Å; V684-L688 HydrophobicContact CG1-CD1 3.83Å; V684-L688 HydrophobicContact CG1-CG 4.3Å; V684-L688 WeakPolarHBondContact O-CB 3.46Å; V684-L688 VanDerWaalsContact O-CG 3.22Å; V684-L688 WeakPolarHBondContact O-CG 3.48Å; V684-L688 PolarHBondContact O-N 3.14Å; V684-A704 HydrophobicContact CG1-CB 4.06Å; V684-L707 HydrophobicContact CG1-CD2 3.9Å; V684-V708 HydrophobicContact CB-CG2 3.94Å; V684-V708 HydrophobicContact CG1-CG2 4.18Å; V684-V708 HydrophobicContact CG2-CG2 3.92Å
685	A	75.9	Confident	70.3	Confident	3 Å²	3	40.7 Å²	40.7	3%	0.025	22%	0.222	C	C	.	.	H	α-helix	trans	-58.9	-43.1	-177.9	0	0	0	0	0	112.2	Y681 E682 K689 A704	Y681-A685 HydrophobicContact CE2-CB 4.36Å; Y681-A685 WeakPolarHBondContact O-CB 3.33Å; Y681-A685 PolarHBondContact O-N 3.08Å; E682-A685 PolarHBondContact O-N 3.02Å; A685-K689 VanDerWaalsContact O-CB 3.24Å; A685-K689 WeakPolarHBondContact O-CB 3.08Å; A685-K689 WeakPolarHBondContact O-CD 3.39Å; A685-K689 WeakPolarHBondContact O-CG 3.44Å; A685-K689 PolarHBondContact O-N 3Å; A685-A704 HydrophobicContact CB-CB 3.8Å
686	L	71	Confident	69.8	Low	55 Å²	55	43.5 Å²	43.5	29%	0.288	24%	0.24	S	C	.	.	H	α-helix	trans	-66.1	-44.6	177.2	-71.7	171.3	0	0	0	112.3	S242 L245 E682 V684 L688 K689 S690	S242-L686 WeakPolarHBondContact OG-CB 3.29Å; L245-L686 HydrophobicContact CD2-CD1 3.56Å; L245-L686 HydrophobicContact CD2-CG 4.5Å; L245-L686 HydrophobicContact CG-CD1 3.69Å; E682-L686 WeakPolarHBondContact O-CB 3.29Å; E682-L686 VanDerWaalsContact O-CG 3.24Å; E682-L686 WeakPolarHBondContact O-CG 3.3Å; E682-L686 PolarHBondContact O-N 3.35Å; V684-L686 VanDerWaalsContact C-N 3.34Å; V684-L686 PolarHBondContact O-N 3.12Å; L686-L688 VanDerWaalsContact C-N 3.32Å; L686-L688 PolarHBondContact O-N 3.31Å; L686-K689 PolarHBondContact O-N 3.17Å; L686-S690 WeakPolarHBondContact O-CB 3.41Å; L686-S690 PolarHBondContact O-N 3.16Å
687	T	74.8	Confident	69.5	Low	1 Å²	1	44.7 Å²	44.7	1%	0.006	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-45.2	179.8	-60.3	0	0	0	0	110.3	H240 S242 F279 T683 V684 S690 H691 L730	H240-T687 HydrophobicContact CB-CG2 3.88Å; S242-T687 PolarHBondContact OG-N 3.23Å; S242-T687 PolarHBondContact OG-OG1 3.28Å; S242-T687 VanDerWaalsContact OG-OG1 3.13Å; F279-T687 HydrophobicContact CE2-CG2 3.86Å; F279-T687 HydrophobicContact CZ-CG2 4.21Å; T683-T687 VanDerWaalsContact O-CB 3.26Å; T683-T687 WeakPolarHBondContact O-CB 3.39Å; T683-T687 PolarHBondContact O-N 2.89Å; T683-T687 PolarHBondContact O-OG1 3.26Å; V684-T687 PolarHBondContact O-N 3Å; T687-S690 PolarHBondContact O-N 3.28Å; T687-S690 PolarHBondContact O-OG 2.9Å; T687-H691 PolarHBondContact O-ND1 2.91Å; T687-L730 HydrophobicContact CG2-CD1 4.34Å
688	L	77.8	Confident	69.7	Low	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-51.6	173.9	-65.1	-178.6	0	0	0	111.4	L312 V684 L686 S690 H691 V700 F703 A704 M726 L730	L312-L688 HydrophobicContact CD2-CD2 4.3Å; V684-L688 HydrophobicContact CG1-CD1 3.83Å; V684-L688 HydrophobicContact CG1-CG 4.3Å; V684-L688 WeakPolarHBondContact O-CB 3.46Å; V684-L688 VanDerWaalsContact O-CG 3.22Å; V684-L688 WeakPolarHBondContact O-CG 3.48Å; V684-L688 PolarHBondContact O-N 3.14Å; L686-L688 VanDerWaalsContact C-N 3.32Å; L686-L688 PolarHBondContact O-N 3.31Å; L688-S690 VanDerWaalsContact C-N 3.27Å; L688-S690 PolarHBondContact O-N 2.99Å; L688-H691 PolarHBondContact O-N 3.47Å; L688-V700 HydrophobicContact CB-CG1 4.01Å; L688-F703 HydrophobicContact CD1-CD1 3.99Å; L688-F703 HydrophobicContact CD1-CE1 4.27Å; L688-A704 HydrophobicContact CD1-CB 4.09Å; L688-M726 HydrophobicContact CB-CE 3.74Å; L688-M726 HydrophobicContact CB-SD 3.63Å; L688-M726 HydrophobicContact CD1-CE 4.2Å; L688-M726 HydrophobicContact CD2-CE 3.65Å; L688-M726 HydrophobicContact CD2-SD 4.49Å; L688-M726 HydrophobicContact CG-CE 4.04Å; L688-M726 VanDerWaalsContact O-CG 3.28Å; L688-M726 WeakPolarHBondContact O-CG 3.37Å; L688-L730 HydrophobicContact CD2-CD2 4.1Å
689	K	74.1	Confident	70.3	Confident	50 Å²	50	52.1 Å²	52.1	22%	0.217	28%	0.284	C	S	.	.	H	α-helix	trans	-57.3	-36.8	179.3	-76.5	171.4	-175.1	-176.1	0	113.2	A685 L686 H691 C692 V696 V700 E701	A685-K689 VanDerWaalsContact O-CB 3.24Å; A685-K689 WeakPolarHBondContact O-CB 3.08Å; A685-K689 WeakPolarHBondContact O-CD 3.39Å; A685-K689 WeakPolarHBondContact O-CG 3.44Å; A685-K689 PolarHBondContact O-N 3Å; L686-K689 PolarHBondContact O-N 3.17Å; K689-H691 PolarHBondContact O-N 3.38Å; K689-H691 VanDerWaalsContact O-N 3.14Å; K689-C692 WeakPolarHBondContact O-CB 3.42Å; K689-C692 PolarHBondContact O-N 2.87Å; K689-V696 HydrophobicContact CB-CG2 4.49Å; K689-V696 HydrophobicContact CD-CG1 3.9Å; K689-V696 HydrophobicContact CD-CG2 4.46Å; K689-V696 HydrophobicContact CG-CG1 3.81Å; K689-V696 HydrophobicContact CG-CG2 4.19Å; K689-V700 HydrophobicContact CG-CG1 4.27Å; K689-E701 VanDerWaalsContact CE-CG 3.41Å; K689-E701 WeakPolarHBondContact CE-OE1 3.39Å; K689-E701 IonicContact NZ-OE1 3.61Å; K689-E701 PolarHBondContact NZ-OE1 2.59Å
690	S	70.2	Confident	70.8	Confident	76 Å²	76	51 Å²	51	53%	0.531	28%	0.279	S	S	.	.	H	α-helix	trans	-62.5	-19.7	179.8	72	0	0	0	0	113.6	L686 T687 L688	L686-S690 WeakPolarHBondContact O-CB 3.41Å; L686-S690 PolarHBondContact O-N 3.16Å; T687-S690 PolarHBondContact O-N 3.28Å; T687-S690 PolarHBondContact O-OG 2.9Å; L688-S690 VanDerWaalsContact C-N 3.27Å; L688-S690 PolarHBondContact O-N 2.99Å
691	H	73.7	Confident	71	Confident	39 Å²	39	52.6 Å²	52.6	18%	0.181	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	4.4	178.2	-64.8	81.6	0	0	0	113.4	T687 L688 K689 M726 L730	T687-H691 PolarHBondContact O-ND1 2.91Å; L688-H691 PolarHBondContact O-N 3.47Å; K689-H691 PolarHBondContact O-N 3.38Å; K689-H691 VanDerWaalsContact O-N 3.14Å; H691-M726 HydrophobicContact CB-CG 4.04Å; H691-L730 HydrophobicContact CB-CB 4.5Å; H691-L730 VanDerWaalsContact CE1-CD1 3.4Å; H691-L730 WeakPolarHBondContact CE1-CD1 3.27Å
692	C	70	Confident	71.4	Confident	34 Å²	34	58.3 Å²	58.3	23%	0.23	31%	0.311	C	S	.	.			trans	-79.3	121.1	173	-75.4	0	0	0	0	111.3	K689 G694 M726	K689-C692 WeakPolarHBondContact O-CB 3.42Å; K689-C692 PolarHBondContact O-N 2.87Å; C692-G694 PolarHBondContact O-N 3.48Å; C692-M726 PolarHBondContact SG-SD 3.37Å
693	R	64.7	Low	72.3	Confident	208 Å²	208	58 Å²	58	79%	0.785	31%	0.31	S	S	*	.	S	Bend	trans	-81.6	22.3	175.9	-64.1	-167.8	-172.5	-172.6	7.6	114.5	N729	R693-N729 PolarHBondContact NE-OD1 3.41Å; R693-N729 PolarHBondContact NH2-OD1 2.9Å
694	G	60.6	Low	72.8	Confident	53 Å²	53	57.3 Å²	57.3	55%	0.546	31%	0.306	S	S	.	.	S	Bend	trans	-159.1	-171.4	-173.1	0	0	0	0	0	113.8	C692 V696	C692-G694 PolarHBondContact O-N 3.48Å; G694-V696 PolarHBondContact O-N 2.75Å
695	S	54.4	Low	73	Confident	119 Å²	119	61.7 Å²	61.7	83%	0.832	32%	0.323	S	S	*	.	S	Bend	trans	-58.3	126.8	172.8	53.5	0	0	0	0	109.5	S697	S695-S697 PolarHBondContact O-N 3.49Å
696	V	54.8	Low	73.5	Confident	72 Å²	72	64.6 Å²	64.6	44%	0.436	34%	0.336	S	S	.	.			trans	-54.4	112.8	177.2	175.5	0	0	0	0	108.5	K689 G694	K689-V696 HydrophobicContact CB-CG2 4.49Å; K689-V696 HydrophobicContact CD-CG1 3.9Å; K689-V696 HydrophobicContact CD-CG2 4.46Å; K689-V696 HydrophobicContact CG-CG1 3.81Å; K689-V696 HydrophobicContact CG-CG2 4.19Å; G694-V696 PolarHBondContact O-N 2.75Å
697	S	63.2	Low	74.3	Confident	34 Å²	34	62 Å²	62	24%	0.238	32%	0.322	C	S	.	.			trans	-77.2	135.9	177.5	171.4	0	0	0	0	108.6	S695 E699 V700	S695-S697 PolarHBondContact O-N 3.49Å; S697-E699 PolarHBondContact O-N 3.31Å; S697-E699 WeakPolarHBondContact OG-CB 3.44Å; S697-E699 VanDerWaalsContact OG-CD 3.26Å; S697-E699 WeakPolarHBondContact OG-CG 3.31Å; S697-E699 PolarHBondContact OG-N 3.16Å; S697-E699 VanDerWaalsContact OG-N 3.13Å; S697-E699 PolarHBondContact OG-OE2 3.33Å; S697-V700 PolarHBondContact O-N 3.34Å
698	E	73.6	Confident	74.7	Confident	151 Å²	151	62.4 Å²	62.4	71%	0.706	33%	0.325	S	S	*	.	H	α-helix	trans	-50.2	-25.4	167.9	-172.9	174.1	-170.6	0	0	111.6	V700 E701 K702	E698-V700 PolarHBondContact O-N 3.15Å; E698-E701 PolarHBondContact O-N 2.92Å; E698-K702 WeakPolarHBondContact O-CB 3.41Å; E698-K702 PolarHBondContact O-N 3.47Å
699	E	80.2	Confident	74.8	Confident	107 Å²	107	65.7 Å²	65.7	50%	0.5	35%	0.348	S	S	.	.	H	α-helix	trans	-62.5	-36.4	173.7	-57.5	165.9	154.9	0	0	113.1	S697 K702 F703	S697-E699 PolarHBondContact O-N 3.31Å; S697-E699 WeakPolarHBondContact OG-CB 3.44Å; S697-E699 VanDerWaalsContact OG-CD 3.26Å; S697-E699 WeakPolarHBondContact OG-CG 3.31Å; S697-E699 PolarHBondContact OG-N 3.16Å; S697-E699 VanDerWaalsContact OG-N 3.13Å; S697-E699 PolarHBondContact OG-OE2 3.33Å; E699-K702 PolarHBondContact O-N 3.21Å; E699-F703 VanDerWaalsContact O-CB 3.23Å; E699-F703 WeakPolarHBondContact O-CB 3.26Å; E699-F703 PolarHBondContact O-N 3.37Å
700	V	80.2	Confident	75.3	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.012	37%	0.365	C	S	.	.	H	α-helix	trans	-70.6	-39.8	-179.9	177.5	0	0	0	0	110.3	L688 K689 S697 E698 F703 A704 V723 M726	L688-V700 HydrophobicContact CB-CG1 4.01Å; K689-V700 HydrophobicContact CG-CG1 4.27Å; S697-V700 PolarHBondContact O-N 3.34Å; E698-V700 PolarHBondContact O-N 3.15Å; V700-F703 PolarHBondContact O-N 2.93Å; V700-A704 WeakPolarHBondContact O-CB 3.39Å; V700-A704 PolarHBondContact O-N 2.89Å; V700-V723 HydrophobicContact CG2-CG2 4.36Å; V700-M726 HydrophobicContact CG1-CE 4.34Å; V700-M726 HydrophobicContact CG1-SD 3.77Å; V700-M726 HydrophobicContact CG2-SD 4.2Å
701	E	77.9	Confident	76	Confident	51 Å²	51	69.3 Å²	69.3	24%	0.238	36%	0.358	C	S	.	.	H	α-helix	trans	-65.6	-42.9	175.5	-70	-175.3	172.4	0	0	111.5	K689 E698 A704 Y705	K689-E701 VanDerWaalsContact CE-CG 3.41Å; K689-E701 WeakPolarHBondContact CE-OE1 3.39Å; K689-E701 IonicContact NZ-OE1 3.61Å; K689-E701 PolarHBondContact NZ-OE1 2.59Å; E698-E701 PolarHBondContact O-N 2.92Å; E701-A704 PolarHBondContact O-N 3.31Å; E701-Y705 WeakPolarHBondContact O-CB 3.21Å; E701-Y705 PolarHBondContact O-N 2.94Å
702	K	82.7	Confident	76.8	Confident	135 Å²	135	71 Å²	71	59%	0.587	37%	0.365	S	S	*	.	H	α-helix	trans	-63.1	-44	175.4	-174.1	178	179.3	179.6	0	111.4	E698 E699 Y705 Q706	E698-K702 WeakPolarHBondContact O-CB 3.41Å; E698-K702 PolarHBondContact O-N 3.47Å; E699-K702 PolarHBondContact O-N 3.21Å; K702-Y705 WeakPolarHBondContact O-CB 3.46Å; K702-Y705 PolarHBondContact O-N 3.22Å; K702-Q706 WeakPolarHBondContact O-CG 3.38Å; K702-Q706 PolarHBondContact O-N 2.8Å
703	F	88.3	Confident	77.8	Confident	13 Å²	13	71 Å²	71	6%	0.057	36%	0.362	C	S	.	.	H	α-helix	trans	-62.9	-44.2	176.8	179.6	-95.4	0	0	0	111.7	L312 L688 E699 V700 Y705 Q706 L707 E713 V715 V723 I727	L312-F703 HydrophobicContact CB-CZ 4.1Å; L312-F703 HydrophobicContact CD2-CE1 3.98Å; L312-F703 HydrophobicContact CD2-CZ 4.33Å; L688-F703 HydrophobicContact CD1-CD1 3.99Å; L688-F703 HydrophobicContact CD1-CE1 4.27Å; E699-F703 VanDerWaalsContact O-CB 3.23Å; E699-F703 WeakPolarHBondContact O-CB 3.26Å; E699-F703 PolarHBondContact O-N 3.37Å; V700-F703 PolarHBondContact O-N 2.93Å; F703-Y705 VanDerWaalsContact C-N 3.3Å; F703-Y705 PolarHBondContact O-N 2.91Å; F703-Q706 PolarHBondContact O-N 2.95Å; F703-L707 HydrophobicContact CE1-CD2 4.25Å; F703-L707 VanDerWaalsContact O-CB 3.3Å; F703-L707 WeakPolarHBondContact O-CB 3.49Å; F703-L707 PolarHBondContact O-N 3.33Å; F703-E713 HydrophobicContact CD2-CG 3.8Å; F703-E713 HydrophobicContact CE2-CB 3.99Å; F703-E713 HydrophobicContact CE2-CG 3.55Å; F703-E713 HydrophobicContact CZ-CB 4.32Å; F703-E713 HydrophobicContact CZ-CG 4.36Å; F703-V715 HydrophobicContact CE2-CG2 3.99Å; F703-V715 HydrophobicContact CZ-CG2 3.73Å; F703-V723 HydrophobicContact CB-CG1 4.48Å; F703-V723 HydrophobicContact CB-CG2 4.46Å; F703-V723 HydrophobicContact CD1-CG1 3.7Å; F703-V723 HydrophobicContact CD2-CG1 4.05Å; F703-V723 HydrophobicContact CE1-CG1 3.87Å; F703-V723 HydrophobicContact CE2-CG1 4.19Å; F703-V723 HydrophobicContact CG-CG1 3.8Å; F703-V723 HydrophobicContact CZ-CG1 4.12Å; F703-I727 HydrophobicContact CE1-CD1 4.2Å; F703-I727 HydrophobicContact CZ-CD1 4.2Å
704	A	83.9	Confident	79.2	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-58.7	-43.6	175.2	0	0	0	0	0	111.5	Y681 V684 A685 L688 V700 E701 L707 V708	Y681-A704 HydrophobicContact CD2-CB 4.34Å; Y681-A704 HydrophobicContact CE2-CB 3.97Å; V684-A704 HydrophobicContact CG1-CB 4.06Å; A685-A704 HydrophobicContact CB-CB 3.8Å; L688-A704 HydrophobicContact CD1-CB 4.09Å; V700-A704 WeakPolarHBondContact O-CB 3.39Å; V700-A704 PolarHBondContact O-N 2.89Å; E701-A704 PolarHBondContact O-N 3.31Å; A704-L707 PolarHBondContact O-N 3.02Å; A704-V708 WeakPolarHBondContact O-CB 3.47Å; A704-V708 WeakPolarHBondContact O-CG2 3.31Å; A704-V708 PolarHBondContact O-N 2.76Å
705	Y	81.8	Confident	80.7	Confident	92 Å²	92	62.9 Å²	62.9	36%	0.361	32%	0.317	S	S	.	.	H	α-helix	trans	-62	-46.9	177.9	179.7	-98.7	0	0	0	111.8	V461 V462 Y681 E701 K702 F703 L707 V708 S709	V461-Y705 HydrophobicContact CB-CE2 3.9Å; V461-Y705 HydrophobicContact CG1-CD2 4.11Å; V461-Y705 HydrophobicContact CG1-CE2 3.79Å; V462-Y705 HydrophobicContact CG2-CD2 4.05Å; V462-Y705 HydrophobicContact CG2-CE2 4.12Å; Y681-Y705 HydrophobicContact CD2-CD2 4.26Å; Y681-Y705 HydrophobicContact CE2-CD2 4.33Å; E701-Y705 WeakPolarHBondContact O-CB 3.21Å; E701-Y705 PolarHBondContact O-N 2.94Å; K702-Y705 WeakPolarHBondContact O-CB 3.46Å; K702-Y705 PolarHBondContact O-N 3.22Å; F703-Y705 VanDerWaalsContact C-N 3.3Å; F703-Y705 PolarHBondContact O-N 2.91Å; Y705-L707 VanDerWaalsContact C-N 3.35Å; Y705-L707 PolarHBondContact O-N 3.49Å; Y705-V708 PolarHBondContact O-N 2.79Å; Y705-S709 WeakPolarHBondContact O-CB 3.47Å; Y705-S709 PolarHBondContact O-N 2.98Å; Y705-S709 PolarHBondContact O-OG 2.72Å
706	Q	86.2	Confident	82.2	Confident	65 Å²	65	62.7 Å²	62.7	30%	0.304	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-43.2	176.7	-72	175.5	-48.5	0	0	111.7	K702 F703 V708 S709 L710 E713	K702-Q706 WeakPolarHBondContact O-CG 3.38Å; K702-Q706 PolarHBondContact O-N 2.8Å; F703-Q706 PolarHBondContact O-N 2.95Å; Q706-V708 PolarHBondContact O-N 2.9Å; Q706-S709 PolarHBondContact O-N 2.98Å; Q706-L710 WeakPolarHBondContact O-CB 3.5Å; Q706-L710 PolarHBondContact O-N 2.77Å; Q706-E713 HydrophobicContact CB-CG 3.97Å
707	L	88.2	Confident	83.6	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.5	-43.5	178.8	179.9	61.5	0	0	0	112.3	F279 L312 L314 V684 F703 A704 Y705 K711 E713	F279-L707 HydrophobicContact CE1-CD2 4.29Å; L312-L707 HydrophobicContact CB-CD1 4.37Å; L312-L707 HydrophobicContact CD2-CD2 3.66Å; L312-L707 HydrophobicContact CG-CD2 4.14Å; L312-L707 WeakPolarHBondContact O-CD1 3.27Å; L314-L707 HydrophobicContact CD1-CG 4.02Å; L314-L707 HydrophobicContact CD2-CD2 4.16Å; L314-L707 HydrophobicContact CD2-CG 4.29Å; L314-L707 HydrophobicContact CG-CD1 4.15Å; L314-L707 HydrophobicContact CG-CD2 4.27Å; L314-L707 HydrophobicContact CG-CG 3.87Å; V684-L707 HydrophobicContact CG1-CD2 3.9Å; F703-L707 HydrophobicContact CE1-CD2 4.25Å; F703-L707 VanDerWaalsContact O-CB 3.3Å; F703-L707 WeakPolarHBondContact O-CB 3.49Å; F703-L707 PolarHBondContact O-N 3.33Å; A704-L707 PolarHBondContact O-N 3.02Å; Y705-L707 VanDerWaalsContact C-N 3.35Å; Y705-L707 PolarHBondContact O-N 3.49Å; L707-K711 CarbonylContact O-C 3.54Å; L707-K711 WeakPolarHBondContact O-CA 3.44Å; L707-K711 PolarHBondContact O-N 2.85Å; L707-E713 HydrophobicContact CB-CB 4.22Å; L707-E713 HydrophobicContact CD1-CB 4.15Å
708	V	81.6	Confident	84.7	Confident	9 Å²	9	59.3 Å²	59.3	6%	0.055	30%	0.296	C	S	.	.	H	α-helix	trans	-67.7	-40	177.1	169.9	0	0	0	0	111	L314 M680 V684 A704 Y705 Q706	L314-V708 HydrophobicContact CD1-CG2 4.23Å; M680-V708 HydrophobicContact CB-CG1 4.2Å; M680-V708 HydrophobicContact CE-CB 4.19Å; M680-V708 HydrophobicContact CE-CG1 3.43Å; M680-V708 VanDerWaalsContact CE-CG1 3.43Å; M680-V708 WeakPolarHBondContact CE-O 2.96Å; M680-V708 HydrophobicContact CG-CG1 4.13Å; M680-V708 HydrophobicContact CG-CG2 4.2Å; V684-V708 HydrophobicContact CB-CG2 3.94Å; V684-V708 HydrophobicContact CG1-CG2 4.18Å; V684-V708 HydrophobicContact CG2-CG2 3.92Å; A704-V708 WeakPolarHBondContact O-CB 3.47Å; A704-V708 WeakPolarHBondContact O-CG2 3.31Å; A704-V708 PolarHBondContact O-N 2.76Å; Y705-V708 PolarHBondContact O-N 2.79Å; Q706-V708 PolarHBondContact O-N 2.9Å
709	S	80.7	Confident	85.3	Confident	69 Å²	69	53 Å²	53	48%	0.483	27%	0.269	S	S	.	.	H	α-helix	trans	-71.7	-39.7	-178.4	-56.4	0	0	0	0	112.9	Y705 Q706	Y705-S709 WeakPolarHBondContact O-CB 3.47Å; Y705-S709 PolarHBondContact O-N 2.98Å; Y705-S709 PolarHBondContact O-OG 2.72Å; Q706-S709 PolarHBondContact O-N 2.98Å
710	L	83.7	Confident	85.5	Confident	110 Å²	110	51.6 Å²	51.6	58%	0.576	28%	0.276	S	S	*	.	H	α-helix	trans	-100.5	-5.4	-173.9	-62.4	172.8	0	0	0	113.3	Q706 K712 E713	Q706-L710 WeakPolarHBondContact O-CB 3.5Å; Q706-L710 PolarHBondContact O-N 2.77Å; L710-K712 WeakPolarHBondContact CB-O 3.45Å; L710-K712 PolarHBondContact O-N 3.46Å; L710-E713 VanDerWaalsContact CD1-OE2 3.26Å; L710-E713 WeakPolarHBondContact CD1-OE2 3.48Å
711	K	85.3	Confident	85.7	Confident	92 Å²	92	52.1 Å²	52.1	40%	0.4	28%	0.28	S	S	.	.	S	Bend	trans	59.7	-17	-169.9	-59.4	-176.3	167.1	-165.5	0	115	K313 L314 A317 D318 L707	K313-K711 WeakPolarHBondContact CA-O 3.48Å; L314-K711 PolarHBondContact N-O 2.89Å; A317-K711 HydrophobicContact CB-CB 4.27Å; A317-K711 HydrophobicContact CB-CD 3.54Å; A317-K711 HydrophobicContact CB-CG 3.86Å; A317-K711 WeakPolarHBondContact O-CE 3.25Å; A317-K711 PolarHBondContact O-NZ 3.26Å; D318-K711 IonicContact OD1-NZ 2.9Å; D318-K711 PolarHBondContact OD1-NZ 2.88Å; L707-K711 CarbonylContact O-C 3.54Å; L707-K711 WeakPolarHBondContact O-CA 3.44Å; L707-K711 PolarHBondContact O-N 2.85Å
712	K	90.1	Very high	86	Confident	76 Å²	76	52.9 Å²	52.9	33%	0.33	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	129.9	178.4	177.7	177.7	67	-174.2	0	109.5	M282 L312 K313 L710	M282-K712 HydrophobicContact CE-CD 4Å; M282-K712 HydrophobicContact CE-CG 4.35Å; L312-K712 CarbonylContact O-C 3.54Å; L312-K712 WeakPolarHBondContact O-CA 3.36Å; K313-K712 HydrophobicContact CB-CB 4.23Å; K313-K712 HydrophobicContact CB-CG 4.25Å; K313-K712 HydrophobicContact CG-CB 4.43Å; L710-K712 WeakPolarHBondContact CB-O 3.45Å; L710-K712 PolarHBondContact O-N 3.46Å
713	E	92.5	Very high	86.2	Confident	34 Å²	34	47.1 Å²	47.1	16%	0.159	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.7	-179.8	-174.8	57.6	-161.2	0	0	112.2	Y311 L312 F703 Q706 L707 L710	Y311-E713 WeakPolarHBondContact CA-O 3.43Å; L312-E713 PolarHBondContact N-O 2.94Å; L312-E713 PolarHBondContact O-N 3.48Å; F703-E713 HydrophobicContact CD2-CG 3.8Å; F703-E713 HydrophobicContact CE2-CB 3.99Å; F703-E713 HydrophobicContact CE2-CG 3.55Å; F703-E713 HydrophobicContact CZ-CB 4.32Å; F703-E713 HydrophobicContact CZ-CG 4.36Å; Q706-E713 HydrophobicContact CB-CG 3.97Å; L707-E713 HydrophobicContact CB-CB 4.22Å; L707-E713 HydrophobicContact CD1-CB 4.15Å; L710-E713 VanDerWaalsContact CD1-OE2 3.26Å; L710-E713 WeakPolarHBondContact CD1-OE2 3.48Å
714	K	93.4	Very high	86.2	Confident	90 Å²	90	46.5 Å²	46.5	39%	0.391	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	129.9	177.6	-175.2	179.6	178.9	-177.9	0	110.7	Y311 V716	Y311-K714 HydrophobicContact CD1-CB 3.81Å; Y311-K714 HydrophobicContact CD1-CG 4.06Å; Y311-K714 HydrophobicContact CE1-CB 3.65Å; Y311-K714 HydrophobicContact CE1-CD 3.95Å; Y311-K714 HydrophobicContact CE1-CG 3.62Å; K714-V716 PolarHBondContact O-N 2.85Å
715	V	92	Very high	86.2	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	96	173.7	-175	0	0	0	0	108.8	W310 L312 F703 G717 G718 V723 I727	W310-V715 HydrophobicContact CB-CB 3.78Å; W310-V715 HydrophobicContact CB-CG1 4.49Å; W310-V715 HydrophobicContact CB-CG2 4.19Å; W310-V715 PolarHBondContact O-N 2.85Å; L312-V715 HydrophobicContact CB-CG2 4.38Å; F703-V715 HydrophobicContact CE2-CG2 3.99Å; F703-V715 HydrophobicContact CZ-CG2 3.73Å; V715-G717 PolarHBondContact O-N 3.26Å; V715-G718 PolarHBondContact O-N 3.15Å; V715-G718 VanDerWaalsContact O-N 3.13Å; V715-V723 HydrophobicContact CG1-CB 4.37Å; V715-V723 HydrophobicContact CG1-CG1 4.13Å; V715-I727 HydrophobicContact CB-CD1 4.39Å; V715-I727 HydrophobicContact CG1-CD1 4.07Å; V715-I727 HydrophobicContact CG2-CD1 3.38Å
716	V	85.1	Confident	86.4	Confident	115 Å²	115	48.8 Å²	48.8	70%	0.697	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.1	119.1	-177.9	-178.4	0	0	0	0	110.5	K714 S721	K714-V716 PolarHBondContact O-N 2.85Å; V716-S721 WeakPolarHBondContact O-CB 3.46Å; V716-S721 PolarHBondContact O-OG 2.99Å
717	G	84.7	Confident	86.4	Confident	35 Å²	35	45.7 Å²	45.7	36%	0.361	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	3.2	179.3	0	0	0	0	0	115.1	V715 A720	V715-G717 PolarHBondContact O-N 3.26Å; G717-A720 PolarHBondContact O-N 3.33Å
718	G	87	Confident	86.3	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	50.8	-141.9	178.8	0	0	0	0	0	112.2	P308 V715 A720 S721 G724	P308-G718 PolarHBondContact O-N 2.99Å; V715-G718 PolarHBondContact O-N 3.15Å; V715-G718 VanDerWaalsContact O-N 3.13Å; G718-A720 PolarHBondContact O-N 2.88Å; G718-A720 VanDerWaalsContact O-N 3.08Å; G718-S721 PolarHBondContact O-N 2.93Å; G718-S721 VanDerWaalsContact O-N 3.13Å; G718-S721 PolarHBondContact O-OG 3.11Å; G718-G724 VanDerWaalsContact O-CA 3.32Å; G718-G724 WeakPolarHBondContact O-CA 3.36Å
719	A	85.4	Confident	86.3	Confident	17 Å²	17	48 Å²	48	14%	0.14	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-55.7	-26	-178	0	0	0	0	0	115.3	W310 S721 R725	W310-A719 HydrophobicContact CH2-CB 3.91Å; W310-A719 HydrophobicContact CZ2-CB 3.61Å; A719-S721 VanDerWaalsContact C-N 3.33Å; A719-R725 WeakPolarHBondContact O-CG 3.21Å
720	A	84	Confident	86.3	Confident	79 Å²	79	44.7 Å²	44.7	65%	0.653	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-76.7	-21.2	-177.5	0	0	0	0	0	113.2	G717 G718 R725	G717-A720 PolarHBondContact O-N 3.33Å; G718-A720 PolarHBondContact O-N 2.88Å; G718-A720 VanDerWaalsContact O-N 3.08Å; A720-R725 PolarHBondContact O-NH1 2.94Å
721	S	85.1	Confident	86.4	Confident	13 Å²	13	39.5 Å²	39.5	9%	0.091	22%	0.218	C	C	.	.	S	Bend	trans	-75.6	156.8	-178.4	70.4	0	0	0	0	112.5	V716 G718 A719 V723 G724 R725	V716-S721 WeakPolarHBondContact O-CB 3.46Å; V716-S721 PolarHBondContact O-OG 2.99Å; G718-S721 PolarHBondContact O-N 2.93Å; G718-S721 VanDerWaalsContact O-N 3.13Å; G718-S721 PolarHBondContact O-OG 3.11Å; A719-S721 VanDerWaalsContact C-N 3.33Å; S721-V723 VanDerWaalsContact C-N 3.31Å; S721-V723 PolarHBondContact O-N 2.78Å; S721-G724 PolarHBondContact O-N 3.18Å; S721-G724 WeakPolarHBondContact OG-CA 3.4Å; S721-G724 PolarHBondContact OG-N 3.36Å; S721-R725 WeakPolarHBondContact O-CG 3.31Å; S721-R725 PolarHBondContact O-N 3.25Å
722	P	83.4	Confident	86.1	Confident	66 Å²	66	36.7 Å²	36.7	43%	0.429	21%	0.21	S	C	.	.	H	α-helix	trans	-55.8	-45.2	173.8	-24.7	34.2	0	0	0	112.7	M726	P722-M726 PolarHBondContact O-N 3.32Å; P722-M726 VanDerWaalsContact O-N 3.16Å
723	V	87.5	Confident	85.2	Confident	14 Å²	14	35.5 Å²	35.5	9%	0.085	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-43.5	176.9	179.3	0	0	0	0	110.8	V700 F703 V715 S721 M726 I727	V700-V723 HydrophobicContact CG2-CG2 4.36Å; F703-V723 HydrophobicContact CB-CG1 4.48Å; F703-V723 HydrophobicContact CB-CG2 4.46Å; F703-V723 HydrophobicContact CD1-CG1 3.7Å; F703-V723 HydrophobicContact CD2-CG1 4.05Å; F703-V723 HydrophobicContact CE1-CG1 3.87Å; F703-V723 HydrophobicContact CE2-CG1 4.19Å; F703-V723 HydrophobicContact CG-CG1 3.8Å; F703-V723 HydrophobicContact CZ-CG1 4.12Å; V715-V723 HydrophobicContact CG1-CB 4.37Å; V715-V723 HydrophobicContact CG1-CG1 4.13Å; S721-V723 VanDerWaalsContact C-N 3.31Å; S721-V723 PolarHBondContact O-N 2.78Å; V723-M726 HydrophobicContact CG1-CE 3.88Å; V723-M726 WeakPolarHBondContact O-CB 3.45Å; V723-M726 PolarHBondContact O-N 2.79Å; V723-I727 HydrophobicContact CG1-CD1 3.88Å; V723-I727 WeakPolarHBondContact O-CG1 3.46Å; V723-I727 PolarHBondContact O-N 3.47Å
724	G	88.9	Confident	83.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-68.2	-36.2	178.9	0	0	0	0	0	114	G718 S721 M726 I727 D728	G718-G724 VanDerWaalsContact O-CA 3.32Å; G718-G724 WeakPolarHBondContact O-CA 3.36Å; S721-G724 PolarHBondContact O-N 3.18Å; S721-G724 WeakPolarHBondContact OG-CA 3.4Å; S721-G724 PolarHBondContact OG-N 3.36Å; G724-M726 VanDerWaalsContact C-N 3.29Å; G724-M726 PolarHBondContact O-N 3.03Å; G724-I727 PolarHBondContact O-N 2.75Å; G724-D728 VanDerWaalsContact O-CB 3.3Å; G724-D728 WeakPolarHBondContact O-CB 3.36Å; G724-D728 PolarHBondContact O-N 3Å
725	R	84.5	Confident	81.5	Confident	138 Å²	138	38.9 Å²	38.9	52%	0.521	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-38.4	170.4	-75.7	-168.2	-71.7	-109	-0.8	112	A719 A720 S721 N729	A719-R725 WeakPolarHBondContact O-CG 3.21Å; A720-R725 PolarHBondContact O-NH1 2.94Å; S721-R725 WeakPolarHBondContact O-CG 3.31Å; S721-R725 PolarHBondContact O-N 3.25Å; R725-N729 PolarHBondContact O-N 3.4Å; R725-N729 VanDerWaalsContact O-N 3.08Å; R725-N729 PolarHBondContact O-ND2 2.79Å
726	M	84.8	Confident	78.9	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-64.8	-45.3	174.8	170.6	-160.5	73.4	0	0	110.6	L688 H691 C692 V700 P722 V723 G724 N729 L730	L688-M726 HydrophobicContact CB-CE 3.74Å; L688-M726 HydrophobicContact CB-SD 3.63Å; L688-M726 HydrophobicContact CD1-CE 4.2Å; L688-M726 HydrophobicContact CD2-CE 3.65Å; L688-M726 HydrophobicContact CD2-SD 4.49Å; L688-M726 HydrophobicContact CG-CE 4.04Å; L688-M726 VanDerWaalsContact O-CG 3.28Å; L688-M726 WeakPolarHBondContact O-CG 3.37Å; H691-M726 HydrophobicContact CB-CG 4.04Å; C692-M726 PolarHBondContact SG-SD 3.37Å; V700-M726 HydrophobicContact CG1-CE 4.34Å; V700-M726 HydrophobicContact CG1-SD 3.77Å; V700-M726 HydrophobicContact CG2-SD 4.2Å; P722-M726 PolarHBondContact O-N 3.32Å; P722-M726 VanDerWaalsContact O-N 3.16Å; V723-M726 HydrophobicContact CG1-CE 3.88Å; V723-M726 WeakPolarHBondContact O-CB 3.45Å; V723-M726 PolarHBondContact O-N 2.79Å; G724-M726 VanDerWaalsContact C-N 3.29Å; G724-M726 PolarHBondContact O-N 3.03Å; M726-N729 PolarHBondContact O-N 3.34Å; M726-L730 WeakPolarHBondContact O-CB 3.25Å; M726-L730 PolarHBondContact O-N 2.73Å
727	I	87.5	Confident	76.5	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-40.1	176.4	-67.9	169.3	0	0	0	111.4	L281 W310 L312 F703 V715 V723 G724 N729 L730 F731	L281-I727 HydrophobicContact CD1-CG2 3.87Å; L281-I727 HydrophobicContact CD2-CG2 3.75Å; L281-I727 HydrophobicContact CG-CG2 4.36Å; W310-I727 HydrophobicContact CE3-CG2 4.16Å; W310-I727 HydrophobicContact CZ3-CB 4.29Å; W310-I727 HydrophobicContact CZ3-CG2 3.93Å; L312-I727 HydrophobicContact CB-CD1 4.48Å; L312-I727 HydrophobicContact CD2-CD1 3.97Å; L312-I727 HydrophobicContact CD2-CG1 4.32Å; F703-I727 HydrophobicContact CE1-CD1 4.2Å; F703-I727 HydrophobicContact CZ-CD1 4.2Å; V715-I727 HydrophobicContact CB-CD1 4.39Å; V715-I727 HydrophobicContact CG1-CD1 4.07Å; V715-I727 HydrophobicContact CG2-CD1 3.38Å; V723-I727 HydrophobicContact CG1-CD1 3.88Å; V723-I727 WeakPolarHBondContact O-CG1 3.46Å; V723-I727 PolarHBondContact O-N 3.47Å; G724-I727 PolarHBondContact O-N 2.75Å; I727-N729 VanDerWaalsContact C-N 3.31Å; I727-N729 PolarHBondContact O-N 3.01Å; I727-L730 WeakPolarHBondContact O-CB 3.33Å; I727-L730 PolarHBondContact O-N 3.21Å; I727-L730 VanDerWaalsContact O-N 3.08Å; I727-F731 HydrophobicContact CG2-CD2 3.87Å; I727-F731 HydrophobicContact CG2-CE2 4.16Å; I727-F731 WeakPolarHBondContact O-CD2 3.38Å; I727-F731 PolarHBondContact O-N 2.89Å
728	D	85.9	Confident	73.8	Confident	26 Å²	26	50.7 Å²	50.7	14%	0.139	29%	0.291	C	S	.	.	H	α-helix	trans	-60.3	-40.6	175.2	-173.7	63.5	0	0	0	111.7	W310 G724 S732 L733 S734	W310-D728 HydrophobicContact CH2-CB 4.07Å; W310-D728 HydrophobicContact CZ3-CB 4.37Å; G724-D728 VanDerWaalsContact O-CB 3.3Å; G724-D728 WeakPolarHBondContact O-CB 3.36Å; G724-D728 PolarHBondContact O-N 3Å; D728-S732 WeakPolarHBondContact O-CA 3.48Å; D728-S732 PolarHBondContact O-N 3.38Å; D728-L733 PolarHBondContact O-N 3.38Å; D728-L733 WeakPolarHBondContact OD1-CB 3.34Å; D728-S734 WeakPolarHBondContact OD2-CB 3.42Å; D728-S734 PolarHBondContact OD2-OG 3.47Å
729	N	81	Confident	71	Confident	30 Å²	30	61.5 Å²	61.5	16%	0.16	33%	0.332	C	S	.	.	H	α-helix	trans	-68.9	-35.8	172.5	-76.8	-73.3	0	0	0	112.4	R693 R725 M726 I727 S732	R693-N729 PolarHBondContact NE-OD1 3.41Å; R693-N729 PolarHBondContact NH2-OD1 2.9Å; R725-N729 PolarHBondContact O-N 3.4Å; R725-N729 VanDerWaalsContact O-N 3.08Å; R725-N729 PolarHBondContact O-ND2 2.79Å; M726-N729 PolarHBondContact O-N 3.34Å; I727-N729 VanDerWaalsContact C-N 3.31Å; I727-N729 PolarHBondContact O-N 3.01Å; N729-S732 PolarHBondContact O-N 2.67Å
730	L	81.2	Confident	68.3	Low	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-64.9	-46.7	178.3	177.6	66.6	0	0	0	111	L237 T687 L688 H691 M726 I727 S732 N750	L237-L730 HydrophobicContact CD2-CD1 3.67Å; L237-L730 HydrophobicContact CD2-CD2 4.16Å; L237-L730 HydrophobicContact CD2-CG 3.56Å; T687-L730 HydrophobicContact CG2-CD1 4.34Å; L688-L730 HydrophobicContact CD2-CD2 4.1Å; H691-L730 HydrophobicContact CB-CB 4.5Å; H691-L730 VanDerWaalsContact CE1-CD1 3.4Å; H691-L730 WeakPolarHBondContact CE1-CD1 3.27Å; M726-L730 WeakPolarHBondContact O-CB 3.25Å; M726-L730 PolarHBondContact O-N 2.73Å; I727-L730 WeakPolarHBondContact O-CB 3.33Å; I727-L730 PolarHBondContact O-N 3.21Å; I727-L730 VanDerWaalsContact O-N 3.08Å; L730-S732 VanDerWaalsContact C-N 3.34Å; L730-N750 PolarHBondContact O-ND2 3.27Å
731	F	85	Confident	65.6	Low	1 Å²	1	69 Å²	69	0%	0.004	36%	0.364	C	S	.	.	H	α-helix	trans	-85.9	-3.3	177.5	-76.6	-100	0	0	0	113.5	Y235 L237 F279 L281 L312 I727 L733 S752	Y235-F731 WeakPolarHBondContact O-CE1 3.28Å; L237-F731 HydrophobicContact CB-CD1 4.12Å; L237-F731 HydrophobicContact CB-CE1 3.54Å; L237-F731 HydrophobicContact CB-CE2 4.45Å; L237-F731 HydrophobicContact CB-CZ 3.73Å; L237-F731 HydrophobicContact CD2-CE2 4.38Å; L237-F731 HydrophobicContact CD2-CZ 4.46Å; F279-F731 HydrophobicContact CB-CE2 4.18Å; F279-F731 HydrophobicContact CB-CZ 3.73Å; L281-F731 HydrophobicContact CB-CD1 4Å; L281-F731 HydrophobicContact CB-CD2 4.13Å; L281-F731 HydrophobicContact CB-CE1 3.58Å; L281-F731 HydrophobicContact CB-CE2 3.74Å; L281-F731 HydrophobicContact CB-CG 4.26Å; L281-F731 HydrophobicContact CB-CZ 3.44Å; L281-F731 VanDerWaalsContact CB-CZ 3.44Å; L281-F731 HydrophobicContact CD2-CB 4.24Å; L281-F731 HydrophobicContact CD2-CD1 4.22Å; L281-F731 HydrophobicContact CD2-CD2 3.87Å; L281-F731 HydrophobicContact CD2-CE2 4.29Å; L281-F731 HydrophobicContact CD2-CG 3.84Å; L312-F731 HydrophobicContact CD1-CE2 3.86Å; L312-F731 HydrophobicContact CD1-CZ 4.12Å; I727-F731 HydrophobicContact CG2-CD2 3.87Å; I727-F731 HydrophobicContact CG2-CE2 4.16Å; I727-F731 WeakPolarHBondContact O-CD2 3.38Å; I727-F731 PolarHBondContact O-N 2.89Å; F731-L733 HydrophobicContact CB-CD1 4.43Å; F731-L733 HydrophobicContact CB-CD2 4.08Å; F731-L733 HydrophobicContact CB-CG 3.84Å; F731-L733 PolarHBondContact O-N 3.09Å; F731-L733 VanDerWaalsContact O-N 3.07Å; F731-S752 PolarHBondContact O-OG 3.19Å
732	S	78.5	Confident	63	Low	33 Å²	33	76 Å²	76	23%	0.231	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	28.7	-178.4	-62.3	0	0	0	0	115.2	D728 N729 L730 S734 K735	D728-S732 WeakPolarHBondContact O-CA 3.48Å; D728-S732 PolarHBondContact O-N 3.38Å; N729-S732 PolarHBondContact O-N 2.67Å; L730-S732 VanDerWaalsContact C-N 3.34Å; S732-S734 PolarHBondContact O-N 3.11Å; S732-S734 VanDerWaalsContact O-N 3.11Å; S732-K735 PolarHBondContact O-N 2.82Å
733	L	71.3	Confident	60.4	Low	51 Å²	51	80.6 Å²	80.6	27%	0.267	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.1	-173.8	-57.1	171.7	0	0	0	113.3	Y235 L281 I283 A304 W310 D728 F731	Y235-L733 HydrophobicContact CD1-CD2 4.06Å; Y235-L733 HydrophobicContact CD2-CD2 4.24Å; Y235-L733 HydrophobicContact CE1-CD2 4.02Å; Y235-L733 HydrophobicContact CE2-CD2 4.21Å; Y235-L733 HydrophobicContact CG-CD2 4.17Å; L281-L733 HydrophobicContact CD2-CD1 3.74Å; I283-L733 HydrophobicContact CD1-CD1 3.9Å; A304-L733 HydrophobicContact CB-CD1 4.05Å; W310-L733 HydrophobicContact CH2-CD1 3.88Å; W310-L733 HydrophobicContact CZ2-CD1 4.38Å; W310-L733 HydrophobicContact CZ3-CD1 4.49Å; D728-L733 PolarHBondContact O-N 3.38Å; D728-L733 WeakPolarHBondContact OD1-CB 3.34Å; F731-L733 HydrophobicContact CB-CD1 4.43Å; F731-L733 HydrophobicContact CB-CD2 4.08Å; F731-L733 HydrophobicContact CB-CG 3.84Å; F731-L733 PolarHBondContact O-N 3.09Å; F731-L733 VanDerWaalsContact O-N 3.07Å
734	S	56.4	Low	57.5	Low	73 Å²	73	86.9 Å²	86.9	51%	0.51	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-3.7	-176.1	54.2	0	0	0	0	114.9	D728 S732 P736	D728-S734 WeakPolarHBondContact OD2-CB 3.42Å; D728-S734 PolarHBondContact OD2-OG 3.47Å; S732-S734 PolarHBondContact O-N 3.11Å; S732-S734 VanDerWaalsContact O-N 3.11Å; S734-P736 WeakPolarHBondContact O-CD 3.45Å
735	K	51.4	Low	54.5	Low	122 Å²	122	97.1 Å²	97.1	53%	0.53	48%	0.484	S	S	.	.			trans	-94.2	115.6	179.4	-71.6	-177.7	-177.6	172	0	110.5	S732 S737	S732-K735 PolarHBondContact O-N 2.82Å; K735-S737 PolarHBondContact O-N 3.45Å
736	P	37.6	Very low	51.8	Low	103 Å²	103	97.4 Å²	97.4	67%	0.669	50%	0.501	S	S	*	.			trans	-59.8	137.6	163.6	24.7	-29.5	0	0	0	108.6	S734 E738	S734-P736 WeakPolarHBondContact O-CD 3.45Å; P736-E738 PolarHBondContact O-N 3.07Å
737	S	34.6	Very low	49.3	Very low	123 Å²	123	102.7 Å²	102.7	86%	0.86	53%	0.533	S	S	*	.			trans	-62.1	82	-179.9	-170.5	0	0	0	0	110.6	K735	K735-S737 PolarHBondContact O-N 3.45Å
738	E	28.7	Very low	46.9	Very low	172 Å²	172	105.9 Å²	105.9	80%	0.804	56%	0.559	S	S	*	*			trans	-78.7	118.8	168.4	-77.3	-175.6	166.5	0	0	108.1	P736	P736-E738 PolarHBondContact O-N 3.07Å
739	R	28.1	Very low	44.7	Very low	228 Å²	228	111.2 Å²	111.2	86%	0.86	58%	0.583	S	S	*	*			trans	-59.1	135.6	174.8	-77	180	175	173.2	-1.4	109.2	D741	R739-D741 PolarHBondContact O-N 3.37Å; R739-D741 VanDerWaalsContact O-N 3.11Å
740	P	29.2	Very low	43.3	Very low	102 Å²	102	110.9 Å²	110.9	66%	0.662	58%	0.582	S	S	*	*			trans	-74.2	109.1	-171.2	28.2	-32	0	0	0	110.6
741	D	27.7	Very low	42.4	Very low	150 Å²	150	117.4 Å²	117.4	80%	0.802	62%	0.616	S	S	*	*			trans	-77.1	119.1	160.9	-80.7	-28.3	0	0	0	109.3	R739	R739-D741 PolarHBondContact O-N 3.37Å; R739-D741 VanDerWaalsContact O-N 3.11Å
742	H	29	Very low	41.7	Very low	160 Å²	160	119 Å²	119	74%	0.741	63%	0.628	S	S	*	*	S	Bend	trans	44.8	114.4	152.6	-69	-76.5	0	0	0	120.6
743	E	29.4	Very low	41.9	Very low	164 Å²	164	119.9 Å²	119.9	77%	0.766	64%	0.637	S	S	*	*	S	Bend	trans	56.5	80.3	139	-61.4	-175.1	-178.4	0	0	117.4
744	N	27.5	Very low	42.7	Very low	145 Å²	145	120 Å²	120	78%	0.775	64%	0.638	S	S	*	*	S	Bend		157.1	136.3	124.1	-81.9	-52.7	0	0	0	109.4
745	Y	26.3	Very low	44.3	Very low	216 Å²	216	117.6 Å²	117.6	85%	0.847	62%	0.619	S	S	*	*			trans	77.5	93.1	-174.6	-61.5	-86.9	0	0	0	115	V747	Y745-V747 PolarHBondContact O-N 3.02Å
746	V	26.3	Very low	46.2	Very low	144 Å²	144	112.5 Å²	112.5	87%	0.873	60%	0.597	S	S	*	*			trans	-63.7	80.9	158.2	-175.1	0	0	0	0	107.8
747	V	32.1	Very low	48.9	Very low	114 Å²	114	108.4 Å²	108.4	69%	0.691	57%	0.569	S	S	*	*			trans	-77.6	115.9	152.5	-178.1	0	0	0	0	103.5	Y745 Q749	Y745-V747 PolarHBondContact O-N 3.02Å; V747-Q749 PolarHBondContact O-N 2.77Å
748	A	37.2	Very low	51.8	Low	67 Å²	67	102.7 Å²	102.7	55%	0.554	53%	0.529	S	S	*	.			trans	-46.3	128.3	174.2	0	0	0	0	0	108.2	N750	A748-N750 PolarHBondContact O-N 3.19Å; A748-N750 PolarHBondContact O-OD1 2.75Å; A748-N750 VanDerWaalsContact O-OD1 3.12Å
749	Q	39.9	Very low	54.9	Low	137 Å²	137	95 Å²	95	64%	0.64	49%	0.492	S	S	*	.			trans	-59.5	114.9	171.8	-79.9	174.8	-35.1	0	0	106.4	V747 D751	V747-Q749 PolarHBondContact O-N 2.77Å; Q749-D751 PolarHBondContact O-N 2.98Å
750	N	52.2	Low	58.1	Low	24 Å²	24	84.1 Å²	84.1	13%	0.128	45%	0.451	C	S	.	.			trans	-73.6	83.4	177.7	-69.7	7.5	0	0	0	107.3	L237 H240 L730 A748 S752	L237-N750 HydrophobicContact CD1-CB 4.29Å; H240-N750 PolarHBondContact CE1-OD1 3.02Å; H240-N750 VanDerWaalsContact CE1-OD1 3.24Å; L730-N750 PolarHBondContact O-ND2 3.27Å; A748-N750 PolarHBondContact O-N 3.19Å; A748-N750 PolarHBondContact O-OD1 2.75Å; A748-N750 VanDerWaalsContact O-OD1 3.12Å; N750-S752 PolarHBondContact O-N 2.95Å
751	D	61.1	Low	61.2	Low	136 Å²	136	79.2 Å²	79.2	73%	0.727	42%	0.42	S	S	*	.			trans	-76.5	80	174.4	-75.6	-12	0	0	0	108.5	Q749	Q749-D751 PolarHBondContact O-N 2.98Å
752	S	71.9	Confident	64.4	Low	35 Å²	35	73.4 Å²	73.4	25%	0.245	39%	0.387	C	S	.	.			trans	-69.8	130.4	164.3	66.5	0	0	0	0	108.9	E236 F731 N750	E236-S752 WeakPolarHBondContact O-CA 3.45Å; F731-S752 PolarHBondContact O-OG 3.19Å; N750-S752 PolarHBondContact O-N 2.95Å
753	A	82.4	Confident	67.3	Low	51 Å²	51	66.8 Å²	66.8	42%	0.421	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	136.9	177.1	0	0	0	0	0	110.3	Y235 E236 I755	Y235-A753 CarbonylContact C-O 3.13Å; Y235-A753 VanDerWaalsContact CA-O 3.27Å; Y235-A753 WeakPolarHBondContact CA-O 3.1Å; E236-A753 PolarHBondContact N-O 2.62Å; E236-A753 PolarHBondContact O-N 2.75Å; A753-I755 HydrophobicContact CB-CG2 4.38Å; A753-I755 PolarHBondContact O-N 2.73Å
754	L	87.8	Confident	70.1	Confident	55 Å²	55	62.1 Å²	62.1	29%	0.288	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	110.7	165	178.8	67	0	0	0	107.8	R233 Y235 E757 H785	R233-L754 HydrophobicContact CB-CD1 4.04Å; R233-L754 HydrophobicContact CG-CD1 4.43Å; Y235-L754 HydrophobicContact CD1-CB 4.1Å; Y235-L754 HydrophobicContact CD1-CD1 4.13Å; Y235-L754 HydrophobicContact CE1-CB 4.01Å; Y235-L754 HydrophobicContact CE1-CD1 3.79Å; Y235-L754 HydrophobicContact CE1-CG 4.44Å; Y235-L754 HydrophobicContact CE2-CD1 4.35Å; L754-E757 HydrophobicContact CD1-CG 3.97Å; L754-E757 HydrophobicContact CD2-CG 3.92Å; L754-E757 HydrophobicContact CG-CG 4.17Å; L754-H785 WeakPolarHBondContact O-CB 3.5Å
755	I	90.2	Very high	72.9	Confident	22 Å²	22	55.3 Å²	55.3	11%	0.113	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-28.1	-176	56	156.6	0	0	0	112.6	T234 E236 E280 A753 H785 K786	T234-I755 HydrophobicContact CG2-CD1 4.03Å; T234-I755 HydrophobicContact CG2-CG1 4.08Å; T234-I755 VanDerWaalsContact O-CG1 3.29Å; T234-I755 WeakPolarHBondContact O-CG1 3.42Å; T234-I755 PolarHBondContact O-N 2.86Å; E236-I755 HydrophobicContact CB-CB 4.41Å; E236-I755 HydrophobicContact CB-CD1 3.9Å; E236-I755 HydrophobicContact CB-CG1 4.03Å; E236-I755 HydrophobicContact CB-CG2 3.51Å; E236-I755 WeakPolarHBondContact OE2-CG2 3.35Å; E280-I755 HydrophobicContact CG-CD1 4.28Å; A753-I755 HydrophobicContact CB-CG2 4.38Å; A753-I755 PolarHBondContact O-N 2.73Å; I755-H785 PolarHBondContact O-N 2.71Å; I755-K786 HydrophobicContact CB-CB 4.37Å; I755-K786 HydrophobicContact CG2-CB 4.27Å; I755-K786 HydrophobicContact CG2-CD 4.29Å
756	N	91.7	Very high	75.7	Confident	14 Å²	14	46 Å²	46	8%	0.075	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	136.4	-173.6	-178.9	-91.2	0	0	0	112.6	R232 T234 E782 L783	R232-N756 PolarHBondContact NH2-OD1 2.92Å; T234-N756 PolarHBondContact N-O 3.01Å; T234-N756 PolarHBondContact O-N 3.25Å; N756-E782 WeakPolarHBondContact ND2-CG 3.26Å; N756-L783 VanDerWaalsContact CA-O 3.26Å; N756-L783 WeakPolarHBondContact CA-O 3.4Å; N756-L783 PolarHBondContact ND2-O 2.8Å
757	E	93.5	Very high	78.4	Confident	18 Å²	18	40.5 Å²	40.5	8%	0.084	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.8	168.7	-61.5	-173.8	-93.4	0	0	109.5	R232 R233 L754 Y759 E782 L783 H785	R232-E757 CarbonylContact O-C 3.58Å; R232-E757 WeakPolarHBondContact O-CA 3.47Å; R233-E757 HydrophobicContact CG-CG 4.16Å; R233-E757 IonicContact CZ-OE2 3.62Å; R233-E757 IonicContact NE-OE2 3.27Å; R233-E757 PolarHBondContact NE-OE2 3.49Å; R233-E757 IonicContact NH2-OE2 2.98Å; R233-E757 PolarHBondContact NH2-OE2 2.85Å; L754-E757 HydrophobicContact CD1-CG 3.97Å; L754-E757 HydrophobicContact CD2-CG 3.92Å; L754-E757 HydrophobicContact CG-CG 4.17Å; E757-Y759 HydrophobicContact CB-CE2 4.03Å; E757-Y759 PolarHBondContact OE2-OH 2.93Å; E757-E782 CarbonylContact O-C 3.54Å; E757-E782 VanDerWaalsContact O-CA 3.29Å; E757-E782 WeakPolarHBondContact O-CA 3.35Å; E757-L783 HydrophobicContact CB-CB 4.19Å; E757-L783 HydrophobicContact CB-CD1 4.2Å; E757-L783 HydrophobicContact CB-CG 4.26Å; E757-L783 PolarHBondContact N-O 3.34Å; E757-L783 PolarHBondContact O-N 3.18Å; E757-H785 IonicContact OE1-CD2 3.02Å; E757-H785 IonicContact OE1-CE1 2.64Å; E757-H785 IonicContact OE1-NE2 2.87Å; E757-H785 PolarHBondContact OE1-NE2 2.81Å
758	R	94.9	Very high	80.7	Confident	3 Å²	3	36.5 Å²	36.5	1%	0.011	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.6	177.1	-173.6	-176.2	-65.2	172.7	-2.8	109.8	E107 L108 E110 A231 R232 I781 E782	E107-R758 PolarHBondContact O-NH1 2.88Å; E107-R758 VanDerWaalsContact O-NH1 3.11Å; L108-R758 PolarHBondContact O-NH1 2.97Å; E110-R758 VanDerWaalsContact O-CZ 3.32Å; E110-R758 PolarHBondContact O-NH1 2.71Å; E110-R758 PolarHBondContact O-NH2 3.04Å; A231-R758 CarbonylContact C-O 3.57Å; A231-R758 WeakPolarHBondContact CA-O 3.4Å; R232-R758 HydrophobicContact CB-CB 4.28Å; R232-R758 PolarHBondContact N-O 3.44Å; R232-R758 VanDerWaalsContact NH2-CZ 3.34Å; R232-R758 PolarHBondContact O-N 3.33Å; R758-I781 CarbonylContact C-O 2.86Å; R758-I781 VanDerWaalsContact CA-O 3.26Å; R758-I781 WeakPolarHBondContact CA-O 3.14Å; R758-E782 IonicContact CZ-OE1 3.8Å; R758-E782 VanDerWaalsContact CZ-OE1 3.24Å; R758-E782 IonicContact NE-OE1 2.91Å; R758-E782 PolarHBondContact NE-OE1 2.69Å; R758-E782 IonicContact NH2-OE1 3.58Å; R758-E782 PolarHBondContact NH2-OE1 3Å
759	Y	94.7	Very high	82.7	Confident	9 Å²	9	33.9 Å²	33.9	4%	0.035	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	135.5	172.5	-57.1	-85.7	0	0	0	109.4	L206 V229 S230 A231 L302 E757 C780 I781 L783	L206-Y759 HydrophobicContact CD1-CD1 3.71Å; L206-Y759 HydrophobicContact CD1-CE1 3.95Å; L206-Y759 HydrophobicContact CD1-CG 4.43Å; V229-Y759 HydrophobicContact CG1-CD1 4.45Å; S230-Y759 CarbonylContact O-C 3.5Å; S230-Y759 WeakPolarHBondContact O-CA 3.39Å; A231-Y759 HydrophobicContact CB-CD1 3.85Å; A231-Y759 HydrophobicContact CB-CE1 4.01Å; L302-Y759 HydrophobicContact CD1-CE1 4.13Å; E757-Y759 HydrophobicContact CB-CE2 4.03Å; E757-Y759 PolarHBondContact OE2-OH 2.93Å; Y759-C780 CarbonylContact O-C 3.46Å; Y759-C780 WeakPolarHBondContact O-CA 3.44Å; Y759-I781 PolarHBondContact N-O 3.34Å; Y759-I781 PolarHBondContact O-N 2.79Å; Y759-L783 HydrophobicContact CE2-CD1 4.33Å
760	I	95.4	Very high	84.5	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	108	170.3	-63.2	173.4	0	0	0	106.1	T103 L108 L116 S230 R762 R778 M779 C780	T103-I760 HydrophobicContact CG2-CB 4.44Å; T103-I760 HydrophobicContact CG2-CD1 3.75Å; T103-I760 HydrophobicContact CG2-CG2 4.41Å; L108-I760 HydrophobicContact CD2-CD1 3.82Å; L108-I760 HydrophobicContact CD2-CG1 4.33Å; L116-I760 HydrophobicContact CD1-CD1 4.48Å; S230-I760 PolarHBondContact N-O 3.13Å; S230-I760 PolarHBondContact O-N 3.22Å; I760-R762 HydrophobicContact CG2-CG 4.32Å; I760-R778 HydrophobicContact CG2-CG 4.49Å; I760-M779 CarbonylContact C-O 3.59Å; I760-M779 WeakPolarHBondContact CA-O 3.21Å; I760-C780 HydrophobicContact CG1-CB 4.42Å
761	L	94.7	Very high	85.7	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	131.1	178.4	-49	-178.3	0	0	0	108.2	L206 W209 F213 V227 V228 V229 R778 M779 I781	L206-L761 HydrophobicContact CD1-CD2 4.18Å; W209-L761 HydrophobicContact CB-CD1 4.38Å; F213-L761 HydrophobicContact CB-CD1 3.94Å; F213-L761 HydrophobicContact CD1-CB 3.83Å; F213-L761 HydrophobicContact CD1-CD1 4.13Å; F213-L761 HydrophobicContact CE1-CB 3.95Å; F213-L761 HydrophobicContact CG-CB 4.49Å; F213-L761 HydrophobicContact CG-CD1 4.24Å; V227-L761 HydrophobicContact CG1-CB 3.92Å; V227-L761 HydrophobicContact CG1-CD2 4.46Å; V228-L761 WeakPolarHBondContact O-CA 3.46Å; V229-L761 HydrophobicContact CB-CD2 4.21Å; V229-L761 HydrophobicContact CG1-CD2 3.9Å; V229-L761 HydrophobicContact CG2-CD2 3.78Å; L761-R778 CarbonylContact O-C 3.58Å; L761-R778 VanDerWaalsContact O-CA 3.31Å; L761-R778 WeakPolarHBondContact O-CA 3.48Å; L761-M779 HydrophobicContact CB-CB 4.26Å; L761-M779 HydrophobicContact CD1-CB 4.48Å; L761-M779 HydrophobicContact CD1-SD 4.35Å; L761-M779 PolarHBondContact N-O 3.49Å; L761-M779 PolarHBondContact O-N 3.43Å; L761-I781 HydrophobicContact CD1-CD1 4.01Å; L761-I781 HydrophobicContact CG-CD1 4.48Å
762	R	93.3	Very high	86.8	Confident	28 Å²	28	31.8 Å²	31.8	11%	0.106	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138	175.6	-65.1	-173.3	-59.7	111.7	12.2	109.3	C101 T103 V228 N287 I760 Q777 R778	C101-R762 VanDerWaalsContact O-CZ 3.28Å; C101-R762 PolarHBondContact O-NE 2.9Å; C101-R762 PolarHBondContact O-NH1 3.07Å; T103-R762 PolarHBondContact OG1-NE 3.18Å; V228-R762 PolarHBondContact N-O 2.98Å; V228-R762 PolarHBondContact O-N 2.84Å; N287-R762 PolarHBondContact OD1-NH2 3.05Å; I760-R762 HydrophobicContact CG2-CG 4.32Å; R762-Q777 WeakPolarHBondContact CA-O 3.36Å; R762-R778 HydrophobicContact CG-CG 4.18Å
763	W	90.5	Very high	87.2	Confident	21 Å²	21	32.1 Å²	32.1	8%	0.08	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	141.7	-179.4	-168.6	31.2	0	0	0	109.7	F213 R214 V217 S223 E225 V227 V765 Q777	F213-W763 HydrophobicContact CE1-CB 3.64Å; F213-W763 HydrophobicContact CE1-CE3 4.45Å; F213-W763 HydrophobicContact CZ-CB 4.11Å; R214-W763 HydrophobicContact CB-CZ3 4.41Å; R214-W763 HydrophobicContact CG-CH2 4.03Å; R214-W763 HydrophobicContact CG-CZ3 3.98Å; V217-W763 HydrophobicContact CB-CE3 4.31Å; V217-W763 HydrophobicContact CB-CZ3 3.93Å; V217-W763 HydrophobicContact CG1-CE3 4.07Å; V217-W763 HydrophobicContact CG1-CZ3 3.69Å; V217-W763 HydrophobicContact CG2-CE3 4.1Å; V217-W763 HydrophobicContact CG2-CZ3 4.21Å; S223-W763 WeakPolarHBondContact OG-CZ2 3.42Å; S223-W763 PolarHBondContact OG-NE1 3.21Å; E225-W763 PolarHBondContact O-NE1 3.5Å; V227-W763 HydrophobicContact CG2-CB 4.35Å; V227-W763 HydrophobicContact CG2-CD2 4.22Å; V227-W763 HydrophobicContact CG2-CG 4.1Å; W763-V765 HydrophobicContact CD2-CB 4.36Å; W763-V765 HydrophobicContact CH2-CG2 4.47Å; W763-V765 HydrophobicContact CZ2-CG2 4.33Å; W763-Q777 HydrophobicContact CB-CB 4.44Å; W763-Q777 PolarHBondContact N-O 3.08Å; W763-Q777 PolarHBondContact O-N 2.89Å
764	F	87.7	Confident	87.2	Confident	65 Å²	65	34.6 Å²	34.6	29%	0.285	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	110.1	-178.9	-154.5	-102.5	0	0	0	108.1	R774 P776	F764-R774 HydrophobicContact CD1-CB 3.7Å; F764-R774 HydrophobicContact CE1-CB 3.36Å; F764-R774 HydrophobicContact CZ-CB 4.28Å; F764-R774 WeakPolarHBondContact CZ-O 3.47Å; F764-R774 PolarHBondContact O-NH2 2.84Å; F764-P776 HydrophobicContact CD2-CB 3.84Å; F764-P776 HydrophobicContact CE2-CB 3.89Å; F764-P776 HydrophobicContact CE2-CG 4.23Å
765	V	87	Confident	87.1	Confident	3 Å²	3	32 Å²	32	2%	0.018	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	149.4	-167	73.5	0	0	0	0	111.1	V217 T219 W763 R767 R774 S775 Q777	V217-V765 HydrophobicContact CG1-CG1 3.87Å; T219-V765 HydrophobicContact CG2-CG1 4.18Å; T219-V765 HydrophobicContact CG2-CG2 3.7Å; W763-V765 HydrophobicContact CD2-CB 4.36Å; W763-V765 HydrophobicContact CH2-CG2 4.47Å; W763-V765 HydrophobicContact CZ2-CG2 4.33Å; V765-R767 HydrophobicContact CG1-CB 4.46Å; V765-R774 WeakPolarHBondContact O-CA 3.34Å; V765-S775 PolarHBondContact N-O 3.03Å; V765-S775 PolarHBondContact O-N 2.99Å; V765-S775 PolarHBondContact O-OG 3.38Å; V765-Q777 HydrophobicContact CG1-CG 3.5Å
766	A	84.5	Confident	87.1	Confident	19 Å²	19	31.1 Å²	31.1	16%	0.157	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	120.8	170.1	0	0	0	0	0	109.1	S769 S772 R774	A766-S769 CarbonylContact C-O 3.35Å; A766-S769 VanDerWaalsContact CB-O 3.28Å; A766-S769 WeakPolarHBondContact CB-O 2.95Å; A766-S772 WeakPolarHBondContact CB-O 3.37Å; A766-R774 HydrophobicContact CB-CG 4.23Å
767	R	83.3	Confident	87.1	Confident	30 Å²	30	30.5 Å²	30.5	11%	0.113	15%	0.153	C	C	.	.			trans	-141.2	135.7	-176.6	-169.7	178.3	-177.9	-120.6	-13.8	109.3	V217 T219 V765 S772 E798 D799	V217-R767 PolarHBondContact O-NE 3.37Å; T219-R767 HydrophobicContact CG2-CB 4.45Å; T219-R767 HydrophobicContact CG2-CG 4.45Å; V765-R767 HydrophobicContact CG1-CB 4.46Å; R767-S772 WeakPolarHBondContact O-CB 3.36Å; R767-E798 HydrophobicContact CG-CG 4.09Å; R767-E798 VanDerWaalsContact CZ-CG 3.44Å; R767-E798 IonicContact CZ-OE1 3.98Å; R767-E798 IonicContact NE-OE1 2.93Å; R767-E798 IonicContact NH1-OE1 2.84Å; R767-E798 PolarHBondContact NH1-OE1 3.44Å; R767-E798 IonicContact NH2-OE1 2.85Å; R767-E798 PolarHBondContact NH2-OE1 3.11Å; R767-D799 WeakPolarHBondContact O-CB 3.48Å; R767-D799 PolarHBondContact O-N 2.93Å
768	P	81.2	Confident	87.1	Confident	30 Å²	30	30 Å²	30	20%	0.195	15%	0.151	C	C	.	.	S	Bend	cis	-81.3	-16.3	8.2	32.2	-37.2	0	0	0	115.3	S772 F802 F803	P768-S772 WeakPolarHBondContact CD-OG 3.38Å; P768-F802 HydrophobicContact CG-CD1 3.89Å; P768-F802 HydrophobicContact CG-CE1 4.39Å; P768-F803 HydrophobicContact CG-CE2 4.3Å; P768-F803 HydrophobicContact CG-CZ 4.28Å
769	S	79.9	Confident	87.1	Confident	12 Å²	12	30.3 Å²	30.3	8%	0.084	15%	0.152	C	C	.	.	S	Bend	trans	-124.7	169.3	-178.5	83.7	0	0	0	0	112.3	A766 L771 S772 F802	A766-S769 CarbonylContact C-O 3.35Å; A766-S769 VanDerWaalsContact CB-O 3.28Å; A766-S769 WeakPolarHBondContact CB-O 2.95Å; S769-L771 PolarHBondContact O-N 2.82Å; S769-L771 PolarHBondContact OG-N 2.96Å; S769-S772 PolarHBondContact N-OG 2.79Å; S769-S772 VanDerWaalsContact O-CB 3.24Å; S769-S772 WeakPolarHBondContact O-CB 3.34Å; S769-S772 PolarHBondContact O-N 2.67Å; S769-S772 PolarHBondContact O-OG 2.73Å; S769-S772 PolarHBondContact OG-OG 2.77Å; S769-F802 WeakPolarHBondContact OG-CD2 3.39Å; S769-F802 WeakPolarHBondContact OG-CE2 3.03Å; S769-F802 WeakPolarHBondContact OG-CZ 3.48Å
770	N	76.5	Confident	87.2	Confident	101 Å²	101	29.9 Å²	29.9	54%	0.54	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-15	175.1	62.6	-4.4	0	0	0	113.9	E221	E221-N770 PolarHBondContact OE2-ND2 2.81Å
771	L	78.4	Confident	87.1	Confident	143 Å²	143	29.9 Å²	29.9	75%	0.749	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-17.7	175	-63.2	173.6	0	0	0	112.4	S769 F802	S769-L771 PolarHBondContact O-N 2.82Å; S769-L771 PolarHBondContact OG-N 2.96Å; L771-F802 HydrophobicContact CB-CD2 4.35Å; L771-F802 HydrophobicContact CB-CE2 4.01Å; L771-F802 HydrophobicContact CD1-CE2 4.36Å
772	S	82.4	Confident	87.1	Confident	8 Å²	8	30.1 Å²	30.1	6%	0.056	15%	0.152	C	C	.	.	S	Bend	trans	-66.5	153.9	178.5	-61	0	0	0	0	112.1	A766 R767 P768 S769 D799	A766-S772 WeakPolarHBondContact CB-O 3.37Å; R767-S772 WeakPolarHBondContact O-CB 3.36Å; P768-S772 WeakPolarHBondContact CD-OG 3.38Å; S769-S772 PolarHBondContact N-OG 2.79Å; S769-S772 VanDerWaalsContact O-CB 3.24Å; S769-S772 WeakPolarHBondContact O-CB 3.34Å; S769-S772 PolarHBondContact O-N 2.67Å; S769-S772 PolarHBondContact O-OG 2.73Å; S769-S772 PolarHBondContact OG-OG 2.77Å; S772-D799 WeakPolarHBondContact CA-OD2 3.48Å
773	C	82.1	Confident	87.1	Confident	42 Å²	42	29.2 Å²	29.2	28%	0.284	15%	0.149	S	C	.	.	P	Polyproline II helix	trans	-57.8	139.6	165.5	-74.3	0	0	0	0	110.4	R90 F187 D799	R90-C773 PolarHBondContact NH1-SG 3.03Å; F187-C773 HydrophobicContact CE1-CB 4.09Å; F187-C773 HydrophobicContact CZ-CB 4Å; C773-D799 HydrophobicContact CB-CB 4.48Å; C773-D799 WeakPolarHBondContact CB-OD2 3.49Å; C773-D799 PolarHBondContact N-OD2 2.96Å
774	R	82.6	Confident	87.1	Confident	104 Å²	104	31 Å²	31	39%	0.392	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	132.9	-179.9	-60.9	-175.4	65.9	-165.1	-6.8	109.8	F92 E225 F764 V765 A766	F92-R774 WeakPolarHBondContact CZ-O 3.14Å; E225-R774 IonicContact OE1-CZ 3.7Å; E225-R774 IonicContact OE1-NH1 3.21Å; E225-R774 PolarHBondContact OE1-NH1 2.93Å; E225-R774 IonicContact OE1-NH2 3.24Å; E225-R774 PolarHBondContact OE1-NH2 2.8Å; E225-R774 IonicContact OE2-CZ 2.76Å; E225-R774 IonicContact OE2-NH2 3.27Å; E225-R774 PolarHBondContact OE2-NH2 3.29Å; F764-R774 HydrophobicContact CD1-CB 3.7Å; F764-R774 HydrophobicContact CE1-CB 3.36Å; F764-R774 HydrophobicContact CZ-CB 4.28Å; F764-R774 WeakPolarHBondContact CZ-O 3.47Å; F764-R774 PolarHBondContact O-NH2 2.84Å; V765-R774 WeakPolarHBondContact O-CA 3.34Å; A766-R774 HydrophobicContact CB-CG 4.23Å
775	S	85.2	Confident	87.1	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	149.6	-176.8	62.3	0	0	0	0	112.3	V765 Q777 T797	V765-S775 PolarHBondContact N-O 3.03Å; V765-S775 PolarHBondContact O-N 2.99Å; V765-S775 PolarHBondContact O-OG 3.38Å; S775-Q777 PolarHBondContact O-NE2 3Å; S775-Q777 PolarHBondContact OG-NE2 2.72Å; S775-T797 PolarHBondContact OG-O 3.29Å
776	P	89.5	Confident	87	Confident	4 Å²	4	37.2 Å²	37.2	3%	0.026	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	138.1	179.1	32.1	-33.1	0	0	0	110.4	F92 M99 Q100 F764 T797	F92-P776 HydrophobicContact CD1-CG 4.43Å; F92-P776 HydrophobicContact CE1-CG 4.19Å; M99-P776 HydrophobicContact CB-CB 4.04Å; M99-P776 HydrophobicContact CB-CG 4.03Å; M99-P776 HydrophobicContact CE-CB 4.44Å; M99-P776 HydrophobicContact CE-CG 4.3Å; M99-P776 WeakPolarHBondContact CE-O 3.38Å; Q100-P776 HydrophobicContact CG-CB 4.06Å; Q100-P776 HydrophobicContact CG-CG 3.83Å; F764-P776 HydrophobicContact CD2-CB 3.84Å; F764-P776 HydrophobicContact CE2-CB 3.89Å; F764-P776 HydrophobicContact CE2-CG 4.23Å; P776-T797 WeakPolarHBondContact O-CB 3.42Å; P776-T797 PolarHBondContact O-OG1 3.13Å
777	Q	92.2	Very high	87	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	143.7	171.5	-45.6	-58.4	-42.9	0	0	107.6	F213 V217 R762 W763 V765 S775 T797	F213-Q777 HydrophobicContact CE2-CB 4.07Å; F213-Q777 HydrophobicContact CZ-CB 3.63Å; V217-Q777 HydrophobicContact CG1-CG 4.37Å; V217-Q777 HydrophobicContact CG2-CB 4.14Å; V217-Q777 HydrophobicContact CG2-CG 4.13Å; R762-Q777 WeakPolarHBondContact CA-O 3.36Å; W763-Q777 HydrophobicContact CB-CB 4.44Å; W763-Q777 PolarHBondContact N-O 3.08Å; W763-Q777 PolarHBondContact O-N 2.89Å; V765-Q777 HydrophobicContact CG1-CG 3.5Å; S775-Q777 PolarHBondContact O-NE2 3Å; S775-Q777 PolarHBondContact OG-NE2 2.72Å; Q777-T797 PolarHBondContact NE2-O 3.19Å
778	R	93.9	Very high	87.2	Confident	8 Å²	8	41.6 Å²	41.6	3%	0.03	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	139.9	178.5	-173.3	178.1	174.1	-77	4.3	111.5	M99 L116 L117 A119 I760 L761 R762 A794 S795	M99-R778 HydrophobicContact CE-CB 4.43Å; L116-R778 VanDerWaalsContact O-CZ 3.32Å; L116-R778 PolarHBondContact O-NH1 3.44Å; L116-R778 PolarHBondContact O-NH2 3.31Å; L117-R778 PolarHBondContact O-NH1 3.27Å; A119-R778 VanDerWaalsContact CB-CD 3.43Å; I760-R778 HydrophobicContact CG2-CG 4.49Å; L761-R778 CarbonylContact O-C 3.58Å; L761-R778 VanDerWaalsContact O-CA 3.31Å; L761-R778 WeakPolarHBondContact O-CA 3.48Å; R762-R778 HydrophobicContact CG-CG 4.18Å; R778-A794 CarbonylContact O-C 3.58Å; R778-A794 WeakPolarHBondContact O-CA 3.28Å; R778-S795 PolarHBondContact N-O 3.28Å; R778-S795 PolarHBondContact O-N 3.32Å
779	M	94.6	Very high	87.6	Confident	8 Å²	8	40.5 Å²	40.5	4%	0.039	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.8	168.7	-171.8	-178.9	-172.7	0	0	109.8	W209 I212 F213 I760 L761 I781 S793	W209-M779 HydrophobicContact CE3-CE 4.37Å; I212-M779 HydrophobicContact CG2-CE 3.99Å; F213-M779 HydrophobicContact CB-SD 3.76Å; F213-M779 HydrophobicContact CD2-CB 3.56Å; F213-M779 HydrophobicContact CD2-CG 4.36Å; F213-M779 HydrophobicContact CD2-SD 4.03Å; F213-M779 HydrophobicContact CE2-CB 3.76Å; F213-M779 HydrophobicContact CG-CB 4.04Å; F213-M779 HydrophobicContact CG-SD 4.17Å; F213-M779 HydrophobicContact CZ-CB 4.36Å; I760-M779 CarbonylContact C-O 3.59Å; I760-M779 WeakPolarHBondContact CA-O 3.21Å; L761-M779 HydrophobicContact CB-CB 4.26Å; L761-M779 HydrophobicContact CD1-CB 4.48Å; L761-M779 HydrophobicContact CD1-SD 4.35Å; L761-M779 PolarHBondContact N-O 3.49Å; L761-M779 PolarHBondContact O-N 3.43Å; M779-I781 HydrophobicContact CE-CD1 3.98Å; M779-I781 HydrophobicContact CE-CG1 3.88Å; M779-I781 HydrophobicContact CG-CD1 4.19Å; M779-I781 HydrophobicContact CG-CG1 4.19Å; M779-I781 HydrophobicContact SD-CD1 3.94Å; M779-I781 HydrophobicContact SD-CG1 4.3Å; M779-S793 CarbonylContact C-O 3.47Å; M779-S793 WeakPolarHBondContact CA-O 3.38Å; M779-S793 WeakPolarHBondContact CG-O 3.47Å
780	C	95.4	Very high	88.1	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.007	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.3	171.2	-173.7	0	0	0	0	109.3	Y759 I760 S792 S793	Y759-C780 CarbonylContact O-C 3.46Å; Y759-C780 WeakPolarHBondContact O-CA 3.44Å; I760-C780 HydrophobicContact CG1-CB 4.42Å; C780-S792 CarbonylContact O-C 3.52Å; C780-S792 VanDerWaalsContact O-CA 3.27Å; C780-S792 WeakPolarHBondContact O-CA 3.39Å; C780-S793 WeakPolarHBondContact CB-OG 3.44Å; C780-S793 PolarHBondContact N-O 2.85Å; C780-S793 PolarHBondContact O-N 3.06Å
781	I	94.3	Very high	88.8	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.8	178.6	-61.5	139.3	0	0	0	107.4	W209 R758 Y759 L761 M779 L783 V791	W209-I781 HydrophobicContact CB-CD1 3.81Å; W209-I781 HydrophobicContact CD2-CD1 3.64Å; W209-I781 HydrophobicContact CD2-CG1 4.24Å; W209-I781 HydrophobicContact CD2-CG2 4.13Å; W209-I781 HydrophobicContact CE3-CD1 3.4Å; W209-I781 VanDerWaalsContact CE3-CD1 3.4Å; W209-I781 HydrophobicContact CE3-CG1 3.76Å; W209-I781 HydrophobicContact CE3-CG2 4.13Å; W209-I781 HydrophobicContact CG-CD1 3.84Å; W209-I781 HydrophobicContact CH2-CG2 3.79Å; W209-I781 HydrophobicContact CZ2-CG2 3.81Å; W209-I781 HydrophobicContact CZ3-CD1 4.16Å; W209-I781 HydrophobicContact CZ3-CG1 3.99Å; W209-I781 HydrophobicContact CZ3-CG2 3.97Å; R758-I781 CarbonylContact C-O 2.86Å; R758-I781 VanDerWaalsContact CA-O 3.26Å; R758-I781 WeakPolarHBondContact CA-O 3.14Å; Y759-I781 PolarHBondContact N-O 3.34Å; Y759-I781 PolarHBondContact O-N 2.79Å; L761-I781 HydrophobicContact CD1-CD1 4.01Å; L761-I781 HydrophobicContact CG-CD1 4.48Å; M779-I781 HydrophobicContact CE-CD1 3.98Å; M779-I781 HydrophobicContact CE-CG1 3.88Å; M779-I781 HydrophobicContact CG-CD1 4.19Å; M779-I781 HydrophobicContact CG-CG1 4.19Å; M779-I781 HydrophobicContact SD-CD1 3.94Å; M779-I781 HydrophobicContact SD-CG1 4.3Å; I781-L783 HydrophobicContact CG2-CD2 3.8Å; I781-L783 HydrophobicContact CG2-CG 4.48Å; I781-V791 CarbonylContact C-O 3.51Å; I781-V791 WeakPolarHBondContact CA-O 3.19Å
782	E	93.8	Very high	89.5	Confident	4 Å²	4	30 Å²	30	2%	0.019	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	113.6	171.5	-173.6	171.2	-100.4	0	0	110.4	L112 R232 N756 E757 R758 R784 F790 V791	L112-E782 HydrophobicContact CD1-CB 3.52Å; L112-E782 HydrophobicContact CD1-CG 4Å; L112-E782 WeakPolarHBondContact CD1-OE1 3.2Å; L112-E782 WeakPolarHBondContact CD1-OE2 3.47Å; R232-E782 IonicContact NH2-OE1 3.21Å; R232-E782 PolarHBondContact NH2-OE1 2.92Å; N756-E782 WeakPolarHBondContact ND2-CG 3.26Å; E757-E782 CarbonylContact O-C 3.54Å; E757-E782 VanDerWaalsContact O-CA 3.29Å; E757-E782 WeakPolarHBondContact O-CA 3.35Å; R758-E782 IonicContact CZ-OE1 3.8Å; R758-E782 VanDerWaalsContact CZ-OE1 3.24Å; R758-E782 IonicContact NE-OE1 2.91Å; R758-E782 PolarHBondContact NE-OE1 2.69Å; R758-E782 IonicContact NH2-OE1 3.58Å; R758-E782 PolarHBondContact NH2-OE1 3Å; E782-R784 HydrophobicContact CG-CG 4.24Å; E782-R784 IonicContact OE2-CZ 2.67Å; E782-R784 VanDerWaalsContact OE2-CZ 3.27Å; E782-R784 IonicContact OE2-NE 3.46Å; E782-R784 PolarHBondContact OE2-NE 2.96Å; E782-R784 IonicContact OE2-NH2 3.45Å; E782-R784 PolarHBondContact OE2-NH2 2.75Å; E782-F790 CarbonylContact O-C 3.45Å; E782-F790 VanDerWaalsContact O-CA 3.24Å; E782-F790 WeakPolarHBondContact O-CA 3.4Å; E782-F790 WeakPolarHBondContact O-CB 3.16Å; E782-V791 PolarHBondContact N-O 3.43Å; E782-V791 PolarHBondContact O-N 2.77Å
783	L	93	Very high	90	Very high	10 Å²	10	29.7 Å²	29.7	5%	0.052	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	121.2	173.3	-45.2	-176.1	0	0	0	108	L198 L201 W209 N756 E757 Y759 I781 F790	L198-L783 HydrophobicContact CD2-CB 4.39Å; L198-L783 HydrophobicContact CD2-CD2 4.32Å; L201-L783 HydrophobicContact CD2-CD2 4.36Å; W209-L783 HydrophobicContact CH2-CD2 4.31Å; W209-L783 HydrophobicContact CZ2-CD2 3.62Å; N756-L783 VanDerWaalsContact CA-O 3.26Å; N756-L783 WeakPolarHBondContact CA-O 3.4Å; N756-L783 PolarHBondContact ND2-O 2.8Å; E757-L783 HydrophobicContact CB-CB 4.19Å; E757-L783 HydrophobicContact CB-CD1 4.2Å; E757-L783 HydrophobicContact CB-CG 4.26Å; E757-L783 PolarHBondContact N-O 3.34Å; E757-L783 PolarHBondContact O-N 3.18Å; Y759-L783 HydrophobicContact CE2-CD1 4.33Å; I781-L783 HydrophobicContact CG2-CD2 3.8Å; I781-L783 HydrophobicContact CG2-CG 4.48Å; L783-F790 HydrophobicContact CD2-CB 3.58Å; L783-F790 HydrophobicContact CD2-CG 4.29Å
784	R	91.1	Very high	90.6	Very high	58 Å²	58	28.2 Å²	28.2	22%	0.219	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	85.6	179	-75.1	-170.4	-174.5	-171.3	3.4	108.6	E782 K786 E787 G788 Y789	E782-R784 HydrophobicContact CG-CG 4.24Å; E782-R784 IonicContact OE2-CZ 2.67Å; E782-R784 VanDerWaalsContact OE2-CZ 3.27Å; E782-R784 IonicContact OE2-NE 3.46Å; E782-R784 PolarHBondContact OE2-NE 2.96Å; E782-R784 IonicContact OE2-NH2 3.45Å; E782-R784 PolarHBondContact OE2-NH2 2.75Å; R784-K786 VanDerWaalsContact C-N 3.35Å; R784-K786 PolarHBondContact O-N 3.02Å; R784-E787 HydrophobicContact CB-CB 4.3Å; R784-E787 WeakPolarHBondContact CB-OE2 3.37Å; R784-E787 PolarHBondContact O-N 3.49Å; R784-G788 PolarHBondContact O-N 2.84Å; R784-Y789 WeakPolarHBondContact CA-O 3.35Å; R784-Y789 HydrophobicContact CB-CD1 4.47Å; R784-Y789 HydrophobicContact CB-CE1 4.34Å; R784-Y789 HydrophobicContact CB-CE2 4.5Å; R784-Y789 WeakPolarHBondContact CB-O 3.5Å; R784-Y789 VanDerWaalsContact CD-CZ 3.43Å; R784-Y789 VanDerWaalsContact CD-OH 3.3Å; R784-Y789 WeakPolarHBondContact CD-OH 3.42Å; R784-Y789 PolarHBondContact N-O 3.13Å; R784-Y789 PolarHBondContact NH1-OH 3.46Å; R784-Y789 PolarHBondContact O-N 3.44Å
785	H	89.2	Confident	91.2	Very high	73 Å²	73	23.2 Å²	23.2	34%	0.338	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-37	-171.4	-69.5	-70.8	0	0	0	112.4	L754 I755 E757	L754-H785 WeakPolarHBondContact O-CB 3.5Å; I755-H785 PolarHBondContact O-N 2.71Å; E757-H785 IonicContact OE1-CD2 3.02Å; E757-H785 IonicContact OE1-CE1 2.64Å; E757-H785 IonicContact OE1-NE2 2.87Å; E757-H785 PolarHBondContact OE1-NE2 2.81Å
786	K	83.8	Confident	91.5	Very high	126 Å²	126	23.6 Å²	23.6	55%	0.548	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-37.8	179.5	-172.8	176.5	-176.4	171.2	0	111.8	E236 I755 R784	E236-K786 VanDerWaalsContact CD-NZ 3.31Å; E236-K786 IonicContact OE1-NZ 3.53Å; E236-K786 PolarHBondContact OE1-NZ 2.76Å; E236-K786 IonicContact OE2-NZ 3.21Å; E236-K786 PolarHBondContact OE2-NZ 2.91Å; I755-K786 HydrophobicContact CB-CB 4.37Å; I755-K786 HydrophobicContact CG2-CB 4.27Å; I755-K786 HydrophobicContact CG2-CD 4.29Å; R784-K786 VanDerWaalsContact C-N 3.35Å; R784-K786 PolarHBondContact O-N 3.02Å
787	E	84.8	Confident	91.6	Very high	106 Å²	106	23.4 Å²	23.4	50%	0.495	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-11.4	-178.8	-58.2	78.2	-176.9	0	0	113.4	R784 Y789	R784-E787 HydrophobicContact CB-CB 4.3Å; R784-E787 WeakPolarHBondContact CB-OE2 3.37Å; R784-E787 PolarHBondContact O-N 3.49Å; E787-Y789 HydrophobicContact CB-CD1 3.53Å; E787-Y789 HydrophobicContact CB-CE1 3.3Å; E787-Y789 HydrophobicContact CG-CE1 4.03Å
788	G	86.9	Confident	91.4	Very high	35 Å²	35	25.5 Å²	25.5	36%	0.361	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	19.6	172.6	0	0	0	0	0	115.4	L198 R784	L198-G788 PolarHBondContact N-O 2.89Å; R784-G788 PolarHBondContact O-N 2.84Å
789	Y	89.3	Confident	91	Very high	6 Å²	6	25.2 Å²	25.2	2%	0.024	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	167	-179.6	71.8	-90	0	0	0	113.1	V171 V173 R195 L196 R784 E787 V791	V171-Y789 HydrophobicContact CG1-CD1 3.52Å; V171-Y789 HydrophobicContact CG1-CE1 4.11Å; V171-Y789 HydrophobicContact CG1-CG 3.74Å; V173-Y789 HydrophobicContact CG2-CD1 4.39Å; V173-Y789 HydrophobicContact CG2-CE1 3.69Å; R195-Y789 HydrophobicContact CG-CD2 3.79Å; R195-Y789 HydrophobicContact CG-CE2 4.22Å; L196-Y789 WeakPolarHBondContact O-CA 3.21Å; L196-Y789 WeakPolarHBondContact O-CB 3.32Å; R784-Y789 WeakPolarHBondContact CA-O 3.35Å; R784-Y789 HydrophobicContact CB-CD1 4.47Å; R784-Y789 HydrophobicContact CB-CE1 4.34Å; R784-Y789 HydrophobicContact CB-CE2 4.5Å; R784-Y789 WeakPolarHBondContact CB-O 3.5Å; R784-Y789 VanDerWaalsContact CD-CZ 3.43Å; R784-Y789 VanDerWaalsContact CD-OH 3.3Å; R784-Y789 WeakPolarHBondContact CD-OH 3.42Å; R784-Y789 PolarHBondContact N-O 3.13Å; R784-Y789 PolarHBondContact NH1-OH 3.46Å; R784-Y789 PolarHBondContact O-N 3.44Å; E787-Y789 HydrophobicContact CB-CD1 3.53Å; E787-Y789 HydrophobicContact CB-CE1 3.3Å; E787-Y789 HydrophobicContact CG-CE1 4.03Å; Y789-V791 HydrophobicContact CD2-CG2 4.08Å; Y789-V791 HydrophobicContact CE2-CG2 3.75Å
790	F	90.7	Very high	90.5	Very high	11 Å²	11	26.3 Å²	26.3	5%	0.048	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	156.7	168.1	73.4	-85.3	0	0	0	111.5	R195 L196 L198 L201 W209 E782 L783	R195-F790 WeakPolarHBondContact CA-O 3.5Å; L196-F790 HydrophobicContact CB-CD1 4.24Å; L196-F790 HydrophobicContact CB-CE1 3.54Å; L196-F790 HydrophobicContact CB-CZ 3.72Å; L196-F790 HydrophobicContact CD1-CE1 4.37Å; L196-F790 HydrophobicContact CD1-CZ 3.79Å; L196-F790 HydrophobicContact CG-CZ 4.28Å; L196-F790 PolarHBondContact N-O 3.03Å; L196-F790 VanDerWaalsContact N-O 3.11Å; L196-F790 WeakPolarHBondContact O-CD1 3.25Å; L196-F790 PolarHBondContact O-N 3.43Å; L198-F790 HydrophobicContact CD2-CB 3.97Å; L198-F790 HydrophobicContact CD2-CD1 4.2Å; L201-F790 HydrophobicContact CB-CD1 4.48Å; L201-F790 HydrophobicContact CB-CE1 4.19Å; L201-F790 HydrophobicContact CD1-CD1 3.94Å; L201-F790 HydrophobicContact CD1-CE1 3.53Å; L201-F790 HydrophobicContact CD1-CE2 4.27Å; L201-F790 HydrophobicContact CD1-CG 4.43Å; L201-F790 HydrophobicContact CD1-CZ 3.71Å; L201-F790 HydrophobicContact CG-CE1 4.43Å; W209-F790 AromaticContact CH2-CD2 3.74Å; W209-F790 HydrophobicContact CH2-CD2 3.74Å; W209-F790 AromaticContact CH2-CE2 3.69Å; W209-F790 HydrophobicContact CH2-CE2 3.69Å; W209-F790 HydrophobicContact CH2-CG 4.37Å; W209-F790 HydrophobicContact CH2-CZ 4.26Å; W209-F790 HydrophobicContact CZ3-CD2 4.49Å; W209-F790 HydrophobicContact CZ3-CE2 4.21Å; E782-F790 CarbonylContact O-C 3.45Å; E782-F790 VanDerWaalsContact O-CA 3.24Å; E782-F790 WeakPolarHBondContact O-CA 3.4Å; E782-F790 WeakPolarHBondContact O-CB 3.16Å; L783-F790 HydrophobicContact CD2-CB 3.58Å; L783-F790 HydrophobicContact CD2-CG 4.29Å
791	V	91.2	Very high	89.5	Confident	8 Å²	8	27.7 Å²	27.7	5%	0.048	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134.6	173.2	176.7	0	0	0	0	107.8	L117 M193 A194 R195 I781 E782 Y789	L117-V791 HydrophobicContact CD2-CG1 4.24Å; M193-V791 HydrophobicContact CE-CG1 3.41Å; M193-V791 VanDerWaalsContact CE-CG1 3.41Å; M193-V791 HydrophobicContact CG-CG1 4.27Å; A194-V791 WeakPolarHBondContact O-CA 3.22Å; R195-V791 HydrophobicContact CG-CG2 4.07Å; I781-V791 CarbonylContact C-O 3.51Å; I781-V791 WeakPolarHBondContact CA-O 3.19Å; E782-V791 PolarHBondContact N-O 3.43Å; E782-V791 PolarHBondContact O-N 2.77Å; Y789-V791 HydrophobicContact CD2-CG2 4.08Å; Y789-V791 HydrophobicContact CE2-CG2 3.75Å
792	S	92.7	Very high	87.9	Confident	18 Å²	18	30.5 Å²	30.5	13%	0.126	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.7	168.7	59.3	0	0	0	0	109.8	M193 A194 C780	M193-S792 CarbonylContact C-O 3.59Å; M193-S792 VanDerWaalsContact CA-O 3.26Å; M193-S792 WeakPolarHBondContact CA-O 3.4Å; A194-S792 PolarHBondContact N-O 2.65Å; A194-S792 PolarHBondContact O-N 2.7Å; C780-S792 CarbonylContact O-C 3.52Å; C780-S792 VanDerWaalsContact O-CA 3.27Å; C780-S792 WeakPolarHBondContact O-CA 3.39Å
793	S	94.5	Very high	86.3	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.007	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.3	170.5	57.7	0	0	0	0	110.4	L117 E192 M779 C780	L117-S793 PolarHBondContact O-OG 3.21Å; E192-S793 CarbonylContact O-C 3.53Å; E192-S793 WeakPolarHBondContact O-CA 3.49Å; M779-S793 CarbonylContact C-O 3.47Å; M779-S793 WeakPolarHBondContact CA-O 3.38Å; M779-S793 WeakPolarHBondContact CG-O 3.47Å; C780-S793 WeakPolarHBondContact CB-OG 3.44Å; C780-S793 PolarHBondContact N-O 2.85Å; C780-S793 PolarHBondContact O-N 3.06Å
794	A	94.5	Very high	84.4	Confident	10 Å²	10	44 Å²	44	8%	0.083	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136.9	177.5	0	0	0	0	0	110.3	F191 E192 R778 L796	F191-A794 WeakPolarHBondContact CA-O 3.34Å; E192-A794 PolarHBondContact N-O 3.36Å; E192-A794 PolarHBondContact O-N 3.35Å; R778-A794 CarbonylContact O-C 3.58Å; R778-A794 WeakPolarHBondContact O-CA 3.28Å; A794-L796 HydrophobicContact CB-CD1 4.42Å; A794-L796 HydrophobicContact CB-CD2 4.29Å; A794-L796 HydrophobicContact CB-CG 4.09Å
795	S	94.5	Very high	81.9	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	104.5	170.4	-51.8	0	0	0	0	107	M99 F118 H190 F191 R778	M99-S795 VanDerWaalsContact CE-CB 3.45Å; M99-S795 WeakPolarHBondContact CE-O 3.41Å; F118-S795 WeakPolarHBondContact CA-OG 3.38Å; F118-S795 PolarHBondContact O-OG 3.36Å; H190-S795 WeakPolarHBondContact O-CA 3.23Å; F191-S795 WeakPolarHBondContact CD1-OG 3.21Å; R778-S795 PolarHBondContact N-O 3.28Å; R778-S795 PolarHBondContact O-N 3.32Å
796	L	92.7	Very high	81.5	Confident	8 Å²	8	49.9 Å²	49.9	4%	0.042	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	113.2	-170.1	-57.3	179.1	0	0	0	111	T189 H190 F213 E216 V217 A794	T189-L796 CarbonylContact C-O 3.5Å; T189-L796 WeakPolarHBondContact CA-O 3.24Å; H190-L796 PolarHBondContact N-O 3.33Å; H190-L796 PolarHBondContact O-N 3.45Å; F213-L796 HydrophobicContact CE2-CD2 4.15Å; E216-L796 HydrophobicContact CB-CD1 4.39Å; V217-L796 HydrophobicContact CG2-CD2 3.77Å; A794-L796 HydrophobicContact CB-CD1 4.42Å; A794-L796 HydrophobicContact CB-CD2 4.29Å; A794-L796 HydrophobicContact CB-CG 4.09Å
797	T	90.6	Very high	81.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	136.4	-175.2	-55.5	0	0	0	0	111.9	F92 F187 Y188 T189 S775 P776 Q777	F92-T797 HydrophobicContact CE1-CG2 4.3Å; F187-T797 HydrophobicContact CB-CG2 3.85Å; F187-T797 HydrophobicContact CD1-CG2 3.93Å; F187-T797 HydrophobicContact CG-CG2 4.16Å; Y188-T797 CarbonylContact O-C 3.51Å; Y188-T797 WeakPolarHBondContact O-CA 3.28Å; T189-T797 WeakPolarHBondContact CG2-OG1 3.23Å; T189-T797 WeakPolarHBondContact OG1-CG2 3.26Å; T189-T797 PolarHBondContact OG1-OG1 3.41Å; S775-T797 PolarHBondContact OG-O 3.29Å; P776-T797 WeakPolarHBondContact O-CB 3.42Å; P776-T797 PolarHBondContact O-OG1 3.13Å; Q777-T797 PolarHBondContact NE2-O 3.19Å
798	E	87.8	Confident	81.2	Confident	45 Å²	45	42.6 Å²	42.6	21%	0.21	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141.2	175.3	-58	179.9	-165	0	0	109.4	F187 Y188 H190 R767	F187-E798 CarbonylContact C-O 3.59Å; F187-E798 VanDerWaalsContact CA-O 3.28Å; F187-E798 WeakPolarHBondContact CA-O 3.42Å; Y188-E798 PolarHBondContact N-O 3.48Å; Y188-E798 PolarHBondContact O-N 3.31Å; H190-E798 IonicContact CE1-OE1 2.81Å; H190-E798 IonicContact ND1-OE1 3.79Å; R767-E798 HydrophobicContact CG-CG 4.09Å; R767-E798 VanDerWaalsContact CZ-CG 3.44Å; R767-E798 IonicContact CZ-OE1 3.98Å; R767-E798 IonicContact NE-OE1 2.93Å; R767-E798 IonicContact NH1-OE1 2.84Å; R767-E798 PolarHBondContact NH1-OE1 3.44Å; R767-E798 IonicContact NH2-OE1 2.85Å; R767-E798 PolarHBondContact NH2-OE1 3.11Å
799	D	86.1	Confident	80.9	Confident	2 Å²	2	43 Å²	43	1%	0.011	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	118	166.6	179.3	8.3	0	0	0	109.4	R90 S186 F187 R767 S772 C773 D801	R90-D799 IonicContact NH1-OD1 3.88Å; R90-D799 IonicContact NH1-OD2 3.94Å; S186-D799 VanDerWaalsContact O-OD1 3.11Å; F187-D799 HydrophobicContact CD1-CB 4.3Å; F187-D799 HydrophobicContact CE1-CB 4.14Å; R767-D799 WeakPolarHBondContact O-CB 3.48Å; R767-D799 PolarHBondContact O-N 2.93Å; S772-D799 WeakPolarHBondContact CA-OD2 3.48Å; C773-D799 HydrophobicContact CB-CB 4.48Å; C773-D799 WeakPolarHBondContact CB-OD2 3.49Å; C773-D799 PolarHBondContact N-OD2 2.96Å; D799-D801 WeakPolarHBondContact OD1-CB 3.44Å; D799-D801 PolarHBondContact OD1-N 2.79Å
800	T	82.8	Confident	80.4	Confident	31 Å²	31	45.3 Å²	45.3	19%	0.19	22%	0.223	C	C	.	.	S	Bend	trans	-88.1	-20.4	178.8	49.4	0	0	0	0	113.2	D185 S186 F187 F802 F803	D185-T800 PolarHBondContact O-OG1 2.99Å; S186-T800 PolarHBondContact O-N 2.74Å; S186-T800 PolarHBondContact O-OG1 3.01Å; S186-T800 VanDerWaalsContact O-OG1 3.13Å; F187-T800 PolarHBondContact N-OG1 2.99Å; T800-F802 PolarHBondContact O-N 3.24Å; T800-F803 PolarHBondContact O-N 2.75Å
801	D	75	Confident	79.7	Confident	29 Å²	29	47.6 Å²	47.6	16%	0.155	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-69.9	-20.3	179	-72.6	-25	0	0	0	111.5	R90 S186 D799 F803 L804	R90-D801 IonicContact CZ-OD2 3.88Å; R90-D801 IonicContact NE-OD2 3.77Å; R90-D801 IonicContact NH1-OD2 2.71Å; S186-D801 WeakPolarHBondContact CA-OD2 3.36Å; S186-D801 VanDerWaalsContact CB-OD2 3.23Å; S186-D801 WeakPolarHBondContact CB-OD2 3.29Å; S186-D801 PolarHBondContact OG-OD2 3.37Å; D799-D801 WeakPolarHBondContact OD1-CB 3.44Å; D799-D801 PolarHBondContact OD1-N 2.79Å; D801-F803 PolarHBondContact O-N 3.24Å; D801-F803 VanDerWaalsContact O-N 3.13Å; D801-L804 WeakPolarHBondContact O-CB 3.45Å; D801-L804 PolarHBondContact O-N 3.45Å
802	F	61.7	Low	78.8	Confident	60 Å²	60	50.4 Å²	50.4	26%	0.263	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-53.6	-31.9	175	174.7	-102.5	0	0	0	113.7	P768 S769 L771 T800 L804	P768-F802 HydrophobicContact CG-CD1 3.89Å; P768-F802 HydrophobicContact CG-CE1 4.39Å; S769-F802 WeakPolarHBondContact OG-CD2 3.39Å; S769-F802 WeakPolarHBondContact OG-CE2 3.03Å; S769-F802 WeakPolarHBondContact OG-CZ 3.48Å; L771-F802 HydrophobicContact CB-CD2 4.35Å; L771-F802 HydrophobicContact CB-CE2 4.01Å; L771-F802 HydrophobicContact CD1-CE2 4.36Å; T800-F802 PolarHBondContact O-N 3.24Å; F802-L804 VanDerWaalsContact C-N 3.29Å
803	F	59.3	Low	77.8	Confident	151 Å²	151	52.9 Å²	52.9	66%	0.662	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-82.7	-5.7	179.4	-66	-77.2	0	0	0	113.8	P768 T800 D801	P768-F803 HydrophobicContact CG-CE2 4.3Å; P768-F803 HydrophobicContact CG-CZ 4.28Å; T800-F803 PolarHBondContact O-N 2.75Å; D801-F803 PolarHBondContact O-N 3.24Å; D801-F803 VanDerWaalsContact O-N 3.13Å
804	L	52.9	Low	76.4	Confident	147 Å²	147	57.3 Å²	57.3	77%	0.77	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-20.9	179.7	-67.3	170.9	0	0	0	113.1	D801 F802	D801-L804 WeakPolarHBondContact O-CB 3.45Å; D801-L804 PolarHBondContact O-N 3.45Å; F802-L804 VanDerWaalsContact C-N 3.29Å
805	E	38.9	Very low	74.7	Confident	204 Å²	204	61.5 Å²	61.5	95%	0.953	30%	0.296	S	S	*	.			trans	-89.5	0	168.8	-71.1	-177.1	-165.5	0	0	111.5	R90	R90-E805 IonicContact NH2-OE1 3.49Å; R90-E805 PolarHBondContact NH2-OE1 3.49Å

Retrieved 805 of 805 residues in 861.8 ms (Link to these results)

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