A0A087YD85_POEFO Loading...

Ubiquitin-protein ligase E3C

AlphaFold DB , UniProt , Accession A0A087YD85, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,081 aa.

						>A0A087YD85_POEFO|A0A087YD85
MFSFEGDFKTRPKVSLGGASKKEEKASLLHRTQEERRKREEERKRLKNAIIIQSYIRGYQDLKQQYAFQRAKFDESVSQSQAEGTQHVMAASTLCLLSRRLIFFYRQSVDAHRLIWLCQNLVKHNSQFVKLLNSPQKQTCVFQIKRILGFCCRLLQNCPDDSLNVAVPMRMLEIFSSERTYLLVIPDANNVASLLEQILHYMVQKGYYKSLYSLVNHRLPSSLEYSDAPSIPLASTLLEHILKPLHFTYSSCTTGARQFVFAAFTEEFISAPFTEQIFHFFIPALSDRRLSFPFEAFLSSLQVTIDSFSAAQSQAPWLFYFVLSAGENCLGSLSEEGHLLYLRALEALLPLLPVSESTSRPEVNSDSEDDDDGDMHPTPMQDNSRISVQLITEECIHKLDTKQQTNALLNLVWRDSASEEVFTMMASICHTLMVQHRLMVPKVRLLYSLAFNARFLRHLWHLITSMTTKMITGSMVPLLQLISRGSPMSFEDSNRIIPLFYLFSSLFSHSLISVHDSEFFGHEMEGQMQSSMMPFTLSELVTLSRCLRDACLGIIKLAYPETKAEHREEYMAAFRSVGVKTNTEVQRRIQAEQKRWVQLFKVITNLVKMLKARDIRRPFCPVGHWLSEEVNIRADKVTQLYVPSARHVWRTRRMGRIGPLQSTLDVGFEPPQLSVSEERHLAILTELPFVVPFEERVKIFQRLISVDKRDVQGDGPFPDGINVTIRRNYIYEDAYDKLSPENEPDLKKRIRVHLLNAHGLDEAGIDGGGIFREFLNELLKSGFNPNQGFFKTTNEGLLYPNPAAEMLVGDSFTRHYYFLGRILGKALYENMLVELPFASFFLSKLLGTSADVDIHHLASLDPEMYRNLLFLKSYEGDVEELGLNFTVVNNDLGEAQVVELKPGGKDIPVTTANRIAYIHLVADYRLNKQIRPHCLAFRQGLANVVNLEWLRMFDQQEIQVLISGAHVPICLDDLKNFTNYSGGYSANHPVIQIFWEVVEGFTDEEKRKLLKFVTSCSRPPLLGFKELYPAFCIHNGGSDLERLPTASTCMNLLKLPEFCDQHLMRSKLLYAIESSAGFELS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33	Very low	44.5	Very low	246 Å²	246	174.5 Å²	174.5	100%	1.212	87%	0.869	S	S	*	*				0	99	0	-137.5	170.8	-176	0	0	106.4
2	F	36.3	Very low	44.8	Very low	206 Å²	206	169.7 Å²	169.7	90%	0.904	86%	0.859	S	S	*	*			trans	-85.8	117	-179.6	-79.5	-82.1	0	0	0	108.4
3	S	34.4	Very low	44.8	Very low	105 Å²	105	173 Å²	173	73%	0.734	87%	0.865	S	S	*	*			trans	-63.6	133.7	178.9	-175	0	0	0	0	110.6
4	F	46.7	Very low	45	Very low	205 Å²	205	168.4 Å²	168.4	90%	0.899	85%	0.85	S	S	*	*			trans	-109.1	62.9	-173.9	-123.5	-86.6	0	0	0	108.5
5	E	42.2	Very low	45.2	Very low	164 Å²	164	164.5 Å²	164.5	77%	0.766	85%	0.845	S	S	*	*			trans	-120.5	111.9	173.5	-73.3	-176.3	168.9	0	0	109.3	D7	E5-D7 PolarHBondContact O-N 3.01Å; E5-D7 VanDerWaalsContact O-N 3.16Å
6	G	51.5	Low	45.6	Very low	73 Å²	73	164.6 Å²	164.6	75%	0.753	85%	0.846	S	S	*	*			trans	-77.1	91.9	177.6	0	0	0	0	0	110.8
7	D	39	Very low	45.5	Very low	153 Å²	153	158.8 Å²	158.8	82%	0.818	84%	0.836	S	S	*	*			trans	-104.6	99.3	167.4	-101.3	-19.8	0	0	0	110.8	E5 K9	E5-D7 PolarHBondContact O-N 3.01Å; E5-D7 VanDerWaalsContact O-N 3.16Å; D7-K9 PolarHBondContact O-N 3.39Å
8	F	53.3	Low	45.4	Very low	200 Å²	200	154.3 Å²	154.3	88%	0.877	84%	0.835	S	S	*	*			trans	-84	83.5	169.7	-84.7	-93.1	0	0	0	110
9	K	50.2	Low	45.3	Very low	198 Å²	198	151.6 Å²	151.6	86%	0.861	84%	0.836	S	S	*	*			trans	152	101.9	145.6	-85.4	168	-177.6	-179.6	0	111.3	D7 R11	D7-K9 PolarHBondContact O-N 3.39Å; K9-R11 PolarHBondContact O-N 3.49Å
10	T	50	Low	45.7	Very low	143 Å²	143	150.1 Å²	150.1	88%	0.877	84%	0.836	S	S	*	*			trans	-80.7	113.6	162.6	45.7	0	0	0	0	110.1
11	R	52.9	Low	46.3	Very low	226 Å²	226	152 Å²	152	85%	0.853	84%	0.835	S	S	*	*			trans	-57.9	146.3	169.3	-66.9	180	179.1	-175.3	-0.3	110.4	K9 K13	K9-R11 PolarHBondContact O-N 3.49Å; R11-K13 PolarHBondContact O-N 3.39Å; R11-K13 VanDerWaalsContact O-N 3.16Å
12	P	47.9	Very low	47.6	Very low	117 Å²	117	150.3 Å²	150.3	76%	0.76	82%	0.821	S	S	*	*			trans	-68.9	113.8	177.2	26.5	-30.2	0	0	0	110.2	V14	P12-V14 PolarHBondContact O-N 3.24Å
13	K	45.4	Very low	48.6	Very low	213 Å²	213	145.6 Å²	145.6	93%	0.926	80%	0.802	S	S	*	*			trans	-74.6	98.5	162.9	-87.5	-175.9	174	179.3	0	107.8	R11 S15	R11-K13 PolarHBondContact O-N 3.39Å; R11-K13 VanDerWaalsContact O-N 3.16Å; K13-S15 PolarHBondContact O-N 3.34Å
14	V	47.2	Very low	50.1	Low	109 Å²	109	147.8 Å²	147.8	66%	0.661	80%	0.801	S	S	*	*			trans	-83.8	106.1	168	-172.5	0	0	0	0	107.4	P12 L16	P12-V14 PolarHBondContact O-N 3.24Å; V14-L16 HydrophobicContact CG1-CD2 4.07Å; V14-L16 HydrophobicContact CG1-CG 3.87Å; V14-L16 PolarHBondContact O-N 3.12Å
15	S	47.5	Very low	51.2	Low	110 Å²	110	146.4 Å²	146.4	77%	0.769	79%	0.794	S	S	*	*			trans	-80.8	105.2	165.8	170.6	0	0	0	0	107.8	K13	K13-S15 PolarHBondContact O-N 3.34Å
16	L	52.3	Low	52.6	Low	166 Å²	166	141.9 Å²	141.9	87%	0.869	79%	0.785	S	S	*	*			trans	-97.7	83.3	168.8	-69.7	172.1	0	0	0	108	V14	V14-L16 HydrophobicContact CG1-CD2 4.07Å; V14-L16 HydrophobicContact CG1-CG 3.87Å; V14-L16 PolarHBondContact O-N 3.12Å
17	G	43.1	Very low	53.6	Low	66 Å²	66	140.8 Å²	140.8	68%	0.68	77%	0.766	S	S	*	*			trans	179.8	107.8	173.3	0	0	0	0	0	114.4
18	G	43.5	Very low	55.4	Low	78 Å²	78	138 Å²	138	80%	0.804	75%	0.751	S	S	*	*			trans	125.9	110.1	146.1	0	0	0	0	0	117.5
19	A	44.4	Very low	56.5	Low	103 Å²	103	133.4 Å²	133.4	85%	0.851	74%	0.735	S	S	*	*			trans	70	91.5	156.3	0	0	0	0	0	118.9	K21	A19-K21 PolarHBondContact O-N 3.2Å; A19-K21 VanDerWaalsContact O-N 3.12Å
20	S	53.8	Low	57.8	Low	120 Å²	120	129.5 Å²	129.5	84%	0.839	72%	0.719	S	S	*	*			trans	-60.8	101.9	161.3	179	0	0	0	0	111
21	K	57.7	Low	59.2	Low	190 Å²	190	129.5 Å²	129.5	83%	0.826	70%	0.703	S	S	*	*			trans	-93.7	128.5	147.9	-76.1	-174.7	177	-178.4	0	106.3	A19 E23	A19-K21 PolarHBondContact O-N 3.2Å; A19-K21 VanDerWaalsContact O-N 3.12Å; K21-E23 PolarHBondContact O-N 3.48Å
22	K	60.2	Low	60.5	Low	211 Å²	211	121 Å²	121	92%	0.917	68%	0.676	S	S	*	*			trans	-62.4	83.7	169.6	-86.6	-179.4	173.3	177.3	0	108.3
23	E	58.1	Low	62	Low	107 Å²	107	121.9 Å²	121.9	50%	0.5	67%	0.67	S	S	.	*			trans	-69.9	132.4	166.3	-82.8	-176	159.6	0	0	108.4	K21	K21-E23 PolarHBondContact O-N 3.48Å
24	E	64.4	Low	63.7	Low	151 Å²	151	115.1 Å²	115.1	71%	0.706	64%	0.642	S	S	*	*			trans	-57	139.4	175.9	-71.3	-179.2	153.2	0	0	110.6	A26 S27 L28	E24-A26 PolarHBondContact O-N 3.21Å; E24-S27 PolarHBondContact N-OG 2.95Å; E24-S27 PolarHBondContact O-N 2.86Å; E24-S27 PolarHBondContact O-OG 2.97Å; E24-L28 PolarHBondContact O-N 3.08Å
25	K	71.2	Confident	65.4	Low	176 Å²	176	113.4 Å²	113.4	77%	0.765	63%	0.627	S	S	*	*	H	α-helix	trans	-51.3	-31.1	180	-174.7	177.6	178.3	-177.4	0	112.6	L29	K25-L29 HydrophobicContact CG-CD1 4.25Å; K25-L29 WeakPolarHBondContact O-CB 3.38Å; K25-L29 VanDerWaalsContact O-CG 3.25Å; K25-L29 WeakPolarHBondContact O-CG 3.23Å; K25-L29 PolarHBondContact O-N 3.36Å; K25-L29 VanDerWaalsContact O-N 3.11Å
26	A	71.6	Confident	67	Low	69 Å²	69	116 Å²	116	57%	0.57	62%	0.62	S	S	*	*	H	α-helix	trans	-66.6	-42.7	176.6	0	0	0	0	0	113.4	E24 L29 H30	E24-A26 PolarHBondContact O-N 3.21Å; A26-L29 PolarHBondContact O-N 3.07Å; A26-H30 WeakPolarHBondContact O-CB 3.36Å; A26-H30 PolarHBondContact O-N 3.38Å
27	S	72.3	Confident	68.4	Low	51 Å²	51	114 Å²	114	36%	0.357	60%	0.601	S	S	.	*	H	α-helix	trans	-72.3	-34.4	-179.8	43.8	0	0	0	0	112.2	E24 H30 R31	E24-S27 PolarHBondContact N-OG 2.95Å; E24-S27 PolarHBondContact O-N 2.86Å; E24-S27 PolarHBondContact O-OG 2.97Å; S27-H30 PolarHBondContact O-N 2.77Å; S27-R31 WeakPolarHBondContact O-CB 3.43Å; S27-R31 PolarHBondContact O-N 2.7Å
28	L	75.9	Confident	70.4	Confident	94 Å²	94	116.7 Å²	116.7	49%	0.492	59%	0.594	S	S	.	*	H	α-helix	trans	-67.9	-40.1	173.8	-155.5	149.2	0	0	0	111.7	E24 T32	E24-L28 PolarHBondContact O-N 3.08Å; L28-T32 WeakPolarHBondContact O-CB 3.49Å; L28-T32 PolarHBondContact O-N 2.92Å; L28-T32 PolarHBondContact O-OG1 3.39Å
29	L	76.5	Confident	72.4	Confident	104 Å²	104	118.8 Å²	118.8	55%	0.545	58%	0.577	S	S	.	*	H	α-helix	trans	-63.7	-44.2	172.2	-76.3	170.2	0	0	0	111.9	K25 A26 T32 Q33	K25-L29 HydrophobicContact CG-CD1 4.25Å; K25-L29 WeakPolarHBondContact O-CB 3.38Å; K25-L29 VanDerWaalsContact O-CG 3.25Å; K25-L29 WeakPolarHBondContact O-CG 3.23Å; K25-L29 PolarHBondContact O-N 3.36Å; K25-L29 VanDerWaalsContact O-N 3.11Å; A26-L29 PolarHBondContact O-N 3.07Å; L29-T32 PolarHBondContact O-N 3.26Å; L29-Q33 WeakPolarHBondContact O-CB 3.44Å; L29-Q33 PolarHBondContact O-N 3.47Å
30	H	78.3	Confident	74.3	Confident	115 Å²	115	119.4 Å²	119.4	53%	0.532	56%	0.562	S	S	.	*	H	α-helix	trans	-61.2	-46.9	177.5	-172.1	-84	0	0	0	111.6	A26 S27 T32 Q33 E34	A26-H30 WeakPolarHBondContact O-CB 3.36Å; A26-H30 PolarHBondContact O-N 3.38Å; S27-H30 PolarHBondContact O-N 2.77Å; H30-T32 PolarHBondContact O-N 3.16Å; H30-Q33 PolarHBondContact O-N 3.47Å; H30-E34 IonicContact CE1-OE2 2.68Å; H30-E34 WeakPolarHBondContact O-CB 3.32Å; H30-E34 PolarHBondContact O-N 2.96Å
31	R	79.6	Confident	75.9	Confident	144 Å²	144	118.5 Å²	118.5	54%	0.543	55%	0.545	S	S	.	.	H	α-helix	trans	-61.7	-42.1	176.1	-174.8	178	175.1	171	2.9	112.1	S27 Q33 E34 E35	S27-R31 WeakPolarHBondContact O-CB 3.43Å; S27-R31 PolarHBondContact O-N 2.7Å; R31-Q33 VanDerWaalsContact C-N 3.34Å; R31-Q33 PolarHBondContact O-N 2.72Å; R31-E34 PolarHBondContact O-N 3.24Å; R31-E35 IonicContact NE-OE1 3.44Å; R31-E35 WeakPolarHBondContact O-CG 3.45Å; R31-E35 PolarHBondContact O-N 3.45Å
32	T	78.8	Confident	77.3	Confident	46 Å²	46	115.5 Å²	115.5	28%	0.282	53%	0.534	S	S	.	.	H	α-helix	trans	-64.5	-39.5	176.7	-53.4	0	0	0	0	111.4	L28 L29 H30 R36	L28-T32 WeakPolarHBondContact O-CB 3.49Å; L28-T32 PolarHBondContact O-N 2.92Å; L28-T32 PolarHBondContact O-OG1 3.39Å; L29-T32 PolarHBondContact O-N 3.26Å; H30-T32 PolarHBondContact O-N 3.16Å; T32-R36 VanDerWaalsContact O-CG 3.31Å; T32-R36 WeakPolarHBondContact O-CG 3.38Å; T32-R36 PolarHBondContact O-N 2.64Å
33	Q	80.2	Confident	78.6	Confident	137 Å²	137	114.2 Å²	114.2	64%	0.64	52%	0.523	S	S	*	.	H	α-helix	trans	-67.1	-39.9	175.6	-174.4	166.8	-1.3	0	0	111.7	L29 H30 R31 R36 R37	L29-Q33 WeakPolarHBondContact O-CB 3.44Å; L29-Q33 PolarHBondContact O-N 3.47Å; H30-Q33 PolarHBondContact O-N 3.47Å; R31-Q33 VanDerWaalsContact C-N 3.34Å; R31-Q33 PolarHBondContact O-N 2.72Å; Q33-R36 WeakPolarHBondContact O-CB 3.16Å; Q33-R36 PolarHBondContact O-N 3.18Å; Q33-R37 WeakPolarHBondContact O-CB 3.36Å; Q33-R37 PolarHBondContact O-N 3.2Å
34	E	81.6	Confident	80	Confident	70 Å²	70	115.7 Å²	115.7	33%	0.327	53%	0.528	S	S	.	.	H	α-helix	trans	-68.3	-38.6	176.8	-167.6	159.7	-143.3	0	0	112.2	H30 R31 R37 K38	H30-E34 IonicContact CE1-OE2 2.68Å; H30-E34 WeakPolarHBondContact O-CB 3.32Å; H30-E34 PolarHBondContact O-N 2.96Å; R31-E34 PolarHBondContact O-N 3.24Å; E34-R37 PolarHBondContact O-N 3.23Å; E34-R37 IonicContact OE1-NH2 3.43Å; E34-R37 PolarHBondContact OE1-NH2 2.98Å; E34-K38 WeakPolarHBondContact O-CG 3.35Å; E34-K38 PolarHBondContact O-N 3.48Å
35	E	82.4	Confident	81.3	Confident	74 Å²	74	118 Å²	118	35%	0.346	53%	0.53	S	S	.	.	H	α-helix	trans	-66.3	-36.4	170.4	-73.7	-175.4	-170.1	0	0	112.6	R31 K38 R39	R31-E35 IonicContact NE-OE1 3.44Å; R31-E35 WeakPolarHBondContact O-CG 3.45Å; R31-E35 PolarHBondContact O-N 3.45Å; E35-K38 PolarHBondContact O-N 3.02Å; E35-R39 VanDerWaalsContact O-CG 3.31Å; E35-R39 WeakPolarHBondContact O-CG 3.37Å; E35-R39 PolarHBondContact O-N 3.49Å; E35-R39 PolarHBondContact O-NH1 3.14Å; E35-R39 IonicContact OE2-CZ 3.88Å; E35-R39 IonicContact OE2-NH1 3.42Å; E35-R39 IonicContact OE2-NH2 2.73Å; E35-R39 PolarHBondContact OE2-NH2 3.25Å
36	R	80.3	Confident	82.2	Confident	165 Å²	165	115.3 Å²	115.3	62%	0.623	52%	0.523	S	S	*	.	H	α-helix	trans	-63.6	-44.2	172.2	-76.3	175.6	-173.5	-179.1	2.9	110.9	T32 Q33 K38 R39 E40	T32-R36 VanDerWaalsContact O-CG 3.31Å; T32-R36 WeakPolarHBondContact O-CG 3.38Å; T32-R36 PolarHBondContact O-N 2.64Å; Q33-R36 WeakPolarHBondContact O-CB 3.16Å; Q33-R36 PolarHBondContact O-N 3.18Å; R36-K38 PolarHBondContact O-N 3.17Å; R36-R39 PolarHBondContact O-N 3.05Å; R36-E40 PolarHBondContact O-N 2.97Å
37	R	82.4	Confident	83.1	Confident	124 Å²	124	118.9 Å²	118.9	47%	0.468	53%	0.526	S	S	.	.	H	α-helix	trans	-59.1	-46.2	175.5	-165.4	-177.1	72.8	-148.6	-10.2	111.1	Q33 E34 R39 E40 E41	Q33-R37 WeakPolarHBondContact O-CB 3.36Å; Q33-R37 PolarHBondContact O-N 3.2Å; E34-R37 PolarHBondContact O-N 3.23Å; E34-R37 IonicContact OE1-NH2 3.43Å; E34-R37 PolarHBondContact OE1-NH2 2.98Å; R37-R39 PolarHBondContact O-N 2.88Å; R37-E40 PolarHBondContact O-N 3.09Å; R37-E41 IonicContact NE-OE1 4Å; R37-E41 PolarHBondContact NE-OE1 2.92Å; R37-E41 WeakPolarHBondContact O-CG 3.29Å; R37-E41 PolarHBondContact O-N 3.46Å
38	K	85.6	Confident	84	Confident	122 Å²	122	120.8 Å²	120.8	53%	0.53	53%	0.532	S	S	.	.	H	α-helix	trans	-59.8	-43.8	175.2	-77.2	-178.2	178.6	179	0	112.7	E34 E35 R36 E40 E41 E42	E34-K38 WeakPolarHBondContact O-CG 3.35Å; E34-K38 PolarHBondContact O-N 3.48Å; E35-K38 PolarHBondContact O-N 3.02Å; R36-K38 PolarHBondContact O-N 3.17Å; K38-E40 VanDerWaalsContact C-N 3.33Å; K38-E40 PolarHBondContact O-N 3.29Å; K38-E41 PolarHBondContact O-N 3.33Å; K38-E42 WeakPolarHBondContact O-CG 3.23Å; K38-E42 PolarHBondContact O-N 3.36Å
39	R	85.1	Confident	84.7	Confident	121 Å²	121	118.1 Å²	118.1	46%	0.457	52%	0.524	S	S	.	.	H	α-helix	trans	-64.6	-36.6	176	-69.8	177.8	-164.4	104.2	2.2	112.2	E35 R36 R37 R43	E35-R39 VanDerWaalsContact O-CG 3.31Å; E35-R39 WeakPolarHBondContact O-CG 3.37Å; E35-R39 PolarHBondContact O-N 3.49Å; E35-R39 PolarHBondContact O-NH1 3.14Å; E35-R39 IonicContact OE2-CZ 3.88Å; E35-R39 IonicContact OE2-NH1 3.42Å; E35-R39 IonicContact OE2-NH2 2.73Å; E35-R39 PolarHBondContact OE2-NH2 3.25Å; R36-R39 PolarHBondContact O-N 3.05Å; R37-R39 PolarHBondContact O-N 2.88Å; R39-R43 WeakPolarHBondContact O-CB 3.33Å; R39-R43 VanDerWaalsContact O-CG 3.26Å; R39-R43 WeakPolarHBondContact O-CG 3.42Å; R39-R43 PolarHBondContact O-N 3.17Å
40	E	83.9	Confident	85.4	Confident	116 Å²	116	118.4 Å²	118.4	54%	0.542	53%	0.525	S	S	.	.	H	α-helix	trans	-68.8	-40.5	173.7	-78.6	-175.3	178.2	0	0	112.6	R36 R37 K38 R43 K44	R36-E40 PolarHBondContact O-N 2.97Å; R37-E40 PolarHBondContact O-N 3.09Å; K38-E40 VanDerWaalsContact C-N 3.33Å; K38-E40 PolarHBondContact O-N 3.29Å; E40-R43 PolarHBondContact O-N 3.24Å; E40-K44 WeakPolarHBondContact O-CB 3.46Å; E40-K44 WeakPolarHBondContact O-CG 3.38Å; E40-K44 PolarHBondContact O-N 3.42Å
41	E	87	Confident	86	Confident	102 Å²	102	116.3 Å²	116.3	48%	0.477	52%	0.517	S	S	.	.	H	α-helix	trans	-61.3	-44.1	173.9	-76.3	169.3	-167.9	0	0	111.3	R37 K38 K44 R45	R37-E41 IonicContact NE-OE1 4Å; R37-E41 PolarHBondContact NE-OE1 2.92Å; R37-E41 WeakPolarHBondContact O-CG 3.29Å; R37-E41 PolarHBondContact O-N 3.46Å; K38-E41 PolarHBondContact O-N 3.33Å; E41-K44 PolarHBondContact O-N 3.48Å; E41-R45 WeakPolarHBondContact O-CB 3.43Å; E41-R45 PolarHBondContact O-N 3.17Å
42	E	87.9	Confident	86.5	Confident	127 Å²	127	114.3 Å²	114.3	59%	0.593	52%	0.516	S	S	*	.	H	α-helix	trans	-62.8	-42.5	174.4	-77.6	179.4	168.5	0	0	112.4	K38 R45 L46	K38-E42 WeakPolarHBondContact O-CG 3.23Å; K38-E42 PolarHBondContact O-N 3.36Å; E42-R45 WeakPolarHBondContact O-CB 3.43Å; E42-R45 PolarHBondContact O-N 2.65Å; E42-L46 PolarHBondContact O-N 3.22Å
43	R	86.8	Confident	87	Confident	183 Å²	183	116.7 Å²	116.7	69%	0.691	52%	0.524	S	S	*	.	H	α-helix	trans	-62	-43.3	174.3	-76	173.7	-177.7	-177.6	0.7	111.8	R39 E40 R45 L46 K47	R39-R43 WeakPolarHBondContact O-CB 3.33Å; R39-R43 VanDerWaalsContact O-CG 3.26Å; R39-R43 WeakPolarHBondContact O-CG 3.42Å; R39-R43 PolarHBondContact O-N 3.17Å; E40-R43 PolarHBondContact O-N 3.24Å; R43-R45 VanDerWaalsContact C-N 3.35Å; R43-L46 PolarHBondContact O-N 3.16Å; R43-K47 WeakPolarHBondContact O-CB 3.33Å; R43-K47 PolarHBondContact O-N 3.03Å
44	K	88.1	Confident	87.6	Confident	139 Å²	139	113.3 Å²	113.3	60%	0.604	52%	0.515	S	S	*	.	H	α-helix	trans	-61.9	-43.3	174.4	-78.2	179.9	-178.4	175.1	0	110.9	E40 E41 K47 N48	E40-K44 WeakPolarHBondContact O-CB 3.46Å; E40-K44 WeakPolarHBondContact O-CG 3.38Å; E40-K44 PolarHBondContact O-N 3.42Å; E41-K44 PolarHBondContact O-N 3.48Å; K44-K47 PolarHBondContact O-N 3.31Å; K44-N48 WeakPolarHBondContact O-CB 3.26Å; K44-N48 PolarHBondContact O-N 3.17Å; K44-N48 PolarHBondContact O-ND2 2.8Å; K44-N48 PolarHBondContact O-OD1 3.38Å
45	R	90.8	Very high	87.9	Confident	200 Å²	200	118.5 Å²	118.5	76%	0.755	53%	0.533	S	S	*	.	H	α-helix	trans	-60.8	-46.1	177.3	-172.2	-180	179.6	-174.4	0.7	111.9	E41 E42 R43 N48 A49	E41-R45 WeakPolarHBondContact O-CB 3.43Å; E41-R45 PolarHBondContact O-N 3.17Å; E42-R45 WeakPolarHBondContact O-CB 3.43Å; E42-R45 PolarHBondContact O-N 2.65Å; R43-R45 VanDerWaalsContact C-N 3.35Å; R45-N48 PolarHBondContact O-N 3.27Å; R45-A49 WeakPolarHBondContact O-CB 3.41Å; R45-A49 PolarHBondContact O-N 2.95Å
46	L	90.5	Very high	88.3	Confident	118 Å²	118	119.2 Å²	119.2	62%	0.618	54%	0.539	S	S	*	.	H	α-helix	trans	-63.9	-44.5	176.2	-78.2	164	0	0	0	112	E42 R43 N48 A49 I50	E42-L46 PolarHBondContact O-N 3.22Å; R43-L46 PolarHBondContact O-N 3.16Å; L46-N48 VanDerWaalsContact C-N 3.35Å; L46-N48 PolarHBondContact O-N 2.7Å; L46-A49 WeakPolarHBondContact O-CB 3.29Å; L46-A49 PolarHBondContact O-N 3.33Å; L46-I50 WeakPolarHBondContact O-CG1 3.33Å; L46-I50 PolarHBondContact O-N 3.01Å
47	K	92	Very high	88.8	Confident	144 Å²	144	118.9 Å²	118.9	63%	0.626	54%	0.537	S	S	*	.	H	α-helix	trans	-59.7	-45.3	175.7	-173.1	179.6	178.9	-178.9	0	111.4	R43 K44 A49 I50 I51	R43-K47 WeakPolarHBondContact O-CB 3.33Å; R43-K47 PolarHBondContact O-N 3.03Å; K44-K47 PolarHBondContact O-N 3.31Å; K47-A49 VanDerWaalsContact C-N 3.34Å; K47-A49 PolarHBondContact O-N 3.19Å; K47-I50 PolarHBondContact O-N 3.33Å; K47-I51 HydrophobicContact CG-CD1 4.33Å; K47-I51 WeakPolarHBondContact O-CG1 3.49Å; K47-I51 PolarHBondContact O-N 3.06Å; K47-I51 VanDerWaalsContact O-N 3.1Å
48	N	89.9	Confident	89.2	Confident	91 Å²	91	114.9 Å²	114.9	49%	0.487	54%	0.535	S	S	.	.	H	α-helix	trans	-63.7	-39	176.5	-69.2	-9.4	0	0	0	111.7	K44 R45 L46 I51 I52	K44-N48 WeakPolarHBondContact O-CB 3.26Å; K44-N48 PolarHBondContact O-N 3.17Å; K44-N48 PolarHBondContact O-ND2 2.8Å; K44-N48 PolarHBondContact O-OD1 3.38Å; R45-N48 PolarHBondContact O-N 3.27Å; L46-N48 VanDerWaalsContact C-N 3.35Å; L46-N48 PolarHBondContact O-N 2.7Å; N48-I51 PolarHBondContact O-N 3.48Å; N48-I52 VanDerWaalsContact O-CG1 3.3Å; N48-I52 WeakPolarHBondContact O-CG1 3.37Å; N48-I52 PolarHBondContact O-N 3.17Å
49	A	91.5	Very high	89.4	Confident	39 Å²	39	116 Å²	116	32%	0.322	54%	0.536	S	S	.	.	H	α-helix	trans	-62.6	-42	175.7	0	0	0	0	0	112.3	R45 L46 K47 I51 I52 Q53	R45-A49 WeakPolarHBondContact O-CB 3.41Å; R45-A49 PolarHBondContact O-N 2.95Å; L46-A49 WeakPolarHBondContact O-CB 3.29Å; L46-A49 PolarHBondContact O-N 3.33Å; K47-A49 VanDerWaalsContact C-N 3.34Å; K47-A49 PolarHBondContact O-N 3.19Å; A49-I51 VanDerWaalsContact C-N 3.32Å; A49-I51 PolarHBondContact O-N 3.46Å; A49-I52 PolarHBondContact O-N 2.87Å; A49-Q53 WeakPolarHBondContact O-CB 3.38Å; A49-Q53 VanDerWaalsContact O-CG 3.26Å; A49-Q53 WeakPolarHBondContact O-CG 3.36Å; A49-Q53 PolarHBondContact O-N 3.07Å
50	I	90.9	Very high	89.5	Confident	109 Å²	109	115.5 Å²	115.5	56%	0.559	54%	0.539	S	S	*	.	H	α-helix	trans	-62.1	-41.7	175.4	-67	166.9	0	0	0	110.9	L46 K47 Q53 S54	L46-I50 WeakPolarHBondContact O-CG1 3.33Å; L46-I50 PolarHBondContact O-N 3.01Å; K47-I50 PolarHBondContact O-N 3.33Å; I50-Q53 PolarHBondContact O-N 3.25Å; I50-S54 PolarHBondContact O-N 3.39Å
51	I	90.4	Very high	89.8	Confident	72 Å²	72	114.6 Å²	114.6	37%	0.369	54%	0.538	S	S	.	.	H	α-helix	trans	-61.3	-48.8	175.8	-67	166	0	0	0	110	K47 N48 A49 Q53 S54 Y55	K47-I51 HydrophobicContact CG-CD1 4.33Å; K47-I51 WeakPolarHBondContact O-CG1 3.49Å; K47-I51 PolarHBondContact O-N 3.06Å; K47-I51 VanDerWaalsContact O-N 3.1Å; N48-I51 PolarHBondContact O-N 3.48Å; A49-I51 VanDerWaalsContact C-N 3.32Å; A49-I51 PolarHBondContact O-N 3.46Å; I51-Q53 VanDerWaalsContact C-N 3.3Å; I51-Q53 PolarHBondContact O-N 3.3Å; I51-S54 PolarHBondContact O-N 2.99Å; I51-S54 PolarHBondContact O-OG 2.93Å; I51-Y55 HydrophobicContact CG2-CD2 3.74Å; I51-Y55 HydrophobicContact CG2-CE2 3.64Å; I51-Y55 VanDerWaalsContact O-CD2 3.23Å; I51-Y55 WeakPolarHBondContact O-CD2 3.44Å; I51-Y55 PolarHBondContact O-N 3.5Å
52	I	91	Very high	89.9	Confident	102 Å²	102	112.9 Å²	112.9	52%	0.523	53%	0.532	S	S	.	.	H	α-helix	trans	-59.1	-43.8	177.5	-67.3	165.4	0	0	0	110.6	N48 A49 S54 Y55 I56	N48-I52 VanDerWaalsContact O-CG1 3.3Å; N48-I52 WeakPolarHBondContact O-CG1 3.37Å; N48-I52 PolarHBondContact O-N 3.17Å; A49-I52 PolarHBondContact O-N 2.87Å; I52-S54 PolarHBondContact O-N 3.38Å; I52-Y55 PolarHBondContact O-N 2.87Å; I52-I56 HydrophobicContact CG2-CD1 3.87Å; I52-I56 HydrophobicContact CG2-CG1 4.49Å; I52-I56 WeakPolarHBondContact O-CG1 3.28Å; I52-I56 PolarHBondContact O-N 2.97Å
53	Q	88.5	Confident	89.9	Confident	96 Å²	96	113.3 Å²	113.3	45%	0.449	53%	0.532	S	S	.	.	H	α-helix	trans	-63.7	-39.7	178.3	-73.8	174.6	-7	0	0	112.8	A49 I50 I51 I56 R57	A49-Q53 WeakPolarHBondContact O-CB 3.38Å; A49-Q53 VanDerWaalsContact O-CG 3.26Å; A49-Q53 WeakPolarHBondContact O-CG 3.36Å; A49-Q53 PolarHBondContact O-N 3.07Å; I50-Q53 PolarHBondContact O-N 3.25Å; I51-Q53 VanDerWaalsContact C-N 3.3Å; I51-Q53 PolarHBondContact O-N 3.3Å; Q53-I56 PolarHBondContact O-N 3.44Å; Q53-R57 WeakPolarHBondContact O-CG 3.35Å; Q53-R57 PolarHBondContact O-N 3.17Å
54	S	91.9	Very high	90	Very high	65 Å²	65	111 Å²	111	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-67.6	-38.6	177.1	70.3	0	0	0	0	111.8	I50 I51 I52 R57 G58	I50-S54 PolarHBondContact O-N 3.39Å; I51-S54 PolarHBondContact O-N 2.99Å; I51-S54 PolarHBondContact O-OG 2.93Å; I52-S54 PolarHBondContact O-N 3.38Å; S54-R57 PolarHBondContact O-N 3.41Å; S54-G58 PolarHBondContact O-N 2.76Å
55	Y	89.8	Confident	90.1	Very high	179 Å²	179	108.8 Å²	108.8	70%	0.702	52%	0.521	S	S	*	.	H	α-helix	trans	-62.5	-41.6	172.1	-85.5	-75.1	0	0	0	112.2	I51 I52 G58 Y59	I51-Y55 HydrophobicContact CG2-CD2 3.74Å; I51-Y55 HydrophobicContact CG2-CE2 3.64Å; I51-Y55 VanDerWaalsContact O-CD2 3.23Å; I51-Y55 WeakPolarHBondContact O-CD2 3.44Å; I51-Y55 PolarHBondContact O-N 3.5Å; I52-Y55 PolarHBondContact O-N 2.87Å; Y55-G58 PolarHBondContact O-N 3.46Å; Y55-Y59 WeakPolarHBondContact O-CB 3.33Å; Y55-Y59 PolarHBondContact O-N 2.98Å
56	I	90.5	Very high	90.2	Very high	90 Å²	90	102.4 Å²	102.4	46%	0.462	50%	0.497	S	S	.	.	H	α-helix	trans	-65.6	-46	178.1	-68.7	169.5	0	0	0	111.3	I52 Q53 Y59 Q60	I52-I56 HydrophobicContact CG2-CD1 3.87Å; I52-I56 HydrophobicContact CG2-CG1 4.49Å; I52-I56 WeakPolarHBondContact O-CG1 3.28Å; I52-I56 PolarHBondContact O-N 2.97Å; Q53-I56 PolarHBondContact O-N 3.44Å; I56-Y59 PolarHBondContact O-N 3.21Å; I56-Q60 WeakPolarHBondContact O-CG 3.44Å; I56-Q60 PolarHBondContact O-N 3.3Å
57	R	91	Very high	90.1	Very high	158 Å²	158	99.3 Å²	99.3	60%	0.596	49%	0.489	S	S	*	.	H	α-helix	trans	-59.9	-47.6	175.8	-70.4	176.5	-169.6	157	4.4	110.9	Q53 S54 Y59 Q60 D61	Q53-R57 WeakPolarHBondContact O-CG 3.35Å; Q53-R57 PolarHBondContact O-N 3.17Å; S54-R57 PolarHBondContact O-N 3.41Å; R57-Y59 VanDerWaalsContact C-N 3.31Å; R57-Y59 PolarHBondContact O-N 2.86Å; R57-Q60 PolarHBondContact O-N 3.05Å; R57-Q60 VanDerWaalsContact O-N 3.15Å; R57-D61 PolarHBondContact O-N 2.92Å
58	G	90.4	Very high	90.2	Very high	40 Å²	40	97.3 Å²	97.3	41%	0.412	48%	0.48	S	S	.	.	H	α-helix	trans	-59.9	-38.7	176.2	0	0	0	0	0	113.3	S54 Y55 L62	S54-G58 PolarHBondContact O-N 2.76Å; Y55-G58 PolarHBondContact O-N 3.46Å; G58-L62 VanDerWaalsContact O-CB 3.25Å; G58-L62 WeakPolarHBondContact O-CB 3.48Å; G58-L62 PolarHBondContact O-N 2.99Å
59	Y	88.6	Confident	90.2	Very high	145 Å²	145	95 Å²	95	57%	0.569	47%	0.467	S	S	*	.	H	α-helix	trans	-66.5	-39.9	175.1	178.6	-101.8	0	0	0	112.6	Y55 I56 R57 K63	Y55-Y59 WeakPolarHBondContact O-CB 3.33Å; Y55-Y59 PolarHBondContact O-N 2.98Å; I56-Y59 PolarHBondContact O-N 3.21Å; R57-Y59 VanDerWaalsContact C-N 3.31Å; R57-Y59 PolarHBondContact O-N 2.86Å; Y59-K63 WeakPolarHBondContact O-CB 3.36Å; Y59-K63 PolarHBondContact O-N 2.72Å
60	Q	89	Confident	90.2	Very high	110 Å²	110	95.3 Å²	95.3	51%	0.514	46%	0.46	S	S	.	.	H	α-helix	trans	-64.7	-46.6	175.8	-73.2	178.2	-10.5	0	0	111.6	I56 R57 L62 K63 Q64	I56-Q60 WeakPolarHBondContact O-CG 3.44Å; I56-Q60 PolarHBondContact O-N 3.3Å; R57-Q60 PolarHBondContact O-N 3.05Å; R57-Q60 VanDerWaalsContact O-N 3.15Å; Q60-L62 PolarHBondContact O-N 2.97Å; Q60-K63 WeakPolarHBondContact O-CB 3.42Å; Q60-K63 PolarHBondContact O-N 3.19Å; Q60-Q64 WeakPolarHBondContact O-CG 3.26Å; Q60-Q64 PolarHBondContact O-N 3.38Å
61	D	90.4	Very high	90.2	Very high	97 Å²	97	93 Å²	93	52%	0.519	46%	0.456	S	S	.	.	H	α-helix	trans	-62.1	-43.7	176.9	-71	-14.9	0	0	0	111.3	R57 K63 Q64 Q65	R57-D61 PolarHBondContact O-N 2.92Å; D61-K63 VanDerWaalsContact C-N 3.33Å; D61-K63 PolarHBondContact O-N 3.21Å; D61-Q64 PolarHBondContact O-N 3.11Å; D61-Q65 WeakPolarHBondContact O-CG 3.26Å; D61-Q65 PolarHBondContact O-N 3.24Å
62	L	87.6	Confident	90.1	Very high	67 Å²	67	93 Å²	93	35%	0.351	45%	0.454	S	S	.	.	H	α-helix	trans	-59.7	-43.5	175.2	-173	72.6	0	0	0	111.4	G58 Q60 Q64 Q65 Y66	G58-L62 VanDerWaalsContact O-CB 3.25Å; G58-L62 WeakPolarHBondContact O-CB 3.48Å; G58-L62 PolarHBondContact O-N 2.99Å; Q60-L62 PolarHBondContact O-N 2.97Å; L62-Q64 PolarHBondContact O-N 3.13Å; L62-Q65 PolarHBondContact O-N 3.42Å; L62-Y66 HydrophobicContact CD1-CD1 4.22Å; L62-Y66 HydrophobicContact CD1-CE1 3.57Å; L62-Y66 HydrophobicContact CD1-CE2 4.34Å; L62-Y66 HydrophobicContact CD2-CE2 3.99Å; L62-Y66 HydrophobicContact CG-CD1 4.38Å; L62-Y66 HydrophobicContact CG-CD2 4.31Å; L62-Y66 HydrophobicContact CG-CE1 3.97Å; L62-Y66 HydrophobicContact CG-CE2 3.89Å; L62-Y66 WeakPolarHBondContact O-CB 3.09Å; L62-Y66 VanDerWaalsContact O-CG 3.29Å; L62-Y66 PolarHBondContact O-N 3.43Å
63	K	87.5	Confident	90.1	Very high	136 Å²	136	88.2 Å²	88.2	59%	0.591	43%	0.429	S	S	*	.	H	α-helix	trans	-62.4	-42.2	177.6	-173.5	-178.4	177.7	-174.4	0	111.5	Y59 Q60 D61 A67	Y59-K63 WeakPolarHBondContact O-CB 3.36Å; Y59-K63 PolarHBondContact O-N 2.72Å; Q60-K63 WeakPolarHBondContact O-CB 3.42Å; Q60-K63 PolarHBondContact O-N 3.19Å; D61-K63 VanDerWaalsContact C-N 3.33Å; D61-K63 PolarHBondContact O-N 3.21Å; K63-A67 PolarHBondContact O-N 2.94Å
64	Q	89.9	Confident	90.1	Very high	133 Å²	133	86.3 Å²	86.3	62%	0.621	42%	0.422	S	S	*	.	H	α-helix	trans	-64.2	-46.7	175.5	-71.4	-178.4	4.6	0	0	111.5	Q60 D61 L62 Y66 A67 F68	Q60-Q64 WeakPolarHBondContact O-CG 3.26Å; Q60-Q64 PolarHBondContact O-N 3.38Å; D61-Q64 PolarHBondContact O-N 3.11Å; L62-Q64 PolarHBondContact O-N 3.13Å; Q64-Y66 VanDerWaalsContact C-N 3.34Å; Q64-Y66 PolarHBondContact O-N 2.73Å; Q64-A67 PolarHBondContact O-N 3.2Å; Q64-F68 PolarHBondContact O-N 2.99Å
65	Q	91	Very high	89.9	Confident	94 Å²	94	88.5 Å²	88.5	44%	0.439	43%	0.425	S	S	.	.	H	α-helix	trans	-63.2	-38.8	177.4	-72.9	-61.5	-24.8	0	0	112.4	D61 L62 F68 Q69 F103	D61-Q65 WeakPolarHBondContact O-CG 3.26Å; D61-Q65 PolarHBondContact O-N 3.24Å; L62-Q65 PolarHBondContact O-N 3.42Å; Q65-F68 PolarHBondContact O-N 2.93Å; Q65-Q69 WeakPolarHBondContact O-CB 3.4Å; Q65-Q69 VanDerWaalsContact O-CG 3.27Å; Q65-Q69 WeakPolarHBondContact O-CG 3.37Å; Q65-Q69 PolarHBondContact O-N 3.04Å; Q65-F103 HydrophobicContact CB-CE1 4.36Å
66	Y	91.9	Very high	89.7	Confident	65 Å²	65	81 Å²	81	26%	0.255	40%	0.399	S	S	.	.	H	α-helix	trans	-62.2	-43.1	173.3	-75	-2.5	0	0	0	112.2	L62 Q64 R70 F103 F104	L62-Y66 HydrophobicContact CD1-CD1 4.22Å; L62-Y66 HydrophobicContact CD1-CE1 3.57Å; L62-Y66 HydrophobicContact CD1-CE2 4.34Å; L62-Y66 HydrophobicContact CD2-CE2 3.99Å; L62-Y66 HydrophobicContact CG-CD1 4.38Å; L62-Y66 HydrophobicContact CG-CD2 4.31Å; L62-Y66 HydrophobicContact CG-CE1 3.97Å; L62-Y66 HydrophobicContact CG-CE2 3.89Å; L62-Y66 WeakPolarHBondContact O-CB 3.09Å; L62-Y66 VanDerWaalsContact O-CG 3.29Å; L62-Y66 PolarHBondContact O-N 3.43Å; Q64-Y66 VanDerWaalsContact C-N 3.34Å; Q64-Y66 PolarHBondContact O-N 2.73Å; Y66-R70 WeakPolarHBondContact O-CB 3.38Å; Y66-R70 VanDerWaalsContact O-CG 3.29Å; Y66-R70 WeakPolarHBondContact O-CG 3.43Å; Y66-R70 PolarHBondContact O-N 3.28Å; Y66-F103 AromaticContact CD1-CD1 3.89Å; Y66-F103 HydrophobicContact CD1-CD1 3.89Å; Y66-F103 AromaticContact CD1-CE1 3.6Å; Y66-F103 HydrophobicContact CD1-CE1 3.6Å; Y66-F103 HydrophobicContact CD1-CZ 4.24Å; Y66-F103 AromaticContact CE1-CD1 3.9Å; Y66-F103 HydrophobicContact CE1-CD1 3.9Å; Y66-F103 AromaticContact CE1-CE1 3.69Å; Y66-F103 HydrophobicContact CE1-CE1 3.69Å; Y66-F103 HydrophobicContact CE1-CE2 4.39Å; Y66-F103 HydrophobicContact CE1-CG 4.35Å; Y66-F103 AromaticContact CE1-CZ 3.95Å; Y66-F103 HydrophobicContact CE1-CZ 3.95Å; Y66-F103 WeakPolarHBondContact CE1-O 3.4Å; Y66-F103 VanDerWaalsContact CZ-O 3.28Å; Y66-F103 PolarHBondContact OH-O 3.35Å; Y66-F104 HydrophobicContact CD1-CB 3.76Å; Y66-F104 HydrophobicContact CE1-CB 4.36Å; Y66-F104 HydrophobicContact CG-CB 3.85Å
67	A	89.3	Confident	89.4	Confident	54 Å²	54	77.5 Å²	77.5	45%	0.446	38%	0.382	S	S	.	.	H	α-helix	trans	-63.4	-43.7	176.2	0	0	0	0	0	111.8	K63 Q64 R70 A71	K63-A67 PolarHBondContact O-N 2.94Å; Q64-A67 PolarHBondContact O-N 3.2Å; A67-R70 PolarHBondContact O-N 3.47Å; A67-A71 PolarHBondContact O-N 2.88Å
68	F	92.2	Very high	89	Confident	102 Å²	102	73.6 Å²	73.6	45%	0.447	38%	0.379	S	S	.	.	H	α-helix	trans	-62	-46.5	177.3	178.9	-106.8	0	0	0	112.6	Q64 Q65 R70 A71 K72	Q64-F68 PolarHBondContact O-N 2.99Å; Q65-F68 PolarHBondContact O-N 2.93Å; F68-R70 VanDerWaalsContact C-N 3.35Å; F68-A71 PolarHBondContact O-N 2.95Å; F68-K72 HydrophobicContact CD1-CD 4.42Å; F68-K72 HydrophobicContact CE1-CD 3.8Å; F68-K72 HydrophobicContact CZ-CD 3.92Å; F68-K72 VanDerWaalsContact CZ-NZ 3.33Å; F68-K72 PolarHBondContact O-N 3.18Å; F68-K72 VanDerWaalsContact O-N 3.07Å
69	Q	90.6	Very high	88.4	Confident	43 Å²	43	77 Å²	77	20%	0.201	38%	0.384	C	S	.	.	H	α-helix	trans	-69.5	-31.4	178.7	-64.5	-64.6	-19.9	0	0	112.5	Q65 F73 F103 F104	Q65-Q69 WeakPolarHBondContact O-CB 3.4Å; Q65-Q69 VanDerWaalsContact O-CG 3.27Å; Q65-Q69 WeakPolarHBondContact O-CG 3.37Å; Q65-Q69 PolarHBondContact O-N 3.04Å; Q69-F73 WeakPolarHBondContact O-CB 3.47Å; Q69-F73 PolarHBondContact O-N 3.36Å; Q69-F103 HydrophobicContact CB-CD1 4.35Å; Q69-F103 HydrophobicContact CG-CD1 3.98Å; Q69-F103 HydrophobicContact CG-CE1 4.05Å; Q69-F104 HydrophobicContact CB-CD1 3.8Å; Q69-F104 HydrophobicContact CB-CE1 4.4Å
70	R	91.6	Very high	87.5	Confident	45 Å²	45	72 Å²	72	17%	0.17	37%	0.37	C	S	.	.	H	α-helix	trans	-61	-49.9	169.9	-81.1	-176.4	-157.8	105.1	10.8	111.6	Y66 A67 F68 K72 F73 D74 F104 D110	Y66-R70 WeakPolarHBondContact O-CB 3.38Å; Y66-R70 VanDerWaalsContact O-CG 3.29Å; Y66-R70 WeakPolarHBondContact O-CG 3.43Å; Y66-R70 PolarHBondContact O-N 3.28Å; A67-R70 PolarHBondContact O-N 3.47Å; F68-R70 VanDerWaalsContact C-N 3.35Å; R70-K72 VanDerWaalsContact C-N 3.32Å; R70-K72 PolarHBondContact O-N 3.44Å; R70-F73 WeakPolarHBondContact O-CB 3.37Å; R70-F73 PolarHBondContact O-N 3.13Å; R70-F73 VanDerWaalsContact O-N 3.08Å; R70-D74 PolarHBondContact O-N 3.27Å; R70-F104 HydrophobicContact CB-CE2 4.46Å; R70-F104 HydrophobicContact CB-CZ 4.49Å; R70-F104 HydrophobicContact CG-CB 4.4Å; R70-F104 HydrophobicContact CG-CD1 4.09Å; R70-F104 HydrophobicContact CG-CD2 3.29Å; R70-F104 HydrophobicContact CG-CE1 4.15Å; R70-F104 HydrophobicContact CG-CE2 3.39Å; R70-F104 HydrophobicContact CG-CG 3.68Å; R70-F104 HydrophobicContact CG-CZ 3.84Å; R70-F104 PolarHBondContact NH2-O 3.42Å; R70-F104 VanDerWaalsContact NH2-O 3.08Å; R70-D110 WeakPolarHBondContact CD-OD1 3.08Å; R70-D110 IonicContact CZ-OD2 2.72Å; R70-D110 IonicContact NE-OD1 3.46Å; R70-D110 PolarHBondContact NE-OD1 2.92Å; R70-D110 IonicContact NE-OD2 3.51Å; R70-D110 PolarHBondContact NE-OD2 3.31Å; R70-D110 VanDerWaalsContact NE-OD2 3.11Å; R70-D110 IonicContact NH2-OD2 3.41Å
71	A	90.4	Very high	86.6	Confident	59 Å²	59	72.4 Å²	72.4	49%	0.488	37%	0.372	S	S	.	.	H	α-helix	trans	-59.2	-44.1	178.8	0	0	0	0	0	111.7	A67 F68 F73 D74 E75	A67-A71 PolarHBondContact O-N 2.88Å; F68-A71 PolarHBondContact O-N 2.95Å; A71-F73 VanDerWaalsContact C-N 3.31Å; A71-F73 PolarHBondContact O-N 2.99Å; A71-D74 PolarHBondContact O-N 2.89Å; A71-E75 WeakPolarHBondContact O-CB 3.5Å; A71-E75 PolarHBondContact O-N 3.47Å
72	K	89	Confident	85.2	Confident	73 Å²	73	72 Å²	72	32%	0.317	38%	0.381	S	S	.	.	H	α-helix	trans	-63.8	-33.6	174.8	-78.8	-166.9	166.5	-178.5	0	113.7	F68 R70 S76 R100	F68-K72 HydrophobicContact CD1-CD 4.42Å; F68-K72 HydrophobicContact CE1-CD 3.8Å; F68-K72 HydrophobicContact CZ-CD 3.92Å; F68-K72 VanDerWaalsContact CZ-NZ 3.33Å; F68-K72 PolarHBondContact O-N 3.18Å; F68-K72 VanDerWaalsContact O-N 3.07Å; R70-K72 VanDerWaalsContact C-N 3.32Å; R70-K72 PolarHBondContact O-N 3.44Å; K72-S76 WeakPolarHBondContact O-CB 3.33Å; K72-S76 PolarHBondContact O-N 3.48Å; K72-S76 PolarHBondContact O-OG 2.99Å; K72-R100 PolarHBondContact O-NH1 3.23Å
73	F	90.8	Very high	83.7	Confident	2 Å²	2	76.2 Å²	76.2	1%	0.009	40%	0.399	C	S	.	.	H	α-helix	trans	-64.2	-51	173.7	-179.8	-83.5	0	0	0	109.9	Q69 R70 A71 E75 S76 V77 L97 R100 L101 F104 R113 W116	Q69-F73 WeakPolarHBondContact O-CB 3.47Å; Q69-F73 PolarHBondContact O-N 3.36Å; R70-F73 WeakPolarHBondContact O-CB 3.37Å; R70-F73 PolarHBondContact O-N 3.13Å; R70-F73 VanDerWaalsContact O-N 3.08Å; A71-F73 VanDerWaalsContact C-N 3.31Å; A71-F73 PolarHBondContact O-N 2.99Å; F73-E75 VanDerWaalsContact C-N 3.33Å; F73-E75 PolarHBondContact O-N 3.06Å; F73-S76 PolarHBondContact O-N 2.98Å; F73-S76 VanDerWaalsContact O-N 3.17Å; F73-V77 HydrophobicContact CD1-CG2 3.91Å; F73-V77 HydrophobicContact CE1-CG2 3.6Å; F73-V77 HydrophobicContact CZ-CG2 4.1Å; F73-V77 WeakPolarHBondContact O-CG2 3.21Å; F73-V77 PolarHBondContact O-N 3.34Å; F73-L97 HydrophobicContact CD2-CB 4.35Å; F73-L97 HydrophobicContact CD2-CD2 3.77Å; F73-L97 HydrophobicContact CE2-CB 3.9Å; F73-L97 HydrophobicContact CE2-CD2 3.94Å; F73-L97 HydrophobicContact CE2-CG 4.48Å; F73-L97 HydrophobicContact CG-CD2 4.38Å; F73-R100 HydrophobicContact CD2-CB 4.3Å; F73-L101 HydrophobicContact CD2-CB 4.46Å; F73-L101 HydrophobicContact CE2-CB 4.05Å; F73-L101 HydrophobicContact CE2-CD1 4.44Å; F73-L101 HydrophobicContact CZ-CD1 4.45Å; F73-F104 HydrophobicContact CB-CE1 3.94Å; F73-F104 HydrophobicContact CB-CZ 3.91Å; F73-F104 HydrophobicContact CD2-CE1 4.48Å; F73-F104 HydrophobicContact CD2-CZ 4.24Å; F73-F104 HydrophobicContact CG-CE1 4.37Å; F73-F104 AromaticContact CG-CZ 3.99Å; F73-F104 HydrophobicContact CG-CZ 3.99Å; F73-R113 HydrophobicContact CD1-CG 4.34Å; F73-R113 HydrophobicContact CE1-CB 3.88Å; F73-R113 HydrophobicContact CE1-CG 4.05Å; F73-R113 HydrophobicContact CZ-CB 4.4Å; F73-W116 HydrophobicContact CZ-CE3 4.4Å
74	D	89.3	Confident	81.9	Confident	55 Å²	55	72 Å²	72	29%	0.294	39%	0.394	S	S	.	.	H	α-helix	trans	-62.7	-38.5	-178.6	-63.5	-19.8	0	0	0	112.3	R70 A71 V77 S78 R113	R70-D74 PolarHBondContact O-N 3.27Å; A71-D74 PolarHBondContact O-N 2.89Å; D74-V77 PolarHBondContact O-N 2.94Å; D74-S78 PolarHBondContact O-N 3.07Å; D74-S78 PolarHBondContact O-OG 2.97Å; D74-S78 VanDerWaalsContact O-OG 3.06Å; D74-R113 IonicContact OD1-CZ 3.57Å; D74-R113 IonicContact OD1-NE 3.5Å; D74-R113 PolarHBondContact OD1-NE 3.44Å; D74-R113 IonicContact OD1-NH2 3.5Å; D74-R113 IonicContact OD2-CZ 3.47Å; D74-R113 IonicContact OD2-NE 3.68Å; D74-R113 PolarHBondContact OD2-NE 3.08Å; D74-R113 IonicContact OD2-NH2 2.72Å; D74-R113 PolarHBondContact OD2-NH2 3.31Å
75	E	87.6	Confident	79.8	Confident	111 Å²	111	72.6 Å²	72.6	52%	0.519	41%	0.408	S	S	.	.	H	α-helix	trans	-60.5	-46.4	173.7	-175.5	-176.8	-166	0	0	111.9	A71 F73 V77 S78 Q79	A71-E75 WeakPolarHBondContact O-CB 3.5Å; A71-E75 PolarHBondContact O-N 3.47Å; F73-E75 VanDerWaalsContact C-N 3.33Å; F73-E75 PolarHBondContact O-N 3.06Å; E75-V77 VanDerWaalsContact C-N 3.31Å; E75-V77 PolarHBondContact O-N 3.4Å; E75-S78 PolarHBondContact O-N 3.23Å; E75-Q79 WeakPolarHBondContact O-CG 3.46Å; E75-Q79 PolarHBondContact O-N 3.32Å
76	S	84.1	Confident	77.7	Confident	23 Å²	23	77.1 Å²	77.1	16%	0.161	43%	0.429	C	S	.	.	H	α-helix	trans	-67.2	-32.4	178.8	-59.3	0	0	0	0	112.3	K72 F73 S80 R100	K72-S76 WeakPolarHBondContact O-CB 3.33Å; K72-S76 PolarHBondContact O-N 3.48Å; K72-S76 PolarHBondContact O-OG 2.99Å; F73-S76 PolarHBondContact O-N 2.98Å; F73-S76 VanDerWaalsContact O-N 3.17Å; S76-S80 WeakPolarHBondContact O-CB 3.44Å; S76-S80 PolarHBondContact O-N 2.88Å; S76-S80 VanDerWaalsContact O-N 3.16Å; S76-S80 PolarHBondContact O-OG 3.32Å; S76-R100 PolarHBondContact OG-NH1 3.32Å
77	V	84.3	Confident	75.8	Confident	16 Å²	16	81.7 Å²	81.7	10%	0.097	45%	0.452	C	S	.	.	H	α-helix	trans	-67.4	-47.1	173.8	170.3	0	0	0	0	110.8	F73 D74 E75 Q79 S80 Q81 W116	F73-V77 HydrophobicContact CD1-CG2 3.91Å; F73-V77 HydrophobicContact CE1-CG2 3.6Å; F73-V77 HydrophobicContact CZ-CG2 4.1Å; F73-V77 WeakPolarHBondContact O-CG2 3.21Å; F73-V77 PolarHBondContact O-N 3.34Å; D74-V77 PolarHBondContact O-N 2.94Å; E75-V77 VanDerWaalsContact C-N 3.31Å; E75-V77 PolarHBondContact O-N 3.4Å; V77-Q79 PolarHBondContact O-N 3Å; V77-S80 PolarHBondContact O-N 3.35Å; V77-Q81 WeakPolarHBondContact O-CG 3.31Å; V77-Q81 PolarHBondContact O-N 3.06Å; V77-Q81 VanDerWaalsContact O-N 3.07Å; V77-W116 HydrophobicContact CB-CH2 4.28Å; V77-W116 HydrophobicContact CB-CZ2 4.4Å; V77-W116 HydrophobicContact CB-CZ3 4.49Å; V77-W116 HydrophobicContact CG1-CD2 4.07Å; V77-W116 HydrophobicContact CG1-CE3 4.36Å; V77-W116 HydrophobicContact CG1-CH2 3.97Å; V77-W116 HydrophobicContact CG1-CZ2 3.62Å; V77-W116 HydrophobicContact CG1-CZ3 4.33Å; V77-W116 HydrophobicContact CG2-CD2 4.41Å; V77-W116 HydrophobicContact CG2-CE3 3.87Å; V77-W116 HydrophobicContact CG2-CH2 3.75Å; V77-W116 HydrophobicContact CG2-CZ2 4.27Å; V77-W116 HydrophobicContact CG2-CZ3 3.54Å
78	S	82.8	Confident	74.2	Confident	76 Å²	76	82.5 Å²	82.5	53%	0.531	45%	0.451	S	S	.	.	H	α-helix	trans	-61.8	-41.3	178.5	-62.7	0	0	0	0	112.3	D74 E75 S80 Q81 A82	D74-S78 PolarHBondContact O-N 3.07Å; D74-S78 PolarHBondContact O-OG 2.97Å; D74-S78 VanDerWaalsContact O-OG 3.06Å; E75-S78 PolarHBondContact O-N 3.23Å; S78-S80 VanDerWaalsContact C-N 3.34Å; S78-S80 PolarHBondContact O-N 2.75Å; S78-Q81 PolarHBondContact O-N 3.44Å; S78-A82 PolarHBondContact O-N 2.99Å; S78-A82 VanDerWaalsContact O-N 3.08Å
79	Q	77.6	Confident	73	Confident	112 Å²	112	79 Å²	79	52%	0.523	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-41.9	174.3	-72.8	170.3	0.9	0	0	111.9	E75 V77 Q81 A82	E75-Q79 WeakPolarHBondContact O-CG 3.46Å; E75-Q79 PolarHBondContact O-N 3.32Å; V77-Q79 PolarHBondContact O-N 3Å; Q79-Q81 VanDerWaalsContact C-N 3.28Å; Q79-Q81 PolarHBondContact O-N 3.36Å; Q79-A82 PolarHBondContact O-N 3.23Å
80	S	71	Confident	72	Confident	38 Å²	38	79.2 Å²	79.2	27%	0.266	45%	0.446	S	S	.	.	H	α-helix	trans	-69.1	-24.9	178.8	-55.1	0	0	0	0	113.3	S76 V77 S78 M89	S76-S80 WeakPolarHBondContact O-CB 3.44Å; S76-S80 PolarHBondContact O-N 2.88Å; S76-S80 VanDerWaalsContact O-N 3.16Å; S76-S80 PolarHBondContact O-OG 3.32Å; V77-S80 PolarHBondContact O-N 3.35Å; S78-S80 VanDerWaalsContact C-N 3.34Å; S78-S80 PolarHBondContact O-N 2.75Å; S80-M89 WeakPolarHBondContact OG-CE 3.44Å
81	Q	69.8	Low	71.1	Confident	119 Å²	119	77.9 Å²	77.9	56%	0.556	44%	0.444	S	S	*	.	H	α-helix	trans	-85.1	-27.2	176.9	-70.2	179.6	11.8	0	0	112.9	V77 S78 Q79 E83	V77-Q81 WeakPolarHBondContact O-CG 3.31Å; V77-Q81 PolarHBondContact O-N 3.06Å; V77-Q81 VanDerWaalsContact O-N 3.07Å; S78-Q81 PolarHBondContact O-N 3.44Å; Q79-Q81 VanDerWaalsContact C-N 3.28Å; Q79-Q81 PolarHBondContact O-N 3.36Å; Q81-E83 VanDerWaalsContact C-N 3.33Å; Q81-E83 PolarHBondContact O-N 2.86Å
82	A	61.5	Low	70.4	Confident	88 Å²	88	78.8 Å²	78.8	73%	0.727	45%	0.448	S	S	*	.	H	α-helix	trans	-73.5	-20.3	-179.3	0	0	0	0	0	113.9	S78 Q79 G84	S78-A82 PolarHBondContact O-N 2.99Å; S78-A82 VanDerWaalsContact O-N 3.08Å; Q79-A82 PolarHBondContact O-N 3.23Å; A82-G84 VanDerWaalsContact C-N 3.32Å; A82-G84 PolarHBondContact O-N 3.44Å
83	E	56.3	Low	70.1	Confident	156 Å²	156	77.7 Å²	77.7	73%	0.729	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	8.8	-177.3	-70.8	-176.3	165.5	0	0	115.2	Q81	Q81-E83 VanDerWaalsContact C-N 3.33Å; Q81-E83 PolarHBondContact O-N 2.86Å
84	G	49.8	Very low	69.7	Low	47 Å²	47	77.6 Å²	77.6	49%	0.485	45%	0.447	S	S	.	.			trans	83.4	154.1	170.8	0	0	0	0	0	115.7	A82 Q86	A82-G84 VanDerWaalsContact C-N 3.32Å; A82-G84 PolarHBondContact O-N 3.44Å; G84-Q86 PolarHBondContact O-N 3.26Å
85	T	45.3	Very low	69.4	Low	147 Å²	147	75.2 Å²	75.2	90%	0.902	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	0.4	-164	15.6	0	0	0	0	117
86	Q	46.7	Very low	69.3	Low	189 Å²	189	73.7 Å²	73.7	88%	0.883	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	-7	-173.6	-76.9	-177.6	-18.4	0	0	115.5	G84	G84-Q86 PolarHBondContact O-N 3.26Å
87	H	52.3	Low	69.4	Low	161 Å²	161	72.6 Å²	72.6	75%	0.745	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-88.9	125.3	178.2	-134.7	-77.1	0	0	0	111.9	M89	H87-M89 PolarHBondContact O-N 3.02Å
88	V	55.8	Low	69.6	Low	71 Å²	71	71.9 Å²	71.9	43%	0.43	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-71.8	122	176	-175.1	0	0	0	0	109.1	A90 Q127	V88-A90 PolarHBondContact O-N 3.46Å; V88-Q127 VanDerWaalsContact CG1-CD 3.44Å
89	M	66.3	Low	69.8	Low	27 Å²	27	73.4 Å²	73.4	13%	0.133	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-61.4	127.1	177.9	-72.4	-163.2	73.8	0	0	111	S80 H87 T93 L94 L97 W116 Q127	S80-M89 WeakPolarHBondContact OG-CE 3.44Å; H87-M89 PolarHBondContact O-N 3.02Å; M89-T93 HydrophobicContact CE-CG2 3.86Å; M89-L94 HydrophobicContact CE-CD2 4.42Å; M89-L94 HydrophobicContact SD-CD2 4.31Å; M89-L97 HydrophobicContact CE-CD1 4.14Å; M89-W116 HydrophobicContact SD-CH2 4.35Å; M89-Q127 PolarHBondContact O-OE1 2.97Å
90	A	70.1	Confident	70.4	Confident	48 Å²	48	70.3 Å²	70.3	40%	0.397	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-63.2	140.5	178.6	0	0	0	0	0	112	V88 S92 T93 L94	V88-A90 PolarHBondContact O-N 3.46Å; A90-S92 PolarHBondContact O-N 3.4Å; A90-T93 WeakPolarHBondContact O-CB 3.34Å; A90-T93 PolarHBondContact O-N 2.93Å; A90-L94 PolarHBondContact O-N 3.14Å
91	A	73.2	Confident	71.4	Confident	17 Å²	17	68.5 Å²	68.5	14%	0.14	38%	0.382	C	S	.	.	H	α-helix	trans	-58.9	-30.6	-179.4	0	0	0	0	0	113.2	L94 C95 Q127 L131	A91-L94 PolarHBondContact O-N 2.99Å; A91-C95 WeakPolarHBondContact O-CB 3.37Å; A91-C95 PolarHBondContact O-N 3.27Å; A91-Q127 HydrophobicContact CB-CB 4.43Å; A91-Q127 WeakPolarHBondContact CB-O 3.34Å; A91-L131 HydrophobicContact CB-CD1 3.84Å; A91-L131 HydrophobicContact CB-CD2 4.09Å; A91-L131 HydrophobicContact CB-CG 3.9Å
92	S	76.1	Confident	72.4	Confident	79 Å²	79	63.9 Å²	63.9	55%	0.552	36%	0.361	S	S	*	.	H	α-helix	trans	-63.4	-39.4	174.8	50	0	0	0	0	112.6	A90 C95 L96	A90-S92 PolarHBondContact O-N 3.4Å; S92-C95 PolarHBondContact O-N 3Å; S92-L96 PolarHBondContact O-N 3.46Å
93	T	81.6	Confident	73.8	Confident	50 Å²	50	64.3 Å²	64.3	31%	0.307	35%	0.346	S	S	.	.	H	α-helix	trans	-67.9	-44.7	177.3	-51.4	0	0	0	0	111	M89 A90 C95 L96 L97	M89-T93 HydrophobicContact CE-CG2 3.86Å; A90-T93 WeakPolarHBondContact O-CB 3.34Å; A90-T93 PolarHBondContact O-N 2.93Å; T93-C95 VanDerWaalsContact C-N 3.32Å; T93-C95 PolarHBondContact O-N 2.91Å; T93-L96 PolarHBondContact O-N 3.39Å; T93-L97 HydrophobicContact CG2-CD1 4.22Å; T93-L97 WeakPolarHBondContact O-CG 3.35Å; T93-L97 PolarHBondContact O-N 3.41Å
94	L	82.4	Confident	75.5	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.7	-39.3	174.8	-69.7	173	0	0	0	112.1	M89 A90 A91 S98 N120 L121 H124 F128	M89-L94 HydrophobicContact CE-CD2 4.42Å; M89-L94 HydrophobicContact SD-CD2 4.31Å; A90-L94 PolarHBondContact O-N 3.14Å; A91-L94 PolarHBondContact O-N 2.99Å; L94-S98 VanDerWaalsContact O-CB 3.26Å; L94-S98 WeakPolarHBondContact O-CB 3.43Å; L94-S98 PolarHBondContact O-N 3.08Å; L94-S98 PolarHBondContact O-OG 2.97Å; L94-N120 HydrophobicContact CD2-CB 4.08Å; L94-L121 HydrophobicContact CB-CD2 4.29Å; L94-L121 HydrophobicContact CD1-CD2 4.47Å; L94-H124 HydrophobicContact CD1-CB 4.07Å; L94-F128 HydrophobicContact CB-CD2 4.06Å; L94-F128 HydrophobicContact CB-CE2 4.39Å
95	C	83.1	Confident	77.5	Confident	4 Å²	4	56 Å²	56	3%	0.027	29%	0.294	C	S	.	.	H	α-helix	trans	-62.5	-43.6	174.1	-176.8	0	0	0	0	111.6	A91 S92 T93 S98 R99 F128 L131 Q143	A91-C95 WeakPolarHBondContact O-CB 3.37Å; A91-C95 PolarHBondContact O-N 3.27Å; S92-C95 PolarHBondContact O-N 3Å; T93-C95 VanDerWaalsContact C-N 3.32Å; T93-C95 PolarHBondContact O-N 2.91Å; C95-S98 PolarHBondContact O-N 3.14Å; C95-R99 WeakPolarHBondContact O-CG 3.45Å; C95-R99 PolarHBondContact O-N 3.26Å; C95-R99 PolarHBondContact SG-NH2 3.06Å; C95-F128 HydrophobicContact CB-CE2 4.49Å; C95-L131 HydrophobicContact CB-CD1 4.11Å; C95-Q143 PolarHBondContact O-NE2 2.91Å; C95-Q143 VanDerWaalsContact O-NE2 3.15Å; C95-Q143 PolarHBondContact SG-NE2 3.36Å
96	L	85.6	Confident	79.4	Confident	79 Å²	79	56 Å²	56	41%	0.414	28%	0.278	S	S	.	.	H	α-helix	trans	-65.4	-46.5	178	-178.5	64	0	0	0	112.2	S92 T93 S98 R99 R100	S92-L96 PolarHBondContact O-N 3.46Å; T93-L96 PolarHBondContact O-N 3.39Å; L96-S98 VanDerWaalsContact C-N 3.31Å; L96-S98 PolarHBondContact O-N 3.04Å; L96-R99 PolarHBondContact O-N 2.95Å; L96-R100 PolarHBondContact O-N 3.47Å
97	L	86.8	Confident	81.2	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-41.4	176.9	-70.4	174	0	0	0	111.3	F73 M89 T93 R99 R100 L101 W116 L117	F73-L97 HydrophobicContact CD2-CB 4.35Å; F73-L97 HydrophobicContact CD2-CD2 3.77Å; F73-L97 HydrophobicContact CE2-CB 3.9Å; F73-L97 HydrophobicContact CE2-CD2 3.94Å; F73-L97 HydrophobicContact CE2-CG 4.48Å; F73-L97 HydrophobicContact CG-CD2 4.38Å; M89-L97 HydrophobicContact CE-CD1 4.14Å; T93-L97 HydrophobicContact CG2-CD1 4.22Å; T93-L97 WeakPolarHBondContact O-CG 3.35Å; T93-L97 PolarHBondContact O-N 3.41Å; L97-R99 PolarHBondContact O-N 3.07Å; L97-R100 PolarHBondContact O-N 2.71Å; L97-L101 PolarHBondContact O-N 2.93Å; L97-W116 HydrophobicContact CD1-CH2 4.36Å; L97-W116 HydrophobicContact CD1-CZ3 4.13Å; L97-L117 HydrophobicContact CB-CD1 4.06Å
98	S	87.4	Confident	82.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.5	-44.5	174.3	-63	0	0	0	0	112.1	L94 C95 L96 R100 I102	L94-S98 VanDerWaalsContact O-CB 3.26Å; L94-S98 WeakPolarHBondContact O-CB 3.43Å; L94-S98 PolarHBondContact O-N 3.08Å; L94-S98 PolarHBondContact O-OG 2.97Å; C95-S98 PolarHBondContact O-N 3.14Å; L96-S98 VanDerWaalsContact C-N 3.31Å; L96-S98 PolarHBondContact O-N 3.04Å; S98-R100 PolarHBondContact O-N 3.36Å; S98-I102 WeakPolarHBondContact O-CB 3.48Å; S98-I102 VanDerWaalsContact O-CD1 3.29Å; S98-I102 WeakPolarHBondContact O-CD1 3.43Å; S98-I102 WeakPolarHBondContact O-CG1 3.38Å; S98-I102 PolarHBondContact O-N 3Å
99	R	88.4	Confident	84	Confident	109 Å²	109	46.5 Å²	46.5	41%	0.411	24%	0.244	S	C	.	.	H	α-helix	trans	-61.1	-45.8	176.3	-67.5	178.4	-169.8	175.1	3.2	112	C95 L96 L97 I102 F103	C95-R99 WeakPolarHBondContact O-CG 3.45Å; C95-R99 PolarHBondContact O-N 3.26Å; C95-R99 PolarHBondContact SG-NH2 3.06Å; L96-R99 PolarHBondContact O-N 2.95Å; L97-R99 PolarHBondContact O-N 3.07Å; R99-I102 PolarHBondContact O-N 3.23Å; R99-F103 PolarHBondContact O-N 3.42Å
100	R	90.1	Very high	85.1	Confident	47 Å²	47	45.2 Å²	45.2	18%	0.177	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-49.7	-179.8	-71.8	-176.2	-179.2	169.3	3.6	110.8	K72 F73 S76 L96 L97 S98 I102 F103 F104	K72-R100 PolarHBondContact O-NH1 3.23Å; F73-R100 HydrophobicContact CD2-CB 4.3Å; S76-R100 PolarHBondContact OG-NH1 3.32Å; L96-R100 PolarHBondContact O-N 3.47Å; L97-R100 PolarHBondContact O-N 2.71Å; S98-R100 PolarHBondContact O-N 3.36Å; R100-I102 PolarHBondContact O-N 3.31Å; R100-F103 WeakPolarHBondContact O-CB 3.36Å; R100-F103 PolarHBondContact O-N 3.48Å; R100-F103 VanDerWaalsContact O-N 3.14Å; R100-F104 VanDerWaalsContact C-CE1 3.48Å; R100-F104 HydrophobicContact CB-CE1 4.17Å; R100-F104 WeakPolarHBondContact O-CD1 3.35Å; R100-F104 WeakPolarHBondContact O-CE1 3.38Å; R100-F104 PolarHBondContact O-N 2.99Å
101	L	90.9	Very high	85.8	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59	-47.6	178.8	-170.5	73.6	0	0	0	111.2	F73 L97 F103 F104 Y105 R113 L114 L117	F73-L101 HydrophobicContact CD2-CB 4.46Å; F73-L101 HydrophobicContact CE2-CB 4.05Å; F73-L101 HydrophobicContact CE2-CD1 4.44Å; F73-L101 HydrophobicContact CZ-CD1 4.45Å; L97-L101 PolarHBondContact O-N 2.93Å; L101-F103 PolarHBondContact O-N 3.21Å; L101-F103 VanDerWaalsContact O-N 3.13Å; L101-F104 HydrophobicContact CB-CZ 4.5Å; L101-F104 HydrophobicContact CD1-CE2 3.68Å; L101-F104 HydrophobicContact CD1-CZ 3.78Å; L101-F104 PolarHBondContact O-N 3.2Å; L101-Y105 HydrophobicContact CD1-CD2 4.32Å; L101-Y105 HydrophobicContact CG-CD2 4.38Å; L101-Y105 WeakPolarHBondContact O-CA 3.46Å; L101-Y105 WeakPolarHBondContact O-CB 3.44Å; L101-Y105 PolarHBondContact O-N 3.3Å; L101-R113 HydrophobicContact CD1-CB 3.9Å; L101-L114 HydrophobicContact CD2-CB 4.2Å; L101-L114 HydrophobicContact CD2-CD1 3.78Å; L101-L117 HydrophobicContact CB-CD2 4.26Å; L101-L117 HydrophobicContact CD2-CB 4.31Å; L101-L117 HydrophobicContact CD2-CD2 3.47Å; L101-L117 VanDerWaalsContact CD2-CD2 3.47Å; L101-L117 HydrophobicContact CG-CD2 4.5Å
102	I	91.9	Very high	86.4	Confident	22 Å²	22	50.6 Å²	50.6	11%	0.113	26%	0.255	C	S	.	.	H	α-helix	trans	-57.7	-31.3	179.6	-68.1	162.2	0	0	0	112.4	S98 R99 R100 F142 Q143 R146 I147 F150	S98-I102 WeakPolarHBondContact O-CB 3.48Å; S98-I102 VanDerWaalsContact O-CD1 3.29Å; S98-I102 WeakPolarHBondContact O-CD1 3.43Å; S98-I102 WeakPolarHBondContact O-CG1 3.38Å; S98-I102 PolarHBondContact O-N 3Å; R99-I102 PolarHBondContact O-N 3.23Å; R100-I102 PolarHBondContact O-N 3.31Å; I102-F142 HydrophobicContact CG2-CE1 4.38Å; I102-Q143 HydrophobicContact CD1-CB 4.06Å; I102-Q143 HydrophobicContact CD1-CG 3.82Å; I102-R146 HydrophobicContact CD1-CB 3.94Å; I102-R146 HydrophobicContact CG1-CB 4.07Å; I102-R146 HydrophobicContact CG2-CB 4.26Å; I102-R146 HydrophobicContact CG2-CG 4.28Å; I102-I147 HydrophobicContact CD1-CG1 4.3Å; I102-I147 HydrophobicContact CG1-CG1 4.34Å; I102-F150 HydrophobicContact CB-CE2 4.39Å; I102-F150 HydrophobicContact CG1-CE2 4Å
103	F	90.7	Very high	87	Confident	97 Å²	97	49.6 Å²	49.6	43%	0.425	24%	0.239	S	C	.	.	H	α-helix	trans	-71.2	-43.8	-179.6	179.2	-105.2	0	0	0	113.2	Q65 Y66 Q69 R99 R100 L101	Q65-F103 HydrophobicContact CB-CE1 4.36Å; Y66-F103 AromaticContact CD1-CD1 3.89Å; Y66-F103 HydrophobicContact CD1-CD1 3.89Å; Y66-F103 AromaticContact CD1-CE1 3.6Å; Y66-F103 HydrophobicContact CD1-CE1 3.6Å; Y66-F103 HydrophobicContact CD1-CZ 4.24Å; Y66-F103 AromaticContact CE1-CD1 3.9Å; Y66-F103 HydrophobicContact CE1-CD1 3.9Å; Y66-F103 AromaticContact CE1-CE1 3.69Å; Y66-F103 HydrophobicContact CE1-CE1 3.69Å; Y66-F103 HydrophobicContact CE1-CE2 4.39Å; Y66-F103 HydrophobicContact CE1-CG 4.35Å; Y66-F103 AromaticContact CE1-CZ 3.95Å; Y66-F103 HydrophobicContact CE1-CZ 3.95Å; Y66-F103 WeakPolarHBondContact CE1-O 3.4Å; Y66-F103 VanDerWaalsContact CZ-O 3.28Å; Y66-F103 PolarHBondContact OH-O 3.35Å; Q69-F103 HydrophobicContact CB-CD1 4.35Å; Q69-F103 HydrophobicContact CG-CD1 3.98Å; Q69-F103 HydrophobicContact CG-CE1 4.05Å; R99-F103 PolarHBondContact O-N 3.42Å; R100-F103 WeakPolarHBondContact O-CB 3.36Å; R100-F103 PolarHBondContact O-N 3.48Å; R100-F103 VanDerWaalsContact O-N 3.14Å; L101-F103 PolarHBondContact O-N 3.21Å; L101-F103 VanDerWaalsContact O-N 3.13Å
104	F	91.4	Very high	87.4	Confident	1 Å²	1	47.2 Å²	47.2	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-107.3	-5.9	-172.8	66.7	-110.7	0	0	0	115.6	Y66 Q69 R70 F73 R100 L101 R106 D110	Y66-F104 HydrophobicContact CD1-CB 3.76Å; Y66-F104 HydrophobicContact CE1-CB 4.36Å; Y66-F104 HydrophobicContact CG-CB 3.85Å; Q69-F104 HydrophobicContact CB-CD1 3.8Å; Q69-F104 HydrophobicContact CB-CE1 4.4Å; R70-F104 HydrophobicContact CB-CE2 4.46Å; R70-F104 HydrophobicContact CB-CZ 4.49Å; R70-F104 HydrophobicContact CG-CB 4.4Å; R70-F104 HydrophobicContact CG-CD1 4.09Å; R70-F104 HydrophobicContact CG-CD2 3.29Å; R70-F104 HydrophobicContact CG-CE1 4.15Å; R70-F104 HydrophobicContact CG-CE2 3.39Å; R70-F104 HydrophobicContact CG-CG 3.68Å; R70-F104 HydrophobicContact CG-CZ 3.84Å; R70-F104 PolarHBondContact NH2-O 3.42Å; R70-F104 VanDerWaalsContact NH2-O 3.08Å; F73-F104 HydrophobicContact CB-CE1 3.94Å; F73-F104 HydrophobicContact CB-CZ 3.91Å; F73-F104 HydrophobicContact CD2-CE1 4.48Å; F73-F104 HydrophobicContact CD2-CZ 4.24Å; F73-F104 HydrophobicContact CG-CE1 4.37Å; F73-F104 AromaticContact CG-CZ 3.99Å; F73-F104 HydrophobicContact CG-CZ 3.99Å; R100-F104 VanDerWaalsContact C-CE1 3.48Å; R100-F104 HydrophobicContact CB-CE1 4.17Å; R100-F104 WeakPolarHBondContact O-CD1 3.35Å; R100-F104 WeakPolarHBondContact O-CE1 3.38Å; R100-F104 PolarHBondContact O-N 2.99Å; L101-F104 HydrophobicContact CB-CZ 4.5Å; L101-F104 HydrophobicContact CD1-CE2 3.68Å; L101-F104 HydrophobicContact CD1-CZ 3.78Å; L101-F104 PolarHBondContact O-N 3.2Å; F104-R106 PolarHBondContact O-N 3.47Å; F104-D110 HydrophobicContact CE2-CB 4.43Å
105	Y	90.5	Very high	87.6	Confident	27 Å²	27	48.3 Å²	48.3	11%	0.106	23%	0.23	C	C	.	.			trans	-53.8	121.2	-168.2	178.2	-100.1	0	0	0	113	L101 Q107 D110 L114 F150	L101-Y105 HydrophobicContact CD1-CD2 4.32Å; L101-Y105 HydrophobicContact CG-CD2 4.38Å; L101-Y105 WeakPolarHBondContact O-CA 3.46Å; L101-Y105 WeakPolarHBondContact O-CB 3.44Å; L101-Y105 PolarHBondContact O-N 3.3Å; Y105-Q107 HydrophobicContact CE1-CB 4.27Å; Y105-D110 HydrophobicContact CD2-CB 3.84Å; Y105-D110 HydrophobicContact CE2-CB 4.2Å; Y105-L114 HydrophobicContact CD2-CB 4.43Å; Y105-L114 HydrophobicContact CE2-CB 3.76Å; Y105-L114 HydrophobicContact CE2-CD2 3.72Å; Y105-L114 HydrophobicContact CE2-CG 4.26Å; Y105-L114 WeakPolarHBondContact OH-CD2 3.47Å; Y105-F150 HydrophobicContact CD1-CB 4.4Å; Y105-F150 AromaticContact CD1-CD1 3.28Å; Y105-F150 HydrophobicContact CD1-CD1 3.28Å; Y105-F150 HydrophobicContact CD1-CD2 4.11Å; Y105-F150 AromaticContact CD1-CE1 3.34Å; Y105-F150 HydrophobicContact CD1-CE1 3.34Å; Y105-F150 HydrophobicContact CD1-CE2 4.16Å; Y105-F150 AromaticContact CD1-CG 3.71Å; Y105-F150 HydrophobicContact CD1-CG 3.71Å; Y105-F150 AromaticContact CD1-CZ 3.81Å; Y105-F150 HydrophobicContact CD1-CZ 3.81Å; Y105-F150 HydrophobicContact CE1-CB 3.92Å; Y105-F150 AromaticContact CE1-CD1 3.38Å; Y105-F150 HydrophobicContact CE1-CD1 3.38Å; Y105-F150 HydrophobicContact CE1-CD2 4.46Å; Y105-F150 AromaticContact CE1-CE1 3.94Å; Y105-F150 HydrophobicContact CE1-CE1 3.94Å; Y105-F150 AromaticContact CE1-CG 3.71Å; Y105-F150 HydrophobicContact CE1-CG 3.71Å; Y105-F150 HydrophobicContact CG-CD1 4.19Å; Y105-F150 HydrophobicContact CG-CD2 4.25Å; Y105-F150 HydrophobicContact CG-CE1 4.12Å; Y105-F150 HydrophobicContact CG-CE2 4.18Å; Y105-F150 HydrophobicContact CG-CG 4.28Å; Y105-F150 HydrophobicContact CG-CZ 4.13Å
106	R	86.4	Confident	87.9	Confident	148 Å²	148	50.4 Å²	50.4	56%	0.558	24%	0.238	S	C	*	.			trans	-128.8	119.7	168.1	-171.9	177.5	-179.1	170.8	1.9	109.2	F104 S108 V109 D110	F104-R106 PolarHBondContact O-N 3.47Å; R106-S108 VanDerWaalsContact C-N 3.29Å; R106-S108 PolarHBondContact O-N 2.91Å; R106-S108 VanDerWaalsContact O-N 3.14Å; R106-V109 PolarHBondContact O-N 2.94Å; R106-D110 PolarHBondContact N-OD2 3.48Å; R106-D110 WeakPolarHBondContact O-CB 3.49Å; R106-D110 PolarHBondContact O-N 3.38Å
107	Q	83.6	Confident	88	Confident	45 Å²	45	46.6 Å²	46.6	21%	0.21	22%	0.218	C	C	.	.	H	α-helix	trans	-51.9	-41.9	-172.1	-178	166.8	-8.7	0	0	114.1	Y105 V109 A111 R153 L154 N157	Y105-Q107 HydrophobicContact CE1-CB 4.27Å; Q107-V109 PolarHBondContact O-N 3.34Å; Q107-A111 WeakPolarHBondContact O-CB 3.2Å; Q107-A111 PolarHBondContact O-N 3.22Å; Q107-R153 PolarHBondContact NE2-O 3.25Å; Q107-L154 HydrophobicContact CG-CD1 4.37Å; Q107-N157 PolarHBondContact NE2-ND2 2.66Å
108	S	81.9	Confident	88.1	Confident	96 Å²	96	46.6 Å²	46.6	67%	0.671	22%	0.218	S	C	*	.	H	α-helix	trans	-67.1	-16	-179.1	64.3	0	0	0	0	115.1	R106	R106-S108 VanDerWaalsContact C-N 3.29Å; R106-S108 PolarHBondContact O-N 2.91Å; R106-S108 VanDerWaalsContact O-N 3.14Å
109	V	84.9	Confident	88.1	Confident	79 Å²	79	51 Å²	51	48%	0.479	24%	0.238	S	C	.	.	H	α-helix	trans	-119.9	-34.8	-175.5	-177.3	0	0	0	0	111.7	R106 Q107 R113	R106-V109 PolarHBondContact O-N 2.94Å; Q107-V109 PolarHBondContact O-N 3.34Å; V109-R113 PolarHBondContact O-NH1 2.74Å
110	D	88.9	Confident	88	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-110.6	10.3	-165.8	-60.8	-51.5	0	0	0	113.6	R70 F104 Y105 R106 H112 R113 L114	R70-D110 WeakPolarHBondContact CD-OD1 3.08Å; R70-D110 IonicContact CZ-OD2 2.72Å; R70-D110 IonicContact NE-OD1 3.46Å; R70-D110 PolarHBondContact NE-OD1 2.92Å; R70-D110 IonicContact NE-OD2 3.51Å; R70-D110 PolarHBondContact NE-OD2 3.31Å; R70-D110 VanDerWaalsContact NE-OD2 3.11Å; R70-D110 IonicContact NH2-OD2 3.41Å; F104-D110 HydrophobicContact CE2-CB 4.43Å; Y105-D110 HydrophobicContact CD2-CB 3.84Å; Y105-D110 HydrophobicContact CE2-CB 4.2Å; R106-D110 PolarHBondContact N-OD2 3.48Å; R106-D110 WeakPolarHBondContact O-CB 3.49Å; R106-D110 PolarHBondContact O-N 3.38Å; D110-H112 PolarHBondContact O-N 3.45Å; D110-R113 PolarHBondContact O-N 2.78Å; D110-R113 IonicContact OD1-CZ 3.74Å; D110-R113 IonicContact OD1-NE 3.38Å; D110-R113 IonicContact OD1-NH1 2.9Å; D110-R113 PolarHBondContact OD1-NH1 3.25Å; D110-L114 PolarHBondContact O-N 3.48Å
111	A	84.9	Confident	87.8	Confident	19 Å²	19	44.7 Å²	44.7	16%	0.157	22%	0.216	C	C	.	.	H	α-helix	trans	-56.3	-44.9	178.6	0	0	0	0	0	112.8	Q107 R113 L114 I115 L154	Q107-A111 WeakPolarHBondContact O-CB 3.2Å; Q107-A111 PolarHBondContact O-N 3.22Å; A111-R113 PolarHBondContact O-N 3.06Å; A111-L114 WeakPolarHBondContact O-CB 3.25Å; A111-L114 PolarHBondContact O-N 3.11Å; A111-I115 WeakPolarHBondContact O-CG1 3.44Å; A111-I115 PolarHBondContact O-N 3.28Å; A111-L154 HydrophobicContact CB-CD1 3.93Å
112	H	85.9	Confident	87.6	Confident	159 Å²	159	46 Å²	46	74%	0.736	22%	0.224	S	C	*	.	H	α-helix	trans	-63.7	-38.7	177.3	-68	-72.3	0	0	0	112.8	D110 L114 I115 W116	D110-H112 PolarHBondContact O-N 3.45Å; H112-L114 VanDerWaalsContact C-N 3.32Å; H112-L114 PolarHBondContact O-N 3.46Å; H112-I115 PolarHBondContact O-N 3.07Å; H112-W116 PolarHBondContact O-N 3.15Å
113	R	89.5	Confident	87.3	Confident	58 Å²	58	52 Å²	52	22%	0.219	25%	0.25	C	C	.	.	H	α-helix	trans	-64	-39.1	175.9	-66.1	-178.5	179.3	78.5	14.1	111.4	F73 D74 L101 V109 D110 A111 L117	F73-R113 HydrophobicContact CD1-CG 4.34Å; F73-R113 HydrophobicContact CE1-CB 3.88Å; F73-R113 HydrophobicContact CE1-CG 4.05Å; F73-R113 HydrophobicContact CZ-CB 4.4Å; D74-R113 IonicContact OD1-CZ 3.57Å; D74-R113 IonicContact OD1-NE 3.5Å; D74-R113 PolarHBondContact OD1-NE 3.44Å; D74-R113 IonicContact OD1-NH2 3.5Å; D74-R113 IonicContact OD2-CZ 3.47Å; D74-R113 IonicContact OD2-NE 3.68Å; D74-R113 PolarHBondContact OD2-NE 3.08Å; D74-R113 IonicContact OD2-NH2 2.72Å; D74-R113 PolarHBondContact OD2-NH2 3.31Å; L101-R113 HydrophobicContact CD1-CB 3.9Å; V109-R113 PolarHBondContact O-NH1 2.74Å; D110-R113 PolarHBondContact O-N 2.78Å; D110-R113 IonicContact OD1-CZ 3.74Å; D110-R113 IonicContact OD1-NE 3.38Å; D110-R113 IonicContact OD1-NH1 2.9Å; D110-R113 PolarHBondContact OD1-NH1 3.25Å; A111-R113 PolarHBondContact O-N 3.06Å; R113-L117 WeakPolarHBondContact O-CB 3.1Å; R113-L117 PolarHBondContact O-N 3.42Å
114	L	89.3	Confident	87	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-46.3	174.5	177.4	66.7	0	0	0	111.7	L101 Y105 D110 A111 H112 W116 L117 C118 I147 F150 L154	L101-L114 HydrophobicContact CD2-CB 4.2Å; L101-L114 HydrophobicContact CD2-CD1 3.78Å; Y105-L114 HydrophobicContact CD2-CB 4.43Å; Y105-L114 HydrophobicContact CE2-CB 3.76Å; Y105-L114 HydrophobicContact CE2-CD2 3.72Å; Y105-L114 HydrophobicContact CE2-CG 4.26Å; Y105-L114 WeakPolarHBondContact OH-CD2 3.47Å; D110-L114 PolarHBondContact O-N 3.48Å; A111-L114 WeakPolarHBondContact O-CB 3.25Å; A111-L114 PolarHBondContact O-N 3.11Å; H112-L114 VanDerWaalsContact C-N 3.32Å; H112-L114 PolarHBondContact O-N 3.46Å; L114-W116 VanDerWaalsContact C-N 3.34Å; L114-W116 PolarHBondContact O-N 3.38Å; L114-L117 PolarHBondContact O-N 2.96Å; L114-C118 WeakPolarHBondContact O-CB 3.26Å; L114-C118 PolarHBondContact O-N 3.15Å; L114-C118 PolarHBondContact O-SG 3.34Å; L114-I147 HydrophobicContact CD1-CG2 4.18Å; L114-F150 HydrophobicContact CD1-CB 4.28Å; L114-F150 HydrophobicContact CD2-CB 3.77Å; L114-L154 HydrophobicContact CD2-CD2 4.25Å
115	I	87.3	Confident	86.6	Confident	23 Å²	23	50.2 Å²	50.2	12%	0.118	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-47.2	178	-68.2	168	0	0	0	110.3	A111 H112 L117 C118 Q119 L154 V167	A111-I115 WeakPolarHBondContact O-CG1 3.44Å; A111-I115 PolarHBondContact O-N 3.28Å; H112-I115 PolarHBondContact O-N 3.07Å; I115-L117 PolarHBondContact O-N 3.47Å; I115-C118 PolarHBondContact O-N 3Å; I115-Q119 WeakPolarHBondContact O-CG 3.41Å; I115-Q119 PolarHBondContact O-N 3.44Å; I115-L154 HydrophobicContact CD1-CD2 4.47Å; I115-L154 HydrophobicContact CG1-CD2 4.15Å; I115-V167 HydrophobicContact CG2-CB 4.23Å; I115-V167 HydrophobicContact CG2-CG1 4.17Å; I115-V167 HydrophobicContact CG2-CG2 4.25Å
116	W	88.4	Confident	86.1	Confident	47 Å²	47	51.7 Å²	51.7	18%	0.178	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-44.5	177.2	-177	89.6	0	0	0	112.1	F73 V77 M89 L97 H112 L114 C118 Q119 N120	F73-W116 HydrophobicContact CZ-CE3 4.4Å; V77-W116 HydrophobicContact CB-CH2 4.28Å; V77-W116 HydrophobicContact CB-CZ2 4.4Å; V77-W116 HydrophobicContact CB-CZ3 4.49Å; V77-W116 HydrophobicContact CG1-CD2 4.07Å; V77-W116 HydrophobicContact CG1-CE3 4.36Å; V77-W116 HydrophobicContact CG1-CH2 3.97Å; V77-W116 HydrophobicContact CG1-CZ2 3.62Å; V77-W116 HydrophobicContact CG1-CZ3 4.33Å; V77-W116 HydrophobicContact CG2-CD2 4.41Å; V77-W116 HydrophobicContact CG2-CE3 3.87Å; V77-W116 HydrophobicContact CG2-CH2 3.75Å; V77-W116 HydrophobicContact CG2-CZ2 4.27Å; V77-W116 HydrophobicContact CG2-CZ3 3.54Å; M89-W116 HydrophobicContact SD-CH2 4.35Å; L97-W116 HydrophobicContact CD1-CH2 4.36Å; L97-W116 HydrophobicContact CD1-CZ3 4.13Å; H112-W116 PolarHBondContact O-N 3.15Å; L114-W116 VanDerWaalsContact C-N 3.34Å; L114-W116 PolarHBondContact O-N 3.38Å; W116-C118 PolarHBondContact O-N 2.94Å; W116-Q119 PolarHBondContact O-N 3.48Å; W116-N120 VanDerWaalsContact CZ2-ND2 3.29Å; W116-N120 WeakPolarHBondContact CZ2-ND2 3.38Å; W116-N120 PolarHBondContact O-N 3.12Å; W116-N120 PolarHBondContact O-ND2 3Å
117	L	88.7	Confident	85.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.3	-43.2	176.9	-175.5	67.7	0	0	0	111.2	L97 L101 R113 L114 I115 N120 L121 I147	L97-L117 HydrophobicContact CB-CD1 4.06Å; L101-L117 HydrophobicContact CB-CD2 4.26Å; L101-L117 HydrophobicContact CD2-CB 4.31Å; L101-L117 HydrophobicContact CD2-CD2 3.47Å; L101-L117 VanDerWaalsContact CD2-CD2 3.47Å; L101-L117 HydrophobicContact CG-CD2 4.5Å; R113-L117 WeakPolarHBondContact O-CB 3.1Å; R113-L117 PolarHBondContact O-N 3.42Å; L114-L117 PolarHBondContact O-N 2.96Å; I115-L117 PolarHBondContact O-N 3.47Å; L117-N120 PolarHBondContact O-N 3.04Å; L117-L121 HydrophobicContact CD2-CD1 4.36Å; L117-L121 HydrophobicContact CG-CD1 3.94Å; L117-L121 HydrophobicContact CG-CG 4.35Å; L117-L121 WeakPolarHBondContact O-CB 3.31Å; L117-L121 WeakPolarHBondContact O-CG 3.33Å; L117-L121 PolarHBondContact O-N 3.34Å; L117-I147 HydrophobicContact CD2-CD1 4.08Å
118	C	89.1	Confident	85.5	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.007	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-42	178.4	-67.6	0	0	0	0	111.9	L114 I115 W116 N120 L121 V122 V167 M171	L114-C118 WeakPolarHBondContact O-CB 3.26Å; L114-C118 PolarHBondContact O-N 3.15Å; L114-C118 PolarHBondContact O-SG 3.34Å; I115-C118 PolarHBondContact O-N 3Å; W116-C118 PolarHBondContact O-N 2.94Å; C118-N120 VanDerWaalsContact C-N 3.32Å; C118-N120 PolarHBondContact O-N 3.43Å; C118-L121 PolarHBondContact O-N 3.39Å; C118-V122 WeakPolarHBondContact O-CB 3.4Å; C118-V122 VanDerWaalsContact O-CG2 3.28Å; C118-V122 WeakPolarHBondContact O-CG2 3.37Å; C118-V122 PolarHBondContact O-N 3.13Å; C118-V167 HydrophobicContact CB-CG1 3.57Å; C118-M171 HydrophobicContact CB-SD 4.37Å
119	Q	88.1	Confident	85.5	Confident	91 Å²	91	41 Å²	41	43%	0.425	20%	0.204	S	C	.	.	H	α-helix	trans	-57.2	-44.9	175.4	-74.5	173.1	-16.9	0	0	111.8	I115 W116 K123 V167	I115-Q119 WeakPolarHBondContact O-CG 3.41Å; I115-Q119 PolarHBondContact O-N 3.44Å; W116-Q119 PolarHBondContact O-N 3.48Å; Q119-K123 WeakPolarHBondContact O-CB 3.49Å; Q119-K123 PolarHBondContact O-N 3.4Å; Q119-V167 HydrophobicContact CG-CB 4.35Å; Q119-V167 HydrophobicContact CG-CG1 3.73Å; Q119-V167 HydrophobicContact CG-CG2 3.65Å
120	N	85.9	Confident	85.2	Confident	24 Å²	24	43.7 Å²	43.7	13%	0.128	21%	0.209	C	C	.	.	H	α-helix	trans	-70.6	-39	178.9	-74.4	-74.1	0	0	0	112.6	L94 W116 L117 C118 K123 H124	L94-N120 HydrophobicContact CD2-CB 4.08Å; W116-N120 VanDerWaalsContact CZ2-ND2 3.29Å; W116-N120 WeakPolarHBondContact CZ2-ND2 3.38Å; W116-N120 PolarHBondContact O-N 3.12Å; W116-N120 PolarHBondContact O-ND2 3Å; L117-N120 PolarHBondContact O-N 3.04Å; C118-N120 VanDerWaalsContact C-N 3.32Å; C118-N120 PolarHBondContact O-N 3.43Å; N120-K123 PolarHBondContact O-N 3.47Å; N120-H124 PolarHBondContact O-CD2 3.39Å; N120-H124 PolarHBondContact O-N 3.21Å
121	L	86.3	Confident	84.7	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.4	-39.5	174.9	-73.6	173.2	0	0	0	112.2	L94 L117 C118 N125 F128 I147 M171 F175	L94-L121 HydrophobicContact CB-CD2 4.29Å; L94-L121 HydrophobicContact CD1-CD2 4.47Å; L117-L121 HydrophobicContact CD2-CD1 4.36Å; L117-L121 HydrophobicContact CG-CD1 3.94Å; L117-L121 HydrophobicContact CG-CG 4.35Å; L117-L121 WeakPolarHBondContact O-CB 3.31Å; L117-L121 WeakPolarHBondContact O-CG 3.33Å; L117-L121 PolarHBondContact O-N 3.34Å; C118-L121 PolarHBondContact O-N 3.39Å; L121-N125 VanDerWaalsContact O-CA 3.26Å; L121-N125 WeakPolarHBondContact O-CA 3.33Å; L121-N125 WeakPolarHBondContact O-CB 3.3Å; L121-N125 PolarHBondContact O-N 3.35Å; L121-F128 HydrophobicContact CD2-CB 4.46Å; L121-F128 HydrophobicContact CD2-CD1 3.87Å; L121-F128 HydrophobicContact CD2-CD2 3.78Å; L121-F128 HydrophobicContact CD2-CE1 3.97Å; L121-F128 HydrophobicContact CD2-CE2 3.9Å; L121-F128 HydrophobicContact CD2-CG 3.77Å; L121-F128 HydrophobicContact CD2-CZ 3.99Å; L121-I147 HydrophobicContact CD1-CD1 3.82Å; L121-I147 HydrophobicContact CD1-CG2 4.47Å; L121-M171 HydrophobicContact CB-CE 4.06Å; L121-M171 HydrophobicContact CB-SD 4.14Å; L121-M171 HydrophobicContact CD1-CE 3.8Å; L121-F175 HydrophobicContact CB-CE2 4.43Å; L121-F175 HydrophobicContact CB-CZ 4.43Å
122	V	86.5	Confident	84.3	Confident	28 Å²	28	44.3 Å²	44.3	17%	0.17	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-47.3	174.3	161	0	0	0	0	110.9	C118 H124 N125 R170 M171 I174	C118-V122 WeakPolarHBondContact O-CB 3.4Å; C118-V122 VanDerWaalsContact O-CG2 3.28Å; C118-V122 WeakPolarHBondContact O-CG2 3.37Å; C118-V122 PolarHBondContact O-N 3.13Å; V122-H124 PolarHBondContact O-N 2.87Å; V122-N125 PolarHBondContact O-ND2 3.05Å; V122-R170 HydrophobicContact CG1-CG 3.96Å; V122-R170 HydrophobicContact CG2-CG 4.4Å; V122-M171 HydrophobicContact CG2-CB 4.35Å; V122-M171 HydrophobicContact CG2-SD 3.92Å; V122-I174 HydrophobicContact CB-CD1 4.16Å; V122-I174 HydrophobicContact CG1-CD1 3.46Å; V122-I174 VanDerWaalsContact CG1-CD1 3.46Å; V122-I174 HydrophobicContact CG2-CD1 4.07Å
123	K	85.4	Confident	83.7	Confident	149 Å²	149	42.1 Å²	42.1	65%	0.648	20%	0.203	S	C	*	.	H	α-helix	trans	-64.3	-37.4	-179.4	-172.5	179.5	178.5	-173.9	0	112.9	Q119 N120	Q119-K123 WeakPolarHBondContact O-CB 3.49Å; Q119-K123 PolarHBondContact O-N 3.4Å; N120-K123 PolarHBondContact O-N 3.47Å
124	H	83.6	Confident	83	Confident	23 Å²	23	41 Å²	41	11%	0.106	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	27.9	-174.9	-59.8	-63.7	0	0	0	113.4	L94 N120 V122 S126 Q127 F128	L94-H124 HydrophobicContact CD1-CB 4.07Å; N120-H124 PolarHBondContact O-CD2 3.39Å; N120-H124 PolarHBondContact O-N 3.21Å; V122-H124 PolarHBondContact O-N 2.87Å; H124-S126 VanDerWaalsContact C-N 3.28Å; H124-S126 PolarHBondContact O-N 3.28Å; H124-Q127 PolarHBondContact O-N 3.18Å; H124-Q127 VanDerWaalsContact O-N 3.12Å; H124-F128 PolarHBondContact O-N 3.39Å
125	N	82.8	Confident	82.1	Confident	37 Å²	37	47.6 Å²	47.6	20%	0.198	25%	0.247	C	C	.	.	H	α-helix	trans	-53.8	-40.5	-174	64.3	55	0	0	0	113.2	L121 V122 Q127 F128 V129 I174 F175	L121-N125 VanDerWaalsContact O-CA 3.26Å; L121-N125 WeakPolarHBondContact O-CA 3.33Å; L121-N125 WeakPolarHBondContact O-CB 3.3Å; L121-N125 PolarHBondContact O-N 3.35Å; V122-N125 PolarHBondContact O-ND2 3.05Å; N125-Q127 VanDerWaalsContact C-N 3.25Å; N125-Q127 PolarHBondContact O-N 2.59Å; N125-F128 PolarHBondContact O-N 2.87Å; N125-V129 WeakPolarHBondContact O-CB 3.47Å; N125-V129 WeakPolarHBondContact O-CG2 3.24Å; N125-V129 PolarHBondContact O-N 3.08Å; N125-I174 HydrophobicContact CB-CG2 4.17Å; N125-F175 HydrophobicContact CB-CZ 4.08Å
126	S	79.8	Confident	81.3	Confident	58 Å²	58	50.4 Å²	50.4	41%	0.406	26%	0.26	S	S	.	.	H	α-helix	trans	-64.6	-29.5	-176.1	62.4	0	0	0	0	112.8	H124 K130	H124-S126 VanDerWaalsContact C-N 3.28Å; H124-S126 PolarHBondContact O-N 3.28Å; S126-K130 VanDerWaalsContact O-CG 3.23Å; S126-K130 WeakPolarHBondContact O-CG 3.3Å; S126-K130 PolarHBondContact O-N 2.94Å
127	Q	77.2	Confident	80.9	Confident	63 Å²	63	53 Å²	53	29%	0.294	27%	0.272	S	S	.	.	H	α-helix	trans	-84.4	-36.3	176.7	-62.5	-167.4	-10.3	0	0	112.3	V88 M89 A91 H124 N125 K130	V88-Q127 VanDerWaalsContact CG1-CD 3.44Å; M89-Q127 PolarHBondContact O-OE1 2.97Å; A91-Q127 HydrophobicContact CB-CB 4.43Å; A91-Q127 WeakPolarHBondContact CB-O 3.34Å; H124-Q127 PolarHBondContact O-N 3.18Å; H124-Q127 VanDerWaalsContact O-N 3.12Å; N125-Q127 VanDerWaalsContact C-N 3.25Å; N125-Q127 PolarHBondContact O-N 2.59Å; Q127-K130 PolarHBondContact O-N 3.21Å
128	F	80.3	Confident	80.5	Confident	1 Å²	1	60.6 Å²	60.6	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-67.9	-41.2	177.2	-171.4	-110.2	0	0	0	111.6	L94 C95 L121 H124 N125 K130 L131 I144 F175	L94-F128 HydrophobicContact CB-CD2 4.06Å; L94-F128 HydrophobicContact CB-CE2 4.39Å; C95-F128 HydrophobicContact CB-CE2 4.49Å; L121-F128 HydrophobicContact CD2-CB 4.46Å; L121-F128 HydrophobicContact CD2-CD1 3.87Å; L121-F128 HydrophobicContact CD2-CD2 3.78Å; L121-F128 HydrophobicContact CD2-CE1 3.97Å; L121-F128 HydrophobicContact CD2-CE2 3.9Å; L121-F128 HydrophobicContact CD2-CG 3.77Å; L121-F128 HydrophobicContact CD2-CZ 3.99Å; H124-F128 PolarHBondContact O-N 3.39Å; N125-F128 PolarHBondContact O-N 2.87Å; F128-K130 VanDerWaalsContact C-N 3.34Å; F128-K130 PolarHBondContact O-N 3.43Å; F128-L131 HydrophobicContact CD2-CD1 4.21Å; F128-L131 HydrophobicContact CE2-CD1 4.45Å; F128-L131 WeakPolarHBondContact O-CB 3.34Å; F128-L131 PolarHBondContact O-N 2.88Å; F128-I144 HydrophobicContact CE1-CD1 4.17Å; F128-I144 HydrophobicContact CE1-CG1 3.72Å; F128-F175 HydrophobicContact CD1-CE1 4.11Å; F128-F175 HydrophobicContact CD1-CZ 4.31Å
129	V	81.6	Confident	80.2	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.9	-30	178.2	177.8	0	0	0	0	111.6	N125 L131 L132 F175 T180 Y181 V184	N125-V129 WeakPolarHBondContact O-CB 3.47Å; N125-V129 WeakPolarHBondContact O-CG2 3.24Å; N125-V129 PolarHBondContact O-N 3.08Å; V129-L131 PolarHBondContact O-N 3.17Å; V129-L131 VanDerWaalsContact O-N 3.09Å; V129-L132 HydrophobicContact CG1-CD1 3.78Å; V129-L132 VanDerWaalsContact O-CB 3.23Å; V129-L132 WeakPolarHBondContact O-CB 3.44Å; V129-L132 VanDerWaalsContact O-CG 3.29Å; V129-L132 WeakPolarHBondContact O-CG 3.39Å; V129-L132 PolarHBondContact O-N 3.03Å; V129-F175 HydrophobicContact CG2-CE1 4.06Å; V129-T180 HydrophobicContact CG2-CG2 3.95Å; V129-Y181 HydrophobicContact CG1-CD1 3.79Å; V129-Y181 HydrophobicContact CG1-CE1 4.24Å; V129-Y181 HydrophobicContact CG2-CE1 4.4Å; V129-V184 HydrophobicContact CB-CG2 4.27Å; V129-V184 HydrophobicContact CG1-CB 4.02Å; V129-V184 HydrophobicContact CG1-CG1 4.41Å; V129-V184 HydrophobicContact CG1-CG2 3.79Å
130	K	80.6	Confident	80	Confident	136 Å²	136	58.8 Å²	58.8	59%	0.591	30%	0.303	S	S	*	.	H	α-helix	trans	-55.8	-25.7	172.5	-82.5	172.7	-174	-173.6	0	113.7	S126 Q127 F128 L132 N133 V184	S126-K130 VanDerWaalsContact O-CG 3.23Å; S126-K130 WeakPolarHBondContact O-CG 3.3Å; S126-K130 PolarHBondContact O-N 2.94Å; Q127-K130 PolarHBondContact O-N 3.21Å; F128-K130 VanDerWaalsContact C-N 3.34Å; F128-K130 PolarHBondContact O-N 3.43Å; K130-L132 PolarHBondContact O-N 3.43Å; K130-N133 PolarHBondContact O-N 3.07Å; K130-V184 HydrophobicContact CG-CG1 4.42Å; K130-V184 HydrophobicContact CG-CG2 4.1Å
131	L	77.8	Confident	80	Confident	27 Å²	27	58.2 Å²	58.2	14%	0.141	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-64.6	-15	174.5	-63.9	173.7	0	0	0	113.3	A91 C95 F128 V129 N133 S134 C140	A91-L131 HydrophobicContact CB-CD1 3.84Å; A91-L131 HydrophobicContact CB-CD2 4.09Å; A91-L131 HydrophobicContact CB-CG 3.9Å; C95-L131 HydrophobicContact CB-CD1 4.11Å; F128-L131 HydrophobicContact CD2-CD1 4.21Å; F128-L131 HydrophobicContact CE2-CD1 4.45Å; F128-L131 WeakPolarHBondContact O-CB 3.34Å; F128-L131 PolarHBondContact O-N 2.88Å; V129-L131 PolarHBondContact O-N 3.17Å; V129-L131 VanDerWaalsContact O-N 3.09Å; L131-N133 PolarHBondContact O-N 3.32Å; L131-S134 WeakPolarHBondContact O-CB 2.96Å; L131-S134 PolarHBondContact O-N 3.08Å; L131-S134 VanDerWaalsContact O-N 3.16Å; L131-S134 PolarHBondContact O-OG 3.18Å; L131-C140 HydrophobicContact CB-CB 4.5Å
132	L	76.7	Confident	80.1	Confident	4 Å²	4	63.7 Å²	63.7	2%	0.021	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-69.2	-21.1	174.5	-64	172.9	0	0	0	113.2	V129 K130 S134 K137 C140 V141 Y181 I185 L194	V129-L132 HydrophobicContact CG1-CD1 3.78Å; V129-L132 VanDerWaalsContact O-CB 3.23Å; V129-L132 WeakPolarHBondContact O-CB 3.44Å; V129-L132 VanDerWaalsContact O-CG 3.29Å; V129-L132 WeakPolarHBondContact O-CG 3.39Å; V129-L132 PolarHBondContact O-N 3.03Å; K130-L132 PolarHBondContact O-N 3.43Å; L132-S134 VanDerWaalsContact C-N 3.33Å; L132-K137 HydrophobicContact CD2-CG 4.31Å; L132-K137 WeakPolarHBondContact O-CB 3.34Å; L132-K137 WeakPolarHBondContact O-CG 3.36Å; L132-C140 HydrophobicContact CD2-CB 3.96Å; L132-V141 HydrophobicContact CD2-CG2 3.54Å; L132-Y181 HydrophobicContact CD1-CD1 3.8Å; L132-Y181 HydrophobicContact CD1-CE1 3.87Å; L132-I185 HydrophobicContact CD1-CD1 4.37Å; L132-L194 HydrophobicContact CD1-CD2 3.92Å
133	N	72.8	Confident	80.2	Confident	113 Å²	113	62.4 Å²	62.4	60%	0.604	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-89	1.9	172.7	-72.7	-9.4	0	0	0	113	K130 L131 V184	K130-N133 PolarHBondContact O-N 3.07Å; L131-N133 PolarHBondContact O-N 3.32Å; N133-V184 PolarHBondContact ND2-O 3.08Å
134	S	75.1	Confident	80.4	Confident	35 Å²	35	55.4 Å²	55.4	25%	0.245	29%	0.286	C	S	.	.	S	Bend	trans	-99.4	166.1	178.5	84.4	0	0	0	0	111	L131 L132 Q136 K137	L131-S134 WeakPolarHBondContact O-CB 2.96Å; L131-S134 PolarHBondContact O-N 3.08Å; L131-S134 VanDerWaalsContact O-N 3.16Å; L131-S134 PolarHBondContact O-OG 3.18Å; L132-S134 VanDerWaalsContact C-N 3.33Å; S134-Q136 PolarHBondContact O-N 3.38Å; S134-Q136 PolarHBondContact OG-N 3.45Å; S134-K137 PolarHBondContact O-N 2.72Å; S134-K137 VanDerWaalsContact O-N 3.13Å
135	P	71.2	Confident	80.7	Confident	140 Å²	140	56.1 Å²	56.1	91%	0.909	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-8.9	173.8	23.4	-34.2	0	0	0	114	K137	P135-K137 VanDerWaalsContact C-N 3.34Å
136	Q	70.3	Confident	81.2	Confident	81 Å²	81	57.6 Å²	57.6	38%	0.379	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	10.7	178	-54.9	-178.9	4.7	0	0	114	S134 Q138 T139 C140	S134-Q136 PolarHBondContact O-N 3.38Å; S134-Q136 PolarHBondContact OG-N 3.45Å; Q136-Q138 PolarHBondContact O-N 3.25Å; Q136-T139 PolarHBondContact O-N 2.98Å; Q136-C140 PolarHBondContact O-N 3.39Å
137	K	78.4	Confident	81.7	Confident	102 Å²	102	54.9 Å²	54.9	44%	0.443	27%	0.273	S	S	.	.	H	α-helix	trans	-45.3	-53.8	-178.8	-177.6	178.9	178.9	177.9	0	113.4	L132 S134 P135 T139 C140 V141	L132-K137 HydrophobicContact CD2-CG 4.31Å; L132-K137 WeakPolarHBondContact O-CB 3.34Å; L132-K137 WeakPolarHBondContact O-CG 3.36Å; S134-K137 PolarHBondContact O-N 2.72Å; S134-K137 VanDerWaalsContact O-N 3.13Å; P135-K137 VanDerWaalsContact C-N 3.34Å; K137-T139 VanDerWaalsContact C-N 3.32Å; K137-T139 PolarHBondContact O-N 3.46Å; K137-C140 PolarHBondContact O-N 2.9Å; K137-V141 WeakPolarHBondContact O-CG2 3.35Å; K137-V141 PolarHBondContact O-N 3.38Å
138	Q	80.3	Confident	82.3	Confident	160 Å²	160	51.9 Å²	51.9	75%	0.748	26%	0.259	S	S	*	.	H	α-helix	trans	-59	-41.8	-178.9	-73.5	-74.2	-13.6	0	0	112.4	Q136 F142	Q136-Q138 PolarHBondContact O-N 3.25Å; Q138-F142 WeakPolarHBondContact O-CB 3.44Å; Q138-F142 PolarHBondContact O-N 3.13Å
139	T	83.1	Confident	82.8	Confident	53 Å²	53	51.8 Å²	51.8	33%	0.325	26%	0.258	S	S	.	.	H	α-helix	trans	-69	-39.4	179.2	-44.7	0	0	0	0	111.9	Q136 K137 F142 Q143	Q136-T139 PolarHBondContact O-N 2.98Å; K137-T139 VanDerWaalsContact C-N 3.32Å; K137-T139 PolarHBondContact O-N 3.46Å; T139-F142 PolarHBondContact O-N 2.77Å; T139-Q143 VanDerWaalsContact O-CG 3.24Å; T139-Q143 WeakPolarHBondContact O-CG 3.36Å; T139-Q143 PolarHBondContact O-N 3.36Å
140	C	84.8	Confident	83.2	Confident	1 Å²	1	52 Å²	52	1%	0.007	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-46.8	176.9	-174.9	0	0	0	0	111.4	L131 L132 Q136 K137 F142 Q143 I144	L131-C140 HydrophobicContact CB-CB 4.5Å; L132-C140 HydrophobicContact CD2-CB 3.96Å; Q136-C140 PolarHBondContact O-N 3.39Å; K137-C140 PolarHBondContact O-N 2.9Å; C140-F142 VanDerWaalsContact C-N 3.33Å; C140-F142 PolarHBondContact O-N 3.24Å; C140-Q143 WeakPolarHBondContact O-CB 3.36Å; C140-Q143 PolarHBondContact O-N 3.11Å; C140-Q143 VanDerWaalsContact O-N 3.15Å; C140-I144 WeakPolarHBondContact O-CG1 3.29Å; C140-I144 PolarHBondContact O-N 3.39Å
141	V	85.6	Confident	83.6	Confident	11 Å²	11	45.5 Å²	45.5	7%	0.067	23%	0.231	C	C	.	.	H	α-helix	trans	-60.2	-42.4	176.1	176.1	0	0	0	0	111.5	L132 K137 Q143 I144 K145 L194	L132-V141 HydrophobicContact CD2-CG2 3.54Å; K137-V141 WeakPolarHBondContact O-CG2 3.35Å; K137-V141 PolarHBondContact O-N 3.38Å; V141-Q143 VanDerWaalsContact C-N 3.35Å; V141-Q143 PolarHBondContact O-N 3.24Å; V141-I144 PolarHBondContact O-N 3.07Å; V141-K145 HydrophobicContact CG1-CD 4.17Å; V141-K145 WeakPolarHBondContact O-CB 3.27Å; V141-K145 WeakPolarHBondContact O-CG 3.37Å; V141-K145 PolarHBondContact O-N 2.96Å; V141-L194 HydrophobicContact CB-CD1 4.42Å; V141-L194 HydrophobicContact CG1-CD1 3.87Å; V141-L194 HydrophobicContact CG2-CD1 3.62Å
142	F	87.8	Confident	84.1	Confident	115 Å²	115	44.2 Å²	44.2	50%	0.504	22%	0.224	S	C	.	.	H	α-helix	trans	-61	-42.1	175.4	177.8	-98	0	0	0	112.4	I102 Q138 T139 C140 R146	I102-F142 HydrophobicContact CG2-CE1 4.38Å; Q138-F142 WeakPolarHBondContact O-CB 3.44Å; Q138-F142 PolarHBondContact O-N 3.13Å; T139-F142 PolarHBondContact O-N 2.77Å; C140-F142 VanDerWaalsContact C-N 3.33Å; C140-F142 PolarHBondContact O-N 3.24Å; F142-R146 HydrophobicContact CD1-CG 4.18Å; F142-R146 HydrophobicContact CD2-CG 4.31Å; F142-R146 HydrophobicContact CE1-CG 3.77Å; F142-R146 HydrophobicContact CE2-CG 3.92Å; F142-R146 HydrophobicContact CG-CG 4.44Å; F142-R146 HydrophobicContact CZ-CG 3.64Å; F142-R146 WeakPolarHBondContact O-CB 3.47Å; F142-R146 VanDerWaalsContact O-CG 3.28Å; F142-R146 WeakPolarHBondContact O-CG 3.4Å; F142-R146 PolarHBondContact O-N 3.12Å
143	Q	88.9	Confident	84.6	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.009	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-47.6	177.3	-72.8	169.9	-1.1	0	0	111.8	C95 I102 T139 C140 V141 K145 R146 I147	C95-Q143 PolarHBondContact O-NE2 2.91Å; C95-Q143 VanDerWaalsContact O-NE2 3.15Å; C95-Q143 PolarHBondContact SG-NE2 3.36Å; I102-Q143 HydrophobicContact CD1-CB 4.06Å; I102-Q143 HydrophobicContact CD1-CG 3.82Å; T139-Q143 VanDerWaalsContact O-CG 3.24Å; T139-Q143 WeakPolarHBondContact O-CG 3.36Å; T139-Q143 PolarHBondContact O-N 3.36Å; C140-Q143 WeakPolarHBondContact O-CB 3.36Å; C140-Q143 PolarHBondContact O-N 3.11Å; C140-Q143 VanDerWaalsContact O-N 3.15Å; V141-Q143 VanDerWaalsContact C-N 3.35Å; V141-Q143 PolarHBondContact O-N 3.24Å; Q143-K145 PolarHBondContact O-N 3.01Å; Q143-R146 PolarHBondContact O-N 3.45Å; Q143-I147 WeakPolarHBondContact O-CB 3.5Å; Q143-I147 VanDerWaalsContact O-CG1 3.26Å; Q143-I147 WeakPolarHBondContact O-CG1 3.35Å; Q143-I147 PolarHBondContact O-N 3.19Å
144	I	89.1	Confident	85.3	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-56	-53	176.8	-68	168.9	0	0	0	109.7	F128 C140 V141 R146 I147 L148 F175 I198	F128-I144 HydrophobicContact CE1-CD1 4.17Å; F128-I144 HydrophobicContact CE1-CG1 3.72Å; C140-I144 WeakPolarHBondContact O-CG1 3.29Å; C140-I144 PolarHBondContact O-N 3.39Å; V141-I144 PolarHBondContact O-N 3.07Å; I144-R146 PolarHBondContact O-N 3.35Å; I144-I147 PolarHBondContact O-N 3.03Å; I144-L148 HydrophobicContact CG2-CD1 3.59Å; I144-L148 HydrophobicContact CG2-CG 4.31Å; I144-L148 WeakPolarHBondContact O-CB 3.39Å; I144-L148 VanDerWaalsContact O-CG 3.25Å; I144-L148 WeakPolarHBondContact O-CG 3.26Å; I144-L148 PolarHBondContact O-N 3.36Å; I144-F175 HydrophobicContact CD1-CD1 4.29Å; I144-F175 HydrophobicContact CD1-CE1 4.42Å; I144-F175 HydrophobicContact CG1-CD1 4.39Å; I144-F175 HydrophobicContact CG2-CB 4.4Å; I144-F175 HydrophobicContact CG2-CD1 4.25Å; I144-I198 HydrophobicContact CG2-CD1 4.07Å
145	K	90.9	Very high	85.7	Confident	38 Å²	38	41.1 Å²	41.1	17%	0.165	20%	0.199	C	C	.	.	H	α-helix	trans	-54.9	-50.7	178.4	-75.1	179.3	-176.3	178.3	0	111.8	V141 Q143 I147 L148 G149 Q197 I198 Y201	V141-K145 HydrophobicContact CG1-CD 4.17Å; V141-K145 WeakPolarHBondContact O-CB 3.27Å; V141-K145 WeakPolarHBondContact O-CG 3.37Å; V141-K145 PolarHBondContact O-N 2.96Å; Q143-K145 PolarHBondContact O-N 3.01Å; K145-I147 PolarHBondContact O-N 3.14Å; K145-L148 PolarHBondContact O-N 3.46Å; K145-G149 PolarHBondContact O-N 2.87Å; K145-Q197 VanDerWaalsContact CE-O 3.28Å; K145-Q197 WeakPolarHBondContact CE-O 3.46Å; K145-I198 HydrophobicContact CG-CG1 4.21Å; K145-Y201 VanDerWaalsContact C-CE1 3.47Å; K145-Y201 HydrophobicContact CB-CD1 3.63Å; K145-Y201 HydrophobicContact CB-CD2 4.44Å; K145-Y201 HydrophobicContact CB-CE1 3.94Å; K145-Y201 HydrophobicContact CB-CG 3.91Å; K145-Y201 HydrophobicContact CD-CD2 4.4Å; K145-Y201 HydrophobicContact CD-CG 4.12Å; K145-Y201 HydrophobicContact CG-CD1 4.21Å; K145-Y201 HydrophobicContact CG-CG 4.11Å; K145-Y201 WeakPolarHBondContact O-CD1 3.42Å; K145-Y201 WeakPolarHBondContact O-CE1 3.29Å
146	R	92.1	Very high	86.2	Confident	68 Å²	68	36.8 Å²	36.8	26%	0.257	17%	0.166	S	C	.	.	H	α-helix	trans	-63.9	-42.7	-177.8	-72.4	-70.6	-75.7	172.9	-6.8	112.8	I102 F142 Q143 I144 G149 F150 Y201	I102-R146 HydrophobicContact CD1-CB 3.94Å; I102-R146 HydrophobicContact CG1-CB 4.07Å; I102-R146 HydrophobicContact CG2-CB 4.26Å; I102-R146 HydrophobicContact CG2-CG 4.28Å; F142-R146 HydrophobicContact CD1-CG 4.18Å; F142-R146 HydrophobicContact CD2-CG 4.31Å; F142-R146 HydrophobicContact CE1-CG 3.77Å; F142-R146 HydrophobicContact CE2-CG 3.92Å; F142-R146 HydrophobicContact CG-CG 4.44Å; F142-R146 HydrophobicContact CZ-CG 3.64Å; F142-R146 WeakPolarHBondContact O-CB 3.47Å; F142-R146 VanDerWaalsContact O-CG 3.28Å; F142-R146 WeakPolarHBondContact O-CG 3.4Å; F142-R146 PolarHBondContact O-N 3.12Å; Q143-R146 PolarHBondContact O-N 3.45Å; I144-R146 PolarHBondContact O-N 3.35Å; R146-G149 PolarHBondContact O-N 2.9Å; R146-F150 VanDerWaalsContact O-CD2 3.24Å; R146-F150 WeakPolarHBondContact O-CD2 3.42Å; R146-F150 WeakPolarHBondContact O-CG 3.35Å; R146-F150 PolarHBondContact O-N 3.19Å; R146-Y201 WeakPolarHBondContact CD-OH 3.29Å
147	I	91	Very high	86.5	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.6	-46.2	179.3	-67.6	169.7	0	0	0	110.3	I102 L114 L117 L121 Q143 I144 K145 G149 F150 C151 M171	I102-I147 HydrophobicContact CD1-CG1 4.3Å; I102-I147 HydrophobicContact CG1-CG1 4.34Å; L114-I147 HydrophobicContact CD1-CG2 4.18Å; L117-I147 HydrophobicContact CD2-CD1 4.08Å; L121-I147 HydrophobicContact CD1-CD1 3.82Å; L121-I147 HydrophobicContact CD1-CG2 4.47Å; Q143-I147 WeakPolarHBondContact O-CB 3.5Å; Q143-I147 VanDerWaalsContact O-CG1 3.26Å; Q143-I147 WeakPolarHBondContact O-CG1 3.35Å; Q143-I147 PolarHBondContact O-N 3.19Å; I144-I147 PolarHBondContact O-N 3.03Å; K145-I147 PolarHBondContact O-N 3.14Å; I147-G149 VanDerWaalsContact C-N 3.29Å; I147-G149 PolarHBondContact O-N 3.4Å; I147-F150 CarbonylContact O-C 3.53Å; I147-F150 WeakPolarHBondContact O-CA 3.16Å; I147-F150 WeakPolarHBondContact O-CB 3.2Å; I147-F150 PolarHBondContact O-N 3.02Å; I147-C151 PolarHBondContact O-N 3.39Å; I147-C151 PolarHBondContact O-SG 3.11Å; I147-C151 VanDerWaalsContact O-SG 3.39Å; I147-M171 HydrophobicContact CG2-CE 4.01Å
148	L	90.6	Very high	85.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.6	-40.4	174.7	-66.5	170.6	0	0	0	111.5	I144 K145 F150 C151 C152 M171 L172 F175 I198 M202	I144-L148 HydrophobicContact CG2-CD1 3.59Å; I144-L148 HydrophobicContact CG2-CG 4.31Å; I144-L148 WeakPolarHBondContact O-CB 3.39Å; I144-L148 VanDerWaalsContact O-CG 3.25Å; I144-L148 WeakPolarHBondContact O-CG 3.26Å; I144-L148 PolarHBondContact O-N 3.36Å; K145-L148 PolarHBondContact O-N 3.46Å; L148-F150 VanDerWaalsContact C-N 3.26Å; L148-F150 PolarHBondContact O-N 2.94Å; L148-C151 WeakPolarHBondContact O-CB 3.4Å; L148-C151 PolarHBondContact O-N 3.42Å; L148-C151 VanDerWaalsContact O-N 3.11Å; L148-C152 PolarHBondContact O-N 2.94Å; L148-C152 PolarHBondContact O-SG 3.36Å; L148-M171 HydrophobicContact CD2-CG 3.82Å; L148-L172 HydrophobicContact CB-CD2 4.42Å; L148-L172 HydrophobicContact CD2-CD2 3.81Å; L148-F175 HydrophobicContact CD1-CB 4.12Å; L148-F175 HydrophobicContact CD2-CB 4.18Å; L148-I198 HydrophobicContact CD1-CG2 3.55Å; L148-M202 HydrophobicContact CB-CG 4.06Å; L148-M202 HydrophobicContact CB-SD 4.13Å; L148-M202 HydrophobicContact CD1-SD 3.87Å; L148-M202 HydrophobicContact CG-SD 4.47Å
149	G	89.8	Confident	84.9	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.4	-19.6	173	0	0	0	0	0	114.9	K145 R146 I147 R153	K145-G149 PolarHBondContact O-N 2.87Å; R146-G149 PolarHBondContact O-N 2.9Å; I147-G149 VanDerWaalsContact C-N 3.29Å; I147-G149 PolarHBondContact O-N 3.4Å; G149-R153 PolarHBondContact O-NE 3.13Å; G149-R153 VanDerWaalsContact O-NE 3.13Å
150	F	90.3	Very high	83.8	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.018	15%	0.15	C	C	.	.	H	α-helix	trans	-81.2	-36.7	167.2	-63.7	-45.8	0	0	0	111.4	I102 Y105 L114 R146 I147 L148 R153 L154	I102-F150 HydrophobicContact CB-CE2 4.39Å; I102-F150 HydrophobicContact CG1-CE2 4Å; Y105-F150 HydrophobicContact CD1-CB 4.4Å; Y105-F150 AromaticContact CD1-CD1 3.28Å; Y105-F150 HydrophobicContact CD1-CD1 3.28Å; Y105-F150 HydrophobicContact CD1-CD2 4.11Å; Y105-F150 AromaticContact CD1-CE1 3.34Å; Y105-F150 HydrophobicContact CD1-CE1 3.34Å; Y105-F150 HydrophobicContact CD1-CE2 4.16Å; Y105-F150 AromaticContact CD1-CG 3.71Å; Y105-F150 HydrophobicContact CD1-CG 3.71Å; Y105-F150 AromaticContact CD1-CZ 3.81Å; Y105-F150 HydrophobicContact CD1-CZ 3.81Å; Y105-F150 HydrophobicContact CE1-CB 3.92Å; Y105-F150 AromaticContact CE1-CD1 3.38Å; Y105-F150 HydrophobicContact CE1-CD1 3.38Å; Y105-F150 HydrophobicContact CE1-CD2 4.46Å; Y105-F150 AromaticContact CE1-CE1 3.94Å; Y105-F150 HydrophobicContact CE1-CE1 3.94Å; Y105-F150 AromaticContact CE1-CG 3.71Å; Y105-F150 HydrophobicContact CE1-CG 3.71Å; Y105-F150 HydrophobicContact CG-CD1 4.19Å; Y105-F150 HydrophobicContact CG-CD2 4.25Å; Y105-F150 HydrophobicContact CG-CE1 4.12Å; Y105-F150 HydrophobicContact CG-CE2 4.18Å; Y105-F150 HydrophobicContact CG-CG 4.28Å; Y105-F150 HydrophobicContact CG-CZ 4.13Å; L114-F150 HydrophobicContact CD1-CB 4.28Å; L114-F150 HydrophobicContact CD2-CB 3.77Å; R146-F150 VanDerWaalsContact O-CD2 3.24Å; R146-F150 WeakPolarHBondContact O-CD2 3.42Å; R146-F150 WeakPolarHBondContact O-CG 3.35Å; R146-F150 PolarHBondContact O-N 3.19Å; I147-F150 CarbonylContact O-C 3.53Å; I147-F150 WeakPolarHBondContact O-CA 3.16Å; I147-F150 WeakPolarHBondContact O-CB 3.2Å; I147-F150 PolarHBondContact O-N 3.02Å; L148-F150 VanDerWaalsContact C-N 3.26Å; L148-F150 PolarHBondContact O-N 2.94Å; F150-R153 VanDerWaalsContact CD1-CZ 3.49Å; F150-R153 PolarHBondContact O-N 2.92Å; F150-L154 WeakPolarHBondContact O-CB 3.24Å; F150-L154 PolarHBondContact O-N 3.4Å
151	C	89.2	Confident	82.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.3	-46.3	172.8	-64.9	0	0	0	0	111.6	I147 L148 R153 L154 L155 P168 L172	I147-C151 PolarHBondContact O-N 3.39Å; I147-C151 PolarHBondContact O-SG 3.11Å; I147-C151 VanDerWaalsContact O-SG 3.39Å; L148-C151 WeakPolarHBondContact O-CB 3.4Å; L148-C151 PolarHBondContact O-N 3.42Å; L148-C151 VanDerWaalsContact O-N 3.11Å; C151-R153 PolarHBondContact O-N 2.9Å; C151-L154 WeakPolarHBondContact O-CB 3.19Å; C151-L154 PolarHBondContact O-N 3.14Å; C151-L154 VanDerWaalsContact O-N 3.17Å; C151-L155 VanDerWaalsContact O-CG 3.29Å; C151-L155 WeakPolarHBondContact O-CG 3.49Å; C151-L155 PolarHBondContact O-N 2.91Å; C151-P168 HydrophobicContact CB-CB 4.06Å; C151-L172 HydrophobicContact CB-CD2 4.39Å
152	C	88.9	Confident	81.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.1	-49.1	175	-61.1	0	0	0	0	111.6	L148 L154 L155 Q156 S210	L148-C152 PolarHBondContact O-N 2.94Å; L148-C152 PolarHBondContact O-SG 3.36Å; C152-L154 VanDerWaalsContact C-N 3.3Å; C152-L154 PolarHBondContact O-N 3.43Å; C152-L155 PolarHBondContact O-N 2.81Å; C152-L155 VanDerWaalsContact O-N 3.17Å; C152-Q156 WeakPolarHBondContact O-CG 3.2Å; C152-Q156 PolarHBondContact O-N 3.09Å; C152-S210 WeakPolarHBondContact CB-OG 3.41Å; C152-S210 PolarHBondContact O-OG 3.32Å
153	R	87.4	Confident	80.7	Confident	80 Å²	80	38.3 Å²	38.3	30%	0.302	20%	0.204	S	C	.	.	H	α-helix	trans	-62.3	-34.9	177.2	-83.3	-177.3	-83	166.2	-9.8	113.6	Q107 G149 F150 C151	Q107-R153 PolarHBondContact NE2-O 3.25Å; G149-R153 PolarHBondContact O-NE 3.13Å; G149-R153 VanDerWaalsContact O-NE 3.13Å; F150-R153 VanDerWaalsContact CD1-CZ 3.49Å; F150-R153 PolarHBondContact O-N 2.92Å; C151-R153 PolarHBondContact O-N 2.9Å
154	L	85.6	Confident	79.9	Confident	2 Å²	2	42 Å²	42	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-66.4	-43.4	175	-172.3	66.3	0	0	0	111	Q107 A111 L114 I115 F150 C151 C152 Q156 N157 L163 P168	Q107-L154 HydrophobicContact CG-CD1 4.37Å; A111-L154 HydrophobicContact CB-CD1 3.93Å; L114-L154 HydrophobicContact CD2-CD2 4.25Å; I115-L154 HydrophobicContact CD1-CD2 4.47Å; I115-L154 HydrophobicContact CG1-CD2 4.15Å; F150-L154 WeakPolarHBondContact O-CB 3.24Å; F150-L154 PolarHBondContact O-N 3.4Å; C151-L154 WeakPolarHBondContact O-CB 3.19Å; C151-L154 PolarHBondContact O-N 3.14Å; C151-L154 VanDerWaalsContact O-N 3.17Å; C152-L154 VanDerWaalsContact C-N 3.3Å; C152-L154 PolarHBondContact O-N 3.43Å; L154-Q156 VanDerWaalsContact C-N 3.3Å; L154-Q156 PolarHBondContact O-N 3.21Å; L154-N157 PolarHBondContact O-N 3.32Å; L154-L163 HydrophobicContact CD1-CD1 4.31Å; L154-L163 HydrophobicContact CD1-CD2 3.99Å; L154-L163 HydrophobicContact CD2-CD2 4.14Å; L154-L163 HydrophobicContact CG-CD2 3.83Å; L154-P168 HydrophobicContact CD2-CG 3.76Å
155	L	84.5	Confident	79.5	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-26.2	178.9	-68.8	172.5	0	0	0	113.5	C151 C152 N157 V165 P168 M169 L172 L214	C151-L155 VanDerWaalsContact O-CG 3.29Å; C151-L155 WeakPolarHBondContact O-CG 3.49Å; C151-L155 PolarHBondContact O-N 2.91Å; C152-L155 PolarHBondContact O-N 2.81Å; C152-L155 VanDerWaalsContact O-N 3.17Å; L155-N157 VanDerWaalsContact C-N 3.28Å; L155-N157 PolarHBondContact O-N 3.33Å; L155-V165 HydrophobicContact CD2-CB 4.36Å; L155-V165 HydrophobicContact CD2-CG1 3.79Å; L155-V165 HydrophobicContact CD2-CG2 4.41Å; L155-P168 HydrophobicContact CD1-CB 4.15Å; L155-P168 HydrophobicContact CD2-CB 3.9Å; L155-P168 HydrophobicContact CD2-CG 4.4Å; L155-P168 HydrophobicContact CG-CB 3.93Å; L155-M169 HydrophobicContact CD1-CG 4.41Å; L155-M169 HydrophobicContact CD1-SD 3.84Å; L155-M169 HydrophobicContact CD2-CG 4.26Å; L155-L172 HydrophobicContact CD1-CD1 3.5Å; L155-L214 HydrophobicContact CD2-CD1 4.05Å
156	Q	82.6	Confident	79.1	Confident	48 Å²	48	44.1 Å²	44.1	22%	0.224	25%	0.246	C	C	.	.	H	α-helix	trans	-63.7	-31.9	175.2	-74.1	172.2	5.9	0	0	113	C152 L154 C158 G206 S210 S213	C152-Q156 WeakPolarHBondContact O-CG 3.2Å; C152-Q156 PolarHBondContact O-N 3.09Å; L154-Q156 VanDerWaalsContact C-N 3.3Å; L154-Q156 PolarHBondContact O-N 3.21Å; Q156-C158 VanDerWaalsContact C-N 3.27Å; Q156-C158 PolarHBondContact O-N 3.01Å; Q156-G206 PolarHBondContact NE2-O 3.3Å; Q156-S210 VanDerWaalsContact CG-OG 3.3Å; Q156-S210 WeakPolarHBondContact CG-OG 3.35Å; Q156-S210 PolarHBondContact NE2-OG 3.13Å; Q156-S210 VanDerWaalsContact NE2-OG 3.14Å; Q156-S213 PolarHBondContact O-OG 3.26Å; Q156-S213 VanDerWaalsContact O-OG 3.08Å
157	N	74.9	Confident	78.8	Confident	85 Å²	85	41.7 Å²	41.7	46%	0.455	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	47.6	-179.9	-69	4.1	0	0	0	111.8	Q107 L154 L155 P159	Q107-N157 PolarHBondContact NE2-ND2 2.66Å; L154-N157 PolarHBondContact O-N 3.32Å; L155-N157 VanDerWaalsContact C-N 3.28Å; L155-N157 PolarHBondContact O-N 3.33Å; N157-P159 WeakPolarHBondContact O-CD 2.93Å
158	C	64.1	Low	78.6	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.014	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-14.1	-176.7	-148.5	0	0	0	0	118.4	Q156 D160 H217 R218	Q156-C158 VanDerWaalsContact C-N 3.27Å; Q156-C158 PolarHBondContact O-N 3.01Å; C158-D160 PolarHBondContact O-N 2.93Å; C158-D160 VanDerWaalsContact O-N 3.08Å; C158-H217 HydrophobicContact CB-CB 4.31Å; C158-R218 PolarHBondContact O-NH2 3.01Å; C158-R218 PolarHBondContact SG-NE 3.32Å
159	P	61.4	Low	78.4	Confident	87 Å²	87	42.5 Å²	42.5	57%	0.565	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.9	-175.4	26.3	-32.8	0	0	0	114.3	N157 D161	N157-P159 WeakPolarHBondContact O-CD 2.93Å; P159-D161 PolarHBondContact O-N 3.37Å
160	D	60.7	Low	78.2	Confident	98 Å²	98	48 Å²	48	52%	0.524	26%	0.264	S	S	.	.			trans	-78.5	105.5	167.9	-74.6	-30.8	0	0	0	110.4	C158 S162 L163 R218	C158-D160 PolarHBondContact O-N 2.93Å; C158-D160 VanDerWaalsContact O-N 3.08Å; D160-S162 PolarHBondContact O-N 3.5Å; D160-L163 HydrophobicContact CB-CB 4.49Å; D160-L163 HydrophobicContact CB-CD1 4.45Å; D160-L163 WeakPolarHBondContact O-CB 3.4Å; D160-L163 PolarHBondContact O-N 3.01Å; D160-L163 VanDerWaalsContact O-N 3.08Å; D160-R218 PolarHBondContact O-NH2 3.47Å
161	D	61	Low	78.2	Confident	134 Å²	134	47.9 Å²	47.9	72%	0.717	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-20	178.1	-87.8	-31.2	0	0	0	114.3	P159 L163 R218	P159-D161 PolarHBondContact O-N 3.37Å; D161-L163 PolarHBondContact O-N 3.47Å; D161-R218 IonicContact OD1-CZ 3.76Å; D161-R218 IonicContact OD1-NH1 2.88Å; D161-R218 PolarHBondContact OD1-NH1 3.01Å; D161-R218 IonicContact OD1-NH2 3.99Å
162	S	62.2	Low	78.2	Confident	115 Å²	115	48 Å²	48	80%	0.804	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-9	176.2	57.5	0	0	0	0	115	D160	D160-S162 PolarHBondContact O-N 3.5Å
163	L	69.3	Low	78.1	Confident	35 Å²	35	51.4 Å²	51.4	18%	0.183	28%	0.28	C	S	.	.	S	Bend	trans	-87	117.7	-170.5	-137.3	151.2	0	0	0	111.4	L154 D160 D161 V165	L154-L163 HydrophobicContact CD1-CD1 4.31Å; L154-L163 HydrophobicContact CD1-CD2 3.99Å; L154-L163 HydrophobicContact CD2-CD2 4.14Å; L154-L163 HydrophobicContact CG-CD2 3.83Å; D160-L163 HydrophobicContact CB-CB 4.49Å; D160-L163 HydrophobicContact CB-CD1 4.45Å; D160-L163 WeakPolarHBondContact O-CB 3.4Å; D160-L163 PolarHBondContact O-N 3.01Å; D160-L163 VanDerWaalsContact O-N 3.08Å; D161-L163 PolarHBondContact O-N 3.47Å; L163-V165 PolarHBondContact O-N 3.47Å
164	N	73.4	Confident	78.1	Confident	78 Å²	78	48.3 Å²	48.3	42%	0.417	27%	0.269	S	S	.	.			trans	-73.3	94.3	178.2	-172.5	-21.6	0	0	0	111.3	A166 P168	N164-A166 VanDerWaalsContact C-N 3.3Å; N164-A166 PolarHBondContact O-N 3.5Å; N164-A166 WeakPolarHBondContact OD1-CB 3.29Å; N164-A166 PolarHBondContact OD1-N 3.2Å; N164-A166 VanDerWaalsContact OD1-N 3.08Å; N164-P168 WeakPolarHBondContact O-CD 3.27Å
165	V	79.6	Confident	78.2	Confident	19 Å²	19	48.2 Å²	48.2	12%	0.115	27%	0.269	C	S	.	.			trans	-67.9	-25.2	178.2	170.1	0	0	0	0	113.1	L155 L163 V167 P168 M169 L214	L155-V165 HydrophobicContact CD2-CB 4.36Å; L155-V165 HydrophobicContact CD2-CG1 3.79Å; L155-V165 HydrophobicContact CD2-CG2 4.41Å; L163-V165 PolarHBondContact O-N 3.47Å; V165-V167 PolarHBondContact O-N 2.94Å; V165-P168 WeakPolarHBondContact O-CD 3.45Å; V165-M169 HydrophobicContact CG1-CG 3.65Å; V165-M169 WeakPolarHBondContact O-CB 3.24Å; V165-M169 WeakPolarHBondContact O-CG 3.35Å; V165-M169 PolarHBondContact O-N 3.07Å; V165-L214 HydrophobicContact CB-CD1 4.5Å; V165-L214 HydrophobicContact CG1-CD1 3.48Å; V165-L214 VanDerWaalsContact CG1-CD1 3.48Å; V165-L214 HydrophobicContact CG1-CD2 4.21Å; V165-L214 HydrophobicContact CG1-CG 4.38Å; V165-L214 HydrophobicContact CG2-CD1 4.15Å
166	A	82.1	Confident	78.3	Confident	66 Å²	66	48 Å²	48	55%	0.545	27%	0.268	S	S	.	.	H	α-helix	trans	-64.1	-39.2	-172.1	0	0	0	0	0	112.5	N164 R170	N164-A166 VanDerWaalsContact C-N 3.3Å; N164-A166 PolarHBondContact O-N 3.5Å; N164-A166 WeakPolarHBondContact OD1-CB 3.29Å; N164-A166 PolarHBondContact OD1-N 3.2Å; N164-A166 VanDerWaalsContact OD1-N 3.08Å; A166-R170 VanDerWaalsContact O-CB 3.26Å; A166-R170 WeakPolarHBondContact O-CB 3.05Å; A166-R170 PolarHBondContact O-N 2.78Å
167	V	85.9	Confident	78.5	Confident	18 Å²	18	47.2 Å²	47.2	11%	0.109	27%	0.268	C	S	.	.	H	α-helix	trans	-68.1	-52	-178.6	173.7	0	0	0	0	111.9	I115 C118 Q119 V165 M169 R170 M171	I115-V167 HydrophobicContact CG2-CB 4.23Å; I115-V167 HydrophobicContact CG2-CG1 4.17Å; I115-V167 HydrophobicContact CG2-CG2 4.25Å; C118-V167 HydrophobicContact CB-CG1 3.57Å; Q119-V167 HydrophobicContact CG-CB 4.35Å; Q119-V167 HydrophobicContact CG-CG1 3.73Å; Q119-V167 HydrophobicContact CG-CG2 3.65Å; V165-V167 PolarHBondContact O-N 2.94Å; V167-M169 VanDerWaalsContact C-N 3.33Å; V167-M169 PolarHBondContact O-N 3.21Å; V167-R170 PolarHBondContact O-N 3.16Å; V167-M171 PolarHBondContact O-N 3.31Å
168	P	87.1	Confident	78.9	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-60.1	-40	174.6	-23.3	33.1	0	0	0	112.9	C151 L154 L155 N164 V165 M171 L172	C151-P168 HydrophobicContact CB-CB 4.06Å; L154-P168 HydrophobicContact CD2-CG 3.76Å; L155-P168 HydrophobicContact CD1-CB 4.15Å; L155-P168 HydrophobicContact CD2-CB 3.9Å; L155-P168 HydrophobicContact CD2-CG 4.4Å; L155-P168 HydrophobicContact CG-CB 3.93Å; N164-P168 WeakPolarHBondContact O-CD 3.27Å; V165-P168 WeakPolarHBondContact O-CD 3.45Å; P168-M171 WeakPolarHBondContact O-CB 3.47Å; P168-M171 PolarHBondContact O-N 2.91Å; P168-L172 WeakPolarHBondContact O-CG 3.15Å; P168-L172 PolarHBondContact O-N 3.49Å
169	M	85.8	Confident	79.8	Confident	16 Å²	16	57.4 Å²	57.4	8%	0.079	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-44.3	176	-76.9	-60.8	-63.2	0	0	112.1	L155 V165 V167 M171 L172 E173 L214 L237	L155-M169 HydrophobicContact CD1-CG 4.41Å; L155-M169 HydrophobicContact CD1-SD 3.84Å; L155-M169 HydrophobicContact CD2-CG 4.26Å; V165-M169 HydrophobicContact CG1-CG 3.65Å; V165-M169 WeakPolarHBondContact O-CB 3.24Å; V165-M169 WeakPolarHBondContact O-CG 3.35Å; V165-M169 PolarHBondContact O-N 3.07Å; V167-M169 VanDerWaalsContact C-N 3.33Å; V167-M169 PolarHBondContact O-N 3.21Å; M169-M171 VanDerWaalsContact C-N 3.27Å; M169-M171 PolarHBondContact O-N 2.81Å; M169-L172 WeakPolarHBondContact O-CB 3.29Å; M169-L172 PolarHBondContact O-N 2.97Å; M169-L172 VanDerWaalsContact O-N 3.14Å; M169-L172 HydrophobicContact SD-CD1 4.18Å; M169-E173 PolarHBondContact O-N 3.16Å; M169-L214 HydrophobicContact CE-CD2 4.46Å; M169-L214 HydrophobicContact CG-CD2 4.43Å; M169-L214 HydrophobicContact SD-CD2 4.06Å; M169-L237 HydrophobicContact CE-CD2 3.57Å; M169-L237 HydrophobicContact SD-CD2 4.42Å
170	R	86.9	Confident	80.9	Confident	115 Å²	115	54 Å²	54	43%	0.434	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-33.5	176.7	-169.8	60.5	176.8	175.8	7.2	112.4	V122 A166 V167 E173 I174	V122-R170 HydrophobicContact CG1-CG 3.96Å; V122-R170 HydrophobicContact CG2-CG 4.4Å; A166-R170 VanDerWaalsContact O-CB 3.26Å; A166-R170 WeakPolarHBondContact O-CB 3.05Å; A166-R170 PolarHBondContact O-N 2.78Å; V167-R170 PolarHBondContact O-N 3.16Å; R170-E173 WeakPolarHBondContact CD-OE2 3.4Å; R170-E173 IonicContact CZ-OE1 3.79Å; R170-E173 IonicContact CZ-OE2 3.66Å; R170-E173 IonicContact NE-OE2 3.94Å; R170-E173 IonicContact NH1-OE1 2.72Å; R170-E173 PolarHBondContact NH1-OE1 3.23Å; R170-E173 IonicContact NH1-OE2 2.7Å; R170-E173 PolarHBondContact NH1-OE2 3.29Å; R170-E173 PolarHBondContact O-N 2.9Å; R170-I174 HydrophobicContact CG-CD1 3.81Å; R170-I174 HydrophobicContact CG-CG1 4.37Å; R170-I174 WeakPolarHBondContact O-CB 3.17Å; R170-I174 WeakPolarHBondContact O-CG1 3.48Å; R170-I174 PolarHBondContact O-N 3.38Å
171	M	89.9	Confident	82.1	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-44.4	173.1	-170	73.2	-174	0	0	111.3	C118 L121 V122 I147 L148 V167 P168 M169 F175	C118-M171 HydrophobicContact CB-SD 4.37Å; L121-M171 HydrophobicContact CB-CE 4.06Å; L121-M171 HydrophobicContact CB-SD 4.14Å; L121-M171 HydrophobicContact CD1-CE 3.8Å; V122-M171 HydrophobicContact CG2-CB 4.35Å; V122-M171 HydrophobicContact CG2-SD 3.92Å; I147-M171 HydrophobicContact CG2-CE 4.01Å; L148-M171 HydrophobicContact CD2-CG 3.82Å; V167-M171 PolarHBondContact O-N 3.31Å; P168-M171 WeakPolarHBondContact O-CB 3.47Å; P168-M171 PolarHBondContact O-N 2.91Å; M169-M171 VanDerWaalsContact C-N 3.27Å; M169-M171 PolarHBondContact O-N 2.81Å; M171-F175 HydrophobicContact CE-CD2 3.38Å; M171-F175 HydrophobicContact CE-CE2 3.32Å; M171-F175 HydrophobicContact CE-CG 4.1Å; M171-F175 HydrophobicContact CE-CZ 3.98Å; M171-F175 HydrophobicContact CG-CD2 4.22Å; M171-F175 PolarHBondContact O-N 3.25Å; M171-F175 VanDerWaalsContact O-N 3.13Å; M171-F175 HydrophobicContact SD-CD2 3.47Å; M171-F175 WeakPolarHBondContact SD-CD2 3.39Å; M171-F175 HydrophobicContact SD-CE2 3.38Å; M171-F175 WeakPolarHBondContact SD-CE2 3.43Å; M171-F175 HydrophobicContact SD-CZ 4.48Å
172	L	88.1	Confident	83.1	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-62.7	-43.7	175.4	-64.6	177.4	0	0	0	111.6	L148 C151 L155 P168 M169 S176 M202 Y207	L148-L172 HydrophobicContact CB-CD2 4.42Å; L148-L172 HydrophobicContact CD2-CD2 3.81Å; C151-L172 HydrophobicContact CB-CD2 4.39Å; L155-L172 HydrophobicContact CD1-CD1 3.5Å; P168-L172 WeakPolarHBondContact O-CG 3.15Å; P168-L172 PolarHBondContact O-N 3.49Å; M169-L172 WeakPolarHBondContact O-CB 3.29Å; M169-L172 PolarHBondContact O-N 2.97Å; M169-L172 VanDerWaalsContact O-N 3.14Å; M169-L172 HydrophobicContact SD-CD1 4.18Å; L172-S176 WeakPolarHBondContact O-CB 3.45Å; L172-S176 PolarHBondContact O-N 3.37Å; L172-S176 VanDerWaalsContact O-N 3.11Å; L172-S176 PolarHBondContact O-OG 3.42Å; L172-M202 HydrophobicContact CD2-CE 3.56Å; L172-M202 HydrophobicContact CD2-SD 4.37Å; L172-Y207 HydrophobicContact CD1-CE2 4.05Å; L172-Y207 HydrophobicContact CD2-CE2 4.47Å
173	E	87.3	Confident	83.8	Confident	72 Å²	72	47.6 Å²	47.6	34%	0.336	24%	0.237	S	C	.	.	H	α-helix	trans	-63.6	-51.5	-179.8	-171.1	-167.4	156.5	0	0	111.8	M169 R170 S176 S177 H240	M169-E173 PolarHBondContact O-N 3.16Å; R170-E173 WeakPolarHBondContact CD-OE2 3.4Å; R170-E173 IonicContact CZ-OE1 3.79Å; R170-E173 IonicContact CZ-OE2 3.66Å; R170-E173 IonicContact NE-OE2 3.94Å; R170-E173 IonicContact NH1-OE1 2.72Å; R170-E173 PolarHBondContact NH1-OE1 3.23Å; R170-E173 IonicContact NH1-OE2 2.7Å; R170-E173 PolarHBondContact NH1-OE2 3.29Å; R170-E173 PolarHBondContact O-N 2.9Å; E173-S176 PolarHBondContact O-OG 3.04Å; E173-S177 WeakPolarHBondContact O-CB 3.37Å; E173-S177 PolarHBondContact O-N 3.3Å; E173-H240 WeakPolarHBondContact CA-NE2 3.44Å
174	I	87.3	Confident	84	Confident	15 Å²	15	46.9 Å²	46.9	8%	0.077	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-49.7	-175.6	-70.2	173.3	0	0	0	111.2	V122 N125 R170 S176 S177 T180	V122-I174 HydrophobicContact CB-CD1 4.16Å; V122-I174 HydrophobicContact CG1-CD1 3.46Å; V122-I174 VanDerWaalsContact CG1-CD1 3.46Å; V122-I174 HydrophobicContact CG2-CD1 4.07Å; N125-I174 HydrophobicContact CB-CG2 4.17Å; R170-I174 HydrophobicContact CG-CD1 3.81Å; R170-I174 HydrophobicContact CG-CG1 4.37Å; R170-I174 WeakPolarHBondContact O-CB 3.17Å; R170-I174 WeakPolarHBondContact O-CG1 3.48Å; R170-I174 PolarHBondContact O-N 3.38Å; I174-S176 VanDerWaalsContact C-N 3.27Å; I174-S176 PolarHBondContact O-N 2.79Å; I174-S177 PolarHBondContact O-N 3.02Å; I174-T180 HydrophobicContact CG2-CG2 4.03Å; I174-T180 VanDerWaalsContact O-CB 3.32Å; I174-T180 WeakPolarHBondContact O-CB 3.49Å; I174-T180 PolarHBondContact O-OG1 3.39Å
175	F	88	Confident	84.3	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-84	0.4	-175.1	-71.5	-87.2	0	0	0	113.7	L121 N125 F128 V129 I144 L148 M171 Y181	L121-F175 HydrophobicContact CB-CE2 4.43Å; L121-F175 HydrophobicContact CB-CZ 4.43Å; N125-F175 HydrophobicContact CB-CZ 4.08Å; F128-F175 HydrophobicContact CD1-CE1 4.11Å; F128-F175 HydrophobicContact CD1-CZ 4.31Å; V129-F175 HydrophobicContact CG2-CE1 4.06Å; I144-F175 HydrophobicContact CD1-CD1 4.29Å; I144-F175 HydrophobicContact CD1-CE1 4.42Å; I144-F175 HydrophobicContact CG1-CD1 4.39Å; I144-F175 HydrophobicContact CG2-CB 4.4Å; I144-F175 HydrophobicContact CG2-CD1 4.25Å; L148-F175 HydrophobicContact CD1-CB 4.12Å; L148-F175 HydrophobicContact CD2-CB 4.18Å; M171-F175 HydrophobicContact CE-CD2 3.38Å; M171-F175 HydrophobicContact CE-CE2 3.32Å; M171-F175 HydrophobicContact CE-CG 4.1Å; M171-F175 HydrophobicContact CE-CZ 3.98Å; M171-F175 HydrophobicContact CG-CD2 4.22Å; M171-F175 PolarHBondContact O-N 3.25Å; M171-F175 VanDerWaalsContact O-N 3.13Å; M171-F175 HydrophobicContact SD-CD2 3.47Å; M171-F175 WeakPolarHBondContact SD-CD2 3.39Å; M171-F175 HydrophobicContact SD-CE2 3.38Å; M171-F175 WeakPolarHBondContact SD-CE2 3.43Å; M171-F175 HydrophobicContact SD-CZ 4.48Å; F175-Y181 WeakPolarHBondContact O-CE2 3.49Å; F175-Y181 PolarHBondContact O-OH 3.14Å
176	S	86.4	Confident	84	Confident	1 Å²	1	49 Å²	49	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-99.9	-8.8	163.6	70.1	0	0	0	0	112.8	L172 E173 I174 L195 K243	L172-S176 WeakPolarHBondContact O-CB 3.45Å; L172-S176 PolarHBondContact O-N 3.37Å; L172-S176 VanDerWaalsContact O-N 3.11Å; L172-S176 PolarHBondContact O-OG 3.42Å; E173-S176 PolarHBondContact O-OG 3.04Å; I174-S176 VanDerWaalsContact C-N 3.27Å; I174-S176 PolarHBondContact O-N 2.79Å; S176-L195 WeakPolarHBondContact O-CD2 3.49Å; S176-K243 WeakPolarHBondContact O-CE 3.38Å; S176-K243 PolarHBondContact O-NZ 3.49Å; S176-K243 PolarHBondContact OG-NZ 3.25Å
177	S	86.9	Confident	84	Confident	31 Å²	31	49 Å²	49	22%	0.217	24%	0.242	C	C	.	.			trans	-81.8	133.8	-176.7	-173.1	0	0	0	0	112.4	E173 I174 R179 T180 Y181	E173-S177 WeakPolarHBondContact O-CB 3.37Å; E173-S177 PolarHBondContact O-N 3.3Å; I174-S177 PolarHBondContact O-N 3.02Å; S177-R179 PolarHBondContact O-N 3.14Å; S177-R179 PolarHBondContact OG-N 3.05Å; S177-T180 WeakPolarHBondContact O-CB 3.43Å; S177-T180 PolarHBondContact O-N 3.4Å; S177-Y181 WeakPolarHBondContact O-CD2 3.28Å
178	E	83.9	Confident	83.8	Confident	97 Å²	97	50.9 Å²	50.9	45%	0.453	26%	0.26	S	S	.	.	H	α-helix	trans	-57.2	-38.3	172.8	-70.4	175.7	-173.7	0	0	112.2	T180 Y181 L182 L195	E178-T180 PolarHBondContact O-N 2.58Å; E178-T180 VanDerWaalsContact O-N 3.14Å; E178-Y181 PolarHBondContact O-N 3.19Å; E178-L182 HydrophobicContact CB-CD1 4.11Å; E178-L182 WeakPolarHBondContact O-CG 3.33Å; E178-L182 PolarHBondContact O-N 2.87Å; E178-L195 HydrophobicContact CB-CD1 4.25Å; E178-L195 HydrophobicContact CG-CD1 3.36Å
179	R	83.6	Confident	83.5	Confident	204 Å²	204	56.8 Å²	56.8	77%	0.77	29%	0.291	S	S	*	.	H	α-helix	trans	-56.9	-33	-178.8	-64.5	-177.7	-179.6	166.1	1.2	112.4	S177 Y181 L183	S177-R179 PolarHBondContact O-N 3.14Å; S177-R179 PolarHBondContact OG-N 3.05Å; R179-Y181 VanDerWaalsContact C-N 3.33Å; R179-Y181 PolarHBondContact O-N 3.13Å; R179-L183 WeakPolarHBondContact O-CG 3.25Å
180	T	84.4	Confident	83.4	Confident	15 Å²	15	60 Å²	60	9%	0.092	31%	0.309	C	S	.	.	H	α-helix	trans	-67.2	-35.5	-179.5	-57.8	0	0	0	0	112.1	V129 I174 S177 E178	V129-T180 HydrophobicContact CG2-CG2 3.95Å; I174-T180 HydrophobicContact CG2-CG2 4.03Å; I174-T180 VanDerWaalsContact O-CB 3.32Å; I174-T180 WeakPolarHBondContact O-CB 3.49Å; I174-T180 PolarHBondContact O-OG1 3.39Å; S177-T180 WeakPolarHBondContact O-CB 3.43Å; S177-T180 PolarHBondContact O-N 3.4Å; E178-T180 PolarHBondContact O-N 2.58Å; E178-T180 VanDerWaalsContact O-N 3.14Å
181	Y	84.7	Confident	83.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-96.1	-32.6	-174.3	-62.3	-75.7	0	0	0	113	V129 L132 F175 S177 E178 R179 L183 V184 I185 L194 L195 I198	V129-Y181 HydrophobicContact CG1-CD1 3.79Å; V129-Y181 HydrophobicContact CG1-CE1 4.24Å; V129-Y181 HydrophobicContact CG2-CE1 4.4Å; L132-Y181 HydrophobicContact CD1-CD1 3.8Å; L132-Y181 HydrophobicContact CD1-CE1 3.87Å; F175-Y181 WeakPolarHBondContact O-CE2 3.49Å; F175-Y181 PolarHBondContact O-OH 3.14Å; S177-Y181 WeakPolarHBondContact O-CD2 3.28Å; E178-Y181 PolarHBondContact O-N 3.19Å; R179-Y181 VanDerWaalsContact C-N 3.33Å; R179-Y181 PolarHBondContact O-N 3.13Å; Y181-L183 PolarHBondContact O-N 3.39Å; Y181-V184 PolarHBondContact O-N 3.35Å; Y181-I185 PolarHBondContact O-N 3.12Å; Y181-L194 HydrophobicContact CD1-CD2 3.63Å; Y181-L194 HydrophobicContact CE1-CD2 3.71Å; Y181-L194 HydrophobicContact CG-CD2 4.23Å; Y181-L195 HydrophobicContact CD2-CD2 3.82Å; Y181-L195 HydrophobicContact CD2-CG 4.38Å; Y181-L195 HydrophobicContact CE2-CD2 3.57Å; Y181-I198 WeakPolarHBondContact OH-CD1 3.45Å
182	L	81.8	Confident	83	Confident	74 Å²	74	56 Å²	56	39%	0.387	30%	0.3	S	S	.	.	H	α-helix	trans	-60.1	-27	177.7	-74.9	169.1	0	0	0	113.2	E178 V184 A188 V191	E178-L182 HydrophobicContact CB-CD1 4.11Å; E178-L182 WeakPolarHBondContact O-CG 3.33Å; E178-L182 PolarHBondContact O-N 2.87Å; L182-V184 PolarHBondContact O-N 3.38Å; L182-A188 HydrophobicContact CD2-CB 4.41Å; L182-V191 HydrophobicContact CD2-CB 4.47Å; L182-V191 HydrophobicContact CD2-CG2 4.1Å; L182-V191 HydrophobicContact CG-CG1 4.45Å; L182-V191 HydrophobicContact CG-CG2 4.44Å
183	L	77.1	Confident	82.9	Confident	140 Å²	140	57.3 Å²	57.3	73%	0.733	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.8	174.6	-68.2	171	0	0	0	113.6	R179 Y181	R179-L183 WeakPolarHBondContact O-CG 3.25Å; Y181-L183 PolarHBondContact O-N 3.39Å
184	V	74.6	Confident	82.9	Confident	19 Å²	19	54.6 Å²	54.6	12%	0.115	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-35.6	-173.5	178.8	0	0	0	0	112.2	V129 K130 N133 Y181 L182	V129-V184 HydrophobicContact CB-CG2 4.27Å; V129-V184 HydrophobicContact CG1-CB 4.02Å; V129-V184 HydrophobicContact CG1-CG1 4.41Å; V129-V184 HydrophobicContact CG1-CG2 3.79Å; K130-V184 HydrophobicContact CG-CG1 4.42Å; K130-V184 HydrophobicContact CG-CG2 4.1Å; N133-V184 PolarHBondContact ND2-O 3.08Å; Y181-V184 PolarHBondContact O-N 3.35Å; L182-V184 PolarHBondContact O-N 3.38Å
185	I	78	Confident	83	Confident	16 Å²	16	53.9 Å²	53.9	8%	0.082	29%	0.294	C	S	.	.			trans	-112.2	109.2	178.5	-58.6	173	0	0	0	107.2	L132 Y181 D187 N190 V191 L194	L132-I185 HydrophobicContact CD1-CD1 4.37Å; Y181-I185 PolarHBondContact O-N 3.12Å; I185-D187 VanDerWaalsContact C-N 3.27Å; I185-D187 PolarHBondContact O-N 3.2Å; I185-N190 HydrophobicContact CG2-CB 4.03Å; I185-V191 HydrophobicContact CB-CG2 3.82Å; I185-V191 HydrophobicContact CG2-CG2 3.94Å; I185-L194 HydrophobicContact CD1-CD2 4.44Å
186	P	74.7	Confident	83.1	Confident	125 Å²	125	54.2 Å²	54.2	81%	0.812	30%	0.295	S	S	*	.			trans	-73	-17.2	-175	26.9	-33.2	0	0	0	113.8
187	D	81.7	Confident	83.2	Confident	66 Å²	66	57.4 Å²	57.4	35%	0.353	31%	0.31	S	S	.	.			trans	-89	112.2	179.1	178.8	13.2	0	0	0	111.9	I185 N189 N190 V191	I185-D187 VanDerWaalsContact C-N 3.27Å; I185-D187 PolarHBondContact O-N 3.2Å; D187-N189 VanDerWaalsContact C-N 3.26Å; D187-N189 PolarHBondContact O-N 2.93Å; D187-N189 PolarHBondContact OD1-N 3.39Å; D187-N190 HydrophobicContact CB-CB 4.21Å; D187-N190 PolarHBondContact O-N 3.39Å; D187-N190 PolarHBondContact OD2-ND2 2.92Å; D187-V191 PolarHBondContact O-N 3.23Å; D187-V191 VanDerWaalsContact O-N 3.17Å
188	A	80.8	Confident	83.3	Confident	59 Å²	59	55.9 Å²	55.9	49%	0.488	30%	0.3	S	S	.	.	H	α-helix	trans	-59.8	-32.8	179.7	0	0	0	0	0	113.2	L182 V191 A192	L182-A188 HydrophobicContact CD2-CB 4.41Å; A188-V191 PolarHBondContact O-N 3.18Å; A188-A192 WeakPolarHBondContact O-CB 3.28Å; A188-A192 PolarHBondContact O-N 3.2Å
189	N	82.1	Confident	83.7	Confident	125 Å²	125	51.4 Å²	51.4	67%	0.668	28%	0.278	S	S	*	.	H	α-helix	trans	-69.6	-39.7	180	-69	-31.5	0	0	0	111.6	D187 V191 A192 S193	D187-N189 VanDerWaalsContact C-N 3.26Å; D187-N189 PolarHBondContact O-N 2.93Å; D187-N189 PolarHBondContact OD1-N 3.39Å; N189-V191 VanDerWaalsContact C-N 3.34Å; N189-A192 PolarHBondContact O-N 2.91Å; N189-S193 WeakPolarHBondContact O-CB 3.5Å; N189-S193 PolarHBondContact O-N 3.44Å
190	N	82.1	Confident	84.1	Confident	83 Å²	83	43.3 Å²	43.3	44%	0.444	25%	0.25	S	C	.	.	H	α-helix	trans	-67.2	-34.7	174.7	-86.6	-52.1	0	0	0	112.2	I185 D187 L194	I185-N190 HydrophobicContact CG2-CB 4.03Å; D187-N190 HydrophobicContact CB-CB 4.21Å; D187-N190 PolarHBondContact O-N 3.39Å; D187-N190 PolarHBondContact OD2-ND2 2.92Å; N190-L194 WeakPolarHBondContact O-CB 3.28Å; N190-L194 PolarHBondContact O-N 2.99Å; N190-L194 VanDerWaalsContact O-N 3.08Å
191	V	84.8	Confident	84.4	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-67.3	-46.7	173	172.5	0	0	0	0	111	L182 I185 D187 A188 N189 S193 L194 L195	L182-V191 HydrophobicContact CD2-CB 4.47Å; L182-V191 HydrophobicContact CD2-CG2 4.1Å; L182-V191 HydrophobicContact CG-CG1 4.45Å; L182-V191 HydrophobicContact CG-CG2 4.44Å; I185-V191 HydrophobicContact CB-CG2 3.82Å; I185-V191 HydrophobicContact CG2-CG2 3.94Å; D187-V191 PolarHBondContact O-N 3.23Å; D187-V191 VanDerWaalsContact O-N 3.17Å; A188-V191 PolarHBondContact O-N 3.18Å; N189-V191 VanDerWaalsContact C-N 3.34Å; V191-S193 VanDerWaalsContact C-N 3.34Å; V191-S193 PolarHBondContact O-N 3.18Å; V191-L194 PolarHBondContact O-N 3.21Å; V191-L195 HydrophobicContact CG1-CD1 4.13Å; V191-L195 HydrophobicContact CG1-CG 4.46Å; V191-L195 WeakPolarHBondContact O-CG 3.44Å; V191-L195 PolarHBondContact O-N 2.98Å
192	A	85.2	Confident	84.8	Confident	30 Å²	30	44.3 Å²	44.3	25%	0.248	25%	0.252	C	S	.	.	H	α-helix	trans	-58.3	-46.2	176.4	0	0	0	0	0	111.3	A188 N189 L194 L195 E196	A188-A192 WeakPolarHBondContact O-CB 3.28Å; A188-A192 PolarHBondContact O-N 3.2Å; N189-A192 PolarHBondContact O-N 2.91Å; A192-L194 VanDerWaalsContact C-N 3.34Å; A192-L194 PolarHBondContact O-N 2.88Å; A192-L195 PolarHBondContact O-N 3.45Å; A192-E196 WeakPolarHBondContact O-CG 3.16Å; A192-E196 PolarHBondContact O-N 3.01Å
193	S	86.2	Confident	85.2	Confident	30 Å²	30	40.9 Å²	40.9	21%	0.21	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-41.6	175.4	174	0	0	0	0	113	N189 V191 E196 Q197 S251	N189-S193 WeakPolarHBondContact O-CB 3.5Å; N189-S193 PolarHBondContact O-N 3.44Å; V191-S193 VanDerWaalsContact C-N 3.34Å; V191-S193 PolarHBondContact O-N 3.18Å; S193-E196 PolarHBondContact O-N 3.38Å; S193-Q197 WeakPolarHBondContact O-CG 3.36Å; S193-Q197 PolarHBondContact O-N 3.38Å; S193-Q197 VanDerWaalsContact O-N 3.13Å; S193-S251 WeakPolarHBondContact CA-OG 3.28Å; S193-S251 PolarHBondContact O-OG 3.1Å; S193-S251 WeakPolarHBondContact OG-CB 3.45Å; S193-S251 PolarHBondContact OG-OG 3.38Å
194	L	86.4	Confident	85.9	Confident	14 Å²	14	39.2 Å²	39.2	7%	0.073	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-43.2	177	177.4	62.5	0	0	0	111.5	L132 V141 Y181 I185 N190 V191 A192 Q197 I198	L132-L194 HydrophobicContact CD1-CD2 3.92Å; V141-L194 HydrophobicContact CB-CD1 4.42Å; V141-L194 HydrophobicContact CG1-CD1 3.87Å; V141-L194 HydrophobicContact CG2-CD1 3.62Å; Y181-L194 HydrophobicContact CD1-CD2 3.63Å; Y181-L194 HydrophobicContact CE1-CD2 3.71Å; Y181-L194 HydrophobicContact CG-CD2 4.23Å; I185-L194 HydrophobicContact CD1-CD2 4.44Å; N190-L194 WeakPolarHBondContact O-CB 3.28Å; N190-L194 PolarHBondContact O-N 2.99Å; N190-L194 VanDerWaalsContact O-N 3.08Å; V191-L194 PolarHBondContact O-N 3.21Å; A192-L194 VanDerWaalsContact C-N 3.34Å; A192-L194 PolarHBondContact O-N 2.88Å; L194-Q197 PolarHBondContact O-N 3.13Å; L194-I198 HydrophobicContact CD1-CD1 4.11Å; L194-I198 HydrophobicContact CD1-CG1 4.46Å; L194-I198 HydrophobicContact CG-CD1 3.97Å; L194-I198 WeakPolarHBondContact O-CG1 3.35Å; L194-I198 PolarHBondContact O-N 3.06Å
195	L	88.8	Confident	86.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.3	-43.1	177.8	-72.6	177.2	0	0	0	112	S176 E178 Y181 V191 A192 Q197 I198 L199 F247	S176-L195 WeakPolarHBondContact O-CD2 3.49Å; E178-L195 HydrophobicContact CB-CD1 4.25Å; E178-L195 HydrophobicContact CG-CD1 3.36Å; Y181-L195 HydrophobicContact CD2-CD2 3.82Å; Y181-L195 HydrophobicContact CD2-CG 4.38Å; Y181-L195 HydrophobicContact CE2-CD2 3.57Å; V191-L195 HydrophobicContact CG1-CD1 4.13Å; V191-L195 HydrophobicContact CG1-CG 4.46Å; V191-L195 WeakPolarHBondContact O-CG 3.44Å; V191-L195 PolarHBondContact O-N 2.98Å; A192-L195 PolarHBondContact O-N 3.45Å; L195-Q197 VanDerWaalsContact C-N 3.28Å; L195-Q197 PolarHBondContact O-N 3.47Å; L195-I198 PolarHBondContact O-N 3.15Å; L195-I198 VanDerWaalsContact O-N 3.12Å; L195-L199 WeakPolarHBondContact O-CB 3.45Å; L195-L199 VanDerWaalsContact O-CG 3.3Å; L195-L199 WeakPolarHBondContact O-CG 3.49Å; L195-L199 PolarHBondContact O-N 3.32Å; L195-F247 HydrophobicContact CB-CE1 4.27Å; L195-F247 HydrophobicContact CB-CZ 4.41Å; L195-F247 HydrophobicContact CD1-CZ 4.34Å
196	E	90.1	Very high	87.1	Confident	8 Å²	8	41.3 Å²	41.3	4%	0.037	23%	0.232	C	C	.	.	H	α-helix	trans	-53.6	-47.5	173.3	-75.3	-179.6	165.4	0	0	111	A192 S193 I198 H200 F247 T248 Y249 S250 S251	A192-E196 WeakPolarHBondContact O-CG 3.16Å; A192-E196 PolarHBondContact O-N 3.01Å; S193-E196 PolarHBondContact O-N 3.38Å; E196-I198 PolarHBondContact O-N 3.44Å; E196-H200 WeakPolarHBondContact O-CB 3.34Å; E196-H200 PolarHBondContact O-N 3.04Å; E196-F247 HydrophobicContact CG-CB 4.28Å; E196-F247 HydrophobicContact CG-CD1 3.76Å; E196-F247 HydrophobicContact CG-CG 4.37Å; E196-T248 PolarHBondContact OE1-OG1 3.29Å; E196-Y249 HydrophobicContact CB-CD1 3.81Å; E196-Y249 HydrophobicContact CB-CE1 4.28Å; E196-Y249 HydrophobicContact CG-CD1 4.11Å; E196-Y249 HydrophobicContact CG-CG 4.48Å; E196-Y249 WeakPolarHBondContact O-CD1 3.48Å; E196-Y249 VanDerWaalsContact O-CE1 3.28Å; E196-Y249 WeakPolarHBondContact O-CE1 3.44Å; E196-Y249 WeakPolarHBondContact OE1-CA 3.39Å; E196-Y249 PolarHBondContact OE1-N 3.18Å; E196-Y249 WeakPolarHBondContact OE2-CA 3.5Å; E196-S250 PolarHBondContact OE1-N 3.44Å; E196-S250 PolarHBondContact OE2-N 3.38Å; E196-S251 VanDerWaalsContact OE2-CB 3.3Å; E196-S251 WeakPolarHBondContact OE2-CB 3.46Å; E196-S251 PolarHBondContact OE2-N 2.89Å; E196-S251 PolarHBondContact OE2-OG 3.25Å
197	Q	88.6	Confident	87.9	Confident	67 Å²	67	35.4 Å²	35.4	31%	0.313	19%	0.193	S	C	.	.	H	α-helix	trans	-66.8	-33.5	178.9	-69.3	-179	26.4	0	0	113.9	K145 S193 L194 L195 Y201	K145-Q197 VanDerWaalsContact CE-O 3.28Å; K145-Q197 WeakPolarHBondContact CE-O 3.46Å; S193-Q197 WeakPolarHBondContact O-CG 3.36Å; S193-Q197 PolarHBondContact O-N 3.38Å; S193-Q197 VanDerWaalsContact O-N 3.13Å; L194-Q197 PolarHBondContact O-N 3.13Å; L195-Q197 VanDerWaalsContact C-N 3.28Å; L195-Q197 PolarHBondContact O-N 3.47Å; Q197-Y201 WeakPolarHBondContact O-CB 3.45Å; Q197-Y201 PolarHBondContact O-N 3.17Å
198	I	90.1	Very high	88.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-72.2	-50.4	177.3	-71	168.5	0	0	0	109.8	I144 K145 L148 Y181 L194 L195 E196 H200 Y201 M202	I144-I198 HydrophobicContact CG2-CD1 4.07Å; K145-I198 HydrophobicContact CG-CG1 4.21Å; L148-I198 HydrophobicContact CD1-CG2 3.55Å; Y181-I198 WeakPolarHBondContact OH-CD1 3.45Å; L194-I198 HydrophobicContact CD1-CD1 4.11Å; L194-I198 HydrophobicContact CD1-CG1 4.46Å; L194-I198 HydrophobicContact CG-CD1 3.97Å; L194-I198 WeakPolarHBondContact O-CG1 3.35Å; L194-I198 PolarHBondContact O-N 3.06Å; L195-I198 PolarHBondContact O-N 3.15Å; L195-I198 VanDerWaalsContact O-N 3.12Å; E196-I198 PolarHBondContact O-N 3.44Å; I198-H200 PolarHBondContact O-N 3.41Å; I198-Y201 WeakPolarHBondContact O-CB 3.23Å; I198-Y201 PolarHBondContact O-N 2.95Å; I198-M202 HydrophobicContact CG2-CG 4.45Å; I198-M202 HydrophobicContact CG2-SD 3.83Å; I198-M202 WeakPolarHBondContact O-CG 2.96Å; I198-M202 PolarHBondContact O-N 3.17Å
199	L	91.2	Very high	88.9	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-61.8	-44.7	179.8	-68.8	172.2	0	0	0	111	L195 Y201 M202 V203 P244 F247 Y249	L195-L199 WeakPolarHBondContact O-CB 3.45Å; L195-L199 VanDerWaalsContact O-CG 3.3Å; L195-L199 WeakPolarHBondContact O-CG 3.49Å; L195-L199 PolarHBondContact O-N 3.32Å; L199-Y201 VanDerWaalsContact C-N 3.32Å; L199-Y201 PolarHBondContact O-N 2.9Å; L199-M202 PolarHBondContact O-N 3.35Å; L199-M202 VanDerWaalsContact O-N 3.16Å; L199-V203 WeakPolarHBondContact O-CG2 3.47Å; L199-V203 PolarHBondContact O-N 3.42Å; L199-P244 HydrophobicContact CD2-CG 4.37Å; L199-F247 HydrophobicContact CD1-CD2 3.65Å; L199-F247 HydrophobicContact CD1-CE2 3.65Å; L199-F247 HydrophobicContact CD1-CG 4.27Å; L199-F247 HydrophobicContact CD1-CZ 4.26Å; L199-Y249 HydrophobicContact CB-CE1 4.07Å; L199-Y249 WeakPolarHBondContact CB-OH 3.36Å
200	H	92.4	Very high	89.2	Confident	35 Å²	35	29.5 Å²	29.5	16%	0.162	15%	0.148	C	C	.	.	H	α-helix	trans	-59	-43.6	176.1	-178.3	71.6	0	0	0	111.7	E196 I198 V203 Q204 Y249 F259	E196-H200 WeakPolarHBondContact O-CB 3.34Å; E196-H200 PolarHBondContact O-N 3.04Å; I198-H200 PolarHBondContact O-N 3.41Å; H200-V203 PolarHBondContact O-N 3.5Å; H200-Q204 WeakPolarHBondContact O-CB 3.48Å; H200-Q204 PolarHBondContact O-N 3.05Å; H200-Y249 HydrophobicContact CB-CD1 4.06Å; H200-Y249 HydrophobicContact CB-CE1 3.99Å; H200-F259 AromaticContact CE1-CD1 3.74Å
201	Y	91	Very high	89.5	Confident	35 Å²	35	25.6 Å²	25.6	14%	0.137	13%	0.127	C	C	.	.	H	α-helix	trans	-63.7	-42	175.2	-178.1	-91.3	0	0	0	112.5	K145 R146 Q197 I198 L199 Q204 K205	K145-Y201 VanDerWaalsContact C-CE1 3.47Å; K145-Y201 HydrophobicContact CB-CD1 3.63Å; K145-Y201 HydrophobicContact CB-CD2 4.44Å; K145-Y201 HydrophobicContact CB-CE1 3.94Å; K145-Y201 HydrophobicContact CB-CG 3.91Å; K145-Y201 HydrophobicContact CD-CD2 4.4Å; K145-Y201 HydrophobicContact CD-CG 4.12Å; K145-Y201 HydrophobicContact CG-CD1 4.21Å; K145-Y201 HydrophobicContact CG-CG 4.11Å; K145-Y201 WeakPolarHBondContact O-CD1 3.42Å; K145-Y201 WeakPolarHBondContact O-CE1 3.29Å; R146-Y201 WeakPolarHBondContact CD-OH 3.29Å; Q197-Y201 WeakPolarHBondContact O-CB 3.45Å; Q197-Y201 PolarHBondContact O-N 3.17Å; I198-Y201 WeakPolarHBondContact O-CB 3.23Å; I198-Y201 PolarHBondContact O-N 2.95Å; L199-Y201 VanDerWaalsContact C-N 3.32Å; L199-Y201 PolarHBondContact O-N 2.9Å; Y201-Q204 WeakPolarHBondContact O-CB 3.41Å; Y201-Q204 PolarHBondContact O-N 3.11Å; Y201-K205 HydrophobicContact CD1-CG 4.24Å; Y201-K205 HydrophobicContact CE1-CG 3.74Å; Y201-K205 WeakPolarHBondContact O-CG 3.47Å; Y201-K205 PolarHBondContact O-N 3.35Å; Y201-K205 WeakPolarHBondContact OH-CE 3.26Å
202	M	92.4	Very high	89.7	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-61.8	-46.2	178.3	-74.6	172.1	48.3	0	0	111.1	L148 L172 I198 L199 Q204 K205 G206 Y207	L148-M202 HydrophobicContact CB-CG 4.06Å; L148-M202 HydrophobicContact CB-SD 4.13Å; L148-M202 HydrophobicContact CD1-SD 3.87Å; L148-M202 HydrophobicContact CG-SD 4.47Å; L172-M202 HydrophobicContact CD2-CE 3.56Å; L172-M202 HydrophobicContact CD2-SD 4.37Å; I198-M202 HydrophobicContact CG2-CG 4.45Å; I198-M202 HydrophobicContact CG2-SD 3.83Å; I198-M202 WeakPolarHBondContact O-CG 2.96Å; I198-M202 PolarHBondContact O-N 3.17Å; L199-M202 PolarHBondContact O-N 3.35Å; L199-M202 VanDerWaalsContact O-N 3.16Å; M202-Q204 VanDerWaalsContact C-N 3.32Å; M202-Q204 PolarHBondContact O-N 2.93Å; M202-K205 CarbonylContact O-C 3.57Å; M202-K205 WeakPolarHBondContact O-CA 3.41Å; M202-K205 PolarHBondContact O-N 3.06Å; M202-G206 PolarHBondContact O-N 3.14Å; M202-Y207 HydrophobicContact CB-CD2 4.39Å; M202-Y207 HydrophobicContact CB-CG 4.44Å; M202-Y207 HydrophobicContact CE-CD2 3.37Å; M202-Y207 HydrophobicContact CE-CE2 3.19Å; M202-Y207 HydrophobicContact CE-CG 4.17Å; M202-Y207 WeakPolarHBondContact O-CB 3.3Å; M202-Y207 PolarHBondContact O-N 3.39Å
203	V	91.6	Very high	89.8	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.012	13%	0.128	C	C	.	.	H	α-helix	trans	-59.6	-43.7	176.1	176.1	0	0	0	0	110.5	L199 H200 K205 G206 Y207 Y208 F259 V260 A263	L199-V203 WeakPolarHBondContact O-CG2 3.47Å; L199-V203 PolarHBondContact O-N 3.42Å; H200-V203 PolarHBondContact O-N 3.5Å; V203-K205 PolarHBondContact O-N 2.84Å; V203-G206 PolarHBondContact O-N 3.08Å; V203-Y207 HydrophobicContact CG2-CD1 4.36Å; V203-Y208 HydrophobicContact CG1-CD2 4.21Å; V203-Y208 HydrophobicContact CG1-CE2 4.13Å; V203-Y208 HydrophobicContact CG2-CD2 4.43Å; V203-Y208 HydrophobicContact CG2-CE2 3.95Å; V203-F259 HydrophobicContact CG1-CD1 4.43Å; V203-F259 HydrophobicContact CG1-CE1 4.02Å; V203-V260 HydrophobicContact CB-CG2 4.45Å; V203-V260 HydrophobicContact CG1-CG2 4.35Å; V203-V260 HydrophobicContact CG2-CG1 4.35Å; V203-V260 HydrophobicContact CG2-CG2 4.37Å; V203-A263 HydrophobicContact CG1-CB 3.43Å; V203-A263 VanDerWaalsContact CG1-CB 3.43Å
204	Q	90.5	Very high	89.8	Confident	104 Å²	104	25.4 Å²	25.4	49%	0.486	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-16.2	173.6	-157.7	-166.8	12.9	0	0	114.1	H200 Y201 M202 F259	H200-Q204 WeakPolarHBondContact O-CB 3.48Å; H200-Q204 PolarHBondContact O-N 3.05Å; Y201-Q204 WeakPolarHBondContact O-CB 3.41Å; Y201-Q204 PolarHBondContact O-N 3.11Å; M202-Q204 VanDerWaalsContact C-N 3.32Å; M202-Q204 PolarHBondContact O-N 2.93Å; Q204-F259 HydrophobicContact CB-CE1 4.26Å; Q204-F259 HydrophobicContact CB-CZ 4.49Å; Q204-F259 HydrophobicContact CG-CE1 4.5Å; Q204-F259 HydrophobicContact CG-CZ 4.34Å
205	K	89.3	Confident	89.8	Confident	71 Å²	71	24.8 Å²	24.8	31%	0.309	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	17.8	176.6	-60.8	-56.4	170.7	-153	0	113.5	Y201 M202 V203	Y201-K205 HydrophobicContact CD1-CG 4.24Å; Y201-K205 HydrophobicContact CE1-CG 3.74Å; Y201-K205 WeakPolarHBondContact O-CG 3.47Å; Y201-K205 PolarHBondContact O-N 3.35Å; Y201-K205 WeakPolarHBondContact OH-CE 3.26Å; M202-K205 CarbonylContact O-C 3.57Å; M202-K205 WeakPolarHBondContact O-CA 3.41Å; M202-K205 PolarHBondContact O-N 3.06Å; V203-K205 PolarHBondContact O-N 2.84Å
206	G	88.4	Confident	89.7	Confident	8 Å²	8	26.3 Å²	26.3	8%	0.082	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	42.7	174.7	0	0	0	0	0	112.9	Q156 M202 V203 S210	Q156-G206 PolarHBondContact NE2-O 3.3Å; M202-G206 PolarHBondContact O-N 3.14Å; V203-G206 PolarHBondContact O-N 3.08Å; G206-S210 PolarHBondContact O-N 3.19Å; G206-S210 VanDerWaalsContact O-N 3.08Å; G206-S210 PolarHBondContact O-OG 3.23Å
207	Y	92.3	Very high	89.3	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-57.9	-50.3	178.7	-178.9	-116.6	0	0	0	112	L172 M202 V203 S210 L211 H240 P244	L172-Y207 HydrophobicContact CD1-CE2 4.05Å; L172-Y207 HydrophobicContact CD2-CE2 4.47Å; M202-Y207 HydrophobicContact CB-CD2 4.39Å; M202-Y207 HydrophobicContact CB-CG 4.44Å; M202-Y207 HydrophobicContact CE-CD2 3.37Å; M202-Y207 HydrophobicContact CE-CE2 3.19Å; M202-Y207 HydrophobicContact CE-CG 4.17Å; M202-Y207 WeakPolarHBondContact O-CB 3.3Å; M202-Y207 PolarHBondContact O-N 3.39Å; V203-Y207 HydrophobicContact CG2-CD1 4.36Å; Y207-S210 VanDerWaalsContact O-CB 3.26Å; Y207-S210 WeakPolarHBondContact O-CB 3.45Å; Y207-S210 PolarHBondContact O-N 3.27Å; Y207-S210 VanDerWaalsContact O-N 3.09Å; Y207-L211 HydrophobicContact CD1-CD1 3.98Å; Y207-L211 HydrophobicContact CE1-CD1 3.52Å; Y207-L211 HydrophobicContact CE1-CG 4.48Å; Y207-L211 HydrophobicContact CE2-CD1 4.29Å; Y207-L211 HydrophobicContact CE2-CG 4.49Å; Y207-L211 PolarHBondContact O-N 3.08Å; Y207-L211 VanDerWaalsContact O-N 3.07Å; Y207-H240 WeakPolarHBondContact OH-CB 3.21Å; Y207-H240 PolarHBondContact OH-O 3.45Å; Y207-P244 HydrophobicContact CD1-CG 4.3Å; Y207-P244 HydrophobicContact CE1-CG 3.78Å
208	Y	92.8	Very high	89	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.2	-39.5	-178.7	-71.5	-64.6	0	0	0	112.1	V203 S210 L211 Y212 P244 L245 V260 A263 F264 E267	V203-Y208 HydrophobicContact CG1-CD2 4.21Å; V203-Y208 HydrophobicContact CG1-CE2 4.13Å; V203-Y208 HydrophobicContact CG2-CD2 4.43Å; V203-Y208 HydrophobicContact CG2-CE2 3.95Å; Y208-S210 PolarHBondContact O-N 3.36Å; Y208-L211 HydrophobicContact CD1-CD1 4.43Å; Y208-L211 PolarHBondContact O-N 3.35Å; Y208-L211 VanDerWaalsContact O-N 3.14Å; Y208-Y212 WeakPolarHBondContact O-CB 3.45Å; Y208-Y212 PolarHBondContact O-N 3.45Å; Y208-P244 WeakPolarHBondContact OH-CB 3.37Å; Y208-L245 WeakPolarHBondContact OH-CD2 3.32Å; Y208-V260 HydrophobicContact CE2-CG1 4.37Å; Y208-A263 HydrophobicContact CD2-CB 4.27Å; Y208-F264 AromaticContact CD1-CD2 3.88Å; Y208-F264 HydrophobicContact CD1-CD2 3.88Å; Y208-F264 HydrophobicContact CD2-CB 4.03Å; Y208-F264 HydrophobicContact CE1-CB 4.24Å; Y208-F264 AromaticContact CE1-CD2 3.67Å; Y208-F264 HydrophobicContact CE1-CD2 3.67Å; Y208-F264 HydrophobicContact CE1-CG 4.38Å; Y208-F264 HydrophobicContact CE2-CB 3.69Å; Y208-F264 HydrophobicContact CG-CB 4.43Å; Y208-F264 HydrophobicContact CG-CD2 4.47Å; Y208-E267 PolarHBondContact N-OE2 2.93Å
209	K	90.3	Very high	88.6	Confident	123 Å²	123	31 Å²	31	54%	0.535	14%	0.142	S	C	.	.	H	α-helix	trans	-57.2	-35.5	170.8	-171.2	172.6	-174.3	170.7	0	113.1	S213 E267	K209-S213 PolarHBondContact O-N 3.14Å; K209-S213 VanDerWaalsContact O-N 3.15Å; K209-E267 HydrophobicContact CB-CB 4.25Å; K209-E267 HydrophobicContact CB-CG 4.42Å; K209-E267 PolarHBondContact N-OE2 3.07Å
210	S	88.5	Confident	88.2	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.014	16%	0.16	C	C	.	.	H	α-helix	trans	-68.5	-44.9	176.4	-45.3	0	0	0	0	111.3	C152 Q156 G206 Y207 Y208 S213 L214	C152-S210 WeakPolarHBondContact CB-OG 3.41Å; C152-S210 PolarHBondContact O-OG 3.32Å; Q156-S210 VanDerWaalsContact CG-OG 3.3Å; Q156-S210 WeakPolarHBondContact CG-OG 3.35Å; Q156-S210 PolarHBondContact NE2-OG 3.13Å; Q156-S210 VanDerWaalsContact NE2-OG 3.14Å; G206-S210 PolarHBondContact O-N 3.19Å; G206-S210 VanDerWaalsContact O-N 3.08Å; G206-S210 PolarHBondContact O-OG 3.23Å; Y207-S210 VanDerWaalsContact O-CB 3.26Å; Y207-S210 WeakPolarHBondContact O-CB 3.45Å; Y207-S210 PolarHBondContact O-N 3.27Å; Y207-S210 VanDerWaalsContact O-N 3.09Å; Y208-S210 PolarHBondContact O-N 3.36Å; S210-S213 PolarHBondContact O-N 3.07Å; S210-L214 PolarHBondContact O-N 3.09Å
211	L	89.1	Confident	87.4	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-42.4	178	-65.7	176.2	0	0	0	111.7	Y207 Y208 S213 L214 V215 L237 I241	Y207-L211 HydrophobicContact CD1-CD1 3.98Å; Y207-L211 HydrophobicContact CE1-CD1 3.52Å; Y207-L211 HydrophobicContact CE1-CG 4.48Å; Y207-L211 HydrophobicContact CE2-CD1 4.29Å; Y207-L211 HydrophobicContact CE2-CG 4.49Å; Y207-L211 PolarHBondContact O-N 3.08Å; Y207-L211 VanDerWaalsContact O-N 3.07Å; Y208-L211 HydrophobicContact CD1-CD1 4.43Å; Y208-L211 PolarHBondContact O-N 3.35Å; Y208-L211 VanDerWaalsContact O-N 3.14Å; L211-S213 PolarHBondContact O-N 3Å; L211-L214 WeakPolarHBondContact O-CB 3.35Å; L211-L214 PolarHBondContact O-N 3.12Å; L211-L214 VanDerWaalsContact O-N 3.13Å; L211-V215 WeakPolarHBondContact O-CG2 3.38Å; L211-V215 PolarHBondContact O-N 3.08Å; L211-L237 HydrophobicContact CD2-CD2 3.98Å; L211-I241 HydrophobicContact CB-CG1 4.42Å; L211-I241 HydrophobicContact CD1-CG1 3.8Å
212	Y	89.6	Confident	86.7	Confident	39 Å²	39	38.6 Å²	38.6	15%	0.153	20%	0.202	C	C	.	.	H	α-helix	trans	-56.9	-48.2	174.4	178.9	-92.8	0	0	0	111.8	Y208 L214 V215 N216 F268 A271 P272 I277	Y208-Y212 WeakPolarHBondContact O-CB 3.45Å; Y208-Y212 PolarHBondContact O-N 3.45Å; Y212-L214 VanDerWaalsContact C-N 3.28Å; Y212-L214 PolarHBondContact O-N 2.72Å; Y212-V215 PolarHBondContact O-N 3.03Å; Y212-N216 WeakPolarHBondContact CD1-ND2 3.32Å; Y212-N216 WeakPolarHBondContact CE1-ND2 3.41Å; Y212-N216 PolarHBondContact O-N 3.14Å; Y212-N216 PolarHBondContact O-ND2 2.83Å; Y212-F268 HydrophobicContact CD2-CD2 4.23Å; Y212-F268 HydrophobicContact CD2-CE2 4.49Å; Y212-A271 HydrophobicContact CD2-CB 4.12Å; Y212-A271 HydrophobicContact CE1-CB 4.33Å; Y212-A271 HydrophobicContact CE2-CB 3.48Å; Y212-A271 VanDerWaalsContact CE2-CB 3.48Å; Y212-P272 PolarHBondContact OH-O 3.18Å; Y212-I277 HydrophobicContact CD2-CD1 3.57Å; Y212-I277 HydrophobicContact CE2-CD1 3.24Å
213	S	87.3	Confident	86.1	Confident	18 Å²	18	38.7 Å²	38.7	13%	0.126	20%	0.203	C	C	.	.	H	α-helix	trans	-59.8	-40.7	175.5	-171.2	0	0	0	0	111.5	Q156 K209 S210 L211 N216 H217	Q156-S213 PolarHBondContact O-OG 3.26Å; Q156-S213 VanDerWaalsContact O-OG 3.08Å; K209-S213 PolarHBondContact O-N 3.14Å; K209-S213 VanDerWaalsContact O-N 3.15Å; S210-S213 PolarHBondContact O-N 3.07Å; L211-S213 PolarHBondContact O-N 3Å; S213-N216 PolarHBondContact O-N 2.67Å; S213-H217 PolarHBondContact O-N 3.32Å; S213-H217 PolarHBondContact O-ND1 3.43Å
214	L	85.9	Confident	85.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-65.8	-45.3	179.5	-154.4	91.2	0	0	0	112.9	L155 V165 M169 S210 L211 Y212 N216 H217 R218 L237	L155-L214 HydrophobicContact CD2-CD1 4.05Å; V165-L214 HydrophobicContact CB-CD1 4.5Å; V165-L214 HydrophobicContact CG1-CD1 3.48Å; V165-L214 VanDerWaalsContact CG1-CD1 3.48Å; V165-L214 HydrophobicContact CG1-CD2 4.21Å; V165-L214 HydrophobicContact CG1-CG 4.38Å; V165-L214 HydrophobicContact CG2-CD1 4.15Å; M169-L214 HydrophobicContact CE-CD2 4.46Å; M169-L214 HydrophobicContact CG-CD2 4.43Å; M169-L214 HydrophobicContact SD-CD2 4.06Å; S210-L214 PolarHBondContact O-N 3.09Å; L211-L214 WeakPolarHBondContact O-CB 3.35Å; L211-L214 PolarHBondContact O-N 3.12Å; L211-L214 VanDerWaalsContact O-N 3.13Å; Y212-L214 VanDerWaalsContact C-N 3.28Å; Y212-L214 PolarHBondContact O-N 2.72Å; L214-N216 VanDerWaalsContact C-N 3.26Å; L214-N216 PolarHBondContact O-N 3.13Å; L214-H217 PolarHBondContact O-N 3.21Å; L214-R218 HydrophobicContact CD1-CG 4.27Å; L214-R218 HydrophobicContact CG-CB 4.41Å; L214-R218 HydrophobicContact CG-CG 4.2Å; L214-R218 WeakPolarHBondContact O-CB 3.42Å; L214-R218 PolarHBondContact O-N 2.85Å; L214-L237 HydrophobicContact CD2-CD1 3.86Å; L214-L237 HydrophobicContact CD2-CD2 3.35Å; L214-L237 HydrophobicContact CD2-CG 4.16Å
215	V	86.9	Confident	84.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-55.1	-46.4	177.2	163.7	0	0	0	0	110.1	L211 Y212 L219 L237 F268 Q276 I277 F281	L211-V215 WeakPolarHBondContact O-CG2 3.38Å; L211-V215 PolarHBondContact O-N 3.08Å; Y212-V215 PolarHBondContact O-N 3.03Å; V215-L219 HydrophobicContact CB-CD1 4.4Å; V215-L219 HydrophobicContact CG1-CD1 4.22Å; V215-L219 HydrophobicContact CG2-CD1 4.28Å; V215-L219 WeakPolarHBondContact O-CB 3.41Å; V215-L219 PolarHBondContact O-N 2.87Å; V215-L237 HydrophobicContact CG2-CD1 4.25Å; V215-F268 HydrophobicContact CG2-CE2 4.49Å; V215-Q276 HydrophobicContact CG1-CB 4.08Å; V215-I277 HydrophobicContact CG1-CD1 4.5Å; V215-I277 HydrophobicContact CG1-CG1 3.85Å; V215-F281 HydrophobicContact CB-CE2 4.16Å; V215-F281 HydrophobicContact CB-CZ 4.49Å; V215-F281 HydrophobicContact CG1-CD2 3.83Å; V215-F281 HydrophobicContact CG1-CE2 3.43Å; V215-F281 VanDerWaalsContact CG1-CE2 3.43Å; V215-F281 HydrophobicContact CG1-CZ 4.22Å; V215-F281 HydrophobicContact CG2-CD2 4.4Å; V215-F281 HydrophobicContact CG2-CE1 4.2Å; V215-F281 HydrophobicContact CG2-CE2 3.61Å; V215-F281 HydrophobicContact CG2-CZ 3.48Å; V215-F281 VanDerWaalsContact CG2-CZ 3.48Å
216	N	85.1	Confident	84.2	Confident	32 Å²	32	44.2 Å²	44.2	17%	0.171	24%	0.235	C	C	.	.	H	α-helix	trans	-72.8	-31.8	-175	-66.5	-23.6	0	0	0	114.3	Y212 S213 L214 T274	Y212-N216 WeakPolarHBondContact CD1-ND2 3.32Å; Y212-N216 WeakPolarHBondContact CE1-ND2 3.41Å; Y212-N216 PolarHBondContact O-N 3.14Å; Y212-N216 PolarHBondContact O-ND2 2.83Å; S213-N216 PolarHBondContact O-N 2.67Å; L214-N216 VanDerWaalsContact C-N 3.26Å; L214-N216 PolarHBondContact O-N 3.13Å; N216-T274 HydrophobicContact CB-CG2 4.4Å; N216-T274 WeakPolarHBondContact OD1-CB 3.49Å; N216-T274 WeakPolarHBondContact OD1-CG2 3.47Å; N216-T274 PolarHBondContact OD1-OG1 3.35Å
217	H	82.3	Confident	82.7	Confident	97 Å²	97	50 Å²	50	45%	0.449	26%	0.264	S	S	.	.	H	α-helix	trans	-100.9	-20.6	-174.1	-64.3	84.1	0	0	0	114.1	C158 S213 L214	C158-H217 HydrophobicContact CB-CB 4.31Å; S213-H217 PolarHBondContact O-N 3.32Å; S213-H217 PolarHBondContact O-ND1 3.43Å; L214-H217 PolarHBondContact O-N 3.21Å
218	R	81.8	Confident	81	Confident	70 Å²	70	52.8 Å²	52.8	26%	0.264	29%	0.288	S	S	.	.	H	α-helix	trans	-114.7	-10	-173.8	-62.5	-63.6	-174.6	-168.5	-5.1	114.5	C158 D160 D161 L214 L233	C158-R218 PolarHBondContact O-NH2 3.01Å; C158-R218 PolarHBondContact SG-NE 3.32Å; D160-R218 PolarHBondContact O-NH2 3.47Å; D161-R218 IonicContact OD1-CZ 3.76Å; D161-R218 IonicContact OD1-NH1 2.88Å; D161-R218 PolarHBondContact OD1-NH1 3.01Å; D161-R218 IonicContact OD1-NH2 3.99Å; L214-R218 HydrophobicContact CD1-CG 4.27Å; L214-R218 HydrophobicContact CG-CB 4.41Å; L214-R218 HydrophobicContact CG-CG 4.2Å; L214-R218 WeakPolarHBondContact O-CB 3.42Å; L214-R218 PolarHBondContact O-N 2.85Å; R218-L233 HydrophobicContact CB-CD2 4.38Å
219	L	83.3	Confident	79.1	Confident	8 Å²	8	58 Å²	58	4%	0.042	32%	0.322	C	S	.	.	S	Bend	trans	-104.9	140.5	174.2	-62	174.9	0	0	0	110.8	V215 L223 I231 L233 A234 L237 Q276 F281	V215-L219 HydrophobicContact CB-CD1 4.4Å; V215-L219 HydrophobicContact CG1-CD1 4.22Å; V215-L219 HydrophobicContact CG2-CD1 4.28Å; V215-L219 WeakPolarHBondContact O-CB 3.41Å; V215-L219 PolarHBondContact O-N 2.87Å; L219-L223 HydrophobicContact CB-CD2 4.5Å; L219-L223 HydrophobicContact CD1-CD2 4.19Å; L219-I231 HydrophobicContact CD2-CG2 4.39Å; L219-L233 HydrophobicContact CD2-CB 4.44Å; L219-L233 HydrophobicContact CD2-CD2 4.22Å; L219-L233 HydrophobicContact CD2-CG 4.28Å; L219-A234 HydrophobicContact CD1-CB 4.3Å; L219-A234 HydrophobicContact CD2-CB 4.03Å; L219-L237 HydrophobicContact CD1-CD1 3.99Å; L219-L237 HydrophobicContact CD2-CD1 4.46Å; L219-L237 HydrophobicContact CG-CD1 4.31Å; L219-Q276 HydrophobicContact CB-CG 4.13Å; L219-Q276 PolarHBondContact O-NE2 3.26Å; L219-F281 HydrophobicContact CD1-CE2 3.61Å; L219-F281 HydrophobicContact CD1-CZ 3.81Å
220	P	80.8	Confident	77.7	Confident	59 Å²	59	54.9 Å²	54.9	38%	0.383	32%	0.315	S	S	.	.			trans	-65.8	145.9	176.6	27.9	-33.4	0	0	0	110.9	S222 L223 I231 Q276	P220-S222 VanDerWaalsContact C-N 3.27Å; P220-S222 PolarHBondContact O-N 3.34Å; P220-L223 WeakPolarHBondContact O-CB 3.31Å; P220-L223 PolarHBondContact O-N 3.39Å; P220-I231 HydrophobicContact CG-CD1 3.96Å; P220-Q276 VanDerWaalsContact O-CG 3.27Å; P220-Q276 WeakPolarHBondContact O-CG 3.24Å
221	S	76.3	Confident	77.1	Confident	68 Å²	68	57.3 Å²	57.3	48%	0.476	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-23.2	178.8	48.8	0	0	0	0	113.7	L223 E275	S221-L223 PolarHBondContact O-N 3.48Å; S221-E275 WeakPolarHBondContact O-CB 3.45Å
222	S	76.2	Confident	76.5	Confident	103 Å²	103	61.9 Å²	61.9	72%	0.72	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	21.6	177.1	67.1	0	0	0	0	113.9	P220 E224	P220-S222 VanDerWaalsContact C-N 3.27Å; P220-S222 PolarHBondContact O-N 3.34Å; S222-E224 PolarHBondContact O-N 2.81Å
223	L	80.8	Confident	76.2	Confident	4 Å²	4	63 Å²	63	2%	0.021	37%	0.366	C	S	.	.			trans	-82	113.3	-175.8	-176	70.5	0	0	0	110.5	L219 P220 S221 I231 A234 H279 F280	L219-L223 HydrophobicContact CB-CD2 4.5Å; L219-L223 HydrophobicContact CD1-CD2 4.19Å; P220-L223 WeakPolarHBondContact O-CB 3.31Å; P220-L223 PolarHBondContact O-N 3.39Å; S221-L223 PolarHBondContact O-N 3.48Å; L223-I231 HydrophobicContact CD1-CD1 3.49Å; L223-I231 VanDerWaalsContact CD1-CD1 3.49Å; L223-A234 HydrophobicContact CD2-CB 3.94Å; L223-H279 WeakPolarHBondContact O-CB 3.09Å; L223-F280 HydrophobicContact CD1-CD2 4.18Å; L223-F280 HydrophobicContact CD1-CE2 4.49Å; L223-F280 HydrophobicContact CD2-CB 3.68Å; L223-F280 HydrophobicContact CD2-CD1 3.92Å; L223-F280 HydrophobicContact CD2-CD2 3.69Å; L223-F280 HydrophobicContact CD2-CE1 4.49Å; L223-F280 HydrophobicContact CD2-CE2 4.28Å; L223-F280 HydrophobicContact CD2-CG 3.48Å; L223-F280 VanDerWaalsContact CD2-CG 3.48Å; L223-F280 HydrophobicContact CG-CB 3.86Å; L223-F280 HydrophobicContact CG-CD2 3.64Å; L223-F280 HydrophobicContact CG-CE2 4.38Å; L223-F280 HydrophobicContact CG-CG 3.84Å
224	E	78.1	Confident	76	Confident	145 Å²	145	62.1 Å²	62.1	68%	0.678	36%	0.36	S	S	*	.			trans	-103.5	146.3	173.1	-67.2	-179.8	-178.8	0	0	111.4	S222 S226	S222-E224 PolarHBondContact O-N 2.81Å; E224-S226 PolarHBondContact O-N 3.21Å
225	Y	78.8	Confident	75.9	Confident	75 Å²	75	64.8 Å²	64.8	29%	0.294	38%	0.378	S	S	.	.			trans	-72.6	119.8	171	-173.5	-111.4	0	0	0	110.5	H279 F280 P283 A284 D287	Y225-H279 PolarHBondContact N-O 3Å; Y225-F280 HydrophobicContact CD2-CD2 4.22Å; Y225-F280 HydrophobicContact CD2-CE2 4.1Å; Y225-P283 HydrophobicContact CD1-CB 4.04Å; Y225-P283 HydrophobicContact CG-CB 4.14Å; Y225-A284 HydrophobicContact CD2-CB 3.63Å; Y225-A284 HydrophobicContact CE2-CB 3.45Å; Y225-A284 VanDerWaalsContact CE2-CB 3.45Å; Y225-A284 HydrophobicContact CG-CB 4.47Å; Y225-D287 HydrophobicContact CE1-CB 4.5Å; Y225-D287 PolarHBondContact OH-OD2 2.93Å
226	S	73.9	Confident	75.8	Confident	73 Å²	73	67 Å²	67	51%	0.51	39%	0.392	S	S	.	.			trans	-137.8	156.1	178.7	-172.2	0	0	0	0	110.3	E224 A228	E224-S226 PolarHBondContact O-N 3.21Å; S226-A228 PolarHBondContact O-N 3.37Å; S226-A228 VanDerWaalsContact O-N 3.17Å
227	D	56.2	Low	75.9	Confident	128 Å²	128	65.4 Å²	65.4	68%	0.684	38%	0.383	S	S	*	.	S	Bend	trans	-62.9	-18	179	-78.4	-53.7	0	0	0	113.2	R289	D227-R289 IonicContact OD1-CZ 3.58Å; D227-R289 IonicContact OD1-NH1 2.76Å; D227-R289 PolarHBondContact OD1-NH1 3.34Å; D227-R289 IonicContact OD1-NH2 3.56Å
228	A	56.6	Low	76.1	Confident	61 Å²	61	61.4 Å²	61.4	50%	0.504	37%	0.365	S	S	.	.	S	Bend	trans	-98.4	142.6	173.9	0	0	0	0	0	111.1	S226 S230	S226-A228 PolarHBondContact O-N 3.37Å; S226-A228 VanDerWaalsContact O-N 3.17Å; A228-S230 PolarHBondContact O-N 3.44Å
229	P	54.2	Low	76.4	Confident	111 Å²	111	63.9 Å²	63.9	72%	0.721	38%	0.38	S	S	*	.			trans	-67.5	94.6	-176.5	27.4	-33.1	0	0	0	110.4	I231	P229-I231 VanDerWaalsContact C-N 3.29Å; P229-I231 PolarHBondContact O-N 2.89Å
230	S	61.3	Low	76.7	Confident	57 Å²	57	63.8 Å²	63.8	40%	0.399	38%	0.379	S	S	.	.	S	Bend	trans	-67.6	-28	-174.8	51.9	0	0	0	0	112.5	A228	A228-S230 PolarHBondContact O-N 3.44Å
231	I	75.3	Confident	77.1	Confident	52 Å²	52	61 Å²	61	27%	0.267	36%	0.361	S	S	.	.			trans	-153.5	127.5	167.3	-78	115.1	0	0	0	110.2	L219 P220 L223 P229 L233 A234 S235	L219-I231 HydrophobicContact CD2-CG2 4.39Å; P220-I231 HydrophobicContact CG-CD1 3.96Å; L223-I231 HydrophobicContact CD1-CD1 3.49Å; L223-I231 VanDerWaalsContact CD1-CD1 3.49Å; P229-I231 VanDerWaalsContact C-N 3.29Å; P229-I231 PolarHBondContact O-N 2.89Å; I231-L233 VanDerWaalsContact C-N 3.28Å; I231-L233 HydrophobicContact CG2-CB 3.81Å; I231-L233 PolarHBondContact O-N 3.3Å; I231-A234 HydrophobicContact CB-CB 4.29Å; I231-A234 HydrophobicContact CG2-CB 4.4Å; I231-A234 WeakPolarHBondContact O-CB 3.47Å; I231-A234 PolarHBondContact O-N 3.46Å; I231-S235 PolarHBondContact O-N 3.13Å
232	P	77.2	Confident	77.8	Confident	98 Å²	98	58.3 Å²	58.3	64%	0.636	34%	0.341	S	S	*	.	H	α-helix	trans	-58.7	-32.3	178	-26.2	34.2	0	0	0	114.8	A234 S235 T236	P232-A234 VanDerWaalsContact C-N 3.34Å; P232-S235 PolarHBondContact O-OG 3.22Å; P232-T236 WeakPolarHBondContact O-CG2 3.5Å; P232-T236 PolarHBondContact O-N 2.98Å; P232-T236 VanDerWaalsContact O-N 3.07Å; P232-T236 PolarHBondContact O-OG1 2.94Å
233	L	81.9	Confident	78.4	Confident	63 Å²	63	55.4 Å²	55.4	33%	0.33	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-39.7	175.8	-177.2	62.9	0	0	0	111.5	R218 L219 I231 T236 L237	R218-L233 HydrophobicContact CB-CD2 4.38Å; L219-L233 HydrophobicContact CD2-CB 4.44Å; L219-L233 HydrophobicContact CD2-CD2 4.22Å; L219-L233 HydrophobicContact CD2-CG 4.28Å; I231-L233 VanDerWaalsContact C-N 3.28Å; I231-L233 HydrophobicContact CG2-CB 3.81Å; I231-L233 PolarHBondContact O-N 3.3Å; L233-T236 WeakPolarHBondContact CA-OG1 3.42Å; L233-T236 PolarHBondContact O-N 3.45Å; L233-T236 PolarHBondContact O-OG1 2.96Å; L233-L237 HydrophobicContact CD1-CD1 4.37Å; L233-L237 HydrophobicContact CD1-CG 4.42Å; L233-L237 HydrophobicContact CG-CD1 4.04Å; L233-L237 VanDerWaalsContact O-CG 3.31Å; L233-L237 WeakPolarHBondContact O-CG 3.47Å; L233-L237 PolarHBondContact O-N 3.23Å
234	A	83.3	Confident	78.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-64.7	-42.4	179.8	0	0	0	0	0	111.5	L219 L223 I231 P232 L237 L238 F280	L219-A234 HydrophobicContact CD1-CB 4.3Å; L219-A234 HydrophobicContact CD2-CB 4.03Å; L223-A234 HydrophobicContact CD2-CB 3.94Å; I231-A234 HydrophobicContact CB-CB 4.29Å; I231-A234 HydrophobicContact CG2-CB 4.4Å; I231-A234 WeakPolarHBondContact O-CB 3.47Å; I231-A234 PolarHBondContact O-N 3.46Å; P232-A234 VanDerWaalsContact C-N 3.34Å; A234-L237 PolarHBondContact O-N 3.27Å; A234-L238 WeakPolarHBondContact O-CB 3.45Å; A234-L238 PolarHBondContact O-N 3.06Å; A234-F280 HydrophobicContact CB-CD1 4.46Å; A234-F280 HydrophobicContact CB-CE1 3.76Å; A234-F280 HydrophobicContact CB-CE2 4.3Å; A234-F280 HydrophobicContact CB-CZ 3.67Å
235	S	83.3	Confident	79.5	Confident	56 Å²	56	48.3 Å²	48.3	39%	0.392	28%	0.282	S	S	.	.	H	α-helix	trans	-65.5	-41	175.3	61.5	0	0	0	0	112.2	I231 P232 L237 L238 E239	I231-S235 PolarHBondContact O-N 3.13Å; P232-S235 PolarHBondContact O-OG 3.22Å; S235-L237 VanDerWaalsContact C-N 3.34Å; S235-L237 PolarHBondContact O-N 3.38Å; S235-L238 PolarHBondContact O-N 2.98Å; S235-E239 PolarHBondContact O-N 3.43Å
236	T	84.6	Confident	80.1	Confident	46 Å²	46	48.7 Å²	48.7	28%	0.282	29%	0.287	S	S	.	.	H	α-helix	trans	-63.3	-40.3	175.8	59.3	0	0	0	0	111.9	P232 L233 E239 H240	P232-T236 WeakPolarHBondContact O-CG2 3.5Å; P232-T236 PolarHBondContact O-N 2.98Å; P232-T236 VanDerWaalsContact O-N 3.07Å; P232-T236 PolarHBondContact O-OG1 2.94Å; L233-T236 WeakPolarHBondContact CA-OG1 3.42Å; L233-T236 PolarHBondContact O-N 3.45Å; L233-T236 PolarHBondContact O-OG1 2.96Å; T236-E239 PolarHBondContact O-N 3.45Å; T236-H240 PolarHBondContact O-N 3.07Å; T236-H240 VanDerWaalsContact O-N 3.07Å; T236-H240 PolarHBondContact O-ND1 2.89Å
237	L	87.4	Confident	80.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.4	-40.8	178	-70.8	167.3	0	0	0	112	M169 L211 L214 V215 L219 L233 A234 S235 E239 H240 I241 F281	M169-L237 HydrophobicContact CE-CD2 3.57Å; M169-L237 HydrophobicContact SD-CD2 4.42Å; L211-L237 HydrophobicContact CD2-CD2 3.98Å; L214-L237 HydrophobicContact CD2-CD1 3.86Å; L214-L237 HydrophobicContact CD2-CD2 3.35Å; L214-L237 HydrophobicContact CD2-CG 4.16Å; V215-L237 HydrophobicContact CG2-CD1 4.25Å; L219-L237 HydrophobicContact CD1-CD1 3.99Å; L219-L237 HydrophobicContact CD2-CD1 4.46Å; L219-L237 HydrophobicContact CG-CD1 4.31Å; L233-L237 HydrophobicContact CD1-CD1 4.37Å; L233-L237 HydrophobicContact CD1-CG 4.42Å; L233-L237 HydrophobicContact CG-CD1 4.04Å; L233-L237 VanDerWaalsContact O-CG 3.31Å; L233-L237 WeakPolarHBondContact O-CG 3.47Å; L233-L237 PolarHBondContact O-N 3.23Å; A234-L237 PolarHBondContact O-N 3.27Å; S235-L237 VanDerWaalsContact C-N 3.34Å; S235-L237 PolarHBondContact O-N 3.38Å; L237-E239 VanDerWaalsContact C-N 3.35Å; L237-E239 PolarHBondContact O-N 3.21Å; L237-H240 PolarHBondContact O-N 3.01Å; L237-I241 VanDerWaalsContact O-CG1 3.26Å; L237-I241 WeakPolarHBondContact O-CG1 3.42Å; L237-I241 PolarHBondContact O-N 3.01Å; L237-F281 HydrophobicContact CB-CE1 4.34Å; L237-F281 HydrophobicContact CB-CZ 4.19Å
238	L	88.1	Confident	82.1	Confident	12 Å²	12	44 Å²	44	6%	0.063	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-45.4	175.1	-178.7	65	0	0	0	111.9	A234 S235 H240 I241 L242 F281 A284 L285 L290	A234-L238 WeakPolarHBondContact O-CB 3.45Å; A234-L238 PolarHBondContact O-N 3.06Å; S235-L238 PolarHBondContact O-N 2.98Å; L238-H240 VanDerWaalsContact C-N 3.31Å; L238-H240 PolarHBondContact O-N 3.22Å; L238-I241 PolarHBondContact O-N 3.32Å; L238-L242 HydrophobicContact CD1-CD1 4.29Å; L238-L242 HydrophobicContact CG-CD1 4.2Å; L238-L242 PolarHBondContact O-N 3.01Å; L238-F281 HydrophobicContact CB-CE1 4.22Å; L238-F281 HydrophobicContact CD1-CD1 4.09Å; L238-F281 HydrophobicContact CD1-CE1 4.47Å; L238-A284 HydrophobicContact CD1-CB 3.92Å; L238-A284 HydrophobicContact CD2-CB 3.72Å; L238-A284 HydrophobicContact CG-CB 4.49Å; L238-L285 HydrophobicContact CD1-CD2 4.01Å; L238-L285 HydrophobicContact CD1-CG 4.3Å; L238-L290 HydrophobicContact CD2-CD1 3.73Å; L238-L290 HydrophobicContact CD2-CD2 4.45Å
239	E	87.8	Confident	83.6	Confident	122 Å²	122	41.5 Å²	41.5	57%	0.57	24%	0.235	S	C	*	.	H	α-helix	trans	-60.5	-41.9	175.6	-170.2	-174.4	166.3	0	0	111.6	S235 T236 L237 I241 L242 K243	S235-E239 PolarHBondContact O-N 3.43Å; T236-E239 PolarHBondContact O-N 3.45Å; L237-E239 VanDerWaalsContact C-N 3.35Å; L237-E239 PolarHBondContact O-N 3.21Å; E239-I241 VanDerWaalsContact C-N 3.34Å; E239-I241 PolarHBondContact O-N 3.46Å; E239-L242 PolarHBondContact O-N 2.9Å; E239-K243 WeakPolarHBondContact O-CB 3.41Å; E239-K243 PolarHBondContact O-N 3.39Å
240	H	88.1	Confident	85	Confident	7 Å²	7	41.2 Å²	41.2	3%	0.032	24%	0.236	C	C	.	.	H	α-helix	trans	-69.2	-29.7	178.6	-77	75.8	0	0	0	113.2	E173 Y207 T236 L237 L238 P244	E173-H240 WeakPolarHBondContact CA-NE2 3.44Å; Y207-H240 WeakPolarHBondContact OH-CB 3.21Å; Y207-H240 PolarHBondContact OH-O 3.45Å; T236-H240 PolarHBondContact O-N 3.07Å; T236-H240 VanDerWaalsContact O-N 3.07Å; T236-H240 PolarHBondContact O-ND1 2.89Å; L237-H240 PolarHBondContact O-N 3.01Å; L238-H240 VanDerWaalsContact C-N 3.31Å; L238-H240 PolarHBondContact O-N 3.22Å; H240-P244 VanDerWaalsContact O-CD 3.24Å; H240-P244 WeakPolarHBondContact O-CD 3.31Å
241	I	90.7	Very high	86	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-71.2	-43.7	172.8	-68.6	162.1	0	0	0	110.5	L211 L237 L238 E239 F264 F268 F281	L211-I241 HydrophobicContact CB-CG1 4.42Å; L211-I241 HydrophobicContact CD1-CG1 3.8Å; L237-I241 VanDerWaalsContact O-CG1 3.26Å; L237-I241 WeakPolarHBondContact O-CG1 3.42Å; L237-I241 PolarHBondContact O-N 3.01Å; L238-I241 PolarHBondContact O-N 3.32Å; E239-I241 VanDerWaalsContact C-N 3.34Å; E239-I241 PolarHBondContact O-N 3.46Å; I241-F264 HydrophobicContact CG2-CD2 4.37Å; I241-F264 HydrophobicContact CG2-CE2 3.72Å; I241-F268 HydrophobicContact CD1-CE1 4.26Å; I241-F268 HydrophobicContact CD1-CE2 3.68Å; I241-F268 HydrophobicContact CD1-CZ 3.48Å; I241-F268 VanDerWaalsContact CD1-CZ 3.48Å; I241-F268 HydrophobicContact CG1-CE2 4.3Å; I241-F268 HydrophobicContact CG1-CZ 4.41Å; I241-F281 HydrophobicContact CD1-CD1 3.68Å; I241-F281 HydrophobicContact CD1-CE1 3.5Å; I241-F281 VanDerWaalsContact CD1-CE1 3.5Å; I241-F281 HydrophobicContact CD1-CZ 4.44Å
242	L	90	Very high	86.5	Confident	11 Å²	11	39.5 Å²	39.5	6%	0.058	23%	0.228	C	C	.	.	H	α-helix	trans	-73.2	-40.2	-176.7	-77.5	170.4	0	0	0	113.1	L238 E239 L245 H246 L285 L290 F292	L238-L242 HydrophobicContact CD1-CD1 4.29Å; L238-L242 HydrophobicContact CG-CD1 4.2Å; L238-L242 PolarHBondContact O-N 3.01Å; E239-L242 PolarHBondContact O-N 2.9Å; L242-L245 WeakPolarHBondContact O-CB 3.37Å; L242-L245 PolarHBondContact O-N 3.45Å; L242-H246 PolarHBondContact O-CD2 3.09Å; L242-L285 HydrophobicContact CD2-CD2 3.5Å; L242-L285 HydrophobicContact CG-CD2 3.9Å; L242-L290 HydrophobicContact CD1-CB 4.05Å; L242-L290 HydrophobicContact CD1-CD2 4.15Å; L242-F292 HydrophobicContact CD2-CB 4.45Å; L242-F292 HydrophobicContact CD2-CD2 3.77Å
243	K	89.2	Confident	86.7	Confident	42 Å²	42	39.6 Å²	39.6	18%	0.183	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-52.6	-47.7	-169.2	179.7	177.1	-175.3	178.1	0	114.9	S176 E239 L245 H246 F247	S176-K243 WeakPolarHBondContact O-CE 3.38Å; S176-K243 PolarHBondContact O-NZ 3.49Å; S176-K243 PolarHBondContact OG-NZ 3.25Å; E239-K243 WeakPolarHBondContact O-CB 3.41Å; E239-K243 PolarHBondContact O-N 3.39Å; K243-L245 PolarHBondContact O-N 2.9Å; K243-H246 PolarHBondContact O-N 3.31Å; K243-F247 HydrophobicContact CG-CE2 4.24Å; K243-F247 VanDerWaalsContact O-CD2 3.31Å; K243-F247 WeakPolarHBondContact O-CD2 3.33Å
244	P	91.2	Very high	86.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-63.6	-27.4	178.4	-15.5	28	0	0	0	113.2	L199 Y207 Y208 H240 H246 F247 Y249 V260	L199-P244 HydrophobicContact CD2-CG 4.37Å; Y207-P244 HydrophobicContact CD1-CG 4.3Å; Y207-P244 HydrophobicContact CE1-CG 3.78Å; Y208-P244 WeakPolarHBondContact OH-CB 3.37Å; H240-P244 VanDerWaalsContact O-CD 3.24Å; H240-P244 WeakPolarHBondContact O-CD 3.31Å; P244-H246 VanDerWaalsContact C-N 3.3Å; P244-H246 PolarHBondContact O-N 3.23Å; P244-F247 PolarHBondContact O-N 2.74Å; P244-Y249 WeakPolarHBondContact CB-OH 3.36Å; P244-Y249 VanDerWaalsContact O-CE2 3.25Å; P244-Y249 WeakPolarHBondContact O-CE2 3.47Å; P244-Y249 PolarHBondContact O-OH 3.46Å; P244-Y249 VanDerWaalsContact O-OH 3.05Å; P244-V260 HydrophobicContact CB-CG1 4.21Å
245	L	90.9	Very high	86.6	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-72.7	-22.4	-176.5	-55	178.4	0	0	0	113.1	Y208 L242 K243 V260 F261 F264 F292 P293	Y208-L245 WeakPolarHBondContact OH-CD2 3.32Å; L242-L245 WeakPolarHBondContact O-CB 3.37Å; L242-L245 PolarHBondContact O-N 3.45Å; K243-L245 PolarHBondContact O-N 2.9Å; L245-V260 HydrophobicContact CD2-CG1 4.26Å; L245-F261 HydrophobicContact CB-CE1 4.03Å; L245-F261 HydrophobicContact CB-CZ 4.12Å; L245-F261 HydrophobicContact CD2-CD1 3.79Å; L245-F261 HydrophobicContact CD2-CE1 3.74Å; L245-F261 HydrophobicContact CD2-CG 4.46Å; L245-F261 HydrophobicContact CD2-CZ 4.32Å; L245-F261 HydrophobicContact CG-CE1 4.32Å; L245-F261 WeakPolarHBondContact O-CZ 3.47Å; L245-F264 HydrophobicContact CD1-CD1 4.17Å; L245-F264 HydrophobicContact CD1-CD2 4.27Å; L245-F264 HydrophobicContact CD1-CE1 4.15Å; L245-F264 HydrophobicContact CD1-CE2 4.26Å; L245-F264 HydrophobicContact CD1-CG 4.22Å; L245-F264 HydrophobicContact CD1-CZ 4.18Å; L245-F264 HydrophobicContact CD2-CB 4.01Å; L245-F264 HydrophobicContact CD2-CD1 4.33Å; L245-F264 HydrophobicContact CD2-CG 4.07Å; L245-F292 HydrophobicContact CD1-CD2 4.23Å; L245-F292 HydrophobicContact CD1-CE2 3.57Å; L245-F292 HydrophobicContact CD1-CZ 4.46Å; L245-P293 HydrophobicContact CB-CG 3.98Å
246	H	90.3	Very high	86.8	Confident	83 Å²	83	42.9 Å²	42.9	38%	0.384	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-80.4	-16.3	179.5	-75	-80.5	0	0	0	114.3	L242 K243 P244 S291	L242-H246 PolarHBondContact O-CD2 3.09Å; K243-H246 PolarHBondContact O-N 3.31Å; P244-H246 VanDerWaalsContact C-N 3.3Å; P244-H246 PolarHBondContact O-N 3.23Å; H246-S291 PolarHBondContact CE1-O 3.09Å; H246-S291 PolarHBondContact CE1-OG 3.13Å
247	F	88.7	Confident	87.1	Confident	25 Å²	25	44.1 Å²	44.1	11%	0.11	25%	0.254	C	S	.	.			trans	-79.2	149.6	-179.7	-76.9	-92.4	0	0	0	112.6	L195 E196 L199 K243 P244 Y249	L195-F247 HydrophobicContact CB-CE1 4.27Å; L195-F247 HydrophobicContact CB-CZ 4.41Å; L195-F247 HydrophobicContact CD1-CZ 4.34Å; E196-F247 HydrophobicContact CG-CB 4.28Å; E196-F247 HydrophobicContact CG-CD1 3.76Å; E196-F247 HydrophobicContact CG-CG 4.37Å; L199-F247 HydrophobicContact CD1-CD2 3.65Å; L199-F247 HydrophobicContact CD1-CE2 3.65Å; L199-F247 HydrophobicContact CD1-CG 4.27Å; L199-F247 HydrophobicContact CD1-CZ 4.26Å; K243-F247 HydrophobicContact CG-CE2 4.24Å; K243-F247 VanDerWaalsContact O-CD2 3.31Å; K243-F247 WeakPolarHBondContact O-CD2 3.33Å; P244-F247 PolarHBondContact O-N 2.74Å; F247-Y249 HydrophobicContact CB-CD2 4Å; F247-Y249 HydrophobicContact CB-CE1 4.46Å; F247-Y249 HydrophobicContact CB-CE2 3.65Å; F247-Y249 WeakPolarHBondContact O-CD2 3.2Å
248	T	84.7	Confident	87.1	Confident	78 Å²	78	48.8 Å²	48.8	48%	0.479	28%	0.276	S	S	.	.			trans	-87.2	-23.7	178.8	59.7	0	0	0	0	112.8	E196 S250	E196-T248 PolarHBondContact OE1-OG1 3.29Å; T248-S250 PolarHBondContact O-N 3.13Å
249	Y	87.6	Confident	87.1	Confident	8 Å²	8	52.3 Å²	52.3	3%	0.031	29%	0.291	C	S	.	.			trans	60.3	30.7	-179.1	-62.7	-84.1	0	0	0	113.7	E196 L199 H200 P244 F247 S251 C252 R257 V260	E196-Y249 HydrophobicContact CB-CD1 3.81Å; E196-Y249 HydrophobicContact CB-CE1 4.28Å; E196-Y249 HydrophobicContact CG-CD1 4.11Å; E196-Y249 HydrophobicContact CG-CG 4.48Å; E196-Y249 WeakPolarHBondContact O-CD1 3.48Å; E196-Y249 VanDerWaalsContact O-CE1 3.28Å; E196-Y249 WeakPolarHBondContact O-CE1 3.44Å; E196-Y249 WeakPolarHBondContact OE1-CA 3.39Å; E196-Y249 PolarHBondContact OE1-N 3.18Å; E196-Y249 WeakPolarHBondContact OE2-CA 3.5Å; L199-Y249 HydrophobicContact CB-CE1 4.07Å; L199-Y249 WeakPolarHBondContact CB-OH 3.36Å; H200-Y249 HydrophobicContact CB-CD1 4.06Å; H200-Y249 HydrophobicContact CB-CE1 3.99Å; P244-Y249 WeakPolarHBondContact CB-OH 3.36Å; P244-Y249 VanDerWaalsContact O-CE2 3.25Å; P244-Y249 WeakPolarHBondContact O-CE2 3.47Å; P244-Y249 PolarHBondContact O-OH 3.46Å; P244-Y249 VanDerWaalsContact O-OH 3.05Å; F247-Y249 HydrophobicContact CB-CD2 4Å; F247-Y249 HydrophobicContact CB-CE1 4.46Å; F247-Y249 HydrophobicContact CB-CE2 3.65Å; F247-Y249 WeakPolarHBondContact O-CD2 3.2Å; Y249-S251 PolarHBondContact O-N 3.16Å; Y249-C252 PolarHBondContact O-N 3.47Å; Y249-C252 VanDerWaalsContact O-N 3.13Å; Y249-R257 HydrophobicContact CD2-CB 4.2Å; Y249-R257 HydrophobicContact CD2-CG 4.39Å; Y249-V260 HydrophobicContact CD2-CG2 4.39Å; Y249-V260 HydrophobicContact CE1-CG2 4.23Å; Y249-V260 HydrophobicContact CE2-CB 4.17Å; Y249-V260 HydrophobicContact CE2-CG1 4.15Å; Y249-V260 HydrophobicContact CE2-CG2 3.86Å
250	S	83.9	Confident	87.3	Confident	105 Å²	105	46.5 Å²	46.5	73%	0.734	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-23	-179	62.3	0	0	0	0	113.1	E196 T248	E196-S250 PolarHBondContact OE1-N 3.44Å; E196-S250 PolarHBondContact OE2-N 3.38Å; T248-S250 PolarHBondContact O-N 3.13Å
251	S	82.1	Confident	87.5	Confident	41 Å²	41	46.2 Å²	46.2	29%	0.287	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	1.3	178.3	69.2	0	0	0	0	115.5	S193 E196 Y249	S193-S251 WeakPolarHBondContact CA-OG 3.28Å; S193-S251 PolarHBondContact O-OG 3.1Å; S193-S251 WeakPolarHBondContact OG-CB 3.45Å; S193-S251 PolarHBondContact OG-OG 3.38Å; E196-S251 VanDerWaalsContact OE2-CB 3.3Å; E196-S251 WeakPolarHBondContact OE2-CB 3.46Å; E196-S251 PolarHBondContact OE2-N 2.89Å; E196-S251 PolarHBondContact OE2-OG 3.25Å; Y249-S251 PolarHBondContact O-N 3.16Å
252	C	84.8	Confident	87.5	Confident	32 Å²	32	47.3 Å²	47.3	22%	0.216	27%	0.271	C	S	.	.	S	Bend	trans	-103.1	-175.4	178.7	-66.9	0	0	0	0	111.5	Y249 A256	Y249-C252 PolarHBondContact O-N 3.47Å; Y249-C252 VanDerWaalsContact O-N 3.13Å; C252-A256 HydrophobicContact CB-CB 3.44Å; C252-A256 VanDerWaalsContact CB-CB 3.44Å
253	T	82.2	Confident	87.5	Confident	100 Å²	100	47 Å²	47	61%	0.613	27%	0.271	S	S	*	.	S	Bend	trans	-62.2	153.5	175.4	51.4	0	0	0	0	111.4	G255 A256	T253-G255 PolarHBondContact O-N 3.39Å; T253-A256 WeakPolarHBondContact O-CB 3.44Å; T253-A256 PolarHBondContact O-N 2.78Å
254	T	81.3	Confident	87.6	Confident	150 Å²	150	45 Å²	45	92%	0.92	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	132	172.7	47.6	0	0	0	0	110.2
255	G	82.5	Confident	87.6	Confident	34 Å²	34	45.1 Å²	45.1	35%	0.351	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	4.3	-175.7	0	0	0	0	0	115.9	T253 R257 Q258 F259	T253-G255 PolarHBondContact O-N 3.39Å; G255-R257 VanDerWaalsContact C-N 3.34Å; G255-R257 PolarHBondContact O-N 3.02Å; G255-Q258 WeakPolarHBondContact O-CB 3.2Å; G255-Q258 PolarHBondContact O-N 3.35Å; G255-F259 PolarHBondContact O-N 2.97Å
256	A	87.3	Confident	87.4	Confident	3 Å²	3	50.3 Å²	50.3	3%	0.025	29%	0.287	C	S	.	.	H	α-helix	trans	-59.3	-39.4	-180	0	0	0	0	0	113.9	C252 T253 F259 V260	C252-A256 HydrophobicContact CB-CB 3.44Å; C252-A256 VanDerWaalsContact CB-CB 3.44Å; T253-A256 WeakPolarHBondContact O-CB 3.44Å; T253-A256 PolarHBondContact O-N 2.78Å; A256-F259 PolarHBondContact O-N 3.4Å; A256-V260 WeakPolarHBondContact O-CG2 3.04Å; A256-V260 PolarHBondContact O-N 3.44Å; A256-V260 VanDerWaalsContact O-N 3.1Å
257	R	89.6	Confident	87.3	Confident	73 Å²	73	48.7 Å²	48.7	28%	0.275	28%	0.279	S	S	.	.	H	α-helix	trans	-62.5	-44.9	175.3	-173.5	176	-176	141	14.9	111.7	Y249 G255 F259 V260 F261	Y249-R257 HydrophobicContact CD2-CB 4.2Å; Y249-R257 HydrophobicContact CD2-CG 4.39Å; G255-R257 VanDerWaalsContact C-N 3.34Å; G255-R257 PolarHBondContact O-N 3.02Å; R257-F259 VanDerWaalsContact C-N 3.33Å; R257-F259 PolarHBondContact O-N 3.16Å; R257-V260 PolarHBondContact O-N 3.44Å; R257-V260 VanDerWaalsContact O-N 3.16Å; R257-F261 HydrophobicContact CG-CD2 4.04Å; R257-F261 HydrophobicContact CG-CE2 3.87Å; R257-F261 WeakPolarHBondContact O-CD2 3.49Å; R257-F261 PolarHBondContact O-N 3.21Å; R257-F261 VanDerWaalsContact O-N 3.13Å
258	Q	87.9	Confident	87.3	Confident	97 Å²	97	47.5 Å²	47.5	45%	0.453	27%	0.274	S	S	.	.	H	α-helix	trans	-61.9	-42.5	177.6	-67.4	162.5	-23.9	0	0	111	G255 V260 F261 A262	G255-Q258 WeakPolarHBondContact O-CB 3.2Å; G255-Q258 PolarHBondContact O-N 3.35Å; Q258-V260 VanDerWaalsContact C-N 3.3Å; Q258-V260 PolarHBondContact O-N 2.97Å; Q258-F261 PolarHBondContact O-N 3.01Å; Q258-A262 WeakPolarHBondContact O-CB 3.41Å; Q258-A262 PolarHBondContact O-N 3.18Å
259	F	89.6	Confident	87.6	Confident	86 Å²	86	43.8 Å²	43.8	38%	0.377	25%	0.251	S	S	.	.	H	α-helix	trans	-59	-40.2	174.4	176.9	-96	0	0	0	112.5	H200 V203 Q204 G255 A256 R257 A262 A263	H200-F259 AromaticContact CE1-CD1 3.74Å; V203-F259 HydrophobicContact CG1-CD1 4.43Å; V203-F259 HydrophobicContact CG1-CE1 4.02Å; Q204-F259 HydrophobicContact CB-CE1 4.26Å; Q204-F259 HydrophobicContact CB-CZ 4.49Å; Q204-F259 HydrophobicContact CG-CE1 4.5Å; Q204-F259 HydrophobicContact CG-CZ 4.34Å; G255-F259 PolarHBondContact O-N 2.97Å; A256-F259 PolarHBondContact O-N 3.4Å; R257-F259 VanDerWaalsContact C-N 3.33Å; R257-F259 PolarHBondContact O-N 3.16Å; F259-A262 PolarHBondContact O-N 3.34Å; F259-A263 WeakPolarHBondContact O-CB 3.41Å; F259-A263 PolarHBondContact O-N 3.02Å
260	V	91.8	Very high	87.6	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	25%	0.25	C	S	.	.	H	α-helix	trans	-65.4	-42.9	178.5	171.9	0	0	0	0	111.5	V203 Y208 P244 L245 Y249 A256 R257 Q258 F264	V203-V260 HydrophobicContact CB-CG2 4.45Å; V203-V260 HydrophobicContact CG1-CG2 4.35Å; V203-V260 HydrophobicContact CG2-CG1 4.35Å; V203-V260 HydrophobicContact CG2-CG2 4.37Å; Y208-V260 HydrophobicContact CE2-CG1 4.37Å; P244-V260 HydrophobicContact CB-CG1 4.21Å; L245-V260 HydrophobicContact CD2-CG1 4.26Å; Y249-V260 HydrophobicContact CD2-CG2 4.39Å; Y249-V260 HydrophobicContact CE1-CG2 4.23Å; Y249-V260 HydrophobicContact CE2-CB 4.17Å; Y249-V260 HydrophobicContact CE2-CG1 4.15Å; Y249-V260 HydrophobicContact CE2-CG2 3.86Å; A256-V260 WeakPolarHBondContact O-CG2 3.04Å; A256-V260 PolarHBondContact O-N 3.44Å; A256-V260 VanDerWaalsContact O-N 3.1Å; R257-V260 PolarHBondContact O-N 3.44Å; R257-V260 VanDerWaalsContact O-N 3.16Å; Q258-V260 VanDerWaalsContact C-N 3.3Å; Q258-V260 PolarHBondContact O-N 2.97Å; V260-F264 PolarHBondContact O-N 2.91Å
261	F	91.9	Very high	87.6	Confident	1 Å²	1	39.1 Å²	39.1	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-67.4	-38.8	173.9	-80.1	-72.7	0	0	0	112.6	L245 R257 Q258 F264 T265 P293 A296 F297	L245-F261 HydrophobicContact CB-CE1 4.03Å; L245-F261 HydrophobicContact CB-CZ 4.12Å; L245-F261 HydrophobicContact CD2-CD1 3.79Å; L245-F261 HydrophobicContact CD2-CE1 3.74Å; L245-F261 HydrophobicContact CD2-CG 4.46Å; L245-F261 HydrophobicContact CD2-CZ 4.32Å; L245-F261 HydrophobicContact CG-CE1 4.32Å; L245-F261 WeakPolarHBondContact O-CZ 3.47Å; R257-F261 HydrophobicContact CG-CD2 4.04Å; R257-F261 HydrophobicContact CG-CE2 3.87Å; R257-F261 WeakPolarHBondContact O-CD2 3.49Å; R257-F261 PolarHBondContact O-N 3.21Å; R257-F261 VanDerWaalsContact O-N 3.13Å; Q258-F261 PolarHBondContact O-N 3.01Å; F261-F264 PolarHBondContact O-N 3.32Å; F261-T265 WeakPolarHBondContact O-CB 3.2Å; F261-T265 PolarHBondContact O-N 3.44Å; F261-T265 PolarHBondContact O-OG1 2.85Å; F261-P293 HydrophobicContact CE1-CG 4.21Å; F261-P293 HydrophobicContact CZ-CB 4.49Å; F261-P293 HydrophobicContact CZ-CG 3.9Å; F261-A296 HydrophobicContact CE2-CB 4.17Å; F261-A296 HydrophobicContact CZ-CB 4.09Å; F261-F297 HydrophobicContact CD1-CB 3.93Å; F261-F297 AromaticContact CD1-CD2 3.92Å; F261-F297 HydrophobicContact CD1-CD2 3.92Å; F261-F297 HydrophobicContact CD1-CG 4.44Å; F261-F297 HydrophobicContact CE1-CB 3.82Å
262	A	89.3	Confident	87.8	Confident	22 Å²	22	39.8 Å²	39.8	18%	0.182	22%	0.224	C	C	.	.	H	α-helix	trans	-62.3	-45.2	176	0	0	0	0	0	111.2	Q258 F259 F264 T265 E266 T304	Q258-A262 WeakPolarHBondContact O-CB 3.41Å; Q258-A262 PolarHBondContact O-N 3.18Å; F259-A262 PolarHBondContact O-N 3.34Å; A262-F264 PolarHBondContact O-N 3.05Å; A262-T265 WeakPolarHBondContact O-CB 3.32Å; A262-T265 PolarHBondContact O-N 2.78Å; A262-E266 WeakPolarHBondContact O-CB 3.26Å; A262-E266 PolarHBondContact O-N 2.68Å; A262-T304 HydrophobicContact CB-CG2 4.46Å
263	A	89.9	Confident	88	Confident	6 Å²	6	38.3 Å²	38.3	5%	0.05	21%	0.214	C	C	.	.	H	α-helix	trans	-63.8	-39.5	175.5	0	0	0	0	0	112.4	V203 Y208 F259 T265 E267	V203-A263 HydrophobicContact CG1-CB 3.43Å; V203-A263 VanDerWaalsContact CG1-CB 3.43Å; Y208-A263 HydrophobicContact CD2-CB 4.27Å; F259-A263 WeakPolarHBondContact O-CB 3.41Å; F259-A263 PolarHBondContact O-N 3.02Å; A263-T265 VanDerWaalsContact C-N 3.34Å; A263-E267 WeakPolarHBondContact O-CB 3.39Å; A263-E267 WeakPolarHBondContact O-CG 3.44Å; A263-E267 PolarHBondContact O-N 3.41Å
264	F	92.3	Very high	88.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-44.2	172.6	170.6	-109.9	0	0	0	111.8	Y208 I241 L245 V260 F261 A262 F268 I269 L285 F292 F297 F321	Y208-F264 AromaticContact CD1-CD2 3.88Å; Y208-F264 HydrophobicContact CD1-CD2 3.88Å; Y208-F264 HydrophobicContact CD2-CB 4.03Å; Y208-F264 HydrophobicContact CE1-CB 4.24Å; Y208-F264 AromaticContact CE1-CD2 3.67Å; Y208-F264 HydrophobicContact CE1-CD2 3.67Å; Y208-F264 HydrophobicContact CE1-CG 4.38Å; Y208-F264 HydrophobicContact CE2-CB 3.69Å; Y208-F264 HydrophobicContact CG-CB 4.43Å; Y208-F264 HydrophobicContact CG-CD2 4.47Å; I241-F264 HydrophobicContact CG2-CD2 4.37Å; I241-F264 HydrophobicContact CG2-CE2 3.72Å; L245-F264 HydrophobicContact CD1-CD1 4.17Å; L245-F264 HydrophobicContact CD1-CD2 4.27Å; L245-F264 HydrophobicContact CD1-CE1 4.15Å; L245-F264 HydrophobicContact CD1-CE2 4.26Å; L245-F264 HydrophobicContact CD1-CG 4.22Å; L245-F264 HydrophobicContact CD1-CZ 4.18Å; L245-F264 HydrophobicContact CD2-CB 4.01Å; L245-F264 HydrophobicContact CD2-CD1 4.33Å; L245-F264 HydrophobicContact CD2-CG 4.07Å; V260-F264 PolarHBondContact O-N 2.91Å; F261-F264 PolarHBondContact O-N 3.32Å; A262-F264 PolarHBondContact O-N 3.05Å; F264-F268 HydrophobicContact CD2-CB 4.16Å; F264-F268 HydrophobicContact CE2-CB 4.3Å; F264-F268 AromaticContact CE2-CD1 3.9Å; F264-F268 HydrophobicContact CE2-CD1 3.9Å; F264-F268 HydrophobicContact CE2-CG 4.3Å; F264-F268 WeakPolarHBondContact O-CB 3.48Å; F264-F268 PolarHBondContact O-N 2.86Å; F264-F268 VanDerWaalsContact O-N 3.13Å; F264-I269 HydrophobicContact CD1-CG1 4.22Å; F264-I269 HydrophobicContact CE1-CD1 4.25Å; F264-I269 HydrophobicContact CE1-CG1 3.54Å; F264-I269 HydrophobicContact CE2-CD1 4.33Å; F264-I269 HydrophobicContact CE2-CG1 4Å; F264-I269 HydrophobicContact CZ-CD1 3.72Å; F264-I269 HydrophobicContact CZ-CG1 3.42Å; F264-I269 VanDerWaalsContact CZ-CG1 3.42Å; F264-I269 PolarHBondContact O-N 3.08Å; F264-L285 HydrophobicContact CZ-CD1 4.19Å; F264-F292 HydrophobicContact CE1-CE2 4.04Å; F264-F292 HydrophobicContact CE1-CZ 4.07Å; F264-F292 HydrophobicContact CZ-CE2 4.24Å; F264-F297 HydrophobicContact CD1-CD2 4.4Å; F264-F297 HydrophobicContact CD1-CE2 4.28Å; F264-F297 HydrophobicContact CE1-CE2 4.33Å; F264-F321 HydrophobicContact CE1-CE1 4.29Å; F264-F321 HydrophobicContact CE1-CZ 4.36Å; F264-F321 HydrophobicContact CZ-CZ 4.44Å
265	T	90.1	Very high	88.4	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.155	C	C	.	.	I	π-helix	trans	-62.7	-54.5	179.2	-52.7	0	0	0	0	110.3	F261 A262 A263 I269 S270 F297 L301 L318	F261-T265 WeakPolarHBondContact O-CB 3.2Å; F261-T265 PolarHBondContact O-N 3.44Å; F261-T265 PolarHBondContact O-OG1 2.85Å; A262-T265 WeakPolarHBondContact O-CB 3.32Å; A262-T265 PolarHBondContact O-N 2.78Å; A263-T265 VanDerWaalsContact C-N 3.34Å; T265-I269 PolarHBondContact O-N 3.2Å; T265-S270 WeakPolarHBondContact O-CB 3Å; T265-S270 PolarHBondContact O-N 3.22Å; T265-S270 PolarHBondContact O-OG 2.94Å; T265-S270 VanDerWaalsContact O-OG 3.09Å; T265-F297 WeakPolarHBondContact OG1-CE2 3.42Å; T265-L301 HydrophobicContact CG2-CD1 3.96Å; T265-L318 HydrophobicContact CG2-CD1 3.6Å; T265-L318 HydrophobicContact CG2-CD2 4.03Å; T265-L318 HydrophobicContact CG2-CG 4.45Å
266	E	87.8	Confident	88.6	Confident	110 Å²	110	28.3 Å²	28.3	51%	0.514	14%	0.141	S	C	.	.	I	π-helix	trans	-69.8	-44.7	-175.8	-178.6	177.3	-176.3	0	0	113.3	A262 F308	A262-E266 WeakPolarHBondContact O-CB 3.26Å; A262-E266 PolarHBondContact O-N 2.68Å; E266-F308 HydrophobicContact CB-CZ 4.07Å; E266-F308 HydrophobicContact CG-CZ 3.95Å
267	E	88.4	Confident	88.7	Confident	49 Å²	49	28.1 Å²	28.1	23%	0.229	14%	0.14	C	C	.	.	I	π-helix	trans	-87.7	-20.2	-171.3	-59.1	-174.6	169.6	0	0	114.1	Y208 K209 A263	Y208-E267 PolarHBondContact N-OE2 2.93Å; K209-E267 HydrophobicContact CB-CB 4.25Å; K209-E267 HydrophobicContact CB-CG 4.42Å; K209-E267 PolarHBondContact N-OE2 3.07Å; A263-E267 WeakPolarHBondContact O-CB 3.39Å; A263-E267 WeakPolarHBondContact O-CG 3.44Å; A263-E267 PolarHBondContact O-N 3.41Å
268	F	89.3	Confident	88.6	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.132	C	C	.	.	I	π-helix	trans	-122.3	-53.9	-174.2	-164.5	-89.6	0	0	0	113.5	Y212 V215 I241 F264 F281	Y212-F268 HydrophobicContact CD2-CD2 4.23Å; Y212-F268 HydrophobicContact CD2-CE2 4.49Å; V215-F268 HydrophobicContact CG2-CE2 4.49Å; I241-F268 HydrophobicContact CD1-CE1 4.26Å; I241-F268 HydrophobicContact CD1-CE2 3.68Å; I241-F268 HydrophobicContact CD1-CZ 3.48Å; I241-F268 VanDerWaalsContact CD1-CZ 3.48Å; I241-F268 HydrophobicContact CG1-CE2 4.3Å; I241-F268 HydrophobicContact CG1-CZ 4.41Å; F264-F268 HydrophobicContact CD2-CB 4.16Å; F264-F268 HydrophobicContact CE2-CB 4.3Å; F264-F268 AromaticContact CE2-CD1 3.9Å; F264-F268 HydrophobicContact CE2-CD1 3.9Å; F264-F268 HydrophobicContact CE2-CG 4.3Å; F264-F268 WeakPolarHBondContact O-CB 3.48Å; F264-F268 PolarHBondContact O-N 2.86Å; F264-F268 VanDerWaalsContact O-N 3.13Å; F268-F281 HydrophobicContact CZ-CD1 4.38Å; F268-F281 HydrophobicContact CZ-CG 4.41Å
269	I	90.2	Very high	88.5	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	I	π-helix	trans	-84.3	-36.7	-172	-65.6	-62.7	0	0	0	113.4	F264 T265 A271 F273 I282 L285 W317 L318 F321	F264-I269 HydrophobicContact CD1-CG1 4.22Å; F264-I269 HydrophobicContact CE1-CD1 4.25Å; F264-I269 HydrophobicContact CE1-CG1 3.54Å; F264-I269 HydrophobicContact CE2-CD1 4.33Å; F264-I269 HydrophobicContact CE2-CG1 4Å; F264-I269 HydrophobicContact CZ-CD1 3.72Å; F264-I269 HydrophobicContact CZ-CG1 3.42Å; F264-I269 VanDerWaalsContact CZ-CG1 3.42Å; F264-I269 PolarHBondContact O-N 3.08Å; T265-I269 PolarHBondContact O-N 3.2Å; I269-A271 PolarHBondContact O-N 2.75Å; I269-F273 WeakPolarHBondContact O-CE1 3.37Å; I269-I282 HydrophobicContact CD1-CD1 4.06Å; I269-L285 HydrophobicContact CD1-CD1 4.25Å; I269-W317 WeakPolarHBondContact O-CB 3.42Å; I269-L318 HydrophobicContact CG2-CD1 3.87Å; I269-F321 HydrophobicContact CD1-CD1 4.13Å; I269-F321 HydrophobicContact CD1-CD2 3.8Å; I269-F321 HydrophobicContact CD1-CE1 4.27Å; I269-F321 HydrophobicContact CD1-CE2 3.94Å; I269-F321 HydrophobicContact CD1-CG 3.88Å; I269-F321 HydrophobicContact CD1-CZ 4.17Å; I269-F321 HydrophobicContact CG1-CD1 4.16Å; I269-F321 HydrophobicContact CG1-CE1 4.27Å; I269-F321 HydrophobicContact CG1-CG 4.35Å; I269-F321 HydrophobicContact CG2-CB 3.54Å; I269-F321 HydrophobicContact CG2-CD1 3.63Å; I269-F321 HydrophobicContact CG2-CG 3.66Å
270	S	86.8	Confident	88.5	Confident	2 Å²	2	21.3 Å²	21.3	1%	0.014	11%	0.112	C	C	.	.	S	Bend	trans	-79.8	-6.1	177.9	-68.6	0	0	0	0	113.1	T265	T265-S270 WeakPolarHBondContact O-CB 3Å; T265-S270 PolarHBondContact O-N 3.22Å; T265-S270 PolarHBondContact O-OG 2.94Å; T265-S270 VanDerWaalsContact O-OG 3.09Å
271	A	85.7	Confident	88.3	Confident	13 Å²	13	21.3 Å²	21.3	11%	0.107	11%	0.111	C	C	.	.	S	Bend	trans	-76.7	149.2	174.9	0	0	0	0	0	110.9	Y212 I269 F273	Y212-A271 HydrophobicContact CD2-CB 4.12Å; Y212-A271 HydrophobicContact CE1-CB 4.33Å; Y212-A271 HydrophobicContact CE2-CB 3.48Å; Y212-A271 VanDerWaalsContact CE2-CB 3.48Å; I269-A271 PolarHBondContact O-N 2.75Å; A271-F273 PolarHBondContact O-N 3.41Å
272	P	86.1	Confident	88.3	Confident	56 Å²	56	21.3 Å²	21.3	36%	0.364	11%	0.112	S	C	.	.	P	Polyproline II helix	trans	-56.6	127.1	-179.7	-24.9	33.8	0	0	0	112.6	Y212 T274 W317	Y212-P272 PolarHBondContact OH-O 3.18Å; P272-T274 PolarHBondContact O-N 2.93Å; P272-W317 HydrophobicContact CB-CH2 4.36Å; P272-W317 HydrophobicContact CB-CZ2 3.85Å
273	F	87.9	Confident	88.2	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.118	C	C	.	.	P	Polyproline II helix	trans	-67.4	134.4	-178.1	-60.2	-24.7	0	0	0	111.9	I269 A271 I277 F278 I282 W317 Y320 I386 I391	I269-F273 WeakPolarHBondContact O-CE1 3.37Å; A271-F273 PolarHBondContact O-N 3.41Å; F273-I277 HydrophobicContact CB-CG2 4.46Å; F273-I277 HydrophobicContact CD1-CG2 3.63Å; F273-I277 HydrophobicContact CE1-CG2 4.11Å; F273-I277 HydrophobicContact CG-CG2 4.16Å; F273-F278 HydrophobicContact CB-CB 4.31Å; F273-F278 HydrophobicContact CD2-CD2 4.07Å; F273-I282 HydrophobicContact CE1-CD1 4.01Å; F273-I282 HydrophobicContact CE2-CD1 4.42Å; F273-I282 HydrophobicContact CE2-CG1 4.41Å; F273-I282 HydrophobicContact CZ-CD1 3.79Å; F273-I282 HydrophobicContact CZ-CG1 4.24Å; F273-W317 HydrophobicContact CB-CE3 3.75Å; F273-W317 HydrophobicContact CB-CZ3 3.61Å; F273-W317 HydrophobicContact CD1-CB 4.4Å; F273-W317 AromaticContact CD1-CE3 3.99Å; F273-W317 HydrophobicContact CD1-CE3 3.99Å; F273-W317 AromaticContact CD2-CE3 3.43Å; F273-W317 HydrophobicContact CD2-CE3 3.43Å; F273-W317 VanDerWaalsContact CD2-CE3 3.43Å; F273-W317 AromaticContact CD2-CZ3 3.9Å; F273-W317 HydrophobicContact CD2-CZ3 3.9Å; F273-W317 HydrophobicContact CE1-CB 3.94Å; F273-W317 HydrophobicContact CE1-CE3 4.48Å; F273-W317 HydrophobicContact CE2-CB 4.34Å; F273-W317 AromaticContact CE2-CE3 3.93Å; F273-W317 HydrophobicContact CE2-CE3 3.93Å; F273-W317 HydrophobicContact CG-CD2 4.46Å; F273-W317 AromaticContact CG-CE3 3.44Å; F273-W317 HydrophobicContact CG-CE3 3.44Å; F273-W317 VanDerWaalsContact CG-CE3 3.44Å; F273-W317 AromaticContact CG-CZ3 3.85Å; F273-W317 HydrophobicContact CG-CZ3 3.85Å; F273-W317 HydrophobicContact CZ-CB 3.9Å; F273-W317 HydrophobicContact CZ-CE3 4.46Å; F273-W317 WeakPolarHBondContact CZ-O 3.43Å; F273-W317 VanDerWaalsContact N-CE3 3.29Å; F273-Y320 HydrophobicContact CD2-CD1 4.36Å; F273-Y320 AromaticContact CE2-CD1 3.51Å; F273-Y320 HydrophobicContact CE2-CD1 3.51Å; F273-Y320 HydrophobicContact CE2-CE1 4.29Å; F273-Y320 HydrophobicContact CE2-CG 4.13Å; F273-Y320 HydrophobicContact CZ-CD1 4.29Å; F273-I386 HydrophobicContact CB-CD1 4.04Å; F273-I386 PolarHBondContact O-N 3.03Å; F273-I391 HydrophobicContact CD2-CD1 3.87Å; F273-I391 HydrophobicContact CE2-CD1 4.31Å
274	T	87.6	Confident	88.1	Confident	6 Å²	6	22.3 Å²	22.3	4%	0.037	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	-91.8	162.8	162	55.9	0	0	0	0	109.3	N216 P272 Q276 I277 F278	N216-T274 HydrophobicContact CB-CG2 4.4Å; N216-T274 WeakPolarHBondContact OD1-CB 3.49Å; N216-T274 WeakPolarHBondContact OD1-CG2 3.47Å; N216-T274 PolarHBondContact OD1-OG1 3.35Å; P272-T274 PolarHBondContact O-N 2.93Å; T274-Q276 VanDerWaalsContact CB-OE1 3.23Å; T274-Q276 PolarHBondContact O-N 3.49Å; T274-Q276 PolarHBondContact OG1-OE1 2.98Å; T274-I277 PolarHBondContact O-N 3.43Å; T274-I277 WeakPolarHBondContact OG1-CG1 3.35Å; T274-F278 PolarHBondContact O-N 2.96Å
275	E	84.3	Confident	87.9	Confident	55 Å²	55	22.4 Å²	22.4	26%	0.257	12%	0.116	S	C	.	.	H	α-helix	trans	-49.2	-42.1	175.7	-64.3	-62.5	135.2	0	0	112	S221 I277 F278 H279 I386	S221-E275 WeakPolarHBondContact O-CB 3.45Å; E275-I277 PolarHBondContact O-N 2.89Å; E275-F278 PolarHBondContact O-N 3.49Å; E275-H279 WeakPolarHBondContact O-CB 3.39Å; E275-H279 PolarHBondContact O-CD2 3.12Å; E275-H279 PolarHBondContact O-N 2.92Å; E275-H279 IonicContact OE2-CD2 3.93Å; E275-H279 PolarHBondContact OE2-CD2 2.86Å; E275-H279 IonicContact OE2-NE2 2.77Å; E275-H279 PolarHBondContact OE2-NE2 3.14Å; E275-H279 VanDerWaalsContact OE2-NE2 3.12Å; E275-I386 WeakPolarHBondContact OE1-CG1 3.35Å
276	Q	87.8	Confident	87.7	Confident	13 Å²	13	22.6 Å²	22.6	6%	0.061	12%	0.118	C	C	.	.	H	α-helix	trans	-63.6	-41.7	179	-57.1	92.6	-24.5	0	0	112.4	V215 L219 P220 T274 F280 F281	V215-Q276 HydrophobicContact CG1-CB 4.08Å; L219-Q276 HydrophobicContact CB-CG 4.13Å; L219-Q276 PolarHBondContact O-NE2 3.26Å; P220-Q276 VanDerWaalsContact O-CG 3.27Å; P220-Q276 WeakPolarHBondContact O-CG 3.24Å; T274-Q276 VanDerWaalsContact CB-OE1 3.23Å; T274-Q276 PolarHBondContact O-N 3.49Å; T274-Q276 PolarHBondContact OG1-OE1 2.98Å; Q276-F280 VanDerWaalsContact O-CB 3.29Å; Q276-F280 WeakPolarHBondContact O-CB 3.35Å; Q276-F280 PolarHBondContact O-N 2.82Å; Q276-F280 VanDerWaalsContact O-N 3.11Å; Q276-F281 PolarHBondContact O-N 2.72Å
277	I	87.9	Confident	87.6	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.101	C	C	.	.	I	π-helix	trans	-69.3	-47.1	-179.4	-67.4	172.9	0	0	0	109.5	Y212 V215 F273 T274 E275 F281 I282	Y212-I277 HydrophobicContact CD2-CD1 3.57Å; Y212-I277 HydrophobicContact CE2-CD1 3.24Å; V215-I277 HydrophobicContact CG1-CD1 4.5Å; V215-I277 HydrophobicContact CG1-CG1 3.85Å; F273-I277 HydrophobicContact CB-CG2 4.46Å; F273-I277 HydrophobicContact CD1-CG2 3.63Å; F273-I277 HydrophobicContact CE1-CG2 4.11Å; F273-I277 HydrophobicContact CG-CG2 4.16Å; T274-I277 PolarHBondContact O-N 3.43Å; T274-I277 WeakPolarHBondContact OG1-CG1 3.35Å; E275-I277 PolarHBondContact O-N 2.89Å; I277-F281 PolarHBondContact O-N 3.17Å; I277-F281 VanDerWaalsContact O-N 3.13Å; I277-I282 HydrophobicContact CG2-CD1 4.23Å; I277-I282 HydrophobicContact CG2-CG1 4.01Å; I277-I282 WeakPolarHBondContact O-CG1 3.28Å; I277-I282 PolarHBondContact O-N 3.22Å
278	F	88.6	Confident	87.1	Confident	26 Å²	26	24.4 Å²	24.4	11%	0.114	12%	0.12	C	C	.	.	I	π-helix	trans	-68.5	-43.1	-176	-177.5	-106.6	0	0	0	113.7	F273 T274 E275 P283 Y320 I386 L390 I391	F273-F278 HydrophobicContact CB-CB 4.31Å; F273-F278 HydrophobicContact CD2-CD2 4.07Å; T274-F278 PolarHBondContact O-N 2.96Å; E275-F278 PolarHBondContact O-N 3.49Å; F278-P283 VanDerWaalsContact O-CD 3.23Å; F278-P283 WeakPolarHBondContact O-CD 3.4Å; F278-Y320 AromaticContact CD2-CE1 3.8Å; F278-Y320 HydrophobicContact CD2-CE1 3.8Å; F278-Y320 HydrophobicContact CE2-CD1 4.45Å; F278-Y320 AromaticContact CE2-CE1 3.61Å; F278-Y320 HydrophobicContact CE2-CE1 3.61Å; F278-Y320 HydrophobicContact CE2-CE2 4.01Å; F278-Y320 AromaticContact CE2-CZ 3.37Å; F278-Y320 VanDerWaalsContact CE2-OH 3.28Å; F278-Y320 WeakPolarHBondContact CE2-OH 3.44Å; F278-I386 HydrophobicContact CB-CD1 3.08Å; F278-I386 HydrophobicContact CD1-CD1 3.61Å; F278-I386 HydrophobicContact CD2-CD1 3.87Å; F278-I386 HydrophobicContact CE1-CD1 4.45Å; F278-I386 HydrophobicContact CG-CD1 3.27Å; F278-L390 HydrophobicContact CZ-CD2 4.35Å; F278-I391 HydrophobicContact CD2-CD1 3.84Å; F278-I391 HydrophobicContact CE2-CD1 3.56Å
279	H	86.1	Confident	86.7	Confident	74 Å²	74	33.1 Å²	33.1	34%	0.343	15%	0.153	S	C	.	.	I	π-helix	trans	-88.8	-24.2	-176.5	-69.1	-61.1	0	0	0	114.5	L223 Y225 E275	L223-H279 WeakPolarHBondContact O-CB 3.09Å; Y225-H279 PolarHBondContact N-O 3Å; E275-H279 WeakPolarHBondContact O-CB 3.39Å; E275-H279 PolarHBondContact O-CD2 3.12Å; E275-H279 PolarHBondContact O-N 2.92Å; E275-H279 IonicContact OE2-CD2 3.93Å; E275-H279 PolarHBondContact OE2-CD2 2.86Å; E275-H279 IonicContact OE2-NE2 2.77Å; E275-H279 PolarHBondContact OE2-NE2 3.14Å; E275-H279 VanDerWaalsContact OE2-NE2 3.12Å
280	F	88.2	Confident	86.2	Confident	13 Å²	13	35.6 Å²	35.6	6%	0.057	17%	0.166	C	C	.	.	I	π-helix	trans	-112.4	-59.7	-179.5	-174	-91.8	0	0	0	113.4	L223 Y225 A234 Q276 A284	L223-F280 HydrophobicContact CD1-CD2 4.18Å; L223-F280 HydrophobicContact CD1-CE2 4.49Å; L223-F280 HydrophobicContact CD2-CB 3.68Å; L223-F280 HydrophobicContact CD2-CD1 3.92Å; L223-F280 HydrophobicContact CD2-CD2 3.69Å; L223-F280 HydrophobicContact CD2-CE1 4.49Å; L223-F280 HydrophobicContact CD2-CE2 4.28Å; L223-F280 HydrophobicContact CD2-CG 3.48Å; L223-F280 VanDerWaalsContact CD2-CG 3.48Å; L223-F280 HydrophobicContact CG-CB 3.86Å; L223-F280 HydrophobicContact CG-CD2 3.64Å; L223-F280 HydrophobicContact CG-CE2 4.38Å; L223-F280 HydrophobicContact CG-CG 3.84Å; Y225-F280 HydrophobicContact CD2-CD2 4.22Å; Y225-F280 HydrophobicContact CD2-CE2 4.1Å; A234-F280 HydrophobicContact CB-CD1 4.46Å; A234-F280 HydrophobicContact CB-CE1 3.76Å; A234-F280 HydrophobicContact CB-CE2 4.3Å; A234-F280 HydrophobicContact CB-CZ 3.67Å; Q276-F280 VanDerWaalsContact O-CB 3.29Å; Q276-F280 WeakPolarHBondContact O-CB 3.35Å; Q276-F280 PolarHBondContact O-N 2.82Å; Q276-F280 VanDerWaalsContact O-N 3.11Å; F280-A284 WeakPolarHBondContact O-CB 3.32Å; F280-A284 PolarHBondContact O-N 3.44Å
281	F	89.1	Confident	86	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	I	π-helix	trans	-72.9	-40.8	-169.2	-73.9	-86	0	0	0	113.8	V215 L219 L237 L238 I241 F268 Q276 I277 A284 L285	V215-F281 HydrophobicContact CB-CE2 4.16Å; V215-F281 HydrophobicContact CB-CZ 4.49Å; V215-F281 HydrophobicContact CG1-CD2 3.83Å; V215-F281 HydrophobicContact CG1-CE2 3.43Å; V215-F281 VanDerWaalsContact CG1-CE2 3.43Å; V215-F281 HydrophobicContact CG1-CZ 4.22Å; V215-F281 HydrophobicContact CG2-CD2 4.4Å; V215-F281 HydrophobicContact CG2-CE1 4.2Å; V215-F281 HydrophobicContact CG2-CE2 3.61Å; V215-F281 HydrophobicContact CG2-CZ 3.48Å; V215-F281 VanDerWaalsContact CG2-CZ 3.48Å; L219-F281 HydrophobicContact CD1-CE2 3.61Å; L219-F281 HydrophobicContact CD1-CZ 3.81Å; L237-F281 HydrophobicContact CB-CE1 4.34Å; L237-F281 HydrophobicContact CB-CZ 4.19Å; L238-F281 HydrophobicContact CB-CE1 4.22Å; L238-F281 HydrophobicContact CD1-CD1 4.09Å; L238-F281 HydrophobicContact CD1-CE1 4.47Å; I241-F281 HydrophobicContact CD1-CD1 3.68Å; I241-F281 HydrophobicContact CD1-CE1 3.5Å; I241-F281 VanDerWaalsContact CD1-CE1 3.5Å; I241-F281 HydrophobicContact CD1-CZ 4.44Å; F268-F281 HydrophobicContact CZ-CD1 4.38Å; F268-F281 HydrophobicContact CZ-CG 4.41Å; Q276-F281 PolarHBondContact O-N 2.72Å; I277-F281 PolarHBondContact O-N 3.17Å; I277-F281 VanDerWaalsContact O-N 3.13Å; F281-A284 PolarHBondContact O-N 3.45Å; F281-L285 WeakPolarHBondContact O-CB 3.18Å; F281-L285 WeakPolarHBondContact O-CG 3.35Å; F281-L285 PolarHBondContact O-N 3.33Å
282	I	89.9	Confident	86.2	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-65	-48.1	179	-58.5	-69	0	0	0	111.1	I269 F273 I277 A284 L285 S286 Y320 F321	I269-I282 HydrophobicContact CD1-CD1 4.06Å; F273-I282 HydrophobicContact CE1-CD1 4.01Å; F273-I282 HydrophobicContact CE2-CD1 4.42Å; F273-I282 HydrophobicContact CE2-CG1 4.41Å; F273-I282 HydrophobicContact CZ-CD1 3.79Å; F273-I282 HydrophobicContact CZ-CG1 4.24Å; I277-I282 HydrophobicContact CG2-CD1 4.23Å; I277-I282 HydrophobicContact CG2-CG1 4.01Å; I277-I282 WeakPolarHBondContact O-CG1 3.28Å; I277-I282 PolarHBondContact O-N 3.22Å; I282-A284 PolarHBondContact O-N 3.02Å; I282-L285 PolarHBondContact O-N 3.31Å; I282-S286 WeakPolarHBondContact O-CB 3.18Å; I282-S286 PolarHBondContact O-N 3.1Å; I282-S286 VanDerWaalsContact O-N 3.12Å; I282-S286 PolarHBondContact O-OG 3.47Å; I282-Y320 HydrophobicContact CG2-CD1 4.2Å; I282-Y320 HydrophobicContact CG2-CE1 3.79Å; I282-F321 HydrophobicContact CD1-CB 4.19Å; I282-F321 HydrophobicContact CD1-CD2 3.53Å; I282-F321 HydrophobicContact CD1-CE2 4.35Å; I282-F321 HydrophobicContact CD1-CG 4.25Å; I282-F321 HydrophobicContact CG2-CD2 4.32Å
283	P	88.4	Confident	86.4	Confident	49 Å²	49	37.8 Å²	37.8	32%	0.318	18%	0.18	S	C	.	.	H	α-helix	trans	-59.7	-42.9	173	-27	36.9	0	0	0	112.9	Y225 F278 S286 D287	Y225-P283 HydrophobicContact CD1-CB 4.04Å; Y225-P283 HydrophobicContact CG-CB 4.14Å; F278-P283 VanDerWaalsContact O-CD 3.23Å; F278-P283 WeakPolarHBondContact O-CD 3.4Å; P283-S286 CarbonylContact O-C 3.54Å; P283-S286 WeakPolarHBondContact O-CB 3.25Å; P283-S286 PolarHBondContact O-N 3.03Å; P283-S286 VanDerWaalsContact O-N 3.12Å; P283-D287 PolarHBondContact O-N 3.4Å; P283-D287 VanDerWaalsContact O-N 3.14Å
284	A	87.1	Confident	86.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.4	-46.7	178.9	0	0	0	0	0	112.5	Y225 L238 F280 F281 I282 S286 D287 L290	Y225-A284 HydrophobicContact CD2-CB 3.63Å; Y225-A284 HydrophobicContact CE2-CB 3.45Å; Y225-A284 VanDerWaalsContact CE2-CB 3.45Å; Y225-A284 HydrophobicContact CG-CB 4.47Å; L238-A284 HydrophobicContact CD1-CB 3.92Å; L238-A284 HydrophobicContact CD2-CB 3.72Å; L238-A284 HydrophobicContact CG-CB 4.49Å; F280-A284 WeakPolarHBondContact O-CB 3.32Å; F280-A284 PolarHBondContact O-N 3.44Å; F281-A284 PolarHBondContact O-N 3.45Å; I282-A284 PolarHBondContact O-N 3.02Å; A284-S286 PolarHBondContact O-N 3.25Å; A284-D287 WeakPolarHBondContact O-CB 3.34Å; A284-D287 PolarHBondContact O-N 3.38Å; A284-D287 VanDerWaalsContact O-N 3.09Å; A284-L290 HydrophobicContact CB-CD1 4.26Å; A284-L290 WeakPolarHBondContact O-CD1 3.42Å
285	L	88	Confident	86.5	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-21.2	176.7	-69.4	172.8	0	0	0	112.7	L238 L242 F264 I269 F281 I282 F292 F321	L238-L285 HydrophobicContact CD1-CD2 4.01Å; L238-L285 HydrophobicContact CD1-CG 4.3Å; L242-L285 HydrophobicContact CD2-CD2 3.5Å; L242-L285 HydrophobicContact CG-CD2 3.9Å; F264-L285 HydrophobicContact CZ-CD1 4.19Å; I269-L285 HydrophobicContact CD1-CD1 4.25Å; F281-L285 WeakPolarHBondContact O-CB 3.18Å; F281-L285 WeakPolarHBondContact O-CG 3.35Å; F281-L285 PolarHBondContact O-N 3.33Å; I282-L285 PolarHBondContact O-N 3.31Å; L285-F292 HydrophobicContact CD2-CD2 4.28Å; L285-F292 WeakPolarHBondContact O-CB 3.42Å; L285-F321 HydrophobicContact CB-CE2 3.86Å; L285-F321 HydrophobicContact CB-CZ 4.43Å; L285-F321 HydrophobicContact CD1-CE2 3.84Å; L285-F321 HydrophobicContact CD1-CZ 4.31Å
286	S	85.8	Confident	86.7	Confident	6 Å²	6	39.7 Å²	39.7	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-88.6	-8.2	176.8	-51.9	0	0	0	0	112.9	I282 P283 A284 S324 A325 N328	I282-S286 WeakPolarHBondContact O-CB 3.18Å; I282-S286 PolarHBondContact O-N 3.1Å; I282-S286 VanDerWaalsContact O-N 3.12Å; I282-S286 PolarHBondContact O-OG 3.47Å; P283-S286 CarbonylContact O-C 3.54Å; P283-S286 WeakPolarHBondContact O-CB 3.25Å; P283-S286 PolarHBondContact O-N 3.03Å; P283-S286 VanDerWaalsContact O-N 3.12Å; A284-S286 PolarHBondContact O-N 3.25Å; S286-S324 PolarHBondContact OG-O 3.28Å; S286-A325 PolarHBondContact OG-N 3.43Å; S286-N328 VanDerWaalsContact O-CB 3.29Å; S286-N328 WeakPolarHBondContact O-CB 3.44Å; S286-N328 PolarHBondContact O-ND2 3.31Å
287	D	85.9	Confident	86.9	Confident	32 Å²	32	39.1 Å²	39.1	17%	0.171	19%	0.189	C	C	.	.			trans	-73.8	128.6	177.3	-176.4	3.9	0	0	0	111.2	Y225 P283 A284 R289 L290	Y225-D287 HydrophobicContact CE1-CB 4.5Å; Y225-D287 PolarHBondContact OH-OD2 2.93Å; P283-D287 PolarHBondContact O-N 3.4Å; P283-D287 VanDerWaalsContact O-N 3.14Å; A284-D287 WeakPolarHBondContact O-CB 3.34Å; A284-D287 PolarHBondContact O-N 3.38Å; A284-D287 VanDerWaalsContact O-N 3.09Å; D287-R289 PolarHBondContact O-N 3.35Å; D287-R289 PolarHBondContact OD1-N 2.8Å; D287-L290 HydrophobicContact CB-CD1 4.37Å; D287-L290 PolarHBondContact O-N 3.01Å
288	R	78.6	Confident	87	Confident	164 Å²	164	39.1 Å²	39.1	62%	0.619	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-57.1	-31.6	176.1	-67.5	-173.8	173.7	176.2	1	112.8	L290 S291 N328	R288-L290 PolarHBondContact O-N 3.26Å; R288-S291 PolarHBondContact O-N 3.29Å; R288-N328 HydrophobicContact CG-CB 4.15Å; R288-N328 PolarHBondContact NE-O 3.13Å; R288-N328 PolarHBondContact NH2-O 3.45Å
289	R	80.4	Confident	87	Confident	183 Å²	183	40.4 Å²	40.4	69%	0.691	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-64.3	-27.9	-178	-60.6	176.9	-171.6	163.3	7.5	112.7	D227 D287	D227-R289 IonicContact OD1-CZ 3.58Å; D227-R289 IonicContact OD1-NH1 2.76Å; D227-R289 PolarHBondContact OD1-NH1 3.34Å; D227-R289 IonicContact OD1-NH2 3.56Å; D287-R289 PolarHBondContact O-N 3.35Å; D287-R289 PolarHBondContact OD1-N 2.8Å
290	L	80.9	Confident	87	Confident	52 Å²	52	37.1 Å²	37.1	27%	0.272	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-87.7	-5.9	-177.6	-71.1	164.2	0	0	0	113.1	L238 L242 A284 D287 R288 F292	L238-L290 HydrophobicContact CD2-CD1 3.73Å; L238-L290 HydrophobicContact CD2-CD2 4.45Å; L242-L290 HydrophobicContact CD1-CB 4.05Å; L242-L290 HydrophobicContact CD1-CD2 4.15Å; A284-L290 HydrophobicContact CB-CD1 4.26Å; A284-L290 WeakPolarHBondContact O-CD1 3.42Å; D287-L290 HydrophobicContact CB-CD1 4.37Å; D287-L290 PolarHBondContact O-N 3.01Å; R288-L290 PolarHBondContact O-N 3.26Å; L290-F292 PolarHBondContact O-N 2.9Å
291	S	82.1	Confident	87	Confident	79 Å²	79	36.6 Å²	36.6	55%	0.552	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	37	170.9	67.3	0	0	0	0	115.6	H246 R288	H246-S291 PolarHBondContact CE1-O 3.09Å; H246-S291 PolarHBondContact CE1-OG 3.13Å; R288-S291 PolarHBondContact O-N 3.29Å
292	F	89.1	Confident	86.6	Confident	15 Å²	15	38.5 Å²	38.5	7%	0.066	19%	0.193	C	C	.	.			trans	-51.6	129	177.5	179.9	-98	0	0	0	111.5	L242 L245 F264 L285 L290 F294 F297 F321	L242-F292 HydrophobicContact CD2-CB 4.45Å; L242-F292 HydrophobicContact CD2-CD2 3.77Å; L245-F292 HydrophobicContact CD1-CD2 4.23Å; L245-F292 HydrophobicContact CD1-CE2 3.57Å; L245-F292 HydrophobicContact CD1-CZ 4.46Å; F264-F292 HydrophobicContact CE1-CE2 4.04Å; F264-F292 HydrophobicContact CE1-CZ 4.07Å; F264-F292 HydrophobicContact CZ-CE2 4.24Å; L285-F292 HydrophobicContact CD2-CD2 4.28Å; L285-F292 WeakPolarHBondContact O-CB 3.42Å; L290-F292 PolarHBondContact O-N 2.9Å; F292-F294 HydrophobicContact CD1-CB 3.95Å; F292-F294 HydrophobicContact CD1-CD2 4.19Å; F292-F294 HydrophobicContact CE1-CB 4.31Å; F292-F294 AromaticContact CE1-CD2 3.98Å; F292-F294 HydrophobicContact CE1-CD2 3.98Å; F292-F294 PolarHBondContact O-N 3.36Å; F292-F297 HydrophobicContact CE1-CB 3.9Å; F292-F297 HydrophobicContact CE1-CD1 4.28Å; F292-F297 HydrophobicContact CE1-CG 4.07Å; F292-F297 HydrophobicContact CZ-CB 4.01Å; F292-F297 HydrophobicContact CZ-CD2 4.23Å; F292-F297 HydrophobicContact CZ-CG 4.01Å; F292-F321 HydrophobicContact CE1-CE1 4.35Å; F292-F321 HydrophobicContact CE1-CZ 4.11Å; F292-F321 HydrophobicContact CE2-CZ 4.2Å; F292-F321 HydrophobicContact CZ-CE1 4.06Å; F292-F321 AromaticContact CZ-CZ 3.8Å; F292-F321 HydrophobicContact CZ-CZ 3.8Å
293	P	89.9	Confident	85.8	Confident	24 Å²	24	42.4 Å²	42.4	16%	0.156	22%	0.217	C	C	.	.			trans	-76.4	68	-176.2	31.4	-36	0	0	0	111.9	L245 F261 E295 A296 F297	L245-P293 HydrophobicContact CB-CG 3.98Å; F261-P293 HydrophobicContact CE1-CG 4.21Å; F261-P293 HydrophobicContact CZ-CB 4.49Å; F261-P293 HydrophobicContact CZ-CG 3.9Å; P293-E295 PolarHBondContact O-N 2.72Å; P293-A296 HydrophobicContact CB-CB 4.35Å; P293-A296 PolarHBondContact O-N 2.86Å; P293-F297 PolarHBondContact O-N 3.24Å
294	F	89.9	Confident	85.1	Confident	6 Å²	6	40.6 Å²	40.6	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-60.8	-42.7	-170.3	-171.3	-119.9	0	0	0	113.7	F292 A296 F297 L298 A325 C329 L333 Y341	F292-F294 HydrophobicContact CD1-CB 3.95Å; F292-F294 HydrophobicContact CD1-CD2 4.19Å; F292-F294 HydrophobicContact CE1-CB 4.31Å; F292-F294 AromaticContact CE1-CD2 3.98Å; F292-F294 HydrophobicContact CE1-CD2 3.98Å; F292-F294 PolarHBondContact O-N 3.36Å; F294-A296 PolarHBondContact O-N 2.97Å; F294-F297 HydrophobicContact CD2-CD1 4.23Å; F294-F297 HydrophobicContact CE2-CD1 4.29Å; F294-F297 WeakPolarHBondContact O-CB 3.48Å; F294-F297 PolarHBondContact O-N 3.2Å; F294-L298 HydrophobicContact CD1-CD1 3.97Å; F294-L298 HydrophobicContact CD1-CG 4.45Å; F294-L298 HydrophobicContact CE1-CD1 3.6Å; F294-L298 HydrophobicContact CE1-CD2 4.5Å; F294-L298 HydrophobicContact CE1-CG 4.15Å; F294-L298 HydrophobicContact CE2-CD2 4.35Å; F294-L298 HydrophobicContact CE2-CG 4.37Å; F294-L298 HydrophobicContact CZ-CD1 3.99Å; F294-L298 HydrophobicContact CZ-CD2 4.04Å; F294-L298 HydrophobicContact CZ-CG 4.1Å; F294-L298 WeakPolarHBondContact O-CG 3.38Å; F294-L298 PolarHBondContact O-N 2.85Å; F294-A325 HydrophobicContact CD2-CB 3.84Å; F294-A325 HydrophobicContact CE2-CB 3.69Å; F294-C329 HydrophobicContact CB-CB 4.19Å; F294-C329 HydrophobicContact CD1-CB 3.74Å; F294-C329 HydrophobicContact CE1-CB 4.41Å; F294-C329 HydrophobicContact CG-CB 4.1Å; F294-L333 HydrophobicContact CD1-CD1 4.23Å; F294-L333 HydrophobicContact CD1-CD2 4.03Å; F294-L333 HydrophobicContact CD1-CG 4.49Å; F294-L333 HydrophobicContact CE1-CD1 4.12Å; F294-Y341 HydrophobicContact CE1-CD2 4.14Å; F294-Y341 AromaticContact CZ-CD2 3.99Å; F294-Y341 HydrophobicContact CZ-CD2 3.99Å; F294-Y341 HydrophobicContact CZ-CE2 4.16Å
295	E	89.4	Confident	84.4	Confident	71 Å²	71	41.8 Å²	41.8	33%	0.332	21%	0.211	S	C	.	.	H	α-helix	trans	-65.3	-41.2	179.2	-170.3	170.9	169	0	0	112.3	P293 F297 L298 S299 L333 S334	P293-E295 PolarHBondContact O-N 2.72Å; E295-F297 VanDerWaalsContact C-N 3.32Å; E295-F297 PolarHBondContact O-N 3.2Å; E295-L298 PolarHBondContact O-N 3.21Å; E295-S299 PolarHBondContact O-N 3.48Å; E295-L333 HydrophobicContact CB-CD2 3.95Å; E295-L333 HydrophobicContact CG-CD2 4.36Å; E295-S334 WeakPolarHBondContact OE1-CB 3.4Å; E295-S334 PolarHBondContact OE1-OG 3.44Å
296	A	88.3	Confident	83.2	Confident	23 Å²	23	48.2 Å²	48.2	19%	0.19	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-36.1	175.5	0	0	0	0	0	111.8	F261 P293 F294 S299 S300	F261-A296 HydrophobicContact CE2-CB 4.17Å; F261-A296 HydrophobicContact CZ-CB 4.09Å; P293-A296 HydrophobicContact CB-CB 4.35Å; P293-A296 PolarHBondContact O-N 2.86Å; F294-A296 PolarHBondContact O-N 2.97Å; A296-S299 PolarHBondContact O-OG 2.76Å; A296-S300 PolarHBondContact O-N 2.97Å; A296-S300 PolarHBondContact O-OG 2.96Å; A296-S300 VanDerWaalsContact O-OG 3.09Å
297	F	91.4	Very high	82.2	Confident	1 Å²	1	52.2 Å²	52.2	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-51.1	171.6	168.1	-101.6	0	0	0	111.4	F261 F264 T265 F292 P293 F294 E295 S299 S300 L301 L318 F321 V322	F261-F297 HydrophobicContact CD1-CB 3.93Å; F261-F297 AromaticContact CD1-CD2 3.92Å; F261-F297 HydrophobicContact CD1-CD2 3.92Å; F261-F297 HydrophobicContact CD1-CG 4.44Å; F261-F297 HydrophobicContact CE1-CB 3.82Å; F264-F297 HydrophobicContact CD1-CD2 4.4Å; F264-F297 HydrophobicContact CD1-CE2 4.28Å; F264-F297 HydrophobicContact CE1-CE2 4.33Å; T265-F297 WeakPolarHBondContact OG1-CE2 3.42Å; F292-F297 HydrophobicContact CE1-CB 3.9Å; F292-F297 HydrophobicContact CE1-CD1 4.28Å; F292-F297 HydrophobicContact CE1-CG 4.07Å; F292-F297 HydrophobicContact CZ-CB 4.01Å; F292-F297 HydrophobicContact CZ-CD2 4.23Å; F292-F297 HydrophobicContact CZ-CG 4.01Å; P293-F297 PolarHBondContact O-N 3.24Å; F294-F297 HydrophobicContact CD2-CD1 4.23Å; F294-F297 HydrophobicContact CE2-CD1 4.29Å; F294-F297 WeakPolarHBondContact O-CB 3.48Å; F294-F297 PolarHBondContact O-N 3.2Å; E295-F297 VanDerWaalsContact C-N 3.32Å; E295-F297 PolarHBondContact O-N 3.2Å; F297-S299 VanDerWaalsContact C-N 3.3Å; F297-S299 PolarHBondContact O-N 2.72Å; F297-S300 PolarHBondContact O-N 2.7Å; F297-S300 VanDerWaalsContact O-N 3.09Å; F297-L301 HydrophobicContact CE1-CD2 4.26Å; F297-L301 HydrophobicContact CZ-CD1 4.31Å; F297-L301 HydrophobicContact CZ-CD2 4.45Å; F297-L301 WeakPolarHBondContact O-CB 3.16Å; F297-L301 PolarHBondContact O-N 2.87Å; F297-L318 HydrophobicContact CZ-CD1 4.22Å; F297-F321 HydrophobicContact CE1-CD1 4.19Å; F297-F321 AromaticContact CE1-CE1 3.94Å; F297-F321 HydrophobicContact CE1-CE1 3.94Å; F297-F321 HydrophobicContact CE2-CE1 4.29Å; F297-F321 AromaticContact CZ-CD1 3.97Å; F297-F321 HydrophobicContact CZ-CD1 3.97Å; F297-F321 AromaticContact CZ-CE1 3.81Å; F297-F321 HydrophobicContact CZ-CE1 3.81Å; F297-V322 HydrophobicContact CE1-CG2 4.08Å
298	L	89.5	Confident	80.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.2	-40.6	178.3	-70.8	175.9	0	0	0	112.4	F294 E295 S300 L301 Q302 V322 L340 Y341 A344	F294-L298 HydrophobicContact CD1-CD1 3.97Å; F294-L298 HydrophobicContact CD1-CG 4.45Å; F294-L298 HydrophobicContact CE1-CD1 3.6Å; F294-L298 HydrophobicContact CE1-CD2 4.5Å; F294-L298 HydrophobicContact CE1-CG 4.15Å; F294-L298 HydrophobicContact CE2-CD2 4.35Å; F294-L298 HydrophobicContact CE2-CG 4.37Å; F294-L298 HydrophobicContact CZ-CD1 3.99Å; F294-L298 HydrophobicContact CZ-CD2 4.04Å; F294-L298 HydrophobicContact CZ-CG 4.1Å; F294-L298 WeakPolarHBondContact O-CG 3.38Å; F294-L298 PolarHBondContact O-N 2.85Å; E295-L298 PolarHBondContact O-N 3.21Å; L298-S300 VanDerWaalsContact C-N 3.31Å; L298-S300 PolarHBondContact O-N 2.87Å; L298-L301 HydrophobicContact CD2-CD2 4.41Å; L298-L301 WeakPolarHBondContact O-CB 3.32Å; L298-L301 PolarHBondContact O-N 3.35Å; L298-Q302 PolarHBondContact O-N 3.15Å; L298-V322 HydrophobicContact CD2-CG1 4.48Å; L298-L340 HydrophobicContact CB-CB 3.99Å; L298-L340 HydrophobicContact CD1-CB 4.45Å; L298-Y341 HydrophobicContact CD1-CD2 4.39Å; L298-Y341 HydrophobicContact CD2-CD2 4.44Å; L298-A344 HydrophobicContact CD2-CB 4.18Å
299	S	88.2	Confident	79.4	Confident	54 Å²	54	51.2 Å²	51.2	38%	0.378	29%	0.288	S	S	.	.	H	α-helix	trans	-62.7	-36.4	176.9	74.5	0	0	0	0	113	E295 A296 F297	E295-S299 PolarHBondContact O-N 3.48Å; A296-S299 PolarHBondContact O-OG 2.76Å; F297-S299 VanDerWaalsContact C-N 3.3Å; F297-S299 PolarHBondContact O-N 2.72Å
300	S	87.2	Confident	77.8	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.028	29%	0.294	C	S	.	.	H	α-helix	trans	-79.6	-27.6	178.4	-57	0	0	0	0	112.1	A296 F297 L298 Q302 T304	A296-S300 PolarHBondContact O-N 2.97Å; A296-S300 PolarHBondContact O-OG 2.96Å; A296-S300 VanDerWaalsContact O-OG 3.09Å; F297-S300 PolarHBondContact O-N 2.7Å; F297-S300 VanDerWaalsContact O-N 3.09Å; L298-S300 VanDerWaalsContact C-N 3.31Å; L298-S300 PolarHBondContact O-N 2.87Å; S300-Q302 VanDerWaalsContact C-N 3.33Å; S300-Q302 PolarHBondContact O-N 3.42Å; S300-T304 PolarHBondContact O-N 3.32Å; S300-T304 PolarHBondContact O-OG1 2.9Å
301	L	87.2	Confident	76.5	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-63.2	-37.5	180	-173.3	65.1	0	0	0	112.1	T265 F297 L298 V303 T304 I305 L318 V322 A344 L348	T265-L301 HydrophobicContact CG2-CD1 3.96Å; F297-L301 HydrophobicContact CE1-CD2 4.26Å; F297-L301 HydrophobicContact CZ-CD1 4.31Å; F297-L301 HydrophobicContact CZ-CD2 4.45Å; F297-L301 WeakPolarHBondContact O-CB 3.16Å; F297-L301 PolarHBondContact O-N 2.87Å; L298-L301 HydrophobicContact CD2-CD2 4.41Å; L298-L301 WeakPolarHBondContact O-CB 3.32Å; L298-L301 PolarHBondContact O-N 3.35Å; L301-V303 PolarHBondContact O-N 2.97Å; L301-T304 CarbonylContact O-C 3.57Å; L301-T304 WeakPolarHBondContact O-CA 3.44Å; L301-T304 WeakPolarHBondContact O-CB 3.46Å; L301-T304 PolarHBondContact O-N 3.45Å; L301-I305 HydrophobicContact CD1-CD1 4.39Å; L301-I305 HydrophobicContact CD1-CG1 4.29Å; L301-I305 HydrophobicContact CD2-CD1 4.12Å; L301-I305 HydrophobicContact CG-CD1 3.72Å; L301-I305 HydrophobicContact CG-CG1 4.09Å; L301-I305 WeakPolarHBondContact O-CG1 3.48Å; L301-I305 PolarHBondContact O-N 3.09Å; L301-L318 HydrophobicContact CD1-CD1 4.08Å; L301-L318 HydrophobicContact CD1-CD2 4.01Å; L301-L318 HydrophobicContact CD1-CG 4.48Å; L301-V322 HydrophobicContact CD2-CG2 3.97Å; L301-A344 HydrophobicContact CD2-CB 3.96Å; L301-L348 HydrophobicContact CD2-CD1 4.49Å
302	Q	81.1	Confident	75.6	Confident	40 Å²	40	49.2 Å²	49.2	19%	0.187	30%	0.296	C	S	.	.	H	α-helix	trans	-56.4	-47.7	-178.9	-63.5	-60.2	-36.3	0	0	112.5	L298 S300 T304 I305 D306 L340	L298-Q302 PolarHBondContact O-N 3.15Å; S300-Q302 VanDerWaalsContact C-N 3.33Å; S300-Q302 PolarHBondContact O-N 3.42Å; Q302-T304 PolarHBondContact O-N 3.49Å; Q302-I305 PolarHBondContact O-N 3.32Å; Q302-D306 PolarHBondContact O-N 2.97Å; Q302-L340 HydrophobicContact CG-CD2 3.84Å; Q302-L340 PolarHBondContact NE2-O 2.9Å
303	V	74.6	Confident	74.5	Confident	85 Å²	85	52.9 Å²	52.9	52%	0.515	32%	0.323	S	S	.	.	H	α-helix	trans	-65.7	-31.1	177.6	-176.2	0	0	0	0	111.8	L301 S307	L301-V303 PolarHBondContact O-N 2.97Å; V303-S307 PolarHBondContact O-OG 2.89Å; V303-S307 VanDerWaalsContact O-OG 3.13Å
304	T	73.3	Confident	74	Confident	10 Å²	10	54.6 Å²	54.6	6%	0.061	33%	0.33	C	S	.	.	H	α-helix	trans	-74.5	-43.3	-178.6	-52.2	0	0	0	0	110.2	A262 S300 L301 Q302 D306 S307 F308	A262-T304 HydrophobicContact CB-CG2 4.46Å; S300-T304 PolarHBondContact O-N 3.32Å; S300-T304 PolarHBondContact O-OG1 2.9Å; L301-T304 CarbonylContact O-C 3.57Å; L301-T304 WeakPolarHBondContact O-CA 3.44Å; L301-T304 WeakPolarHBondContact O-CB 3.46Å; L301-T304 PolarHBondContact O-N 3.45Å; Q302-T304 PolarHBondContact O-N 3.49Å; T304-D306 VanDerWaalsContact C-N 3.32Å; T304-D306 PolarHBondContact O-N 2.9Å; T304-S307 PolarHBondContact O-N 3.28Å; T304-S307 VanDerWaalsContact O-N 3.14Å; T304-S307 PolarHBondContact O-OG 3.47Å; T304-F308 HydrophobicContact CG2-CD2 3.57Å; T304-F308 HydrophobicContact CG2-CE2 3.46Å; T304-F308 VanDerWaalsContact CG2-CE2 3.46Å; T304-F308 VanDerWaalsContact O-CD2 3.24Å; T304-F308 WeakPolarHBondContact O-CD2 3.44Å; T304-F308 PolarHBondContact O-N 2.91Å
305	I	71.6	Confident	73.6	Confident	26 Å²	26	54.6 Å²	54.6	13%	0.133	33%	0.331	C	S	.	.	H	α-helix	trans	-58	-42.8	177.5	-70.7	169.7	0	0	0	111.6	L301 Q302 S307 F308 A347 L348	L301-I305 HydrophobicContact CD1-CD1 4.39Å; L301-I305 HydrophobicContact CD1-CG1 4.29Å; L301-I305 HydrophobicContact CD2-CD1 4.12Å; L301-I305 HydrophobicContact CG-CD1 3.72Å; L301-I305 HydrophobicContact CG-CG1 4.09Å; L301-I305 WeakPolarHBondContact O-CG1 3.48Å; L301-I305 PolarHBondContact O-N 3.09Å; Q302-I305 PolarHBondContact O-N 3.32Å; I305-S307 VanDerWaalsContact C-N 3.25Å; I305-S307 PolarHBondContact O-N 2.83Å; I305-F308 PolarHBondContact O-N 3.37Å; I305-A347 HydrophobicContact CD1-CB 4.17Å; I305-A347 HydrophobicContact CG2-CB 3.78Å; I305-L348 HydrophobicContact CD1-CD2 4.35Å; I305-L348 HydrophobicContact CD1-CG 4.24Å; I305-L348 HydrophobicContact CG1-CD2 4.41Å
306	D	63.9	Low	73.5	Confident	135 Å²	135	51.3 Å²	51.3	72%	0.722	32%	0.315	S	S	*	.	H	α-helix	trans	-63.5	-29.9	179.4	-71.4	-23.2	0	0	0	113.3	Q302 T304	Q302-D306 PolarHBondContact O-N 2.97Å; T304-D306 VanDerWaalsContact C-N 3.32Å; T304-D306 PolarHBondContact O-N 2.9Å
307	S	63	Low	73.6	Confident	90 Å²	90	50.6 Å²	50.6	63%	0.629	31%	0.308	S	S	*	.	H	α-helix	trans	-84.3	-14.4	176.9	42.5	0	0	0	0	113.2	V303 T304 I305 S309	V303-S307 PolarHBondContact O-OG 2.89Å; V303-S307 VanDerWaalsContact O-OG 3.13Å; T304-S307 PolarHBondContact O-N 3.28Å; T304-S307 VanDerWaalsContact O-N 3.14Å; T304-S307 PolarHBondContact O-OG 3.47Å; I305-S307 VanDerWaalsContact C-N 3.25Å; I305-S307 PolarHBondContact O-N 2.83Å; S307-S309 PolarHBondContact O-N 2.93Å
308	F	58.8	Low	73.5	Confident	52 Å²	52	51 Å²	51	23%	0.228	31%	0.31	C	S	.	.			trans	-89.3	18.4	-175.2	-100	-66.2	0	0	0	115.7	E266 T304 I305 A310 A311 Q314	E266-F308 HydrophobicContact CB-CZ 4.07Å; E266-F308 HydrophobicContact CG-CZ 3.95Å; T304-F308 HydrophobicContact CG2-CD2 3.57Å; T304-F308 HydrophobicContact CG2-CE2 3.46Å; T304-F308 VanDerWaalsContact CG2-CE2 3.46Å; T304-F308 VanDerWaalsContact O-CD2 3.24Å; T304-F308 WeakPolarHBondContact O-CD2 3.44Å; T304-F308 PolarHBondContact O-N 2.91Å; I305-F308 PolarHBondContact O-N 3.37Å; F308-A310 PolarHBondContact O-N 3.02Å; F308-A311 HydrophobicContact CD1-CB 3.34Å; F308-A311 HydrophobicContact CE1-CB 3.78Å; F308-A311 HydrophobicContact CG-CB 4.44Å; F308-A311 PolarHBondContact O-N 3.21Å; F308-Q314 VanDerWaalsContact CE1-OE1 3.27Å
309	S	47.4	Very low	73.6	Confident	124 Å²	124	51 Å²	51	87%	0.867	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-2.5	178	61.1	0	0	0	0	116.5	S307	S307-S309 PolarHBondContact O-N 2.93Å
310	A	47.2	Very low	73.8	Confident	99 Å²	99	49.3 Å²	49.3	82%	0.818	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-1.2	176.6	0	0	0	0	0	116.2	F308	F308-A310 PolarHBondContact O-N 3.02Å
311	A	53.8	Low	74	Confident	17 Å²	17	49.1 Å²	49.1	14%	0.14	29%	0.294	C	S	.	.			trans	-116.9	54.8	-166.5	0	0	0	0	0	116.7	F308 S313 Q314	F308-A311 HydrophobicContact CD1-CB 3.34Å; F308-A311 HydrophobicContact CE1-CB 3.78Å; F308-A311 HydrophobicContact CG-CB 4.44Å; F308-A311 PolarHBondContact O-N 3.21Å; A311-S313 PolarHBondContact O-N 3.28Å; A311-S313 VanDerWaalsContact O-N 3.11Å; A311-Q314 HydrophobicContact CB-CB 4.21Å; A311-Q314 HydrophobicContact CB-CG 4.44Å; A311-Q314 PolarHBondContact O-N 3.33Å; A311-Q314 VanDerWaalsContact O-N 3.15Å
312	Q	62.3	Low	74.2	Confident	156 Å²	156	49 Å²	49	73%	0.729	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-28.6	170.5	-73.4	177.3	-16.3	0	0	113.4	Q314	Q312-Q314 PolarHBondContact O-N 3.01Å
313	S	66.8	Low	74.6	Confident	91 Å²	91	47.1 Å²	47.1	64%	0.636	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-16.4	-178.2	57.4	0	0	0	0	114.9	A311	A311-S313 PolarHBondContact O-N 3.28Å; A311-S313 VanDerWaalsContact O-N 3.11Å
314	Q	78.5	Confident	75.4	Confident	61 Å²	61	43.4 Å²	43.4	29%	0.285	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-20.2	-174.7	-68.1	-176.7	-8.1	0	0	113.5	F308 A311 Q312 P316 W317	F308-Q314 VanDerWaalsContact CE1-OE1 3.27Å; A311-Q314 HydrophobicContact CB-CB 4.21Å; A311-Q314 HydrophobicContact CB-CG 4.44Å; A311-Q314 PolarHBondContact O-N 3.33Å; A311-Q314 VanDerWaalsContact O-N 3.15Å; Q312-Q314 PolarHBondContact O-N 3.01Å; Q314-P316 VanDerWaalsContact C-CD 3.44Å; Q314-W317 PolarHBondContact O-N 3.28Å
315	A	82.4	Confident	76	Confident	6 Å²	6	42.9 Å²	42.9	5%	0.05	26%	0.259	C	S	.	.	H	α-helix	trans	-57.2	-38.1	-177	0	0	0	0	0	115.3	W317 L318 F319 L351	A315-W317 PolarHBondContact O-N 3.43Å; A315-L318 PolarHBondContact O-N 3.14Å; A315-F319 WeakPolarHBondContact O-CB 3.48Å; A315-F319 PolarHBondContact O-N 3.41Å; A315-L351 HydrophobicContact CB-CB 3.47Å; A315-L351 VanDerWaalsContact CB-CB 3.47Å; A315-L351 HydrophobicContact CB-CD1 3.95Å; A315-L351 HydrophobicContact CB-CG 4.37Å
316	P	87.6	Confident	76.6	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.013	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-40.4	-178.2	-26.1	36.6	0	0	0	114	Q314 F319 Y320 L352 P353 V388 I391	Q314-P316 VanDerWaalsContact C-CD 3.44Å; P316-F319 PolarHBondContact O-N 2.97Å; P316-Y320 PolarHBondContact O-N 3.05Å; P316-L352 HydrophobicContact CB-CD2 3.9Å; P316-L352 HydrophobicContact CG-CD2 4.02Å; P316-P353 HydrophobicContact CG-CG 4.4Å; P316-V388 HydrophobicContact CB-CG1 4.29Å; P316-V388 HydrophobicContact CG-CG1 3.98Å; P316-I391 HydrophobicContact CB-CG2 4.08Å; P316-I391 WeakPolarHBondContact O-CG2 3.33Å
317	W	90.1	Very high	77.5	Confident	7 Å²	7	37.4 Å²	37.4	3%	0.027	23%	0.229	C	C	.	.	H	α-helix	trans	-65.8	-48	179.9	-47.1	107.4	0	0	0	111.1	I269 P272 F273 Q314 A315 F319 Y320 F321 I386 V388 I391	I269-W317 WeakPolarHBondContact O-CB 3.42Å; P272-W317 HydrophobicContact CB-CH2 4.36Å; P272-W317 HydrophobicContact CB-CZ2 3.85Å; F273-W317 HydrophobicContact CB-CE3 3.75Å; F273-W317 HydrophobicContact CB-CZ3 3.61Å; F273-W317 HydrophobicContact CD1-CB 4.4Å; F273-W317 AromaticContact CD1-CE3 3.99Å; F273-W317 HydrophobicContact CD1-CE3 3.99Å; F273-W317 AromaticContact CD2-CE3 3.43Å; F273-W317 HydrophobicContact CD2-CE3 3.43Å; F273-W317 VanDerWaalsContact CD2-CE3 3.43Å; F273-W317 AromaticContact CD2-CZ3 3.9Å; F273-W317 HydrophobicContact CD2-CZ3 3.9Å; F273-W317 HydrophobicContact CE1-CB 3.94Å; F273-W317 HydrophobicContact CE1-CE3 4.48Å; F273-W317 HydrophobicContact CE2-CB 4.34Å; F273-W317 AromaticContact CE2-CE3 3.93Å; F273-W317 HydrophobicContact CE2-CE3 3.93Å; F273-W317 HydrophobicContact CG-CD2 4.46Å; F273-W317 AromaticContact CG-CE3 3.44Å; F273-W317 HydrophobicContact CG-CE3 3.44Å; F273-W317 VanDerWaalsContact CG-CE3 3.44Å; F273-W317 AromaticContact CG-CZ3 3.85Å; F273-W317 HydrophobicContact CG-CZ3 3.85Å; F273-W317 HydrophobicContact CZ-CB 3.9Å; F273-W317 HydrophobicContact CZ-CE3 4.46Å; F273-W317 WeakPolarHBondContact CZ-O 3.43Å; F273-W317 VanDerWaalsContact N-CE3 3.29Å; Q314-W317 PolarHBondContact O-N 3.28Å; A315-W317 PolarHBondContact O-N 3.43Å; W317-F319 VanDerWaalsContact C-N 3.33Å; W317-F319 PolarHBondContact O-N 3.24Å; W317-Y320 PolarHBondContact O-N 2.98Å; W317-F321 PolarHBondContact O-N 2.91Å; W317-F321 VanDerWaalsContact O-N 3.13Å; W317-I386 HydrophobicContact CH2-CB 4.43Å; W317-I386 WeakPolarHBondContact CH2-O 3.44Å; W317-I386 HydrophobicContact CZ3-CB 4.27Å; W317-I386 HydrophobicContact CZ3-CG2 4.34Å; W317-V388 HydrophobicContact CH2-CG2 4.41Å; W317-V388 HydrophobicContact CZ2-CG2 3.62Å; W317-I391 HydrophobicContact CE3-CD1 4.37Å; W317-I391 HydrophobicContact CE3-CG1 3.82Å; W317-I391 HydrophobicContact CE3-CG2 4.39Å; W317-I391 HydrophobicContact CH2-CG1 4.14Å; W317-I391 HydrophobicContact CZ3-CB 4.41Å; W317-I391 HydrophobicContact CZ3-CD1 4.12Å; W317-I391 HydrophobicContact CZ3-CG1 3.42Å; W317-I391 VanDerWaalsContact CZ3-CG1 3.42Å
318	L	90.3	Very high	78.3	Confident	9 Å²	9	35.9 Å²	35.9	5%	0.047	21%	0.214	C	C	.	.	H	α-helix	trans	-60.8	-43.9	176.7	177.4	56.8	0	0	0	111.8	T265 I269 F297 L301 A315 F321 V322 L348	T265-L318 HydrophobicContact CG2-CD1 3.6Å; T265-L318 HydrophobicContact CG2-CD2 4.03Å; T265-L318 HydrophobicContact CG2-CG 4.45Å; I269-L318 HydrophobicContact CG2-CD1 3.87Å; F297-L318 HydrophobicContact CZ-CD1 4.22Å; L301-L318 HydrophobicContact CD1-CD1 4.08Å; L301-L318 HydrophobicContact CD1-CD2 4.01Å; L301-L318 HydrophobicContact CD1-CG 4.48Å; A315-L318 PolarHBondContact O-N 3.14Å; L318-F321 PolarHBondContact O-N 3.24Å; L318-V322 HydrophobicContact CD1-CG2 4.36Å; L318-V322 WeakPolarHBondContact O-CG2 3.36Å; L318-V322 PolarHBondContact O-N 3.46Å; L318-L348 HydrophobicContact CD2-CD1 4.34Å; L318-L348 HydrophobicContact CD2-CD2 3.85Å; L318-L348 HydrophobicContact CG-CD1 4.04Å; L318-L348 HydrophobicContact CG-CD2 4.3Å
319	F	90.9	Very high	79.3	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.8	-43.9	179.2	-168.9	-123.5	0	0	0	112.1	A315 P316 W317 F321 V322 L323 L345 L348 L349 L352 C395 L399	A315-F319 WeakPolarHBondContact O-CB 3.48Å; A315-F319 PolarHBondContact O-N 3.41Å; P316-F319 PolarHBondContact O-N 2.97Å; W317-F319 VanDerWaalsContact C-N 3.33Å; W317-F319 PolarHBondContact O-N 3.24Å; F319-F321 VanDerWaalsContact C-N 3.31Å; F319-F321 PolarHBondContact O-N 2.77Å; F319-V322 PolarHBondContact O-N 3.14Å; F319-L323 HydrophobicContact CD1-CD1 3.89Å; F319-L323 HydrophobicContact CE1-CD1 3.61Å; F319-L323 HydrophobicContact CE1-CG 4.34Å; F319-L323 HydrophobicContact CE2-CG 4.45Å; F319-L323 HydrophobicContact CG-CD1 4.48Å; F319-L323 HydrophobicContact CZ-CD1 3.99Å; F319-L323 HydrophobicContact CZ-CD2 4.31Å; F319-L323 HydrophobicContact CZ-CG 4.3Å; F319-L323 WeakPolarHBondContact O-CG 3.38Å; F319-L323 PolarHBondContact O-N 3.15Å; F319-L345 HydrophobicContact CE2-CD2 3.51Å; F319-L345 HydrophobicContact CZ-CD2 3.98Å; F319-L348 HydrophobicContact CB-CB 4.22Å; F319-L348 HydrophobicContact CB-CD1 4.48Å; F319-L348 HydrophobicContact CD2-CB 3.42Å; F319-L348 VanDerWaalsContact CD2-CB 3.42Å; F319-L348 HydrophobicContact CD2-CD1 4.01Å; F319-L348 HydrophobicContact CD2-CG 4.37Å; F319-L348 HydrophobicContact CE2-CB 4.06Å; F319-L348 HydrophobicContact CG-CB 4.11Å; F319-L349 HydrophobicContact CE1-CD1 3.91Å; F319-L349 HydrophobicContact CE2-CB 4.41Å; F319-L349 HydrophobicContact CZ-CB 4.04Å; F319-L349 HydrophobicContact CZ-CD1 3.95Å; F319-L352 HydrophobicContact CB-CD2 4.24Å; F319-L352 HydrophobicContact CD1-CD1 3.65Å; F319-L352 HydrophobicContact CD1-CD2 3.98Å; F319-L352 HydrophobicContact CD1-CG 4.13Å; F319-L352 HydrophobicContact CE1-CD1 3.76Å; F319-L352 HydrophobicContact CG-CD2 4.43Å; F319-C395 HydrophobicContact CD1-CB 3.69Å; F319-C395 HydrophobicContact CE1-CB 3.95Å; F319-L399 HydrophobicContact CE1-CD1 3.9Å; F319-L399 HydrophobicContact CZ-CD1 3.87Å; F319-L399 HydrophobicContact CZ-CD2 4.43Å; F319-L399 HydrophobicContact CZ-CG 4.39Å
320	Y	91.8	Very high	80.8	Confident	19 Å²	19	28.6 Å²	28.6	8%	0.075	17%	0.168	C	C	.	.	H	α-helix	trans	-58.7	-42.2	175.5	-178.5	-95.4	0	0	0	112.6	F273 F278 I282 P316 W317 L323 S324 I391 E394 K398	F273-Y320 HydrophobicContact CD2-CD1 4.36Å; F273-Y320 AromaticContact CE2-CD1 3.51Å; F273-Y320 HydrophobicContact CE2-CD1 3.51Å; F273-Y320 HydrophobicContact CE2-CE1 4.29Å; F273-Y320 HydrophobicContact CE2-CG 4.13Å; F273-Y320 HydrophobicContact CZ-CD1 4.29Å; F278-Y320 AromaticContact CD2-CE1 3.8Å; F278-Y320 HydrophobicContact CD2-CE1 3.8Å; F278-Y320 HydrophobicContact CE2-CD1 4.45Å; F278-Y320 AromaticContact CE2-CE1 3.61Å; F278-Y320 HydrophobicContact CE2-CE1 3.61Å; F278-Y320 HydrophobicContact CE2-CE2 4.01Å; F278-Y320 AromaticContact CE2-CZ 3.37Å; F278-Y320 VanDerWaalsContact CE2-OH 3.28Å; F278-Y320 WeakPolarHBondContact CE2-OH 3.44Å; I282-Y320 HydrophobicContact CG2-CD1 4.2Å; I282-Y320 HydrophobicContact CG2-CE1 3.79Å; P316-Y320 PolarHBondContact O-N 3.05Å; W317-Y320 PolarHBondContact O-N 2.98Å; Y320-L323 PolarHBondContact O-N 3.39Å; Y320-S324 WeakPolarHBondContact CE1-OG 3.48Å; Y320-S324 WeakPolarHBondContact O-CB 3.44Å; Y320-S324 PolarHBondContact O-N 3.5Å; Y320-S324 PolarHBondContact O-OG 2.68Å; Y320-I391 HydrophobicContact CD2-CD1 4.5Å; Y320-I391 HydrophobicContact CG-CD1 4.41Å; Y320-I391 HydrophobicContact CG-CG2 4.43Å; Y320-E394 HydrophobicContact CD2-CB 4.14Å; Y320-E394 HydrophobicContact CE2-CB 3.85Å; Y320-K398 HydrophobicContact CD2-CD 4.22Å; Y320-K398 HydrophobicContact CE2-CD 3.7Å
321	F	91.6	Very high	82	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.7	-45.2	176.7	175.8	-108.2	0	0	0	112.1	F264 I269 I282 L285 F292 F297 W317 L318 F319 L323 S324 A325	F264-F321 HydrophobicContact CE1-CE1 4.29Å; F264-F321 HydrophobicContact CE1-CZ 4.36Å; F264-F321 HydrophobicContact CZ-CZ 4.44Å; I269-F321 HydrophobicContact CD1-CD1 4.13Å; I269-F321 HydrophobicContact CD1-CD2 3.8Å; I269-F321 HydrophobicContact CD1-CE1 4.27Å; I269-F321 HydrophobicContact CD1-CE2 3.94Å; I269-F321 HydrophobicContact CD1-CG 3.88Å; I269-F321 HydrophobicContact CD1-CZ 4.17Å; I269-F321 HydrophobicContact CG1-CD1 4.16Å; I269-F321 HydrophobicContact CG1-CE1 4.27Å; I269-F321 HydrophobicContact CG1-CG 4.35Å; I269-F321 HydrophobicContact CG2-CB 3.54Å; I269-F321 HydrophobicContact CG2-CD1 3.63Å; I269-F321 HydrophobicContact CG2-CG 3.66Å; I282-F321 HydrophobicContact CD1-CB 4.19Å; I282-F321 HydrophobicContact CD1-CD2 3.53Å; I282-F321 HydrophobicContact CD1-CE2 4.35Å; I282-F321 HydrophobicContact CD1-CG 4.25Å; I282-F321 HydrophobicContact CG2-CD2 4.32Å; L285-F321 HydrophobicContact CB-CE2 3.86Å; L285-F321 HydrophobicContact CB-CZ 4.43Å; L285-F321 HydrophobicContact CD1-CE2 3.84Å; L285-F321 HydrophobicContact CD1-CZ 4.31Å; F292-F321 HydrophobicContact CE1-CE1 4.35Å; F292-F321 HydrophobicContact CE1-CZ 4.11Å; F292-F321 HydrophobicContact CE2-CZ 4.2Å; F292-F321 HydrophobicContact CZ-CE1 4.06Å; F292-F321 AromaticContact CZ-CZ 3.8Å; F292-F321 HydrophobicContact CZ-CZ 3.8Å; F297-F321 HydrophobicContact CE1-CD1 4.19Å; F297-F321 AromaticContact CE1-CE1 3.94Å; F297-F321 HydrophobicContact CE1-CE1 3.94Å; F297-F321 HydrophobicContact CE2-CE1 4.29Å; F297-F321 AromaticContact CZ-CD1 3.97Å; F297-F321 HydrophobicContact CZ-CD1 3.97Å; F297-F321 AromaticContact CZ-CE1 3.81Å; F297-F321 HydrophobicContact CZ-CE1 3.81Å; W317-F321 PolarHBondContact O-N 2.91Å; W317-F321 VanDerWaalsContact O-N 3.13Å; L318-F321 PolarHBondContact O-N 3.24Å; F319-F321 VanDerWaalsContact C-N 3.31Å; F319-F321 PolarHBondContact O-N 2.77Å; F321-L323 VanDerWaalsContact C-N 3.29Å; F321-L323 PolarHBondContact O-N 3.13Å; F321-S324 PolarHBondContact O-N 2.96Å; F321-A325 HydrophobicContact CE2-CB 4.26Å; F321-A325 HydrophobicContact CZ-CB 4.23Å; F321-A325 WeakPolarHBondContact O-CB 3.46Å; F321-A325 PolarHBondContact O-N 2.84Å
322	V	91.4	Very high	83.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.4	-43.3	177.3	171.3	0	0	0	0	111	F297 L298 L301 L318 F319 G326 Y341 A344 L348	F297-V322 HydrophobicContact CE1-CG2 4.08Å; L298-V322 HydrophobicContact CD2-CG1 4.48Å; L301-V322 HydrophobicContact CD2-CG2 3.97Å; L318-V322 HydrophobicContact CD1-CG2 4.36Å; L318-V322 WeakPolarHBondContact O-CG2 3.36Å; L318-V322 PolarHBondContact O-N 3.46Å; F319-V322 PolarHBondContact O-N 3.14Å; V322-G326 WeakPolarHBondContact O-CA 3.43Å; V322-G326 PolarHBondContact O-N 3.27Å; V322-Y341 HydrophobicContact CG1-CD2 4.13Å; V322-Y341 HydrophobicContact CG1-CE2 3.78Å; V322-A344 HydrophobicContact CG1-CB 4.42Å; V322-L348 HydrophobicContact CG2-CD1 4.11Å
323	L	90.4	Very high	84.1	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.7	-43.3	176.8	-67.8	174.8	0	0	0	112.5	F319 Y320 F321 G326 E327 L345 C395 K398 L399 Q404	F319-L323 HydrophobicContact CD1-CD1 3.89Å; F319-L323 HydrophobicContact CE1-CD1 3.61Å; F319-L323 HydrophobicContact CE1-CG 4.34Å; F319-L323 HydrophobicContact CE2-CG 4.45Å; F319-L323 HydrophobicContact CG-CD1 4.48Å; F319-L323 HydrophobicContact CZ-CD1 3.99Å; F319-L323 HydrophobicContact CZ-CD2 4.31Å; F319-L323 HydrophobicContact CZ-CG 4.3Å; F319-L323 WeakPolarHBondContact O-CG 3.38Å; F319-L323 PolarHBondContact O-N 3.15Å; Y320-L323 PolarHBondContact O-N 3.39Å; F321-L323 VanDerWaalsContact C-N 3.29Å; F321-L323 PolarHBondContact O-N 3.13Å; L323-G326 PolarHBondContact O-N 3.25Å; L323-E327 PolarHBondContact O-N 3.22Å; L323-L345 HydrophobicContact CD2-CD2 3.67Å; L323-C395 HydrophobicContact CD1-CB 3.97Å; L323-C395 WeakPolarHBondContact CD1-O 3.33Å; L323-K398 HydrophobicContact CB-CB 4.4Å; L323-K398 HydrophobicContact CB-CD 4.49Å; L323-K398 HydrophobicContact CD1-CB 4.28Å; L323-L399 HydrophobicContact CD1-CG 3.97Å; L323-L399 HydrophobicContact CD2-CD2 3.52Å; L323-L399 HydrophobicContact CD2-CG 3.87Å; L323-Q404 PolarHBondContact O-NE2 2.97Å
324	S	89.6	Confident	85	Confident	7 Å²	7	22.7 Å²	22.7	5%	0.049	15%	0.147	C	C	.	.	H	α-helix	trans	-68.5	-46.9	-177.7	-59.3	0	0	0	0	112.2	S286 Y320 F321 G326 E327 K398	S286-S324 PolarHBondContact OG-O 3.28Å; Y320-S324 WeakPolarHBondContact CE1-OG 3.48Å; Y320-S324 WeakPolarHBondContact O-CB 3.44Å; Y320-S324 PolarHBondContact O-N 3.5Å; Y320-S324 PolarHBondContact O-OG 2.68Å; F321-S324 PolarHBondContact O-N 2.96Å; S324-G326 VanDerWaalsContact C-N 3.32Å; S324-E327 PolarHBondContact O-N 3.21Å; S324-K398 WeakPolarHBondContact OG-CE 3.47Å
325	A	87.6	Confident	85.1	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-67.9	-35.6	175.8	0	0	0	0	0	111.5	S286 F294 F321 C329	S286-A325 PolarHBondContact OG-N 3.43Å; F294-A325 HydrophobicContact CD2-CB 3.84Å; F294-A325 HydrophobicContact CE2-CB 3.69Å; F321-A325 HydrophobicContact CE2-CB 4.26Å; F321-A325 HydrophobicContact CZ-CB 4.23Å; F321-A325 WeakPolarHBondContact O-CB 3.46Å; F321-A325 PolarHBondContact O-N 2.84Å; A325-C329 WeakPolarHBondContact O-CB 3.36Å; A325-C329 PolarHBondContact O-N 2.91Å; A325-C329 PolarHBondContact O-SG 3.29Å
326	G	83.7	Confident	85.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-42.4	176.5	0	0	0	0	0	113.1	V322 L323 S324 N328 C329 L330	V322-G326 WeakPolarHBondContact O-CA 3.43Å; V322-G326 PolarHBondContact O-N 3.27Å; L323-G326 PolarHBondContact O-N 3.25Å; S324-G326 VanDerWaalsContact C-N 3.32Å; G326-N328 PolarHBondContact O-N 3.37Å; G326-N328 VanDerWaalsContact O-N 3.07Å; G326-C329 PolarHBondContact O-N 3.3Å; G326-L330 WeakPolarHBondContact O-CB 3.4Å; G326-L330 VanDerWaalsContact O-CD1 3.31Å; G326-L330 WeakPolarHBondContact O-CD1 3.43Å; G326-L330 WeakPolarHBondContact O-CG 3.38Å; G326-L330 PolarHBondContact O-N 3.38Å
327	E	82	Confident	85.1	Confident	46 Å²	46	32.1 Å²	32.1	22%	0.215	19%	0.19	C	C	.	.	H	α-helix	trans	-49	-43.3	-175.9	-170.8	168.2	-169.8	0	0	112.3	L323 S324 K398	L323-E327 PolarHBondContact O-N 3.22Å; S324-E327 PolarHBondContact O-N 3.21Å; E327-K398 IonicContact OE2-NZ 3.12Å; E327-K398 PolarHBondContact OE2-NZ 3.18Å
328	N	79.8	Confident	84.8	Confident	57 Å²	57	32.7 Å²	32.7	31%	0.305	19%	0.193	S	C	.	.	H	α-helix	trans	-88.6	-25.8	178.3	-69.4	-30	0	0	0	114	S286 R288 G326	S286-N328 VanDerWaalsContact O-CB 3.29Å; S286-N328 WeakPolarHBondContact O-CB 3.44Å; S286-N328 PolarHBondContact O-ND2 3.31Å; R288-N328 HydrophobicContact CG-CB 4.15Å; R288-N328 PolarHBondContact NE-O 3.13Å; R288-N328 PolarHBondContact NH2-O 3.45Å; G326-N328 PolarHBondContact O-N 3.37Å; G326-N328 VanDerWaalsContact O-N 3.07Å
329	C	79.8	Confident	84.6	Confident	16 Å²	16	34 Å²	34	11%	0.108	20%	0.2	C	C	.	.	H	α-helix	trans	-95.4	-14.9	-172.8	-61.5	0	0	0	0	114.7	F294 A325 G326 G331 S332	F294-C329 HydrophobicContact CB-CB 4.19Å; F294-C329 HydrophobicContact CD1-CB 3.74Å; F294-C329 HydrophobicContact CE1-CB 4.41Å; F294-C329 HydrophobicContact CG-CB 4.1Å; A325-C329 WeakPolarHBondContact O-CB 3.36Å; A325-C329 PolarHBondContact O-N 2.91Å; A325-C329 PolarHBondContact O-SG 3.29Å; G326-C329 PolarHBondContact O-N 3.3Å; C329-G331 VanDerWaalsContact C-N 3.32Å; C329-G331 PolarHBondContact O-N 3.23Å; C329-S332 PolarHBondContact O-N 3.38Å; C329-S332 PolarHBondContact O-OG 3.32Å
330	L	79	Confident	84.5	Confident	8 Å²	8	34.9 Å²	34.9	4%	0.042	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-56	-40.9	-174.6	-81.2	158.5	0	0	0	113.5	G326 S332 L333 H338 Y341 Q404 A407	G326-L330 WeakPolarHBondContact O-CB 3.4Å; G326-L330 VanDerWaalsContact O-CD1 3.31Å; G326-L330 WeakPolarHBondContact O-CD1 3.43Å; G326-L330 WeakPolarHBondContact O-CG 3.38Å; G326-L330 PolarHBondContact O-N 3.38Å; L330-S332 PolarHBondContact O-N 2.91Å; L330-S332 VanDerWaalsContact O-N 3.16Å; L330-L333 HydrophobicContact CD2-CD1 4.1Å; L330-L333 PolarHBondContact O-N 3.07Å; L330-H338 PolarHBondContact O-NE2 3.02Å; L330-H338 VanDerWaalsContact O-NE2 3.14Å; L330-Y341 HydrophobicContact CD1-CE1 4.26Å; L330-Y341 HydrophobicContact CD2-CD1 3.66Å; L330-Y341 HydrophobicContact CD2-CE1 3.68Å; L330-Y341 HydrophobicContact CD2-CG 4.15Å; L330-Y341 HydrophobicContact CG-CE1 4.49Å; L330-Q404 VanDerWaalsContact CD1-OE1 3.24Å; L330-A407 HydrophobicContact CB-CB 4.13Å; L330-A407 HydrophobicContact CD1-CB 3.85Å; L330-A407 HydrophobicContact CD2-CB 4.29Å; L330-A407 HydrophobicContact CG-CB 4.31Å
331	G	72.9	Confident	84.4	Confident	75 Å²	75	34 Å²	34	77%	0.773	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-66.4	-14.9	179.7	0	0	0	0	0	115.3	C329	C329-G331 VanDerWaalsContact C-N 3.32Å; C329-G331 PolarHBondContact O-N 3.23Å
332	S	77	Confident	84.3	Confident	95 Å²	95	34.1 Å²	34.1	66%	0.664	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-106.6	-2.8	-178.5	50.8	0	0	0	0	114.5	C329 L330	C329-S332 PolarHBondContact O-N 3.38Å; C329-S332 PolarHBondContact O-OG 3.32Å; L330-S332 PolarHBondContact O-N 2.91Å; L330-S332 VanDerWaalsContact O-N 3.16Å
333	L	82.4	Confident	84.2	Confident	21 Å²	21	38.5 Å²	38.5	11%	0.11	22%	0.218	C	C	.	.			trans	-73.4	145.9	-176.7	-74.9	174.4	0	0	0	112.4	F294 E295 L330 H338	F294-L333 HydrophobicContact CD1-CD1 4.23Å; F294-L333 HydrophobicContact CD1-CD2 4.03Å; F294-L333 HydrophobicContact CD1-CG 4.49Å; F294-L333 HydrophobicContact CE1-CD1 4.12Å; E295-L333 HydrophobicContact CB-CD2 3.95Å; E295-L333 HydrophobicContact CG-CD2 4.36Å; L330-L333 HydrophobicContact CD2-CD1 4.1Å; L330-L333 PolarHBondContact O-N 3.07Å; L333-H338 PolarHBondContact O-CE1 3.4Å; L333-H338 PolarHBondContact O-ND1 3.43Å
334	S	85.9	Confident	84.1	Confident	47 Å²	47	38.5 Å²	38.5	33%	0.329	22%	0.218	S	C	.	.			trans	-66.1	168.6	165.7	80.4	0	0	0	0	111.2	E295 E336 G337 H338	E295-S334 WeakPolarHBondContact OE1-CB 3.4Å; E295-S334 PolarHBondContact OE1-OG 3.44Å; S334-E336 VanDerWaalsContact C-N 3.27Å; S334-E336 PolarHBondContact O-N 2.88Å; S334-E336 PolarHBondContact OG-N 3.48Å; S334-G337 PolarHBondContact O-N 3.5Å; S334-G337 VanDerWaalsContact O-N 3.16Å; S334-G337 PolarHBondContact OG-N 3.08Å; S334-H338 PolarHBondContact O-N 2.83Å; S334-H338 PolarHBondContact O-ND1 3.25Å
335	E	80.3	Confident	84.2	Confident	129 Å²	129	38.2 Å²	38.2	60%	0.603	22%	0.216	S	C	*	.	H	α-helix	trans	-60.5	-38.8	174.6	-62.3	-165.2	146.3	0	0	112.1	G337 H338 L339 R414	E335-G337 VanDerWaalsContact C-N 3.35Å; E335-H338 PolarHBondContact O-N 3.15Å; E335-L339 PolarHBondContact O-N 3.02Å; E335-L339 VanDerWaalsContact O-N 3.14Å; E335-R414 IonicContact OE1-NH1 3.2Å; E335-R414 PolarHBondContact OE1-NH1 3.15Å
336	E	84.3	Confident	84.2	Confident	139 Å²	139	41.3 Å²	41.3	65%	0.65	23%	0.23	S	C	*	.	H	α-helix	trans	-64.8	-39.8	174.2	-171	172	-174.7	0	0	111.2	S334 H338 L339 L340	S334-E336 VanDerWaalsContact C-N 3.27Å; S334-E336 PolarHBondContact O-N 2.88Å; S334-E336 PolarHBondContact OG-N 3.48Å; E336-H338 PolarHBondContact O-N 2.95Å; E336-L339 WeakPolarHBondContact O-CB 3.18Å; E336-L339 PolarHBondContact O-N 3.21Å; E336-L340 HydrophobicContact CG-CD1 4.43Å; E336-L340 VanDerWaalsContact O-CG 3.32Å; E336-L340 WeakPolarHBondContact O-CG 3.39Å; E336-L340 PolarHBondContact O-N 3.04Å
337	G	85.5	Confident	84.4	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.7	-40.2	174.6	0	0	0	0	0	113.5	S334 E335 L340 Y341	S334-G337 PolarHBondContact O-N 3.5Å; S334-G337 VanDerWaalsContact O-N 3.16Å; S334-G337 PolarHBondContact OG-N 3.08Å; E335-G337 VanDerWaalsContact C-N 3.35Å; G337-L340 PolarHBondContact O-N 3.44Å; G337-Y341 PolarHBondContact O-N 2.97Å
338	H	84	Confident	84.7	Confident	18 Å²	18	40.9 Å²	40.9	8%	0.083	24%	0.235	C	C	.	.	H	α-helix	trans	-67	-38.4	174.8	-71.5	92.3	0	0	0	112.5	L330 L333 S334 E335 E336 Y341 L342 L411	L330-H338 PolarHBondContact O-NE2 3.02Å; L330-H338 VanDerWaalsContact O-NE2 3.14Å; L333-H338 PolarHBondContact O-CE1 3.4Å; L333-H338 PolarHBondContact O-ND1 3.43Å; S334-H338 PolarHBondContact O-N 2.83Å; S334-H338 PolarHBondContact O-ND1 3.25Å; E335-H338 PolarHBondContact O-N 3.15Å; E336-H338 PolarHBondContact O-N 2.95Å; H338-Y341 WeakPolarHBondContact O-CB 3.35Å; H338-Y341 PolarHBondContact O-N 2.99Å; H338-L342 PolarHBondContact O-N 2.7Å; H338-L411 HydrophobicContact CB-CD1 4.01Å; H338-L411 HydrophobicContact CB-CD2 3.52Å; H338-L411 HydrophobicContact CB-CG 4.39Å
339	L	87.1	Confident	85.2	Confident	37 Å²	37	38.2 Å²	38.2	19%	0.194	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-43.6	175.2	-167	78	0	0	0	111.2	E335 E336 Y341 L342 R343 V421 M424	E335-L339 PolarHBondContact O-N 3.02Å; E335-L339 VanDerWaalsContact O-N 3.14Å; E336-L339 WeakPolarHBondContact O-CB 3.18Å; E336-L339 PolarHBondContact O-N 3.21Å; L339-Y341 VanDerWaalsContact C-N 3.29Å; L339-Y341 PolarHBondContact O-N 3.4Å; L339-L342 PolarHBondContact O-N 3.35Å; L339-R343 WeakPolarHBondContact O-CG 3.43Å; L339-R343 PolarHBondContact O-N 3.44Å; L339-V421 HydrophobicContact CD1-CG2 3.98Å; L339-M424 HydrophobicContact CD1-CE 3.33Å; L339-M424 HydrophobicContact CG-CE 4.1Å
340	L	88.8	Confident	85.5	Confident	19 Å²	19	39.8 Å²	39.8	10%	0.099	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-37	175.1	-71.6	171	0	0	0	112.1	L298 Q302 E336 G337 A344	L298-L340 HydrophobicContact CB-CB 3.99Å; L298-L340 HydrophobicContact CD1-CB 4.45Å; Q302-L340 HydrophobicContact CG-CD2 3.84Å; Q302-L340 PolarHBondContact NE2-O 2.9Å; E336-L340 HydrophobicContact CG-CD1 4.43Å; E336-L340 VanDerWaalsContact O-CG 3.32Å; E336-L340 WeakPolarHBondContact O-CG 3.39Å; E336-L340 PolarHBondContact O-N 3.04Å; G337-L340 PolarHBondContact O-N 3.44Å; L340-A344 PolarHBondContact O-N 2.93Å
341	Y	89.7	Confident	85.8	Confident	1 Å²	1	42.7 Å²	42.7	0%	0.004	25%	0.245	C	C	.	.	H	α-helix	trans	-64.5	-47.2	174.2	-177.1	-109	0	0	0	111.6	F294 L298 V322 L330 G337 H338 L339 R343 A344 L345 Q404 L408	F294-Y341 HydrophobicContact CE1-CD2 4.14Å; F294-Y341 AromaticContact CZ-CD2 3.99Å; F294-Y341 HydrophobicContact CZ-CD2 3.99Å; F294-Y341 HydrophobicContact CZ-CE2 4.16Å; L298-Y341 HydrophobicContact CD1-CD2 4.39Å; L298-Y341 HydrophobicContact CD2-CD2 4.44Å; V322-Y341 HydrophobicContact CG1-CD2 4.13Å; V322-Y341 HydrophobicContact CG1-CE2 3.78Å; L330-Y341 HydrophobicContact CD1-CE1 4.26Å; L330-Y341 HydrophobicContact CD2-CD1 3.66Å; L330-Y341 HydrophobicContact CD2-CE1 3.68Å; L330-Y341 HydrophobicContact CD2-CG 4.15Å; L330-Y341 HydrophobicContact CG-CE1 4.49Å; G337-Y341 PolarHBondContact O-N 2.97Å; H338-Y341 WeakPolarHBondContact O-CB 3.35Å; H338-Y341 PolarHBondContact O-N 2.99Å; L339-Y341 VanDerWaalsContact C-N 3.29Å; L339-Y341 PolarHBondContact O-N 3.4Å; Y341-R343 VanDerWaalsContact C-N 3.34Å; Y341-R343 PolarHBondContact O-N 3.38Å; Y341-A344 WeakPolarHBondContact O-CB 3.46Å; Y341-A344 PolarHBondContact O-N 3.43Å; Y341-A344 VanDerWaalsContact O-N 3.15Å; Y341-L345 HydrophobicContact CD1-CD1 4.09Å; Y341-L345 HydrophobicContact CD1-CG 4.38Å; Y341-L345 HydrophobicContact CE1-CD1 3.63Å; Y341-L345 HydrophobicContact CE1-CD2 4.41Å; Y341-L345 HydrophobicContact CE1-CG 4.1Å; Y341-L345 HydrophobicContact CE2-CD2 4.37Å; Y341-L345 WeakPolarHBondContact O-CG 3.36Å; Y341-L345 PolarHBondContact O-N 2.87Å; Y341-Q404 VanDerWaalsContact OH-CD 3.26Å; Y341-Q404 PolarHBondContact OH-NE2 3.16Å; Y341-Q404 PolarHBondContact OH-OE1 2.99Å; Y341-L408 HydrophobicContact CE1-CD2 4.35Å
342	L	88.8	Confident	86.3	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-42.8	175.8	-75.7	176.4	0	0	0	112.4	H338 L339 A344 L345 E346 L408 L411 V421 M424 M425 I428	H338-L342 PolarHBondContact O-N 2.7Å; L339-L342 PolarHBondContact O-N 3.35Å; L342-A344 VanDerWaalsContact C-N 3.32Å; L342-A344 PolarHBondContact O-N 3.1Å; L342-L345 PolarHBondContact O-N 3.44Å; L342-E346 PolarHBondContact O-N 3.4Å; L342-L408 HydrophobicContact CD2-CD2 3.55Å; L342-L411 HydrophobicContact CD1-CD1 3.81Å; L342-L411 HydrophobicContact CD2-CD1 4.37Å; L342-L411 HydrophobicContact CG-CD1 4.02Å; L342-V421 HydrophobicContact CD1-CB 4.46Å; L342-V421 HydrophobicContact CD1-CG1 3.91Å; L342-V421 HydrophobicContact CD1-CG2 4.3Å; L342-M424 HydrophobicContact CB-CE 3.91Å; L342-M424 HydrophobicContact CB-SD 4.08Å; L342-M424 HydrophobicContact CD1-CE 4.18Å; L342-M425 HydrophobicContact CD2-CE 4Å; L342-I428 HydrophobicContact CD2-CD1 4.05Å
343	R	88.9	Confident	86.4	Confident	92 Å²	92	37.3 Å²	37.3	35%	0.347	20%	0.195	S	C	.	.	H	α-helix	trans	-61.4	-40	175.3	-72.6	-178.5	-177.2	172.5	2.4	112.1	L339 Y341 L345 E346 A347 E420 M424	L339-R343 WeakPolarHBondContact O-CG 3.43Å; L339-R343 PolarHBondContact O-N 3.44Å; Y341-R343 VanDerWaalsContact C-N 3.34Å; Y341-R343 PolarHBondContact O-N 3.38Å; R343-L345 VanDerWaalsContact C-N 3.35Å; R343-E346 PolarHBondContact O-N 3.33Å; R343-A347 WeakPolarHBondContact O-CB 3.49Å; R343-A347 PolarHBondContact O-N 3.47Å; R343-E420 IonicContact NH2-OE2 2.66Å; R343-E420 PolarHBondContact NH2-OE2 2.99Å; R343-M424 HydrophobicContact CB-SD 4.34Å; R343-M424 HydrophobicContact CG-CE 4.39Å; R343-M424 HydrophobicContact CG-SD 3.41Å; R343-M424 WeakPolarHBondContact CG-SD 3.38Å
344	A	89.5	Confident	85.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.8	-40.7	175	0	0	0	0	0	111.7	L298 L301 V322 L340 Y341 L342 L348	L298-A344 HydrophobicContact CD2-CB 4.18Å; L301-A344 HydrophobicContact CD2-CB 3.96Å; V322-A344 HydrophobicContact CG1-CB 4.42Å; L340-A344 PolarHBondContact O-N 2.93Å; Y341-A344 WeakPolarHBondContact O-CB 3.46Å; Y341-A344 PolarHBondContact O-N 3.43Å; Y341-A344 VanDerWaalsContact O-N 3.15Å; L342-A344 VanDerWaalsContact C-N 3.32Å; L342-A344 PolarHBondContact O-N 3.1Å; A344-L348 WeakPolarHBondContact O-CB 3.43Å; A344-L348 WeakPolarHBondContact O-CG 3.47Å; A344-L348 PolarHBondContact O-N 3.39Å
345	L	90.4	Very high	84.6	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-64.4	-46.4	175.5	-64.2	-175	0	0	0	112.3	F319 L323 Y341 L342 R343 A347 L349 L399 L408 I428	F319-L345 HydrophobicContact CE2-CD2 3.51Å; F319-L345 HydrophobicContact CZ-CD2 3.98Å; L323-L345 HydrophobicContact CD2-CD2 3.67Å; Y341-L345 HydrophobicContact CD1-CD1 4.09Å; Y341-L345 HydrophobicContact CD1-CG 4.38Å; Y341-L345 HydrophobicContact CE1-CD1 3.63Å; Y341-L345 HydrophobicContact CE1-CD2 4.41Å; Y341-L345 HydrophobicContact CE1-CG 4.1Å; Y341-L345 HydrophobicContact CE2-CD2 4.37Å; Y341-L345 WeakPolarHBondContact O-CG 3.36Å; Y341-L345 PolarHBondContact O-N 2.87Å; L342-L345 PolarHBondContact O-N 3.44Å; R343-L345 VanDerWaalsContact C-N 3.35Å; L345-A347 VanDerWaalsContact C-N 3.29Å; L345-A347 PolarHBondContact O-N 3.24Å; L345-L349 WeakPolarHBondContact O-CB 3.34Å; L345-L349 PolarHBondContact O-N 3.38Å; L345-L399 HydrophobicContact CD1-CD2 4.39Å; L345-L399 HydrophobicContact CD2-CD2 4.34Å; L345-L408 HydrophobicContact CD1-CD2 3.97Å; L345-I428 HydrophobicContact CB-CD1 3.73Å; L345-I428 HydrophobicContact CB-CG1 4.28Å; L345-I428 HydrophobicContact CD1-CD1 4.36Å
346	E	89	Confident	83	Confident	65 Å²	65	40.7 Å²	40.7	30%	0.304	21%	0.212	S	C	.	.	H	α-helix	trans	-59.7	-39.1	178.6	-179.6	177.3	-143.8	0	0	112.2	L342 R343 P350 M424 S427 I428	L342-E346 PolarHBondContact O-N 3.4Å; R343-E346 PolarHBondContact O-N 3.33Å; E346-P350 WeakPolarHBondContact O-CD 3.43Å; E346-P350 VanDerWaalsContact O-CG 3.3Å; E346-P350 WeakPolarHBondContact O-CG 3.32Å; E346-M424 WeakPolarHBondContact OE2-CG 3.44Å; E346-S427 WeakPolarHBondContact OE1-CB 3.46Å; E346-S427 PolarHBondContact OE1-OG 3.15Å; E346-I428 HydrophobicContact CB-CG1 4.23Å
347	A	87.6	Confident	80.7	Confident	34 Å²	34	38.3 Å²	38.3	28%	0.281	21%	0.211	S	C	.	.	H	α-helix	trans	-81.6	-35.3	-176.8	0	0	0	0	0	113.9	I305 R343 L345	I305-A347 HydrophobicContact CD1-CB 4.17Å; I305-A347 HydrophobicContact CG2-CB 3.78Å; R343-A347 WeakPolarHBondContact O-CB 3.49Å; R343-A347 PolarHBondContact O-N 3.47Å; L345-A347 VanDerWaalsContact C-N 3.29Å; L345-A347 PolarHBondContact O-N 3.24Å
348	L	88.3	Confident	78.1	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-87.9	-34	-175.1	-67.6	174.2	0	0	0	113.5	L301 I305 L318 F319 V322 A344 L351	L301-L348 HydrophobicContact CD2-CD1 4.49Å; I305-L348 HydrophobicContact CD1-CD2 4.35Å; I305-L348 HydrophobicContact CD1-CG 4.24Å; I305-L348 HydrophobicContact CG1-CD2 4.41Å; L318-L348 HydrophobicContact CD2-CD1 4.34Å; L318-L348 HydrophobicContact CD2-CD2 3.85Å; L318-L348 HydrophobicContact CG-CD1 4.04Å; L318-L348 HydrophobicContact CG-CD2 4.3Å; F319-L348 HydrophobicContact CB-CB 4.22Å; F319-L348 HydrophobicContact CB-CD1 4.48Å; F319-L348 HydrophobicContact CD2-CB 3.42Å; F319-L348 VanDerWaalsContact CD2-CB 3.42Å; F319-L348 HydrophobicContact CD2-CD1 4.01Å; F319-L348 HydrophobicContact CD2-CG 4.37Å; F319-L348 HydrophobicContact CE2-CB 4.06Å; F319-L348 HydrophobicContact CG-CB 4.11Å; V322-L348 HydrophobicContact CG2-CD1 4.11Å; A344-L348 WeakPolarHBondContact O-CB 3.43Å; A344-L348 WeakPolarHBondContact O-CG 3.47Å; A344-L348 PolarHBondContact O-N 3.39Å; L348-L351 HydrophobicContact CD2-CD1 4.5Å; L348-L351 WeakPolarHBondContact O-CB 3.43Å; L348-L351 PolarHBondContact O-N 2.86Å; L348-L351 VanDerWaalsContact O-N 3.1Å
349	L	89.1	Confident	75.4	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-58.8	-44.4	-177.3	179.9	68	0	0	0	113.3	F319 L345 L351 L352 L399 I428 T431 L432	F319-L349 HydrophobicContact CE1-CD1 3.91Å; F319-L349 HydrophobicContact CE2-CB 4.41Å; F319-L349 HydrophobicContact CZ-CB 4.04Å; F319-L349 HydrophobicContact CZ-CD1 3.95Å; L345-L349 WeakPolarHBondContact O-CB 3.34Å; L345-L349 PolarHBondContact O-N 3.38Å; L349-L351 PolarHBondContact O-N 3.07Å; L349-L351 VanDerWaalsContact O-N 3.17Å; L349-L352 HydrophobicContact CD1-CD1 3.86Å; L349-L352 WeakPolarHBondContact O-CB 3.48Å; L349-L352 PolarHBondContact O-N 3.41Å; L349-L399 HydrophobicContact CD1-CD1 4.02Å; L349-I428 HydrophobicContact CD2-CG2 3.93Å; L349-T431 HydrophobicContact CD2-CG2 3.97Å; L349-T431 HydrophobicContact CG-CG2 3.82Å; L349-L432 HydrophobicContact CD1-CD2 4.06Å; L349-L432 HydrophobicContact CD2-CD2 3.88Å; L349-L432 HydrophobicContact CD2-CG 3.94Å
350	P	86	Confident	72.4	Confident	49 Å²	49	55.1 Å²	55.1	32%	0.318	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-65.7	-17.2	178.2	-20.5	33.4	0	0	0	114.1	E346 L352 T431 Q435	E346-P350 WeakPolarHBondContact O-CD 3.43Å; E346-P350 VanDerWaalsContact O-CG 3.3Å; E346-P350 WeakPolarHBondContact O-CG 3.32Å; P350-L352 VanDerWaalsContact C-N 3.32Å; P350-T431 HydrophobicContact CB-CG2 4.3Å; P350-T431 HydrophobicContact CG-CG2 4.1Å; P350-Q435 PolarHBondContact O-NE2 3.07Å; P350-Q435 PolarHBondContact O-OE1 3.39Å
351	L	85.6	Confident	69.4	Low	68 Å²	68	59.9 Å²	59.9	36%	0.356	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-84.4	-6.8	179.5	-58.6	176.5	0	0	0	112.8	A315 L348 L349	A315-L351 HydrophobicContact CB-CB 3.47Å; A315-L351 VanDerWaalsContact CB-CB 3.47Å; A315-L351 HydrophobicContact CB-CD1 3.95Å; A315-L351 HydrophobicContact CB-CG 4.37Å; L348-L351 HydrophobicContact CD2-CD1 4.5Å; L348-L351 WeakPolarHBondContact O-CB 3.43Å; L348-L351 PolarHBondContact O-N 2.86Å; L348-L351 VanDerWaalsContact O-N 3.1Å; L349-L351 PolarHBondContact O-N 3.07Å; L349-L351 VanDerWaalsContact O-N 3.17Å
352	L	83.8	Confident	66.3	Low	4 Å²	4	66.6 Å²	66.6	2%	0.021	36%	0.359	C	S	.	.	S	Bend	trans	-70.5	139.6	176.8	-65.8	-175.1	0	0	0	111.8	P316 F319 L349 P350 T392 C395 Q435	P316-L352 HydrophobicContact CB-CD2 3.9Å; P316-L352 HydrophobicContact CG-CD2 4.02Å; F319-L352 HydrophobicContact CB-CD2 4.24Å; F319-L352 HydrophobicContact CD1-CD1 3.65Å; F319-L352 HydrophobicContact CD1-CD2 3.98Å; F319-L352 HydrophobicContact CD1-CG 4.13Å; F319-L352 HydrophobicContact CE1-CD1 3.76Å; F319-L352 HydrophobicContact CG-CD2 4.43Å; L349-L352 HydrophobicContact CD1-CD1 3.86Å; L349-L352 WeakPolarHBondContact O-CB 3.48Å; L349-L352 PolarHBondContact O-N 3.41Å; P350-L352 VanDerWaalsContact C-N 3.32Å; L352-T392 HydrophobicContact CB-CG2 4.33Å; L352-T392 HydrophobicContact CD1-CG2 4.48Å; L352-C395 HydrophobicContact CD1-CB 4.22Å; L352-Q435 PolarHBondContact O-NE2 3.29Å
353	P	80.3	Confident	63.4	Low	54 Å²	54	73.5 Å²	73.5	35%	0.351	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-64.7	146.7	173.9	27.1	-31.6	0	0	0	110.6	P316 S355 V388 T392	P316-P353 HydrophobicContact CG-CG 4.4Å; P353-S355 PolarHBondContact O-N 2.95Å; P353-V388 HydrophobicContact CG-CG1 3.86Å; P353-T392 HydrophobicContact CG-CG2 4.4Å; P353-T392 WeakPolarHBondContact CG-OG1 3.37Å; P353-T392 WeakPolarHBondContact O-CG2 3.49Å
354	V	72	Confident	60.3	Low	72 Å²	72	76.4 Å²	76.4	44%	0.436	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-79.3	123.8	175.1	-177.4	0	0	0	0	108	E356 Q435	V354-E356 PolarHBondContact O-N 3.33Å; V354-Q435 HydrophobicContact CG2-CG 3.81Å
355	S	57.9	Low	57.3	Low	26 Å²	26	81.1 Å²	81.1	18%	0.182	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-65.5	116.2	172.8	-60.5	0	0	0	0	109.3	P353 S357	P353-S355 PolarHBondContact O-N 2.95Å; S355-S357 PolarHBondContact O-N 2.92Å; S355-S357 VanDerWaalsContact O-N 3.13Å
356	E	45.9	Very low	54.5	Low	170 Å²	170	89 Å²	89	79%	0.794	50%	0.498	S	S	*	.			trans	-70.4	-0.9	-179.9	-69.7	-174.1	154	0	0	113.4	V354 T358	V354-E356 PolarHBondContact O-N 3.33Å; E356-T358 PolarHBondContact O-N 3.25Å
357	S	36.1	Very low	51.5	Low	88 Å²	88	90.4 Å²	90.4	62%	0.615	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	15.1	-172.5	54.3	0	0	0	0	116.5	S355	S355-S357 PolarHBondContact O-N 2.92Å; S355-S357 VanDerWaalsContact O-N 3.13Å
358	T	32.3	Very low	48.8	Very low	90 Å²	90	97.9 Å²	97.9	55%	0.552	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131	26.4	173.1	45.2	0	0	0	0	114.8	E356 R360	E356-T358 PolarHBondContact O-N 3.25Å; T358-R360 PolarHBondContact O-N 3.32Å; T358-R360 VanDerWaalsContact O-N 3.12Å
359	S	27.5	Very low	45.9	Very low	95 Å²	95	105.5 Å²	105.5	66%	0.664	59%	0.585	S	S	*	*			trans	-76.6	80.4	148.2	57.8	0	0	0	0	108.4	P361	S359-P361 WeakPolarHBondContact O-CD 3.33Å
360	R	23	Very low	43.2	Very low	223 Å²	223	113.5 Å²	113.5	84%	0.842	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-55.9	122.8	155.3	-75.4	-176.8	176.5	-176.9	-3.9	105.9	T358 E362	T358-R360 PolarHBondContact O-N 3.32Å; T358-R360 VanDerWaalsContact O-N 3.12Å; R360-E362 PolarHBondContact O-N 2.74Å
361	P	25.5	Very low	40.4	Very low	119 Å²	119	118.7 Å²	118.7	77%	0.773	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-57	118.4	159.7	-10.5	25.5	0	0	0	105.1	S359 V363	S359-P361 WeakPolarHBondContact O-CD 3.33Å; P361-V363 PolarHBondContact O-N 3.35Å
362	E	25.3	Very low	37.8	Very low	143 Å²	143	123 Å²	123	67%	0.668	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-54.4	127.2	165.1	-73.8	-179.6	156.9	0	0	106.7	R360 N364 R656	R360-E362 PolarHBondContact O-N 2.74Å; E362-N364 PolarHBondContact O-N 3.38Å; E362-R656 IonicContact OE2-CZ 3.93Å; E362-R656 IonicContact OE2-NH2 2.81Å; E362-R656 PolarHBondContact OE2-NH2 2.89Å
363	V	27.3	Very low	35.5	Very low	145 Å²	145	126.3 Å²	126.3	88%	0.879	71%	0.712	S	S	*	*	S	Bend	trans	-51.6	101.8	177	177.7	0	0	0	0	108.7	P361	P361-V363 PolarHBondContact O-N 3.35Å
364	N	24.4	Very low	32.9	Very low	154 Å²	154	130.4 Å²	130.4	82%	0.824	73%	0.731	S	S	*	*			trans	-147.3	95.1	162.3	-93	-2.6	0	0	0	104.6	E362	E362-N364 PolarHBondContact O-N 3.38Å
365	S	25.8	Very low	30.8	Very low	99 Å²	99	135.8 Å²	135.8	69%	0.692	75%	0.753	S	S	*	*				171.7	118.5	128.1	-151.7	0	0	0	0	109	S367	S365-S367 PolarHBondContact O-N 3.38Å
366	D	32.1	Very low	29.4	Very low	166 Å²	166	142 Å²	142	89%	0.888	78%	0.779	S	S	*	*			trans	-56.3	121.9	140.1	-70.7	-42.4	0	0	0	107.6
367	S	27.1	Very low	28.6	Very low	94 Å²	94	139.7 Å²	139.7	66%	0.657	78%	0.779	S	S	*	*			trans	175.3	100.2	150.2	52.7	0	0	0	0	107.2	S365	S365-S367 PolarHBondContact O-N 3.38Å
368	E	30	Very low	28.1	Very low	191 Å²	191	141.6 Å²	141.6	89%	0.893	79%	0.787	S	S	*	*			trans	-61.9	125.2	156.4	-62.4	177.2	158.6	0	0	107.3
369	D	27.4	Very low	28	Very low	165 Å²	165	142.8 Å²	142.8	88%	0.882	80%	0.796	S	S	*	*			trans	-161.2	112.8	151.2	-91.2	-29.2	0	0	0	107.8
370	D	31.6	Very low	28.2	Very low	169 Å²	169	146.9 Å²	146.9	90%	0.904	81%	0.807	S	S	*	*			trans	-67.3	130.5	167.3	-74.5	-46.9	0	0	0	109.4
371	D	28.4	Very low	28.7	Very low	157 Å²	157	144.6 Å²	144.6	84%	0.84	81%	0.806	S	S	*	*			trans	-154.9	152.6	144.5	-148.6	7.1	0	0	0	113
372	D	30.6	Very low	29.3	Very low	158 Å²	158	145.2 Å²	145.2	85%	0.845	80%	0.803	S	S	*	*			trans	-70.9	165.4	-151.5	-93	-46.9	0	0	0	117.8
373	G	34.4	Very low	30.1	Very low	74 Å²	74	146 Å²	146	76%	0.763	81%	0.812	S	S	*	*			trans	-70.1	141.2	-173.4	0	0	0	0	0	115.5
374	D	26.8	Very low	31.5	Very low	141 Å²	141	141.8 Å²	141.8	75%	0.754	79%	0.789	S	S	*	*			trans	-134.9	97.8	158.7	-137.4	-7.1	0	0	0	109.6	H376	D374-H376 PolarHBondContact O-N 2.96Å
375	M	28.2	Very low	33.6	Very low	184 Å²	184	142.3 Å²	142.3	91%	0.906	78%	0.779	S	S	*	*			trans	-81.3	95.4	175.9	-94.4	-81.3	-179.1	0	0	109	P377	M375-P377 WeakPolarHBondContact O-CD 3.32Å
376	H	27.6	Very low	36.3	Very low	157 Å²	157	138.5 Å²	138.5	73%	0.727	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-77.5	120.6	163.2	-79.2	-46.1	0	0	0	110.3	D374 T378	D374-H376 PolarHBondContact O-N 2.96Å; H376-T378 PolarHBondContact O-N 3.16Å
377	P	29.2	Very low	38.8	Very low	121 Å²	121	133.4 Å²	133.4	79%	0.786	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-71.8	122.4	177	28.4	-31.4	0	0	0	109.9	M375	M375-P377 WeakPolarHBondContact O-CD 3.32Å
378	T	25.8	Very low	41.5	Very low	128 Å²	128	131.8 Å²	131.8	79%	0.785	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-69.4	145.6	168.4	20.9	0	0	0	0	110.1	H376 M380	H376-T378 PolarHBondContact O-N 3.16Å; T378-M380 PolarHBondContact O-N 2.9Å
379	P	29.9	Very low	44.1	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-69.5	134.9	-177.2	28.1	-31.6	0	0	0	110.4	Q381	P379-Q381 PolarHBondContact O-N 3.46Å
380	M	31.5	Very low	46.9	Very low	181 Å²	181	124.4 Å²	124.4	89%	0.892	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-52.4	118	177.7	-61.8	-169.7	77.3	0	0	111.4	T378	T378-M380 PolarHBondContact O-N 2.9Å
381	Q	34.2	Very low	49.5	Very low	174 Å²	174	116.3 Å²	116.3	81%	0.813	63%	0.633	S	S	*	*			trans	-109.1	140.6	164.6	-81.1	-177.4	-15.7	0	0	109.1	P379 N383	P379-Q381 PolarHBondContact O-N 3.46Å; Q381-N383 PolarHBondContact O-N 3.18Å
382	D	38.1	Very low	52.3	Low	132 Å²	132	108.9 Å²	108.9	71%	0.706	59%	0.593	S	S	*	*			trans	-38	112.7	-173.9	-74.2	-35.3	0	0	0	115.3	S384	D382-S384 PolarHBondContact O-N 3.44Å
383	N	42.9	Very low	54.9	Low	161 Å²	161	106.2 Å²	106.2	86%	0.861	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	17.9	-179.1	-85.1	-6.3	0	0	0	116.1	Q381	Q381-N383 PolarHBondContact O-N 3.18Å
384	S	55.4	Low	57.4	Low	56 Å²	56	105.9 Å²	105.9	39%	0.392	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.7	4.7	-171.4	81.1	0	0	0	0	115.9	D382	D382-S384 PolarHBondContact O-N 3.44Å
385	R	69.3	Low	60.4	Low	165 Å²	165	99.2 Å²	99.2	62%	0.623	52%	0.518	S	S	*	.	B	Isolated β-bridge	trans	-113.6	134	-179.5	-70.3	-174.3	-177.2	159.5	6.6	110.4
386	I	81.1	Confident	63.2	Low	18 Å²	18	92 Å²	92	9%	0.092	48%	0.483	C	S	.	.			trans	-67.9	145.4	178.6	-66.1	164.4	0	0	0	109	F273 E275 F278 W317 L390 I391	F273-I386 HydrophobicContact CB-CD1 4.04Å; F273-I386 PolarHBondContact O-N 3.03Å; E275-I386 WeakPolarHBondContact OE1-CG1 3.35Å; F278-I386 HydrophobicContact CB-CD1 3.08Å; F278-I386 HydrophobicContact CD1-CD1 3.61Å; F278-I386 HydrophobicContact CD2-CD1 3.87Å; F278-I386 HydrophobicContact CE1-CD1 4.45Å; F278-I386 HydrophobicContact CG-CD1 3.27Å; W317-I386 HydrophobicContact CH2-CB 4.43Å; W317-I386 WeakPolarHBondContact CH2-O 3.44Å; W317-I386 HydrophobicContact CZ3-CB 4.27Å; W317-I386 HydrophobicContact CZ3-CG2 4.34Å; I386-L390 HydrophobicContact CG2-CB 4.5Å; I386-L390 HydrophobicContact CG2-CD2 3.81Å; I386-I391 HydrophobicContact CG2-CD1 3.9Å; I386-I391 HydrophobicContact CG2-CG1 3.72Å
387	S	84.8	Confident	66.1	Low	59 Å²	59	90 Å²	90	41%	0.413	47%	0.474	S	S	.	.			trans	-77.9	144	178.5	77.6	0	0	0	0	111.2	Q389 L390 I391	S387-Q389 PolarHBondContact O-N 3.06Å; S387-L390 PolarHBondContact O-N 2.86Å; S387-L390 VanDerWaalsContact OG-CB 3.23Å; S387-L390 WeakPolarHBondContact OG-CB 3.4Å; S387-L390 PolarHBondContact OG-N 3.4Å; S387-L390 VanDerWaalsContact OG-N 3.13Å; S387-I391 PolarHBondContact O-N 3.33Å
388	V	84.5	Confident	68.9	Low	60 Å²	60	85.9 Å²	85.9	36%	0.364	44%	0.444	S	S	.	.	H	α-helix	trans	-62.4	-31.8	175.7	178.8	0	0	0	0	111.3	P316 W317 P353 T392	P316-V388 HydrophobicContact CB-CG1 4.29Å; P316-V388 HydrophobicContact CG-CG1 3.98Å; W317-V388 HydrophobicContact CH2-CG2 4.41Å; W317-V388 HydrophobicContact CZ2-CG2 3.62Å; P353-V388 HydrophobicContact CG-CG1 3.86Å; V388-T392 WeakPolarHBondContact O-CB 3.44Å; V388-T392 PolarHBondContact O-N 3.23Å; V388-T392 PolarHBondContact O-OG1 2.98Å
389	Q	83.6	Confident	71.7	Confident	128 Å²	128	80.3 Å²	80.3	60%	0.598	41%	0.409	S	S	*	.	H	α-helix	trans	-64.4	-47.9	177	-70.9	177.6	-13.2	0	0	111.4	S387 I391 T392 E393	S387-Q389 PolarHBondContact O-N 3.06Å; Q389-I391 VanDerWaalsContact C-N 3.33Å; Q389-I391 PolarHBondContact O-N 3.37Å; Q389-T392 WeakPolarHBondContact O-CB 3.43Å; Q389-T392 PolarHBondContact O-N 3.35Å; Q389-E393 PolarHBondContact O-N 3.2Å
390	L	86.1	Confident	74.4	Confident	73 Å²	73	75.9 Å²	75.9	38%	0.382	38%	0.379	S	S	.	.	H	α-helix	trans	-58.7	-44.7	178	-176.2	144.1	0	0	0	111.5	F278 I386 S387 T392 E393 E394	F278-L390 HydrophobicContact CZ-CD2 4.35Å; I386-L390 HydrophobicContact CG2-CB 4.5Å; I386-L390 HydrophobicContact CG2-CD2 3.81Å; S387-L390 PolarHBondContact O-N 2.86Å; S387-L390 VanDerWaalsContact OG-CB 3.23Å; S387-L390 WeakPolarHBondContact OG-CB 3.4Å; S387-L390 PolarHBondContact OG-N 3.4Å; S387-L390 VanDerWaalsContact OG-N 3.13Å; L390-T392 VanDerWaalsContact C-N 3.28Å; L390-T392 PolarHBondContact O-N 3.14Å; L390-E393 PolarHBondContact O-N 2.87Å; L390-E394 HydrophobicContact CD2-CG 4.11Å; L390-E394 WeakPolarHBondContact O-CB 3.36Å; L390-E394 WeakPolarHBondContact O-CG 3.34Å; L390-E394 PolarHBondContact O-N 3.01Å
391	I	88	Confident	77.1	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.5	-36	176.7	-67.9	-64.8	0	0	0	112.3	F273 F278 P316 W317 Y320 I386 S387 Q389 E394 C395	F273-I391 HydrophobicContact CD2-CD1 3.87Å; F273-I391 HydrophobicContact CE2-CD1 4.31Å; F278-I391 HydrophobicContact CD2-CD1 3.84Å; F278-I391 HydrophobicContact CE2-CD1 3.56Å; P316-I391 HydrophobicContact CB-CG2 4.08Å; P316-I391 WeakPolarHBondContact O-CG2 3.33Å; W317-I391 HydrophobicContact CE3-CD1 4.37Å; W317-I391 HydrophobicContact CE3-CG1 3.82Å; W317-I391 HydrophobicContact CE3-CG2 4.39Å; W317-I391 HydrophobicContact CH2-CG1 4.14Å; W317-I391 HydrophobicContact CZ3-CB 4.41Å; W317-I391 HydrophobicContact CZ3-CD1 4.12Å; W317-I391 HydrophobicContact CZ3-CG1 3.42Å; W317-I391 VanDerWaalsContact CZ3-CG1 3.42Å; Y320-I391 HydrophobicContact CD2-CD1 4.5Å; Y320-I391 HydrophobicContact CG-CD1 4.41Å; Y320-I391 HydrophobicContact CG-CG2 4.43Å; I386-I391 HydrophobicContact CG2-CD1 3.9Å; I386-I391 HydrophobicContact CG2-CG1 3.72Å; S387-I391 PolarHBondContact O-N 3.33Å; Q389-I391 VanDerWaalsContact C-N 3.33Å; Q389-I391 PolarHBondContact O-N 3.37Å; I391-E394 PolarHBondContact O-N 3.17Å; I391-C395 WeakPolarHBondContact O-CB 3.45Å; I391-C395 PolarHBondContact O-N 3.2Å; I391-C395 PolarHBondContact O-SG 3.13Å
392	T	85.9	Confident	79.5	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.006	34%	0.338	C	S	.	.	H	α-helix	trans	-67	-43.1	178.5	-57.2	0	0	0	0	110.9	L352 P353 V388 Q389 L390 C395 I396	L352-T392 HydrophobicContact CB-CG2 4.33Å; L352-T392 HydrophobicContact CD1-CG2 4.48Å; P353-T392 HydrophobicContact CG-CG2 4.4Å; P353-T392 WeakPolarHBondContact CG-OG1 3.37Å; P353-T392 WeakPolarHBondContact O-CG2 3.49Å; V388-T392 WeakPolarHBondContact O-CB 3.44Å; V388-T392 PolarHBondContact O-N 3.23Å; V388-T392 PolarHBondContact O-OG1 2.98Å; Q389-T392 WeakPolarHBondContact O-CB 3.43Å; Q389-T392 PolarHBondContact O-N 3.35Å; L390-T392 VanDerWaalsContact C-N 3.28Å; L390-T392 PolarHBondContact O-N 3.14Å; T392-C395 PolarHBondContact O-N 2.92Å; T392-I396 WeakPolarHBondContact O-CG1 3.29Å; T392-I396 PolarHBondContact O-N 3.44Å
393	E	85.7	Confident	81.6	Confident	102 Å²	102	66.6 Å²	66.6	48%	0.477	33%	0.329	S	S	.	.	H	α-helix	trans	-63.8	-44.8	175.1	-69.1	-179.3	172.1	0	0	111.4	Q389 L390 C395 I396 H397	Q389-E393 PolarHBondContact O-N 3.2Å; L390-E393 PolarHBondContact O-N 2.87Å; E393-C395 VanDerWaalsContact C-N 3.35Å; E393-C395 PolarHBondContact O-N 3.16Å; E393-I396 PolarHBondContact O-N 3.01Å; E393-H397 WeakPolarHBondContact O-CB 3.25Å; E393-H397 PolarHBondContact O-N 2.91Å
394	E	87.5	Confident	83.6	Confident	67 Å²	67	59 Å²	59	31%	0.313	29%	0.288	S	S	.	.	H	α-helix	trans	-61.8	-38.4	175.6	-77.4	-60.3	134.2	0	0	112.8	Y320 L390 I391 I396 H397 K398	Y320-E394 HydrophobicContact CD2-CB 4.14Å; Y320-E394 HydrophobicContact CE2-CB 3.85Å; L390-E394 HydrophobicContact CD2-CG 4.11Å; L390-E394 WeakPolarHBondContact O-CB 3.36Å; L390-E394 WeakPolarHBondContact O-CG 3.34Å; L390-E394 PolarHBondContact O-N 3.01Å; I391-E394 PolarHBondContact O-N 3.17Å; E394-I396 PolarHBondContact O-N 3.24Å; E394-H397 PolarHBondContact O-N 2.99Å; E394-K398 VanDerWaalsContact O-CB 3.32Å; E394-K398 WeakPolarHBondContact O-CB 3.3Å; E394-K398 WeakPolarHBondContact O-CG 3.3Å; E394-K398 PolarHBondContact O-N 3.32Å
395	C	89.9	Confident	85	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59.8	-46.1	173.9	-73.2	0	0	0	0	111.9	F319 L323 L352 I391 T392 E393 K398 L399	F319-C395 HydrophobicContact CD1-CB 3.69Å; F319-C395 HydrophobicContact CE1-CB 3.95Å; L323-C395 HydrophobicContact CD1-CB 3.97Å; L323-C395 WeakPolarHBondContact CD1-O 3.33Å; L352-C395 HydrophobicContact CD1-CB 4.22Å; I391-C395 WeakPolarHBondContact O-CB 3.45Å; I391-C395 PolarHBondContact O-N 3.2Å; I391-C395 PolarHBondContact O-SG 3.13Å; T392-C395 PolarHBondContact O-N 2.92Å; E393-C395 VanDerWaalsContact C-N 3.35Å; E393-C395 PolarHBondContact O-N 3.16Å; C395-K398 PolarHBondContact O-N 3.18Å; C395-L399 WeakPolarHBondContact O-CG 3.24Å; C395-L399 PolarHBondContact O-N 3.32Å
396	I	87	Confident	85.8	Confident	33 Å²	33	51.8 Å²	51.8	17%	0.169	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-43.1	178.8	-65.3	168.4	0	0	0	110.3	T392 E393 E394 L399 D400 H436 L438	T392-I396 WeakPolarHBondContact O-CG1 3.29Å; T392-I396 PolarHBondContact O-N 3.44Å; E393-I396 PolarHBondContact O-N 3.01Å; E394-I396 PolarHBondContact O-N 3.24Å; I396-L399 PolarHBondContact O-N 2.91Å; I396-D400 PolarHBondContact O-N 3.41Å; I396-H436 HydrophobicContact CD1-CB 4.28Å; I396-L438 HydrophobicContact CG2-CD1 3.73Å; I396-L438 HydrophobicContact CG2-CD2 4.39Å
397	H	87.9	Confident	85.8	Confident	115 Å²	115	51.7 Å²	51.7	53%	0.532	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-44.2	177	-179.9	-108.2	0	0	0	111.8	E393 E394 L399 D400 T401	E393-H397 WeakPolarHBondContact O-CB 3.25Å; E393-H397 PolarHBondContact O-N 2.91Å; E394-H397 PolarHBondContact O-N 2.99Å; H397-L399 PolarHBondContact O-N 3.41Å; H397-D400 CarbonylContact O-C 3.45Å; H397-D400 PolarHBondContact O-N 2.83Å; H397-D400 VanDerWaalsContact O-N 3.1Å; H397-T401 PolarHBondContact O-N 2.98Å
398	K	87.1	Confident	85.8	Confident	34 Å²	34	49 Å²	49	15%	0.148	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-40.8	176.8	-81.4	-170.8	167.6	-64.3	0	112.8	Y320 L323 S324 E327 E394 C395 D400 T401 Q404	Y320-K398 HydrophobicContact CD2-CD 4.22Å; Y320-K398 HydrophobicContact CE2-CD 3.7Å; L323-K398 HydrophobicContact CB-CB 4.4Å; L323-K398 HydrophobicContact CB-CD 4.49Å; L323-K398 HydrophobicContact CD1-CB 4.28Å; S324-K398 WeakPolarHBondContact OG-CE 3.47Å; E327-K398 IonicContact OE2-NZ 3.12Å; E327-K398 PolarHBondContact OE2-NZ 3.18Å; E394-K398 VanDerWaalsContact O-CB 3.32Å; E394-K398 WeakPolarHBondContact O-CB 3.3Å; E394-K398 WeakPolarHBondContact O-CG 3.3Å; E394-K398 PolarHBondContact O-N 3.32Å; C395-K398 PolarHBondContact O-N 3.18Å; K398-D400 PolarHBondContact O-N 3.04Å; K398-T401 WeakPolarHBondContact O-CB 3.35Å; K398-T401 WeakPolarHBondContact O-CG2 3.45Å; K398-T401 PolarHBondContact O-N 3.13Å; K398-T401 VanDerWaalsContact O-N 3.17Å; K398-T401 PolarHBondContact O-OG1 3.27Å; K398-Q404 WeakPolarHBondContact O-CG 3.41Å
399	L	85.8	Confident	85.8	Confident	12 Å²	12	46.2 Å²	46.2	6%	0.063	22%	0.224	C	C	.	.	H	α-helix	trans	-59.2	-32.7	173.3	-80.7	168.6	0	0	0	112.8	F319 L323 L345 L349 C395 I396 H397 T401 T405 L432	F319-L399 HydrophobicContact CE1-CD1 3.9Å; F319-L399 HydrophobicContact CZ-CD1 3.87Å; F319-L399 HydrophobicContact CZ-CD2 4.43Å; F319-L399 HydrophobicContact CZ-CG 4.39Å; L323-L399 HydrophobicContact CD1-CG 3.97Å; L323-L399 HydrophobicContact CD2-CD2 3.52Å; L323-L399 HydrophobicContact CD2-CG 3.87Å; L345-L399 HydrophobicContact CD1-CD2 4.39Å; L345-L399 HydrophobicContact CD2-CD2 4.34Å; L349-L399 HydrophobicContact CD1-CD1 4.02Å; C395-L399 WeakPolarHBondContact O-CG 3.24Å; C395-L399 PolarHBondContact O-N 3.32Å; I396-L399 PolarHBondContact O-N 2.91Å; H397-L399 PolarHBondContact O-N 3.41Å; L399-T401 VanDerWaalsContact C-N 3.33Å; L399-T405 WeakPolarHBondContact O-CG2 3.33Å; L399-L432 HydrophobicContact CD1-CD2 4.17Å
400	D	85.4	Confident	85.8	Confident	23 Å²	23	44.1 Å²	44.1	12%	0.123	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	5	179.9	-163.5	54.6	0	0	0	114.1	I396 H397 K398 V443 R444	I396-D400 PolarHBondContact O-N 3.41Å; H397-D400 CarbonylContact O-C 3.45Å; H397-D400 PolarHBondContact O-N 2.83Å; H397-D400 VanDerWaalsContact O-N 3.1Å; K398-D400 PolarHBondContact O-N 3.04Å; D400-V443 WeakPolarHBondContact OD1-CA 3.31Å; D400-V443 WeakPolarHBondContact OD1-CG1 3.42Å; D400-R444 WeakPolarHBondContact O-CD 3.34Å; D400-R444 PolarHBondContact O-NH1 3.29Å; D400-R444 VanDerWaalsContact O-NH1 3.14Å; D400-R444 WeakPolarHBondContact OD1-CB 3.36Å; D400-R444 PolarHBondContact OD1-N 3.33Å; D400-R444 IonicContact OD2-CZ 3.82Å; D400-R444 IonicContact OD2-NH1 3.66Å; D400-R444 PolarHBondContact OD2-NH1 3.18Å
401	T	87.9	Confident	85.5	Confident	26 Å²	26	41.5 Å²	41.5	16%	0.16	20%	0.203	C	C	.	.	S	Bend	trans	-66.6	149.2	175.1	59.9	0	0	0	0	111.7	H397 K398 L399 Q403 Q404 T405	H397-T401 PolarHBondContact O-N 2.98Å; K398-T401 WeakPolarHBondContact O-CB 3.35Å; K398-T401 WeakPolarHBondContact O-CG2 3.45Å; K398-T401 PolarHBondContact O-N 3.13Å; K398-T401 VanDerWaalsContact O-N 3.17Å; K398-T401 PolarHBondContact O-OG1 3.27Å; L399-T401 VanDerWaalsContact C-N 3.33Å; T401-Q403 PolarHBondContact O-N 3.13Å; T401-Q404 PolarHBondContact O-N 2.99Å; T401-Q404 WeakPolarHBondContact OG1-CB 3.4Å; T401-Q404 VanDerWaalsContact OG1-CG 3.28Å; T401-Q404 WeakPolarHBondContact OG1-CG 3.25Å; T401-T405 WeakPolarHBondContact O-CB 3.41Å; T401-T405 VanDerWaalsContact O-CG2 3.32Å; T401-T405 WeakPolarHBondContact O-CG2 3.46Å; T401-T405 PolarHBondContact O-N 3.43Å; T401-T405 PolarHBondContact O-OG1 3.21Å
402	K	84.5	Confident	85.3	Confident	154 Å²	154	42 Å²	42	67%	0.67	21%	0.206	S	C	*	.	H	α-helix	trans	-57.2	-36.2	180	-175.5	177.9	178.2	-179.1	0	112.9	T405 N406	K402-T405 WeakPolarHBondContact CA-OG1 3.42Å; K402-T405 PolarHBondContact O-OG1 2.89Å; K402-T405 VanDerWaalsContact O-OG1 3.13Å; K402-N406 VanDerWaalsContact O-CB 3.24Å; K402-N406 WeakPolarHBondContact O-CB 3.27Å; K402-N406 PolarHBondContact O-N 3.3Å; K402-N406 PolarHBondContact O-ND2 3.49Å
403	Q	82.4	Confident	85.1	Confident	112 Å²	112	47 Å²	47	52%	0.523	23%	0.225	S	C	.	.	H	α-helix	trans	-70.8	-49.9	-178.3	-66	-176.4	2.3	0	0	111.7	T401 N406 A407	T401-Q403 PolarHBondContact O-N 3.13Å; Q403-N406 PolarHBondContact O-N 2.89Å; Q403-A407 WeakPolarHBondContact O-CB 3.35Å; Q403-A407 PolarHBondContact O-N 3.06Å
404	Q	84.8	Confident	84.9	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-60.2	-48.9	177.1	-73.5	-74.1	-5.5	0	0	111.3	L323 L330 Y341 K398 T401 N406 A407 L408	L323-Q404 PolarHBondContact O-NE2 2.97Å; L330-Q404 VanDerWaalsContact CD1-OE1 3.24Å; Y341-Q404 VanDerWaalsContact OH-CD 3.26Å; Y341-Q404 PolarHBondContact OH-NE2 3.16Å; Y341-Q404 PolarHBondContact OH-OE1 2.99Å; K398-Q404 WeakPolarHBondContact O-CG 3.41Å; T401-Q404 PolarHBondContact O-N 2.99Å; T401-Q404 WeakPolarHBondContact OG1-CB 3.4Å; T401-Q404 VanDerWaalsContact OG1-CG 3.28Å; T401-Q404 WeakPolarHBondContact OG1-CG 3.25Å; Q404-N406 PolarHBondContact O-N 2.75Å; Q404-A407 PolarHBondContact O-N 2.91Å; Q404-L408 WeakPolarHBondContact O-CG 3.47Å; Q404-L408 PolarHBondContact O-N 3.36Å
405	T	85.5	Confident	84	Confident	5 Å²	5	51 Å²	51	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-60.9	-44.8	179.3	52	0	0	0	0	112.4	L399 T401 K402 A407 L408 L409 R444 L445	L399-T405 WeakPolarHBondContact O-CG2 3.33Å; T401-T405 WeakPolarHBondContact O-CB 3.41Å; T401-T405 VanDerWaalsContact O-CG2 3.32Å; T401-T405 WeakPolarHBondContact O-CG2 3.46Å; T401-T405 PolarHBondContact O-N 3.43Å; T401-T405 PolarHBondContact O-OG1 3.21Å; K402-T405 WeakPolarHBondContact CA-OG1 3.42Å; K402-T405 PolarHBondContact O-OG1 2.89Å; K402-T405 VanDerWaalsContact O-OG1 3.13Å; T405-A407 VanDerWaalsContact C-N 3.35Å; T405-A407 PolarHBondContact O-N 2.94Å; T405-L408 PolarHBondContact O-N 3.27Å; T405-L409 WeakPolarHBondContact O-CB 3.08Å; T405-L409 WeakPolarHBondContact O-CG 3.1Å; T405-L409 PolarHBondContact O-N 3.29Å; T405-R444 HydrophobicContact CG2-CB 4.18Å; T405-L445 HydrophobicContact CG2-CB 3.94Å
406	N	85.3	Confident	83.1	Confident	65 Å²	65	55.5 Å²	55.5	35%	0.348	28%	0.275	S	S	.	.	H	α-helix	trans	-63.6	-38.6	175.5	-74.9	-14.3	0	0	0	112.8	K402 Q403 Q404 L409 N410	K402-N406 VanDerWaalsContact O-CB 3.24Å; K402-N406 WeakPolarHBondContact O-CB 3.27Å; K402-N406 PolarHBondContact O-N 3.3Å; K402-N406 PolarHBondContact O-ND2 3.49Å; Q403-N406 PolarHBondContact O-N 2.89Å; Q404-N406 PolarHBondContact O-N 2.75Å; N406-L409 PolarHBondContact O-N 3.27Å; N406-N410 VanDerWaalsContact O-CB 3.31Å; N406-N410 WeakPolarHBondContact O-CB 3.37Å; N406-N410 PolarHBondContact O-N 3.47Å; N406-N410 PolarHBondContact O-ND2 3.19Å
407	A	81.8	Confident	82.6	Confident	16 Å²	16	55.2 Å²	55.2	13%	0.132	28%	0.278	C	S	.	.	H	α-helix	trans	-63.4	-45.3	176.7	0	0	0	0	0	111.6	L330 Q403 Q404 T405 N410 L411	L330-A407 HydrophobicContact CB-CB 4.13Å; L330-A407 HydrophobicContact CD1-CB 3.85Å; L330-A407 HydrophobicContact CD2-CB 4.29Å; L330-A407 HydrophobicContact CG-CB 4.31Å; Q403-A407 WeakPolarHBondContact O-CB 3.35Å; Q403-A407 PolarHBondContact O-N 3.06Å; Q404-A407 PolarHBondContact O-N 2.91Å; T405-A407 VanDerWaalsContact C-N 3.35Å; T405-A407 PolarHBondContact O-N 2.94Å; A407-N410 PolarHBondContact O-N 3.28Å; A407-L411 PolarHBondContact O-N 3.1Å
408	L	85.4	Confident	82.3	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-64.5	-42.3	176.3	-67.9	176.4	0	0	0	112.2	Y341 L342 L345 Q404 T405 L411 M425 L445	Y341-L408 HydrophobicContact CE1-CD2 4.35Å; L342-L408 HydrophobicContact CD2-CD2 3.55Å; L345-L408 HydrophobicContact CD1-CD2 3.97Å; Q404-L408 WeakPolarHBondContact O-CG 3.47Å; Q404-L408 PolarHBondContact O-N 3.36Å; T405-L408 PolarHBondContact O-N 3.27Å; L408-L411 WeakPolarHBondContact O-CB 3.22Å; L408-L411 PolarHBondContact O-N 2.97Å; L408-M425 HydrophobicContact CB-CE 3.88Å; L408-M425 HydrophobicContact CD2-CE 4.17Å; L408-L445 HydrophobicContact CB-CD1 4.15Å; L408-L445 HydrophobicContact CD1-CD2 3.97Å
409	L	85.1	Confident	82.2	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-41	177.3	-73	170.5	0	0	0	112	T405 N406 L411 V412 W413 L445 L449	T405-L409 WeakPolarHBondContact O-CB 3.08Å; T405-L409 WeakPolarHBondContact O-CG 3.1Å; T405-L409 PolarHBondContact O-N 3.29Å; N406-L409 PolarHBondContact O-N 3.27Å; L409-L411 PolarHBondContact O-N 3.12Å; L409-V412 PolarHBondContact O-N 3.03Å; L409-W413 HydrophobicContact CB-CD2 4.08Å; L409-W413 HydrophobicContact CB-CE3 4.18Å; L409-W413 HydrophobicContact CB-CH2 3.8Å; L409-W413 HydrophobicContact CB-CZ2 3.65Å; L409-W413 HydrophobicContact CB-CZ3 4.05Å; L409-W413 HydrophobicContact CD1-CH2 3.82Å; L409-W413 HydrophobicContact CD1-CZ2 3.76Å; L409-W413 HydrophobicContact CD2-CZ2 3.85Å; L409-W413 HydrophobicContact CG-CH2 4.29Å; L409-W413 HydrophobicContact CG-CZ2 3.95Å; L409-W413 WeakPolarHBondContact O-CB 3.47Å; L409-W413 PolarHBondContact O-N 3.38Å; L409-L445 HydrophobicContact CD2-CD1 3.96Å; L409-L445 HydrophobicContact CG-CD1 3.99Å; L409-L449 HydrophobicContact CD2-CD2 3.58Å; L409-L449 HydrophobicContact CD2-CG 3.84Å
410	N	83.5	Confident	82.2	Confident	85 Å²	85	60.6 Å²	60.6	46%	0.455	31%	0.309	S	S	.	.	H	α-helix	trans	-60.5	-27.6	176.4	-77.7	-23.9	0	0	0	113	N406 A407 R414	N406-N410 VanDerWaalsContact O-CB 3.31Å; N406-N410 WeakPolarHBondContact O-CB 3.37Å; N406-N410 PolarHBondContact O-N 3.47Å; N406-N410 PolarHBondContact O-ND2 3.19Å; A407-N410 PolarHBondContact O-N 3.28Å; N410-R414 WeakPolarHBondContact O-CG 3.47Å
411	L	80.1	Confident	82.3	Confident	17 Å²	17	60.1 Å²	60.1	9%	0.089	31%	0.307	C	S	.	.	H	α-helix	trans	-71.1	-36.6	174.3	-67	170.5	0	0	0	112.1	H338 L342 A407 L408 L409 A417 V421	H338-L411 HydrophobicContact CB-CD1 4.01Å; H338-L411 HydrophobicContact CB-CD2 3.52Å; H338-L411 HydrophobicContact CB-CG 4.39Å; L342-L411 HydrophobicContact CD1-CD1 3.81Å; L342-L411 HydrophobicContact CD2-CD1 4.37Å; L342-L411 HydrophobicContact CG-CD1 4.02Å; A407-L411 PolarHBondContact O-N 3.1Å; L408-L411 WeakPolarHBondContact O-CB 3.22Å; L408-L411 PolarHBondContact O-N 2.97Å; L409-L411 PolarHBondContact O-N 3.12Å; L411-A417 WeakPolarHBondContact O-CB 3.43Å; L411-V421 HydrophobicContact CB-CG1 4.23Å
412	V	82.3	Confident	82.2	Confident	11 Å²	11	59.4 Å²	59.4	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-79.3	-29.8	180	177.4	0	0	0	0	111.9	L409 V421 F422 M425 L449 F455	L409-V412 PolarHBondContact O-N 3.03Å; V412-V421 HydrophobicContact CG2-CG1 4.47Å; V412-F422 HydrophobicContact CG1-CD1 4.38Å; V412-F422 HydrophobicContact CG1-CE1 3.84Å; V412-M425 HydrophobicContact CG2-CB 4.49Å; V412-M425 HydrophobicContact CG2-CE 3.86Å; V412-M425 HydrophobicContact CG2-CG 4.09Å; V412-L449 HydrophobicContact CG1-CD2 4.33Å; V412-F455 HydrophobicContact CG1-CB 4.33Å; V412-F455 HydrophobicContact CG1-CD2 3.3Å; V412-F455 HydrophobicContact CG1-CE2 3.85Å; V412-F455 HydrophobicContact CG1-CG 4.1Å
413	W	82.4	Confident	82.5	Confident	107 Å²	107	54.4 Å²	54.4	41%	0.405	28%	0.284	S	S	.	.	H	α-helix	trans	-82.9	-9.5	-176.1	-63.1	-13.5	0	0	0	114.5	L409 N452	L409-W413 HydrophobicContact CB-CD2 4.08Å; L409-W413 HydrophobicContact CB-CE3 4.18Å; L409-W413 HydrophobicContact CB-CH2 3.8Å; L409-W413 HydrophobicContact CB-CZ2 3.65Å; L409-W413 HydrophobicContact CB-CZ3 4.05Å; L409-W413 HydrophobicContact CD1-CH2 3.82Å; L409-W413 HydrophobicContact CD1-CZ2 3.76Å; L409-W413 HydrophobicContact CD2-CZ2 3.85Å; L409-W413 HydrophobicContact CG-CH2 4.29Å; L409-W413 HydrophobicContact CG-CZ2 3.95Å; L409-W413 WeakPolarHBondContact O-CB 3.47Å; L409-W413 PolarHBondContact O-N 3.38Å; W413-N452 PolarHBondContact NE1-ND2 3.38Å
414	R	80.5	Confident	82.8	Confident	105 Å²	105	49.4 Å²	49.4	40%	0.396	26%	0.261	S	S	.	.	S	Bend	trans	-69.9	133.4	175	-76.4	172.5	-172.2	-151.9	5.4	110.5	E335 N410 S416 A417	E335-R414 IonicContact OE1-NH1 3.2Å; E335-R414 PolarHBondContact OE1-NH1 3.15Å; N410-R414 WeakPolarHBondContact O-CG 3.47Å; R414-S416 PolarHBondContact O-N 3.18Å; R414-S416 VanDerWaalsContact O-N 3.14Å; R414-A417 WeakPolarHBondContact O-CB 3.23Å; R414-A417 PolarHBondContact O-N 3.49Å; R414-A417 VanDerWaalsContact O-N 3.15Å
415	D	69.3	Low	83	Confident	146 Å²	146	49.4 Å²	49.4	78%	0.781	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-16.6	177.2	-63.8	-39.4	0	0	0	113	R454	D415-R454 IonicContact OD1-CZ 3.11Å; D415-R454 IonicContact OD1-NH1 3.35Å; D415-R454 PolarHBondContact OD1-NH1 2.9Å
416	S	71.1	Confident	83.3	Confident	95 Å²	95	49.1 Å²	49.1	66%	0.664	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	10.7	177.1	59.3	0	0	0	0	114.7	R414 S418	R414-S416 PolarHBondContact O-N 3.18Å; R414-S416 VanDerWaalsContact O-N 3.14Å; S416-S418 PolarHBondContact O-N 3.11Å
417	A	77.1	Confident	83.5	Confident	27 Å²	27	47.2 Å²	47.2	22%	0.223	25%	0.251	C	S	.	.			trans	-61.7	130.4	-178	0	0	0	0	0	111.8	L411 R414 F422	L411-A417 WeakPolarHBondContact O-CB 3.43Å; R414-A417 WeakPolarHBondContact O-CB 3.23Å; R414-A417 PolarHBondContact O-N 3.49Å; R414-A417 VanDerWaalsContact O-N 3.15Å; A417-F422 HydrophobicContact CB-CE2 3.7Å; A417-F422 HydrophobicContact CB-CZ 4.11Å
418	S	81.6	Confident	83.9	Confident	55 Å²	55	46.5 Å²	46.5	39%	0.385	25%	0.245	S	C	.	.			trans	-74.8	155.5	178.6	66.6	0	0	0	0	111.9	S416 E420 V421 F422	S416-S418 PolarHBondContact O-N 3.11Å; S418-E420 PolarHBondContact O-N 2.98Å; S418-V421 WeakPolarHBondContact O-CB 3.31Å; S418-V421 PolarHBondContact O-N 3.35Å; S418-F422 WeakPolarHBondContact O-CD2 3.25Å
419	E	84.3	Confident	84.2	Confident	124 Å²	124	46.5 Å²	46.5	58%	0.579	25%	0.245	S	C	*	.	H	α-helix	trans	-55.5	-33.8	175.2	-65.9	-173.6	169	0	0	112.3	V421 F422 T423 L462	E419-V421 VanDerWaalsContact C-N 3.28Å; E419-V421 PolarHBondContact O-N 3.3Å; E419-F422 PolarHBondContact O-N 3.49Å; E419-T423 PolarHBondContact O-N 2.95Å; E419-T423 PolarHBondContact O-OG1 3.36Å; E419-L462 HydrophobicContact CB-CD2 4.15Å; E419-L462 HydrophobicContact CG-CD2 4.03Å
420	E	85.3	Confident	84.5	Confident	96 Å²	96	47.3 Å²	47.3	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-57.4	-38.5	176.4	-66.1	-172.7	-168.1	0	0	112.5	R343 S418 T423 M424	R343-E420 IonicContact NH2-OE2 2.66Å; R343-E420 PolarHBondContact NH2-OE2 2.99Å; S418-E420 PolarHBondContact O-N 2.98Å; E420-T423 WeakPolarHBondContact CA-OG1 3.41Å; E420-T423 PolarHBondContact O-N 3.04Å; E420-T423 PolarHBondContact O-OG1 3.49Å; E420-M424 HydrophobicContact CB-CE 4.37Å; E420-M424 WeakPolarHBondContact O-CB 3.41Å; E420-M424 WeakPolarHBondContact O-CE 3.48Å; E420-M424 VanDerWaalsContact O-CG 3.27Å; E420-M424 WeakPolarHBondContact O-CG 3.39Å; E420-M424 PolarHBondContact O-N 3.13Å
421	V	87.8	Confident	84.7	Confident	13 Å²	13	43.9 Å²	43.9	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-43.6	179	173	0	0	0	0	110.6	L339 L342 L411 V412 S418 E419 M425	L339-V421 HydrophobicContact CD1-CG2 3.98Å; L342-V421 HydrophobicContact CD1-CB 4.46Å; L342-V421 HydrophobicContact CD1-CG1 3.91Å; L342-V421 HydrophobicContact CD1-CG2 4.3Å; L411-V421 HydrophobicContact CB-CG1 4.23Å; V412-V421 HydrophobicContact CG2-CG1 4.47Å; S418-V421 WeakPolarHBondContact O-CB 3.31Å; S418-V421 PolarHBondContact O-N 3.35Å; E419-V421 VanDerWaalsContact C-N 3.28Å; E419-V421 PolarHBondContact O-N 3.3Å; V421-M425 VanDerWaalsContact O-CB 3.25Å; V421-M425 WeakPolarHBondContact O-CB 3.39Å; V421-M425 PolarHBondContact O-N 2.98Å
422	F	87.2	Confident	85.1	Confident	11 Å²	11	43.3 Å²	43.3	5%	0.048	23%	0.228	C	C	.	.	H	α-helix	trans	-66.5	-40.5	178.5	-67.9	-88.4	0	0	0	111.8	V412 A417 S418 E419 A426 F455 H458 L462	V412-F422 HydrophobicContact CG1-CD1 4.38Å; V412-F422 HydrophobicContact CG1-CE1 3.84Å; A417-F422 HydrophobicContact CB-CE2 3.7Å; A417-F422 HydrophobicContact CB-CZ 4.11Å; S418-F422 WeakPolarHBondContact O-CD2 3.25Å; E419-F422 PolarHBondContact O-N 3.49Å; F422-A426 WeakPolarHBondContact O-CB 3.44Å; F422-A426 PolarHBondContact O-N 3.17Å; F422-F455 AromaticContact CD1-CD2 3.65Å; F422-F455 HydrophobicContact CD1-CD2 3.65Å; F422-F455 AromaticContact CD1-CE2 3.75Å; F422-F455 HydrophobicContact CD1-CE2 3.75Å; F422-F455 AromaticContact CE1-CD2 3.79Å; F422-F455 HydrophobicContact CE1-CD2 3.79Å; F422-F455 HydrophobicContact CE1-CE2 4.32Å; F422-H458 HydrophobicContact CD1-CB 4.03Å; F422-H458 HydrophobicContact CE1-CB 3.85Å; F422-H458 HydrophobicContact CZ-CB 4.31Å; F422-L462 HydrophobicContact CB-CD1 3.67Å
423	T	88.8	Confident	85.3	Confident	48 Å²	48	43.7 Å²	43.7	29%	0.294	23%	0.229	S	C	.	.	H	α-helix	trans	-66.3	-43.2	178	53.3	0	0	0	0	112.3	E419 E420 A426 S427 L462 L499	E419-T423 PolarHBondContact O-N 2.95Å; E419-T423 PolarHBondContact O-OG1 3.36Å; E420-T423 WeakPolarHBondContact CA-OG1 3.41Å; E420-T423 PolarHBondContact O-N 3.04Å; E420-T423 PolarHBondContact O-OG1 3.49Å; T423-A426 PolarHBondContact O-N 3.06Å; T423-S427 PolarHBondContact O-N 3Å; T423-L462 HydrophobicContact CG2-CD1 4.33Å; T423-L499 HydrophobicContact CG2-CD1 4.44Å
424	M	89.6	Confident	85.3	Confident	8 Å²	8	39.9 Å²	39.9	4%	0.039	22%	0.218	C	C	.	.	H	α-helix	trans	-66.5	-43.4	176.9	-68.9	-171.8	-72.1	0	0	111.3	L339 L342 R343 E346 E420 A426 S427 I428	L339-M424 HydrophobicContact CD1-CE 3.33Å; L339-M424 HydrophobicContact CG-CE 4.1Å; L342-M424 HydrophobicContact CB-CE 3.91Å; L342-M424 HydrophobicContact CB-SD 4.08Å; L342-M424 HydrophobicContact CD1-CE 4.18Å; R343-M424 HydrophobicContact CB-SD 4.34Å; R343-M424 HydrophobicContact CG-CE 4.39Å; R343-M424 HydrophobicContact CG-SD 3.41Å; R343-M424 WeakPolarHBondContact CG-SD 3.38Å; E346-M424 WeakPolarHBondContact OE2-CG 3.44Å; E420-M424 HydrophobicContact CB-CE 4.37Å; E420-M424 WeakPolarHBondContact O-CB 3.41Å; E420-M424 WeakPolarHBondContact O-CE 3.48Å; E420-M424 VanDerWaalsContact O-CG 3.27Å; E420-M424 WeakPolarHBondContact O-CG 3.39Å; E420-M424 PolarHBondContact O-N 3.13Å; M424-A426 PolarHBondContact O-N 3.1Å; M424-S427 WeakPolarHBondContact O-CB 3.4Å; M424-S427 PolarHBondContact O-N 2.71Å; M424-I428 VanDerWaalsContact O-CG1 3.3Å; M424-I428 WeakPolarHBondContact O-CG1 3.33Å; M424-I428 PolarHBondContact O-N 2.9Å
425	M	90.1	Very high	85.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.6	-40.4	175.1	-171.2	59.1	65.7	0	0	111.2	L342 L408 V412 V421 C429 L445 L449 F455	L342-M425 HydrophobicContact CD2-CE 4Å; L408-M425 HydrophobicContact CB-CE 3.88Å; L408-M425 HydrophobicContact CD2-CE 4.17Å; V412-M425 HydrophobicContact CG2-CB 4.49Å; V412-M425 HydrophobicContact CG2-CE 3.86Å; V412-M425 HydrophobicContact CG2-CG 4.09Å; V421-M425 VanDerWaalsContact O-CB 3.25Å; V421-M425 WeakPolarHBondContact O-CB 3.39Å; V421-M425 PolarHBondContact O-N 2.98Å; M425-C429 WeakPolarHBondContact O-CB 3.4Å; M425-C429 PolarHBondContact O-N 3.2Å; M425-C429 PolarHBondContact O-SG 2.98Å; M425-L445 HydrophobicContact SD-CD2 4.25Å; M425-L449 HydrophobicContact CG-CD1 4.25Å; M425-L449 HydrophobicContact SD-CD1 4.46Å; M425-F455 HydrophobicContact CG-CE2 4.3Å; M425-F455 HydrophobicContact CG-CZ 4.17Å
426	A	90	Very high	86.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.6	-41.5	177.2	0	0	0	0	0	113	F422 T423 M424 H430 L459 L499 L502	F422-A426 WeakPolarHBondContact O-CB 3.44Å; F422-A426 PolarHBondContact O-N 3.17Å; T423-A426 PolarHBondContact O-N 3.06Å; M424-A426 PolarHBondContact O-N 3.1Å; A426-H430 WeakPolarHBondContact O-CB 3.42Å; A426-H430 PolarHBondContact O-N 3.05Å; A426-L459 HydrophobicContact CB-CD2 4.17Å; A426-L499 HydrophobicContact CB-CD2 3.49Å; A426-L499 VanDerWaalsContact CB-CD2 3.49Å; A426-L499 HydrophobicContact CB-CG 4.22Å; A426-L502 HydrophobicContact CB-CD2 3.94Å
427	S	90.3	Very high	86.6	Confident	25 Å²	25	34.8 Å²	34.8	18%	0.175	18%	0.176	C	C	.	.	H	α-helix	trans	-61.9	-46.3	175.7	-170.6	0	0	0	0	112.3	E346 T423 M424 H430 T431	E346-S427 WeakPolarHBondContact OE1-CB 3.46Å; E346-S427 PolarHBondContact OE1-OG 3.15Å; T423-S427 PolarHBondContact O-N 3Å; M424-S427 WeakPolarHBondContact O-CB 3.4Å; M424-S427 PolarHBondContact O-N 2.71Å; S427-H430 PolarHBondContact O-N 3.13Å; S427-T431 WeakPolarHBondContact O-CB 3.14Å; S427-T431 PolarHBondContact O-N 2.98Å; S427-T431 PolarHBondContact O-OG1 3.18Å
428	I	90.8	Very high	86.9	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-60.4	-52.9	176.1	-67.2	164.3	0	0	0	110.2	L342 L345 E346 L349 M424 H430 T431 L432	L342-I428 HydrophobicContact CD2-CD1 4.05Å; L345-I428 HydrophobicContact CB-CD1 3.73Å; L345-I428 HydrophobicContact CB-CG1 4.28Å; L345-I428 HydrophobicContact CD1-CD1 4.36Å; E346-I428 HydrophobicContact CB-CG1 4.23Å; L349-I428 HydrophobicContact CD2-CG2 3.93Å; M424-I428 VanDerWaalsContact O-CG1 3.3Å; M424-I428 WeakPolarHBondContact O-CG1 3.33Å; M424-I428 PolarHBondContact O-N 2.9Å; I428-H430 PolarHBondContact O-N 3.25Å; I428-T431 WeakPolarHBondContact O-CB 3.43Å; I428-T431 PolarHBondContact O-N 3.3Å; I428-T431 VanDerWaalsContact O-N 3.17Å; I428-L432 HydrophobicContact CG2-CD1 4.43Å; I428-L432 WeakPolarHBondContact O-CG 3.06Å; I428-L432 PolarHBondContact O-N 2.97Å
429	C	91.2	Very high	86.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.2	-41	-178.9	-69	0	0	0	0	112.2	M425 T431 L432 M433 L446 L502	M425-C429 WeakPolarHBondContact O-CB 3.4Å; M425-C429 PolarHBondContact O-N 3.2Å; M425-C429 PolarHBondContact O-SG 2.98Å; C429-T431 VanDerWaalsContact C-N 3.32Å; C429-T431 PolarHBondContact O-N 2.65Å; C429-L432 PolarHBondContact O-N 2.86Å; C429-M433 VanDerWaalsContact O-CG 3.28Å; C429-M433 WeakPolarHBondContact O-CG 3.47Å; C429-M433 PolarHBondContact O-N 3.17Å; C429-L446 HydrophobicContact CB-CD2 3.59Å; C429-L502 HydrophobicContact CB-CD1 3.59Å; C429-L502 HydrophobicContact CB-CD2 3.8Å; C429-L502 HydrophobicContact CB-CG 4.35Å
430	H	90.6	Very high	86.5	Confident	19 Å²	19	33 Å²	33	9%	0.088	16%	0.16	C	C	.	.	H	α-helix	trans	-60.1	-42.4	174.2	171.2	-93	0	0	0	111.7	A426 S427 I428 M433 V434 P498 Y501	A426-H430 WeakPolarHBondContact O-CB 3.42Å; A426-H430 PolarHBondContact O-N 3.05Å; S427-H430 PolarHBondContact O-N 3.13Å; I428-H430 PolarHBondContact O-N 3.25Å; H430-M433 PolarHBondContact O-N 3.43Å; H430-V434 WeakPolarHBondContact O-CB 3.45Å; H430-V434 WeakPolarHBondContact O-CG2 3.03Å; H430-V434 PolarHBondContact O-N 3.39Å; H430-P498 HydrophobicContact CB-CB 3.74Å; H430-Y501 AromaticContact CD2-CD1 3.7Å; H430-Y501 AromaticContact CD2-CG 3.68Å
431	T	88.4	Confident	86	Confident	13 Å²	13	32.1 Å²	32.1	8%	0.08	16%	0.163	C	C	.	.	H	α-helix	trans	-63.3	-43.6	177.3	-55.7	0	0	0	0	111.3	L349 P350 S427 I428 C429 M433 Q435 H436	L349-T431 HydrophobicContact CD2-CG2 3.97Å; L349-T431 HydrophobicContact CG-CG2 3.82Å; P350-T431 HydrophobicContact CB-CG2 4.3Å; P350-T431 HydrophobicContact CG-CG2 4.1Å; S427-T431 WeakPolarHBondContact O-CB 3.14Å; S427-T431 PolarHBondContact O-N 2.98Å; S427-T431 PolarHBondContact O-OG1 3.18Å; I428-T431 WeakPolarHBondContact O-CB 3.43Å; I428-T431 PolarHBondContact O-N 3.3Å; I428-T431 VanDerWaalsContact O-N 3.17Å; C429-T431 VanDerWaalsContact C-N 3.32Å; C429-T431 PolarHBondContact O-N 2.65Å; T431-M433 VanDerWaalsContact C-N 3.33Å; T431-M433 PolarHBondContact O-N 2.93Å; T431-Q435 HydrophobicContact CG2-CB 4.11Å; T431-Q435 VanDerWaalsContact O-CB 3.32Å; T431-Q435 WeakPolarHBondContact O-CB 3.49Å; T431-Q435 PolarHBondContact O-N 3.4Å; T431-H436 PolarHBondContact O-N 3.01Å
432	L	87.6	Confident	85.5	Confident	5 Å²	5	39 Å²	39	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-57.7	-43.8	173.7	-68.7	176.8	0	0	0	112.3	L349 L399 I428 C429 H436 R437 L438	L349-L432 HydrophobicContact CD1-CD2 4.06Å; L349-L432 HydrophobicContact CD2-CD2 3.88Å; L349-L432 HydrophobicContact CD2-CG 3.94Å; L399-L432 HydrophobicContact CD1-CD2 4.17Å; I428-L432 HydrophobicContact CG2-CD1 4.43Å; I428-L432 WeakPolarHBondContact O-CG 3.06Å; I428-L432 PolarHBondContact O-N 2.97Å; C429-L432 PolarHBondContact O-N 2.86Å; L432-H436 CarbonylContact O-C 3.32Å; L432-H436 WeakPolarHBondContact O-CB 3.23Å; L432-R437 PolarHBondContact O-N 2.81Å; L432-L438 HydrophobicContact CB-CD1 4.17Å; L432-L438 HydrophobicContact CD2-CD1 3.97Å; L432-L438 WeakPolarHBondContact O-CB 3.4Å; L432-L438 PolarHBondContact O-N 3.15Å
433	M	86.4	Confident	85.3	Confident	19 Å²	19	39 Å²	39	9%	0.094	19%	0.193	C	C	.	.	H	α-helix	trans	-75.4	-40.3	-177.3	-66.8	-178.6	70.7	0	0	113.5	C429 H430 T431 R437 V440 L446 Y501 L502 S505	C429-M433 VanDerWaalsContact O-CG 3.28Å; C429-M433 WeakPolarHBondContact O-CG 3.47Å; C429-M433 PolarHBondContact O-N 3.17Å; H430-M433 PolarHBondContact O-N 3.43Å; T431-M433 VanDerWaalsContact C-N 3.33Å; T431-M433 PolarHBondContact O-N 2.93Å; M433-R437 VanDerWaalsContact O-CA 3.26Å; M433-R437 WeakPolarHBondContact O-CA 3.5Å; M433-R437 PolarHBondContact O-N 3.35Å; M433-V440 HydrophobicContact CE-CG2 3.66Å; M433-V440 HydrophobicContact SD-CG2 4.4Å; M433-L446 HydrophobicContact CG-CD1 3.56Å; M433-L446 HydrophobicContact CG-CD2 4.34Å; M433-L446 HydrophobicContact SD-CD1 4.1Å; M433-L446 HydrophobicContact SD-CD2 4.19Å; M433-Y501 HydrophobicContact CB-CE1 3.9Å; M433-Y501 HydrophobicContact CE-CE1 3.9Å; M433-Y501 HydrophobicContact SD-CE1 4.18Å; M433-L502 HydrophobicContact SD-CD1 3.91Å; M433-S505 WeakPolarHBondContact CE-OG 3.42Å
434	V	84.3	Confident	85.2	Confident	28 Å²	28	43.2 Å²	43.2	17%	0.17	20%	0.203	C	C	.	.	H	α-helix	trans	-93.8	-47.7	-171	177.6	0	0	0	0	112.5	H430 Y501	H430-V434 WeakPolarHBondContact O-CB 3.45Å; H430-V434 WeakPolarHBondContact O-CG2 3.03Å; H430-V434 PolarHBondContact O-N 3.39Å; V434-Y501 HydrophobicContact CG2-CD1 4.15Å; V434-Y501 HydrophobicContact CG2-CD2 4.35Å; V434-Y501 HydrophobicContact CG2-CE1 3.64Å; V434-Y501 HydrophobicContact CG2-CE2 3.87Å; V434-Y501 HydrophobicContact CG2-CG 4.49Å; V434-Y501 VanDerWaalsContact CG2-CZ 3.5Å
435	Q	83.3	Confident	85.1	Confident	56 Å²	56	43.1 Å²	43.1	26%	0.262	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-48.4	-177.6	179	167.9	-16.2	0	0	111.1	P350 L352 V354 T431	P350-Q435 PolarHBondContact O-NE2 3.07Å; P350-Q435 PolarHBondContact O-OE1 3.39Å; L352-Q435 PolarHBondContact O-NE2 3.29Å; V354-Q435 HydrophobicContact CG2-CG 3.81Å; T431-Q435 HydrophobicContact CG2-CB 4.11Å; T431-Q435 VanDerWaalsContact O-CB 3.32Å; T431-Q435 WeakPolarHBondContact O-CB 3.49Å; T431-Q435 PolarHBondContact O-N 3.4Å
436	H	81.4	Confident	85	Confident	19 Å²	19	43.1 Å²	43.1	9%	0.088	20%	0.203	C	C	.	.	S	Bend	trans	-90.6	0.8	179.8	-64.1	-73.3	0	0	0	114.1	I396 T431 L432 L438	I396-H436 HydrophobicContact CD1-CB 4.28Å; T431-H436 PolarHBondContact O-N 3.01Å; L432-H436 CarbonylContact O-C 3.32Å; L432-H436 WeakPolarHBondContact O-CB 3.23Å; H436-L438 HydrophobicContact CB-CD1 4.34Å; H436-L438 HydrophobicContact CB-CG 4.08Å; H436-L438 PolarHBondContact O-N 3.48Å; H436-L438 VanDerWaalsContact O-N 3.15Å
437	R	82.9	Confident	84.8	Confident	164 Å²	164	48.5 Å²	48.5	62%	0.619	22%	0.224	S	C	*	.			trans	54.9	30.5	175.4	-56.2	-176.7	-176.1	179.1	4.2	114.1	L432 M433	L432-R437 PolarHBondContact O-N 2.81Å; M433-R437 VanDerWaalsContact O-CA 3.26Å; M433-R437 WeakPolarHBondContact O-CA 3.5Å; M433-R437 PolarHBondContact O-N 3.35Å
438	L	82.4	Confident	84.6	Confident	41 Å²	41	49.4 Å²	49.4	22%	0.215	23%	0.23	C	C	.	.			trans	-77.9	130.2	179.5	-59.3	177.6	0	0	0	110.6	I396 L432 H436 V443	I396-L438 HydrophobicContact CG2-CD1 3.73Å; I396-L438 HydrophobicContact CG2-CD2 4.39Å; L432-L438 HydrophobicContact CB-CD1 4.17Å; L432-L438 HydrophobicContact CD2-CD1 3.97Å; L432-L438 WeakPolarHBondContact O-CB 3.4Å; L432-L438 PolarHBondContact O-N 3.15Å; H436-L438 HydrophobicContact CB-CD1 4.34Å; H436-L438 HydrophobicContact CB-CG 4.08Å; H436-L438 PolarHBondContact O-N 3.48Å; H436-L438 VanDerWaalsContact O-N 3.15Å; L438-V443 HydrophobicContact CB-CG2 3.71Å; L438-V443 HydrophobicContact CD1-CG2 3.92Å; L438-V443 HydrophobicContact CG-CG2 4.31Å
439	M	78.7	Confident	84.5	Confident	116 Å²	116	49.4 Å²	49.4	57%	0.571	23%	0.23	S	C	*	.			trans	-85.9	143.4	177.8	-57.5	-170	81.2	0	0	110.6	P441 K442	M439-P441 HydrophobicContact CB-CG 4.45Å; M439-K442 HydrophobicContact CB-CG 4.49Å; M439-K442 PolarHBondContact O-N 3.22Å
440	V	80.5	Confident	84.3	Confident	11 Å²	11	49.4 Å²	49.4	7%	0.067	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-45	-50.7	179.2	-178.2	0	0	0	0	114.1	M433 K442 V443 L446 A450 L506 H509	M433-V440 HydrophobicContact CE-CG2 3.66Å; M433-V440 HydrophobicContact SD-CG2 4.4Å; V440-K442 PolarHBondContact O-N 3.21Å; V440-V443 PolarHBondContact O-N 2.93Å; V440-L446 HydrophobicContact CB-CB 4.46Å; V440-L446 HydrophobicContact CG1-CB 4.12Å; V440-A450 HydrophobicContact CG1-CB 4.22Å; V440-L506 HydrophobicContact CG1-CD2 4.1Å; V440-L506 HydrophobicContact CG2-CD2 4.27Å; V440-H509 HydrophobicContact CB-CB 4.44Å; V440-H509 HydrophobicContact CG1-CB 4.03Å; V440-H509 VanDerWaalsContact CG1-CD2 3.4Å; V440-H509 WeakPolarHBondContact CG1-CD2 3.4Å
441	P	74.4	Confident	84	Confident	78 Å²	78	51.1 Å²	51.1	51%	0.506	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-70.4	-13.7	-177.1	27.6	-36.7	0	0	0	114.5	M439	M439-P441 HydrophobicContact CB-CG 4.45Å
442	K	76.4	Confident	83.9	Confident	158 Å²	158	52 Å²	52	69%	0.687	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-91.5	-10.9	-178.4	-65.8	-172.4	176.9	-176.8	0	113.4	M439 V440	M439-K442 HydrophobicContact CB-CG 4.49Å; M439-K442 PolarHBondContact O-N 3.22Å; V440-K442 PolarHBondContact O-N 3.21Å
443	V	83.8	Confident	83.9	Confident	11 Å²	11	53.3 Å²	53.3	7%	0.067	25%	0.253	C	S	.	.			trans	-120.8	120.6	-176.8	-178.5	0	0	0	0	108.9	D400 L438 V440 L445 L446 Y447	D400-V443 WeakPolarHBondContact OD1-CA 3.31Å; D400-V443 WeakPolarHBondContact OD1-CG1 3.42Å; L438-V443 HydrophobicContact CB-CG2 3.71Å; L438-V443 HydrophobicContact CD1-CG2 3.92Å; L438-V443 HydrophobicContact CG-CG2 4.31Å; V440-V443 PolarHBondContact O-N 2.93Å; V443-L445 VanDerWaalsContact C-N 3.3Å; V443-L445 HydrophobicContact CG1-CB 4.21Å; V443-L445 PolarHBondContact O-N 2.99Å; V443-L446 HydrophobicContact CB-CB 4.21Å; V443-L446 HydrophobicContact CB-CD1 4.01Å; V443-L446 HydrophobicContact CB-CG 4.08Å; V443-L446 HydrophobicContact CG1-CB 4.45Å; V443-L446 HydrophobicContact CG1-CD1 4.34Å; V443-L446 HydrophobicContact CG1-CG 4.05Å; V443-L446 HydrophobicContact CG2-CD1 4.22Å; V443-L446 PolarHBondContact O-N 2.99Å; V443-Y447 WeakPolarHBondContact O-CB 3.17Å; V443-Y447 PolarHBondContact O-N 2.97Å
444	R	85.6	Confident	83.9	Confident	136 Å²	136	59.8 Å²	59.8	51%	0.513	28%	0.277	S	S	.	.	H	α-helix	trans	-58.1	-39.6	-177.3	-66.2	-178.7	176.5	86.9	-1.8	112.5	D400 T405 S448	D400-R444 WeakPolarHBondContact O-CD 3.34Å; D400-R444 PolarHBondContact O-NH1 3.29Å; D400-R444 VanDerWaalsContact O-NH1 3.14Å; D400-R444 WeakPolarHBondContact OD1-CB 3.36Å; D400-R444 PolarHBondContact OD1-N 3.33Å; D400-R444 IonicContact OD2-CZ 3.82Å; D400-R444 IonicContact OD2-NH1 3.66Å; D400-R444 PolarHBondContact OD2-NH1 3.18Å; T405-R444 HydrophobicContact CG2-CB 4.18Å; R444-S448 VanDerWaalsContact O-CB 3.3Å; R444-S448 WeakPolarHBondContact O-CB 3.38Å; R444-S448 PolarHBondContact O-N 2.73Å; R444-S448 PolarHBondContact O-OG 3.03Å
445	L	87.3	Confident	84.1	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-54.3	176.9	-178.6	62.6	0	0	0	111.2	T405 L408 L409 M425 V443 S448 L449	T405-L445 HydrophobicContact CG2-CB 3.94Å; L408-L445 HydrophobicContact CB-CD1 4.15Å; L408-L445 HydrophobicContact CD1-CD2 3.97Å; L409-L445 HydrophobicContact CD2-CD1 3.96Å; L409-L445 HydrophobicContact CG-CD1 3.99Å; M425-L445 HydrophobicContact SD-CD2 4.25Å; V443-L445 VanDerWaalsContact C-N 3.3Å; V443-L445 HydrophobicContact CG1-CB 4.21Å; V443-L445 PolarHBondContact O-N 2.99Å; L445-S448 PolarHBondContact O-N 3.23Å; L445-L449 HydrophobicContact CD1-CD1 4.02Å; L445-L449 HydrophobicContact CD1-CG 4.33Å; L445-L449 HydrophobicContact CG-CD1 4.01Å; L445-L449 WeakPolarHBondContact O-CB 3.3Å; L445-L449 VanDerWaalsContact O-CG 3.3Å; L445-L449 WeakPolarHBondContact O-CG 3.24Å; L445-L449 PolarHBondContact O-N 3.41Å
446	L	87.9	Confident	84.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.9	-43.9	-178.2	-63.4	178.2	0	0	0	111.4	C429 M433 V440 V443 L449 A450 L502 L506	C429-L446 HydrophobicContact CB-CD2 3.59Å; M433-L446 HydrophobicContact CG-CD1 3.56Å; M433-L446 HydrophobicContact CG-CD2 4.34Å; M433-L446 HydrophobicContact SD-CD1 4.1Å; M433-L446 HydrophobicContact SD-CD2 4.19Å; V440-L446 HydrophobicContact CB-CB 4.46Å; V440-L446 HydrophobicContact CG1-CB 4.12Å; V443-L446 HydrophobicContact CB-CB 4.21Å; V443-L446 HydrophobicContact CB-CD1 4.01Å; V443-L446 HydrophobicContact CB-CG 4.08Å; V443-L446 HydrophobicContact CG1-CB 4.45Å; V443-L446 HydrophobicContact CG1-CD1 4.34Å; V443-L446 HydrophobicContact CG1-CG 4.05Å; V443-L446 HydrophobicContact CG2-CD1 4.22Å; V443-L446 PolarHBondContact O-N 2.99Å; L446-L449 PolarHBondContact O-N 3.05Å; L446-A450 PolarHBondContact O-N 2.91Å; L446-L502 HydrophobicContact CD2-CD1 4.22Å; L446-L506 HydrophobicContact CB-CD2 4.42Å; L446-L506 WeakPolarHBondContact O-CD2 3.29Å
447	Y	86.8	Confident	85	Confident	114 Å²	114	59.7 Å²	59.7	45%	0.447	27%	0.27	S	S	.	.	H	α-helix	trans	-56.9	-51.3	175.2	-177.4	-97.4	0	0	0	110.9	V443 L449 A450 F451 H509	V443-Y447 WeakPolarHBondContact O-CB 3.17Å; V443-Y447 PolarHBondContact O-N 2.97Å; Y447-L449 VanDerWaalsContact C-N 3.34Å; Y447-L449 PolarHBondContact O-N 3.47Å; Y447-A450 WeakPolarHBondContact O-CB 3.3Å; Y447-A450 PolarHBondContact O-N 3.47Å; Y447-A450 VanDerWaalsContact O-N 3.16Å; Y447-F451 AromaticContact CD2-CE2 3.92Å; Y447-F451 HydrophobicContact CD2-CE2 3.92Å; Y447-F451 HydrophobicContact CE1-CD2 4.31Å; Y447-F451 HydrophobicContact CE1-CE2 4.15Å; Y447-F451 HydrophobicContact CE2-CD2 4.35Å; Y447-F451 AromaticContact CE2-CE2 3.48Å; Y447-F451 HydrophobicContact CE2-CE2 3.48Å; Y447-F451 VanDerWaalsContact CE2-CE2 3.48Å; Y447-F451 HydrophobicContact CE2-CZ 4.21Å; Y447-F451 HydrophobicContact CG-CE2 4.43Å; Y447-F451 AromaticContact CZ-CE2 3.61Å; Y447-F451 VanDerWaalsContact O-CD2 3.25Å; Y447-F451 WeakPolarHBondContact O-CD2 3.27Å; Y447-H509 AromaticContact CD2-NE2 3.72Å; Y447-H509 AromaticContact CE2-NE2 3.96Å
448	S	86.4	Confident	85.3	Confident	44 Å²	44	56.3 Å²	56.3	31%	0.308	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-37	-178.9	-54.7	0	0	0	0	112.9	R444 L445	R444-S448 VanDerWaalsContact O-CB 3.3Å; R444-S448 WeakPolarHBondContact O-CB 3.38Å; R444-S448 PolarHBondContact O-N 2.73Å; R444-S448 PolarHBondContact O-OG 3.03Å; L445-S448 PolarHBondContact O-N 3.23Å
449	L	87.9	Confident	85.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.7	-31.9	175.8	-71.3	173.4	0	0	0	112.6	L409 V412 M425 L445 L446 Y447 F451 N452 F455 L506	L409-L449 HydrophobicContact CD2-CD2 3.58Å; L409-L449 HydrophobicContact CD2-CG 3.84Å; V412-L449 HydrophobicContact CG1-CD2 4.33Å; M425-L449 HydrophobicContact CG-CD1 4.25Å; M425-L449 HydrophobicContact SD-CD1 4.46Å; L445-L449 HydrophobicContact CD1-CD1 4.02Å; L445-L449 HydrophobicContact CD1-CG 4.33Å; L445-L449 HydrophobicContact CG-CD1 4.01Å; L445-L449 WeakPolarHBondContact O-CB 3.3Å; L445-L449 VanDerWaalsContact O-CG 3.3Å; L445-L449 WeakPolarHBondContact O-CG 3.24Å; L445-L449 PolarHBondContact O-N 3.41Å; L446-L449 PolarHBondContact O-N 3.05Å; Y447-L449 VanDerWaalsContact C-N 3.34Å; Y447-L449 PolarHBondContact O-N 3.47Å; L449-F451 VanDerWaalsContact C-N 3.26Å; L449-F451 PolarHBondContact O-N 3.41Å; L449-N452 PolarHBondContact O-N 2.91Å; L449-F455 HydrophobicContact CB-CD1 3.97Å; L449-F455 HydrophobicContact CB-CE1 3.97Å; L449-F455 HydrophobicContact CD1-CE1 4Å; L449-F455 HydrophobicContact CD1-CZ 4.16Å; L449-F455 HydrophobicContact CD2-CD1 3.83Å; L449-F455 HydrophobicContact CD2-CD2 4.21Å; L449-F455 HydrophobicContact CD2-CE1 3.92Å; L449-F455 HydrophobicContact CD2-CE2 4.29Å; L449-F455 HydrophobicContact CD2-CG 3.97Å; L449-F455 HydrophobicContact CD2-CZ 4.15Å; L449-F455 HydrophobicContact CG-CD1 4.36Å; L449-F455 HydrophobicContact CG-CE1 4.18Å; L449-L506 HydrophobicContact CB-CD1 3.97Å
450	A	86.7	Confident	86.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-31.4	178.8	0	0	0	0	0	113.3	V440 L446 Y447 L506 S510	V440-A450 HydrophobicContact CG1-CB 4.22Å; L446-A450 PolarHBondContact O-N 2.91Å; Y447-A450 WeakPolarHBondContact O-CB 3.3Å; Y447-A450 PolarHBondContact O-N 3.47Å; Y447-A450 VanDerWaalsContact O-N 3.16Å; A450-L506 HydrophobicContact CB-CB 4.25Å; A450-L506 HydrophobicContact CB-CD2 3.96Å; A450-S510 WeakPolarHBondContact O-CB 3.45Å
451	F	85.4	Confident	87.2	Confident	56 Å²	56	54.8 Å²	54.8	25%	0.246	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	2.1	179	-67.4	-84	0	0	0	113.6	Y447 L449 A453 S513 M532	Y447-F451 AromaticContact CD2-CE2 3.92Å; Y447-F451 HydrophobicContact CD2-CE2 3.92Å; Y447-F451 HydrophobicContact CE1-CD2 4.31Å; Y447-F451 HydrophobicContact CE1-CE2 4.15Å; Y447-F451 HydrophobicContact CE2-CD2 4.35Å; Y447-F451 AromaticContact CE2-CE2 3.48Å; Y447-F451 HydrophobicContact CE2-CE2 3.48Å; Y447-F451 VanDerWaalsContact CE2-CE2 3.48Å; Y447-F451 HydrophobicContact CE2-CZ 4.21Å; Y447-F451 HydrophobicContact CG-CE2 4.43Å; Y447-F451 AromaticContact CZ-CE2 3.61Å; Y447-F451 VanDerWaalsContact O-CD2 3.25Å; Y447-F451 WeakPolarHBondContact O-CD2 3.27Å; L449-F451 VanDerWaalsContact C-N 3.26Å; L449-F451 PolarHBondContact O-N 3.41Å; F451-A453 PolarHBondContact O-N 2.71Å; F451-S513 WeakPolarHBondContact CE1-OG 3.34Å; F451-M532 HydrophobicContact CD1-CE 4.34Å
452	N	86.5	Confident	88	Confident	32 Å²	32	51.5 Å²	51.5	17%	0.171	23%	0.227	C	C	.	.			trans	-91.3	102.2	177.2	-169.6	-50.7	0	0	0	111.1	W413 L449 R454 F455 L456	W413-N452 PolarHBondContact NE1-ND2 3.38Å; L449-N452 PolarHBondContact O-N 2.91Å; N452-R454 VanDerWaalsContact C-N 3.31Å; N452-R454 PolarHBondContact O-N 3.18Å; N452-R454 WeakPolarHBondContact OD1-CB 3.48Å; N452-R454 PolarHBondContact OD1-N 2.77Å; N452-F455 HydrophobicContact CB-CB 3.99Å; N452-F455 PolarHBondContact O-N 3.05Å; N452-F455 PolarHBondContact OD1-N 2.99Å; N452-L456 PolarHBondContact O-N 3.39Å; N452-L456 VanDerWaalsContact O-N 3.17Å
453	A	86.2	Confident	88.8	Confident	32 Å²	32	44 Å²	44	26%	0.264	20%	0.195	S	C	.	.	H	α-helix	trans	-59.2	-37.9	-179.9	0	0	0	0	0	113.7	F451 L456 R457 P534	F451-A453 PolarHBondContact O-N 2.71Å; A453-L456 PolarHBondContact O-N 2.88Å; A453-R457 VanDerWaalsContact O-CG 3.31Å; A453-R457 WeakPolarHBondContact O-CG 3.33Å; A453-R457 PolarHBondContact O-N 2.88Å; A453-P534 HydrophobicContact CB-CB 3.98Å
454	R	86.7	Confident	89.2	Confident	154 Å²	154	46 Å²	46	58%	0.581	21%	0.207	S	C	*	.	H	α-helix	trans	-64.6	-42.9	179.2	-63.9	-178.1	177.8	-168.9	-4.4	111.2	D415 N452 R457 H458	D415-R454 IonicContact OD1-CZ 3.11Å; D415-R454 IonicContact OD1-NH1 3.35Å; D415-R454 PolarHBondContact OD1-NH1 2.9Å; N452-R454 VanDerWaalsContact C-N 3.31Å; N452-R454 PolarHBondContact O-N 3.18Å; N452-R454 WeakPolarHBondContact OD1-CB 3.48Å; N452-R454 PolarHBondContact OD1-N 2.77Å; R454-R457 PolarHBondContact O-N 2.92Å; R454-H458 PolarHBondContact O-N 3.5Å; R454-H458 PolarHBondContact O-ND1 3.19Å
455	F	89.1	Confident	89.4	Confident	1 Å²	1	42 Å²	42	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-63.2	-47.1	178.3	-176.2	-113	0	0	0	111.6	V412 F422 M425 L449 N452 R457 H458 L459 L502 L506	V412-F455 HydrophobicContact CG1-CB 4.33Å; V412-F455 HydrophobicContact CG1-CD2 3.3Å; V412-F455 HydrophobicContact CG1-CE2 3.85Å; V412-F455 HydrophobicContact CG1-CG 4.1Å; F422-F455 AromaticContact CD1-CD2 3.65Å; F422-F455 HydrophobicContact CD1-CD2 3.65Å; F422-F455 AromaticContact CD1-CE2 3.75Å; F422-F455 HydrophobicContact CD1-CE2 3.75Å; F422-F455 AromaticContact CE1-CD2 3.79Å; F422-F455 HydrophobicContact CE1-CD2 3.79Å; F422-F455 HydrophobicContact CE1-CE2 4.32Å; M425-F455 HydrophobicContact CG-CE2 4.3Å; M425-F455 HydrophobicContact CG-CZ 4.17Å; L449-F455 HydrophobicContact CB-CD1 3.97Å; L449-F455 HydrophobicContact CB-CE1 3.97Å; L449-F455 HydrophobicContact CD1-CE1 4Å; L449-F455 HydrophobicContact CD1-CZ 4.16Å; L449-F455 HydrophobicContact CD2-CD1 3.83Å; L449-F455 HydrophobicContact CD2-CD2 4.21Å; L449-F455 HydrophobicContact CD2-CE1 3.92Å; L449-F455 HydrophobicContact CD2-CE2 4.29Å; L449-F455 HydrophobicContact CD2-CG 3.97Å; L449-F455 HydrophobicContact CD2-CZ 4.15Å; L449-F455 HydrophobicContact CG-CD1 4.36Å; L449-F455 HydrophobicContact CG-CE1 4.18Å; N452-F455 HydrophobicContact CB-CB 3.99Å; N452-F455 PolarHBondContact O-N 3.05Å; N452-F455 PolarHBondContact OD1-N 2.99Å; F455-R457 VanDerWaalsContact C-N 3.34Å; F455-R457 PolarHBondContact O-N 3.3Å; F455-H458 PolarHBondContact O-N 3.22Å; F455-L459 HydrophobicContact CD1-CD1 3.91Å; F455-L459 HydrophobicContact CD1-CG 4.37Å; F455-L459 HydrophobicContact CE1-CD1 3.47Å; F455-L459 VanDerWaalsContact CE1-CD1 3.47Å; F455-L459 HydrophobicContact CE1-CG 4.08Å; F455-L459 HydrophobicContact CE2-CD2 4.38Å; F455-L459 HydrophobicContact CE2-CG 4.36Å; F455-L459 HydrophobicContact CZ-CD1 3.86Å; F455-L459 HydrophobicContact CZ-CD2 4.11Å; F455-L459 HydrophobicContact CZ-CG 4.07Å; F455-L459 WeakPolarHBondContact O-CG 3.42Å; F455-L459 PolarHBondContact O-N 2.89Å; F455-L502 HydrophobicContact CE1-CD2 4.04Å; F455-L502 HydrophobicContact CZ-CD2 4.01Å; F455-L506 HydrophobicContact CD1-CD1 4.11Å; F455-L506 HydrophobicContact CE1-CD1 3.7Å
456	L	91.4	Very high	89.6	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-60.5	-41.2	176.7	-70.2	177.4	0	0	0	112.5	N452 A453 W460 F503 L506 F507 P534	N452-L456 PolarHBondContact O-N 3.39Å; N452-L456 VanDerWaalsContact O-N 3.17Å; A453-L456 PolarHBondContact O-N 2.88Å; L456-W460 PolarHBondContact O-N 3.43Å; L456-F503 HydrophobicContact CB-CE2 4.49Å; L456-F503 HydrophobicContact CD2-CD2 4.29Å; L456-L506 HydrophobicContact CD2-CB 3.76Å; L456-L506 HydrophobicContact CD2-CD1 4.47Å; L456-F507 HydrophobicContact CD1-CD2 4.14Å; L456-F507 HydrophobicContact CD2-CB 4.31Å; L456-P534 HydrophobicContact CB-CB 4.12Å; L456-P534 HydrophobicContact CD1-CB 4.16Å; L456-P534 HydrophobicContact CD1-CG 3.86Å
457	R	91.2	Very high	89.7	Confident	100 Å²	100	45.2 Å²	45.2	38%	0.377	22%	0.219	S	C	.	.	H	α-helix	trans	-64	-42.4	175.6	-71.3	179.7	81.4	89.2	3.5	112.1	A453 R454 F455 W460 H461 P534 F535 E539	A453-R457 VanDerWaalsContact O-CG 3.31Å; A453-R457 WeakPolarHBondContact O-CG 3.33Å; A453-R457 PolarHBondContact O-N 2.88Å; R454-R457 PolarHBondContact O-N 2.92Å; F455-R457 VanDerWaalsContact C-N 3.34Å; F455-R457 PolarHBondContact O-N 3.3Å; R457-W460 PolarHBondContact O-N 2.96Å; R457-H461 WeakPolarHBondContact O-CB 3.45Å; R457-H461 PolarHBondContact O-N 3.13Å; R457-P534 WeakPolarHBondContact CD-O 3.38Å; R457-P534 VanDerWaalsContact CG-O 3.23Å; R457-P534 WeakPolarHBondContact CG-O 3.43Å; R457-P534 PolarHBondContact NH1-O 2.91Å; R457-F535 HydrophobicContact CB-CE1 4.45Å; R457-F535 HydrophobicContact CG-CD1 4.28Å; R457-F535 HydrophobicContact CG-CE1 3.87Å; R457-F535 HydrophobicContact CG-CZ 4.29Å; R457-E539 IonicContact CZ-OE1 2.77Å; R457-E539 IonicContact CZ-OE2 3.51Å; R457-E539 IonicContact NH1-OE1 3.9Å; R457-E539 IonicContact NH1-OE2 2.68Å; R457-E539 PolarHBondContact NH1-OE2 2.98Å; R457-E539 IonicContact NH2-OE1 3.22Å; R457-E539 PolarHBondContact NH2-OE1 3.2Å; R457-E539 IonicContact NH2-OE2 3.83Å; R457-E539 PolarHBondContact NH2-OE2 3.27Å
458	H	90.6	Very high	89.9	Confident	92 Å²	92	40.8 Å²	40.8	43%	0.426	20%	0.204	S	C	.	.	H	α-helix	trans	-66.3	-43.4	177.1	-80.2	79.2	0	0	0	112.2	F422 R454 F455 W460 H461 L462	F422-H458 HydrophobicContact CD1-CB 4.03Å; F422-H458 HydrophobicContact CE1-CB 3.85Å; F422-H458 HydrophobicContact CZ-CB 4.31Å; R454-H458 PolarHBondContact O-N 3.5Å; R454-H458 PolarHBondContact O-ND1 3.19Å; F455-H458 PolarHBondContact O-N 3.22Å; H458-W460 VanDerWaalsContact C-N 3.31Å; H458-W460 PolarHBondContact O-N 3.01Å; H458-H461 WeakPolarHBondContact O-CB 3.44Å; H458-H461 PolarHBondContact O-N 3.3Å; H458-L462 WeakPolarHBondContact O-CG 3.11Å; H458-L462 PolarHBondContact O-N 2.89Å
459	L	92.8	Very high	89.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.5	-45.8	174.3	-73.2	-178.6	0	0	0	111.5	A426 F455 L462 I463 L499 L502 F503	A426-L459 HydrophobicContact CB-CD2 4.17Å; F455-L459 HydrophobicContact CD1-CD1 3.91Å; F455-L459 HydrophobicContact CD1-CG 4.37Å; F455-L459 HydrophobicContact CE1-CD1 3.47Å; F455-L459 VanDerWaalsContact CE1-CD1 3.47Å; F455-L459 HydrophobicContact CE1-CG 4.08Å; F455-L459 HydrophobicContact CE2-CD2 4.38Å; F455-L459 HydrophobicContact CE2-CG 4.36Å; F455-L459 HydrophobicContact CZ-CD1 3.86Å; F455-L459 HydrophobicContact CZ-CD2 4.11Å; F455-L459 HydrophobicContact CZ-CG 4.07Å; F455-L459 WeakPolarHBondContact O-CG 3.42Å; F455-L459 PolarHBondContact O-N 2.89Å; L459-L462 PolarHBondContact O-N 3.49Å; L459-I463 WeakPolarHBondContact O-CD1 3.46Å; L459-I463 VanDerWaalsContact O-CG1 3.25Å; L459-I463 WeakPolarHBondContact O-CG1 3.31Å; L459-I463 PolarHBondContact O-N 2.96Å; L459-L499 HydrophobicContact CD2-CD2 3.63Å; L459-L502 HydrophobicContact CD1-CD2 3.99Å; L459-L502 HydrophobicContact CD1-CG 4.15Å; L459-F503 HydrophobicContact CB-CB 4.22Å; L459-F503 HydrophobicContact CB-CD2 4.16Å; L459-F503 HydrophobicContact CD1-CB 4.34Å
460	W	94.8	Very high	89.6	Confident	30 Å²	30	49.4 Å²	49.4	11%	0.114	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-42.9	176.3	-174.7	-111.9	0	0	0	112	L456 R457 H458 L462 I463 T464 F500 F503 F535 L543 C546 L547	L456-W460 PolarHBondContact O-N 3.43Å; R457-W460 PolarHBondContact O-N 2.96Å; H458-W460 VanDerWaalsContact C-N 3.31Å; H458-W460 PolarHBondContact O-N 3.01Å; W460-L462 PolarHBondContact O-N 3.15Å; W460-I463 HydrophobicContact CE3-CD1 4.28Å; W460-I463 PolarHBondContact O-N 3.07Å; W460-T464 HydrophobicContact CD2-CG2 4.33Å; W460-T464 HydrophobicContact CZ2-CG2 3.97Å; W460-T464 WeakPolarHBondContact O-CG2 3.37Å; W460-T464 PolarHBondContact O-N 3.48Å; W460-T464 PolarHBondContact O-OG1 2.84Å; W460-F500 HydrophobicContact CZ3-CE2 4.28Å; W460-F503 HydrophobicContact CB-CD2 4.27Å; W460-F503 HydrophobicContact CB-CE2 3.95Å; W460-F503 HydrophobicContact CB-CZ 4.34Å; W460-F503 HydrophobicContact CD2-CE1 4.36Å; W460-F503 HydrophobicContact CD2-CZ 4.33Å; W460-F503 AromaticContact CE3-CD1 3.8Å; W460-F503 HydrophobicContact CE3-CD1 3.8Å; W460-F503 AromaticContact CE3-CE1 3.49Å; W460-F503 HydrophobicContact CE3-CE1 3.49Å; W460-F503 VanDerWaalsContact CE3-CE1 3.49Å; W460-F503 HydrophobicContact CE3-CE2 4.44Å; W460-F503 HydrophobicContact CE3-CG 4.41Å; W460-F503 AromaticContact CE3-CZ 3.88Å; W460-F503 HydrophobicContact CE3-CZ 3.88Å; W460-F503 HydrophobicContact CZ3-CD1 4.22Å; W460-F503 AromaticContact CZ3-CE1 3.91Å; W460-F503 HydrophobicContact CZ3-CE1 3.91Å; W460-F535 HydrophobicContact CB-CE1 4.07Å; W460-F535 HydrophobicContact CB-CZ 3.84Å; W460-F535 HydrophobicContact CG-CE1 4.19Å; W460-F535 HydrophobicContact CG-CZ 4.22Å; W460-L543 HydrophobicContact CD2-CD1 3.63Å; W460-L543 HydrophobicContact CD2-CG 4.08Å; W460-L543 HydrophobicContact CE3-CD1 4.06Å; W460-L543 HydrophobicContact CE3-CG 4.28Å; W460-L543 HydrophobicContact CG-CD1 3.97Å; W460-L543 HydrophobicContact CH2-CD1 4.47Å; W460-L543 HydrophobicContact CH2-CG 3.86Å; W460-L543 HydrophobicContact CZ2-CB 3.95Å; W460-L543 HydrophobicContact CZ2-CD1 4.09Å; W460-L543 HydrophobicContact CZ2-CG 3.64Å; W460-L543 HydrophobicContact CZ3-CD1 4.46Å; W460-L543 HydrophobicContact CZ3-CG 4.17Å; W460-C546 HydrophobicContact CH2-CB 3.82Å; W460-C546 HydrophobicContact CZ2-CB 4.01Å; W460-L547 HydrophobicContact CH2-CD2 4.09Å; W460-L547 HydrophobicContact CH2-CG 4.48Å; W460-L547 HydrophobicContact CZ3-CD2 3.8Å
461	H	92.4	Very high	89.1	Confident	107 Å²	107	58.2 Å²	58.2	50%	0.495	28%	0.283	S	S	.	.	H	α-helix	trans	-57.5	-49	175.5	-173.8	65.1	0	0	0	111.8	R457 H458 I463 T464 S465	R457-H461 WeakPolarHBondContact O-CB 3.45Å; R457-H461 PolarHBondContact O-N 3.13Å; H458-H461 WeakPolarHBondContact O-CB 3.44Å; H458-H461 PolarHBondContact O-N 3.3Å; H461-I463 PolarHBondContact O-N 3.35Å; H461-T464 PolarHBondContact O-N 3.33Å; H461-T464 VanDerWaalsContact O-N 3.11Å; H461-T464 PolarHBondContact O-OG1 3.36Å; H461-S465 WeakPolarHBondContact O-CB 3.19Å; H461-S465 PolarHBondContact O-N 2.87Å; H461-S465 PolarHBondContact O-OG 3.49Å
462	L	91.9	Very high	88.7	Confident	8 Å²	8	61.3 Å²	61.3	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-58.7	-42.8	177.3	-69.9	172.6	0	0	0	112.4	E419 F422 T423 H458 L459 W460 T464 S465 M466 L499	E419-L462 HydrophobicContact CB-CD2 4.15Å; E419-L462 HydrophobicContact CG-CD2 4.03Å; F422-L462 HydrophobicContact CB-CD1 3.67Å; T423-L462 HydrophobicContact CG2-CD1 4.33Å; H458-L462 WeakPolarHBondContact O-CG 3.11Å; H458-L462 PolarHBondContact O-N 2.89Å; L459-L462 PolarHBondContact O-N 3.49Å; W460-L462 PolarHBondContact O-N 3.15Å; L462-T464 VanDerWaalsContact C-N 3.28Å; L462-T464 PolarHBondContact O-N 3.03Å; L462-S465 PolarHBondContact O-N 3.33Å; L462-S465 PolarHBondContact O-OG 2.92Å; L462-M466 WeakPolarHBondContact O-CB 3.23Å; L462-M466 VanDerWaalsContact O-CG 3.26Å; L462-M466 WeakPolarHBondContact O-CG 3.48Å; L462-M466 PolarHBondContact O-N 3.29Å; L462-M466 VanDerWaalsContact O-N 3.12Å; L462-L499 HydrophobicContact CB-CD1 4.21Å; L462-L499 HydrophobicContact CD1-CD2 4.14Å
463	I	92.9	Very high	88.3	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.9	-40.7	176.8	-66.5	159.9	0	0	0	110.8	L459 W460 H461 L479 L499 F500 F503	L459-I463 WeakPolarHBondContact O-CD1 3.46Å; L459-I463 VanDerWaalsContact O-CG1 3.25Å; L459-I463 WeakPolarHBondContact O-CG1 3.31Å; L459-I463 PolarHBondContact O-N 2.96Å; W460-I463 HydrophobicContact CE3-CD1 4.28Å; W460-I463 PolarHBondContact O-N 3.07Å; H461-I463 PolarHBondContact O-N 3.35Å; I463-L479 HydrophobicContact CG2-CD1 4.37Å; I463-L499 HydrophobicContact CD1-CB 4.45Å; I463-L499 HydrophobicContact CG1-CB 3.91Å; I463-F500 HydrophobicContact CD1-CB 4.24Å; I463-F500 HydrophobicContact CD1-CD2 4.1Å; I463-F500 HydrophobicContact CD1-CG 4.36Å; I463-F500 HydrophobicContact CG1-CB 4.49Å; I463-F500 HydrophobicContact CG2-CD1 4.44Å; I463-F500 HydrophobicContact CG2-CG 4.43Å; I463-F503 HydrophobicContact CD1-CB 3.7Å; I463-F503 HydrophobicContact CD1-CD1 4.26Å; I463-F503 HydrophobicContact CD1-CG 4.01Å
464	T	92.4	Very high	88.3	Confident	54 Å²	54	62.9 Å²	62.9	33%	0.331	32%	0.324	S	S	.	.	H	α-helix	trans	-79.5	-28.1	-178.7	58.8	0	0	0	0	114.2	W460 H461 L462 L479	W460-T464 HydrophobicContact CD2-CG2 4.33Å; W460-T464 HydrophobicContact CZ2-CG2 3.97Å; W460-T464 WeakPolarHBondContact O-CG2 3.37Å; W460-T464 PolarHBondContact O-N 3.48Å; W460-T464 PolarHBondContact O-OG1 2.84Å; H461-T464 PolarHBondContact O-N 3.33Å; H461-T464 VanDerWaalsContact O-N 3.11Å; H461-T464 PolarHBondContact O-OG1 3.36Å; L462-T464 VanDerWaalsContact C-N 3.28Å; L462-T464 PolarHBondContact O-N 3.03Å; T464-L479 HydrophobicContact CG2-CD2 4.18Å
465	S	91.1	Very high	88.4	Confident	51 Å²	51	61 Å²	61	36%	0.357	32%	0.324	S	S	.	.	H	α-helix	trans	-87	-20.1	-178.1	67.6	0	0	0	0	113.5	H461 L462 T467	H461-S465 WeakPolarHBondContact O-CB 3.19Å; H461-S465 PolarHBondContact O-N 2.87Å; H461-S465 PolarHBondContact O-OG 3.49Å; L462-S465 PolarHBondContact O-N 3.33Å; L462-S465 PolarHBondContact O-OG 2.92Å; S465-T467 PolarHBondContact O-N 3.49Å
466	M	90.5	Very high	88.4	Confident	20 Å²	20	62 Å²	62	10%	0.099	33%	0.33	C	S	.	.			trans	-61.3	126.1	179.6	-88.5	-173.5	171.3	0	0	112.8	L462 P477 L478 R495 I496 L499	L462-M466 WeakPolarHBondContact O-CB 3.23Å; L462-M466 VanDerWaalsContact O-CG 3.26Å; L462-M466 WeakPolarHBondContact O-CG 3.48Å; L462-M466 PolarHBondContact O-N 3.29Å; L462-M466 VanDerWaalsContact O-N 3.12Å; M466-P477 CarbonylContact O-C 3.59Å; M466-P477 WeakPolarHBondContact O-CA 3.39Å; M466-L478 HydrophobicContact CB-CB 4.46Å; M466-L478 HydrophobicContact CB-CD1 4.14Å; M466-L478 HydrophobicContact CB-CG 4.44Å; M466-L478 PolarHBondContact O-N 2.89Å; M466-L478 HydrophobicContact SD-CD1 4.4Å; M466-R495 HydrophobicContact CE-CB 4.06Å; M466-R495 HydrophobicContact SD-CB 4.34Å; M466-I496 HydrophobicContact SD-CB 4.37Å; M466-L499 HydrophobicContact CE-CD1 3.27Å; M466-L499 HydrophobicContact SD-CD1 3.75Å
467	T	90.9	Very high	88.4	Confident	53 Å²	53	64.2 Å²	64.2	33%	0.325	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	151.5	179.3	52.1	0	0	0	0	111.5	S465 M475 V476 P477	S465-T467 PolarHBondContact O-N 3.49Å; T467-M475 WeakPolarHBondContact OG1-CE 3.33Å; T467-V476 CarbonylContact C-O 3.47Å; T467-V476 VanDerWaalsContact CA-O 3.31Å; T467-V476 WeakPolarHBondContact CA-O 3.49Å; T467-P477 HydrophobicContact CG2-CG 4.36Å
468	T	89.6	Confident	88.3	Confident	21 Å²	21	59.4 Å²	59.4	13%	0.129	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	153.9	171.8	-169	0	0	0	0	110.8	M475 V476 L478 L481 D492	T468-M475 WeakPolarHBondContact O-CA 3.28Å; T468-V476 PolarHBondContact N-O 3.23Å; T468-V476 PolarHBondContact O-N 2.95Å; T468-L478 HydrophobicContact CG2-CD2 3.48Å; T468-L478 VanDerWaalsContact CG2-CD2 3.48Å; T468-L481 HydrophobicContact CG2-CD1 3.47Å; T468-L481 VanDerWaalsContact CG2-CD1 3.47Å; T468-D492 WeakPolarHBondContact CB-OD2 3.38Å; T468-D492 PolarHBondContact OG1-OD1 3.29Å; T468-D492 PolarHBondContact OG1-OD2 3.42Å
469	K	86.6	Confident	88.4	Confident	149 Å²	149	56 Å²	56	65%	0.648	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	115.5	-179.6	-170.4	176.5	-179.7	178.4	0	109.6	M475	K469-M475 HydrophobicContact CB-SD 3.76Å; K469-M475 HydrophobicContact CG-SD 4.15Å
470	M	82	Confident	88.2	Confident	76 Å²	76	59.4 Å²	59.4	37%	0.374	33%	0.327	S	S	.	.			trans	-71.2	163.9	176	-62.3	-64.7	-85	0	0	111.3	T472 G473 S474 V476 L481	M470-T472 PolarHBondContact O-N 3.16Å; M470-T472 VanDerWaalsContact O-N 3.15Å; M470-G473 WeakPolarHBondContact O-CA 3.21Å; M470-G473 PolarHBondContact O-N 3.37Å; M470-S474 PolarHBondContact N-O 3.5Å; M470-V476 HydrophobicContact CG-CB 4.14Å; M470-V476 HydrophobicContact CG-CG2 3.52Å; M470-V476 HydrophobicContact SD-CG2 4.45Å; M470-L481 HydrophobicContact CE-CD2 4.14Å; M470-L481 HydrophobicContact SD-CD1 4.28Å; M470-L481 HydrophobicContact SD-CD2 4.19Å
471	I	76.8	Confident	87.9	Confident	185 Å²	185	58.4 Å²	58.4	95%	0.949	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-31	176.4	-57.2	168.2	0	0	0	111.4	G473	I471-G473 PolarHBondContact O-N 3.3Å
472	T	76.8	Confident	87.8	Confident	121 Å²	121	53.3 Å²	53.3	74%	0.742	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-4.4	174.9	52.9	0	0	0	0	114	M470 S474	M470-T472 PolarHBondContact O-N 3.16Å; M470-T472 VanDerWaalsContact O-N 3.15Å; T472-S474 VanDerWaalsContact C-N 3.32Å; T472-S474 PolarHBondContact O-N 3.09Å; T472-S474 PolarHBondContact OG1-OG 3.08Å
473	G	78.3	Confident	87.7	Confident	40 Å²	40	54 Å²	54	41%	0.412	31%	0.306	S	S	.	.	S	Bend	trans	85.4	-8.8	-179.1	0	0	0	0	0	115.4	M470 I471	M470-G473 WeakPolarHBondContact O-CA 3.21Å; M470-G473 PolarHBondContact O-N 3.37Å; I471-G473 PolarHBondContact O-N 3.3Å
474	S	86.3	Confident	87.4	Confident	57 Å²	57	60.8 Å²	60.8	40%	0.399	33%	0.331	S	S	.	.			trans	-76.1	139.9	177.3	56.1	0	0	0	0	112.2	M470 T472	M470-S474 PolarHBondContact N-O 3.5Å; T472-S474 VanDerWaalsContact C-N 3.32Å; T472-S474 PolarHBondContact O-N 3.09Å; T472-S474 PolarHBondContact OG1-OG 3.08Å
475	M	88.2	Confident	87	Confident	115 Å²	115	58.9 Å²	58.9	57%	0.567	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	128.7	172.3	-62	-63.5	-78.8	0	0	110	T467 T468 K469	T467-M475 WeakPolarHBondContact OG1-CE 3.33Å; T468-M475 WeakPolarHBondContact O-CA 3.28Å; K469-M475 HydrophobicContact CB-SD 3.76Å; K469-M475 HydrophobicContact CG-SD 4.15Å
476	V	88.8	Confident	86.7	Confident	22 Å²	22	58.4 Å²	58.4	13%	0.133	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.1	178.9	-178.9	0	0	0	0	109.4	T467 T468 M470 L478 L481	T467-V476 CarbonylContact C-O 3.47Å; T467-V476 VanDerWaalsContact CA-O 3.31Å; T467-V476 WeakPolarHBondContact CA-O 3.49Å; T468-V476 PolarHBondContact N-O 3.23Å; T468-V476 PolarHBondContact O-N 2.95Å; M470-V476 HydrophobicContact CG-CB 4.14Å; M470-V476 HydrophobicContact CG-CG2 3.52Å; M470-V476 HydrophobicContact SD-CG2 4.45Å; V476-L478 PolarHBondContact O-N 3.27Å; V476-L481 HydrophobicContact CG1-CD2 4.08Å; V476-L481 HydrophobicContact CG1-CG 4.08Å
477	P	91.6	Very high	86	Confident	47 Å²	47	63.1 Å²	63.1	31%	0.305	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	132.7	173.5	-23.9	34.1	0	0	0	112	M466 T467 L479 Q480 L481	M466-P477 CarbonylContact O-C 3.59Å; M466-P477 WeakPolarHBondContact O-CA 3.39Å; T467-P477 HydrophobicContact CG2-CG 4.36Å; P477-L479 VanDerWaalsContact C-N 3.27Å; P477-L479 PolarHBondContact O-N 3.27Å; P477-Q480 HydrophobicContact CB-CB 4.29Å; P477-Q480 WeakPolarHBondContact O-CB 3.43Å; P477-Q480 PolarHBondContact O-N 3.01Å; P477-Q480 VanDerWaalsContact O-N 3.08Å; P477-L481 PolarHBondContact O-N 2.95Å
478	L	90.4	Very high	85.5	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-61.7	-36.9	-179.9	-75.4	-174.6	0	0	0	111.9	M466 T468 V476 Q480 L481 I482 D492 I496	M466-L478 HydrophobicContact CB-CB 4.46Å; M466-L478 HydrophobicContact CB-CD1 4.14Å; M466-L478 HydrophobicContact CB-CG 4.44Å; M466-L478 PolarHBondContact O-N 2.89Å; M466-L478 HydrophobicContact SD-CD1 4.4Å; T468-L478 HydrophobicContact CG2-CD2 3.48Å; T468-L478 VanDerWaalsContact CG2-CD2 3.48Å; V476-L478 PolarHBondContact O-N 3.27Å; L478-Q480 PolarHBondContact O-N 3.45Å; L478-L481 HydrophobicContact CD2-CD1 4.1Å; L478-L481 WeakPolarHBondContact O-CB 3.26Å; L478-L481 PolarHBondContact O-N 3.45Å; L478-L481 VanDerWaalsContact O-N 3.08Å; L478-I482 WeakPolarHBondContact O-CG1 3.26Å; L478-I482 PolarHBondContact O-N 2.84Å; L478-D492 HydrophobicContact CD1-CB 4.14Å; L478-D492 HydrophobicContact CD2-CB 3.85Å; L478-I496 HydrophobicContact CB-CD1 3.51Å; L478-I496 HydrophobicContact CD1-CB 4.13Å; L478-I496 HydrophobicContact CD1-CD1 4.36Å; L478-I496 HydrophobicContact CD1-CG2 4.48Å
479	L	90.8	Very high	85.2	Confident	19 Å²	19	63.5 Å²	63.5	10%	0.099	35%	0.354	C	S	.	.	H	α-helix	trans	-59.4	-34.2	176.1	-175.3	62.1	0	0	0	112.5	I463 T464 P477 I482 S483 F500 C546 A550	I463-L479 HydrophobicContact CG2-CD1 4.37Å; T464-L479 HydrophobicContact CG2-CD2 4.18Å; P477-L479 VanDerWaalsContact C-N 3.27Å; P477-L479 PolarHBondContact O-N 3.27Å; L479-I482 PolarHBondContact O-N 3.01Å; L479-S483 PolarHBondContact O-N 3.4Å; L479-S483 PolarHBondContact O-OG 3.32Å; L479-F500 HydrophobicContact CD1-CE1 3.74Å; L479-F500 HydrophobicContact CD1-CZ 4.08Å; L479-C546 HydrophobicContact CD2-CB 4.14Å; L479-A550 HydrophobicContact CD1-CB 4.24Å
480	Q	89.4	Confident	84.9	Confident	72 Å²	72	62.6 Å²	62.6	34%	0.336	35%	0.35	S	S	.	.	H	α-helix	trans	-73	-33	176.4	-170.8	-179.5	11.1	0	0	112.2	P477 L478 S483 R484	P477-Q480 HydrophobicContact CB-CB 4.29Å; P477-Q480 WeakPolarHBondContact O-CB 3.43Å; P477-Q480 PolarHBondContact O-N 3.01Å; P477-Q480 VanDerWaalsContact O-N 3.08Å; L478-Q480 PolarHBondContact O-N 3.45Å; Q480-S483 WeakPolarHBondContact CA-OG 3.48Å; Q480-S483 PolarHBondContact O-OG 3.44Å; Q480-S483 VanDerWaalsContact O-OG 3.07Å; Q480-R484 WeakPolarHBondContact O-CB 3.43Å; Q480-R484 WeakPolarHBondContact O-CG 3.34Å; Q480-R484 PolarHBondContact O-N 2.99Å; Q480-R484 VanDerWaalsContact O-N 3.15Å
481	L	88.8	Confident	84.9	Confident	9 Å²	9	65.6 Å²	65.6	5%	0.047	36%	0.364	C	S	.	.	H	α-helix	trans	-67.4	-42	172	-66.9	177.7	0	0	0	110.9	T468 M470 V476 P477 L478 G485 S486	T468-L481 HydrophobicContact CG2-CD1 3.47Å; T468-L481 VanDerWaalsContact CG2-CD1 3.47Å; M470-L481 HydrophobicContact CE-CD2 4.14Å; M470-L481 HydrophobicContact SD-CD1 4.28Å; M470-L481 HydrophobicContact SD-CD2 4.19Å; V476-L481 HydrophobicContact CG1-CD2 4.08Å; V476-L481 HydrophobicContact CG1-CG 4.08Å; P477-L481 PolarHBondContact O-N 2.95Å; L478-L481 HydrophobicContact CD2-CD1 4.1Å; L478-L481 WeakPolarHBondContact O-CB 3.26Å; L478-L481 PolarHBondContact O-N 3.45Å; L478-L481 VanDerWaalsContact O-N 3.08Å; L481-G485 PolarHBondContact O-N 3.3Å; L481-G485 VanDerWaalsContact O-N 3.14Å; L481-S486 PolarHBondContact O-N 3.16Å
482	I	89.6	Confident	85.4	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-53.3	174	-65.3	176.4	0	0	0	109.6	L478 L479 R484 G485 M488 I496 F500 A550 G553 I554 W596	L478-I482 WeakPolarHBondContact O-CG1 3.26Å; L478-I482 PolarHBondContact O-N 2.84Å; L479-I482 PolarHBondContact O-N 3.01Å; I482-R484 VanDerWaalsContact C-N 3.29Å; I482-R484 PolarHBondContact O-N 3.28Å; I482-G485 WeakPolarHBondContact O-CA 3.5Å; I482-G485 PolarHBondContact O-N 3.1Å; I482-M488 HydrophobicContact CD1-CE 4.36Å; I482-M488 HydrophobicContact CG1-CE 3.46Å; I482-M488 VanDerWaalsContact CG1-CE 3.46Å; I482-I496 HydrophobicContact CD1-CD1 3.57Å; I482-I496 HydrophobicContact CD1-CG1 4.06Å; I482-I496 HydrophobicContact CD1-CG2 4.03Å; I482-F500 HydrophobicContact CD1-CD1 4.3Å; I482-A550 HydrophobicContact CG2-CB 4.01Å; I482-G553 CarbonylContact O-C 3.58Å; I482-G553 WeakPolarHBondContact O-CA 3.46Å; I482-I554 HydrophobicContact CG2-CD1 4.18Å; I482-I554 HydrophobicContact CG2-CG1 3.71Å; I482-W596 HydrophobicContact CD1-CH2 4.34Å; I482-W596 HydrophobicContact CD1-CZ3 4.29Å; I482-W596 HydrophobicContact CG1-CH2 4.25Å; I482-W596 HydrophobicContact CG1-CZ3 4.37Å
483	S	89.9	Confident	85.8	Confident	24 Å²	24	51.7 Å²	51.7	17%	0.168	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-35.3	-175.7	67.5	0	0	0	0	113.5	L479 Q480 G485 D549 G553	L479-S483 PolarHBondContact O-N 3.4Å; L479-S483 PolarHBondContact O-OG 3.32Å; Q480-S483 WeakPolarHBondContact CA-OG 3.48Å; Q480-S483 PolarHBondContact O-OG 3.44Å; Q480-S483 VanDerWaalsContact O-OG 3.07Å; S483-G485 VanDerWaalsContact C-N 3.25Å; S483-G485 PolarHBondContact O-N 2.98Å; S483-D549 WeakPolarHBondContact CA-O 3.38Å; S483-G553 VanDerWaalsContact O-CA 3.3Å; S483-G553 WeakPolarHBondContact O-CA 3.43Å
484	R	87.1	Confident	86.1	Confident	141 Å²	141	52.8 Å²	52.8	53%	0.532	28%	0.283	S	S	.	.	H	α-helix	trans	-73	-17.6	173.5	-73.3	-179.7	169.9	165.6	-1.3	113.5	Q480 I482	Q480-R484 WeakPolarHBondContact O-CB 3.43Å; Q480-R484 WeakPolarHBondContact O-CG 3.34Å; Q480-R484 PolarHBondContact O-N 2.99Å; Q480-R484 VanDerWaalsContact O-N 3.15Å; I482-R484 VanDerWaalsContact C-N 3.29Å; I482-R484 PolarHBondContact O-N 3.28Å
485	G	84.8	Confident	86.2	Confident	15 Å²	15	55.5 Å²	55.5	16%	0.155	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	31.3	-174.6	0	0	0	0	0	113.4	L481 I482 S483 G553 L557	L481-G485 PolarHBondContact O-N 3.3Å; L481-G485 VanDerWaalsContact O-N 3.14Å; I482-G485 WeakPolarHBondContact O-CA 3.5Å; I482-G485 PolarHBondContact O-N 3.1Å; S483-G485 VanDerWaalsContact C-N 3.25Å; S483-G485 PolarHBondContact O-N 2.98Å; G485-G553 VanDerWaalsContact CA-O 3.29Å; G485-G553 WeakPolarHBondContact CA-O 3.36Å; G485-L557 WeakPolarHBondContact O-CD2 3.17Å
486	S	83.5	Confident	86.3	Confident	41 Å²	41	50 Å²	50	29%	0.287	26%	0.258	S	S	.	.			trans	-85.9	134	-179.9	-61	0	0	0	0	111	L481 L557	L481-S486 PolarHBondContact O-N 3.16Å; S486-L557 WeakPolarHBondContact O-CD2 3.46Å
487	P	75.8	Confident	86.4	Confident	118 Å²	118	49 Å²	49	77%	0.766	25%	0.252	S	S	*	.			trans	-61.3	141.8	179	26.9	-34.2	0	0	0	110.7
488	M	81.4	Confident	86.4	Confident	29 Å²	29	47.2 Å²	47.2	14%	0.143	24%	0.239	C	C	.	.			trans	-123.7	169	-179.1	65.5	-173	70.9	0	0	111.8	I482 D492 I496 W596	I482-M488 HydrophobicContact CD1-CE 4.36Å; I482-M488 HydrophobicContact CG1-CE 3.46Å; I482-M488 VanDerWaalsContact CG1-CE 3.46Å; M488-D492 HydrophobicContact CB-CB 4.47Å; M488-D492 HydrophobicContact SD-CB 4.49Å; M488-I496 HydrophobicContact SD-CG2 4.33Å; M488-W596 HydrophobicContact CE-CH2 3.63Å; M488-W596 HydrophobicContact CE-CZ2 3.95Å; M488-W596 HydrophobicContact CG-CZ2 4.24Å; M488-W596 HydrophobicContact SD-CH2 3.76Å; M488-W596 HydrophobicContact SD-CZ2 3.84Å
489	S	82.1	Confident	86.5	Confident	54 Å²	54	47.3 Å²	47.3	38%	0.378	24%	0.24	S	C	.	.			trans	-68.9	154.1	175.7	77.1	0	0	0	0	111.3	E491 D492 S493	S489-E491 PolarHBondContact O-N 2.78Å; S489-D492 PolarHBondContact O-N 3.38Å; S489-D492 WeakPolarHBondContact OG-CB 3.48Å; S489-D492 PolarHBondContact OG-N 2.67Å; S489-D492 VanDerWaalsContact OG-N 3.11Å; S489-D492 PolarHBondContact OG-OD2 3.32Å; S489-S493 PolarHBondContact O-N 3.46Å
490	F	79.8	Confident	86.6	Confident	129 Å²	129	46.4 Å²	46.4	57%	0.566	24%	0.235	S	C	*	.	H	α-helix	trans	-63.2	-29.5	176.1	-176.4	-106	0	0	0	112.6	S493 N494	F490-S493 WeakPolarHBondContact CA-OG 3.42Å; F490-S493 PolarHBondContact O-OG 3.27Å; F490-S493 VanDerWaalsContact O-OG 3.12Å; F490-N494 VanDerWaalsContact CD1-ND2 3.33Å; F490-N494 WeakPolarHBondContact CD1-ND2 3.46Å; F490-N494 WeakPolarHBondContact CE1-ND2 3.37Å; F490-N494 WeakPolarHBondContact CZ-ND2 3.32Å; F490-N494 WeakPolarHBondContact O-CB 3.28Å; F490-N494 VanDerWaalsContact O-CG 3.24Å; F490-N494 PolarHBondContact O-N 2.94Å; F490-N494 PolarHBondContact O-ND2 3.41Å
491	E	82.5	Confident	86.8	Confident	140 Å²	140	44.4 Å²	44.4	65%	0.654	23%	0.225	S	C	*	.	H	α-helix	trans	-68.4	-45.9	175.8	-171.4	175.8	177.8	0	0	111	S489 S493 N494 R495	S489-E491 PolarHBondContact O-N 2.78Å; E491-S493 PolarHBondContact O-N 2.96Å; E491-N494 PolarHBondContact O-N 3.3Å; E491-R495 WeakPolarHBondContact O-CG 3.49Å; E491-R495 PolarHBondContact O-N 3.21Å; E491-R495 VanDerWaalsContact O-N 3.15Å
492	D	86.9	Confident	87.1	Confident	14 Å²	14	44 Å²	44	8%	0.075	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-40.8	176.5	-69	-39.2	0	0	0	111.7	T468 L478 M488 S489 N494 R495 I496	T468-D492 WeakPolarHBondContact CB-OD2 3.38Å; T468-D492 PolarHBondContact OG1-OD1 3.29Å; T468-D492 PolarHBondContact OG1-OD2 3.42Å; L478-D492 HydrophobicContact CD1-CB 4.14Å; L478-D492 HydrophobicContact CD2-CB 3.85Å; M488-D492 HydrophobicContact CB-CB 4.47Å; M488-D492 HydrophobicContact SD-CB 4.49Å; S489-D492 PolarHBondContact O-N 3.38Å; S489-D492 WeakPolarHBondContact OG-CB 3.48Å; S489-D492 PolarHBondContact OG-N 2.67Å; S489-D492 VanDerWaalsContact OG-N 3.11Å; S489-D492 PolarHBondContact OG-OD2 3.32Å; D492-N494 VanDerWaalsContact C-N 3.35Å; D492-N494 PolarHBondContact O-N 2.89Å; D492-R495 PolarHBondContact O-N 3.06Å; D492-R495 IonicContact OD1-NH1 3.13Å; D492-I496 WeakPolarHBondContact O-CG2 3.5Å; D492-I496 PolarHBondContact O-N 3Å; D492-I496 VanDerWaalsContact O-N 3.08Å
493	S	85.9	Confident	87.4	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.1	-36.3	176.9	73.2	0	0	0	0	112.2	S489 F490 E491 R495 I497	S489-S493 PolarHBondContact O-N 3.46Å; F490-S493 WeakPolarHBondContact CA-OG 3.42Å; F490-S493 PolarHBondContact O-OG 3.27Å; F490-S493 VanDerWaalsContact O-OG 3.12Å; E491-S493 PolarHBondContact O-N 2.96Å; S493-R495 VanDerWaalsContact C-N 3.28Å; S493-R495 PolarHBondContact O-N 3.36Å; S493-I497 VanDerWaalsContact O-CB 3.27Å; S493-I497 WeakPolarHBondContact O-CB 3.34Å; S493-I497 WeakPolarHBondContact O-CD1 3.49Å; S493-I497 WeakPolarHBondContact O-CG1 3.08Å; S493-I497 PolarHBondContact O-N 2.92Å; S493-I497 VanDerWaalsContact O-N 3.12Å
494	N	85.1	Confident	87.6	Confident	62 Å²	62	42.9 Å²	42.9	33%	0.332	22%	0.215	S	C	.	.	H	α-helix	trans	-64.5	-29.6	172.4	-79.1	-24.2	0	0	0	113.8	F490 E491 D492 P498 R595	F490-N494 VanDerWaalsContact CD1-ND2 3.33Å; F490-N494 WeakPolarHBondContact CD1-ND2 3.46Å; F490-N494 WeakPolarHBondContact CE1-ND2 3.37Å; F490-N494 WeakPolarHBondContact CZ-ND2 3.32Å; F490-N494 WeakPolarHBondContact O-CB 3.28Å; F490-N494 VanDerWaalsContact O-CG 3.24Å; F490-N494 PolarHBondContact O-N 2.94Å; F490-N494 PolarHBondContact O-ND2 3.41Å; E491-N494 PolarHBondContact O-N 3.3Å; D492-N494 VanDerWaalsContact C-N 3.35Å; D492-N494 PolarHBondContact O-N 2.89Å; N494-P498 WeakPolarHBondContact O-CD 3.37Å; N494-P498 VanDerWaalsContact O-CG 3.29Å; N494-P498 WeakPolarHBondContact O-CG 3.46Å; N494-R595 PolarHBondContact OD1-NH1 3.46Å; N494-R595 PolarHBondContact OD1-NH2 3.26Å; N494-R595 VanDerWaalsContact OD1-NH2 3.14Å
495	R	87.9	Confident	87.8	Confident	115 Å²	115	36.8 Å²	36.8	43%	0.434	19%	0.194	S	C	.	.	H	α-helix	trans	-79.3	-45.7	179.5	-69.3	170.6	69.3	-156.7	1.9	112.3	M466 E491 D492 S493	M466-R495 HydrophobicContact CE-CB 4.06Å; M466-R495 HydrophobicContact SD-CB 4.34Å; E491-R495 WeakPolarHBondContact O-CG 3.49Å; E491-R495 PolarHBondContact O-N 3.21Å; E491-R495 VanDerWaalsContact O-N 3.15Å; D492-R495 PolarHBondContact O-N 3.06Å; D492-R495 IonicContact OD1-NH1 3.13Å; S493-R495 VanDerWaalsContact C-N 3.28Å; S493-R495 PolarHBondContact O-N 3.36Å
496	I	90.6	Very high	88.1	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-85.5	-36	-172.7	-166.7	158.6	0	0	0	114.2	M466 L478 I482 M488 D492 L499 F500	M466-I496 HydrophobicContact SD-CB 4.37Å; L478-I496 HydrophobicContact CB-CD1 3.51Å; L478-I496 HydrophobicContact CD1-CB 4.13Å; L478-I496 HydrophobicContact CD1-CD1 4.36Å; L478-I496 HydrophobicContact CD1-CG2 4.48Å; I482-I496 HydrophobicContact CD1-CD1 3.57Å; I482-I496 HydrophobicContact CD1-CG1 4.06Å; I482-I496 HydrophobicContact CD1-CG2 4.03Å; M488-I496 HydrophobicContact SD-CG2 4.33Å; D492-I496 WeakPolarHBondContact O-CG2 3.5Å; D492-I496 PolarHBondContact O-N 3Å; D492-I496 VanDerWaalsContact O-N 3.08Å; I496-L499 PolarHBondContact O-N 2.88Å; I496-F500 WeakPolarHBondContact O-CB 3.33Å; I496-F500 PolarHBondContact O-N 2.97Å
497	I	89.9	Confident	88.6	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-60.8	-48	-174.2	-67.2	172.7	0	0	0	112.1	S493 L499 F500 Y501 R595 W596 L599	S493-I497 VanDerWaalsContact O-CB 3.27Å; S493-I497 WeakPolarHBondContact O-CB 3.34Å; S493-I497 WeakPolarHBondContact O-CD1 3.49Å; S493-I497 WeakPolarHBondContact O-CG1 3.08Å; S493-I497 PolarHBondContact O-N 2.92Å; S493-I497 VanDerWaalsContact O-N 3.12Å; I497-L499 PolarHBondContact O-N 3.42Å; I497-F500 PolarHBondContact O-N 3.23Å; I497-Y501 WeakPolarHBondContact O-CB 3.34Å; I497-Y501 PolarHBondContact O-N 3.39Å; I497-R595 HydrophobicContact CD1-CB 4.26Å; I497-W596 HydrophobicContact CD1-CD2 4.43Å; I497-W596 HydrophobicContact CD1-CE3 4.47Å; I497-W596 HydrophobicContact CD1-CH2 4.13Å; I497-W596 HydrophobicContact CD1-CZ2 4.09Å; I497-W596 HydrophobicContact CD1-CZ3 4.33Å; I497-W596 HydrophobicContact CG1-CH2 4.14Å; I497-W596 HydrophobicContact CG1-CZ3 4.2Å; I497-L599 HydrophobicContact CG1-CD2 4.18Å
498	P	91.8	Very high	89.2	Confident	8 Å²	8	28.8 Å²	28.8	5%	0.052	14%	0.138	C	C	.	.	H	α-helix	trans	-60.5	-44.2	-179.9	-25.8	36.9	0	0	0	113.3	H430 N494 L502	H430-P498 HydrophobicContact CB-CB 3.74Å; N494-P498 WeakPolarHBondContact O-CD 3.37Å; N494-P498 VanDerWaalsContact O-CG 3.29Å; N494-P498 WeakPolarHBondContact O-CG 3.46Å; P498-L502 VanDerWaalsContact O-CB 3.25Å; P498-L502 WeakPolarHBondContact O-CB 3.13Å; P498-L502 PolarHBondContact O-N 3.47Å
499	L	92.7	Very high	89.4	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-60.9	-49.9	177.4	-70.9	169.2	0	0	0	111.1	T423 A426 L459 L462 I463 M466 I496 I497 L502 F503	T423-L499 HydrophobicContact CG2-CD1 4.44Å; A426-L499 HydrophobicContact CB-CD2 3.49Å; A426-L499 VanDerWaalsContact CB-CD2 3.49Å; A426-L499 HydrophobicContact CB-CG 4.22Å; L459-L499 HydrophobicContact CD2-CD2 3.63Å; L462-L499 HydrophobicContact CB-CD1 4.21Å; L462-L499 HydrophobicContact CD1-CD2 4.14Å; I463-L499 HydrophobicContact CD1-CB 4.45Å; I463-L499 HydrophobicContact CG1-CB 3.91Å; M466-L499 HydrophobicContact CE-CD1 3.27Å; M466-L499 HydrophobicContact SD-CD1 3.75Å; I496-L499 PolarHBondContact O-N 2.88Å; I497-L499 PolarHBondContact O-N 3.42Å; L499-L502 PolarHBondContact O-N 2.83Å; L499-F503 VanDerWaalsContact O-CB 3.27Å; L499-F503 WeakPolarHBondContact O-CB 3.49Å; L499-F503 PolarHBondContact O-N 3.27Å
500	F	93.7	Very high	89.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-68.5	-42.8	-175.5	-155.3	170.4	0	0	0	111.4	W460 I463 L479 I482 I496 I497 S504 L547 A550 L599 I603	W460-F500 HydrophobicContact CZ3-CE2 4.28Å; I463-F500 HydrophobicContact CD1-CB 4.24Å; I463-F500 HydrophobicContact CD1-CD2 4.1Å; I463-F500 HydrophobicContact CD1-CG 4.36Å; I463-F500 HydrophobicContact CG1-CB 4.49Å; I463-F500 HydrophobicContact CG2-CD1 4.44Å; I463-F500 HydrophobicContact CG2-CG 4.43Å; L479-F500 HydrophobicContact CD1-CE1 3.74Å; L479-F500 HydrophobicContact CD1-CZ 4.08Å; I482-F500 HydrophobicContact CD1-CD1 4.3Å; I496-F500 WeakPolarHBondContact O-CB 3.33Å; I496-F500 PolarHBondContact O-N 2.97Å; I497-F500 PolarHBondContact O-N 3.23Å; F500-S504 WeakPolarHBondContact O-CB 3.28Å; F500-S504 PolarHBondContact O-N 2.92Å; F500-S504 PolarHBondContact O-OG 2.97Å; F500-L547 HydrophobicContact CE2-CD2 3.36Å; F500-L547 HydrophobicContact CZ-CD2 3.75Å; F500-A550 HydrophobicContact CE1-CB 3.82Å; F500-A550 HydrophobicContact CZ-CB 3.87Å; F500-L599 HydrophobicContact CB-CD1 4Å; F500-L599 HydrophobicContact CD1-CD2 4.41Å; F500-L599 HydrophobicContact CG-CD1 4.25Å; F500-I603 HydrophobicContact CD1-CD1 3.91Å; F500-I603 HydrophobicContact CD2-CD1 3.96Å; F500-I603 HydrophobicContact CD2-CG1 4.19Å; F500-I603 HydrophobicContact CE1-CD1 3.67Å; F500-I603 HydrophobicContact CE2-CD1 3.73Å; F500-I603 HydrophobicContact CE2-CG1 3.99Å; F500-I603 HydrophobicContact CG-CD1 4.06Å; F500-I603 HydrophobicContact CZ-CD1 3.59Å; F500-I603 HydrophobicContact CZ-CG1 4.29Å
501	Y	93.9	Very high	89.7	Confident	31 Å²	31	20.6 Å²	20.6	12%	0.122	10%	0.096	C	C	.	.	H	α-helix	trans	-60.7	-46.9	175.4	-175.4	-82	0	0	0	111.9	H430 M433 V434 I497 S505 Q598 L599 V602	H430-Y501 AromaticContact CD2-CD1 3.7Å; H430-Y501 AromaticContact CD2-CG 3.68Å; M433-Y501 HydrophobicContact CB-CE1 3.9Å; M433-Y501 HydrophobicContact CE-CE1 3.9Å; M433-Y501 HydrophobicContact SD-CE1 4.18Å; V434-Y501 HydrophobicContact CG2-CD1 4.15Å; V434-Y501 HydrophobicContact CG2-CD2 4.35Å; V434-Y501 HydrophobicContact CG2-CE1 3.64Å; V434-Y501 HydrophobicContact CG2-CE2 3.87Å; V434-Y501 HydrophobicContact CG2-CG 4.49Å; V434-Y501 VanDerWaalsContact CG2-CZ 3.5Å; I497-Y501 WeakPolarHBondContact O-CB 3.34Å; I497-Y501 PolarHBondContact O-N 3.39Å; Y501-S505 WeakPolarHBondContact O-CB 3.21Å; Y501-S505 PolarHBondContact O-N 2.89Å; Y501-S505 PolarHBondContact O-OG 3.45Å; Y501-Q598 HydrophobicContact CE2-CB 4.38Å; Y501-L599 HydrophobicContact CD2-CD1 4.47Å; Y501-V602 HydrophobicContact CD2-CB 4.44Å; Y501-V602 HydrophobicContact CD2-CG2 3.88Å; Y501-V602 HydrophobicContact CE2-CB 4.37Å; Y501-V602 HydrophobicContact CE2-CG2 3.36Å
502	L	94.2	Very high	89.4	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-65	-49.2	179.8	-177.2	66.6	0	0	0	110.9	A426 C429 M433 L446 F455 L459 P498 L499 S504 S505 L506	A426-L502 HydrophobicContact CB-CD2 3.94Å; C429-L502 HydrophobicContact CB-CD1 3.59Å; C429-L502 HydrophobicContact CB-CD2 3.8Å; C429-L502 HydrophobicContact CB-CG 4.35Å; M433-L502 HydrophobicContact SD-CD1 3.91Å; L446-L502 HydrophobicContact CD2-CD1 4.22Å; F455-L502 HydrophobicContact CE1-CD2 4.04Å; F455-L502 HydrophobicContact CZ-CD2 4.01Å; L459-L502 HydrophobicContact CD1-CD2 3.99Å; L459-L502 HydrophobicContact CD1-CG 4.15Å; P498-L502 VanDerWaalsContact O-CB 3.25Å; P498-L502 WeakPolarHBondContact O-CB 3.13Å; P498-L502 PolarHBondContact O-N 3.47Å; L499-L502 PolarHBondContact O-N 2.83Å; L502-S504 VanDerWaalsContact C-N 3.33Å; L502-S504 PolarHBondContact O-N 2.98Å; L502-S505 PolarHBondContact O-N 3.44Å; L502-L506 HydrophobicContact CD1-CD1 3.67Å; L502-L506 HydrophobicContact CD1-CD2 4.12Å; L502-L506 HydrophobicContact CD1-CG 3.67Å; L502-L506 HydrophobicContact CD2-CD1 4.19Å; L502-L506 HydrophobicContact CG-CD1 3.67Å; L502-L506 HydrophobicContact CG-CG 3.99Å; L502-L506 WeakPolarHBondContact O-CB 3.27Å; L502-L506 VanDerWaalsContact O-CG 3.31Å; L502-L506 WeakPolarHBondContact O-CG 3.25Å; L502-L506 PolarHBondContact O-N 3.41Å
503	F	95.4	Very high	88.7	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-53.1	-52.5	177.4	171.7	-100.8	0	0	0	111	L456 L459 W460 I463 L499 S505 F507 F535 L543 L606	L456-F503 HydrophobicContact CB-CE2 4.49Å; L456-F503 HydrophobicContact CD2-CD2 4.29Å; L459-F503 HydrophobicContact CB-CB 4.22Å; L459-F503 HydrophobicContact CB-CD2 4.16Å; L459-F503 HydrophobicContact CD1-CB 4.34Å; W460-F503 HydrophobicContact CB-CD2 4.27Å; W460-F503 HydrophobicContact CB-CE2 3.95Å; W460-F503 HydrophobicContact CB-CZ 4.34Å; W460-F503 HydrophobicContact CD2-CE1 4.36Å; W460-F503 HydrophobicContact CD2-CZ 4.33Å; W460-F503 AromaticContact CE3-CD1 3.8Å; W460-F503 HydrophobicContact CE3-CD1 3.8Å; W460-F503 AromaticContact CE3-CE1 3.49Å; W460-F503 HydrophobicContact CE3-CE1 3.49Å; W460-F503 VanDerWaalsContact CE3-CE1 3.49Å; W460-F503 HydrophobicContact CE3-CE2 4.44Å; W460-F503 HydrophobicContact CE3-CG 4.41Å; W460-F503 AromaticContact CE3-CZ 3.88Å; W460-F503 HydrophobicContact CE3-CZ 3.88Å; W460-F503 HydrophobicContact CZ3-CD1 4.22Å; W460-F503 AromaticContact CZ3-CE1 3.91Å; W460-F503 HydrophobicContact CZ3-CE1 3.91Å; I463-F503 HydrophobicContact CD1-CB 3.7Å; I463-F503 HydrophobicContact CD1-CD1 4.26Å; I463-F503 HydrophobicContact CD1-CG 4.01Å; L499-F503 VanDerWaalsContact O-CB 3.27Å; L499-F503 WeakPolarHBondContact O-CB 3.49Å; L499-F503 PolarHBondContact O-N 3.27Å; F503-S505 VanDerWaalsContact C-N 3.34Å; F503-S505 PolarHBondContact O-N 2.95Å; F503-F507 HydrophobicContact CE1-CD1 4.34Å; F503-F507 HydrophobicContact CE2-CB 4.31Å; F503-F507 HydrophobicContact CZ-CB 4.23Å; F503-F507 AromaticContact CZ-CD1 3.81Å; F503-F507 HydrophobicContact CZ-CD1 3.81Å; F503-F507 HydrophobicContact CZ-CG 4.23Å; F503-F507 WeakPolarHBondContact O-CB 3.33Å; F503-F507 PolarHBondContact O-N 3.41Å; F503-F535 AromaticContact CE2-CE2 3.76Å; F503-F535 HydrophobicContact CE2-CE2 3.76Å; F503-F535 AromaticContact CE2-CZ 3.71Å; F503-F535 HydrophobicContact CE2-CZ 3.71Å; F503-F535 AromaticContact CZ-CE2 3.87Å; F503-F535 HydrophobicContact CZ-CE2 3.87Å; F503-F535 HydrophobicContact CZ-CZ 4.03Å; F503-L543 HydrophobicContact CE1-CD1 4.24Å; F503-L543 HydrophobicContact CZ-CD1 3.73Å; F503-L606 HydrophobicContact CE1-CD2 4.12Å
504	S	94.6	Very high	88.1	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-65.5	-37.5	-177.7	-62.7	0	0	0	0	112.5	F500 L502 S508	F500-S504 WeakPolarHBondContact O-CB 3.28Å; F500-S504 PolarHBondContact O-N 2.92Å; F500-S504 PolarHBondContact O-OG 2.97Å; L502-S504 VanDerWaalsContact C-N 3.33Å; L502-S504 PolarHBondContact O-N 2.98Å; S504-S508 VanDerWaalsContact O-CB 3.26Å; S504-S508 WeakPolarHBondContact O-CB 3.25Å; S504-S508 PolarHBondContact O-N 3.04Å; S504-S508 PolarHBondContact O-OG 3.36Å
505	S	91.7	Very high	87.4	Confident	13 Å²	13	17.6 Å²	17.6	9%	0.091	9%	0.085	C	C	.	.	H	α-helix	trans	-69.3	-47.4	178.9	-58.6	0	0	0	0	112.7	M433 Y501 L502 F503 H509 V602	M433-S505 WeakPolarHBondContact CE-OG 3.42Å; Y501-S505 WeakPolarHBondContact O-CB 3.21Å; Y501-S505 PolarHBondContact O-N 2.89Å; Y501-S505 PolarHBondContact O-OG 3.45Å; L502-S505 PolarHBondContact O-N 3.44Å; F503-S505 VanDerWaalsContact C-N 3.34Å; F503-S505 PolarHBondContact O-N 2.95Å; S505-H509 PolarHBondContact O-N 3.19Å; S505-V602 VanDerWaalsContact N-CG1 3.3Å; S505-V602 WeakPolarHBondContact OG-CG1 3.47Å
506	L	91.4	Very high	86.5	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-67.5	-42.9	-179.5	-67.5	-174.6	0	0	0	111	V440 L446 L449 A450 F455 L456 L502 H509 S510	V440-L506 HydrophobicContact CG1-CD2 4.1Å; V440-L506 HydrophobicContact CG2-CD2 4.27Å; L446-L506 HydrophobicContact CB-CD2 4.42Å; L446-L506 WeakPolarHBondContact O-CD2 3.29Å; L449-L506 HydrophobicContact CB-CD1 3.97Å; A450-L506 HydrophobicContact CB-CB 4.25Å; A450-L506 HydrophobicContact CB-CD2 3.96Å; F455-L506 HydrophobicContact CD1-CD1 4.11Å; F455-L506 HydrophobicContact CE1-CD1 3.7Å; L456-L506 HydrophobicContact CD2-CB 3.76Å; L456-L506 HydrophobicContact CD2-CD1 4.47Å; L502-L506 HydrophobicContact CD1-CD1 3.67Å; L502-L506 HydrophobicContact CD1-CD2 4.12Å; L502-L506 HydrophobicContact CD1-CG 3.67Å; L502-L506 HydrophobicContact CD2-CD1 4.19Å; L502-L506 HydrophobicContact CG-CD1 3.67Å; L502-L506 HydrophobicContact CG-CG 3.99Å; L502-L506 WeakPolarHBondContact O-CB 3.27Å; L502-L506 VanDerWaalsContact O-CG 3.31Å; L502-L506 WeakPolarHBondContact O-CG 3.25Å; L502-L506 PolarHBondContact O-N 3.41Å; L506-H509 PolarHBondContact O-N 3.29Å; L506-S510 WeakPolarHBondContact O-CB 3.26Å; L506-S510 PolarHBondContact O-N 2.9Å
507	F	92.6	Very high	85.5	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-69.1	-38.8	179.3	-171.5	-140.7	0	0	0	111.8	L456 F503 H509 S510 L511 P534 F535 L540 L543 L606 L610	L456-F507 HydrophobicContact CD1-CD2 4.14Å; L456-F507 HydrophobicContact CD2-CB 4.31Å; F503-F507 HydrophobicContact CE1-CD1 4.34Å; F503-F507 HydrophobicContact CE2-CB 4.31Å; F503-F507 HydrophobicContact CZ-CB 4.23Å; F503-F507 AromaticContact CZ-CD1 3.81Å; F503-F507 HydrophobicContact CZ-CD1 3.81Å; F503-F507 HydrophobicContact CZ-CG 4.23Å; F503-F507 WeakPolarHBondContact O-CB 3.33Å; F503-F507 PolarHBondContact O-N 3.41Å; F507-H509 VanDerWaalsContact C-N 3.31Å; F507-H509 PolarHBondContact O-N 3.13Å; F507-S510 WeakPolarHBondContact O-CB 3.48Å; F507-S510 PolarHBondContact O-N 2.85Å; F507-L511 HydrophobicContact CD1-CD1 4.36Å; F507-L511 HydrophobicContact CD2-CG 4.14Å; F507-L511 HydrophobicContact CE1-CD1 4.04Å; F507-L511 HydrophobicContact CE1-CG 4.5Å; F507-L511 HydrophobicContact CE2-CD1 4.24Å; F507-L511 HydrophobicContact CE2-CD2 3.8Å; F507-L511 HydrophobicContact CE2-CG 3.81Å; F507-L511 HydrophobicContact CZ-CD1 3.97Å; F507-L511 HydrophobicContact CZ-CD2 3.87Å; F507-L511 HydrophobicContact CZ-CG 3.99Å; F507-L511 WeakPolarHBondContact O-CG 3.4Å; F507-L511 PolarHBondContact O-N 3.21Å; F507-P534 HydrophobicContact CD2-CG 3.87Å; F507-P534 HydrophobicContact CE2-CG 3.52Å; F507-P534 HydrophobicContact CZ-CG 4.41Å; F507-F535 HydrophobicContact CE1-CD2 4.26Å; F507-F535 HydrophobicContact CE1-CE2 4.44Å; F507-F535 HydrophobicContact CE2-CD2 4.21Å; F507-F535 HydrophobicContact CE2-CE2 4.48Å; F507-F535 AromaticContact CZ-CD2 3.95Å; F507-F535 HydrophobicContact CZ-CD2 3.95Å; F507-F535 HydrophobicContact CZ-CE2 4.41Å; F507-L540 HydrophobicContact CE1-CD2 4.04Å; F507-L540 HydrophobicContact CZ-CD2 3.79Å; F507-L543 HydrophobicContact CE1-CD2 4.41Å; F507-L606 HydrophobicContact CB-CD1 4.48Å; F507-L606 HydrophobicContact CB-CD2 4.42Å; F507-L606 HydrophobicContact CD1-CD1 3.58Å; F507-L606 HydrophobicContact CD1-CD2 3.78Å; F507-L606 HydrophobicContact CD1-CG 4.28Å; F507-L606 HydrophobicContact CE1-CD1 4.06Å; F507-L606 HydrophobicContact CG-CD1 4.23Å; F507-L610 HydrophobicContact CE1-CD2 4.39Å
508	S	89.4	Confident	84.7	Confident	6 Å²	6	18 Å²	18	4%	0.042	10%	0.097	C	C	.	.	H	α-helix	trans	-55.9	-45.4	168.8	-82.4	0	0	0	0	111.9	S504 L511 I512 N605 L606 M609	S504-S508 VanDerWaalsContact O-CB 3.26Å; S504-S508 WeakPolarHBondContact O-CB 3.25Å; S504-S508 PolarHBondContact O-N 3.04Å; S504-S508 PolarHBondContact O-OG 3.36Å; S508-L511 PolarHBondContact O-N 3.11Å; S508-I512 WeakPolarHBondContact O-CG1 3.48Å; S508-I512 PolarHBondContact O-N 3.39Å; S508-N605 PolarHBondContact OG-ND2 3.37Å; S508-L606 WeakPolarHBondContact OG-CA 3.37Å; S508-L606 WeakPolarHBondContact OG-CB 3.29Å; S508-L606 PolarHBondContact OG-N 3.34Å; S508-M609 WeakPolarHBondContact O-CE 3.33Å
509	H	85.3	Confident	84.2	Confident	36 Å²	36	18 Å²	18	17%	0.167	10%	0.097	C	C	.	.	H	α-helix	trans	-64.9	-42.5	178.9	-170.9	62.3	0	0	0	112.3	V440 Y447 S505 L506 F507 L511 I512	V440-H509 HydrophobicContact CB-CB 4.44Å; V440-H509 HydrophobicContact CG1-CB 4.03Å; V440-H509 VanDerWaalsContact CG1-CD2 3.4Å; V440-H509 WeakPolarHBondContact CG1-CD2 3.4Å; Y447-H509 AromaticContact CD2-NE2 3.72Å; Y447-H509 AromaticContact CE2-NE2 3.96Å; S505-H509 PolarHBondContact O-N 3.19Å; L506-H509 PolarHBondContact O-N 3.29Å; F507-H509 VanDerWaalsContact C-N 3.31Å; F507-H509 PolarHBondContact O-N 3.13Å; H509-L511 PolarHBondContact O-N 3.06Å; H509-I512 PolarHBondContact O-N 3.41Å
510	S	85.5	Confident	83.5	Confident	3 Å²	3	19 Å²	19	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-56.7	-47.3	174	-176.4	0	0	0	0	111.5	A450 L506 F507 I512 S513 V514	A450-S510 WeakPolarHBondContact O-CB 3.45Å; L506-S510 WeakPolarHBondContact O-CB 3.26Å; L506-S510 PolarHBondContact O-N 2.9Å; F507-S510 WeakPolarHBondContact O-CB 3.48Å; F507-S510 PolarHBondContact O-N 2.85Å; S510-I512 PolarHBondContact O-N 3.43Å; S510-I512 VanDerWaalsContact O-N 3.13Å; S510-S513 PolarHBondContact O-N 2.82Å; S510-S513 PolarHBondContact O-OG 3.28Å; S510-V514 WeakPolarHBondContact O-CG2 3.46Å; S510-V514 PolarHBondContact O-N 3.47Å
511	L	82.7	Confident	82.2	Confident	1 Å²	1	21 Å²	21	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-63.7	-19.6	-178.7	-73.4	176.8	0	0	0	115.2	F507 S508 H509 S513 F519 M533 L606 M609 L610 R613	F507-L511 HydrophobicContact CD1-CD1 4.36Å; F507-L511 HydrophobicContact CD2-CG 4.14Å; F507-L511 HydrophobicContact CE1-CD1 4.04Å; F507-L511 HydrophobicContact CE1-CG 4.5Å; F507-L511 HydrophobicContact CE2-CD1 4.24Å; F507-L511 HydrophobicContact CE2-CD2 3.8Å; F507-L511 HydrophobicContact CE2-CG 3.81Å; F507-L511 HydrophobicContact CZ-CD1 3.97Å; F507-L511 HydrophobicContact CZ-CD2 3.87Å; F507-L511 HydrophobicContact CZ-CG 3.99Å; F507-L511 WeakPolarHBondContact O-CG 3.4Å; F507-L511 PolarHBondContact O-N 3.21Å; S508-L511 PolarHBondContact O-N 3.11Å; H509-L511 PolarHBondContact O-N 3.06Å; L511-S513 VanDerWaalsContact C-N 3.29Å; L511-F519 HydrophobicContact CD2-CD2 3.97Å; L511-F519 HydrophobicContact CD2-CE2 3.79Å; L511-M533 HydrophobicContact CD2-CE 4.44Å; L511-M533 HydrophobicContact CD2-SD 4.24Å; L511-L606 HydrophobicContact CD1-CD1 3.52Å; L511-M609 HydrophobicContact CB-CE 3.61Å; L511-L610 HydrophobicContact CD1-CD2 3.8Å; L511-L610 HydrophobicContact CD1-CG 4.27Å; L511-R613 PolarHBondContact O-NH2 3.39Å
512	I	76.1	Confident	80.4	Confident	98 Å²	98	26.6 Å²	26.6	50%	0.503	15%	0.149	S	C	.	.	H	α-helix	trans	-68.6	-34.2	173.6	-63.5	170.4	0	0	0	110.4	S508 H509 S510 M609	S508-I512 WeakPolarHBondContact O-CG1 3.48Å; S508-I512 PolarHBondContact O-N 3.39Å; H509-I512 PolarHBondContact O-N 3.41Å; S510-I512 PolarHBondContact O-N 3.43Å; S510-I512 VanDerWaalsContact O-N 3.13Å; I512-M609 HydrophobicContact CG1-CE 3.69Å
513	S	71.3	Confident	78	Confident	36 Å²	36	36.1 Å²	36.1	25%	0.252	19%	0.194	S	C	.	.	H	α-helix	trans	-91.7	-19.3	-177	67	0	0	0	0	114.3	F451 S510 L511 H515	F451-S513 WeakPolarHBondContact CE1-OG 3.34Å; S510-S513 PolarHBondContact O-N 2.82Å; S510-S513 PolarHBondContact O-OG 3.28Å; L511-S513 VanDerWaalsContact C-N 3.29Å; S513-H515 PolarHBondContact O-CD2 3.16Å; S513-H515 VanDerWaalsContact O-CD2 3.3Å
514	V	74.8	Confident	75.4	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.012	23%	0.23	C	C	.	.			trans	-80.5	129.9	178.7	179.1	0	0	0	0	110.1	S510 E518 F519 M533 R613	S510-V514 WeakPolarHBondContact O-CG2 3.46Å; S510-V514 PolarHBondContact O-N 3.47Å; V514-E518 HydrophobicContact CG1-CB 3.77Å; V514-F519 HydrophobicContact CG1-CB 4.08Å; V514-M533 HydrophobicContact CB-SD 4.23Å; V514-M533 HydrophobicContact CG1-CG 3.84Å; V514-M533 HydrophobicContact CG1-SD 3.61Å; V514-M533 HydrophobicContact CG2-SD 4.05Å; V514-R613 PolarHBondContact O-NH1 3.29Å; V514-R613 PolarHBondContact O-NH2 3.42Å
515	H	69.4	Low	72.8	Confident	17 Å²	17	53.2 Å²	53.2	8%	0.079	28%	0.275	C	S	.	.			trans	-89.6	164.8	178.2	-65.2	-102.2	0	0	0	112.5	S513 S517 E518 F519 H855 K872	S513-H515 PolarHBondContact O-CD2 3.16Å; S513-H515 VanDerWaalsContact O-CD2 3.3Å; H515-S517 VanDerWaalsContact C-N 3.27Å; H515-S517 PolarHBondContact O-N 3.32Å; H515-E518 IonicContact CD2-OE2 2.76Å; H515-E518 PolarHBondContact N-OE2 2.98Å; H515-E518 PolarHBondContact O-N 3.35Å; H515-E518 VanDerWaalsContact O-N 3.15Å; H515-F519 VanDerWaalsContact O-CB 3.28Å; H515-F519 WeakPolarHBondContact O-CB 3.21Å; H515-F519 PolarHBondContact O-N 3.45Å; H515-H855 VanDerWaalsContact CA-CE1 3.46Å; H515-H855 WeakPolarHBondContact CA-CE1 3.34Å; H515-H855 AromaticContact CG-CE1 3.86Å; H515-H855 AromaticContact ND1-CE1 3.54Å; H515-K872 PolarHBondContact CD2-NZ 3.14Å; H515-K872 WeakPolarHBondContact NE2-CD 3.29Å; H515-K872 PolarHBondContact NE2-NZ 3.12Å; H515-K872 VanDerWaalsContact NE2-NZ 3.13Å
516	D	70.5	Confident	70.4	Confident	32 Å²	32	56.5 Å²	56.5	17%	0.171	31%	0.311	C	S	.	.	H	α-helix	trans	-57.8	-36.8	178.1	-72.6	-21.8	0	0	0	112.5	E518 F519 F520 R613 R616 H855	D516-E518 PolarHBondContact O-N 3.08Å; D516-F519 PolarHBondContact O-N 2.84Å; D516-F520 HydrophobicContact CB-CD2 4.05Å; D516-F520 HydrophobicContact CB-CE2 4.12Å; D516-F520 WeakPolarHBondContact O-CB 3.14Å; D516-F520 WeakPolarHBondContact O-CD2 3.26Å; D516-F520 PolarHBondContact O-N 3.35Å; D516-R613 IonicContact OD1-CZ 3.5Å; D516-R613 IonicContact OD1-NH1 2.98Å; D516-R613 PolarHBondContact OD1-NH1 2.94Å; D516-R616 IonicContact OD1-CZ 3.93Å; D516-R616 IonicContact OD1-NE 3.38Å; D516-R616 IonicContact OD1-NH2 3.49Å; D516-R616 PolarHBondContact OD1-NH2 2.92Å; D516-R616 IonicContact OD2-CZ 3.28Å; D516-R616 IonicContact OD2-NE 3.22Å; D516-R616 IonicContact OD2-NH2 2.75Å; D516-R616 PolarHBondContact OD2-NH2 3.35Å; D516-H855 PolarHBondContact N-CE1 3.48Å; D516-H855 VanDerWaalsContact N-CE1 3.3Å; D516-H855 IonicContact OD2-CG 2.74Å; D516-H855 IonicContact OD2-ND1 3.85Å; D516-H855 PolarHBondContact OD2-ND1 3.18Å
517	S	68.3	Low	67.8	Low	39 Å²	39	64.6 Å²	64.6	27%	0.273	35%	0.349	S	S	.	.	H	α-helix	trans	-63.6	-40.4	176.6	50.1	0	0	0	0	113.1	H515 G521	H515-S517 VanDerWaalsContact C-N 3.27Å; H515-S517 PolarHBondContact O-N 3.32Å; S517-G521 CarbonylContact O-C 3.6Å; S517-G521 VanDerWaalsContact O-CA 3.24Å; S517-G521 WeakPolarHBondContact O-CA 3.41Å; S517-G521 PolarHBondContact O-N 3.29Å
518	E	74.6	Confident	65.1	Low	53 Å²	53	74 Å²	74	25%	0.248	40%	0.395	C	S	.	.	H	α-helix	trans	-75.5	-34.3	176.7	-67.8	163.4	-174	0	0	111.5	V514 H515 D516 M533 K872	V514-E518 HydrophobicContact CG1-CB 3.77Å; H515-E518 IonicContact CD2-OE2 2.76Å; H515-E518 PolarHBondContact N-OE2 2.98Å; H515-E518 PolarHBondContact O-N 3.35Å; H515-E518 VanDerWaalsContact O-N 3.15Å; D516-E518 PolarHBondContact O-N 3.08Å; E518-M533 VanDerWaalsContact O-CG 3.27Å; E518-M533 WeakPolarHBondContact O-CG 3.49Å; E518-K872 IonicContact OE1-NZ 3Å; E518-K872 PolarHBondContact OE1-NZ 2.87Å; E518-K872 IonicContact OE2-NZ 3.05Å
519	F	79.7	Confident	62.9	Low	8 Å²	8	81.7 Å²	81.7	4%	0.035	43%	0.431	C	S	.	.	H	α-helix	trans	-68.9	-48.3	179.6	-172.9	-87.7	0	0	0	112.4	L511 V514 H515 D516 M533 L537 L540 L610 R613 F619	L511-F519 HydrophobicContact CD2-CD2 3.97Å; L511-F519 HydrophobicContact CD2-CE2 3.79Å; V514-F519 HydrophobicContact CG1-CB 4.08Å; H515-F519 VanDerWaalsContact O-CB 3.28Å; H515-F519 WeakPolarHBondContact O-CB 3.21Å; H515-F519 PolarHBondContact O-N 3.45Å; D516-F519 PolarHBondContact O-N 2.84Å; F519-M533 HydrophobicContact CD2-CE 3.4Å; F519-M533 HydrophobicContact CD2-SD 3.75Å; F519-M533 HydrophobicContact CE2-CE 3.57Å; F519-M533 HydrophobicContact CE2-SD 4.4Å; F519-M533 HydrophobicContact CG-CE 4.19Å; F519-M533 HydrophobicContact CZ-CE 4.47Å; F519-L537 HydrophobicContact CD1-CD2 4.35Å; F519-L537 HydrophobicContact CE1-CD2 4.04Å; F519-L540 HydrophobicContact CE1-CD1 4.31Å; F519-L540 HydrophobicContact CE2-CD1 3.92Å; F519-L540 HydrophobicContact CZ-CD1 3.65Å; F519-L610 HydrophobicContact CE2-CD2 4.34Å; F519-L610 HydrophobicContact CZ-CD2 4.36Å; F519-R613 HydrophobicContact CE1-CB 4.3Å; F519-R613 HydrophobicContact CE2-CG 4.47Å; F519-R613 HydrophobicContact CZ-CB 4.23Å; F519-R613 HydrophobicContact CZ-CG 4.44Å; F519-F619 HydrophobicContact CE1-CD1 4.17Å; F519-F619 AromaticContact CE1-CE1 3.89Å; F519-F619 HydrophobicContact CE1-CE1 3.89Å; F519-F619 HydrophobicContact CE1-CZ 4.28Å; F519-F619 HydrophobicContact CZ-CE1 4.09Å; F519-F619 HydrophobicContact CZ-CZ 4.12Å
520	F	78.1	Confident	61.1	Low	23 Å²	23	85.5 Å²	85.5	10%	0.101	46%	0.461	C	S	.	.	H	α-helix	trans	-89.8	-18.6	-178.1	-64.9	-72.6	0	0	0	113.2	D516 L537 R617 F619	D516-F520 HydrophobicContact CB-CD2 4.05Å; D516-F520 HydrophobicContact CB-CE2 4.12Å; D516-F520 WeakPolarHBondContact O-CB 3.14Å; D516-F520 WeakPolarHBondContact O-CD2 3.26Å; D516-F520 PolarHBondContact O-N 3.35Å; F520-L537 HydrophobicContact CD1-CD1 4.36Å; F520-L537 HydrophobicContact CD1-CD2 4.03Å; F520-L537 HydrophobicContact CE1-CD2 4.45Å; F520-R617 HydrophobicContact CD1-CG 4.37Å; F520-R617 HydrophobicContact CE1-CB 4.04Å; F520-R617 HydrophobicContact CE1-CG 4.01Å; F520-R617 WeakPolarHBondContact CE1-O 3.48Å; F520-R617 HydrophobicContact CE2-CB 3.85Å; F520-R617 HydrophobicContact CE2-CG 4.31Å; F520-R617 HydrophobicContact CZ-CB 3.56Å; F520-R617 HydrophobicContact CZ-CG 4.01Å; F520-R617 WeakPolarHBondContact CZ-O 3.5Å; F520-F619 HydrophobicContact CE1-CB 4.18Å; F520-F619 AromaticContact CE1-CD1 3.84Å; F520-F619 HydrophobicContact CE1-CD1 3.84Å; F520-F619 HydrophobicContact CE1-CG 4.33Å; F520-F619 HydrophobicContact CZ-CD1 4.38Å
521	G	66.7	Low	59.8	Low	44 Å²	44	88.7 Å²	88.7	45%	0.454	48%	0.484	S	S	.	.			trans	77.6	143.9	-171.7	0	0	0	0	0	112.5	S517	S517-G521 CarbonylContact O-C 3.6Å; S517-G521 VanDerWaalsContact O-CA 3.24Å; S517-G521 WeakPolarHBondContact O-CA 3.41Å; S517-G521 PolarHBondContact O-N 3.29Å
522	H	56.3	Low	58.9	Low	147 Å²	147	93.3 Å²	93.3	68%	0.681	51%	0.507	S	S	*	.			trans	-113.7	128	164.6	-104.7	-72.7	0	0	0	108.8	M524	H522-M524 VanDerWaalsContact C-N 3.34Å; H522-M524 HydrophobicContact CB-CG 4.47Å; H522-M524 PolarHBondContact O-N 2.75Å; H522-M524 VanDerWaalsContact O-N 3.16Å
523	E	43.3	Very low	59.3	Low	200 Å²	200	89.5 Å²	89.5	94%	0.935	49%	0.487	S	S	*	.			trans	-76.5	90.9	159.6	-70.5	-175.6	167.2	0	0	107.5
524	M	41.4	Very low	59.9	Low	156 Å²	156	88 Å²	88	77%	0.768	48%	0.476	S	S	*	.			trans	-99.9	128.4	159.6	-75.1	-81.5	-84.7	0	0	106.7	H522 G526	H522-M524 VanDerWaalsContact C-N 3.34Å; H522-M524 HydrophobicContact CB-CG 4.47Å; H522-M524 PolarHBondContact O-N 2.75Å; H522-M524 VanDerWaalsContact O-N 3.16Å; M524-G526 PolarHBondContact O-N 3.43Å
525	E	39.1	Very low	60.6	Low	203 Å²	203	88.5 Å²	88.5	95%	0.949	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	110.8	-177.2	-67.7	176.2	149.1	0	0	112.1
526	G	41.3	Very low	61.5	Low	82 Å²	82	91 Å²	91	85%	0.845	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	-2.2	153.7	0	0	0	0	0	119.6	M524	M524-G526 PolarHBondContact O-N 3.43Å
527	Q	36.7	Very low	62.4	Low	170 Å²	170	92.4 Å²	92.4	79%	0.794	50%	0.502	S	S	*	.			trans	-125.5	106.6	172.7	-80.8	-174.6	-20	0	0	112.5	Q529	Q527-Q529 VanDerWaalsContact C-N 3.34Å; Q527-Q529 PolarHBondContact O-N 2.87Å
528	M	36.3	Very low	63.4	Low	197 Å²	197	94.7 Å²	94.7	97%	0.97	52%	0.518	S	S	*	.			trans	-74.2	84.2	175.4	-165.4	175.2	166.5	0	0	109.3
529	Q	42.9	Very low	64.2	Low	168 Å²	168	95.1 Å²	95.1	79%	0.785	52%	0.52	S	S	*	.			trans	-61.3	136.2	167.7	-80.2	179.6	-13.7	0	0	109.1	Q527 S531	Q527-Q529 VanDerWaalsContact C-N 3.34Å; Q527-Q529 PolarHBondContact O-N 2.87Å; Q529-S531 PolarHBondContact O-N 3.12Å
530	S	48.1	Very low	64.8	Low	116 Å²	116	94.8 Å²	94.8	81%	0.811	52%	0.519	S	S	*	.			trans	-60	103.7	174.7	58.5	0	0	0	0	109	M532	S530-M532 PolarHBondContact O-N 3.01Å
531	S	57.5	Low	65.6	Low	71 Å²	71	94.7 Å²	94.7	50%	0.497	52%	0.52	S	S	.	.			trans	-63.5	124.9	178.7	-176.3	0	0	0	0	109.3	Q529 M533	Q529-S531 PolarHBondContact O-N 3.12Å; S531-M533 PolarHBondContact O-N 3.23Å; S531-M533 WeakPolarHBondContact OG-CB 3.3Å; S531-M533 PolarHBondContact OG-N 2.99Å
532	M	65.8	Low	66.8	Low	97 Å²	97	96.8 Å²	96.8	48%	0.478	52%	0.524	S	S	.	.	S	Bend	trans	-66.9	-9.1	171.6	-62.5	-132.6	78.9	0	0	112	F451 S530 P534	F451-M532 HydrophobicContact CD1-CE 4.34Å; S530-M532 PolarHBondContact O-N 3.01Å; M532-P534 WeakPolarHBondContact O-CD 3.31Å
533	M	82.7	Confident	68.6	Low	18 Å²	18	89.8 Å²	89.8	9%	0.089	49%	0.492	C	S	.	.			trans	-76.9	124.5	178.2	-81.8	-64	-73	0	0	112.9	L511 V514 E518 F519 S531 F535 L540	L511-M533 HydrophobicContact CD2-CE 4.44Å; L511-M533 HydrophobicContact CD2-SD 4.24Å; V514-M533 HydrophobicContact CB-SD 4.23Å; V514-M533 HydrophobicContact CG1-CG 3.84Å; V514-M533 HydrophobicContact CG1-SD 3.61Å; V514-M533 HydrophobicContact CG2-SD 4.05Å; E518-M533 VanDerWaalsContact O-CG 3.27Å; E518-M533 WeakPolarHBondContact O-CG 3.49Å; F519-M533 HydrophobicContact CD2-CE 3.4Å; F519-M533 HydrophobicContact CD2-SD 3.75Å; F519-M533 HydrophobicContact CE2-CE 3.57Å; F519-M533 HydrophobicContact CE2-SD 4.4Å; F519-M533 HydrophobicContact CG-CE 4.19Å; F519-M533 HydrophobicContact CZ-CE 4.47Å; S531-M533 PolarHBondContact O-N 3.23Å; S531-M533 WeakPolarHBondContact OG-CB 3.3Å; S531-M533 PolarHBondContact OG-N 2.99Å; M533-F535 PolarHBondContact O-N 2.8Å; M533-L540 HydrophobicContact CE-CD1 3.69Å
534	P	84.1	Confident	71.1	Confident	4 Å²	4	80.3 Å²	80.3	3%	0.026	45%	0.448	C	S	.	.	S	Bend	trans	-74.7	-20.7	-179.8	26.4	-32.6	0	0	0	114.5	A453 L456 R457 F507 M532	A453-P534 HydrophobicContact CB-CB 3.98Å; L456-P534 HydrophobicContact CB-CB 4.12Å; L456-P534 HydrophobicContact CD1-CB 4.16Å; L456-P534 HydrophobicContact CD1-CG 3.86Å; R457-P534 WeakPolarHBondContact CD-O 3.38Å; R457-P534 VanDerWaalsContact CG-O 3.23Å; R457-P534 WeakPolarHBondContact CG-O 3.43Å; R457-P534 PolarHBondContact NH1-O 2.91Å; F507-P534 HydrophobicContact CD2-CG 3.87Å; F507-P534 HydrophobicContact CE2-CG 3.52Å; F507-P534 HydrophobicContact CZ-CG 4.41Å; M532-P534 WeakPolarHBondContact O-CD 3.31Å
535	F	89.9	Confident	73.5	Confident	14 Å²	14	78.1 Å²	78.1	6%	0.061	43%	0.431	C	S	.	.	S	Bend	trans	-132.8	146.7	-173.1	-59	-76	0	0	0	111.3	R457 W460 F503 F507 M533 E539 L540 L543	R457-F535 HydrophobicContact CB-CE1 4.45Å; R457-F535 HydrophobicContact CG-CD1 4.28Å; R457-F535 HydrophobicContact CG-CE1 3.87Å; R457-F535 HydrophobicContact CG-CZ 4.29Å; W460-F535 HydrophobicContact CB-CE1 4.07Å; W460-F535 HydrophobicContact CB-CZ 3.84Å; W460-F535 HydrophobicContact CG-CE1 4.19Å; W460-F535 HydrophobicContact CG-CZ 4.22Å; F503-F535 AromaticContact CE2-CE2 3.76Å; F503-F535 HydrophobicContact CE2-CE2 3.76Å; F503-F535 AromaticContact CE2-CZ 3.71Å; F503-F535 HydrophobicContact CE2-CZ 3.71Å; F503-F535 AromaticContact CZ-CE2 3.87Å; F503-F535 HydrophobicContact CZ-CE2 3.87Å; F503-F535 HydrophobicContact CZ-CZ 4.03Å; F507-F535 HydrophobicContact CE1-CD2 4.26Å; F507-F535 HydrophobicContact CE1-CE2 4.44Å; F507-F535 HydrophobicContact CE2-CD2 4.21Å; F507-F535 HydrophobicContact CE2-CE2 4.48Å; F507-F535 AromaticContact CZ-CD2 3.95Å; F507-F535 HydrophobicContact CZ-CD2 3.95Å; F507-F535 HydrophobicContact CZ-CE2 4.41Å; M533-F535 PolarHBondContact O-N 2.8Å; F535-E539 WeakPolarHBondContact CA-OE2 3.45Å; F535-E539 HydrophobicContact CB-CB 4.13Å; F535-E539 HydrophobicContact CD1-CB 4.43Å; F535-L540 HydrophobicContact CB-CD2 3.77Å; F535-L540 HydrophobicContact CB-CG 3.88Å; F535-L540 HydrophobicContact CD2-CD2 4.24Å; F535-L540 HydrophobicContact CG-CD2 4.32Å; F535-L543 HydrophobicContact CD1-CD1 4.39Å; F535-L543 HydrophobicContact CD2-CD1 4.17Å; F535-L543 HydrophobicContact CE1-CD1 4.21Å; F535-L543 HydrophobicContact CE2-CD1 4.02Å; F535-L543 HydrophobicContact CG-CD1 4.39Å; F535-L543 HydrophobicContact CZ-CD1 4.04Å
536	T	89.4	Confident	76.1	Confident	69 Å²	69	70.2 Å²	70.2	42%	0.423	40%	0.397	S	S	.	.			trans	-75.2	163.6	171.9	67.8	0	0	0	0	111.1	S538 E539 L540	T536-S538 VanDerWaalsContact C-N 3.28Å; T536-S538 PolarHBondContact O-N 2.76Å; T536-S538 PolarHBondContact OG1-OG 3.45Å; T536-S538 VanDerWaalsContact OG1-OG 3.13Å; T536-E539 PolarHBondContact N-OE2 3.3Å; T536-E539 PolarHBondContact O-N 3.02Å; T536-E539 VanDerWaalsContact OG1-CG 3.29Å; T536-E539 WeakPolarHBondContact OG1-CG 3.45Å; T536-E539 PolarHBondContact OG1-N 3.37Å; T536-L540 WeakPolarHBondContact O-CG 3.42Å; T536-L540 PolarHBondContact O-N 3.43Å
537	L	89	Confident	78.7	Confident	61 Å²	61	66.3 Å²	66.3	32%	0.319	36%	0.357	S	S	.	.	H	α-helix	trans	-57.7	-38.8	177.9	-66.6	176.6	0	0	0	112.6	F519 F520 L540 V541 F619	F519-L537 HydrophobicContact CD1-CD2 4.35Å; F519-L537 HydrophobicContact CE1-CD2 4.04Å; F520-L537 HydrophobicContact CD1-CD1 4.36Å; F520-L537 HydrophobicContact CD1-CD2 4.03Å; F520-L537 HydrophobicContact CE1-CD2 4.45Å; L537-L540 HydrophobicContact CD2-CD1 4.44Å; L537-L540 PolarHBondContact O-N 3.31Å; L537-V541 WeakPolarHBondContact O-CG2 3.32Å; L537-V541 PolarHBondContact O-N 2.98Å; L537-F619 HydrophobicContact CD2-CB 4.18Å; L537-F619 HydrophobicContact CD2-CD2 4.21Å; L537-F619 HydrophobicContact CD2-CG 4.16Å
538	S	89.2	Confident	81.4	Confident	87 Å²	87	59 Å²	59	61%	0.608	32%	0.322	S	S	*	.	H	α-helix	trans	-68.3	-38.2	177.9	57.1	0	0	0	0	112.9	T536 V541 T542	T536-S538 VanDerWaalsContact C-N 3.28Å; T536-S538 PolarHBondContact O-N 2.76Å; T536-S538 PolarHBondContact OG1-OG 3.45Å; T536-S538 VanDerWaalsContact OG1-OG 3.13Å; S538-V541 PolarHBondContact O-N 3.01Å; S538-T542 PolarHBondContact O-N 3.47Å; S538-T542 PolarHBondContact O-OG1 2.81Å
539	E	91.8	Very high	84.1	Confident	63 Å²	63	51.6 Å²	51.6	29%	0.294	29%	0.286	S	S	.	.	H	α-helix	trans	-64.2	-41.7	172.4	-70.9	172.3	163	0	0	110.9	R457 F535 T536 V541 T542 L543	R457-E539 IonicContact CZ-OE1 2.77Å; R457-E539 IonicContact CZ-OE2 3.51Å; R457-E539 IonicContact NH1-OE1 3.9Å; R457-E539 IonicContact NH1-OE2 2.68Å; R457-E539 PolarHBondContact NH1-OE2 2.98Å; R457-E539 IonicContact NH2-OE1 3.22Å; R457-E539 PolarHBondContact NH2-OE1 3.2Å; R457-E539 IonicContact NH2-OE2 3.83Å; R457-E539 PolarHBondContact NH2-OE2 3.27Å; F535-E539 WeakPolarHBondContact CA-OE2 3.45Å; F535-E539 HydrophobicContact CB-CB 4.13Å; F535-E539 HydrophobicContact CD1-CB 4.43Å; T536-E539 PolarHBondContact N-OE2 3.3Å; T536-E539 PolarHBondContact O-N 3.02Å; T536-E539 VanDerWaalsContact OG1-CG 3.29Å; T536-E539 WeakPolarHBondContact OG1-CG 3.45Å; T536-E539 PolarHBondContact OG1-N 3.37Å; E539-V541 VanDerWaalsContact C-N 3.35Å; E539-V541 PolarHBondContact O-N 3.42Å; E539-T542 PolarHBondContact O-N 3.41Å; E539-L543 VanDerWaalsContact O-CB 3.24Å; E539-L543 WeakPolarHBondContact O-CB 3.37Å; E539-L543 PolarHBondContact O-N 3.45Å
540	L	92.1	Very high	86.5	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-64.4	-34.6	177.6	-71.1	174.4	0	0	0	113.3	F507 F519 M533 F535 T536 L537 S544 L610 F619	F507-L540 HydrophobicContact CE1-CD2 4.04Å; F507-L540 HydrophobicContact CZ-CD2 3.79Å; F519-L540 HydrophobicContact CE1-CD1 4.31Å; F519-L540 HydrophobicContact CE2-CD1 3.92Å; F519-L540 HydrophobicContact CZ-CD1 3.65Å; M533-L540 HydrophobicContact CE-CD1 3.69Å; F535-L540 HydrophobicContact CB-CD2 3.77Å; F535-L540 HydrophobicContact CB-CG 3.88Å; F535-L540 HydrophobicContact CD2-CD2 4.24Å; F535-L540 HydrophobicContact CG-CD2 4.32Å; T536-L540 WeakPolarHBondContact O-CG 3.42Å; T536-L540 PolarHBondContact O-N 3.43Å; L537-L540 HydrophobicContact CD2-CD1 4.44Å; L537-L540 PolarHBondContact O-N 3.31Å; L540-S544 WeakPolarHBondContact O-CB 3.37Å; L540-S544 PolarHBondContact O-N 3Å; L540-S544 PolarHBondContact O-OG 2.64Å; L540-L610 HydrophobicContact CD2-CD2 4.4Å; L540-F619 HydrophobicContact CB-CE2 4.03Å
541	V	93.6	Very high	88.6	Confident	21 Å²	21	38 Å²	38	13%	0.127	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-49.9	171.8	172.5	0	0	0	0	109.7	L537 S538 E539 L543 S544 R545 F619 P621 H624	L537-V541 WeakPolarHBondContact O-CG2 3.32Å; L537-V541 PolarHBondContact O-N 2.98Å; S538-V541 PolarHBondContact O-N 3.01Å; E539-V541 VanDerWaalsContact C-N 3.35Å; E539-V541 PolarHBondContact O-N 3.42Å; V541-L543 PolarHBondContact O-N 3.41Å; V541-S544 PolarHBondContact O-OG 3.35Å; V541-R545 PolarHBondContact O-N 3.43Å; V541-F619 HydrophobicContact CG2-CD2 4.08Å; V541-F619 HydrophobicContact CG2-CE2 4.41Å; V541-P621 HydrophobicContact CG1-CG 4.47Å; V541-H624 PolarHBondContact O-CE1 2.81Å; V541-H624 PolarHBondContact O-NE2 2.94Å
542	T	93	Very high	90.1	Very high	87 Å²	87	34.9 Å²	34.9	53%	0.534	19%	0.188	S	C	.	.	H	α-helix	trans	-64.1	-44.9	180	-52.9	0	0	0	0	111.4	S538 E539 R545 C546	S538-T542 PolarHBondContact O-N 3.47Å; S538-T542 PolarHBondContact O-OG1 2.81Å; E539-T542 PolarHBondContact O-N 3.41Å; T542-R545 PolarHBondContact O-N 3.48Å; T542-C546 PolarHBondContact O-N 2.91Å; T542-C546 VanDerWaalsContact O-N 3.11Å; T542-C546 PolarHBondContact O-SG 3.21Å; T542-C546 VanDerWaalsContact O-SG 3.4Å
543	L	94.4	Very high	91.2	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-61.4	-50.3	179.7	-174.7	149.6	0	0	0	111.8	W460 F503 F507 F535 E539 V541 R545 C546 L547 L610	W460-L543 HydrophobicContact CD2-CD1 3.63Å; W460-L543 HydrophobicContact CD2-CG 4.08Å; W460-L543 HydrophobicContact CE3-CD1 4.06Å; W460-L543 HydrophobicContact CE3-CG 4.28Å; W460-L543 HydrophobicContact CG-CD1 3.97Å; W460-L543 HydrophobicContact CH2-CD1 4.47Å; W460-L543 HydrophobicContact CH2-CG 3.86Å; W460-L543 HydrophobicContact CZ2-CB 3.95Å; W460-L543 HydrophobicContact CZ2-CD1 4.09Å; W460-L543 HydrophobicContact CZ2-CG 3.64Å; W460-L543 HydrophobicContact CZ3-CD1 4.46Å; W460-L543 HydrophobicContact CZ3-CG 4.17Å; F503-L543 HydrophobicContact CE1-CD1 4.24Å; F503-L543 HydrophobicContact CZ-CD1 3.73Å; F507-L543 HydrophobicContact CE1-CD2 4.41Å; F535-L543 HydrophobicContact CD1-CD1 4.39Å; F535-L543 HydrophobicContact CD2-CD1 4.17Å; F535-L543 HydrophobicContact CE1-CD1 4.21Å; F535-L543 HydrophobicContact CE2-CD1 4.02Å; F535-L543 HydrophobicContact CG-CD1 4.39Å; F535-L543 HydrophobicContact CZ-CD1 4.04Å; E539-L543 VanDerWaalsContact O-CB 3.24Å; E539-L543 WeakPolarHBondContact O-CB 3.37Å; E539-L543 PolarHBondContact O-N 3.45Å; V541-L543 PolarHBondContact O-N 3.41Å; L543-R545 VanDerWaalsContact C-N 3.29Å; L543-R545 PolarHBondContact O-N 2.87Å; L543-C546 WeakPolarHBondContact O-CB 3.38Å; L543-C546 PolarHBondContact O-N 3.46Å; L543-C546 VanDerWaalsContact O-N 3.12Å; L543-L547 HydrophobicContact CD2-CD1 3.42Å; L543-L547 VanDerWaalsContact CD2-CD1 3.42Å; L543-L547 HydrophobicContact CD2-CG 3.86Å; L543-L547 WeakPolarHBondContact O-CG 3.16Å; L543-L547 PolarHBondContact O-N 3.32Å; L543-L610 HydrophobicContact CD2-CD1 4.09Å
544	S	94.5	Very high	91.5	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-60.9	-35.8	180	56.9	0	0	0	0	112.8	L540 V541 R548 H624	L540-S544 WeakPolarHBondContact O-CB 3.37Å; L540-S544 PolarHBondContact O-N 3Å; L540-S544 PolarHBondContact O-OG 2.64Å; V541-S544 PolarHBondContact O-OG 3.35Å; S544-R548 WeakPolarHBondContact O-CB 3.26Å; S544-R548 PolarHBondContact O-N 2.93Å; S544-H624 PolarHBondContact OG-NE2 3.48Å
545	R	93.2	Very high	91.5	Very high	109 Å²	109	29.3 Å²	29.3	41%	0.411	16%	0.16	S	C	.	.	H	α-helix	trans	-62.5	-49.9	172.1	-170.7	174.9	-63.9	159.2	3.1	111.4	V541 T542 L543 L547 R548 D549 H624	V541-R545 PolarHBondContact O-N 3.43Å; T542-R545 PolarHBondContact O-N 3.48Å; L543-R545 VanDerWaalsContact C-N 3.29Å; L543-R545 PolarHBondContact O-N 2.87Å; R545-L547 VanDerWaalsContact C-N 3.34Å; R545-L547 PolarHBondContact O-N 2.84Å; R545-R548 PolarHBondContact O-N 3.16Å; R545-D549 VanDerWaalsContact O-CG 3.24Å; R545-D549 PolarHBondContact O-N 2.79Å; R545-H624 PolarHBondContact NH2-ND1 3.46Å
546	C	93.8	Very high	91.2	Very high	37 Å²	37	31.3 Å²	31.3	25%	0.25	17%	0.169	C	C	.	.	H	α-helix	trans	-59.2	-43	177.7	-70.7	0	0	0	0	112.5	W460 L479 T542 L543 A550	W460-C546 HydrophobicContact CH2-CB 3.82Å; W460-C546 HydrophobicContact CZ2-CB 4.01Å; L479-C546 HydrophobicContact CD2-CB 4.14Å; T542-C546 PolarHBondContact O-N 2.91Å; T542-C546 VanDerWaalsContact O-N 3.11Å; T542-C546 PolarHBondContact O-SG 3.21Å; T542-C546 VanDerWaalsContact O-SG 3.4Å; L543-C546 WeakPolarHBondContact O-CB 3.38Å; L543-C546 PolarHBondContact O-N 3.46Å; L543-C546 VanDerWaalsContact O-N 3.12Å; C546-A550 WeakPolarHBondContact O-CB 3.11Å; C546-A550 PolarHBondContact O-N 2.73Å
547	L	94.4	Very high	90.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.1	-45.2	177.1	-64.4	-176.9	0	0	0	112.1	W460 F500 L543 R545 A550 C551 I603 L606 V607 L610	W460-L547 HydrophobicContact CH2-CD2 4.09Å; W460-L547 HydrophobicContact CH2-CG 4.48Å; W460-L547 HydrophobicContact CZ3-CD2 3.8Å; F500-L547 HydrophobicContact CE2-CD2 3.36Å; F500-L547 HydrophobicContact CZ-CD2 3.75Å; L543-L547 HydrophobicContact CD2-CD1 3.42Å; L543-L547 VanDerWaalsContact CD2-CD1 3.42Å; L543-L547 HydrophobicContact CD2-CG 3.86Å; L543-L547 WeakPolarHBondContact O-CG 3.16Å; L543-L547 PolarHBondContact O-N 3.32Å; R545-L547 VanDerWaalsContact C-N 3.34Å; R545-L547 PolarHBondContact O-N 2.84Å; L547-A550 PolarHBondContact O-N 3.37Å; L547-C551 PolarHBondContact O-N 3.5Å; L547-I603 HydrophobicContact CB-CG2 4.04Å; L547-I603 HydrophobicContact CD2-CG2 4.12Å; L547-L606 HydrophobicContact CD1-CD2 3.46Å; L547-L606 VanDerWaalsContact CD1-CD2 3.46Å; L547-L606 HydrophobicContact CD1-CG 3.75Å; L547-V607 HydrophobicContact CB-CG2 3.47Å; L547-V607 VanDerWaalsContact CB-CG2 3.47Å; L547-V607 HydrophobicContact CD1-CG2 4.25Å; L547-L610 HydrophobicContact CD1-CD1 4.04Å
548	R	94	Very high	90.1	Very high	17 Å²	17	26.4 Å²	26.4	6%	0.064	14%	0.14	C	C	.	.	H	α-helix	trans	-58.2	-50.1	176.5	177.4	-156.9	67.2	173.8	8.2	110.9	S544 R545 A550 C551 L552 H624 W625 L626 V690	S544-R548 WeakPolarHBondContact O-CB 3.26Å; S544-R548 PolarHBondContact O-N 2.93Å; R545-R548 PolarHBondContact O-N 3.16Å; R548-A550 VanDerWaalsContact C-N 3.34Å; R548-A550 PolarHBondContact O-N 3.33Å; R548-C551 WeakPolarHBondContact O-CB 3.36Å; R548-C551 PolarHBondContact O-N 3.49Å; R548-L552 PolarHBondContact O-N 3.31Å; R548-L552 VanDerWaalsContact O-N 3.14Å; R548-H624 PolarHBondContact NH1-O 2.94Å; R548-W625 WeakPolarHBondContact CD-O 3.2Å; R548-L626 PolarHBondContact NH1-O 3.11Å; R548-V690 HydrophobicContact CG-CG1 3.93Å
549	D	93	Very high	89.3	Confident	41 Å²	41	23.9 Å²	23.9	22%	0.219	12%	0.118	C	C	.	.	H	α-helix	trans	-67.6	-37.2	-178.1	-63.2	-17.5	0	0	0	111.2	S483 R545 C551 L552 G553	S483-D549 WeakPolarHBondContact CA-O 3.38Å; R545-D549 VanDerWaalsContact O-CG 3.24Å; R545-D549 PolarHBondContact O-N 2.79Å; D549-C551 PolarHBondContact O-N 3.14Å; D549-L552 PolarHBondContact O-N 2.97Å; D549-G553 PolarHBondContact O-N 3.12Å
550	A	92.6	Very high	88.1	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60	-43.9	171.5	0	0	0	0	0	111.8	L479 I482 F500 C546 L547 R548 L552 G553 I554	L479-A550 HydrophobicContact CD1-CB 4.24Å; I482-A550 HydrophobicContact CG2-CB 4.01Å; F500-A550 HydrophobicContact CE1-CB 3.82Å; F500-A550 HydrophobicContact CZ-CB 3.87Å; C546-A550 WeakPolarHBondContact O-CB 3.11Å; C546-A550 PolarHBondContact O-N 2.73Å; L547-A550 PolarHBondContact O-N 3.37Å; R548-A550 VanDerWaalsContact C-N 3.34Å; R548-A550 PolarHBondContact O-N 3.33Å; A550-L552 PolarHBondContact O-N 3.37Å; A550-G553 PolarHBondContact O-N 3.49Å; A550-I554 WeakPolarHBondContact O-CG1 3.1Å; A550-I554 PolarHBondContact O-N 3.17Å
551	C	91.9	Very high	86.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.9	-45.2	175.2	-80.7	0	0	0	0	112.7	L547 R548 D549 G553 I554 I555 F600 I603 T604 L687	L547-C551 PolarHBondContact O-N 3.5Å; R548-C551 WeakPolarHBondContact O-CB 3.36Å; R548-C551 PolarHBondContact O-N 3.49Å; D549-C551 PolarHBondContact O-N 3.14Å; C551-G553 VanDerWaalsContact C-N 3.31Å; C551-G553 PolarHBondContact O-N 3.49Å; C551-I554 PolarHBondContact O-N 3.05Å; C551-I555 WeakPolarHBondContact O-CG1 3.45Å; C551-I555 PolarHBondContact O-N 3.2Å; C551-F600 HydrophobicContact CB-CD2 4.23Å; C551-F600 HydrophobicContact CB-CE2 3.91Å; C551-I603 WeakPolarHBondContact SG-CG2 3.44Å; C551-T604 PolarHBondContact SG-OG1 3.06Å; C551-T604 VanDerWaalsContact SG-OG1 3.35Å; C551-L687 HydrophobicContact CB-CD1 3.45Å; C551-L687 VanDerWaalsContact CB-CD1 3.45Å
552	L	90.5	Very high	84.8	Confident	5 Å²	5	35.9 Å²	35.9	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-61.5	-42	177.8	-66.8	176.1	0	0	0	111.7	R548 D549 A550 I555 K556 S627 V630 I683 V690	R548-L552 PolarHBondContact O-N 3.31Å; R548-L552 VanDerWaalsContact O-N 3.14Å; D549-L552 PolarHBondContact O-N 2.97Å; A550-L552 PolarHBondContact O-N 3.37Å; L552-I555 PolarHBondContact O-N 3.12Å; L552-K556 PolarHBondContact O-N 3.49Å; L552-S627 WeakPolarHBondContact CD1-OG 3.42Å; L552-V630 HydrophobicContact CD1-CG2 3.81Å; L552-V630 HydrophobicContact CD2-CG2 3.85Å; L552-V630 HydrophobicContact CG-CG2 4.44Å; L552-I683 HydrophobicContact CD2-CD1 4.06Å; L552-I683 HydrophobicContact CD2-CG1 4Å; L552-V690 HydrophobicContact CD2-CG2 4.19Å
553	G	88.7	Confident	82.7	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.2	-37.8	175.4	0	0	0	0	0	113.9	I482 S483 G485 D549 A550 C551 I555 K556 L557	I482-G553 CarbonylContact O-C 3.58Å; I482-G553 WeakPolarHBondContact O-CA 3.46Å; S483-G553 VanDerWaalsContact O-CA 3.3Å; S483-G553 WeakPolarHBondContact O-CA 3.43Å; G485-G553 VanDerWaalsContact CA-O 3.29Å; G485-G553 WeakPolarHBondContact CA-O 3.36Å; D549-G553 PolarHBondContact O-N 3.12Å; A550-G553 PolarHBondContact O-N 3.49Å; C551-G553 VanDerWaalsContact C-N 3.31Å; C551-G553 PolarHBondContact O-N 3.49Å; G553-I555 VanDerWaalsContact C-N 3.33Å; G553-I555 PolarHBondContact O-N 2.68Å; G553-K556 WeakPolarHBondContact O-CB 3.27Å; G553-K556 PolarHBondContact O-N 3.32Å; G553-K556 VanDerWaalsContact O-N 3.13Å; G553-L557 WeakPolarHBondContact O-CG 3.45Å; G553-L557 PolarHBondContact O-N 3.4Å
554	I	88.1	Confident	80.4	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.2	-35.9	173.7	-65.5	163.5	0	0	0	111.2	I482 A550 C551 K556 L557 A558 W596 L599 F600 I603	I482-I554 HydrophobicContact CG2-CD1 4.18Å; I482-I554 HydrophobicContact CG2-CG1 3.71Å; A550-I554 WeakPolarHBondContact O-CG1 3.1Å; A550-I554 PolarHBondContact O-N 3.17Å; C551-I554 PolarHBondContact O-N 3.05Å; I554-K556 VanDerWaalsContact C-N 3.31Å; I554-K556 PolarHBondContact O-N 2.86Å; I554-L557 PolarHBondContact O-N 3.37Å; I554-A558 WeakPolarHBondContact O-CB 3Å; I554-A558 PolarHBondContact O-N 2.98Å; I554-W596 HydrophobicContact CG1-CE3 3.99Å; I554-W596 HydrophobicContact CG1-CZ3 4.22Å; I554-W596 HydrophobicContact CG2-CB 4.11Å; I554-W596 HydrophobicContact CG2-CE3 4.18Å; I554-W596 WeakPolarHBondContact CG2-O 3.5Å; I554-L599 HydrophobicContact CD1-CD2 3.95Å; I554-L599 HydrophobicContact CD1-CG 4.11Å; I554-F600 HydrophobicContact CB-CD2 4.37Å; I554-F600 HydrophobicContact CG2-CB 3.8Å; I554-F600 HydrophobicContact CG2-CD2 4.28Å; I554-F600 HydrophobicContact CG2-CG 4.46Å; I554-I603 HydrophobicContact CD1-CD1 3.64Å
555	I	85.2	Confident	78	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-59.8	-43.2	172	-68.8	169.6	0	0	0	110.3	C551 L552 G553 L557 A558 Y559 F600 R679 A682 I683 L687	C551-I555 WeakPolarHBondContact O-CG1 3.45Å; C551-I555 PolarHBondContact O-N 3.2Å; L552-I555 PolarHBondContact O-N 3.12Å; G553-I555 VanDerWaalsContact C-N 3.33Å; G553-I555 PolarHBondContact O-N 2.68Å; I555-L557 VanDerWaalsContact C-N 3.33Å; I555-L557 PolarHBondContact O-N 3.23Å; I555-A558 PolarHBondContact O-N 3.12Å; I555-Y559 HydrophobicContact CG2-CD2 4.27Å; I555-Y559 WeakPolarHBondContact O-CD2 3.33Å; I555-Y559 PolarHBondContact O-N 2.83Å; I555-Y559 VanDerWaalsContact O-N 3.1Å; I555-F600 HydrophobicContact CD1-CE2 3.62Å; I555-F600 HydrophobicContact CD1-CZ 3.84Å; I555-F600 HydrophobicContact CG1-CD2 4.06Å; I555-F600 HydrophobicContact CG1-CE2 3.46Å; I555-F600 VanDerWaalsContact CG1-CE2 3.46Å; I555-F600 HydrophobicContact CG1-CZ 3.93Å; I555-R679 HydrophobicContact CG2-CB 4.06Å; I555-R679 HydrophobicContact CG2-CG 4.02Å; I555-A682 HydrophobicContact CD1-CB 4.28Å; I555-A682 HydrophobicContact CG1-CB 4.45Å; I555-A682 HydrophobicContact CG2-CB 4.07Å; I555-I683 HydrophobicContact CD1-CG1 3.7Å; I555-L687 HydrophobicContact CD1-CD1 4.32Å
556	K	83.9	Confident	75.6	Confident	57 Å²	57	43.3 Å²	43.3	25%	0.248	23%	0.228	C	C	.	.	H	α-helix	trans	-62.6	-38.2	175.5	-64.5	171.7	-172.1	168.6	0	112.1	L552 G553 I554 Y559 E629 R679	L552-K556 PolarHBondContact O-N 3.49Å; G553-K556 WeakPolarHBondContact O-CB 3.27Å; G553-K556 PolarHBondContact O-N 3.32Å; G553-K556 VanDerWaalsContact O-N 3.13Å; I554-K556 VanDerWaalsContact C-N 3.31Å; I554-K556 PolarHBondContact O-N 2.86Å; K556-Y559 CarbonylContact O-C 3.45Å; K556-Y559 VanDerWaalsContact O-C 3.31Å; K556-Y559 VanDerWaalsContact O-O 3.1Å; K556-E629 IonicContact NZ-OE2 3.79Å; K556-E629 PolarHBondContact NZ-OE2 3.15Å; K556-R679 PolarHBondContact O-NH2 3.02Å
557	L	80.7	Confident	73.3	Confident	27 Å²	27	45.4 Å²	45.4	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-70.4	-39.9	176.6	-70.8	171.7	0	0	0	113.3	G485 S486 G553 I554 I555 Y559 W596	G485-L557 WeakPolarHBondContact O-CD2 3.17Å; S486-L557 WeakPolarHBondContact O-CD2 3.46Å; G553-L557 WeakPolarHBondContact O-CG 3.45Å; G553-L557 PolarHBondContact O-N 3.4Å; I554-L557 PolarHBondContact O-N 3.37Å; I555-L557 VanDerWaalsContact C-N 3.33Å; I555-L557 PolarHBondContact O-N 3.23Å; L557-Y559 VanDerWaalsContact C-N 3.31Å; L557-W596 HydrophobicContact CD1-CD2 4.27Å; L557-W596 HydrophobicContact CD1-CE3 4.24Å; L557-W596 HydrophobicContact CD1-CH2 4.1Å; L557-W596 HydrophobicContact CD1-CZ2 4.1Å; L557-W596 HydrophobicContact CD1-CZ3 4.15Å
558	A	74.1	Confident	70.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-71	-28.1	-180	0	0	0	0	0	112.4	I554 I555 Q593 M654	I554-A558 WeakPolarHBondContact O-CB 3Å; I554-A558 PolarHBondContact O-N 2.98Å; I555-A558 PolarHBondContact O-N 3.12Å; A558-Q593 PolarHBondContact O-NE2 3.34Å; A558-M654 HydrophobicContact CB-CE 3.8Å
559	Y	71.4	Confident	68.5	Low	34 Å²	34	57.9 Å²	57.9	13%	0.133	29%	0.29	C	S	.	.	S	Bend	trans	-123.8	76.9	177.6	-59	-82.3	0	0	0	110.3	I555 K556 L557 M654 V675 E678 R679 A682	I555-Y559 HydrophobicContact CG2-CD2 4.27Å; I555-Y559 WeakPolarHBondContact O-CD2 3.33Å; I555-Y559 PolarHBondContact O-N 2.83Å; I555-Y559 VanDerWaalsContact O-N 3.1Å; K556-Y559 CarbonylContact O-C 3.45Å; K556-Y559 VanDerWaalsContact O-C 3.31Å; K556-Y559 VanDerWaalsContact O-O 3.1Å; L557-Y559 VanDerWaalsContact C-N 3.31Å; Y559-M654 HydrophobicContact CE2-CE 3.99Å; Y559-V675 VanDerWaalsContact O-CG1 3.23Å; Y559-V675 WeakPolarHBondContact O-CG1 3.35Å; Y559-E678 HydrophobicContact CD1-CB 4.09Å; Y559-E678 VanDerWaalsContact CD1-OE2 3.29Å; Y559-E678 WeakPolarHBondContact CD1-OE2 3.5Å; Y559-E678 HydrophobicContact CE1-CB 4.34Å; Y559-R679 PolarHBondContact O-NE 3Å; Y559-R679 PolarHBondContact O-NH2 2.75Å; Y559-A682 HydrophobicContact CE2-CB 4.32Å
560	P	67.5	Low	66.6	Low	66 Å²	66	63.3 Å²	63.3	43%	0.429	31%	0.308	S	S	.	.			trans	-70.1	145.9	-178.9	28.1	-33.6	0	0	0	112.1	T562	P560-T562 PolarHBondContact O-N 2.88Å
561	E	59.2	Low	64.3	Low	152 Å²	152	64.2 Å²	64.2	71%	0.71	31%	0.313	S	S	*	.	S	Bend	trans	-63.4	-27.2	-176.5	-74.1	172.2	-164.1	0	0	113.5	K563 R679	E561-K563 PolarHBondContact O-N 3.12Å; E561-K563 VanDerWaalsContact O-N 3.16Å; E561-R679 IonicContact OE1-CZ 3.87Å; E561-R679 IonicContact OE1-NH1 3.85Å; E561-R679 PolarHBondContact OE1-NH1 3.45Å; E561-R679 IonicContact OE1-NH2 3.37Å
562	T	56.4	Low	62.5	Low	119 Å²	119	67 Å²	67	73%	0.73	34%	0.336	S	S	*	.	S	Bend	trans	-80.5	91.8	172.6	53.6	0	0	0	0	109.6	P560 A564	P560-T562 PolarHBondContact O-N 2.88Å; T562-A564 PolarHBondContact O-N 3.32Å
563	K	49.6	Very low	60.8	Low	69 Å²	69	69.3 Å²	69.3	30%	0.3	36%	0.356	S	S	.	.			trans	-51.7	134.5	170.4	-88.6	-176.4	156.8	-153	0	110.6	E561 E565 V675	E561-K563 PolarHBondContact O-N 3.12Å; E561-K563 VanDerWaalsContact O-N 3.16Å; K563-E565 WeakPolarHBondContact CD-OE2 3.46Å; K563-E565 WeakPolarHBondContact CE-OE2 3.24Å; K563-E565 IonicContact NZ-OE2 3.22Å; K563-E565 PolarHBondContact NZ-OE2 3.11Å; K563-E565 PolarHBondContact O-N 3.17Å; K563-V675 HydrophobicContact CG-CG2 3.85Å
564	A	46.3	Very low	58.9	Low	59 Å²	59	74 Å²	74	49%	0.488	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-9.3	172	0	0	0	0	0	113.5	T562 R567	T562-A564 PolarHBondContact O-N 3.32Å; A564-R567 WeakPolarHBondContact O-CA 3.39Å; A564-R567 WeakPolarHBondContact O-CB 3.33Å; A564-R567 PolarHBondContact O-N 3.08Å; A564-R567 VanDerWaalsContact O-N 3.14Å
565	E	43.2	Very low	57.2	Low	80 Å²	80	82.9 Å²	82.9	37%	0.374	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-36.1	-176.7	-68	174.8	154	0	0	113	K563 R567 E568 Q672	K563-E565 WeakPolarHBondContact CD-OE2 3.46Å; K563-E565 WeakPolarHBondContact CE-OE2 3.24Å; K563-E565 IonicContact NZ-OE2 3.22Å; K563-E565 PolarHBondContact NZ-OE2 3.11Å; K563-E565 PolarHBondContact O-N 3.17Å; E565-R567 PolarHBondContact O-N 3.49Å; E565-E568 PolarHBondContact O-N 3.45Å; E565-Q672 PolarHBondContact OE1-NE2 3.36Å; E565-Q672 PolarHBondContact OE1-OE1 3.15Å; E565-Q672 PolarHBondContact OE2-OE1 3.49Å; E565-Q672 VanDerWaalsContact OE2-OE1 3.1Å
566	H	42.6	Very low	55.8	Low	146 Å²	146	87.5 Å²	87.5	68%	0.676	44%	0.442	S	S	*	.	H	α-helix	trans	-61.7	-17.9	169.2	-73.8	-59.1	0	0	0	112.1	Y570	H566-Y570 WeakPolarHBondContact O-CB 3.21Å; H566-Y570 PolarHBondContact O-N 3.27Å
567	R	45.5	Very low	54.3	Low	80 Å²	80	90.1 Å²	90.1	30%	0.302	46%	0.463	S	S	.	.	H	α-helix	trans	-77.1	-21.7	173	-142	-177.5	-172.5	-175.2	2.7	111.8	A564 E565 Y570 M571	A564-R567 WeakPolarHBondContact O-CA 3.39Å; A564-R567 WeakPolarHBondContact O-CB 3.33Å; A564-R567 PolarHBondContact O-N 3.08Å; A564-R567 VanDerWaalsContact O-N 3.14Å; E565-R567 PolarHBondContact O-N 3.49Å; R567-Y570 CarbonylContact O-C 3.59Å; R567-M571 HydrophobicContact CG-CG 4.4Å; R567-M571 WeakPolarHBondContact O-CA 3.45Å; R567-M571 WeakPolarHBondContact O-CB 3.41Å; R567-M571 WeakPolarHBondContact O-CG 3.33Å; R567-M571 PolarHBondContact O-N 3.33Å
568	E	45.3	Very low	52.4	Low	126 Å²	126	91.6 Å²	91.6	59%	0.589	48%	0.484	S	S	*	.	H	α-helix	trans	-74.2	-45	-179.5	-82.1	-171.1	162	0	0	113.1	E565 M571 A572	E565-E568 PolarHBondContact O-N 3.45Å; E568-M571 HydrophobicContact CB-CE 4.24Å; E568-M571 HydrophobicContact CG-CE 3.53Å; E568-M571 CarbonylContact O-C 3.46Å; E568-M571 PolarHBondContact O-N 3.03Å; E568-A572 WeakPolarHBondContact O-CB 3.4Å; E568-A572 PolarHBondContact O-N 3.45Å
569	E	44	Very low	50.9	Low	153 Å²	153	95 Å²	95	72%	0.715	51%	0.505	S	S	*	.	H	α-helix	trans	-66.4	-39.7	171.3	-67.7	-179.3	162.3	0	0	111.1	M571 A572 A573	E569-M571 VanDerWaalsContact C-N 3.32Å; E569-M571 PolarHBondContact O-N 3.37Å; E569-A572 PolarHBondContact O-N 3.47Å; E569-A573 PolarHBondContact O-N 3.39Å
570	Y	51.2	Low	49.8	Very low	156 Å²	156	102.8 Å²	102.8	61%	0.612	54%	0.54	S	S	*	.	H	α-helix	trans	-61.4	-40.1	169.7	-127.6	-113.8	0	0	0	111.4	H566 R567 A573 F574	H566-Y570 WeakPolarHBondContact O-CB 3.21Å; H566-Y570 PolarHBondContact O-N 3.27Å; R567-Y570 CarbonylContact O-C 3.59Å; Y570-A573 CarbonylContact O-C 3.6Å; Y570-A573 WeakPolarHBondContact O-CA 3.36Å; Y570-A573 WeakPolarHBondContact O-CB 3.35Å; Y570-A573 PolarHBondContact O-N 3.4Å; Y570-F574 AromaticContact CD1-CD2 3.81Å; Y570-F574 HydrophobicContact CD1-CD2 3.81Å; Y570-F574 AromaticContact CD1-CE2 3.45Å; Y570-F574 HydrophobicContact CD1-CE2 3.45Å; Y570-F574 VanDerWaalsContact CD1-CE2 3.45Å; Y570-F574 HydrophobicContact CE1-CD2 4.32Å; Y570-F574 AromaticContact CE1-CE2 3.51Å; Y570-F574 HydrophobicContact CE1-CE2 3.51Å; Y570-F574 HydrophobicContact CE1-CZ 4.42Å; Y570-F574 HydrophobicContact CG-CE2 4.48Å; Y570-F574 VanDerWaalsContact O-CD2 3.26Å; Y570-F574 WeakPolarHBondContact O-CD2 3.31Å; Y570-F574 PolarHBondContact O-N 3.31Å
571	M	45.8	Very low	48.8	Very low	18 Å²	18	104.6 Å²	104.6	9%	0.089	55%	0.55	C	S	.	.	H	α-helix	trans	-71	-34	178.4	-85.2	-173.9	-56	0	0	111.4	R567 E568 E569 A573 F574 R575	R567-M571 HydrophobicContact CG-CG 4.4Å; R567-M571 WeakPolarHBondContact O-CA 3.45Å; R567-M571 WeakPolarHBondContact O-CB 3.41Å; R567-M571 WeakPolarHBondContact O-CG 3.33Å; R567-M571 PolarHBondContact O-N 3.33Å; E568-M571 HydrophobicContact CB-CE 4.24Å; E568-M571 HydrophobicContact CG-CE 3.53Å; E568-M571 CarbonylContact O-C 3.46Å; E568-M571 PolarHBondContact O-N 3.03Å; E569-M571 VanDerWaalsContact C-N 3.32Å; E569-M571 PolarHBondContact O-N 3.37Å; M571-A573 VanDerWaalsContact C-N 3.29Å; M571-F574 PolarHBondContact O-N 3.34Å; M571-R575 VanDerWaalsContact O-CB 3.26Å; M571-R575 WeakPolarHBondContact O-CB 3.3Å; M571-R575 VanDerWaalsContact O-CG 3.22Å; M571-R575 WeakPolarHBondContact O-CG 3.26Å; M571-R575 PolarHBondContact O-N 2.84Å
572	A	53.8	Low	48.7	Very low	59 Å²	59	100 Å²	100	49%	0.488	53%	0.53	S	S	.	.	H	α-helix	trans	-62.3	-41.6	170	0	0	0	0	0	110.1	E568 E569 S576	E568-A572 WeakPolarHBondContact O-CB 3.4Å; E568-A572 PolarHBondContact O-N 3.45Å; E569-A572 PolarHBondContact O-N 3.47Å; A572-S576 PolarHBondContact O-N 3.23Å; A572-S576 VanDerWaalsContact O-N 3.1Å
573	A	53.6	Low	48.8	Very low	54 Å²	54	99.1 Å²	99.1	45%	0.446	53%	0.525	S	S	.	.	H	α-helix	trans	-70.6	-26.4	173.6	0	0	0	0	0	114.5	E569 Y570 M571 S576 V577	E569-A573 PolarHBondContact O-N 3.39Å; Y570-A573 CarbonylContact O-C 3.6Å; Y570-A573 WeakPolarHBondContact O-CA 3.36Å; Y570-A573 WeakPolarHBondContact O-CB 3.35Å; Y570-A573 PolarHBondContact O-N 3.4Å; M571-A573 VanDerWaalsContact C-N 3.29Å; A573-S576 PolarHBondContact O-OG 3.11Å; A573-V577 WeakPolarHBondContact O-CG2 3.39Å
574	F	49.6	Very low	49.3	Very low	99 Å²	99	99.7 Å²	99.7	43%	0.434	53%	0.528	S	S	.	.	H	α-helix	trans	-86.4	-29.7	173.6	-90	-80.9	0	0	0	113	Y570 M571 S576 V577 G578 V579	Y570-F574 AromaticContact CD1-CD2 3.81Å; Y570-F574 HydrophobicContact CD1-CD2 3.81Å; Y570-F574 AromaticContact CD1-CE2 3.45Å; Y570-F574 HydrophobicContact CD1-CE2 3.45Å; Y570-F574 VanDerWaalsContact CD1-CE2 3.45Å; Y570-F574 HydrophobicContact CE1-CD2 4.32Å; Y570-F574 AromaticContact CE1-CE2 3.51Å; Y570-F574 HydrophobicContact CE1-CE2 3.51Å; Y570-F574 HydrophobicContact CE1-CZ 4.42Å; Y570-F574 HydrophobicContact CG-CE2 4.48Å; Y570-F574 VanDerWaalsContact O-CD2 3.26Å; Y570-F574 WeakPolarHBondContact O-CD2 3.31Å; Y570-F574 PolarHBondContact O-N 3.31Å; M571-F574 PolarHBondContact O-N 3.34Å; F574-S576 VanDerWaalsContact C-N 3.32Å; F574-V577 CarbonylContact O-C 3.5Å; F574-V577 PolarHBondContact O-N 3.19Å; F574-G578 PolarHBondContact O-N 2.88Å; F574-V579 HydrophobicContact CD1-CG2 4.28Å; F574-V579 PolarHBondContact O-N 3.16Å
575	R	53	Low	50.1	Low	185 Å²	185	99.6 Å²	99.6	70%	0.698	52%	0.522	S	S	*	.	H	α-helix	trans	-65.6	-36.2	170.6	-79	-178.6	-148.9	-179.3	9.2	110.9	M571 V577 G578	M571-R575 VanDerWaalsContact O-CB 3.26Å; M571-R575 WeakPolarHBondContact O-CB 3.3Å; M571-R575 VanDerWaalsContact O-CG 3.22Å; M571-R575 WeakPolarHBondContact O-CG 3.26Å; M571-R575 PolarHBondContact O-N 2.84Å; R575-V577 PolarHBondContact O-N 3.4Å; R575-G578 PolarHBondContact O-N 2.92Å; R575-G578 VanDerWaalsContact O-N 3.15Å
576	S	55.5	Low	50.9	Low	98 Å²	98	98.2 Å²	98.2	69%	0.685	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-17.2	173.9	66.4	0	0	0	0	113.3	A572 A573 F574	A572-S576 PolarHBondContact O-N 3.23Å; A572-S576 VanDerWaalsContact O-N 3.1Å; A573-S576 PolarHBondContact O-OG 3.11Å; F574-S576 VanDerWaalsContact C-N 3.32Å
577	V	51.9	Low	52	Low	112 Å²	112	98.7 Å²	98.7	68%	0.679	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	3.3	176.4	-168.1	0	0	0	0	112.4	A573 F574 R575	A573-V577 WeakPolarHBondContact O-CG2 3.39Å; F574-V577 CarbonylContact O-C 3.5Å; F574-V577 PolarHBondContact O-N 3.19Å; R575-V577 PolarHBondContact O-N 3.4Å
578	G	40.9	Very low	52.9	Low	58 Å²	58	102.9 Å²	102.9	60%	0.598	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	16.3	168	0	0	0	0	0	117.2	F574 R575	F574-G578 PolarHBondContact O-N 2.88Å; R575-G578 PolarHBondContact O-N 2.92Å; R575-G578 VanDerWaalsContact O-N 3.15Å
579	V	41.9	Very low	53.9	Low	72 Å²	72	100.7 Å²	100.7	44%	0.436	52%	0.518	S	S	.	.			trans	-84.2	116	-179.5	-176.7	0	0	0	0	111.4	F574 T581	F574-V579 HydrophobicContact CD1-CG2 4.28Å; F574-V579 PolarHBondContact O-N 3.16Å; V579-T581 WeakPolarHBondContact CG1-OG1 3.33Å
580	K	48.6	Very low	55	Low	197 Å²	197	98.9 Å²	98.9	86%	0.857	51%	0.51	S	S	*	.			trans	-95.2	5.5	-174.2	-67	-173.6	177.9	-178.7	0	116.1
581	T	47.6	Very low	55.9	Low	105 Å²	105	94 Å²	94	64%	0.644	50%	0.502	S	S	*	.			trans	-92.4	0.7	-163.2	47.5	0	0	0	0	117	V579	V579-T581 WeakPolarHBondContact CG1-OG1 3.33Å
582	N	57.3	Low	57.1	Low	54 Å²	54	95.5 Å²	95.5	29%	0.289	51%	0.509	S	S	.	.	H	α-helix	trans	-94.3	-11.2	-166.8	-113.7	-22.1	0	0	0	117.2	V585 Q586	N582-V585 PolarHBondContact O-N 3.31Å; N582-Q586 PolarHBondContact O-N 3.35Å; N582-Q586 VanDerWaalsContact O-N 3.13Å
583	T	58.5	Low	57.9	Low	101 Å²	101	95.8 Å²	95.8	62%	0.62	50%	0.5	S	S	*	.	H	α-helix	trans	-69.2	-37.8	-178.8	48.3	0	0	0	0	112.8	Q586 R587	T583-Q586 PolarHBondContact O-N 3.18Å; T583-R587 PolarHBondContact O-N 3.43Å; T583-R587 VanDerWaalsContact O-N 3.12Å
584	E	59.5	Low	59	Low	81 Å²	81	99.7 Å²	99.7	38%	0.379	51%	0.507	S	S	.	.	H	α-helix	trans	-69.2	-38	177.5	-177.3	56.8	-159.5	0	0	112	Q586 R587 R588	E584-Q586 VanDerWaalsContact C-N 3.33Å; E584-Q586 PolarHBondContact O-N 3.49Å; E584-R587 PolarHBondContact O-N 3.06Å; E584-R587 IonicContact OE2-CZ 2.71Å; E584-R587 IonicContact OE2-NH1 3.6Å; E584-R587 PolarHBondContact OE2-NH1 2.85Å; E584-R588 WeakPolarHBondContact O-CG 2.84Å; E584-R588 PolarHBondContact O-N 3.26Å; E584-R588 VanDerWaalsContact O-N 3.07Å; E584-R588 IonicContact OE1-NE 2.77Å; E584-R588 PolarHBondContact OE1-NE 3.35Å; E584-R588 IonicContact OE1-NH2 3.59Å
585	V	62.1	Low	60.5	Low	58 Å²	58	97.2 Å²	97.2	35%	0.352	50%	0.495	S	S	.	.	H	α-helix	trans	-63.4	-40.8	174.3	179.2	0	0	0	0	110.8	N582 R588 I589	N582-V585 PolarHBondContact O-N 3.31Å; V585-R588 PolarHBondContact O-N 2.97Å; V585-I589 HydrophobicContact CG1-CD1 4Å; V585-I589 VanDerWaalsContact O-CG1 3.32Å; V585-I589 WeakPolarHBondContact O-CG1 3.33Å; V585-I589 PolarHBondContact O-N 3.03Å; V585-I589 VanDerWaalsContact O-N 3.1Å
586	Q	61.1	Low	62	Low	50 Å²	50	88.9 Å²	88.9	23%	0.234	46%	0.463	C	S	.	.	H	α-helix	trans	-62.7	-45	176.6	-159.4	101.1	-13.4	0	0	112	N582 T583 E584 R588 I589 Q590	N582-Q586 PolarHBondContact O-N 3.35Å; N582-Q586 VanDerWaalsContact O-N 3.13Å; T583-Q586 PolarHBondContact O-N 3.18Å; E584-Q586 VanDerWaalsContact C-N 3.33Å; E584-Q586 PolarHBondContact O-N 3.49Å; Q586-R588 VanDerWaalsContact C-N 3.33Å; Q586-R588 PolarHBondContact O-N 2.61Å; Q586-I589 PolarHBondContact O-N 3.16Å; Q586-Q590 WeakPolarHBondContact O-CG 3.22Å; Q586-Q590 PolarHBondContact O-N 3.09Å
587	R	65.3	Low	63.2	Low	157 Å²	157	85 Å²	85	59%	0.592	44%	0.435	S	S	*	.	H	α-helix	trans	-61.1	-40.6	176.4	-72.1	-170.1	-151.6	137.9	-7.7	112.3	T583 E584 Q590 A591	T583-R587 PolarHBondContact O-N 3.43Å; T583-R587 VanDerWaalsContact O-N 3.12Å; E584-R587 PolarHBondContact O-N 3.06Å; E584-R587 IonicContact OE2-CZ 2.71Å; E584-R587 IonicContact OE2-NH1 3.6Å; E584-R587 PolarHBondContact OE2-NH1 2.85Å; R587-Q590 PolarHBondContact O-N 2.74Å; R587-A591 WeakPolarHBondContact O-CB 3.45Å; R587-A591 PolarHBondContact O-N 3.4Å
588	R	64.9	Low	64.7	Low	168 Å²	168	82.3 Å²	82.3	63%	0.634	42%	0.415	S	S	*	.	H	α-helix	trans	-62.9	-44.7	177.8	-73	179.7	-175.4	-156.3	-1	112	E584 V585 Q586 Q590 A591 E592	E584-R588 WeakPolarHBondContact O-CG 2.84Å; E584-R588 PolarHBondContact O-N 3.26Å; E584-R588 VanDerWaalsContact O-N 3.07Å; E584-R588 IonicContact OE1-NE 2.77Å; E584-R588 PolarHBondContact OE1-NE 3.35Å; E584-R588 IonicContact OE1-NH2 3.59Å; V585-R588 PolarHBondContact O-N 2.97Å; Q586-R588 VanDerWaalsContact C-N 3.33Å; Q586-R588 PolarHBondContact O-N 2.61Å; R588-Q590 PolarHBondContact O-N 3.38Å; R588-A591 PolarHBondContact O-N 3.32Å; R588-E592 WeakPolarHBondContact O-CB 3.49Å; R588-E592 PolarHBondContact O-N 3.02Å
589	I	66.4	Low	66.9	Low	79 Å²	79	79.6 Å²	79.6	41%	0.405	39%	0.387	S	S	.	.	H	α-helix	trans	-61.6	-45.3	176.9	-66.7	165.4	0	0	0	110.8	V585 Q586 E592 Q593	V585-I589 HydrophobicContact CG1-CD1 4Å; V585-I589 VanDerWaalsContact O-CG1 3.32Å; V585-I589 WeakPolarHBondContact O-CG1 3.33Å; V585-I589 PolarHBondContact O-N 3.03Å; V585-I589 VanDerWaalsContact O-N 3.1Å; Q586-I589 PolarHBondContact O-N 3.16Å; I589-E592 PolarHBondContact O-N 3.48Å; I589-Q593 WeakPolarHBondContact O-CB 3.15Å; I589-Q593 PolarHBondContact O-N 2.84Å
590	Q	67.1	Low	69.2	Low	115 Å²	115	76.2 Å²	76.2	54%	0.537	37%	0.367	S	S	.	.	H	α-helix	trans	-64.6	-41	177.6	-72.8	177.8	-8.8	0	0	112.6	Q586 R587 R588 E592 Q593 K594	Q586-Q590 WeakPolarHBondContact O-CG 3.22Å; Q586-Q590 PolarHBondContact O-N 3.09Å; R587-Q590 PolarHBondContact O-N 2.74Å; R588-Q590 PolarHBondContact O-N 3.38Å; Q590-E592 VanDerWaalsContact C-N 3.35Å; Q590-Q593 PolarHBondContact O-N 2.94Å; Q590-K594 WeakPolarHBondContact O-CB 3.49Å; Q590-K594 PolarHBondContact O-N 3.24Å
591	A	69.6	Low	70.9	Confident	55 Å²	55	71.3 Å²	71.3	46%	0.455	35%	0.345	S	S	.	.	H	α-helix	trans	-63.7	-41.1	176.4	0	0	0	0	0	111.7	R587 R588 K594 R595	R587-A591 WeakPolarHBondContact O-CB 3.45Å; R587-A591 PolarHBondContact O-N 3.4Å; R588-A591 PolarHBondContact O-N 3.32Å; A591-K594 WeakPolarHBondContact O-CB 3.35Å; A591-K594 PolarHBondContact O-N 3.46Å; A591-R595 WeakPolarHBondContact O-CG 3.39Å; A591-R595 PolarHBondContact O-N 3.23Å; A591-R595 VanDerWaalsContact O-N 3.16Å
592	E	70.4	Confident	72.9	Confident	48 Å²	48	67.3 Å²	67.3	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-66	-44.6	176.6	-170.8	170.5	-155.7	0	0	111.8	R588 I589 Q590 K594 R595 W596	R588-E592 WeakPolarHBondContact O-CB 3.49Å; R588-E592 PolarHBondContact O-N 3.02Å; I589-E592 PolarHBondContact O-N 3.48Å; Q590-E592 VanDerWaalsContact C-N 3.35Å; E592-K594 VanDerWaalsContact C-N 3.29Å; E592-K594 PolarHBondContact O-N 3.26Å; E592-R595 WeakPolarHBondContact O-CB 3.32Å; E592-R595 PolarHBondContact O-N 2.86Å; E592-R595 VanDerWaalsContact O-N 3.09Å; E592-W596 PolarHBondContact O-N 3.11Å
593	Q	71.6	Confident	74.6	Confident	65 Å²	65	64.8 Å²	64.8	30%	0.304	31%	0.307	S	S	.	.	H	α-helix	trans	-57.9	-42	174.2	-167	-177.4	15.3	0	0	111.6	A558 I589 Q590 R595 W596 V597	A558-Q593 PolarHBondContact O-NE2 3.34Å; I589-Q593 WeakPolarHBondContact O-CB 3.15Å; I589-Q593 PolarHBondContact O-N 2.84Å; Q590-Q593 PolarHBondContact O-N 2.94Å; Q593-R595 VanDerWaalsContact C-N 3.31Å; Q593-R595 PolarHBondContact O-N 3.43Å; Q593-W596 PolarHBondContact O-N 3.3Å; Q593-V597 VanDerWaalsContact O-CG2 3.25Å; Q593-V597 WeakPolarHBondContact O-CG2 3.47Å; Q593-V597 PolarHBondContact O-N 3.47Å
594	K	76.4	Confident	76	Confident	136 Å²	136	60.1 Å²	60.1	59%	0.591	28%	0.278	S	S	*	.	H	α-helix	trans	-60.4	-39.1	176	-172.8	178.6	179.5	-179.2	0	112.3	Q590 A591 E592 V597 Q598	Q590-K594 WeakPolarHBondContact O-CB 3.49Å; Q590-K594 PolarHBondContact O-N 3.24Å; A591-K594 WeakPolarHBondContact O-CB 3.35Å; A591-K594 PolarHBondContact O-N 3.46Å; E592-K594 VanDerWaalsContact C-N 3.29Å; E592-K594 PolarHBondContact O-N 3.26Å; K594-V597 PolarHBondContact O-N 2.9Å; K594-Q598 WeakPolarHBondContact O-CG 3.34Å; K594-Q598 PolarHBondContact O-N 3.45Å
595	R	81.8	Confident	77.4	Confident	47 Å²	47	60.1 Å²	60.1	18%	0.177	28%	0.281	C	S	.	.	H	α-helix	trans	-66.5	-43.8	176.7	-68.5	176.9	76.7	-169.2	12.6	111.9	N494 I497 A591 E592 Q593 V597 Q598 L599	N494-R595 PolarHBondContact OD1-NH1 3.46Å; N494-R595 PolarHBondContact OD1-NH2 3.26Å; N494-R595 VanDerWaalsContact OD1-NH2 3.14Å; I497-R595 HydrophobicContact CD1-CB 4.26Å; A591-R595 WeakPolarHBondContact O-CG 3.39Å; A591-R595 PolarHBondContact O-N 3.23Å; A591-R595 VanDerWaalsContact O-N 3.16Å; E592-R595 WeakPolarHBondContact O-CB 3.32Å; E592-R595 PolarHBondContact O-N 2.86Å; E592-R595 VanDerWaalsContact O-N 3.09Å; Q593-R595 VanDerWaalsContact C-N 3.31Å; Q593-R595 PolarHBondContact O-N 3.43Å; R595-V597 VanDerWaalsContact C-N 3.32Å; R595-V597 PolarHBondContact O-N 2.95Å; R595-Q598 PolarHBondContact O-N 2.89Å; R595-L599 WeakPolarHBondContact O-CB 3.41Å; R595-L599 PolarHBondContact O-N 3.39Å
596	W	83.2	Confident	78.8	Confident	11 Å²	11	57.4 Å²	57.4	4%	0.042	27%	0.265	C	S	.	.	H	α-helix	trans	-60.5	-42	175.4	-72.2	118.4	0	0	0	112.3	I482 M488 I497 I554 L557 E592 Q593 L599 F600	I482-W596 HydrophobicContact CD1-CH2 4.34Å; I482-W596 HydrophobicContact CD1-CZ3 4.29Å; I482-W596 HydrophobicContact CG1-CH2 4.25Å; I482-W596 HydrophobicContact CG1-CZ3 4.37Å; M488-W596 HydrophobicContact CE-CH2 3.63Å; M488-W596 HydrophobicContact CE-CZ2 3.95Å; M488-W596 HydrophobicContact CG-CZ2 4.24Å; M488-W596 HydrophobicContact SD-CH2 3.76Å; M488-W596 HydrophobicContact SD-CZ2 3.84Å; I497-W596 HydrophobicContact CD1-CD2 4.43Å; I497-W596 HydrophobicContact CD1-CE3 4.47Å; I497-W596 HydrophobicContact CD1-CH2 4.13Å; I497-W596 HydrophobicContact CD1-CZ2 4.09Å; I497-W596 HydrophobicContact CD1-CZ3 4.33Å; I497-W596 HydrophobicContact CG1-CH2 4.14Å; I497-W596 HydrophobicContact CG1-CZ3 4.2Å; I554-W596 HydrophobicContact CG1-CE3 3.99Å; I554-W596 HydrophobicContact CG1-CZ3 4.22Å; I554-W596 HydrophobicContact CG2-CB 4.11Å; I554-W596 HydrophobicContact CG2-CE3 4.18Å; I554-W596 WeakPolarHBondContact CG2-O 3.5Å; L557-W596 HydrophobicContact CD1-CD2 4.27Å; L557-W596 HydrophobicContact CD1-CE3 4.24Å; L557-W596 HydrophobicContact CD1-CH2 4.1Å; L557-W596 HydrophobicContact CD1-CZ2 4.1Å; L557-W596 HydrophobicContact CD1-CZ3 4.15Å; E592-W596 PolarHBondContact O-N 3.11Å; Q593-W596 PolarHBondContact O-N 3.3Å; W596-L599 HydrophobicContact CE3-CD2 4.02Å; W596-L599 HydrophobicContact CZ3-CD2 3.84Å; W596-L599 PolarHBondContact O-N 2.98Å; W596-F600 WeakPolarHBondContact O-CB 3.41Å; W596-F600 PolarHBondContact O-N 3.35Å
597	V	80.4	Confident	80.3	Confident	16 Å²	16	55 Å²	55	10%	0.097	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-43	175.8	168.3	0	0	0	0	111.9	Q593 K594 R595 F600 K601 M654	Q593-V597 VanDerWaalsContact O-CG2 3.25Å; Q593-V597 WeakPolarHBondContact O-CG2 3.47Å; Q593-V597 PolarHBondContact O-N 3.47Å; K594-V597 PolarHBondContact O-N 2.9Å; R595-V597 VanDerWaalsContact C-N 3.32Å; R595-V597 PolarHBondContact O-N 2.95Å; V597-F600 PolarHBondContact O-N 2.85Å; V597-K601 WeakPolarHBondContact O-CG 3.41Å; V597-K601 PolarHBondContact O-N 3.46Å; V597-M654 HydrophobicContact CB-CG 4.49Å; V597-M654 HydrophobicContact CG1-CB 4.16Å; V597-M654 HydrophobicContact CG1-CG 3.74Å; V597-M654 WeakPolarHBondContact CG1-O 3.38Å; V597-M654 HydrophobicContact CG1-SD 4.41Å; V597-M654 HydrophobicContact CG2-CE 3.83Å; V597-M654 HydrophobicContact CG2-CG 4.12Å
598	Q	83.5	Confident	81.4	Confident	55 Å²	55	51.4 Å²	51.4	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-44.7	176.4	-75.3	173.8	-31	0	0	111.4	Y501 K594 R595 K601 V602	Y501-Q598 HydrophobicContact CE2-CB 4.38Å; K594-Q598 WeakPolarHBondContact O-CG 3.34Å; K594-Q598 PolarHBondContact O-N 3.45Å; R595-Q598 PolarHBondContact O-N 2.89Å; Q598-K601 PolarHBondContact O-N 3.2Å; Q598-V602 PolarHBondContact O-N 3.3Å
599	L	88.4	Confident	82.4	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-61.4	-45.6	175.8	-178.9	63	0	0	0	111.6	I497 F500 Y501 I554 R595 W596 K601 V602 I603	I497-L599 HydrophobicContact CG1-CD2 4.18Å; F500-L599 HydrophobicContact CB-CD1 4Å; F500-L599 HydrophobicContact CD1-CD2 4.41Å; F500-L599 HydrophobicContact CG-CD1 4.25Å; Y501-L599 HydrophobicContact CD2-CD1 4.47Å; I554-L599 HydrophobicContact CD1-CD2 3.95Å; I554-L599 HydrophobicContact CD1-CG 4.11Å; R595-L599 WeakPolarHBondContact O-CB 3.41Å; R595-L599 PolarHBondContact O-N 3.39Å; W596-L599 HydrophobicContact CE3-CD2 4.02Å; W596-L599 HydrophobicContact CZ3-CD2 3.84Å; W596-L599 PolarHBondContact O-N 2.98Å; L599-K601 VanDerWaalsContact C-N 3.3Å; L599-K601 PolarHBondContact O-N 3.47Å; L599-V602 PolarHBondContact O-N 3.41Å; L599-I603 HydrophobicContact CD1-CD1 3.75Å; L599-I603 HydrophobicContact CD1-CG1 4.02Å; L599-I603 HydrophobicContact CD2-CD1 4.19Å; L599-I603 HydrophobicContact CG-CD1 3.63Å; L599-I603 HydrophobicContact CG-CG1 4.27Å; L599-I603 WeakPolarHBondContact O-CG1 3.28Å; L599-I603 PolarHBondContact O-N 2.93Å
600	F	88.9	Confident	83.5	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.009	20%	0.202	C	C	.	.	H	α-helix	trans	-54.6	-44.4	178.3	177.1	-98.6	0	0	0	112.4	C551 I554 I555 W596 V597 V602 T604 M654 E686 L687	C551-F600 HydrophobicContact CB-CD2 4.23Å; C551-F600 HydrophobicContact CB-CE2 3.91Å; I554-F600 HydrophobicContact CB-CD2 4.37Å; I554-F600 HydrophobicContact CG2-CB 3.8Å; I554-F600 HydrophobicContact CG2-CD2 4.28Å; I554-F600 HydrophobicContact CG2-CG 4.46Å; I555-F600 HydrophobicContact CD1-CE2 3.62Å; I555-F600 HydrophobicContact CD1-CZ 3.84Å; I555-F600 HydrophobicContact CG1-CD2 4.06Å; I555-F600 HydrophobicContact CG1-CE2 3.46Å; I555-F600 VanDerWaalsContact CG1-CE2 3.46Å; I555-F600 HydrophobicContact CG1-CZ 3.93Å; W596-F600 WeakPolarHBondContact O-CB 3.41Å; W596-F600 PolarHBondContact O-N 3.35Å; V597-F600 PolarHBondContact O-N 2.85Å; F600-V602 PolarHBondContact O-N 3.19Å; F600-T604 WeakPolarHBondContact CE1-OG1 3.44Å; F600-T604 WeakPolarHBondContact CE2-OG1 3.49Å; F600-T604 HydrophobicContact CZ-CG2 4.5Å; F600-T604 VanDerWaalsContact CZ-OG1 3.29Å; F600-T604 WeakPolarHBondContact CZ-OG1 3.48Å; F600-T604 WeakPolarHBondContact O-CB 3.11Å; F600-T604 PolarHBondContact O-N 3.37Å; F600-T604 PolarHBondContact O-OG1 3.03Å; F600-M654 HydrophobicContact CB-CE 4.47Å; F600-M654 HydrophobicContact CB-SD 4.5Å; F600-M654 HydrophobicContact CD1-CE 4.08Å; F600-M654 HydrophobicContact CD1-SD 3.28Å; F600-M654 WeakPolarHBondContact CD1-SD 3.34Å; F600-M654 HydrophobicContact CE1-SD 3.64Å; F600-M654 HydrophobicContact CG-CE 4.24Å; F600-M654 HydrophobicContact CG-SD 4.02Å; F600-E686 HydrophobicContact CE1-CB 3.86Å; F600-E686 HydrophobicContact CE1-CG 3.85Å; F600-E686 HydrophobicContact CZ-CB 3.72Å; F600-E686 HydrophobicContact CZ-CG 4.2Å; F600-L687 HydrophobicContact CE2-CD1 4.05Å; F600-L687 HydrophobicContact CZ-CD1 4.22Å
601	K	86	Confident	84.6	Confident	94 Å²	94	37.7 Å²	37.7	41%	0.409	18%	0.184	S	C	.	.	H	α-helix	trans	-60.8	-44.7	179.9	-73.9	177.9	-177.8	174.3	0	112.6	V597 Q598 L599 N605 M654	V597-K601 WeakPolarHBondContact O-CG 3.41Å; V597-K601 PolarHBondContact O-N 3.46Å; Q598-K601 PolarHBondContact O-N 3.2Å; L599-K601 VanDerWaalsContact C-N 3.3Å; L599-K601 PolarHBondContact O-N 3.47Å; K601-N605 WeakPolarHBondContact O-CB 3.32Å; K601-N605 PolarHBondContact O-N 3.44Å; K601-M654 WeakPolarHBondContact CE-O 3.41Å; K601-M654 PolarHBondContact NZ-O 2.68Å
602	V	88.4	Confident	85.1	Confident	21 Å²	21	37.1 Å²	37.1	13%	0.127	18%	0.179	C	C	.	.	H	α-helix	trans	-69.4	-46.1	-177.7	-179	0	0	0	0	110.6	Y501 S505 Q598 L599 F600 T604 N605 L606	Y501-V602 HydrophobicContact CD2-CB 4.44Å; Y501-V602 HydrophobicContact CD2-CG2 3.88Å; Y501-V602 HydrophobicContact CE2-CB 4.37Å; Y501-V602 HydrophobicContact CE2-CG2 3.36Å; S505-V602 VanDerWaalsContact N-CG1 3.3Å; S505-V602 WeakPolarHBondContact OG-CG1 3.47Å; Q598-V602 PolarHBondContact O-N 3.3Å; L599-V602 PolarHBondContact O-N 3.41Å; F600-V602 PolarHBondContact O-N 3.19Å; V602-T604 PolarHBondContact O-N 2.73Å; V602-N605 PolarHBondContact O-N 3.43Å; V602-L606 PolarHBondContact O-N 2.84Å; V602-L606 VanDerWaalsContact O-N 3.11Å
603	I	92.6	Very high	85.7	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63	-45.5	177.6	-59.6	172.3	0	0	0	110	F500 L547 C551 I554 L599 N605 L606 V607	F500-I603 HydrophobicContact CD1-CD1 3.91Å; F500-I603 HydrophobicContact CD2-CD1 3.96Å; F500-I603 HydrophobicContact CD2-CG1 4.19Å; F500-I603 HydrophobicContact CE1-CD1 3.67Å; F500-I603 HydrophobicContact CE2-CD1 3.73Å; F500-I603 HydrophobicContact CE2-CG1 3.99Å; F500-I603 HydrophobicContact CG-CD1 4.06Å; F500-I603 HydrophobicContact CZ-CD1 3.59Å; F500-I603 HydrophobicContact CZ-CG1 4.29Å; L547-I603 HydrophobicContact CB-CG2 4.04Å; L547-I603 HydrophobicContact CD2-CG2 4.12Å; C551-I603 WeakPolarHBondContact SG-CG2 3.44Å; I554-I603 HydrophobicContact CD1-CD1 3.64Å; L599-I603 HydrophobicContact CD1-CD1 3.75Å; L599-I603 HydrophobicContact CD1-CG1 4.02Å; L599-I603 HydrophobicContact CD2-CD1 4.19Å; L599-I603 HydrophobicContact CG-CD1 3.63Å; L599-I603 HydrophobicContact CG-CG1 4.27Å; L599-I603 WeakPolarHBondContact O-CG1 3.28Å; L599-I603 PolarHBondContact O-N 2.93Å; I603-N605 VanDerWaalsContact C-N 3.3Å; I603-N605 PolarHBondContact O-N 3.16Å; I603-L606 WeakPolarHBondContact O-CB 3.3Å; I603-L606 PolarHBondContact O-N 3.37Å; I603-L606 VanDerWaalsContact O-N 3.11Å; I603-V607 HydrophobicContact CG2-CG2 4.11Å; I603-V607 VanDerWaalsContact O-CG2 3.3Å; I603-V607 WeakPolarHBondContact O-CG2 3.33Å; I603-V607 PolarHBondContact O-N 3.47Å
604	T	88.8	Confident	86.4	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-39.9	179.2	-62.7	0	0	0	0	111.7	C551 F600 V602 V607 K608 E686 L687	C551-T604 PolarHBondContact SG-OG1 3.06Å; C551-T604 VanDerWaalsContact SG-OG1 3.35Å; F600-T604 WeakPolarHBondContact CE1-OG1 3.44Å; F600-T604 WeakPolarHBondContact CE2-OG1 3.49Å; F600-T604 HydrophobicContact CZ-CG2 4.5Å; F600-T604 VanDerWaalsContact CZ-OG1 3.29Å; F600-T604 WeakPolarHBondContact CZ-OG1 3.48Å; F600-T604 WeakPolarHBondContact O-CB 3.11Å; F600-T604 PolarHBondContact O-N 3.37Å; F600-T604 PolarHBondContact O-OG1 3.03Å; V602-T604 PolarHBondContact O-N 2.73Å; T604-V607 PolarHBondContact O-N 3.25Å; T604-K608 HydrophobicContact CG2-CD 4.07Å; T604-K608 VanDerWaalsContact CG2-CE 3.48Å; T604-K608 HydrophobicContact CG2-CG 4.39Å; T604-K608 WeakPolarHBondContact O-CB 3.47Å; T604-K608 VanDerWaalsContact O-CG 3.28Å; T604-K608 WeakPolarHBondContact O-CG 3.46Å; T604-K608 PolarHBondContact O-N 3.29Å; T604-E686 HydrophobicContact CG2-CB 4.27Å; T604-L687 HydrophobicContact CG2-CD2 4.03Å; T604-L687 HydrophobicContact CG2-CG 4.37Å
605	N	88.8	Confident	86.6	Confident	82 Å²	82	27.7 Å²	27.7	44%	0.439	14%	0.138	S	C	.	.	H	α-helix	trans	-59.7	-48	173.7	-175.6	59.8	0	0	0	111.5	S508 K601 V602 I603 V607 K608 M609	S508-N605 PolarHBondContact OG-ND2 3.37Å; K601-N605 WeakPolarHBondContact O-CB 3.32Å; K601-N605 PolarHBondContact O-N 3.44Å; V602-N605 PolarHBondContact O-N 3.43Å; I603-N605 VanDerWaalsContact C-N 3.3Å; I603-N605 PolarHBondContact O-N 3.16Å; N605-V607 PolarHBondContact O-N 3.4Å; N605-K608 PolarHBondContact O-N 3.09Å; N605-M609 WeakPolarHBondContact O-CG 3.48Å; N605-M609 PolarHBondContact O-N 3.2Å
606	L	91.5	Very high	86.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.4	-44.9	176.8	178.4	57.5	0	0	0	112.3	F503 F507 S508 L511 L547 V602 I603 K608 M609 L610	F503-L606 HydrophobicContact CE1-CD2 4.12Å; F507-L606 HydrophobicContact CB-CD1 4.48Å; F507-L606 HydrophobicContact CB-CD2 4.42Å; F507-L606 HydrophobicContact CD1-CD1 3.58Å; F507-L606 HydrophobicContact CD1-CD2 3.78Å; F507-L606 HydrophobicContact CD1-CG 4.28Å; F507-L606 HydrophobicContact CE1-CD1 4.06Å; F507-L606 HydrophobicContact CG-CD1 4.23Å; S508-L606 WeakPolarHBondContact OG-CA 3.37Å; S508-L606 WeakPolarHBondContact OG-CB 3.29Å; S508-L606 PolarHBondContact OG-N 3.34Å; L511-L606 HydrophobicContact CD1-CD1 3.52Å; L547-L606 HydrophobicContact CD1-CD2 3.46Å; L547-L606 VanDerWaalsContact CD1-CD2 3.46Å; L547-L606 HydrophobicContact CD1-CG 3.75Å; V602-L606 PolarHBondContact O-N 2.84Å; V602-L606 VanDerWaalsContact O-N 3.11Å; I603-L606 WeakPolarHBondContact O-CB 3.3Å; I603-L606 PolarHBondContact O-N 3.37Å; I603-L606 VanDerWaalsContact O-N 3.11Å; L606-K608 PolarHBondContact O-N 2.87Å; L606-M609 PolarHBondContact O-N 3.03Å; L606-L610 HydrophobicContact CD1-CD1 4.31Å; L606-L610 HydrophobicContact CD1-CG 4.28Å; L606-L610 HydrophobicContact CG-CD1 4.28Å; L606-L610 WeakPolarHBondContact O-CG 3.25Å; L606-L610 PolarHBondContact O-N 2.86Å
607	V	92.9	Very high	86.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.7	-45.3	177.2	175.4	0	0	0	0	110.8	L547 I603 T604 N605 M609 L610 K611 W625 L687 F689	L547-V607 HydrophobicContact CB-CG2 3.47Å; L547-V607 VanDerWaalsContact CB-CG2 3.47Å; L547-V607 HydrophobicContact CD1-CG2 4.25Å; I603-V607 HydrophobicContact CG2-CG2 4.11Å; I603-V607 VanDerWaalsContact O-CG2 3.3Å; I603-V607 WeakPolarHBondContact O-CG2 3.33Å; I603-V607 PolarHBondContact O-N 3.47Å; T604-V607 PolarHBondContact O-N 3.25Å; N605-V607 PolarHBondContact O-N 3.4Å; V607-M609 VanDerWaalsContact C-N 3.34Å; V607-M609 PolarHBondContact O-N 3.41Å; V607-L610 PolarHBondContact O-N 2.88Å; V607-K611 WeakPolarHBondContact O-CB 3.39Å; V607-K611 PolarHBondContact O-N 2.73Å; V607-W625 HydrophobicContact CG1-CZ3 3.84Å; V607-L687 HydrophobicContact CG1-CD2 4.17Å; V607-F689 HydrophobicContact CG1-CE2 4.05Å; V607-F689 HydrophobicContact CG1-CZ 3.62Å
608	K	87.8	Confident	86.4	Confident	81 Å²	81	38.6 Å²	38.6	35%	0.352	19%	0.19	S	C	.	.	H	α-helix	trans	-60.9	-41.5	176.3	-74.8	174.7	-177.1	172.6	0	111.7	T604 N605 L606 K611 A612 E686 F689	T604-K608 HydrophobicContact CG2-CD 4.07Å; T604-K608 VanDerWaalsContact CG2-CE 3.48Å; T604-K608 HydrophobicContact CG2-CG 4.39Å; T604-K608 WeakPolarHBondContact O-CB 3.47Å; T604-K608 VanDerWaalsContact O-CG 3.28Å; T604-K608 WeakPolarHBondContact O-CG 3.46Å; T604-K608 PolarHBondContact O-N 3.29Å; N605-K608 PolarHBondContact O-N 3.09Å; L606-K608 PolarHBondContact O-N 2.87Å; K608-K611 PolarHBondContact O-N 3.26Å; K608-A612 WeakPolarHBondContact O-CB 3.22Å; K608-A612 PolarHBondContact O-N 3.46Å; K608-E686 WeakPolarHBondContact CE-O 3.45Å; K608-E686 PolarHBondContact NZ-O 3.49Å; K608-E686 IonicContact NZ-OE2 3.64Å; K608-E686 PolarHBondContact NZ-OE2 2.89Å; K608-F689 HydrophobicContact CG-CE1 4.4Å
609	M	86.4	Confident	86.8	Confident	40 Å²	40	37.5 Å²	37.5	20%	0.197	19%	0.185	C	C	.	.	H	α-helix	trans	-63	-44.9	175.7	-70.5	-179.7	75	0	0	112.3	S508 L511 I512 N605 L606 V607 A612 R613	S508-M609 WeakPolarHBondContact O-CE 3.33Å; L511-M609 HydrophobicContact CB-CE 3.61Å; I512-M609 HydrophobicContact CG1-CE 3.69Å; N605-M609 WeakPolarHBondContact O-CG 3.48Å; N605-M609 PolarHBondContact O-N 3.2Å; L606-M609 PolarHBondContact O-N 3.03Å; V607-M609 VanDerWaalsContact C-N 3.34Å; V607-M609 PolarHBondContact O-N 3.41Å; M609-A612 PolarHBondContact O-N 3.31Å; M609-R613 WeakPolarHBondContact O-CG 3.46Å; M609-R613 PolarHBondContact O-N 2.85Å; M609-R613 VanDerWaalsContact O-N 3.12Å
610	L	90	Very high	86.9	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-40.6	176.9	-68.9	173.8	0	0	0	111.8	F507 L511 F519 L540 L543 L547 L606 V607 R613 D614 W625	F507-L610 HydrophobicContact CE1-CD2 4.39Å; L511-L610 HydrophobicContact CD1-CD2 3.8Å; L511-L610 HydrophobicContact CD1-CG 4.27Å; F519-L610 HydrophobicContact CE2-CD2 4.34Å; F519-L610 HydrophobicContact CZ-CD2 4.36Å; L540-L610 HydrophobicContact CD2-CD2 4.4Å; L543-L610 HydrophobicContact CD2-CD1 4.09Å; L547-L610 HydrophobicContact CD1-CD1 4.04Å; L606-L610 HydrophobicContact CD1-CD1 4.31Å; L606-L610 HydrophobicContact CD1-CG 4.28Å; L606-L610 HydrophobicContact CG-CD1 4.28Å; L606-L610 WeakPolarHBondContact O-CG 3.25Å; L606-L610 PolarHBondContact O-N 2.86Å; V607-L610 PolarHBondContact O-N 2.88Å; L610-R613 PolarHBondContact O-N 2.91Å; L610-D614 PolarHBondContact O-N 2.89Å; L610-W625 HydrophobicContact CB-CH2 4.1Å
611	K	88.5	Confident	87	Confident	34 Å²	34	41.7 Å²	41.7	15%	0.148	21%	0.213	C	C	.	.	H	α-helix	trans	-63.1	-42.5	174.6	176.7	59.6	-177.9	167.7	0	111.5	V607 K608 R613 D614 I615 W625 F689	V607-K611 WeakPolarHBondContact O-CB 3.39Å; V607-K611 PolarHBondContact O-N 2.73Å; K608-K611 PolarHBondContact O-N 3.26Å; K611-R613 VanDerWaalsContact C-N 3.3Å; K611-R613 PolarHBondContact O-N 3.42Å; K611-D614 PolarHBondContact O-N 2.99Å; K611-I615 HydrophobicContact CD-CD1 4.25Å; K611-I615 HydrophobicContact CD-CG1 4.18Å; K611-I615 HydrophobicContact CG-CD1 4Å; K611-I615 HydrophobicContact CG-CG1 4.41Å; K611-I615 VanDerWaalsContact O-CG1 3.32Å; K611-I615 WeakPolarHBondContact O-CG1 3.32Å; K611-I615 PolarHBondContact O-N 3.05Å; K611-W625 HydrophobicContact CB-CH2 4.07Å; K611-W625 HydrophobicContact CB-CZ2 4.03Å; K611-W625 HydrophobicContact CB-CZ3 4.36Å; K611-W625 HydrophobicContact CD-CD2 3.68Å; K611-W625 HydrophobicContact CD-CE3 4.42Å; K611-W625 HydrophobicContact CD-CG 3.75Å; K611-W625 HydrophobicContact CD-CZ2 4.11Å; K611-W625 VanDerWaalsContact NZ-CD1 3.27Å; K611-F689 HydrophobicContact CG-CD1 4.23Å; K611-F689 HydrophobicContact CG-CE1 4.47Å; K611-F689 HydrophobicContact CG-CG 4.29Å
612	A	81.8	Confident	87	Confident	43 Å²	43	44.7 Å²	44.7	36%	0.355	24%	0.239	S	C	.	.	H	α-helix	trans	-60	-40.2	176.5	0	0	0	0	0	111.8	K608 M609 I615 R616	K608-A612 WeakPolarHBondContact O-CB 3.22Å; K608-A612 PolarHBondContact O-N 3.46Å; M609-A612 PolarHBondContact O-N 3.31Å; A612-I615 PolarHBondContact O-N 3.07Å; A612-R616 WeakPolarHBondContact O-CG 3.45Å; A612-R616 PolarHBondContact O-N 3.22Å
613	R	82.8	Confident	86.9	Confident	8 Å²	8	45.6 Å²	45.6	3%	0.03	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-44.7	174	-65.8	-84.8	175.9	177	6.4	111.7	L511 V514 D516 F519 M609 L610 K611 I615 R616 R617 F619 H855	L511-R613 PolarHBondContact O-NH2 3.39Å; V514-R613 PolarHBondContact O-NH1 3.29Å; V514-R613 PolarHBondContact O-NH2 3.42Å; D516-R613 IonicContact OD1-CZ 3.5Å; D516-R613 IonicContact OD1-NH1 2.98Å; D516-R613 PolarHBondContact OD1-NH1 2.94Å; F519-R613 HydrophobicContact CE1-CB 4.3Å; F519-R613 HydrophobicContact CE2-CG 4.47Å; F519-R613 HydrophobicContact CZ-CB 4.23Å; F519-R613 HydrophobicContact CZ-CG 4.44Å; M609-R613 WeakPolarHBondContact O-CG 3.46Å; M609-R613 PolarHBondContact O-N 2.85Å; M609-R613 VanDerWaalsContact O-N 3.12Å; L610-R613 PolarHBondContact O-N 2.91Å; K611-R613 VanDerWaalsContact C-N 3.3Å; K611-R613 PolarHBondContact O-N 3.42Å; R613-I615 PolarHBondContact O-N 2.96Å; R613-R616 PolarHBondContact O-N 2.88Å; R613-R617 PolarHBondContact O-N 2.98Å; R613-F619 HydrophobicContact CB-CE1 4.42Å; R613-H855 PolarHBondContact NH1-CD2 3.08Å; R613-H855 PolarHBondContact NH1-NE2 3.38Å
614	D	86.4	Confident	86.9	Confident	14 Å²	14	45.9 Å²	45.9	8%	0.075	25%	0.253	C	S	.	.	H	α-helix	trans	-65.3	-35.4	178.4	-173.1	60.5	0	0	0	112.9	L610 K611 R616 R617 P618 F619 C620 W625	L610-D614 PolarHBondContact O-N 2.89Å; K611-D614 PolarHBondContact O-N 2.99Å; D614-R616 VanDerWaalsContact C-N 3.31Å; D614-R616 PolarHBondContact O-N 3.46Å; D614-R617 CarbonylContact O-C 3.5Å; D614-R617 VanDerWaalsContact O-C 3.28Å; D614-P618 VanDerWaalsContact O-CA 3.25Å; D614-P618 WeakPolarHBondContact O-CA 3.46Å; D614-P618 VanDerWaalsContact O-N 3.16Å; D614-P618 WeakPolarHBondContact OD1-CA 3.41Å; D614-F619 HydrophobicContact CB-CD1 4Å; D614-F619 HydrophobicContact CB-CE1 3.58Å; D614-F619 HydrophobicContact CB-CZ 4.28Å; D614-F619 PolarHBondContact OD1-N 3.08Å; D614-C620 WeakPolarHBondContact OD1-CB 3.38Å; D614-C620 PolarHBondContact OD1-N 2.8Å; D614-W625 HydrophobicContact CB-CZ2 4.24Å; D614-W625 PolarHBondContact OD2-NE1 3.42Å
615	I	80.4	Confident	87	Confident	29 Å²	29	46.4 Å²	46.4	15%	0.149	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-38.3	173.6	-69.3	165.1	0	0	0	111	K611 A612 R613 D954 Q956	K611-I615 HydrophobicContact CD-CD1 4.25Å; K611-I615 HydrophobicContact CD-CG1 4.18Å; K611-I615 HydrophobicContact CG-CD1 4Å; K611-I615 HydrophobicContact CG-CG1 4.41Å; K611-I615 VanDerWaalsContact O-CG1 3.32Å; K611-I615 WeakPolarHBondContact O-CG1 3.32Å; K611-I615 PolarHBondContact O-N 3.05Å; A612-I615 PolarHBondContact O-N 3.07Å; R613-I615 PolarHBondContact O-N 2.96Å; I615-D954 HydrophobicContact CD1-CB 4.11Å; I615-Q956 HydrophobicContact CG2-CG 4.43Å
616	R	75.6	Confident	87.1	Confident	60 Å²	60	46.2 Å²	46.2	23%	0.226	25%	0.254	C	S	.	.	H	α-helix	trans	-71.3	-49.3	179.8	-68.9	-162.8	-56.8	-127.2	11.9	112.1	D516 A612 R613 D614 D853 H855	D516-R616 IonicContact OD1-CZ 3.93Å; D516-R616 IonicContact OD1-NE 3.38Å; D516-R616 IonicContact OD1-NH2 3.49Å; D516-R616 PolarHBondContact OD1-NH2 2.92Å; D516-R616 IonicContact OD2-CZ 3.28Å; D516-R616 IonicContact OD2-NE 3.22Å; D516-R616 IonicContact OD2-NH2 2.75Å; D516-R616 PolarHBondContact OD2-NH2 3.35Å; A612-R616 WeakPolarHBondContact O-CG 3.45Å; A612-R616 PolarHBondContact O-N 3.22Å; R613-R616 PolarHBondContact O-N 2.88Å; D614-R616 VanDerWaalsContact C-N 3.31Å; D614-R616 PolarHBondContact O-N 3.46Å; R616-D853 IonicContact CZ-OD2 2.85Å; R616-D853 IonicContact NH1-OD2 3.78Å; R616-D853 PolarHBondContact NH1-OD2 3.19Å; R616-D853 IonicContact NH2-OD2 3.73Å; R616-D853 PolarHBondContact NH2-OD2 3.23Å; R616-H855 PolarHBondContact NH2-CD2 2.92Å; R616-H855 VanDerWaalsContact NH2-CD2 3.27Å
617	R	81.1	Confident	86.8	Confident	138 Å²	138	46.8 Å²	46.8	52%	0.521	26%	0.257	S	S	.	.	S	Bend	trans	-138.9	106.3	176.5	-179.6	179.2	-177.6	-168.5	0.4	108.3	F520 R613 D614 F619	F520-R617 HydrophobicContact CD1-CG 4.37Å; F520-R617 HydrophobicContact CE1-CB 4.04Å; F520-R617 HydrophobicContact CE1-CG 4.01Å; F520-R617 WeakPolarHBondContact CE1-O 3.48Å; F520-R617 HydrophobicContact CE2-CB 3.85Å; F520-R617 HydrophobicContact CE2-CG 4.31Å; F520-R617 HydrophobicContact CZ-CB 3.56Å; F520-R617 HydrophobicContact CZ-CG 4.01Å; F520-R617 WeakPolarHBondContact CZ-O 3.5Å; R613-R617 PolarHBondContact O-N 2.98Å; D614-R617 CarbonylContact O-C 3.5Å; D614-R617 VanDerWaalsContact O-C 3.28Å; R617-F619 PolarHBondContact O-N 3.44Å
618	P	84.6	Confident	86	Confident	104 Å²	104	56.6 Å²	56.6	68%	0.675	30%	0.303	S	S	*	.			trans	-59.3	128.5	-176.6	-25.6	34.1	0	0	0	111.9	D614	D614-P618 VanDerWaalsContact O-CA 3.25Å; D614-P618 WeakPolarHBondContact O-CA 3.46Å; D614-P618 VanDerWaalsContact O-N 3.16Å; D614-P618 WeakPolarHBondContact OD1-CA 3.41Å
619	F	90.8	Very high	85.5	Confident	32 Å²	32	58.2 Å²	58.2	14%	0.14	31%	0.312	C	S	.	.			trans	-129.8	-15	170.4	68.1	-87.5	0	0	0	112.2	F519 F520 L537 L540 V541 R613 D614 R617	F519-F619 HydrophobicContact CE1-CD1 4.17Å; F519-F619 AromaticContact CE1-CE1 3.89Å; F519-F619 HydrophobicContact CE1-CE1 3.89Å; F519-F619 HydrophobicContact CE1-CZ 4.28Å; F519-F619 HydrophobicContact CZ-CE1 4.09Å; F519-F619 HydrophobicContact CZ-CZ 4.12Å; F520-F619 HydrophobicContact CE1-CB 4.18Å; F520-F619 AromaticContact CE1-CD1 3.84Å; F520-F619 HydrophobicContact CE1-CD1 3.84Å; F520-F619 HydrophobicContact CE1-CG 4.33Å; F520-F619 HydrophobicContact CZ-CD1 4.38Å; L537-F619 HydrophobicContact CD2-CB 4.18Å; L537-F619 HydrophobicContact CD2-CD2 4.21Å; L537-F619 HydrophobicContact CD2-CG 4.16Å; L540-F619 HydrophobicContact CB-CE2 4.03Å; V541-F619 HydrophobicContact CG2-CD2 4.08Å; V541-F619 HydrophobicContact CG2-CE2 4.41Å; R613-F619 HydrophobicContact CB-CE1 4.42Å; D614-F619 HydrophobicContact CB-CD1 4Å; D614-F619 HydrophobicContact CB-CE1 3.58Å; D614-F619 HydrophobicContact CB-CZ 4.28Å; D614-F619 PolarHBondContact OD1-N 3.08Å; R617-F619 PolarHBondContact O-N 3.44Å
620	C	91.2	Very high	85.1	Confident	16 Å²	16	57.3 Å²	57.3	11%	0.108	31%	0.308	C	S	.	.	S	Bend	trans	-86	148.7	172.6	-69.9	0	0	0	0	111.7	D614 H624	D614-C620 WeakPolarHBondContact OD1-CB 3.38Å; D614-C620 PolarHBondContact OD1-N 2.8Å; C620-H624 HydrophobicContact CB-CB 3.82Å; C620-H624 PolarHBondContact SG-CD2 3.31Å
621	P	91.3	Very high	84.6	Confident	76 Å²	76	62.3 Å²	62.3	49%	0.494	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-60.4	158.3	171.7	-23.1	33.2	0	0	0	113.5	V541 G623 H624	V541-P621 HydrophobicContact CG1-CG 4.47Å; P621-G623 PolarHBondContact O-N 3.34Å; P621-H624 WeakPolarHBondContact O-CB 3.45Å; P621-H624 PolarHBondContact O-N 3.28Å; P621-H624 VanDerWaalsContact O-N 3.08Å
622	V	86.4	Confident	84.3	Confident	157 Å²	157	61 Å²	61	95%	0.952	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	134.6	174.2	-177.8	0	0	0	0	110.1	H624	V622-H624 PolarHBondContact O-N 3.08Å
623	G	85.8	Confident	84	Confident	39 Å²	39	65.4 Å²	65.4	40%	0.402	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	-0.5	-178.2	0	0	0	0	0	115	P621 W625 L626	P621-G623 PolarHBondContact O-N 3.34Å; G623-W625 PolarHBondContact O-N 2.95Å; G623-L626 WeakPolarHBondContact O-CB 3.44Å; G623-L626 PolarHBondContact O-N 3.03Å
624	H	91.1	Very high	83.5	Confident	7 Å²	7	65 Å²	65	3%	0.032	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-29	-177.2	177.7	77	0	0	0	115	V541 S544 R545 R548 C620 P621 V622	V541-H624 PolarHBondContact O-CE1 2.81Å; V541-H624 PolarHBondContact O-NE2 2.94Å; S544-H624 PolarHBondContact OG-NE2 3.48Å; R545-H624 PolarHBondContact NH2-ND1 3.46Å; R548-H624 PolarHBondContact NH1-O 2.94Å; C620-H624 HydrophobicContact CB-CB 3.82Å; C620-H624 PolarHBondContact SG-CD2 3.31Å; P621-H624 WeakPolarHBondContact O-CB 3.45Å; P621-H624 PolarHBondContact O-N 3.28Å; P621-H624 VanDerWaalsContact O-N 3.08Å; V622-H624 PolarHBondContact O-N 3.08Å
625	W	91.6	Very high	82.7	Confident	13 Å²	13	69.6 Å²	69.6	5%	0.049	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-13.1	-179.3	-63.4	101	0	0	0	113.5	R548 V607 L610 K611 D614 G623 F689 V690	R548-W625 WeakPolarHBondContact CD-O 3.2Å; V607-W625 HydrophobicContact CG1-CZ3 3.84Å; L610-W625 HydrophobicContact CB-CH2 4.1Å; K611-W625 HydrophobicContact CB-CH2 4.07Å; K611-W625 HydrophobicContact CB-CZ2 4.03Å; K611-W625 HydrophobicContact CB-CZ3 4.36Å; K611-W625 HydrophobicContact CD-CD2 3.68Å; K611-W625 HydrophobicContact CD-CE3 4.42Å; K611-W625 HydrophobicContact CD-CG 3.75Å; K611-W625 HydrophobicContact CD-CZ2 4.11Å; K611-W625 VanDerWaalsContact NZ-CD1 3.27Å; D614-W625 HydrophobicContact CB-CZ2 4.24Å; D614-W625 PolarHBondContact OD2-NE1 3.42Å; G623-W625 PolarHBondContact O-N 2.95Å; W625-F689 HydrophobicContact CB-CD2 4.07Å; W625-F689 HydrophobicContact CE3-CD2 4.28Å; W625-F689 AromaticContact CE3-CE2 3.89Å; W625-F689 HydrophobicContact CE3-CE2 3.89Å; W625-V690 WeakPolarHBondContact O-CA 3.35Å
626	L	90.4	Very high	82	Confident	79 Å²	79	75.4 Å²	75.4	41%	0.414	39%	0.385	S	S	.	.			trans	-78.8	138.4	178.3	-57.7	176.8	0	0	0	110.6	R548 G623 P692	R548-L626 PolarHBondContact NH1-O 3.11Å; G623-L626 WeakPolarHBondContact O-CB 3.44Å; G623-L626 PolarHBondContact O-N 3.03Å; L626-P692 HydrophobicContact CD2-CG 4.36Å
627	S	85.4	Confident	81.3	Confident	11 Å²	11	72.6 Å²	72.6	8%	0.077	37%	0.374	C	S	.	.			trans	-112.5	122	176.3	-178.5	0	0	0	0	110.9	L552 E629 V630 V690	L552-S627 WeakPolarHBondContact CD1-OG 3.42Å; S627-E629 PolarHBondContact O-N 3.46Å; S627-E629 PolarHBondContact OG-N 3.3Å; S627-V630 PolarHBondContact O-N 2.83Å; S627-V630 VanDerWaalsContact O-N 3.17Å; S627-V690 PolarHBondContact N-O 3.48Å
628	E	77.3	Confident	80.2	Confident	206 Å²	206	67.5 Å²	67.5	96%	0.963	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-22.7	175.1	-63	-175.9	174.8	0	0	112.5	V630	E628-V630 PolarHBondContact O-N 3.49Å
629	E	76	Confident	79	Confident	116 Å²	116	69.3 Å²	69.3	54%	0.542	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-17.9	176.5	-61.2	-167.3	-178.3	0	0	112.9	K556 S627	K556-E629 IonicContact NZ-OE2 3.79Å; K556-E629 PolarHBondContact NZ-OE2 3.15Å; S627-E629 PolarHBondContact O-N 3.46Å; S627-E629 PolarHBondContact OG-N 3.3Å
630	V	79.3	Confident	77.4	Confident	20 Å²	20	67.8 Å²	67.8	12%	0.121	35%	0.351	C	S	.	.			trans	-100.5	99.7	-176.2	-178.9	0	0	0	0	109.7	L552 S627 E628 I632 I683 V690 V691	L552-V630 HydrophobicContact CD1-CG2 3.81Å; L552-V630 HydrophobicContact CD2-CG2 3.85Å; L552-V630 HydrophobicContact CG-CG2 4.44Å; S627-V630 PolarHBondContact O-N 2.83Å; S627-V630 VanDerWaalsContact O-N 3.17Å; E628-V630 PolarHBondContact O-N 3.49Å; V630-I632 HydrophobicContact CG1-CD1 3.74Å; V630-I632 HydrophobicContact CG1-CG1 3.72Å; V630-I683 HydrophobicContact CG1-CD1 4.2Å; V630-I683 HydrophobicContact CG1-CG2 4.23Å; V630-I683 HydrophobicContact CG2-CD1 4.22Å; V630-V690 HydrophobicContact CG1-CG2 4.34Å; V630-V690 HydrophobicContact CG2-CG2 4.29Å; V630-V691 HydrophobicContact CG1-CG2 4.05Å
631	N	79.4	Confident	75.7	Confident	106 Å²	106	68.1 Å²	68.1	57%	0.567	35%	0.35	S	S	*	.			trans	-106.5	71.2	177.1	-173.2	7.4	0	0	0	111	R633	N631-R633 WeakPolarHBondContact OD1-CG 3.49Å; N631-R633 PolarHBondContact OD1-NE 2.97Å; N631-R633 VanDerWaalsContact OD1-NE 3.15Å
632	I	80.8	Confident	73.9	Confident	6 Å²	6	67 Å²	67	3%	0.031	34%	0.342	C	S	.	.			trans	-89.6	110.2	174.7	-62.3	178.9	0	0	0	108.2	V630 V637 H680 I683 L684 V691 I699	V630-I632 HydrophobicContact CG1-CD1 3.74Å; V630-I632 HydrophobicContact CG1-CG1 3.72Å; I632-V637 HydrophobicContact CG2-CG2 3.47Å; I632-V637 VanDerWaalsContact CG2-CG2 3.47Å; I632-H680 HydrophobicContact CD1-CB 3.99Å; I632-H680 HydrophobicContact CG1-CB 4.31Å; I632-H680 VanDerWaalsContact CG1-CD2 3.43Å; I632-H680 WeakPolarHBondContact CG1-CD2 3.44Å; I632-I683 HydrophobicContact CD1-CB 4.15Å; I632-I683 HydrophobicContact CD1-CD1 4.47Å; I632-I683 HydrophobicContact CD1-CG2 3.99Å; I632-L684 HydrophobicContact CD1-CD2 4.47Å; I632-L684 HydrophobicContact CD1-CG 4.2Å; I632-L684 HydrophobicContact CG2-CD1 4.32Å; I632-V691 HydrophobicContact CB-CG1 4.44Å; I632-V691 HydrophobicContact CB-CG2 4.39Å; I632-V691 HydrophobicContact CD1-CG2 3.87Å; I632-V691 HydrophobicContact CG1-CG2 4.49Å; I632-I699 HydrophobicContact CG2-CD1 3.94Å
633	R	76.3	Confident	71.9	Confident	136 Å²	136	61.8 Å²	61.8	51%	0.513	31%	0.311	S	S	.	.			trans	-103.6	140.2	177	-62.2	-172.5	-177.4	-176.3	-4.4	111	N631 D635 K636 V637	N631-R633 WeakPolarHBondContact OD1-CG 3.49Å; N631-R633 PolarHBondContact OD1-NE 2.97Å; N631-R633 VanDerWaalsContact OD1-NE 3.15Å; R633-D635 PolarHBondContact O-N 2.98Å; R633-K636 PolarHBondContact O-N 3.21Å; R633-V637 WeakPolarHBondContact O-CG2 3.48Å
634	A	72.8	Confident	69.8	Low	1 Å²	1	63.1 Å²	63.1	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-56.9	-24.2	-179.5	0	0	0	0	0	114.4	K636 E695 K698 I699 R702	A634-K636 VanDerWaalsContact C-N 3.29Å; A634-K636 PolarHBondContact O-N 3.26Å; A634-E695 PolarHBondContact N-OE2 2.93Å; A634-K698 HydrophobicContact CB-CB 3.56Å; A634-I699 HydrophobicContact CB-CG1 3.87Å; A634-R702 PolarHBondContact O-NH1 3.09Å; A634-R702 VanDerWaalsContact O-NH1 3.08Å
635	D	68.3	Low	67.5	Low	110 Å²	110	63.1 Å²	63.1	59%	0.588	32%	0.316	S	S	*	.	H	α-helix	trans	-65.5	-25.6	176.7	-60.5	-48.5	0	0	0	114.7	R633 R702	R633-D635 PolarHBondContact O-N 2.98Å; D635-R702 IonicContact OD1-CZ 2.65Å; D635-R702 IonicContact OD1-NH1 3.65Å; D635-R702 PolarHBondContact OD1-NH1 3.3Å; D635-R702 IonicContact OD1-NH2 3.48Å; D635-R702 PolarHBondContact OD1-NH2 3.41Å
636	K	65.8	Low	65.3	Low	150 Å²	150	69 Å²	69	65%	0.652	34%	0.338	S	S	*	.	H	α-helix	trans	-104.2	-10.4	-173.6	-62.4	-175.8	177.4	-176.5	0	113.6	R633 A634	R633-K636 PolarHBondContact O-N 3.21Å; A634-K636 VanDerWaalsContact C-N 3.29Å; A634-K636 PolarHBondContact O-N 3.26Å
637	V	62.2	Low	63.1	Low	1 Å²	1	72.2 Å²	72.2	1%	0.006	35%	0.35	C	S	.	.	H	α-helix	trans	-98.1	-21.7	-167.6	174.6	0	0	0	0	112.8	I632 R633 Q639 L640 Y641 L684 I699	I632-V637 HydrophobicContact CG2-CG2 3.47Å; I632-V637 VanDerWaalsContact CG2-CG2 3.47Å; R633-V637 WeakPolarHBondContact O-CG2 3.48Å; V637-Q639 PolarHBondContact O-N 3.13Å; V637-Q639 VanDerWaalsContact O-N 3.12Å; V637-L640 HydrophobicContact CB-CD1 4.37Å; V637-L640 HydrophobicContact CG1-CD1 4.04Å; V637-L640 HydrophobicContact CG2-CD1 4.47Å; V637-L640 VanDerWaalsContact O-CB 3.24Å; V637-L640 WeakPolarHBondContact O-CB 3.26Å; V637-L640 PolarHBondContact O-N 3.28Å; V637-Y641 HydrophobicContact CG1-CD2 4.42Å; V637-Y641 HydrophobicContact CG1-CE2 4.22Å; V637-L684 HydrophobicContact CG1-CD1 3.9Å; V637-I699 HydrophobicContact CB-CD1 4.49Å; V637-I699 HydrophobicContact CB-CG1 4.29Å; V637-I699 HydrophobicContact CB-CG2 4.48Å; V637-I699 HydrophobicContact CG1-CD1 4.27Å; V637-I699 HydrophobicContact CG1-CG1 4.24Å; V637-I699 HydrophobicContact CG1-CG2 3.69Å; V637-I699 HydrophobicContact CG2-CD1 4.25Å; V637-I699 HydrophobicContact CG2-CG1 4.48Å
638	T	58.1	Low	61	Low	31 Å²	31	72.6 Å²	72.6	19%	0.19	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-59.7	-26.4	-177.3	39.8	0	0	0	0	113.8	L640 V642 R702 V706	T638-L640 VanDerWaalsContact C-N 3.3Å; T638-L640 PolarHBondContact O-N 3.45Å; T638-V642 WeakPolarHBondContact O-CG2 3.28Å; T638-R702 HydrophobicContact CG2-CB 3.46Å; T638-R702 VanDerWaalsContact CG2-CB 3.46Å; T638-R702 HydrophobicContact CG2-CG 4.31Å; T638-V706 HydrophobicContact CG2-CG2 4.43Å
639	Q	58.3	Low	59.3	Low	142 Å²	142	65.4 Å²	65.4	66%	0.664	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-72.4	-18.9	176.5	-63.7	-178.7	-0.5	0	0	113.4	V637 Y641	V637-Q639 PolarHBondContact O-N 3.13Å; V637-Q639 VanDerWaalsContact O-N 3.12Å; Q639-Y641 PolarHBondContact O-N 2.86Å
640	L	57	Low	57.7	Low	1 Å²	1	70.6 Å²	70.6	1%	0.005	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-75.9	-20.1	-176.7	-71.4	169.2	0	0	0	114.9	V637 T638 W649 L673 E677 H680	V637-L640 HydrophobicContact CB-CD1 4.37Å; V637-L640 HydrophobicContact CG1-CD1 4.04Å; V637-L640 HydrophobicContact CG2-CD1 4.47Å; V637-L640 VanDerWaalsContact O-CB 3.24Å; V637-L640 WeakPolarHBondContact O-CB 3.26Å; V637-L640 PolarHBondContact O-N 3.28Å; T638-L640 VanDerWaalsContact C-N 3.3Å; T638-L640 PolarHBondContact O-N 3.45Å; L640-W649 PolarHBondContact O-NE1 3.37Å; L640-L673 HydrophobicContact CD2-CD1 4.26Å; L640-L673 HydrophobicContact CD2-CD2 3.76Å; L640-E677 HydrophobicContact CD2-CB 3.32Å; L640-E677 HydrophobicContact CD2-CG 3.5Å; L640-E677 HydrophobicContact CG-CB 4.4Å; L640-E677 HydrophobicContact CG-CG 4.16Å; L640-H680 HydrophobicContact CD1-CB 4.38Å
641	Y	55.8	Low	55.7	Low	22 Å²	22	73.3 Å²	73.3	9%	0.086	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-118	7.5	-170.2	-77.3	-93.6	0	0	0	113.3	V637 Q639 W649 L703 W949	V637-Y641 HydrophobicContact CG1-CD2 4.42Å; V637-Y641 HydrophobicContact CG1-CE2 4.22Å; Q639-Y641 PolarHBondContact O-N 2.86Å; Y641-W649 AromaticContact CD1-CH2 3.79Å; Y641-W649 HydrophobicContact CD1-CH2 3.79Å; Y641-W649 AromaticContact CD1-CZ2 3.32Å; Y641-W649 HydrophobicContact CD1-CZ2 3.32Å; Y641-W649 HydrophobicContact CD2-CZ2 4.23Å; Y641-W649 AromaticContact CE1-CH2 3Å; Y641-W649 HydrophobicContact CE1-CH2 3Å; Y641-W649 AromaticContact CE1-CZ2 3.02Å; Y641-W649 HydrophobicContact CE1-CZ2 3.02Å; Y641-W649 HydrophobicContact CE1-CZ3 4.02Å; Y641-W649 HydrophobicContact CE2-CH2 4.28Å; Y641-W649 AromaticContact CE2-CZ2 3.97Å; Y641-W649 HydrophobicContact CE2-CZ2 3.97Å; Y641-W649 AromaticContact CG-CZ2 3.95Å; Y641-W649 HydrophobicContact CG-CZ2 3.95Å; Y641-W649 AromaticContact CZ-CH2 3.3Å; Y641-W649 AromaticContact CZ-CZ2 3.38Å; Y641-W649 WeakPolarHBondContact OH-CH2 3.28Å; Y641-L703 HydrophobicContact CD1-CD1 4.12Å; Y641-L703 HydrophobicContact CD1-CD2 4.45Å; Y641-L703 HydrophobicContact CD2-CD1 4Å; Y641-L703 HydrophobicContact CD2-CD2 3.75Å; Y641-L703 HydrophobicContact CE1-CD1 4.24Å; Y641-L703 HydrophobicContact CE2-CD1 4.18Å; Y641-L703 HydrophobicContact CG-CD1 3.96Å; Y641-L703 HydrophobicContact CG-CD2 3.62Å; Y641-L703 HydrophobicContact CG-CG 4.45Å; Y641-W949 AromaticContact CD1-CD1 3.63Å; Y641-W949 AromaticContact CD1-NE1 3.33Å; Y641-W949 VanDerWaalsContact CD1-NE1 3.33Å; Y641-W949 AromaticContact CE1-CD1 3.52Å; Y641-W949 AromaticContact CE1-NE1 3.75Å
642	V	53.3	Low	54.1	Low	52 Å²	52	73.8 Å²	73.8	32%	0.315	34%	0.342	S	S	.	.	S	Bend	trans	-61.2	145.2	177.1	-177.7	0	0	0	0	109.8	T638 S644 A645	T638-V642 WeakPolarHBondContact O-CG2 3.28Å; V642-S644 PolarHBondContact O-N 3.36Å; V642-A645 PolarHBondContact O-N 3.11Å
643	P	44.9	Very low	52.3	Low	48 Å²	48	80.8 Å²	80.8	31%	0.312	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-49.1	-32.3	-176	-31.4	36.2	0	0	0	115.8	A645 R646	P643-A645 PolarHBondContact O-N 2.84Å; P643-R646 VanDerWaalsContact O-CB 3.26Å; P643-R646 WeakPolarHBondContact O-CB 3.41Å; P643-R646 VanDerWaalsContact O-CG 3.26Å; P643-R646 WeakPolarHBondContact O-CG 3.42Å; P643-R646 PolarHBondContact O-N 2.51Å
644	S	41	Very low	50.7	Low	67 Å²	67	75 Å²	75	47%	0.469	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-60.4	-23.9	176.9	-37.6	0	0	0	0	113.8	V642 P670	V642-S644 PolarHBondContact O-N 3.36Å; S644-P670 VanDerWaalsContact O-CB 3.28Å; S644-P670 WeakPolarHBondContact O-CB 3.39Å
645	A	44.5	Very low	49.1	Very low	7 Å²	7	77.4 Å²	77.4	6%	0.058	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-89	-7.3	177	0	0	0	0	0	113.6	V642 P643 H647 V648 W649	V642-A645 PolarHBondContact O-N 3.11Å; P643-A645 PolarHBondContact O-N 2.84Å; A645-H647 PolarHBondContact O-N 3.26Å; A645-H647 VanDerWaalsContact O-N 3.08Å; A645-V648 WeakPolarHBondContact O-CA 3.34Å; A645-V648 VanDerWaalsContact O-CB 3.27Å; A645-V648 WeakPolarHBondContact O-CB 3.37Å; A645-V648 PolarHBondContact O-N 3.46Å; A645-W649 VanDerWaalsContact O-CD1 3.3Å; A645-W649 PolarHBondContact O-N 3Å
646	R	45.2	Very low	47.7	Very low	138 Å²	138	79.5 Å²	79.5	52%	0.521	37%	0.371	S	S	.	.	H	α-helix	trans	-57.2	-28.4	-172.5	-74.9	174.1	-178.4	-178	3.4	114.6	P643	P643-R646 VanDerWaalsContact O-CB 3.26Å; P643-R646 WeakPolarHBondContact O-CB 3.41Å; P643-R646 VanDerWaalsContact O-CG 3.26Å; P643-R646 WeakPolarHBondContact O-CG 3.42Å; P643-R646 PolarHBondContact O-N 2.51Å
647	H	42.5	Very low	46.2	Very low	145 Å²	145	77.3 Å²	77.3	67%	0.671	37%	0.366	S	S	*	.	H	α-helix	trans	-74.6	-28.9	175.2	-70.1	-69.4	0	0	0	113.2	A645 W649 T651 P670	A645-H647 PolarHBondContact O-N 3.26Å; A645-H647 VanDerWaalsContact O-N 3.08Å; H647-W649 VanDerWaalsContact C-N 3.32Å; H647-T651 PolarHBondContact O-OG1 2.96Å; H647-P670 HydrophobicContact CB-CG 4.36Å
648	V	43.3	Very low	44.7	Very low	20 Å²	20	79.5 Å²	79.5	12%	0.121	39%	0.388	C	S	.	.	H	α-helix	trans	-68	-35.9	175	-177	0	0	0	0	110.6	A645 T651 R652 P670	A645-V648 WeakPolarHBondContact O-CA 3.34Å; A645-V648 VanDerWaalsContact O-CB 3.27Å; A645-V648 WeakPolarHBondContact O-CB 3.37Å; A645-V648 PolarHBondContact O-N 3.46Å; V648-T651 PolarHBondContact O-N 3.45Å; V648-R652 HydrophobicContact CG1-CB 4.47Å; V648-R652 VanDerWaalsContact CG1-CD 3.42Å; V648-R652 HydrophobicContact CG1-CG 3.93Å; V648-R652 VanDerWaalsContact O-CB 3.29Å; V648-R652 WeakPolarHBondContact O-CB 3.36Å; V648-R652 WeakPolarHBondContact O-CG 3.3Å; V648-R652 PolarHBondContact O-N 2.94Å; V648-P670 HydrophobicContact CG2-CB 3.85Å; V648-P670 HydrophobicContact CG2-CG 4Å
649	W	41.6	Very low	43.2	Very low	54 Å²	54	84.5 Å²	84.5	21%	0.205	42%	0.421	C	S	.	.	H	α-helix	trans	-65.2	-38.8	-178.5	-84.3	83.6	0	0	0	114.9	L640 Y641 A645 H647 T651 L681 T685 E948	L640-W649 PolarHBondContact O-NE1 3.37Å; Y641-W649 AromaticContact CD1-CH2 3.79Å; Y641-W649 HydrophobicContact CD1-CH2 3.79Å; Y641-W649 AromaticContact CD1-CZ2 3.32Å; Y641-W649 HydrophobicContact CD1-CZ2 3.32Å; Y641-W649 HydrophobicContact CD2-CZ2 4.23Å; Y641-W649 AromaticContact CE1-CH2 3Å; Y641-W649 HydrophobicContact CE1-CH2 3Å; Y641-W649 AromaticContact CE1-CZ2 3.02Å; Y641-W649 HydrophobicContact CE1-CZ2 3.02Å; Y641-W649 HydrophobicContact CE1-CZ3 4.02Å; Y641-W649 HydrophobicContact CE2-CH2 4.28Å; Y641-W649 AromaticContact CE2-CZ2 3.97Å; Y641-W649 HydrophobicContact CE2-CZ2 3.97Å; Y641-W649 AromaticContact CG-CZ2 3.95Å; Y641-W649 HydrophobicContact CG-CZ2 3.95Å; Y641-W649 AromaticContact CZ-CH2 3.3Å; Y641-W649 AromaticContact CZ-CZ2 3.38Å; Y641-W649 WeakPolarHBondContact OH-CH2 3.28Å; A645-W649 VanDerWaalsContact O-CD1 3.3Å; A645-W649 PolarHBondContact O-N 3Å; H647-W649 VanDerWaalsContact C-N 3.32Å; W649-T651 VanDerWaalsContact C-N 3.35Å; W649-L681 HydrophobicContact CH2-CD1 3.26Å; W649-L681 HydrophobicContact CZ2-CD1 3.21Å; W649-L681 HydrophobicContact CZ2-CD2 4.39Å; W649-L681 HydrophobicContact CZ2-CG 4.43Å; W649-L681 HydrophobicContact CZ3-CD1 4.17Å; W649-T685 HydrophobicContact CH2-CG2 4.11Å; W649-T685 HydrophobicContact CZ3-CG2 4.06Å; W649-E948 HydrophobicContact CZ3-CB 4.27Å
650	R	40.7	Very low	41.7	Very low	226 Å²	226	85.2 Å²	85.2	85%	0.853	43%	0.429	S	S	*	.	H	α-helix	trans	-73.3	-28.8	179.2	-72.3	-169	-172	-174.3	3.6	112.7
651	T	38.6	Very low	40.3	Very low	76 Å²	76	94 Å²	94	47%	0.466	47%	0.469	S	S	.	.	H	α-helix	trans	-98.7	-28.3	-170.3	-31.2	0	0	0	0	112.4	H647 V648 W649 R653 R656	H647-T651 PolarHBondContact O-OG1 2.96Å; V648-T651 PolarHBondContact O-N 3.45Å; W649-T651 VanDerWaalsContact C-N 3.35Å; T651-R653 PolarHBondContact O-N 3.43Å; T651-R656 WeakPolarHBondContact O-CB 3.44Å; T651-R656 VanDerWaalsContact O-O 3.07Å
652	R	44.4	Very low	38.8	Very low	117 Å²	117	97.5 Å²	97.5	44%	0.442	50%	0.498	S	S	.	.			trans	-100.8	42.5	-174.4	-59.4	-165.4	-172.8	179	-0	115.1	V648 E678	V648-R652 HydrophobicContact CG1-CB 4.47Å; V648-R652 VanDerWaalsContact CG1-CD 3.42Å; V648-R652 HydrophobicContact CG1-CG 3.93Å; V648-R652 VanDerWaalsContact O-CB 3.29Å; V648-R652 WeakPolarHBondContact O-CB 3.36Å; V648-R652 WeakPolarHBondContact O-CG 3.3Å; V648-R652 PolarHBondContact O-N 2.94Å; R652-E678 IonicContact CZ-OE1 3.6Å; R652-E678 IonicContact NH1-OE1 3.55Å; R652-E678 PolarHBondContact NH1-OE1 3.46Å
653	R	42.9	Very low	37.6	Very low	152 Å²	152	101.3 Å²	101.3	57%	0.574	52%	0.521	S	S	*	.	S	Bend	trans	-65.9	142.7	150.2	-69	-169	-148.9	-158.3	6.3	106.7	T651 G655 R656	T651-R653 PolarHBondContact O-N 3.43Å; R653-G655 PolarHBondContact O-N 3.37Å; R653-R656 PolarHBondContact O-N 2.98Å
654	M	43.1	Very low	36.9	Very low	16 Å²	16	106 Å²	106	8%	0.079	54%	0.543	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	13.3	177.6	-127.4	176.5	176	0	0	114.1	A558 Y559 V597 F600 K601	A558-M654 HydrophobicContact CB-CE 3.8Å; Y559-M654 HydrophobicContact CE2-CE 3.99Å; V597-M654 HydrophobicContact CB-CG 4.49Å; V597-M654 HydrophobicContact CG1-CB 4.16Å; V597-M654 HydrophobicContact CG1-CG 3.74Å; V597-M654 WeakPolarHBondContact CG1-O 3.38Å; V597-M654 HydrophobicContact CG1-SD 4.41Å; V597-M654 HydrophobicContact CG2-CE 3.83Å; V597-M654 HydrophobicContact CG2-CG 4.12Å; F600-M654 HydrophobicContact CB-CE 4.47Å; F600-M654 HydrophobicContact CB-SD 4.5Å; F600-M654 HydrophobicContact CD1-CE 4.08Å; F600-M654 HydrophobicContact CD1-SD 3.28Å; F600-M654 WeakPolarHBondContact CD1-SD 3.34Å; F600-M654 HydrophobicContact CE1-SD 3.64Å; F600-M654 HydrophobicContact CG-CE 4.24Å; F600-M654 HydrophobicContact CG-SD 4.02Å; K601-M654 WeakPolarHBondContact CE-O 3.41Å; K601-M654 PolarHBondContact NZ-O 2.68Å
655	G	39.5	Very low	36.9	Very low	51 Å²	51	111 Å²	111	53%	0.526	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.8	-3.9	169.6	0	0	0	0	0	117.1	R653	R653-G655 PolarHBondContact O-N 3.37Å
656	R	38.2	Very low	36.3	Very low	154 Å²	154	117.1 Å²	117.1	58%	0.581	60%	0.6	S	S	*	*			trans	-129.3	50.6	176.5	-75.3	-168.1	-176.2	-142.6	5.4	112.6	E362 T651 R653 G658	E362-R656 IonicContact OE2-CZ 3.93Å; E362-R656 IonicContact OE2-NH2 2.81Å; E362-R656 PolarHBondContact OE2-NH2 2.89Å; T651-R656 WeakPolarHBondContact O-CB 3.44Å; T651-R656 VanDerWaalsContact O-O 3.07Å; R653-R656 PolarHBondContact O-N 2.98Å; R656-G658 PolarHBondContact O-N 2.85Å
657	I	35	Very low	35.9	Very low	104 Å²	104	114.1 Å²	114.1	53%	0.533	61%	0.612	S	S	.	*			trans	-94.6	85.1	166.3	-54.7	175.2	0	0	0	107.7
658	G	30.8	Very low	35.7	Very low	46 Å²	46	116.3 Å²	116.3	47%	0.474	62%	0.621	S	S	.	*	S	Bend	trans	-128.8	154	159.4	0	0	0	0	0	108.1	R656 L660	R656-G658 PolarHBondContact O-N 2.85Å; G658-L660 PolarHBondContact O-N 2.93Å
659	P	27.2	Very low	35.4	Very low	137 Å²	137	124.4 Å²	124.4	89%	0.89	66%	0.657	S	S	*	*			trans	-73.3	99.5	171.6	30.3	-27.8	0	0	0	107.2
660	L	25.1	Very low	35.6	Very low	157 Å²	157	123.7 Å²	123.7	82%	0.822	66%	0.659	S	S	*	*			trans	-106.8	102.3	166.6	-79.7	167.2	0	0	0	107.9	G658 S662	G658-L660 PolarHBondContact O-N 2.93Å; L660-S662 PolarHBondContact O-N 3.39Å; L660-S662 VanDerWaalsContact O-N 3.15Å
661	Q	28.6	Very low	36.1	Very low	184 Å²	184	117.3 Å²	117.3	86%	0.86	65%	0.647	S	S	*	*			trans	-54.8	106.9	166	-153.3	160.6	7.7	0	0	107.6	T663	Q661-T663 PolarHBondContact O-N 2.87Å
662	S	24.7	Very low	37	Very low	97 Å²	97	119.4 Å²	119.4	68%	0.678	65%	0.652	S	S	*	*			trans	-77.5	104.2	172.3	177.9	0	0	0	0	108.1	L660 L664	L660-S662 PolarHBondContact O-N 3.39Å; L660-S662 VanDerWaalsContact O-N 3.15Å; S662-L664 PolarHBondContact O-N 3.25Å
663	T	26.8	Very low	37.9	Very low	132 Å²	132	114.5 Å²	114.5	81%	0.81	63%	0.634	S	S	*	*			trans	-77.8	51.6	167.5	49.1	0	0	0	0	111.2	Q661	Q661-T663 PolarHBondContact O-N 2.87Å
664	L	32.2	Very low	39.4	Very low	147 Å²	147	109.7 Å²	109.7	77%	0.77	62%	0.624	S	S	*	*	S	Bend	trans	-138.2	102.9	166	-79.1	172.2	0	0	0	107.9	S662 V666	S662-L664 PolarHBondContact O-N 3.25Å; L664-V666 PolarHBondContact O-N 3.11Å
665	D	39.3	Very low	40.8	Very low	170 Å²	170	109.7 Å²	109.7	91%	0.909	63%	0.625	S	S	*	*			trans	-58.4	108.6	174.8	-81.7	-42.2	0	0	0	111.1
666	V	33.8	Very low	42.6	Very low	136 Å²	136	110.2 Å²	110.2	82%	0.824	62%	0.62	S	S	*	*			trans	-138.1	105	147.9	-168.7	0	0	0	0	106.9	L664 F668	L664-V666 PolarHBondContact O-N 3.11Å; V666-F668 VanDerWaalsContact C-N 3.34Å; V666-F668 PolarHBondContact O-N 3.34Å
667	G	35.8	Very low	44.4	Very low	75 Å²	75	104.7 Å²	104.7	77%	0.773	60%	0.601	S	S	*	*			trans	-73.8	59.9	-162.1	0	0	0	0	0	117.7
668	F	37.7	Very low	46.3	Very low	192 Å²	192	101.3 Å²	101.3	84%	0.842	58%	0.583	S	S	*	*			trans	-139.3	101	158.7	-80.7	-83.5	0	0	0	109.7	V666	V666-F668 VanDerWaalsContact C-N 3.34Å; V666-F668 PolarHBondContact O-N 3.34Å
669	E	37.8	Very low	48.7	Very low	189 Å²	189	101 Å²	101	88%	0.883	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-60	129.6	165.2	-77.9	-172.5	150.1	0	0	108.8
670	P	45.4	Very low	51.4	Low	40 Å²	40	96.3 Å²	96.3	26%	0.26	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-54.9	144.2	173.2	-25.5	34.9	0	0	0	110.7	S644 H647 V648 Q672	S644-P670 VanDerWaalsContact O-CB 3.28Å; S644-P670 WeakPolarHBondContact O-CB 3.39Å; H647-P670 HydrophobicContact CB-CG 4.36Å; V648-P670 HydrophobicContact CG2-CB 3.85Å; V648-P670 HydrophobicContact CG2-CG 4Å; P670-Q672 PolarHBondContact O-N 3.03Å
671	P	50.5	Low	54	Low	92 Å²	92	90.1 Å²	90.1	60%	0.597	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-56.1	129.6	168.1	23.7	-31	0	0	0	109.4	L673	P671-L673 PolarHBondContact O-N 3.14Å
672	Q	57.8	Low	56.5	Low	119 Å²	119	81.8 Å²	81.8	56%	0.556	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-67.3	129.1	179.4	-66.2	-168.1	-15.4	0	0	110.4	E565 P670	E565-Q672 PolarHBondContact OE1-NE2 3.36Å; E565-Q672 PolarHBondContact OE1-OE1 3.15Å; E565-Q672 PolarHBondContact OE2-OE1 3.49Å; E565-Q672 VanDerWaalsContact OE2-OE1 3.1Å; P670-Q672 PolarHBondContact O-N 3.03Å
673	L	64.9	Low	59.4	Low	15 Å²	15	77.8 Å²	77.8	8%	0.079	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-64.9	144.6	173.9	-62.5	177.7	0	0	0	110.7	L640 P671 E677 E678 L681	L640-L673 HydrophobicContact CD2-CD1 4.26Å; L640-L673 HydrophobicContact CD2-CD2 3.76Å; P671-L673 PolarHBondContact O-N 3.14Å; L673-E677 HydrophobicContact CB-CB 4.16Å; L673-E677 HydrophobicContact CD2-CB 4.49Å; L673-E678 HydrophobicContact CB-CG 3.79Å; L673-E678 HydrophobicContact CD1-CG 4.36Å; L673-L681 HydrophobicContact CD1-CD2 4.16Å
674	S	72.8	Confident	62.1	Low	51 Å²	51	71.6 Å²	71.6	36%	0.357	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-68.5	159	167.7	68.3	0	0	0	0	111.1	S676 E677 E678	S674-S676 PolarHBondContact O-N 3.49Å; S674-E677 VanDerWaalsContact CB-OE2 3.29Å; S674-E677 WeakPolarHBondContact CB-OE2 3.49Å; S674-E677 PolarHBondContact N-OE2 2.74Å; S674-E677 VanDerWaalsContact O-CB 3.31Å; S674-E677 WeakPolarHBondContact O-CB 3.5Å; S674-E677 PolarHBondContact O-N 3.32Å; S674-E677 VanDerWaalsContact O-N 3.09Å; S674-E677 WeakPolarHBondContact OG-CB 2.99Å; S674-E677 VanDerWaalsContact OG-CD 3.24Å; S674-E677 VanDerWaalsContact OG-CG 3.25Å; S674-E677 WeakPolarHBondContact OG-CG 2.99Å; S674-E677 PolarHBondContact OG-N 3.05Å; S674-E677 PolarHBondContact OG-OE2 3.21Å; S674-E678 PolarHBondContact O-N 3.33Å
675	V	73.4	Confident	64.5	Low	16 Å²	16	67.1 Å²	67.1	10%	0.097	38%	0.375	C	S	.	.	H	α-helix	trans	-59.7	-37.4	178.7	178.4	0	0	0	0	111.7	Y559 K563 E677 E678 R679	Y559-V675 VanDerWaalsContact O-CG1 3.23Å; Y559-V675 WeakPolarHBondContact O-CG1 3.35Å; K563-V675 HydrophobicContact CG-CG2 3.85Å; V675-E677 VanDerWaalsContact C-N 3.33Å; V675-E677 PolarHBondContact O-N 3.31Å; V675-E678 PolarHBondContact O-N 2.98Å; V675-R679 VanDerWaalsContact O-CG 3.3Å; V675-R679 WeakPolarHBondContact O-CG 3.39Å; V675-R679 PolarHBondContact O-N 3.32Å
676	S	77.7	Confident	66.5	Low	61 Å²	61	61.6 Å²	61.6	43%	0.427	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-40.8	176.9	-178.2	0	0	0	0	111.6	S674 R679 H680	S674-S676 PolarHBondContact O-N 3.49Å; S676-R679 PolarHBondContact O-N 2.89Å; S676-H680 PolarHBondContact O-N 2.89Å; S676-H680 PolarHBondContact O-ND1 3.33Å; S676-H680 PolarHBondContact OG-CE1 3.4Å
677	E	76.3	Confident	69.1	Low	38 Å²	38	55.1 Å²	55.1	18%	0.178	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-44	176	-84.4	170.7	148.1	0	0	112.4	L640 L673 S674 V675 R679 H680 L681	L640-E677 HydrophobicContact CD2-CB 3.32Å; L640-E677 HydrophobicContact CD2-CG 3.5Å; L640-E677 HydrophobicContact CG-CB 4.4Å; L640-E677 HydrophobicContact CG-CG 4.16Å; L673-E677 HydrophobicContact CB-CB 4.16Å; L673-E677 HydrophobicContact CD2-CB 4.49Å; S674-E677 VanDerWaalsContact CB-OE2 3.29Å; S674-E677 WeakPolarHBondContact CB-OE2 3.49Å; S674-E677 PolarHBondContact N-OE2 2.74Å; S674-E677 VanDerWaalsContact O-CB 3.31Å; S674-E677 WeakPolarHBondContact O-CB 3.5Å; S674-E677 PolarHBondContact O-N 3.32Å; S674-E677 VanDerWaalsContact O-N 3.09Å; S674-E677 WeakPolarHBondContact OG-CB 2.99Å; S674-E677 VanDerWaalsContact OG-CD 3.24Å; S674-E677 VanDerWaalsContact OG-CG 3.25Å; S674-E677 WeakPolarHBondContact OG-CG 2.99Å; S674-E677 PolarHBondContact OG-N 3.05Å; S674-E677 PolarHBondContact OG-OE2 3.21Å; V675-E677 VanDerWaalsContact C-N 3.33Å; V675-E677 PolarHBondContact O-N 3.31Å; E677-R679 VanDerWaalsContact C-N 3.35Å; E677-R679 PolarHBondContact O-N 2.64Å; E677-H680 PolarHBondContact O-N 2.96Å; E677-L681 VanDerWaalsContact O-CB 3.3Å; E677-L681 WeakPolarHBondContact O-CB 3.49Å; E677-L681 PolarHBondContact O-N 3.12Å
678	E	74.2	Confident	71.6	Confident	34 Å²	34	52.3 Å²	52.3	16%	0.159	27%	0.273	C	S	.	.	H	α-helix	trans	-61.9	-41.2	175.6	-68.3	-176.3	164.9	0	0	112.1	Y559 R652 L673 S674 V675 L681 A682	Y559-E678 HydrophobicContact CD1-CB 4.09Å; Y559-E678 VanDerWaalsContact CD1-OE2 3.29Å; Y559-E678 WeakPolarHBondContact CD1-OE2 3.5Å; Y559-E678 HydrophobicContact CE1-CB 4.34Å; R652-E678 IonicContact CZ-OE1 3.6Å; R652-E678 IonicContact NH1-OE1 3.55Å; R652-E678 PolarHBondContact NH1-OE1 3.46Å; L673-E678 HydrophobicContact CB-CG 3.79Å; L673-E678 HydrophobicContact CD1-CG 4.36Å; S674-E678 PolarHBondContact O-N 3.33Å; V675-E678 PolarHBondContact O-N 2.98Å; E678-L681 PolarHBondContact O-N 3.37Å; E678-A682 WeakPolarHBondContact O-CB 2.81Å; E678-A682 PolarHBondContact O-N 2.93Å
679	R	81.4	Confident	74.1	Confident	38 Å²	38	44.5 Å²	44.5	14%	0.143	24%	0.239	C	C	.	.	H	α-helix	trans	-64.3	-47.6	175.3	-70.4	173.2	177.6	179.1	-4.9	112	I555 K556 Y559 E561 V675 S676 E677 L681 A682 I683	I555-R679 HydrophobicContact CG2-CB 4.06Å; I555-R679 HydrophobicContact CG2-CG 4.02Å; K556-R679 PolarHBondContact O-NH2 3.02Å; Y559-R679 PolarHBondContact O-NE 3Å; Y559-R679 PolarHBondContact O-NH2 2.75Å; E561-R679 IonicContact OE1-CZ 3.87Å; E561-R679 IonicContact OE1-NH1 3.85Å; E561-R679 PolarHBondContact OE1-NH1 3.45Å; E561-R679 IonicContact OE1-NH2 3.37Å; V675-R679 VanDerWaalsContact O-CG 3.3Å; V675-R679 WeakPolarHBondContact O-CG 3.39Å; V675-R679 PolarHBondContact O-N 3.32Å; S676-R679 PolarHBondContact O-N 2.89Å; E677-R679 VanDerWaalsContact C-N 3.35Å; E677-R679 PolarHBondContact O-N 2.64Å; R679-L681 VanDerWaalsContact C-N 3.27Å; R679-L681 PolarHBondContact O-N 3.39Å; R679-A682 PolarHBondContact O-N 2.91Å; R679-I683 WeakPolarHBondContact O-CG1 3.29Å; R679-I683 PolarHBondContact O-N 3.31Å
680	H	84.1	Confident	76.7	Confident	40 Å²	40	35.5 Å²	35.5	19%	0.185	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-40.1	178.1	-65.3	147.6	0	0	0	111.5	I632 L640 S676 E677 I683 L684	I632-H680 HydrophobicContact CD1-CB 3.99Å; I632-H680 HydrophobicContact CG1-CB 4.31Å; I632-H680 VanDerWaalsContact CG1-CD2 3.43Å; I632-H680 WeakPolarHBondContact CG1-CD2 3.44Å; L640-H680 HydrophobicContact CD1-CB 4.38Å; S676-H680 PolarHBondContact O-N 2.89Å; S676-H680 PolarHBondContact O-ND1 3.33Å; S676-H680 PolarHBondContact OG-CE1 3.4Å; E677-H680 PolarHBondContact O-N 2.96Å; H680-I683 PolarHBondContact O-N 3.45Å; H680-L684 WeakPolarHBondContact O-CG 3.37Å; H680-L684 PolarHBondContact O-N 2.74Å
681	L	79.2	Confident	78.8	Confident	27 Å²	27	33.6 Å²	33.6	14%	0.141	18%	0.184	C	C	.	.	H	α-helix	trans	-63.5	-45.8	175.7	177.6	59.7	0	0	0	111.8	W649 L673 E677 E678 R679 I683 L684 T685	W649-L681 HydrophobicContact CH2-CD1 3.26Å; W649-L681 HydrophobicContact CZ2-CD1 3.21Å; W649-L681 HydrophobicContact CZ2-CD2 4.39Å; W649-L681 HydrophobicContact CZ2-CG 4.43Å; W649-L681 HydrophobicContact CZ3-CD1 4.17Å; L673-L681 HydrophobicContact CD1-CD2 4.16Å; E677-L681 VanDerWaalsContact O-CB 3.3Å; E677-L681 WeakPolarHBondContact O-CB 3.49Å; E677-L681 PolarHBondContact O-N 3.12Å; E678-L681 PolarHBondContact O-N 3.37Å; R679-L681 VanDerWaalsContact C-N 3.27Å; R679-L681 PolarHBondContact O-N 3.39Å; L681-I683 VanDerWaalsContact C-N 3.28Å; L681-I683 PolarHBondContact O-N 3.36Å; L681-L684 PolarHBondContact O-N 3.35Å; L681-T685 HydrophobicContact CD1-CG2 3.9Å; L681-T685 WeakPolarHBondContact O-CB 3.5Å; L681-T685 VanDerWaalsContact O-CG2 3.32Å; L681-T685 WeakPolarHBondContact O-CG2 3.28Å; L681-T685 PolarHBondContact O-N 2.99Å; L681-T685 PolarHBondContact O-OG1 2.93Å
682	A	80.6	Confident	80.7	Confident	8 Å²	8	31.8 Å²	31.8	7%	0.066	17%	0.173	C	C	.	.	H	α-helix	trans	-59.7	-39.9	176.2	0	0	0	0	0	111.7	I555 Y559 E678 R679 T685 E686	I555-A682 HydrophobicContact CD1-CB 4.28Å; I555-A682 HydrophobicContact CG1-CB 4.45Å; I555-A682 HydrophobicContact CG2-CB 4.07Å; Y559-A682 HydrophobicContact CE2-CB 4.32Å; E678-A682 WeakPolarHBondContact O-CB 2.81Å; E678-A682 PolarHBondContact O-N 2.93Å; R679-A682 PolarHBondContact O-N 2.91Å; A682-T685 WeakPolarHBondContact CA-OG1 3.33Å; A682-T685 PolarHBondContact O-OG1 3.36Å; A682-T685 VanDerWaalsContact O-OG1 3.12Å; A682-E686 WeakPolarHBondContact O-CB 3.25Å; A682-E686 PolarHBondContact O-N 2.92Å
683	I	86.4	Confident	82.3	Confident	14 Å²	14	28.1 Å²	28.1	7%	0.072	16%	0.155	C	C	.	.	H	α-helix	trans	-66	-49.8	176.6	-67.3	167.4	0	0	0	111.2	L552 I555 V630 I632 R679 H680 L681 T685 L687 V690 V691	L552-I683 HydrophobicContact CD2-CD1 4.06Å; L552-I683 HydrophobicContact CD2-CG1 4Å; I555-I683 HydrophobicContact CD1-CG1 3.7Å; V630-I683 HydrophobicContact CG1-CD1 4.2Å; V630-I683 HydrophobicContact CG1-CG2 4.23Å; V630-I683 HydrophobicContact CG2-CD1 4.22Å; I632-I683 HydrophobicContact CD1-CB 4.15Å; I632-I683 HydrophobicContact CD1-CD1 4.47Å; I632-I683 HydrophobicContact CD1-CG2 3.99Å; R679-I683 WeakPolarHBondContact O-CG1 3.29Å; R679-I683 PolarHBondContact O-N 3.31Å; H680-I683 PolarHBondContact O-N 3.45Å; L681-I683 VanDerWaalsContact C-N 3.28Å; L681-I683 PolarHBondContact O-N 3.36Å; I683-T685 PolarHBondContact O-N 3.34Å; I683-L687 CarbonylContact O-C 3.57Å; I683-L687 VanDerWaalsContact O-CA 3.31Å; I683-L687 WeakPolarHBondContact O-CA 3.46Å; I683-L687 PolarHBondContact O-N 3.04Å; I683-V690 HydrophobicContact CG2-CG2 3.43Å; I683-V690 VanDerWaalsContact CG2-CG2 3.43Å; I683-V691 HydrophobicContact CG2-CG2 4.15Å
684	L	83.8	Confident	83.4	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-25.6	-178.2	-71.5	172.3	0	0	0	113.3	I632 V637 H680 L681 P688 V691 R696 I699 M952	I632-L684 HydrophobicContact CD1-CD2 4.47Å; I632-L684 HydrophobicContact CD1-CG 4.2Å; I632-L684 HydrophobicContact CG2-CD1 4.32Å; V637-L684 HydrophobicContact CG1-CD1 3.9Å; H680-L684 WeakPolarHBondContact O-CG 3.37Å; H680-L684 PolarHBondContact O-N 2.74Å; L681-L684 PolarHBondContact O-N 3.35Å; L684-P688 WeakPolarHBondContact O-CB 3.38Å; L684-V691 HydrophobicContact CD2-CG2 4.05Å; L684-R696 HydrophobicContact CD2-CG 4.38Å; L684-I699 HydrophobicContact CD1-CD1 4.29Å; L684-I699 HydrophobicContact CD2-CD1 4.19Å; L684-M952 HydrophobicContact CB-SD 4.46Å; L684-M952 HydrophobicContact CD2-SD 4.12Å
685	T	80.9	Confident	84.1	Confident	54 Å²	54	32.2 Å²	32.2	33%	0.331	17%	0.168	S	C	.	.	H	α-helix	trans	-88.5	-41.3	179.9	50.5	0	0	0	0	112.6	W649 L681 A682 I683	W649-T685 HydrophobicContact CH2-CG2 4.11Å; W649-T685 HydrophobicContact CZ3-CG2 4.06Å; L681-T685 HydrophobicContact CD1-CG2 3.9Å; L681-T685 WeakPolarHBondContact O-CB 3.5Å; L681-T685 VanDerWaalsContact O-CG2 3.32Å; L681-T685 WeakPolarHBondContact O-CG2 3.28Å; L681-T685 PolarHBondContact O-N 2.99Å; L681-T685 PolarHBondContact O-OG1 2.93Å; A682-T685 WeakPolarHBondContact CA-OG1 3.33Å; A682-T685 PolarHBondContact O-OG1 3.36Å; A682-T685 VanDerWaalsContact O-OG1 3.12Å; I683-T685 PolarHBondContact O-N 3.34Å
686	E	82.9	Confident	84.9	Confident	54 Å²	54	31.6 Å²	31.6	25%	0.252	16%	0.164	S	C	.	.	H	α-helix	trans	-102.2	-27.8	-172.6	-65.6	-70.1	176.8	0	0	113.6	F600 T604 K608 A682	F600-E686 HydrophobicContact CE1-CB 3.86Å; F600-E686 HydrophobicContact CE1-CG 3.85Å; F600-E686 HydrophobicContact CZ-CB 3.72Å; F600-E686 HydrophobicContact CZ-CG 4.2Å; T604-E686 HydrophobicContact CG2-CB 4.27Å; K608-E686 WeakPolarHBondContact CE-O 3.45Å; K608-E686 PolarHBondContact NZ-O 3.49Å; K608-E686 IonicContact NZ-OE2 3.64Å; K608-E686 PolarHBondContact NZ-OE2 2.89Å; A682-E686 WeakPolarHBondContact O-CB 3.25Å; A682-E686 PolarHBondContact O-N 2.92Å
687	L	88.3	Confident	85.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.145	C	C	.	.			trans	-139.4	50.1	-176	-65	165	0	0	0	112.1	C551 I555 F600 T604 V607 I683 F689 V690	C551-L687 HydrophobicContact CB-CD1 3.45Å; C551-L687 VanDerWaalsContact CB-CD1 3.45Å; I555-L687 HydrophobicContact CD1-CD1 4.32Å; F600-L687 HydrophobicContact CE2-CD1 4.05Å; F600-L687 HydrophobicContact CZ-CD1 4.22Å; T604-L687 HydrophobicContact CG2-CD2 4.03Å; T604-L687 HydrophobicContact CG2-CG 4.37Å; V607-L687 HydrophobicContact CG1-CD2 4.17Å; I683-L687 CarbonylContact O-C 3.57Å; I683-L687 VanDerWaalsContact O-CA 3.31Å; I683-L687 WeakPolarHBondContact O-CA 3.46Å; I683-L687 PolarHBondContact O-N 3.04Å; L687-F689 HydrophobicContact CB-CZ 4.43Å; L687-F689 HydrophobicContact CD2-CE1 4Å; L687-F689 HydrophobicContact CD2-CE2 4.2Å; L687-F689 HydrophobicContact CD2-CZ 3.41Å; L687-F689 VanDerWaalsContact CD2-CZ 3.41Å; L687-F689 PolarHBondContact O-N 3.07Å; L687-F689 VanDerWaalsContact O-N 3.13Å; L687-V690 HydrophobicContact CB-CG1 4.11Å; L687-V690 WeakPolarHBondContact O-CG2 3.39Å; L687-V690 PolarHBondContact O-N 3.44Å; L687-V690 VanDerWaalsContact O-N 3.16Å
688	P	88.6	Confident	86.1	Confident	16 Å²	16	30.1 Å²	30.1	10%	0.104	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-60.9	-29.9	-172.3	22.5	-33	0	0	0	113.7	L684 V690 V691 R696 M952	L684-P688 WeakPolarHBondContact O-CB 3.38Å; P688-V690 PolarHBondContact O-N 3.35Å; P688-V690 VanDerWaalsContact O-N 3.08Å; P688-V691 WeakPolarHBondContact O-CB 3.32Å; P688-V691 PolarHBondContact O-N 3.1Å; P688-R696 VanDerWaalsContact O-CD 3.27Å; P688-R696 WeakPolarHBondContact O-CD 3.26Å; P688-R696 PolarHBondContact O-NE 3.36Å; P688-R696 VanDerWaalsContact O-NE 3.12Å; P688-M952 HydrophobicContact CB-CB 4.31Å; P688-M952 VanDerWaalsContact CB-O 3.28Å; P688-M952 WeakPolarHBondContact CB-O 3.19Å
689	F	89.3	Confident	86.7	Confident	27 Å²	27	28.6 Å²	28.6	12%	0.118	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-65.2	-9.4	-179.6	56.1	-101.4	0	0	0	114.6	V607 K608 K611 W625 L687 V691	V607-F689 HydrophobicContact CG1-CE2 4.05Å; V607-F689 HydrophobicContact CG1-CZ 3.62Å; K608-F689 HydrophobicContact CG-CE1 4.4Å; K611-F689 HydrophobicContact CG-CD1 4.23Å; K611-F689 HydrophobicContact CG-CE1 4.47Å; K611-F689 HydrophobicContact CG-CG 4.29Å; W625-F689 HydrophobicContact CB-CD2 4.07Å; W625-F689 HydrophobicContact CE3-CD2 4.28Å; W625-F689 AromaticContact CE3-CE2 3.89Å; W625-F689 HydrophobicContact CE3-CE2 3.89Å; L687-F689 HydrophobicContact CB-CZ 4.43Å; L687-F689 HydrophobicContact CD2-CE1 4Å; L687-F689 HydrophobicContact CD2-CE2 4.2Å; L687-F689 HydrophobicContact CD2-CZ 3.41Å; L687-F689 VanDerWaalsContact CD2-CZ 3.41Å; L687-F689 PolarHBondContact O-N 3.07Å; L687-F689 VanDerWaalsContact O-N 3.13Å; F689-V691 VanDerWaalsContact C-N 3.27Å
690	V	91.4	Very high	87.1	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-77.7	-18	171.7	-51.1	0	0	0	0	112.4	R548 L552 W625 S627 V630 I683 L687 P688	R548-V690 HydrophobicContact CG-CG1 3.93Å; L552-V690 HydrophobicContact CD2-CG2 4.19Å; W625-V690 WeakPolarHBondContact O-CA 3.35Å; S627-V690 PolarHBondContact N-O 3.48Å; V630-V690 HydrophobicContact CG1-CG2 4.34Å; V630-V690 HydrophobicContact CG2-CG2 4.29Å; I683-V690 HydrophobicContact CG2-CG2 3.43Å; I683-V690 VanDerWaalsContact CG2-CG2 3.43Å; L687-V690 HydrophobicContact CB-CG1 4.11Å; L687-V690 WeakPolarHBondContact O-CG2 3.39Å; L687-V690 PolarHBondContact O-N 3.44Å; L687-V690 VanDerWaalsContact O-N 3.16Å; P688-V690 PolarHBondContact O-N 3.35Å; P688-V690 VanDerWaalsContact O-N 3.08Å
691	V	90.6	Very high	87.2	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.006	14%	0.135	C	C	.	.	S	Bend	trans	-93.8	133.9	174.8	-174.8	0	0	0	0	108.5	V630 I632 I683 L684 P688 F689 F693 E695 R696	V630-V691 HydrophobicContact CG1-CG2 4.05Å; I632-V691 HydrophobicContact CB-CG1 4.44Å; I632-V691 HydrophobicContact CB-CG2 4.39Å; I632-V691 HydrophobicContact CD1-CG2 3.87Å; I632-V691 HydrophobicContact CG1-CG2 4.49Å; I683-V691 HydrophobicContact CG2-CG2 4.15Å; L684-V691 HydrophobicContact CD2-CG2 4.05Å; P688-V691 WeakPolarHBondContact O-CB 3.32Å; P688-V691 PolarHBondContact O-N 3.1Å; F689-V691 VanDerWaalsContact C-N 3.27Å; V691-F693 PolarHBondContact O-N 2.85Å; V691-E695 HydrophobicContact CG1-CB 4.07Å; V691-R696 HydrophobicContact CB-CG 3.98Å; V691-R696 HydrophobicContact CG1-CG 3.87Å; V691-R696 PolarHBondContact O-NE 2.8Å; V691-R696 PolarHBondContact O-NH2 3.19Å
692	P	91.1	Very high	87.6	Confident	54 Å²	54	29.1 Å²	29.1	35%	0.351	14%	0.143	S	C	.	.			trans	-50.9	140.3	176.5	-27.7	35.2	0	0	0	112.7	L626 E694 E695 R696	L626-P692 HydrophobicContact CD2-CG 4.36Å; P692-E694 VanDerWaalsContact C-N 3.31Å; P692-E694 PolarHBondContact O-N 3.19Å; P692-E695 PolarHBondContact O-N 3.5Å; P692-E695 VanDerWaalsContact O-N 3.17Å; P692-R696 PolarHBondContact O-N 3.28Å; P692-R696 VanDerWaalsContact O-N 3.14Å
693	F	89.6	Confident	87.8	Confident	42 Å²	42	29 Å²	29	18%	0.184	14%	0.141	C	C	.	.	H	α-helix	trans	-55.4	-45.5	-179	174.8	-133.5	0	0	0	112	V691 E695 R696 V697 F953 E957 V960 L1021	V691-F693 PolarHBondContact O-N 2.85Å; F693-E695 VanDerWaalsContact C-N 3.34Å; F693-E695 PolarHBondContact O-N 3.33Å; F693-R696 PolarHBondContact O-N 3.03Å; F693-R696 VanDerWaalsContact O-N 3.13Å; F693-V697 HydrophobicContact CD2-CG2 3.9Å; F693-V697 HydrophobicContact CE1-CG2 4.49Å; F693-V697 HydrophobicContact CE2-CG2 3.5Å; F693-V697 VanDerWaalsContact CE2-CG2 3.5Å; F693-V697 HydrophobicContact CZ-CG2 3.84Å; F693-V697 WeakPolarHBondContact O-CG2 3.42Å; F693-V697 PolarHBondContact O-N 2.92Å; F693-F953 AromaticContact CD2-CD1 3.87Å; F693-F953 HydrophobicContact CD2-CD1 3.87Å; F693-F953 AromaticContact CD2-CE1 3.98Å; F693-F953 HydrophobicContact CD2-CE1 3.98Å; F693-F953 AromaticContact CE2-CD1 3.63Å; F693-F953 HydrophobicContact CE2-CD1 3.63Å; F693-F953 AromaticContact CE2-CE1 3.8Å; F693-F953 HydrophobicContact CE2-CE1 3.8Å; F693-E957 HydrophobicContact CD2-CB 4.03Å; F693-E957 HydrophobicContact CD2-CG 3.79Å; F693-E957 HydrophobicContact CE2-CB 3.6Å; F693-E957 HydrophobicContact CE2-CG 3.84Å; F693-E957 HydrophobicContact CG-CG 4.27Å; F693-E957 HydrophobicContact CZ-CB 4.1Å; F693-E957 HydrophobicContact CZ-CG 4.32Å; F693-V960 HydrophobicContact CE1-CB 4.27Å; F693-V960 HydrophobicContact CE1-CG1 3.84Å; F693-V960 HydrophobicContact CZ-CB 4.07Å; F693-V960 HydrophobicContact CZ-CG1 3.93Å; F693-L1021 HydrophobicContact CD1-CD1 4.04Å; F693-L1021 HydrophobicContact CD1-CD2 3.56Å; F693-L1021 HydrophobicContact CD1-CG 4.43Å; F693-L1021 HydrophobicContact CE1-CD1 3.65Å; F693-L1021 HydrophobicContact CE1-CD2 3.19Å; F693-L1021 HydrophobicContact CE1-CG 4.03Å; F693-L1021 HydrophobicContact CE2-CD2 4.38Å; F693-L1021 HydrophobicContact CG-CD2 4.32Å; F693-L1021 HydrophobicContact CZ-CD2 3.65Å
694	E	88.3	Confident	87.8	Confident	107 Å²	107	28.4 Å²	28.4	50%	0.5	14%	0.137	S	C	.	.	H	α-helix	trans	-56.8	-42.9	177.7	-64.1	172.4	-160.9	0	0	113.2	P692 V697 K698 L1022	P692-E694 VanDerWaalsContact C-N 3.31Å; P692-E694 PolarHBondContact O-N 3.19Å; E694-V697 PolarHBondContact O-N 3.45Å; E694-K698 WeakPolarHBondContact O-CG 3.19Å; E694-K698 PolarHBondContact O-N 3.31Å; E694-L1022 HydrophobicContact CB-CD2 3.96Å; E694-L1022 HydrophobicContact CG-CD2 4.27Å
695	E	88.4	Confident	87.9	Confident	44 Å²	44	30.7 Å²	30.7	21%	0.206	15%	0.154	C	C	.	.	H	α-helix	trans	-67.9	-38.5	177.9	-74.4	-58.4	126.7	0	0	111.5	A634 V691 P692 F693 K698 I699	A634-E695 PolarHBondContact N-OE2 2.93Å; V691-E695 HydrophobicContact CG1-CB 4.07Å; P692-E695 PolarHBondContact O-N 3.5Å; P692-E695 VanDerWaalsContact O-N 3.17Å; F693-E695 VanDerWaalsContact C-N 3.34Å; F693-E695 PolarHBondContact O-N 3.33Å; E695-K698 PolarHBondContact O-N 2.94Å; E695-K698 IonicContact OE1-NZ 3.45Å; E695-K698 PolarHBondContact OE1-NZ 3Å; E695-I699 VanDerWaalsContact O-CG1 3.28Å; E695-I699 WeakPolarHBondContact O-CG1 3.41Å; E695-I699 PolarHBondContact O-N 3.21Å
696	R	90.6	Very high	88	Confident	4 Å²	4	29.4 Å²	29.4	2%	0.015	15%	0.146	C	C	.	.	H	α-helix	trans	-64.5	-38.2	173.9	-71.8	-174.5	-77.4	112.9	0.9	112.4	L684 P688 V691 P692 F693 I699 F700 M952 F953 E957	L684-R696 HydrophobicContact CD2-CG 4.38Å; P688-R696 VanDerWaalsContact O-CD 3.27Å; P688-R696 WeakPolarHBondContact O-CD 3.26Å; P688-R696 PolarHBondContact O-NE 3.36Å; P688-R696 VanDerWaalsContact O-NE 3.12Å; V691-R696 HydrophobicContact CB-CG 3.98Å; V691-R696 HydrophobicContact CG1-CG 3.87Å; V691-R696 PolarHBondContact O-NE 2.8Å; V691-R696 PolarHBondContact O-NH2 3.19Å; P692-R696 PolarHBondContact O-N 3.28Å; P692-R696 VanDerWaalsContact O-N 3.14Å; F693-R696 PolarHBondContact O-N 3.03Å; F693-R696 VanDerWaalsContact O-N 3.13Å; R696-I699 WeakPolarHBondContact O-CB 3.3Å; R696-I699 PolarHBondContact O-N 3.46Å; R696-F700 WeakPolarHBondContact O-CB 3.1Å; R696-F700 PolarHBondContact O-N 3.5Å; R696-M952 WeakPolarHBondContact CD-O 3.48Å; R696-M952 PolarHBondContact NH1-O 3.43Å; R696-F953 HydrophobicContact CB-CD1 4.5Å; R696-F953 HydrophobicContact CB-CE1 3.67Å; R696-F953 HydrophobicContact CB-CZ 4.07Å; R696-F953 VanDerWaalsContact NH1-CD1 3.26Å; R696-F953 WeakPolarHBondContact O-CZ 3.25Å; R696-E957 IonicContact CZ-OE1 2.75Å; R696-E957 IonicContact CZ-OE2 2.78Å; R696-E957 IonicContact NH1-OE1 3.83Å; R696-E957 PolarHBondContact NH1-OE1 2.7Å; R696-E957 IonicContact NH1-OE2 3.96Å; R696-E957 PolarHBondContact NH1-OE2 3Å; R696-E957 IonicContact NH2-OE1 3.79Å; R696-E957 PolarHBondContact NH2-OE1 2.78Å; R696-E957 IonicContact NH2-OE2 3.65Å; R696-E957 PolarHBondContact NH2-OE2 3.49Å
697	V	89.6	Confident	88.1	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.024	14%	0.136	C	C	.	.	H	α-helix	trans	-62.9	-44.7	173.3	176.5	0	0	0	0	111.2	F693 E694 I699 F700 Q701 F953 L961 L1021 L1022	F693-V697 HydrophobicContact CD2-CG2 3.9Å; F693-V697 HydrophobicContact CE1-CG2 4.49Å; F693-V697 HydrophobicContact CE2-CG2 3.5Å; F693-V697 VanDerWaalsContact CE2-CG2 3.5Å; F693-V697 HydrophobicContact CZ-CG2 3.84Å; F693-V697 WeakPolarHBondContact O-CG2 3.42Å; F693-V697 PolarHBondContact O-N 2.92Å; E694-V697 PolarHBondContact O-N 3.45Å; V697-I699 VanDerWaalsContact C-N 3.32Å; V697-I699 PolarHBondContact O-N 3.06Å; V697-F700 WeakPolarHBondContact O-CB 3.34Å; V697-F700 PolarHBondContact O-N 3.14Å; V697-Q701 HydrophobicContact CG1-CG 4.29Å; V697-Q701 WeakPolarHBondContact O-CG 3.36Å; V697-Q701 PolarHBondContact O-N 3.45Å; V697-F953 HydrophobicContact CG2-CE1 3.82Å; V697-F953 HydrophobicContact CG2-CZ 4.28Å; V697-L961 HydrophobicContact CB-CD2 4.47Å; V697-L961 HydrophobicContact CG1-CD2 4.03Å; V697-L961 HydrophobicContact CG2-CD2 3.75Å; V697-L1021 HydrophobicContact CB-CD2 4.12Å; V697-L1021 HydrophobicContact CG1-CD2 4.37Å; V697-L1021 HydrophobicContact CG2-CD2 3.51Å; V697-L1022 HydrophobicContact CG1-CD1 4.24Å; V697-L1022 HydrophobicContact CG1-CG 4.5Å
698	K	88.1	Confident	87.9	Confident	64 Å²	64	29 Å²	29	28%	0.278	14%	0.143	S	C	.	.	H	α-helix	trans	-60.3	-40.6	174.6	-68.6	172.4	-165.3	167	0	112.1	A634 E694 E695 R702 L1022	A634-K698 HydrophobicContact CB-CB 3.56Å; E694-K698 WeakPolarHBondContact O-CG 3.19Å; E694-K698 PolarHBondContact O-N 3.31Å; E695-K698 PolarHBondContact O-N 2.94Å; E695-K698 IonicContact OE1-NZ 3.45Å; E695-K698 PolarHBondContact OE1-NZ 3Å; K698-R702 WeakPolarHBondContact O-CB 3.48Å; K698-R702 WeakPolarHBondContact O-CD 3.29Å; K698-R702 WeakPolarHBondContact O-CG 3.38Å; K698-R702 PolarHBondContact O-N 2.98Å; K698-R702 VanDerWaalsContact O-N 3.15Å; K698-L1022 HydrophobicContact CG-CD1 3.66Å; K698-L1022 HydrophobicContact CG-CD2 4.32Å
699	I	87.9	Confident	87.5	Confident	1 Å²	1	35 Å²	35	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-59.6	-53.4	174	-68	163.4	0	0	0	109.2	I632 A634 V637 L684 E695 R696 V697 Q701 R702 L703 M952	I632-I699 HydrophobicContact CG2-CD1 3.94Å; A634-I699 HydrophobicContact CB-CG1 3.87Å; V637-I699 HydrophobicContact CB-CD1 4.49Å; V637-I699 HydrophobicContact CB-CG1 4.29Å; V637-I699 HydrophobicContact CB-CG2 4.48Å; V637-I699 HydrophobicContact CG1-CD1 4.27Å; V637-I699 HydrophobicContact CG1-CG1 4.24Å; V637-I699 HydrophobicContact CG1-CG2 3.69Å; V637-I699 HydrophobicContact CG2-CD1 4.25Å; V637-I699 HydrophobicContact CG2-CG1 4.48Å; L684-I699 HydrophobicContact CD1-CD1 4.29Å; L684-I699 HydrophobicContact CD2-CD1 4.19Å; E695-I699 VanDerWaalsContact O-CG1 3.28Å; E695-I699 WeakPolarHBondContact O-CG1 3.41Å; E695-I699 PolarHBondContact O-N 3.21Å; R696-I699 WeakPolarHBondContact O-CB 3.3Å; R696-I699 PolarHBondContact O-N 3.46Å; V697-I699 VanDerWaalsContact C-N 3.32Å; V697-I699 PolarHBondContact O-N 3.06Å; I699-Q701 PolarHBondContact O-N 2.82Å; I699-R702 PolarHBondContact O-N 3.5Å; I699-L703 HydrophobicContact CG2-CD1 4.04Å; I699-L703 HydrophobicContact CG2-CG 4.31Å; I699-L703 VanDerWaalsContact O-CG 3.32Å; I699-L703 WeakPolarHBondContact O-CG 3.48Å; I699-L703 PolarHBondContact O-N 3.33Å; I699-M952 HydrophobicContact CG2-CE 4.05Å; I699-M952 HydrophobicContact CG2-SD 4.17Å
700	F	88.8	Confident	87.1	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.018	18%	0.183	C	C	.	.	H	α-helix	trans	-55.3	-50.1	-179.9	176.7	-105.2	0	0	0	113.1	R696 V697 R702 L703 I704 V945 W949 L950 M952 F953	R696-F700 WeakPolarHBondContact O-CB 3.1Å; R696-F700 PolarHBondContact O-N 3.5Å; V697-F700 WeakPolarHBondContact O-CB 3.34Å; V697-F700 PolarHBondContact O-N 3.14Å; F700-R702 VanDerWaalsContact C-N 3.28Å; F700-R702 PolarHBondContact O-N 2.89Å; F700-L703 WeakPolarHBondContact O-CB 3.45Å; F700-L703 PolarHBondContact O-N 3.08Å; F700-I704 HydrophobicContact CD1-CD1 3.94Å; F700-I704 HydrophobicContact CE1-CD1 3.34Å; F700-I704 HydrophobicContact CE2-CD1 3.99Å; F700-I704 HydrophobicContact CG-CD1 4.5Å; F700-I704 HydrophobicContact CZ-CD1 3.38Å; F700-I704 HydrophobicContact CZ-CG1 4.35Å; F700-I704 PolarHBondContact O-N 3.07Å; F700-V945 HydrophobicContact CE2-CG1 3.95Å; F700-V945 HydrophobicContact CZ-CG1 4.12Å; F700-W949 HydrophobicContact CD2-CB 3.83Å; F700-W949 HydrophobicContact CE2-CB 4.02Å; F700-W949 HydrophobicContact CE2-CE3 4.46Å; F700-L950 HydrophobicContact CD2-CD2 4.48Å; F700-L950 HydrophobicContact CE2-CD2 3.6Å; F700-L950 HydrophobicContact CE2-CG 4.35Å; F700-L950 HydrophobicContact CZ-CD2 3.74Å; F700-M952 HydrophobicContact CB-CE 4.24Å; F700-F953 HydrophobicContact CB-CE2 3.91Å; F700-F953 HydrophobicContact CB-CZ 3.79Å; F700-F953 HydrophobicContact CD2-CE2 4.09Å; F700-F953 AromaticContact CG-CE2 3.99Å; F700-F953 HydrophobicContact CG-CE2 3.99Å; F700-F953 HydrophobicContact CG-CZ 4.28Å
701	Q	87.9	Confident	86.6	Confident	35 Å²	35	40.9 Å²	40.9	16%	0.164	20%	0.199	C	C	.	.	H	α-helix	trans	-60.3	-37.3	178.8	-73.1	175.3	-28.9	0	0	112.6	V697 I699 S705	V697-Q701 HydrophobicContact CG1-CG 4.29Å; V697-Q701 WeakPolarHBondContact O-CG 3.36Å; V697-Q701 PolarHBondContact O-N 3.45Å; I699-Q701 PolarHBondContact O-N 2.82Å; Q701-S705 WeakPolarHBondContact O-CB 3.44Å; Q701-S705 PolarHBondContact O-N 3.42Å; Q701-S705 PolarHBondContact O-OG 3.28Å
702	R	85.9	Confident	85.9	Confident	78 Å²	78	41.7 Å²	41.7	29%	0.294	20%	0.203	S	C	.	.	H	α-helix	trans	-72.6	-36.3	177	-69.8	171.1	-174.2	-140.2	0.7	112.7	A634 D635 T638 K698 I699 F700 I704 S705 V706	A634-R702 PolarHBondContact O-NH1 3.09Å; A634-R702 VanDerWaalsContact O-NH1 3.08Å; D635-R702 IonicContact OD1-CZ 2.65Å; D635-R702 IonicContact OD1-NH1 3.65Å; D635-R702 PolarHBondContact OD1-NH1 3.3Å; D635-R702 IonicContact OD1-NH2 3.48Å; D635-R702 PolarHBondContact OD1-NH2 3.41Å; T638-R702 HydrophobicContact CG2-CB 3.46Å; T638-R702 VanDerWaalsContact CG2-CB 3.46Å; T638-R702 HydrophobicContact CG2-CG 4.31Å; K698-R702 WeakPolarHBondContact O-CB 3.48Å; K698-R702 WeakPolarHBondContact O-CD 3.29Å; K698-R702 WeakPolarHBondContact O-CG 3.38Å; K698-R702 PolarHBondContact O-N 2.98Å; K698-R702 VanDerWaalsContact O-N 3.15Å; I699-R702 PolarHBondContact O-N 3.5Å; F700-R702 VanDerWaalsContact C-N 3.28Å; F700-R702 PolarHBondContact O-N 2.89Å; R702-I704 VanDerWaalsContact C-N 3.32Å; R702-S705 PolarHBondContact O-N 3.01Å; R702-S705 VanDerWaalsContact O-N 3.16Å; R702-V706 WeakPolarHBondContact O-CG2 3.06Å; R702-V706 PolarHBondContact O-N 3.14Å
703	L	85.9	Confident	84.8	Confident	6 Å²	6	40.7 Å²	40.7	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-45.7	173.7	-67.7	179	0	0	0	110.8	Y641 I699 F700 S705 V706 D707 W949 M952	Y641-L703 HydrophobicContact CD1-CD1 4.12Å; Y641-L703 HydrophobicContact CD1-CD2 4.45Å; Y641-L703 HydrophobicContact CD2-CD1 4Å; Y641-L703 HydrophobicContact CD2-CD2 3.75Å; Y641-L703 HydrophobicContact CE1-CD1 4.24Å; Y641-L703 HydrophobicContact CE2-CD1 4.18Å; Y641-L703 HydrophobicContact CG-CD1 3.96Å; Y641-L703 HydrophobicContact CG-CD2 3.62Å; Y641-L703 HydrophobicContact CG-CG 4.45Å; I699-L703 HydrophobicContact CG2-CD1 4.04Å; I699-L703 HydrophobicContact CG2-CG 4.31Å; I699-L703 VanDerWaalsContact O-CG 3.32Å; I699-L703 WeakPolarHBondContact O-CG 3.48Å; I699-L703 PolarHBondContact O-N 3.33Å; F700-L703 WeakPolarHBondContact O-CB 3.45Å; F700-L703 PolarHBondContact O-N 3.08Å; L703-S705 VanDerWaalsContact C-N 3.34Å; L703-S705 PolarHBondContact O-N 2.66Å; L703-V706 PolarHBondContact O-N 2.71Å; L703-D707 WeakPolarHBondContact O-CB 3.44Å; L703-D707 PolarHBondContact O-N 3.15Å; L703-W949 HydrophobicContact CB-CD2 4.12Å; L703-W949 HydrophobicContact CB-CE3 4.26Å; L703-W949 HydrophobicContact CB-CH2 4.41Å; L703-W949 HydrophobicContact CB-CZ2 4.26Å; L703-W949 HydrophobicContact CB-CZ3 4.41Å; L703-W949 HydrophobicContact CD1-CB 4.41Å; L703-W949 HydrophobicContact CD1-CD2 4.14Å; L703-W949 HydrophobicContact CD1-CG 3.86Å; L703-M952 HydrophobicContact CD1-CE 4.4Å
704	I	87.1	Confident	83.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-45.8	171.3	-72	173.1	0	0	0	111	F700 R702 V706 D707 K708 Y828 W949	F700-I704 HydrophobicContact CD1-CD1 3.94Å; F700-I704 HydrophobicContact CE1-CD1 3.34Å; F700-I704 HydrophobicContact CE2-CD1 3.99Å; F700-I704 HydrophobicContact CG-CD1 4.5Å; F700-I704 HydrophobicContact CZ-CD1 3.38Å; F700-I704 HydrophobicContact CZ-CG1 4.35Å; F700-I704 PolarHBondContact O-N 3.07Å; R702-I704 VanDerWaalsContact C-N 3.32Å; I704-V706 VanDerWaalsContact C-N 3.33Å; I704-V706 PolarHBondContact O-N 3.23Å; I704-D707 PolarHBondContact O-N 3.5Å; I704-K708 HydrophobicContact CG2-CD 4.11Å; I704-K708 HydrophobicContact CG2-CG 4.28Å; I704-K708 WeakPolarHBondContact O-CB 3.36Å; I704-K708 WeakPolarHBondContact O-CG 3.45Å; I704-K708 PolarHBondContact O-N 3.09Å; I704-Y828 HydrophobicContact CG1-CD2 4.37Å; I704-Y828 HydrophobicContact CG2-CD2 4Å; I704-Y828 HydrophobicContact CG2-CE2 4.19Å; I704-Y828 HydrophobicContact CG2-CG 4.37Å; I704-Y828 WeakPolarHBondContact CG2-O 3.41Å; I704-W949 HydrophobicContact CG1-CE3 4.33Å; I704-W949 HydrophobicContact CG1-CZ3 4.07Å
705	S	84.9	Confident	81.5	Confident	50 Å²	50	43 Å²	43	35%	0.35	23%	0.229	S	C	.	.	H	α-helix	trans	-63.3	-37.5	-178.1	-58.4	0	0	0	0	112.8	Q701 R702 L703 R709	Q701-S705 WeakPolarHBondContact O-CB 3.44Å; Q701-S705 PolarHBondContact O-N 3.42Å; Q701-S705 PolarHBondContact O-OG 3.28Å; R702-S705 PolarHBondContact O-N 3.01Å; R702-S705 VanDerWaalsContact O-N 3.16Å; L703-S705 VanDerWaalsContact C-N 3.34Å; L703-S705 PolarHBondContact O-N 2.66Å; S705-R709 WeakPolarHBondContact O-CG 3.48Å; S705-R709 PolarHBondContact O-N 3.47Å; S705-R709 VanDerWaalsContact O-N 3.15Å
706	V	83.1	Confident	79.8	Confident	26 Å²	26	46.3 Å²	46.3	16%	0.158	25%	0.254	C	S	.	.	H	α-helix	trans	-65.7	-50.5	173.6	172.7	0	0	0	0	110.1	T638 R702 L703 I704 K708 R709 D710	T638-V706 HydrophobicContact CG2-CG2 4.43Å; R702-V706 WeakPolarHBondContact O-CG2 3.06Å; R702-V706 PolarHBondContact O-N 3.14Å; L703-V706 PolarHBondContact O-N 2.71Å; I704-V706 VanDerWaalsContact C-N 3.33Å; I704-V706 PolarHBondContact O-N 3.23Å; V706-K708 VanDerWaalsContact C-N 3.27Å; V706-K708 PolarHBondContact O-N 3.33Å; V706-R709 PolarHBondContact O-N 3.39Å; V706-R709 VanDerWaalsContact O-N 3.09Å; V706-D710 PolarHBondContact O-N 2.92Å
707	D	84.2	Confident	78	Confident	11 Å²	11	55.2 Å²	55.2	6%	0.059	29%	0.293	C	S	.	.	H	α-helix	trans	-60.4	-36.8	178.8	-171	86.9	0	0	0	111.9	L703 I704 D710 V711 K747 Y828 W949	L703-D707 WeakPolarHBondContact O-CB 3.44Å; L703-D707 PolarHBondContact O-N 3.15Å; I704-D707 PolarHBondContact O-N 3.5Å; D707-D710 PolarHBondContact O-N 3.11Å; D707-V711 WeakPolarHBondContact O-CB 3.22Å; D707-V711 VanDerWaalsContact O-CG2 3.32Å; D707-V711 WeakPolarHBondContact O-CG2 3.36Å; D707-V711 PolarHBondContact O-N 2.96Å; D707-K747 IonicContact OD1-NZ 2.74Å; D707-K747 PolarHBondContact OD1-NZ 2.99Å; D707-K747 IonicContact OD2-NZ 2.93Å; D707-K747 PolarHBondContact OD2-NZ 2.84Å; D707-Y828 HydrophobicContact CB-CE2 4.46Å; D707-Y828 VanDerWaalsContact OD2-CE2 3.28Å; D707-Y828 WeakPolarHBondContact OD2-CE2 3.49Å; D707-Y828 PolarHBondContact OD2-OH 3.14Å; D707-W949 HydrophobicContact CB-CH2 3.93Å
708	K	84.3	Confident	76.4	Confident	34 Å²	34	57.3 Å²	57.3	15%	0.148	31%	0.307	C	S	.	.	H	α-helix	trans	-62.1	-43.8	173.1	-81.9	-174.9	179.6	-176.3	0	112.7	I704 V706 D710 V711 Q712 Y828 E829	I704-K708 HydrophobicContact CG2-CD 4.11Å; I704-K708 HydrophobicContact CG2-CG 4.28Å; I704-K708 WeakPolarHBondContact O-CB 3.36Å; I704-K708 WeakPolarHBondContact O-CG 3.45Å; I704-K708 PolarHBondContact O-N 3.09Å; V706-K708 VanDerWaalsContact C-N 3.27Å; V706-K708 PolarHBondContact O-N 3.33Å; K708-D710 VanDerWaalsContact C-N 3.31Å; K708-V711 PolarHBondContact O-N 3.41Å; K708-Q712 WeakPolarHBondContact O-CA 3.41Å; K708-Q712 WeakPolarHBondContact O-CB 3.33Å; K708-Q712 WeakPolarHBondContact O-CG 3.35Å; K708-Q712 PolarHBondContact O-N 3.13Å; K708-Y828 WeakPolarHBondContact CA-OH 3.34Å; K708-Y828 HydrophobicContact CD-CE1 4.13Å; K708-Y828 WeakPolarHBondContact CE-O 3.48Å; K708-Y828 HydrophobicContact CG-CD1 4.24Å; K708-Y828 HydrophobicContact CG-CE1 3.4Å; K708-Y828 HydrophobicContact CG-CE2 4.31Å; K708-Y828 VanDerWaalsContact CG-CZ 3.45Å; K708-Y828 WeakPolarHBondContact CG-OH 3.26Å; K708-Y828 PolarHBondContact N-OH 2.85Å; K708-Y828 PolarHBondContact NZ-O 2.75Å; K708-E829 WeakPolarHBondContact CE-OE2 3.41Å; K708-E829 IonicContact NZ-OE2 2.63Å; K708-E829 PolarHBondContact NZ-OE2 3.33Å
709	R	81.5	Confident	75.2	Confident	143 Å²	143	61.3 Å²	61.3	54%	0.54	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-40.5	177.3	-75.3	-174.6	-62.6	-142.9	0.2	111.3	S705 V706 G713	S705-R709 WeakPolarHBondContact O-CG 3.48Å; S705-R709 PolarHBondContact O-N 3.47Å; S705-R709 VanDerWaalsContact O-N 3.15Å; V706-R709 PolarHBondContact O-N 3.39Å; V706-R709 VanDerWaalsContact O-N 3.09Å; R709-G713 WeakPolarHBondContact O-CA 3.48Å; R709-G713 PolarHBondContact O-N 3.47Å
710	D	80.4	Confident	74.4	Confident	97 Å²	97	62.6 Å²	62.6	52%	0.519	35%	0.345	S	S	.	.	H	α-helix	trans	-66.5	-39.6	178.9	-67.1	-11.2	0	0	0	112.2	V706 D707 K708	V706-D710 PolarHBondContact O-N 2.92Å; D707-D710 PolarHBondContact O-N 3.11Å; K708-D710 VanDerWaalsContact C-N 3.31Å
711	V	79.8	Confident	74.2	Confident	54 Å²	54	62.6 Å²	62.6	33%	0.327	35%	0.345	S	S	.	.	H	α-helix	trans	-87.6	-41.4	-176.4	176.4	0	0	0	0	113.1	D707 K708 K747	D707-V711 WeakPolarHBondContact O-CB 3.22Å; D707-V711 VanDerWaalsContact O-CG2 3.32Å; D707-V711 WeakPolarHBondContact O-CG2 3.36Å; D707-V711 PolarHBondContact O-N 2.96Å; K708-V711 PolarHBondContact O-N 3.41Å; V711-K747 HydrophobicContact CG1-CB 3.91Å; V711-K747 HydrophobicContact CG2-CD 4.23Å
712	Q	77.3	Confident	74.1	Confident	18 Å²	18	65.8 Å²	65.8	8%	0.084	36%	0.363	C	S	.	.	H	α-helix	trans	-93.5	-17.2	-174.2	-55.1	-177.2	1.8	0	0	113.1	K708 P718 K747 R749	K708-Q712 WeakPolarHBondContact O-CA 3.41Å; K708-Q712 WeakPolarHBondContact O-CB 3.33Å; K708-Q712 WeakPolarHBondContact O-CG 3.35Å; K708-Q712 PolarHBondContact O-N 3.13Å; Q712-P718 VanDerWaalsContact O-CB 3.22Å; Q712-P718 WeakPolarHBondContact O-CB 3.36Å; Q712-P718 WeakPolarHBondContact O-CG 3.28Å; Q712-K747 PolarHBondContact NE2-O 3.35Å; Q712-R749 HydrophobicContact CG-CG 4.29Å; Q712-R749 VanDerWaalsContact OE1-CG 3.3Å
713	G	66.9	Low	74.1	Confident	33 Å²	33	62.4 Å²	62.4	34%	0.34	35%	0.351	S	S	.	.			trans	68.7	166.4	-177.3	0	0	0	0	0	114.7	R709	R709-G713 WeakPolarHBondContact O-CA 3.48Å; R709-G713 PolarHBondContact O-N 3.47Å
714	D	56.4	Low	74.2	Confident	158 Å²	158	64.8 Å²	64.8	85%	0.845	37%	0.366	S	S	*	.	S	Bend	trans	-91.7	-0.1	176.6	-98.2	-11.4	0	0	0	113.2
715	G	53.7	Low	74.2	Confident	39 Å²	39	64.8 Å²	64.8	40%	0.402	37%	0.366	S	S	.	.	S	Bend	trans	-78.6	150.8	-176.8	0	0	0	0	0	113.5	F717 P718	G715-F717 PolarHBondContact O-N 3.01Å; G715-P718 WeakPolarHBondContact O-CD 3.48Å
716	P	51.9	Low	74.3	Confident	114 Å²	114	67.6 Å²	67.6	74%	0.74	37%	0.369	S	S	*	.	S	Bend	trans	-69.3	-11.4	178.8	23.9	-29.4	0	0	0	114.5
717	F	53.3	Low	74.3	Confident	191 Å²	191	69.7 Å²	69.7	84%	0.838	37%	0.374	S	S	*	.			trans	-138	76.4	-179.9	-60.8	-81.9	0	0	0	113.4	G715	G715-F717 PolarHBondContact O-N 3.01Å
718	P	56	Low	74.3	Confident	48 Å²	48	74.7 Å²	74.7	31%	0.312	40%	0.401	S	S	.	.			trans	-86.8	149	163.1	4.8	15.2	0	0	0	110.7	Q712 G715 G720	Q712-P718 VanDerWaalsContact O-CB 3.22Å; Q712-P718 WeakPolarHBondContact O-CB 3.36Å; Q712-P718 WeakPolarHBondContact O-CG 3.28Å; G715-P718 WeakPolarHBondContact O-CD 3.48Å; P718-G720 PolarHBondContact O-N 3.31Å; P718-G720 VanDerWaalsContact O-N 3.09Å
719	D	61.5	Low	74.5	Confident	148 Å²	148	78.5 Å²	78.5	79%	0.791	42%	0.415	S	S	*	.			trans	-53.8	109.9	169.1	-91.9	-22.9	0	0	0	110.4
720	G	72.6	Confident	74.9	Confident	28 Å²	28	72.4 Å²	72.4	29%	0.289	39%	0.393	S	S	.	.			trans	-105	154.6	175.5	0	0	0	0	0	111.7	P718 N722 R749	P718-G720 PolarHBondContact O-N 3.31Å; P718-G720 VanDerWaalsContact O-N 3.09Å; G720-N722 PolarHBondContact O-N 3.26Å; G720-R749 CarbonylContact C-O 3.56Å; G720-R749 VanDerWaalsContact CA-O 3.27Å; G720-R749 WeakPolarHBondContact CA-O 3.4Å
721	I	83.4	Confident	75.4	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.021	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	120.2	174.8	-60.4	172.8	0	0	0	107.6	V723 L738 E743 L746 K748 R749 I750 R751	I721-V723 HydrophobicContact CG2-CG1 3.99Å; I721-L738 HydrophobicContact CG2-CD2 3.98Å; I721-E743 HydrophobicContact CD1-CB 4.28Å; I721-E743 HydrophobicContact CD1-CG 4.27Å; I721-E743 HydrophobicContact CG1-CG 4.47Å; I721-E743 HydrophobicContact CG2-CG 3.93Å; I721-L746 HydrophobicContact CD1-CD1 4.48Å; I721-K748 HydrophobicContact CD1-CB 4.15Å; I721-K748 HydrophobicContact CG1-CB 4.13Å; I721-R749 PolarHBondContact N-O 3.03Å; I721-I750 HydrophobicContact CB-CG1 4.19Å; I721-I750 HydrophobicContact CD1-CG1 4.16Å; I721-I750 HydrophobicContact CG2-CG2 4.5Å; I721-I750 CarbonylContact O-C 3.57Å; I721-I750 WeakPolarHBondContact O-CA 3.36Å; I721-R751 PolarHBondContact O-N 2.98Å
722	N	85.1	Confident	75.8	Confident	102 Å²	102	70.9 Å²	70.9	55%	0.545	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	117.5	176.2	-64.8	-33.3	0	0	0	109.3	G720 R751	G720-N722 PolarHBondContact O-N 3.26Å; N722-R751 WeakPolarHBondContact CA-O 3.17Å; N722-R751 WeakPolarHBondContact OD1-CB 3.41Å
723	V	87.4	Confident	76.5	Confident	7 Å²	7	70.8 Å²	70.8	4%	0.042	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	142.6	178.2	-68.2	0	0	0	0	111.5	I721 I725 K737 L738 I750 R751 V752 H753	I721-V723 HydrophobicContact CG2-CG1 3.99Å; V723-I725 HydrophobicContact CB-CD1 4.46Å; V723-I725 HydrophobicContact CG2-CG1 4.27Å; V723-K737 HydrophobicContact CB-CD 4.47Å; V723-K737 HydrophobicContact CG1-CB 3.98Å; V723-L738 HydrophobicContact CG1-CD2 3.8Å; V723-L738 HydrophobicContact CG1-CG 4.36Å; V723-I750 HydrophobicContact CG2-CG2 4.1Å; V723-R751 PolarHBondContact N-O 3.41Å; V723-V752 HydrophobicContact CG2-CB 4.41Å; V723-V752 HydrophobicContact CG2-CG1 4.38Å; V723-V752 HydrophobicContact CG2-CG2 3.92Å; V723-V752 CarbonylContact O-C 3.31Å; V723-V752 WeakPolarHBondContact O-CA 3.5Å; V723-H753 PolarHBondContact O-N 2.9Å
724	T	87.4	Confident	77.7	Confident	55 Å²	55	69.2 Å²	69.2	34%	0.337	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.4	172.2	-50.7	0	0	0	0	108.5	K737 H753 L755	T724-K737 WeakPolarHBondContact O-CD 3.42Å; T724-K737 WeakPolarHBondContact O-CE 3.28Å; T724-K737 PolarHBondContact O-NZ 3.34Å; T724-H753 CarbonylContact C-O 3.48Å; T724-H753 VanDerWaalsContact CA-O 3.27Å; T724-H753 WeakPolarHBondContact CA-O 3.31Å; T724-H753 HydrophobicContact CG2-CB 4.33Å; T724-L755 HydrophobicContact CG2-CD1 3.59Å; T724-L755 HydrophobicContact CG2-CD2 4.22Å; T724-L755 HydrophobicContact CG2-CG 3.68Å
725	I	88.2	Confident	79.3	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	133.1	-172.2	-59.1	-67.1	0	0	0	109.4	V723 I730 D733 A734 K737 V752 H753 L754 L755 F774	V723-I725 HydrophobicContact CB-CD1 4.46Å; V723-I725 HydrophobicContact CG2-CG1 4.27Å; I725-I730 HydrophobicContact CG2-CB 4.29Å; I725-I730 HydrophobicContact CG2-CG1 3.89Å; I725-D733 HydrophobicContact CD1-CB 3.79Å; I725-D733 HydrophobicContact CG2-CB 4.25Å; I725-A734 HydrophobicContact CD1-CB 4.4Å; I725-K737 HydrophobicContact CD1-CD 4.29Å; I725-V752 HydrophobicContact CB-CG1 4.44Å; I725-V752 HydrophobicContact CG1-CG1 4.07Å; I725-H753 PolarHBondContact N-O 2.91Å; I725-L754 HydrophobicContact CB-CD2 4.1Å; I725-L754 HydrophobicContact CG2-CD2 4.26Å; I725-L754 CarbonylContact O-C 3.59Å; I725-L754 WeakPolarHBondContact O-CA 3.43Å; I725-L755 PolarHBondContact O-N 3.48Å; I725-F774 HydrophobicContact CB-CD2 4.41Å; I725-F774 HydrophobicContact CB-CE2 4.23Å; I725-F774 HydrophobicContact CD1-CE2 4.05Å; I725-F774 HydrophobicContact CD1-CZ 4.29Å; I725-F774 HydrophobicContact CG1-CD2 4.15Å; I725-F774 HydrophobicContact CG1-CE2 3.65Å; I725-F774 HydrophobicContact CG1-CZ 4.14Å; I725-F774 HydrophobicContact CG2-CD2 4.1Å; I725-F774 HydrophobicContact CG2-CE2 3.86Å
726	R	86.6	Confident	81.1	Confident	109 Å²	109	67 Å²	67	41%	0.411	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	131.2	174	-61.1	172.4	-65.9	165.3	2.8	110.1	N728 Y729 I730 D733 L755	R726-N728 VanDerWaalsContact C-N 3.27Å; R726-N728 PolarHBondContact O-N 3.01Å; R726-Y729 HydrophobicContact CB-CD2 4.41Å; R726-Y729 CarbonylContact O-C 3.53Å; R726-Y729 VanDerWaalsContact O-C 3.32Å; R726-Y729 PolarHBondContact O-N 3.07Å; R726-I730 PolarHBondContact O-N 2.99Å; R726-D733 VanDerWaalsContact CB-OD2 3.29Å; R726-D733 WeakPolarHBondContact CB-OD2 3.35Å; R726-D733 VanDerWaalsContact CG-OD2 3.31Å; R726-D733 WeakPolarHBondContact CG-OD2 3.45Å; R726-D733 IonicContact CZ-OD1 3.87Å; R726-D733 IonicContact CZ-OD2 3.96Å; R726-D733 PolarHBondContact N-OD2 3.16Å; R726-D733 IonicContact NE-OD1 2.79Å; R726-D733 PolarHBondContact NE-OD1 3.46Å; R726-D733 IonicContact NE-OD2 3.71Å; R726-D733 PolarHBondContact NE-OD2 2.96Å; R726-D733 IonicContact NH2-OD1 2.74Å; R726-D733 PolarHBondContact NH2-OD1 3.3Å; R726-D733 IonicContact NH2-OD2 2.98Å; R726-L755 HydrophobicContact CG-CB 4.31Å; R726-L755 HydrophobicContact CG-CD1 4.11Å
727	R	82.6	Confident	82.8	Confident	70 Å²	70	65 Å²	65	26%	0.264	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-56.8	-36.7	-175.4	-163.2	170.7	-165.5	125.4	12.2	114.1	Y729 I730 L755 E762 E773 E777	R727-Y729 VanDerWaalsContact C-N 3.33Å; R727-Y729 PolarHBondContact O-N 2.91Å; R727-I730 HydrophobicContact CG-CD1 4.33Å; R727-I730 VanDerWaalsContact O-CD1 3.25Å; R727-I730 WeakPolarHBondContact O-CD1 3.47Å; R727-I730 VanDerWaalsContact O-CG1 3.29Å; R727-I730 WeakPolarHBondContact O-CG1 3.15Å; R727-L755 PolarHBondContact N-O 3.46Å; R727-E762 IonicContact CZ-OE1 3.1Å; R727-E762 IonicContact NH1-OE1 2.7Å; R727-E762 PolarHBondContact NH1-OE1 3.26Å; R727-E762 IonicContact NH1-OE2 2.99Å; R727-E762 PolarHBondContact NH1-OE2 3.41Å; R727-E773 IonicContact CZ-OE1 3.9Å; R727-E773 IonicContact NH1-OE1 3.56Å; R727-E773 IonicContact NH2-OE1 3.73Å; R727-E773 PolarHBondContact NH2-OE1 3.33Å; R727-E777 IonicContact NH2-OE1 2.73Å; R727-E777 PolarHBondContact NH2-OE1 3.42Å
728	N	85	Confident	84.6	Confident	117 Å²	117	56 Å²	56	63%	0.626	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-80	-12.8	179.8	-65.3	-15.8	0	0	0	114.1	R726	R726-N728 VanDerWaalsContact C-N 3.27Å; R726-N728 PolarHBondContact O-N 3.01Å
729	Y	87.1	Confident	86	Confident	114 Å²	114	54.2 Å²	54.2	45%	0.447	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-129.4	36.5	-176.3	-62.3	-83	0	0	0	111.1	R726 R727 Y731 E732 D733	R726-Y729 HydrophobicContact CB-CD2 4.41Å; R726-Y729 CarbonylContact O-C 3.53Å; R726-Y729 VanDerWaalsContact O-C 3.32Å; R726-Y729 PolarHBondContact O-N 3.07Å; R727-Y729 VanDerWaalsContact C-N 3.33Å; R727-Y729 PolarHBondContact O-N 2.91Å; Y729-Y731 PolarHBondContact O-N 3.3Å; Y729-E732 WeakPolarHBondContact CA-OE2 3.31Å; Y729-E732 WeakPolarHBondContact CB-OE2 3.31Å; Y729-E732 PolarHBondContact O-N 2.65Å; Y729-D733 VanDerWaalsContact O-CB 3.29Å; Y729-D733 WeakPolarHBondContact O-CB 3.42Å; Y729-D733 PolarHBondContact O-N 3.35Å
730	I	89.7	Confident	87.1	Confident	14 Å²	14	49.8 Å²	49.8	7%	0.072	25%	0.246	C	C	.	.	H	α-helix	trans	-56.4	-41.5	-174.7	-76.7	165.7	0	0	0	111.3	I725 R726 R727 A734 F774 E777 L778	I725-I730 HydrophobicContact CG2-CB 4.29Å; I725-I730 HydrophobicContact CG2-CG1 3.89Å; R726-I730 PolarHBondContact O-N 2.99Å; R727-I730 HydrophobicContact CG-CD1 4.33Å; R727-I730 VanDerWaalsContact O-CD1 3.25Å; R727-I730 WeakPolarHBondContact O-CD1 3.47Å; R727-I730 VanDerWaalsContact O-CG1 3.29Å; R727-I730 WeakPolarHBondContact O-CG1 3.15Å; I730-A734 WeakPolarHBondContact O-CB 3.39Å; I730-A734 PolarHBondContact O-N 3.2Å; I730-A734 VanDerWaalsContact O-N 3.1Å; I730-F774 HydrophobicContact CG2-CD2 4.16Å; I730-F774 HydrophobicContact CG2-CE2 4.06Å; I730-E777 HydrophobicContact CD1-CB 4.13Å; I730-E777 WeakPolarHBondContact CD1-OE2 3.49Å; I730-L778 HydrophobicContact CG2-CB 3.98Å; I730-L778 HydrophobicContact CG2-CD1 4.15Å
731	Y	90.9	Very high	87.6	Confident	16 Å²	16	55.5 Å²	55.5	6%	0.063	27%	0.266	C	S	.	.	H	α-helix	trans	-72	-48.8	-177.2	-173.9	-91.6	0	0	0	111.8	Y729 A734 Y735 L778 F789 H815 L819	Y729-Y731 PolarHBondContact O-N 3.3Å; Y731-A734 PolarHBondContact O-N 2.74Å; Y731-Y735 VanDerWaalsContact O-CB 3.27Å; Y731-Y735 WeakPolarHBondContact O-CB 3.49Å; Y731-Y735 PolarHBondContact O-N 3.41Å; Y731-L778 HydrophobicContact CD2-CD1 3.93Å; Y731-F789 AromaticContact CE1-CE2 3.99Å; Y731-F789 HydrophobicContact CE1-CE2 3.99Å; Y731-F789 HydrophobicContact CE1-CZ 4.29Å; Y731-F789 AromaticContact CZ-CE2 3.75Å; Y731-F789 WeakPolarHBondContact OH-CE2 3.25Å; Y731-H815 AromaticContact CE1-ND1 3.72Å; Y731-H815 AromaticContact CZ-ND1 3.8Å; Y731-H815 PolarHBondContact OH-ND1 3.17Å; Y731-L819 HydrophobicContact CE2-CD2 3.92Å
732	E	89.8	Confident	87.6	Confident	104 Å²	104	59.4 Å²	59.4	49%	0.486	29%	0.286	S	S	.	.	H	α-helix	trans	-65.7	-46.1	-178.3	-57.8	93	163.7	0	0	111.7	Y729 A734 Y735 D736	Y729-E732 WeakPolarHBondContact CA-OE2 3.31Å; Y729-E732 WeakPolarHBondContact CB-OE2 3.31Å; Y729-E732 PolarHBondContact O-N 2.65Å; E732-A734 VanDerWaalsContact C-N 3.32Å; E732-A734 PolarHBondContact O-N 3.49Å; E732-Y735 PolarHBondContact O-N 3.41Å; E732-D736 PolarHBondContact O-N 3.16Å
733	D	91.3	Very high	87.7	Confident	16 Å²	16	57.1 Å²	57.1	9%	0.086	27%	0.272	C	S	.	.	H	α-helix	trans	-65.7	-36.8	179.8	-72.4	-3.3	0	0	0	111.2	I725 R726 Y729 K737	I725-D733 HydrophobicContact CD1-CB 3.79Å; I725-D733 HydrophobicContact CG2-CB 4.25Å; R726-D733 VanDerWaalsContact CB-OD2 3.29Å; R726-D733 WeakPolarHBondContact CB-OD2 3.35Å; R726-D733 VanDerWaalsContact CG-OD2 3.31Å; R726-D733 WeakPolarHBondContact CG-OD2 3.45Å; R726-D733 IonicContact CZ-OD1 3.87Å; R726-D733 IonicContact CZ-OD2 3.96Å; R726-D733 PolarHBondContact N-OD2 3.16Å; R726-D733 IonicContact NE-OD1 2.79Å; R726-D733 PolarHBondContact NE-OD1 3.46Å; R726-D733 IonicContact NE-OD2 3.71Å; R726-D733 PolarHBondContact NE-OD2 2.96Å; R726-D733 IonicContact NH2-OD1 2.74Å; R726-D733 PolarHBondContact NH2-OD1 3.3Å; R726-D733 IonicContact NH2-OD2 2.98Å; Y729-D733 VanDerWaalsContact O-CB 3.29Å; Y729-D733 WeakPolarHBondContact O-CB 3.42Å; Y729-D733 PolarHBondContact O-N 3.35Å; D733-K737 VanDerWaalsContact O-CB 3.31Å; D733-K737 WeakPolarHBondContact O-CB 3.46Å; D733-K737 VanDerWaalsContact O-CG 3.29Å; D733-K737 WeakPolarHBondContact O-CG 3.46Å; D733-K737 PolarHBondContact O-N 2.79Å
734	A	91.3	Very high	87.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-70.9	-42	175.8	0	0	0	0	0	112	I725 I730 Y731 E732 D736 L738 F774 L778 F818	I725-A734 HydrophobicContact CD1-CB 4.4Å; I730-A734 WeakPolarHBondContact O-CB 3.39Å; I730-A734 PolarHBondContact O-N 3.2Å; I730-A734 VanDerWaalsContact O-N 3.1Å; Y731-A734 PolarHBondContact O-N 2.74Å; E732-A734 VanDerWaalsContact C-N 3.32Å; E732-A734 PolarHBondContact O-N 3.49Å; A734-D736 VanDerWaalsContact C-N 3.33Å; A734-D736 PolarHBondContact O-N 2.86Å; A734-L738 WeakPolarHBondContact O-CA 3.44Å; A734-L738 VanDerWaalsContact O-CB 3.26Å; A734-L738 WeakPolarHBondContact O-CB 3.35Å; A734-L738 PolarHBondContact O-N 3.11Å; A734-F774 HydrophobicContact CB-CE2 3.92Å; A734-F774 HydrophobicContact CB-CZ 3.67Å; A734-L778 HydrophobicContact CB-CD1 3.62Å; A734-L778 HydrophobicContact CB-CD2 3.74Å; A734-L778 HydrophobicContact CB-CG 4.32Å; A734-F818 HydrophobicContact CB-CZ 4.06Å; A734-F818 WeakPolarHBondContact O-CZ 3.39Å
735	Y	90.9	Very high	87.4	Confident	53 Å²	53	60.9 Å²	60.9	21%	0.208	30%	0.295	C	S	.	.	H	α-helix	trans	-60.9	-43.9	178.6	177	-103.4	0	0	0	111.2	Y731 E732 S739 R814 H815 F818	Y731-Y735 VanDerWaalsContact O-CB 3.27Å; Y731-Y735 WeakPolarHBondContact O-CB 3.49Å; Y731-Y735 PolarHBondContact O-N 3.41Å; E732-Y735 PolarHBondContact O-N 3.41Å; Y735-S739 WeakPolarHBondContact O-CA 3.31Å; Y735-S739 WeakPolarHBondContact O-CB 3.47Å; Y735-S739 PolarHBondContact O-N 2.95Å; Y735-R814 VanDerWaalsContact OH-CB 3.23Å; Y735-R814 WeakPolarHBondContact OH-CB 3.23Å; Y735-H815 AromaticContact CD1-CE1 3.96Å; Y735-H815 AromaticContact CD2-CE1 3.96Å; Y735-H815 AromaticContact CD2-ND1 3.79Å; Y735-H815 AromaticContact CE1-CE1 3.77Å; Y735-H815 AromaticContact CE2-CE1 3.8Å; Y735-H815 AromaticContact CE2-ND1 3.67Å; Y735-H815 AromaticContact CZ-CE1 3.69Å; Y735-H815 AromaticContact CZ-NE2 3.88Å; Y735-F818 HydrophobicContact CD2-CB 3.83Å; Y735-F818 AromaticContact CD2-CD1 3.76Å; Y735-F818 HydrophobicContact CD2-CD1 3.76Å; Y735-F818 HydrophobicContact CD2-CD2 4.18Å; Y735-F818 HydrophobicContact CD2-CE1 4.36Å; Y735-F818 AromaticContact CD2-CG 3.66Å; Y735-F818 HydrophobicContact CD2-CG 3.66Å; Y735-F818 HydrophobicContact CE2-CB 3.94Å; Y735-F818 HydrophobicContact CE2-CG 4.27Å
736	D	90.4	Very high	87.4	Confident	97 Å²	97	60.9 Å²	60.9	52%	0.519	30%	0.295	S	S	.	.	H	α-helix	trans	-64.9	-57.9	176.1	-174.4	31.9	0	0	0	111	E732 A734 L738 S739 N742	E732-D736 PolarHBondContact O-N 3.16Å; A734-D736 VanDerWaalsContact C-N 3.33Å; A734-D736 PolarHBondContact O-N 2.86Å; D736-L738 PolarHBondContact O-N 2.83Å; D736-S739 WeakPolarHBondContact O-CB 3.46Å; D736-S739 PolarHBondContact O-N 3.37Å; D736-S739 PolarHBondContact O-OG 2.95Å; D736-N742 PolarHBondContact O-ND2 3.28Å
737	K	88.9	Confident	87.5	Confident	72 Å²	72	57.4 Å²	57.4	31%	0.313	28%	0.283	S	S	.	.	H	α-helix	trans	-72.9	-31.4	-170.7	-65.4	-179	-177	-175.2	0	114.9	V723 T724 I725 D733	V723-K737 HydrophobicContact CB-CD 4.47Å; V723-K737 HydrophobicContact CG1-CB 3.98Å; T724-K737 WeakPolarHBondContact O-CD 3.42Å; T724-K737 WeakPolarHBondContact O-CE 3.28Å; T724-K737 PolarHBondContact O-NZ 3.34Å; I725-K737 HydrophobicContact CD1-CD 4.29Å; D733-K737 VanDerWaalsContact O-CB 3.31Å; D733-K737 WeakPolarHBondContact O-CB 3.46Å; D733-K737 VanDerWaalsContact O-CG 3.29Å; D733-K737 WeakPolarHBondContact O-CG 3.46Å; D733-K737 PolarHBondContact O-N 2.79Å
738	L	89.9	Confident	87.6	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	13.9	-179.9	-58.8	174	0	0	0	112.1	I721 V723 A734 D736 L746 I750 F774 F818 R821 I822	I721-L738 HydrophobicContact CG2-CD2 3.98Å; V723-L738 HydrophobicContact CG1-CD2 3.8Å; V723-L738 HydrophobicContact CG1-CG 4.36Å; A734-L738 WeakPolarHBondContact O-CA 3.44Å; A734-L738 VanDerWaalsContact O-CB 3.26Å; A734-L738 WeakPolarHBondContact O-CB 3.35Å; A734-L738 PolarHBondContact O-N 3.11Å; D736-L738 PolarHBondContact O-N 2.83Å; L738-L746 HydrophobicContact CB-CD1 4.34Å; L738-L746 HydrophobicContact CD2-CD1 4.31Å; L738-I750 HydrophobicContact CD2-CD1 4.43Å; L738-F774 HydrophobicContact CD1-CE1 3.96Å; L738-F774 HydrophobicContact CD1-CZ 3.96Å; L738-F818 HydrophobicContact CB-CE2 3.88Å; L738-F818 HydrophobicContact CB-CZ 4.45Å; L738-R821 PolarHBondContact O-NH1 3.08Å; L738-I822 HydrophobicContact CD1-CD1 4.37Å
739	S	86.6	Confident	87.5	Confident	12 Å²	12	58.6 Å²	58.6	8%	0.084	28%	0.28	C	S	.	.	S	Bend	trans	-56.7	156.1	170.3	63.2	0	0	0	0	111.2	Y735 D736 E741 N742 E743 R821	Y735-S739 WeakPolarHBondContact O-CA 3.31Å; Y735-S739 WeakPolarHBondContact O-CB 3.47Å; Y735-S739 PolarHBondContact O-N 2.95Å; D736-S739 WeakPolarHBondContact O-CB 3.46Å; D736-S739 PolarHBondContact O-N 3.37Å; D736-S739 PolarHBondContact O-OG 2.95Å; S739-E741 PolarHBondContact O-N 2.7Å; S739-N742 PolarHBondContact O-N 2.83Å; S739-N742 PolarHBondContact OG-N 3.29Å; S739-N742 PolarHBondContact OG-ND2 3.02Å; S739-E743 PolarHBondContact O-N 2.97Å; S739-R821 VanDerWaalsContact C-NH1 3.35Å
740	P	83.1	Confident	87.4	Confident	54 Å²	54	53.9 Å²	53.9	35%	0.351	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-21.6	175.8	26	-35.1	0	0	0	113.4	Y817 R821	P740-Y817 HydrophobicContact CB-CE1 3.96Å; P740-Y817 HydrophobicContact CG-CD1 4.27Å; P740-Y817 HydrophobicContact CG-CE1 3.8Å; P740-R821 VanDerWaalsContact N-NH1 3.13Å
741	E	83.9	Confident	87.1	Confident	149 Å²	149	59 Å²	59	70%	0.696	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-40.1	178.4	-62.7	175.9	-167.8	0	0	111.2	S739 R814	S739-E741 PolarHBondContact O-N 2.7Å; E741-R814 IonicContact OE1-NH1 3.48Å
742	N	84.7	Confident	86.7	Confident	86 Å²	86	58.3 Å²	58.3	46%	0.46	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-46.9	179.6	-71.6	-26.2	0	0	0	112.3	D736 S739	D736-N742 PolarHBondContact O-ND2 3.28Å; S739-N742 PolarHBondContact O-N 2.83Å; S739-N742 PolarHBondContact OG-N 3.29Å; S739-N742 PolarHBondContact OG-ND2 3.02Å
743	E	87	Confident	86.4	Confident	54 Å²	54	57.7 Å²	57.7	25%	0.252	28%	0.276	S	S	.	.			trans	-130.2	90.2	-175.7	-71.1	-64.6	172.4	0	0	110.4	I721 S739 L746 R821	I721-E743 HydrophobicContact CD1-CB 4.28Å; I721-E743 HydrophobicContact CD1-CG 4.27Å; I721-E743 HydrophobicContact CG1-CG 4.47Å; I721-E743 HydrophobicContact CG2-CG 3.93Å; S739-E743 PolarHBondContact O-N 2.97Å; E743-L746 HydrophobicContact CB-CD1 4.2Å; E743-R821 PolarHBondContact O-NH2 3.11Å
744	P	83.7	Confident	85.9	Confident	84 Å²	84	57.2 Å²	57.2	55%	0.545	27%	0.273	S	S	.	.	S	Bend	trans	-70.9	-31.9	-176	25.8	-33.5	0	0	0	113.1	R821 N943	P744-R821 PolarHBondContact O-NH2 2.92Å; P744-N943 PolarHBondContact O-ND2 3.49Å
745	D	84.6	Confident	85.4	Confident	56 Å²	56	58.8 Å²	58.8	30%	0.299	28%	0.281	S	S	.	.			trans	-109.5	89.8	-177.5	-175.5	15.5	0	0	0	112.8	K747	D745-K747 PolarHBondContact O-N 3.12Å; D745-K747 VanDerWaalsContact OD1-CB 3.25Å; D745-K747 WeakPolarHBondContact OD1-CB 3.41Å; D745-K747 WeakPolarHBondContact OD1-CG 3.41Å; D745-K747 PolarHBondContact OD1-N 3.38Å; D745-K747 VanDerWaalsContact OD1-N 3.11Å
746	L	87.4	Confident	84.7	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-0.8	179.3	-124.9	70.8	0	0	0	113.9	I721 L738 E743 K748 I750 R821 I822 K825 V944	I721-L746 HydrophobicContact CD1-CD1 4.48Å; L738-L746 HydrophobicContact CB-CD1 4.34Å; L738-L746 HydrophobicContact CD2-CD1 4.31Å; E743-L746 HydrophobicContact CB-CD1 4.2Å; L746-K748 VanDerWaalsContact C-N 3.3Å; L746-I750 HydrophobicContact CG-CD1 4.18Å; L746-R821 HydrophobicContact CD2-CB 4.37Å; L746-I822 HydrophobicContact CD2-CD1 3.88Å; L746-K825 HydrophobicContact CD2-CB 4.3Å; L746-K825 VanDerWaalsContact O-CD 3.3Å; L746-K825 WeakPolarHBondContact O-CD 3.28Å; L746-K825 VanDerWaalsContact O-CE 3.23Å; L746-K825 WeakPolarHBondContact O-CE 3.32Å; L746-K825 PolarHBondContact O-NZ 2.74Å; L746-V944 HydrophobicContact CB-CG2 3.93Å
747	K	88.1	Confident	83.6	Confident	37 Å²	37	58.6 Å²	58.6	16%	0.161	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-21	178	-63.6	-179.9	171.3	-159.7	0	112.9	D707 V711 Q712 D745 Y828 V944	D707-K747 IonicContact OD1-NZ 2.74Å; D707-K747 PolarHBondContact OD1-NZ 2.99Å; D707-K747 IonicContact OD2-NZ 2.93Å; D707-K747 PolarHBondContact OD2-NZ 2.84Å; V711-K747 HydrophobicContact CG1-CB 3.91Å; V711-K747 HydrophobicContact CG2-CD 4.23Å; Q712-K747 PolarHBondContact NE2-O 3.35Å; D745-K747 PolarHBondContact O-N 3.12Å; D745-K747 VanDerWaalsContact OD1-CB 3.25Å; D745-K747 WeakPolarHBondContact OD1-CB 3.41Å; D745-K747 WeakPolarHBondContact OD1-CG 3.41Å; D745-K747 PolarHBondContact OD1-N 3.38Å; D745-K747 VanDerWaalsContact OD1-N 3.11Å; K747-Y828 HydrophobicContact CB-CE1 4.08Å; K747-Y828 HydrophobicContact CG-CE1 4.41Å; K747-Y828 HydrophobicContact CG-CE2 4.44Å; K747-V944 WeakPolarHBondContact CE-O 3.5Å; K747-V944 HydrophobicContact CG-CG1 4.35Å
748	K	85.2	Confident	82.6	Confident	76 Å²	76	63.2 Å²	63.2	33%	0.33	32%	0.317	S	S	.	.	S	Bend	trans	-59	159.3	173	-64.9	-176.4	-178.7	-179.4	0	111.4	I721 L746 I750 K825	I721-K748 HydrophobicContact CD1-CB 4.15Å; I721-K748 HydrophobicContact CG1-CB 4.13Å; L746-K748 VanDerWaalsContact C-N 3.3Å; K748-I750 PolarHBondContact O-N 3.13Å; K748-K825 PolarHBondContact O-NZ 3.5Å
749	R	82.8	Confident	81.4	Confident	136 Å²	136	65.8 Å²	65.8	51%	0.513	34%	0.343	S	S	.	.			trans	-67.4	130.9	175	-67.4	-172.9	-179.2	-178.5	5.6	109.1	Q712 G720 I721	Q712-R749 HydrophobicContact CG-CG 4.29Å; Q712-R749 VanDerWaalsContact OE1-CG 3.3Å; G720-R749 CarbonylContact C-O 3.56Å; G720-R749 VanDerWaalsContact CA-O 3.27Å; G720-R749 WeakPolarHBondContact CA-O 3.4Å; I721-R749 PolarHBondContact N-O 3.03Å
750	I	85	Confident	80.5	Confident	14 Å²	14	71.1 Å²	71.1	7%	0.072	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.4	178.3	-56.3	178.6	0	0	0	107.8	I721 V723 L738 L746 K748 V752 F771 K825	I721-I750 HydrophobicContact CB-CG1 4.19Å; I721-I750 HydrophobicContact CD1-CG1 4.16Å; I721-I750 HydrophobicContact CG2-CG2 4.5Å; I721-I750 CarbonylContact O-C 3.57Å; I721-I750 WeakPolarHBondContact O-CA 3.36Å; V723-I750 HydrophobicContact CG2-CG2 4.1Å; L738-I750 HydrophobicContact CD2-CD1 4.43Å; L746-I750 HydrophobicContact CG-CD1 4.18Å; K748-I750 PolarHBondContact O-N 3.13Å; I750-V752 HydrophobicContact CG2-CG2 3.95Å; I750-F771 HydrophobicContact CB-CD2 3.85Å; I750-F771 HydrophobicContact CB-CE2 3.67Å; I750-F771 HydrophobicContact CD1-CE2 3.97Å; I750-F771 HydrophobicContact CG1-CE2 4.27Å; I750-F771 HydrophobicContact CG2-CD2 3.99Å; I750-F771 HydrophobicContact CG2-CE2 4.05Å; I750-K825 HydrophobicContact CD1-CD 4.42Å; I750-K825 HydrophobicContact CD1-CG 4.34Å
751	R	82.9	Confident	79.8	Confident	123 Å²	123	74.3 Å²	74.3	46%	0.464	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.3	170.1	-62.3	-176.8	-180	165.4	1.7	110	I721 N722 V723 D766	I721-R751 PolarHBondContact O-N 2.98Å; N722-R751 WeakPolarHBondContact CA-O 3.17Å; N722-R751 WeakPolarHBondContact OD1-CB 3.41Å; V723-R751 PolarHBondContact N-O 3.41Å; R751-D766 WeakPolarHBondContact CA-OD2 3.47Å; R751-D766 VanDerWaalsContact CB-OD2 3.27Å; R751-D766 WeakPolarHBondContact CB-OD2 3.41Å; R751-D766 WeakPolarHBondContact CG-OD2 3.42Å
752	V	83.8	Confident	79	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.006	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.9	-172.6	-173.6	0	0	0	0	109.7	V723 I725 I750 L754 D766 I770 F771 F774	V723-V752 HydrophobicContact CG2-CB 4.41Å; V723-V752 HydrophobicContact CG2-CG1 4.38Å; V723-V752 HydrophobicContact CG2-CG2 3.92Å; V723-V752 CarbonylContact O-C 3.31Å; V723-V752 WeakPolarHBondContact O-CA 3.5Å; I725-V752 HydrophobicContact CB-CG1 4.44Å; I725-V752 HydrophobicContact CG1-CG1 4.07Å; I750-V752 HydrophobicContact CG2-CG2 3.95Å; V752-L754 HydrophobicContact CG1-CD2 4.2Å; V752-L754 HydrophobicContact CG1-CG 4.32Å; V752-D766 PolarHBondContact N-OD2 3.48Å; V752-I770 HydrophobicContact CB-CG2 4.25Å; V752-I770 HydrophobicContact CG1-CG2 4.48Å; V752-I770 WeakPolarHBondContact O-CG2 3.42Å; V752-F771 HydrophobicContact CG2-CB 4.34Å; V752-F771 HydrophobicContact CG2-CD2 3.96Å; V752-F774 HydrophobicContact CG1-CB 4.03Å; V752-F774 HydrophobicContact CG1-CD1 4.29Å; V752-F774 HydrophobicContact CG1-CD2 4.2Å; V752-F774 HydrophobicContact CG1-CG 3.9Å; V752-F774 HydrophobicContact CG2-CB 4.35Å; V752-F774 HydrophobicContact CG2-CD1 3.66Å; V752-F774 HydrophobicContact CG2-CE1 4.19Å; V752-F774 HydrophobicContact CG2-CG 4.08Å
753	H	82.5	Confident	77.7	Confident	91 Å²	91	70.7 Å²	70.7	42%	0.421	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	115.4	170	-58.7	81.5	0	0	0	108.2	V723 T724 I725	V723-H753 PolarHBondContact O-N 2.9Å; T724-H753 CarbonylContact C-O 3.48Å; T724-H753 VanDerWaalsContact CA-O 3.27Å; T724-H753 WeakPolarHBondContact CA-O 3.31Å; T724-H753 HydrophobicContact CG2-CB 4.33Å; I725-H753 PolarHBondContact N-O 2.91Å
754	L	80.6	Confident	76.2	Confident	6 Å²	6	70.5 Å²	70.5	3%	0.031	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.7	178.9	-69.7	172.2	0	0	0	110.5	I725 V752 E762 I770	I725-L754 HydrophobicContact CB-CD2 4.1Å; I725-L754 HydrophobicContact CG2-CD2 4.26Å; I725-L754 CarbonylContact O-C 3.59Å; I725-L754 WeakPolarHBondContact O-CA 3.43Å; V752-L754 HydrophobicContact CG1-CD2 4.2Å; V752-L754 HydrophobicContact CG1-CG 4.32Å; L754-E762 HydrophobicContact CB-CB 4.34Å; L754-E762 HydrophobicContact CB-CG 4.37Å; L754-E762 WeakPolarHBondContact CB-OE2 3.34Å; L754-E762 WeakPolarHBondContact O-CB 3.27Å; L754-E762 PolarHBondContact O-N 3.49Å; L754-I770 HydrophobicContact CD1-CG2 3.74Å; L754-I770 HydrophobicContact CG-CG2 3.9Å
755	L	81.8	Confident	74.9	Confident	33 Å²	33	74.8 Å²	74.8	17%	0.173	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	127.5	173.1	-64.3	175.3	0	0	0	109.8	T724 I725 R726 R727 D761	T724-L755 HydrophobicContact CG2-CD1 3.59Å; T724-L755 HydrophobicContact CG2-CD2 4.22Å; T724-L755 HydrophobicContact CG2-CG 3.68Å; I725-L755 PolarHBondContact O-N 3.48Å; R726-L755 HydrophobicContact CG-CB 4.31Å; R726-L755 HydrophobicContact CG-CD1 4.11Å; R727-L755 PolarHBondContact N-O 3.46Å; L755-D761 WeakPolarHBondContact CD2-OD1 3.46Å
756	N	75.9	Confident	73.4	Confident	71 Å²	71	74.2 Å²	74.2	38%	0.38	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-65.1	168.6	174.2	-90.9	-37.2	0	0	0	112.1	H758 G759 L760 E762	N756-H758 PolarHBondContact O-N 3.34Å; N756-G759 PolarHBondContact O-N 3.48Å; N756-L760 PolarHBondContact N-O 3.25Å; N756-E762 HydrophobicContact CB-CG 4.25Å; N756-E762 VanDerWaalsContact ND2-CG 3.33Å; N756-E762 WeakPolarHBondContact ND2-CG 3.17Å; N756-E762 VanDerWaalsContact OD1-CG 3.23Å; N756-E762 WeakPolarHBondContact OD1-CG 3.31Å; N756-E762 PolarHBondContact OD1-OE1 2.72Å
757	A	68	Low	71.9	Confident	75 Å²	75	77.1 Å²	77.1	62%	0.62	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-22.6	176.7	0	0	0	0	0	114.5
758	H	66.8	Low	70.8	Confident	169 Å²	169	76.7 Å²	76.7	78%	0.782	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	5.8	177	-58.5	96.7	0	0	0	113.9	N756 L760	N756-H758 PolarHBondContact O-N 3.34Å; H758-L760 VanDerWaalsContact C-N 3.27Å; H758-L760 PolarHBondContact O-N 2.85Å
759	G	64.6	Low	69.9	Low	54 Å²	54	73.3 Å²	73.3	56%	0.557	43%	0.433	S	S	*	.	S	Bend	trans	74.1	12.2	178.3	0	0	0	0	0	115.2	N756	N756-G759 PolarHBondContact O-N 3.48Å
760	L	68.8	Low	69.6	Low	124 Å²	124	68.1 Å²	68.1	65%	0.649	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-92	146.9	174.9	-64	171.8	0	0	0	110.4	N756 H758 E762	N756-L760 PolarHBondContact N-O 3.25Å; H758-L760 VanDerWaalsContact C-N 3.27Å; H758-L760 PolarHBondContact O-N 2.85Å; L760-E762 PolarHBondContact O-N 3Å
761	D	67.1	Low	69.4	Low	122 Å²	122	68.3 Å²	68.3	65%	0.652	42%	0.415	S	S	*	.	B	Isolated β-bridge	trans	-58.7	126.1	173.8	-70.4	-29.5	0	0	0	110.3	L755	L755-D761 WeakPolarHBondContact CD2-OD1 3.46Å
762	E	67.9	Low	69.2	Low	43 Å²	43	65.2 Å²	65.2	20%	0.201	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-65.6	133.3	169.1	-79	-177.7	-173.3	0	0	109.8	R727 L754 N756 L760 G764	R727-E762 IonicContact CZ-OE1 3.1Å; R727-E762 IonicContact NH1-OE1 2.7Å; R727-E762 PolarHBondContact NH1-OE1 3.26Å; R727-E762 IonicContact NH1-OE2 2.99Å; R727-E762 PolarHBondContact NH1-OE2 3.41Å; L754-E762 HydrophobicContact CB-CB 4.34Å; L754-E762 HydrophobicContact CB-CG 4.37Å; L754-E762 WeakPolarHBondContact CB-OE2 3.34Å; L754-E762 WeakPolarHBondContact O-CB 3.27Å; L754-E762 PolarHBondContact O-N 3.49Å; N756-E762 HydrophobicContact CB-CG 4.25Å; N756-E762 VanDerWaalsContact ND2-CG 3.33Å; N756-E762 WeakPolarHBondContact ND2-CG 3.17Å; N756-E762 VanDerWaalsContact OD1-CG 3.23Å; N756-E762 WeakPolarHBondContact OD1-CG 3.31Å; N756-E762 PolarHBondContact OD1-OE1 2.72Å; L760-E762 PolarHBondContact O-N 3Å; E762-G764 PolarHBondContact O-N 2.95Å; E762-G764 VanDerWaalsContact O-N 3.09Å
763	A	57.2	Low	68.9	Low	115 Å²	115	66.4 Å²	66.4	95%	0.95	41%	0.409	S	S	*	.	S	Bend	trans	-70.1	106.5	179.7	0	0	0	0	0	110.7
764	G	56.4	Low	69.1	Low	50 Å²	50	62.1 Å²	62.1	52%	0.515	39%	0.389	S	S	.	.			trans	-171.7	133.8	174.2	0	0	0	0	0	112.4	E762	E762-G764 PolarHBondContact O-N 2.95Å; E762-G764 VanDerWaalsContact O-N 3.09Å
765	I	54.9	Low	69.4	Low	174 Å²	174	61.9 Å²	61.9	89%	0.892	39%	0.388	S	S	*	.			trans	-87.9	124.6	171.2	-61.2	171.9	0	0	0	107	G767	I765-G767 VanDerWaalsContact C-N 3.28Å; I765-G767 PolarHBondContact O-N 2.66Å
766	D	54.3	Low	69.5	Low	44 Å²	44	61.1 Å²	61.1	24%	0.235	38%	0.384	C	S	.	.			trans	-72.2	81.1	-178.3	-172.5	16.1	0	0	0	112.2	R751 V752 G768 I770	R751-D766 WeakPolarHBondContact CA-OD2 3.47Å; R751-D766 VanDerWaalsContact CB-OD2 3.27Å; R751-D766 WeakPolarHBondContact CB-OD2 3.41Å; R751-D766 WeakPolarHBondContact CG-OD2 3.42Å; V752-D766 PolarHBondContact N-OD2 3.48Å; D766-G768 WeakPolarHBondContact OD1-CA 3.31Å; D766-G768 PolarHBondContact OD1-N 3.46Å; D766-I770 HydrophobicContact CB-CD1 4.45Å
767	G	56.1	Low	70	Confident	61 Å²	61	60.5 Å²	60.5	63%	0.629	38%	0.379	S	S	*	.	S	Bend	trans	-83.7	18.2	165.5	0	0	0	0	0	113.4	I765	I765-G767 VanDerWaalsContact C-N 3.28Å; I765-G767 PolarHBondContact O-N 2.66Å
768	G	63.4	Low	71.1	Confident	28 Å²	28	56.9 Å²	56.9	29%	0.289	35%	0.349	S	S	.	.	S	Bend	trans	95.6	-7.3	-175.8	0	0	0	0	0	114.8	D766 R772	D766-G768 WeakPolarHBondContact OD1-CA 3.31Å; D766-G768 PolarHBondContact OD1-N 3.46Å; G768-R772 WeakPolarHBondContact O-CD 3.5Å; G768-R772 VanDerWaalsContact O-CG 3.32Å; G768-R772 WeakPolarHBondContact O-CG 3.35Å; G768-R772 PolarHBondContact O-N 3.12Å
769	G	67.6	Low	72.2	Confident	5 Å²	5	48.9 Å²	48.9	5%	0.052	31%	0.312	C	S	.	.	H	α-helix	trans	-69.3	-53.7	177.9	0	0	0	0	0	114	F771 R772 E773 C1049	G769-F771 VanDerWaalsContact C-N 3.29Å; G769-F771 PolarHBondContact O-N 3.13Å; G769-R772 WeakPolarHBondContact O-CB 3.23Å; G769-R772 PolarHBondContact O-N 2.99Å; G769-E773 PolarHBondContact O-N 3.38Å; G769-E773 VanDerWaalsContact O-N 3.14Å; G769-C1049 PolarHBondContact O-SG 3.47Å
770	I	75.3	Confident	73.3	Confident	28 Å²	28	51 Å²	51	14%	0.144	31%	0.306	C	S	.	.	H	α-helix	trans	-61	-41.5	-177.4	-58.3	173	0	0	0	110.4	V752 L754 D766 R772 E773 F774	V752-I770 HydrophobicContact CB-CG2 4.25Å; V752-I770 HydrophobicContact CG1-CG2 4.48Å; V752-I770 WeakPolarHBondContact O-CG2 3.42Å; L754-I770 HydrophobicContact CD1-CG2 3.74Å; L754-I770 HydrophobicContact CG-CG2 3.9Å; D766-I770 HydrophobicContact CB-CD1 4.45Å; I770-R772 VanDerWaalsContact C-N 3.31Å; I770-R772 PolarHBondContact O-N 3.08Å; I770-E773 PolarHBondContact O-N 3.46Å; I770-F774 WeakPolarHBondContact O-CB 3.29Å; I770-F774 PolarHBondContact O-N 3.45Å
771	F	81.9	Confident	74.3	Confident	18 Å²	18	46.8 Å²	46.8	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-57.7	-40.5	174.8	170	-106	0	0	0	113.1	I750 V752 G769 L775 K825 E829	I750-F771 HydrophobicContact CB-CD2 3.85Å; I750-F771 HydrophobicContact CB-CE2 3.67Å; I750-F771 HydrophobicContact CD1-CE2 3.97Å; I750-F771 HydrophobicContact CG1-CE2 4.27Å; I750-F771 HydrophobicContact CG2-CD2 3.99Å; I750-F771 HydrophobicContact CG2-CE2 4.05Å; V752-F771 HydrophobicContact CG2-CB 4.34Å; V752-F771 HydrophobicContact CG2-CD2 3.96Å; G769-F771 VanDerWaalsContact C-N 3.29Å; G769-F771 PolarHBondContact O-N 3.13Å; F771-L775 HydrophobicContact CE1-CD2 4.13Å; F771-L775 HydrophobicContact CE2-CD2 4.44Å; F771-L775 HydrophobicContact CZ-CD2 3.75Å; F771-L775 VanDerWaalsContact O-CB 3.28Å; F771-L775 WeakPolarHBondContact O-CB 3.44Å; F771-L775 PolarHBondContact O-N 3.13Å; F771-K825 HydrophobicContact CZ-CG 4.13Å; F771-E829 HydrophobicContact CE1-CB 4.43Å; F771-E829 HydrophobicContact CE1-CG 3.94Å; F771-E829 HydrophobicContact CZ-CG 4.2Å
772	R	78.3	Confident	75.3	Confident	58 Å²	58	41 Å²	41	22%	0.219	26%	0.256	C	S	.	.	H	α-helix	trans	-69.7	-42.6	179.5	-73	170.9	173.1	-152.1	-6.2	112.7	G768 G769 I770 L775 N776 M831 Y1028	G768-R772 WeakPolarHBondContact O-CD 3.5Å; G768-R772 VanDerWaalsContact O-CG 3.32Å; G768-R772 WeakPolarHBondContact O-CG 3.35Å; G768-R772 PolarHBondContact O-N 3.12Å; G769-R772 WeakPolarHBondContact O-CB 3.23Å; G769-R772 PolarHBondContact O-N 2.99Å; I770-R772 VanDerWaalsContact C-N 3.31Å; I770-R772 PolarHBondContact O-N 3.08Å; R772-L775 PolarHBondContact O-N 3.24Å; R772-N776 VanDerWaalsContact O-CB 3.32Å; R772-N776 WeakPolarHBondContact O-CB 3.16Å; R772-N776 PolarHBondContact O-N 2.99Å; R772-M831 HydrophobicContact CB-SD 3.99Å; R772-M831 HydrophobicContact CG-SD 3.9Å; R772-Y1028 PolarHBondContact NH1-O 3.23Å; R772-Y1028 PolarHBondContact NH2-O 3.16Å
773	E	78.4	Confident	76.4	Confident	25 Å²	25	39.1 Å²	39.1	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-53.3	174.7	-178.8	176.8	174.9	0	0	110	R727 G769 I770 L775 N776 E777 F1078	R727-E773 IonicContact CZ-OE1 3.9Å; R727-E773 IonicContact NH1-OE1 3.56Å; R727-E773 IonicContact NH2-OE1 3.73Å; R727-E773 PolarHBondContact NH2-OE1 3.33Å; G769-E773 PolarHBondContact O-N 3.38Å; G769-E773 VanDerWaalsContact O-N 3.14Å; I770-E773 PolarHBondContact O-N 3.46Å; E773-L775 VanDerWaalsContact C-N 3.33Å; E773-L775 PolarHBondContact O-N 3.1Å; E773-N776 PolarHBondContact O-N 3.41Å; E773-E777 PolarHBondContact O-N 3.33Å; E773-F1078 WeakPolarHBondContact OE2-CE2 3.4Å
774	F	85.3	Confident	77.9	Confident	1 Å²	1	36.5 Å²	36.5	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-52.2	-49.3	175.7	163.6	-105.8	0	0	0	112.1	I725 I730 A734 L738 V752 I770 N776 E777 L778	I725-F774 HydrophobicContact CB-CD2 4.41Å; I725-F774 HydrophobicContact CB-CE2 4.23Å; I725-F774 HydrophobicContact CD1-CE2 4.05Å; I725-F774 HydrophobicContact CD1-CZ 4.29Å; I725-F774 HydrophobicContact CG1-CD2 4.15Å; I725-F774 HydrophobicContact CG1-CE2 3.65Å; I725-F774 HydrophobicContact CG1-CZ 4.14Å; I725-F774 HydrophobicContact CG2-CD2 4.1Å; I725-F774 HydrophobicContact CG2-CE2 3.86Å; I730-F774 HydrophobicContact CG2-CD2 4.16Å; I730-F774 HydrophobicContact CG2-CE2 4.06Å; A734-F774 HydrophobicContact CB-CE2 3.92Å; A734-F774 HydrophobicContact CB-CZ 3.67Å; L738-F774 HydrophobicContact CD1-CE1 3.96Å; L738-F774 HydrophobicContact CD1-CZ 3.96Å; V752-F774 HydrophobicContact CG1-CB 4.03Å; V752-F774 HydrophobicContact CG1-CD1 4.29Å; V752-F774 HydrophobicContact CG1-CD2 4.2Å; V752-F774 HydrophobicContact CG1-CG 3.9Å; V752-F774 HydrophobicContact CG2-CB 4.35Å; V752-F774 HydrophobicContact CG2-CD1 3.66Å; V752-F774 HydrophobicContact CG2-CE1 4.19Å; V752-F774 HydrophobicContact CG2-CG 4.08Å; I770-F774 WeakPolarHBondContact O-CB 3.29Å; I770-F774 PolarHBondContact O-N 3.45Å; F774-N776 PolarHBondContact O-N 2.98Å; F774-E777 PolarHBondContact O-N 3.2Å; F774-L778 HydrophobicContact CE1-CD2 4.18Å; F774-L778 HydrophobicContact CE2-CD2 4.36Å; F774-L778 HydrophobicContact CZ-CD2 3.81Å; F774-L778 WeakPolarHBondContact O-CB 3.47Å; F774-L778 PolarHBondContact O-N 2.76Å
775	L	87.6	Confident	79.3	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-67.2	-37.3	-176.9	-171.4	62	0	0	0	112.1	F771 R772 E773 L779 I822 K825 A826 M831	F771-L775 HydrophobicContact CE1-CD2 4.13Å; F771-L775 HydrophobicContact CE2-CD2 4.44Å; F771-L775 HydrophobicContact CZ-CD2 3.75Å; F771-L775 VanDerWaalsContact O-CB 3.28Å; F771-L775 WeakPolarHBondContact O-CB 3.44Å; F771-L775 PolarHBondContact O-N 3.13Å; R772-L775 PolarHBondContact O-N 3.24Å; E773-L775 VanDerWaalsContact C-N 3.33Å; E773-L775 PolarHBondContact O-N 3.1Å; L775-L779 HydrophobicContact CG-CD1 4.28Å; L775-L779 WeakPolarHBondContact O-CB 3.49Å; L775-L779 WeakPolarHBondContact O-CD1 3.35Å; L775-L779 VanDerWaalsContact O-CG 3.24Å; L775-L779 WeakPolarHBondContact O-CG 3.32Å; L775-L779 PolarHBondContact O-N 3.01Å; L775-I822 HydrophobicContact CD1-CG2 3.33Å; L775-K825 HydrophobicContact CD2-CG 4.4Å; L775-A826 HydrophobicContact CD2-CB 4Å; L775-M831 HydrophobicContact CB-CE 3.71Å; L775-M831 HydrophobicContact CB-SD 4.23Å; L775-M831 HydrophobicContact CD2-CE 3.43Å; L775-M831 VanDerWaalsContact CD2-CE 3.43Å; L775-M831 HydrophobicContact CD2-SD 3.96Å; L775-M831 HydrophobicContact CG-CE 3.45Å; L775-M831 VanDerWaalsContact CG-CE 3.45Å; L775-M831 HydrophobicContact CG-SD 4.37Å
776	N	84.4	Confident	80.8	Confident	17 Å²	17	35.5 Å²	35.5	9%	0.091	20%	0.204	C	C	.	.	H	α-helix	trans	-68.8	-44.5	175.9	-169.5	24.7	0	0	0	111.9	R772 E773 F774 L779 K780	R772-N776 VanDerWaalsContact O-CB 3.32Å; R772-N776 WeakPolarHBondContact O-CB 3.16Å; R772-N776 PolarHBondContact O-N 2.99Å; E773-N776 PolarHBondContact O-N 3.41Å; F774-N776 PolarHBondContact O-N 2.98Å; N776-L779 PolarHBondContact O-N 2.88Å; N776-K780 PolarHBondContact ND2-NZ 3.15Å; N776-K780 WeakPolarHBondContact O-CB 3.34Å; N776-K780 VanDerWaalsContact O-CG 3.28Å; N776-K780 WeakPolarHBondContact O-CG 3.31Å; N776-K780 PolarHBondContact O-N 3.4Å; N776-K780 WeakPolarHBondContact OD1-CE 3.25Å
777	E	85.8	Confident	82.2	Confident	57 Å²	57	36.4 Å²	36.4	27%	0.266	21%	0.207	S	C	.	.	H	α-helix	trans	-65.5	-41.4	176.3	-71.7	-170	163	0	0	111.8	R727 I730 E773 F774 L779 K780 S781	R727-E777 IonicContact NH2-OE1 2.73Å; R727-E777 PolarHBondContact NH2-OE1 3.42Å; I730-E777 HydrophobicContact CD1-CB 4.13Å; I730-E777 WeakPolarHBondContact CD1-OE2 3.49Å; E773-E777 PolarHBondContact O-N 3.33Å; F774-E777 PolarHBondContact O-N 3.2Å; E777-L779 PolarHBondContact O-N 3.17Å; E777-K780 PolarHBondContact O-N 3.3Å; E777-S781 VanDerWaalsContact O-CB 3.25Å; E777-S781 WeakPolarHBondContact O-CB 3.44Å; E777-S781 PolarHBondContact O-N 2.86Å
778	L	90.8	Very high	83.6	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.5	-46.2	175.5	177.3	60.7	0	0	0	111.7	I730 Y731 A734 F774 S781 G782 F818 I822	I730-L778 HydrophobicContact CG2-CB 3.98Å; I730-L778 HydrophobicContact CG2-CD1 4.15Å; Y731-L778 HydrophobicContact CD2-CD1 3.93Å; A734-L778 HydrophobicContact CB-CD1 3.62Å; A734-L778 HydrophobicContact CB-CD2 3.74Å; A734-L778 HydrophobicContact CB-CG 4.32Å; F774-L778 HydrophobicContact CE1-CD2 4.18Å; F774-L778 HydrophobicContact CE2-CD2 4.36Å; F774-L778 HydrophobicContact CZ-CD2 3.81Å; F774-L778 WeakPolarHBondContact O-CB 3.47Å; F774-L778 PolarHBondContact O-N 2.76Å; L778-S781 PolarHBondContact O-N 3.13Å; L778-G782 PolarHBondContact O-N 3.28Å; L778-F818 HydrophobicContact CD1-CE1 4.39Å; L778-F818 HydrophobicContact CD2-CZ 4.31Å; L778-I822 HydrophobicContact CD2-CD1 4.12Å; L778-I822 HydrophobicContact CD2-CG1 4.01Å; L778-I822 HydrophobicContact CD2-CG2 3.68Å; L778-I822 HydrophobicContact CG-CG2 4.18Å
779	L	90.9	Very high	84.8	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.7	-44.2	176.9	-72.4	169.8	0	0	0	111.2	L775 N776 E777 S781 G782 F783 I822 L823 A826 V833 L835	L775-L779 HydrophobicContact CG-CD1 4.28Å; L775-L779 WeakPolarHBondContact O-CB 3.49Å; L775-L779 WeakPolarHBondContact O-CD1 3.35Å; L775-L779 VanDerWaalsContact O-CG 3.24Å; L775-L779 WeakPolarHBondContact O-CG 3.32Å; L775-L779 PolarHBondContact O-N 3.01Å; N776-L779 PolarHBondContact O-N 2.88Å; E777-L779 PolarHBondContact O-N 3.17Å; L779-S781 VanDerWaalsContact C-N 3.28Å; L779-S781 PolarHBondContact O-N 2.88Å; L779-G782 PolarHBondContact O-N 3.49Å; L779-F783 HydrophobicContact CB-CD2 4.43Å; L779-F783 HydrophobicContact CD2-CD2 4.05Å; L779-F783 HydrophobicContact CD2-CE2 3.52Å; L779-F783 WeakPolarHBondContact O-CB 3.48Å; L779-F783 VanDerWaalsContact O-CD2 3.25Å; L779-F783 WeakPolarHBondContact O-CD2 3.45Å; L779-F783 PolarHBondContact O-N 3.49Å; L779-I822 HydrophobicContact CD1-CG2 4.48Å; L779-I822 HydrophobicContact CD2-CB 4.26Å; L779-I822 HydrophobicContact CD2-CG2 3.63Å; L779-I822 HydrophobicContact CG-CG2 3.87Å; L779-L823 HydrophobicContact CD2-CB 4.45Å; L779-A826 HydrophobicContact CD1-CB 3.95Å; L779-V833 HydrophobicContact CB-CG1 4.04Å; L779-V833 HydrophobicContact CD1-CB 4.27Å; L779-V833 HydrophobicContact CD1-CG1 3.83Å; L779-V833 HydrophobicContact CD1-CG2 3.66Å; L779-L835 HydrophobicContact CB-CD1 4.41Å; L779-L835 HydrophobicContact CD2-CD1 4.47Å
780	K	87.5	Confident	86	Confident	99 Å²	99	33 Å²	33	43%	0.43	17%	0.169	S	C	.	.	H	α-helix	trans	-59.4	-40.5	175.2	-76.3	172	179.8	171.5	0	112.5	N776 E777 N784	N776-K780 PolarHBondContact ND2-NZ 3.15Å; N776-K780 WeakPolarHBondContact O-CB 3.34Å; N776-K780 VanDerWaalsContact O-CG 3.28Å; N776-K780 WeakPolarHBondContact O-CG 3.31Å; N776-K780 PolarHBondContact O-N 3.4Å; N776-K780 WeakPolarHBondContact OD1-CE 3.25Å; E777-K780 PolarHBondContact O-N 3.3Å; K780-N784 WeakPolarHBondContact O-CB 3.45Å; K780-N784 PolarHBondContact O-N 3.01Å
781	S	89	Confident	86.7	Confident	35 Å²	35	36.5 Å²	36.5	25%	0.245	18%	0.183	C	C	.	.	H	α-helix	trans	-65	-54.5	176.5	-173	0	0	0	0	110.6	E777 L778 L779 F783 N784 Q787	E777-S781 VanDerWaalsContact O-CB 3.25Å; E777-S781 WeakPolarHBondContact O-CB 3.44Å; E777-S781 PolarHBondContact O-N 2.86Å; L778-S781 PolarHBondContact O-N 3.13Å; L779-S781 VanDerWaalsContact C-N 3.28Å; L779-S781 PolarHBondContact O-N 2.88Å; S781-F783 PolarHBondContact O-N 3.4Å; S781-N784 WeakPolarHBondContact O-CB 3.29Å; S781-N784 PolarHBondContact O-N 3.4Å; S781-N784 VanDerWaalsContact O-N 3.14Å; S781-Q787 PolarHBondContact O-NE2 3.29Å; S781-Q787 VanDerWaalsContact O-NE2 3.13Å; S781-Q787 PolarHBondContact O-OE1 3.33Å; S781-Q787 PolarHBondContact OG-NE2 3.14Å
782	G	89	Confident	87.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.8	-28.2	-174.7	0	0	0	0	0	116	L778 L779	L778-G782 PolarHBondContact O-N 3.28Å; L779-G782 PolarHBondContact O-N 3.49Å
783	F	91.1	Very high	87.5	Confident	5 Å²	5	36.4 Å²	36.4	2%	0.022	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	4	175.8	-72.5	-85.7	0	0	0	113.1	L779 S781 P785 F790 L798 L819 L835 F837 F937	L779-F783 HydrophobicContact CB-CD2 4.43Å; L779-F783 HydrophobicContact CD2-CD2 4.05Å; L779-F783 HydrophobicContact CD2-CE2 3.52Å; L779-F783 WeakPolarHBondContact O-CB 3.48Å; L779-F783 VanDerWaalsContact O-CD2 3.25Å; L779-F783 WeakPolarHBondContact O-CD2 3.45Å; L779-F783 PolarHBondContact O-N 3.49Å; S781-F783 PolarHBondContact O-N 3.4Å; F783-P785 WeakPolarHBondContact O-CD 3.39Å; F783-F790 HydrophobicContact CD1-CD1 4.02Å; F783-F790 AromaticContact CD1-CD2 3.64Å; F783-F790 HydrophobicContact CD1-CD2 3.64Å; F783-F790 AromaticContact CD1-CE1 3.9Å; F783-F790 HydrophobicContact CD1-CE1 3.9Å; F783-F790 AromaticContact CD1-CE2 3.51Å; F783-F790 HydrophobicContact CD1-CE2 3.51Å; F783-F790 AromaticContact CD1-CG 3.93Å; F783-F790 HydrophobicContact CD1-CG 3.93Å; F783-F790 AromaticContact CD1-CZ 3.65Å; F783-F790 HydrophobicContact CD1-CZ 3.65Å; F783-F790 HydrophobicContact CE1-CD1 4.34Å; F783-F790 HydrophobicContact CE1-CD2 4.12Å; F783-F790 AromaticContact CE1-CE1 3.74Å; F783-F790 HydrophobicContact CE1-CE1 3.74Å; F783-F790 AromaticContact CE1-CE2 3.49Å; F783-F790 HydrophobicContact CE1-CE2 3.49Å; F783-F790 VanDerWaalsContact CE1-CE2 3.49Å; F783-F790 AromaticContact CE1-CZ 3.27Å; F783-F790 HydrophobicContact CE1-CZ 3.27Å; F783-F790 HydrophobicContact CG-CD2 4.4Å; F783-F790 HydrophobicContact CG-CE2 4.44Å; F783-F790 HydrophobicContact CZ-CE2 4.4Å; F783-F790 HydrophobicContact CZ-CZ 4.29Å; F783-L798 HydrophobicContact CB-CD1 4.15Å; F783-L819 HydrophobicContact CE2-CD2 4.22Å; F783-L819 HydrophobicContact CZ-CB 4.35Å; F783-L835 HydrophobicContact CB-CD2 3.73Å; F783-L835 HydrophobicContact CD2-CD1 3.6Å; F783-L835 HydrophobicContact CD2-CD2 4.07Å; F783-L835 HydrophobicContact CE2-CD1 3.73Å; F783-L835 HydrophobicContact CG-CD1 4.03Å; F783-L835 HydrophobicContact CG-CD2 3.94Å; F783-L835 HydrophobicContact CZ-CD1 4.21Å; F783-F837 AromaticContact CD1-CE1 3.7Å; F783-F837 HydrophobicContact CD1-CE1 3.7Å; F783-F837 AromaticContact CD1-CZ 3.92Å; F783-F837 HydrophobicContact CD1-CZ 3.92Å; F783-F837 AromaticContact CE1-CE1 3.37Å; F783-F837 HydrophobicContact CE1-CE1 3.37Å; F783-F837 AromaticContact CE1-CZ 3.4Å; F783-F837 HydrophobicContact CE1-CZ 3.4Å; F783-F837 HydrophobicContact CZ-CE1 4.22Å; F783-F837 AromaticContact CZ-CZ 3.79Å; F783-F837 HydrophobicContact CZ-CZ 3.79Å; F783-F937 AromaticContact CE1-CE2 3.96Å; F783-F937 HydrophobicContact CE1-CE2 3.96Å; F783-F937 HydrophobicContact CE1-CZ 4.25Å; F783-F937 AromaticContact CZ-CE2 3.67Å; F783-F937 HydrophobicContact CZ-CE2 3.67Å; F783-F937 AromaticContact CZ-CZ 3.91Å; F783-F937 HydrophobicContact CZ-CZ 3.91Å
784	N	88.4	Confident	87.6	Confident	60 Å²	60	41.9 Å²	41.9	32%	0.321	22%	0.22	S	C	.	.			trans	-66	124.9	176.1	-170.7	-26	0	0	0	109.9	K780 S781 N786 Q787	K780-N784 WeakPolarHBondContact O-CB 3.45Å; K780-N784 PolarHBondContact O-N 3.01Å; S781-N784 WeakPolarHBondContact O-CB 3.29Å; S781-N784 PolarHBondContact O-N 3.4Å; S781-N784 VanDerWaalsContact O-N 3.14Å; N784-N786 PolarHBondContact O-N 2.91Å; N784-N786 VanDerWaalsContact O-N 3.07Å; N784-N786 WeakPolarHBondContact OD1-CB 3.39Å; N784-N786 PolarHBondContact OD1-N 3.21Å; N784-Q787 HydrophobicContact CB-CG 4.4Å; N784-Q787 PolarHBondContact O-N 3.15Å
785	P	86.5	Confident	87.3	Confident	52 Å²	52	49.1 Å²	49.1	34%	0.338	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-56.1	-27.7	178.1	-26.9	35.7	0	0	0	114.2	F783 Q787 G788 F790 T792 L798	F783-P785 WeakPolarHBondContact O-CD 3.39Å; P785-Q787 PolarHBondContact O-N 3.38Å; P785-G788 PolarHBondContact O-N 3.36Å; P785-G788 VanDerWaalsContact O-N 3.13Å; P785-F790 VanDerWaalsContact CA-O 3.3Å; P785-F790 WeakPolarHBondContact CA-O 3.34Å; P785-T792 HydrophobicContact CG-CG2 3.8Å; P785-L798 HydrophobicContact CG-CD2 4.08Å
786	N	85.8	Confident	87.1	Confident	150 Å²	150	50.8 Å²	50.8	80%	0.802	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-68.9	-19.4	179.1	-63.4	-21.6	0	0	0	113.5	N784 G788	N784-N786 PolarHBondContact O-N 2.91Å; N784-N786 VanDerWaalsContact O-N 3.07Å; N784-N786 WeakPolarHBondContact OD1-CB 3.39Å; N784-N786 PolarHBondContact OD1-N 3.21Å; N786-G788 VanDerWaalsContact C-N 3.27Å
787	Q	82.6	Confident	87.4	Confident	64 Å²	64	52 Å²	52	30%	0.299	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-77.9	-12.7	173.9	-70.8	-162.3	-5.2	0	0	113.1	S781 N784 P785 F789	S781-Q787 PolarHBondContact O-NE2 3.29Å; S781-Q787 VanDerWaalsContact O-NE2 3.13Å; S781-Q787 PolarHBondContact O-OE1 3.33Å; S781-Q787 PolarHBondContact OG-NE2 3.14Å; N784-Q787 HydrophobicContact CB-CG 4.4Å; N784-Q787 PolarHBondContact O-N 3.15Å; P785-Q787 PolarHBondContact O-N 3.38Å; Q787-F789 HydrophobicContact CB-CD2 3.91Å; Q787-F789 HydrophobicContact CB-CE2 4.21Å; Q787-F789 PolarHBondContact O-N 3.15Å
788	G	85.4	Confident	87.6	Confident	10 Å²	10	49.8 Å²	49.8	10%	0.103	27%	0.268	C	S	.	.	S	Bend	trans	86.6	-6.3	176.1	0	0	0	0	0	115.7	P785 N786 N801	P785-G788 PolarHBondContact O-N 3.36Å; P785-G788 VanDerWaalsContact O-N 3.13Å; N786-G788 VanDerWaalsContact C-N 3.27Å; G788-N801 VanDerWaalsContact O-CB 3.28Å; G788-N801 WeakPolarHBondContact O-CB 3.2Å; G788-N801 PolarHBondContact O-ND2 3.39Å
789	F	89.5	Confident	87.7	Confident	11 Å²	11	51 Å²	51	5%	0.048	27%	0.273	C	S	.	.	S	Bend	trans	-78.4	-34.3	175.8	-58.6	-63	0	0	0	113.3	Y731 Q787 N801 V808 H815 Y816 L819	Y731-F789 AromaticContact CE1-CE2 3.99Å; Y731-F789 HydrophobicContact CE1-CE2 3.99Å; Y731-F789 HydrophobicContact CE1-CZ 4.29Å; Y731-F789 AromaticContact CZ-CE2 3.75Å; Y731-F789 WeakPolarHBondContact OH-CE2 3.25Å; Q787-F789 HydrophobicContact CB-CD2 3.91Å; Q787-F789 HydrophobicContact CB-CE2 4.21Å; Q787-F789 PolarHBondContact O-N 3.15Å; F789-N801 PolarHBondContact O-N 2.93Å; F789-V808 HydrophobicContact CD1-CG2 4.36Å; F789-V808 HydrophobicContact CE1-CB 4.46Å; F789-V808 HydrophobicContact CE1-CG1 4.18Å; F789-V808 HydrophobicContact CE1-CG2 3.76Å; F789-V808 HydrophobicContact CZ-CG2 4.33Å; F789-H815 HydrophobicContact CD1-CB 4.08Å; F789-H815 HydrophobicContact CE1-CB 3.45Å; F789-H815 VanDerWaalsContact CE1-CB 3.45Å; F789-H815 AromaticContact CE1-CG 3.6Å; F789-H815 HydrophobicContact CZ-CB 3.87Å; F789-H815 AromaticContact CZ-CG 3.65Å; F789-H815 AromaticContact CZ-ND1 3.65Å; F789-Y816 VanDerWaalsContact O-CZ 3.3Å; F789-Y816 PolarHBondContact O-OH 2.94Å; F789-L819 HydrophobicContact CB-CD1 4.34Å; F789-L819 HydrophobicContact CD2-CD1 4.43Å; F789-L819 HydrophobicContact CG-CD1 4.39Å
790	F	92.4	Very high	87.8	Confident	2 Å²	2	51 Å²	51	1%	0.009	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	153.1	-179.1	-75.5	-95.7	0	0	0	110.4	F783 P785 L798 Y799 P800 Y816 L819 F837 F841 F937	F783-F790 HydrophobicContact CD1-CD1 4.02Å; F783-F790 AromaticContact CD1-CD2 3.64Å; F783-F790 HydrophobicContact CD1-CD2 3.64Å; F783-F790 AromaticContact CD1-CE1 3.9Å; F783-F790 HydrophobicContact CD1-CE1 3.9Å; F783-F790 AromaticContact CD1-CE2 3.51Å; F783-F790 HydrophobicContact CD1-CE2 3.51Å; F783-F790 AromaticContact CD1-CG 3.93Å; F783-F790 HydrophobicContact CD1-CG 3.93Å; F783-F790 AromaticContact CD1-CZ 3.65Å; F783-F790 HydrophobicContact CD1-CZ 3.65Å; F783-F790 HydrophobicContact CE1-CD1 4.34Å; F783-F790 HydrophobicContact CE1-CD2 4.12Å; F783-F790 AromaticContact CE1-CE1 3.74Å; F783-F790 HydrophobicContact CE1-CE1 3.74Å; F783-F790 AromaticContact CE1-CE2 3.49Å; F783-F790 HydrophobicContact CE1-CE2 3.49Å; F783-F790 VanDerWaalsContact CE1-CE2 3.49Å; F783-F790 AromaticContact CE1-CZ 3.27Å; F783-F790 HydrophobicContact CE1-CZ 3.27Å; F783-F790 HydrophobicContact CG-CD2 4.4Å; F783-F790 HydrophobicContact CG-CE2 4.44Å; F783-F790 HydrophobicContact CZ-CE2 4.4Å; F783-F790 HydrophobicContact CZ-CZ 4.29Å; P785-F790 VanDerWaalsContact CA-O 3.3Å; P785-F790 WeakPolarHBondContact CA-O 3.34Å; F790-L798 HydrophobicContact CB-CD2 4.23Å; F790-L798 HydrophobicContact CD1-CB 4.4Å; F790-Y799 CarbonylContact C-O 3.53Å; F790-Y799 WeakPolarHBondContact CA-O 3.41Å; F790-Y799 VanDerWaalsContact CD1-C 3.45Å; F790-Y799 WeakPolarHBondContact CD1-O 3.31Å; F790-P800 HydrophobicContact CE1-CG 4.21Å; F790-Y816 HydrophobicContact CE2-CD1 4.26Å; F790-Y816 AromaticContact CE2-CE1 3.87Å; F790-Y816 HydrophobicContact CE2-CE1 3.87Å; F790-Y816 HydrophobicContact CZ-CD1 4.13Å; F790-Y816 AromaticContact CZ-CE1 3.85Å; F790-Y816 HydrophobicContact CZ-CE1 3.85Å; F790-L819 HydrophobicContact CD2-CD1 4.46Å; F790-L819 HydrophobicContact CE2-CD1 3.76Å; F790-F837 HydrophobicContact CE1-CE1 4.32Å; F790-F841 HydrophobicContact CE1-CE1 4.21Å; F790-F841 HydrophobicContact CE1-CZ 4.26Å; F790-F937 HydrophobicContact CZ-CD2 4.31Å; F790-F937 HydrophobicContact CZ-CE2 4.11Å
791	K	89.9	Confident	88	Confident	101 Å²	101	47.1 Å²	47.1	44%	0.439	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	155.7	173.5	-171.2	167.6	176	-177.3	0	109	L798 Y799 N801	K791-L798 WeakPolarHBondContact O-CA 3.22Å; K791-Y799 HydrophobicContact CB-CE1 4.08Å; K791-Y799 HydrophobicContact CB-CE2 4.16Å; K791-Y799 WeakPolarHBondContact CD-OH 3.46Å; K791-Y799 HydrophobicContact CG-CE1 4.22Å; K791-Y799 PolarHBondContact N-O 3.44Å; K791-Y799 WeakPolarHBondContact O-CD1 3.47Å; K791-Y799 PolarHBondContact O-N 2.92Å; K791-N801 HydrophobicContact CB-CB 4.39Å
792	T	89.8	Confident	87.9	Confident	62 Å²	62	46.7 Å²	46.7	38%	0.38	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	143.6	177.2	48.2	0	0	0	0	111.4	P785 L797 L798	P785-T792 HydrophobicContact CG-CG2 3.8Å; T792-L797 CarbonylContact C-O 3.53Å; T792-L797 VanDerWaalsContact CA-O 3.28Å; T792-L797 WeakPolarHBondContact CA-O 3.22Å; T792-L798 HydrophobicContact CG2-CD2 3.89Å
793	T	87.3	Confident	87.7	Confident	11 Å²	11	47 Å²	47	7%	0.067	26%	0.256	C	S	.	.			trans	-74.5	176.1	165.9	66.6	0	0	0	0	110.2	E795 G796 L797 Y799 A838 F840	T793-E795 PolarHBondContact O-N 2.96Å; T793-E795 VanDerWaalsContact O-N 3.09Å; T793-E795 PolarHBondContact OG1-N 3.43Å; T793-G796 PolarHBondContact O-N 2.88Å; T793-L797 HydrophobicContact CG2-CB 4.36Å; T793-L797 PolarHBondContact N-O 2.98Å; T793-L797 WeakPolarHBondContact OG1-CB 3.32Å; T793-L797 PolarHBondContact OG1-N 3.36Å; T793-Y799 HydrophobicContact CG2-CD1 3.67Å; T793-Y799 HydrophobicContact CG2-CE1 3.76Å; T793-A838 HydrophobicContact CG2-CB 4.31Å; T793-F840 HydrophobicContact CG2-CE1 4.5Å
794	N	80.2	Confident	87.5	Confident	141 Å²	141	46.8 Å²	46.8	75%	0.754	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-24	174.3	-62.9	-14.5	0	0	0	113.1
795	E	79.8	Confident	87.3	Confident	152 Å²	152	48.6 Å²	48.6	71%	0.71	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	4.5	178.9	-62.2	179	177	0	0	112.9	T793 L797	T793-E795 PolarHBondContact O-N 2.96Å; T793-E795 VanDerWaalsContact O-N 3.09Å; T793-E795 PolarHBondContact OG1-N 3.43Å; E795-L797 HydrophobicContact CB-CG 4.23Å
796	G	83.6	Confident	87	Confident	37 Å²	37	50.7 Å²	50.7	38%	0.381	27%	0.268	S	S	.	.	S	Bend	trans	79.1	14.3	-178.2	0	0	0	0	0	114.7	T793	T793-G796 PolarHBondContact O-N 2.88Å
797	L	89.4	Confident	86.6	Confident	42 Å²	42	47.5 Å²	47.5	22%	0.22	25%	0.25	C	S	.	.			trans	-85.3	137	179.5	-54.1	177.2	0	0	0	111.6	T792 T793 E795 P836 A838	T792-L797 CarbonylContact C-O 3.53Å; T792-L797 VanDerWaalsContact CA-O 3.28Å; T792-L797 WeakPolarHBondContact CA-O 3.22Å; T793-L797 HydrophobicContact CG2-CB 4.36Å; T793-L797 PolarHBondContact N-O 2.98Å; T793-L797 WeakPolarHBondContact OG1-CB 3.32Å; T793-L797 PolarHBondContact OG1-N 3.36Å; E795-L797 HydrophobicContact CB-CG 4.23Å; L797-P836 CarbonylContact C-O 3.31Å; L797-P836 WeakPolarHBondContact CA-O 3.34Å; L797-P836 HydrophobicContact CD2-CB 3.99Å; L797-A838 HydrophobicContact CB-CB 4.01Å
798	L	91.8	Very high	86.4	Confident	12 Å²	12	46.5 Å²	46.5	6%	0.063	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	134.3	-175.3	-64.9	168.8	0	0	0	112.4	F783 P785 F790 K791 T792 L835 P836 F837 A838	F783-L798 HydrophobicContact CB-CD1 4.15Å; P785-L798 HydrophobicContact CG-CD2 4.08Å; F790-L798 HydrophobicContact CB-CD2 4.23Å; F790-L798 HydrophobicContact CD1-CB 4.4Å; K791-L798 WeakPolarHBondContact O-CA 3.22Å; T792-L798 HydrophobicContact CG2-CD2 3.89Å; L798-L835 HydrophobicContact CD1-CD2 4.34Å; L798-P836 PolarHBondContact N-O 2.93Å; L798-F837 HydrophobicContact CB-CD1 4.09Å; L798-F837 HydrophobicContact CB-CE1 4.46Å; L798-A838 PolarHBondContact O-N 3.48Å
799	Y	92.2	Very high	86.1	Confident	25 Å²	25	47.5 Å²	47.5	10%	0.098	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	158.7	169.1	67.2	-83.9	0	0	0	111.2	F790 K791 T793 N801 F840 L860	F790-Y799 CarbonylContact C-O 3.53Å; F790-Y799 WeakPolarHBondContact CA-O 3.41Å; F790-Y799 VanDerWaalsContact CD1-C 3.45Å; F790-Y799 WeakPolarHBondContact CD1-O 3.31Å; K791-Y799 HydrophobicContact CB-CE1 4.08Å; K791-Y799 HydrophobicContact CB-CE2 4.16Å; K791-Y799 WeakPolarHBondContact CD-OH 3.46Å; K791-Y799 HydrophobicContact CG-CE1 4.22Å; K791-Y799 PolarHBondContact N-O 3.44Å; K791-Y799 WeakPolarHBondContact O-CD1 3.47Å; K791-Y799 PolarHBondContact O-N 2.92Å; T793-Y799 HydrophobicContact CG2-CD1 3.67Å; T793-Y799 HydrophobicContact CG2-CE1 3.76Å; Y799-N801 PolarHBondContact O-N 3.38Å; Y799-F840 HydrophobicContact CD1-CZ 4.3Å; Y799-F840 HydrophobicContact CD2-CZ 4.01Å; Y799-F840 HydrophobicContact CG-CE1 4.39Å; Y799-F840 AromaticContact CG-CZ 3.66Å; Y799-F840 HydrophobicContact CG-CZ 3.66Å; Y799-L860 HydrophobicContact CD2-CD1 4.11Å; Y799-L860 HydrophobicContact CE1-CD1 4.28Å; Y799-L860 HydrophobicContact CE2-CD1 3.87Å; Y799-L860 HydrophobicContact CG-CD1 4.43Å
800	P	92.5	Very high	85.5	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	131.4	179.2	-25.3	34.6	0	0	0	112.1	F790 P802 Y816 F841 H933	F790-P800 HydrophobicContact CE1-CG 4.21Å; P800-P802 VanDerWaalsContact O-CD 3.26Å; P800-P802 WeakPolarHBondContact O-CD 3.46Å; P800-Y816 HydrophobicContact CB-CE1 3.82Å; P800-Y816 HydrophobicContact CG-CE1 4.39Å; P800-F841 VanDerWaalsContact CD-CD2 3.43Å; P800-F841 HydrophobicContact CG-CD2 3.62Å; P800-F841 HydrophobicContact CG-CE2 3.36Å; P800-F841 HydrophobicContact CG-CG 4.43Å; P800-F841 HydrophobicContact CG-CZ 3.99Å; P800-H933 HydrophobicContact CB-CB 3.83Å; P800-H933 HydrophobicContact CG-CB 4.49Å
801	N	91	Very high	85.1	Confident	18 Å²	18	55.8 Å²	55.8	10%	0.096	31%	0.307	C	S	.	.			trans	-71.2	117.5	176.9	-179.1	14.8	0	0	0	110.4	G788 F789 K791 Y799 A803 A804 L807 Y816	G788-N801 VanDerWaalsContact O-CB 3.28Å; G788-N801 WeakPolarHBondContact O-CB 3.2Å; G788-N801 PolarHBondContact O-ND2 3.39Å; F789-N801 PolarHBondContact O-N 2.93Å; K791-N801 HydrophobicContact CB-CB 4.39Å; Y799-N801 PolarHBondContact O-N 3.38Å; N801-A803 PolarHBondContact O-N 3.05Å; N801-A803 PolarHBondContact OD1-N 3.16Å; N801-A803 VanDerWaalsContact OD1-N 3.16Å; N801-A804 HydrophobicContact CB-CB 4.43Å; N801-A804 VanDerWaalsContact O-CB 3.26Å; N801-A804 WeakPolarHBondContact O-CB 3.49Å; N801-A804 PolarHBondContact O-N 3.02Å; N801-A804 VanDerWaalsContact O-N 3.11Å; N801-L807 WeakPolarHBondContact ND2-CD1 3.3Å; N801-Y816 PolarHBondContact N-OH 3.25Å
802	P	87.3	Confident	85	Confident	25 Å²	25	51.5 Å²	51.5	16%	0.162	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-27.9	176.9	-26.3	36.9	0	0	0	114.6	P800 A804 Q929 I930	P800-P802 VanDerWaalsContact O-CD 3.26Å; P800-P802 WeakPolarHBondContact O-CD 3.46Å; P802-A804 VanDerWaalsContact C-N 3.29Å; P802-A804 PolarHBondContact O-N 3.02Å; P802-Q929 HydrophobicContact CB-CG 3.88Å; P802-Q929 VanDerWaalsContact CB-NE2 3.34Å; P802-Q929 HydrophobicContact CG-CG 4.4Å; P802-I930 HydrophobicContact CG-CG2 3.96Å
803	A	85.8	Confident	85	Confident	7 Å²	7	50.9 Å²	50.9	6%	0.058	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	7.8	-179.1	0	0	0	0	0	113.3	N801 E805 M806 L807 D891	N801-A803 PolarHBondContact O-N 3.05Å; N801-A803 PolarHBondContact OD1-N 3.16Å; N801-A803 VanDerWaalsContact OD1-N 3.16Å; A803-E805 PolarHBondContact O-N 3.05Å; A803-M806 PolarHBondContact O-N 3.14Å; A803-M806 VanDerWaalsContact O-N 3.13Å; A803-L807 PolarHBondContact O-N 3.17Å; A803-D891 HydrophobicContact CB-CB 3.99Å
804	A	86	Confident	85.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.3	-33.9	-178.2	0	0	0	0	0	112.7	N801 P802 M806 L807 V808 Y816	N801-A804 HydrophobicContact CB-CB 4.43Å; N801-A804 VanDerWaalsContact O-CB 3.26Å; N801-A804 WeakPolarHBondContact O-CB 3.49Å; N801-A804 PolarHBondContact O-N 3.02Å; N801-A804 VanDerWaalsContact O-N 3.11Å; P802-A804 VanDerWaalsContact C-N 3.29Å; P802-A804 PolarHBondContact O-N 3.02Å; A804-M806 VanDerWaalsContact C-N 3.32Å; A804-M806 PolarHBondContact O-N 3.34Å; A804-L807 PolarHBondContact O-N 2.99Å; A804-V808 PolarHBondContact O-N 3.45Å; A804-Y816 HydrophobicContact CB-CE2 3.97Å; A804-Y816 WeakPolarHBondContact CB-OH 3.38Å
805	E	84.4	Confident	85.8	Confident	99 Å²	99	51.7 Å²	51.7	46%	0.463	28%	0.277	S	S	.	.	H	α-helix	trans	-59.6	-40.8	175.4	-176.2	170.8	-166.9	0	0	112	A803 G809 F812	A803-E805 PolarHBondContact O-N 3.05Å; E805-G809 WeakPolarHBondContact O-CA 3.29Å; E805-G809 PolarHBondContact O-N 3.43Å; E805-F812 HydrophobicContact CB-CD1 3.88Å; E805-F812 HydrophobicContact CB-CE1 3.79Å; E805-F812 HydrophobicContact CB-CG 4.35Å; E805-F812 HydrophobicContact CB-CZ 4.19Å; E805-F812 HydrophobicContact CG-CD1 3.95Å; E805-F812 HydrophobicContact CG-CE1 3.64Å; E805-F812 HydrophobicContact CG-CZ 4.35Å
806	M	79.4	Confident	86.4	Confident	96 Å²	96	44.4 Å²	44.4	47%	0.473	24%	0.243	S	C	.	.	H	α-helix	trans	-72.1	-29.2	177.3	-62.5	178.7	73.1	0	0	112.8	A803 A804 D891 L892 E894	A803-M806 PolarHBondContact O-N 3.14Å; A803-M806 VanDerWaalsContact O-N 3.13Å; A804-M806 VanDerWaalsContact C-N 3.32Å; A804-M806 PolarHBondContact O-N 3.34Å; M806-D891 HydrophobicContact SD-CB 4.24Å; M806-L892 HydrophobicContact CB-CD1 4.45Å; M806-E894 WeakPolarHBondContact CE-OE2 3.31Å
807	L	78.4	Confident	86.9	Confident	83 Å²	83	45.3 Å²	45.3	44%	0.435	24%	0.235	S	C	.	.	H	α-helix	trans	-82.3	-39.5	-176.5	-70.7	170.2	0	0	0	113.1	N801 A803 A804 L892	N801-L807 WeakPolarHBondContact ND2-CD1 3.3Å; A803-L807 PolarHBondContact O-N 3.17Å; A804-L807 PolarHBondContact O-N 2.99Å; L807-L892 HydrophobicContact CD2-CD1 3.66Å; L807-L892 HydrophobicContact CD2-CD2 4.46Å; L807-L892 HydrophobicContact CG-CD1 4.13Å
808	V	77.5	Confident	87.1	Confident	43 Å²	43	43.3 Å²	43.3	26%	0.261	23%	0.225	S	C	.	.	H	α-helix	trans	-114	-8.2	-169.6	-170.2	0	0	0	0	111.8	F789 A804 S811 F812	F789-V808 HydrophobicContact CD1-CG2 4.36Å; F789-V808 HydrophobicContact CE1-CB 4.46Å; F789-V808 HydrophobicContact CE1-CG1 4.18Å; F789-V808 HydrophobicContact CE1-CG2 3.76Å; F789-V808 HydrophobicContact CZ-CG2 4.33Å; A804-V808 PolarHBondContact O-N 3.45Å; V808-S811 PolarHBondContact O-OG 2.9Å; V808-F812 HydrophobicContact CB-CB 4.34Å
809	G	80	Confident	87.2	Confident	30 Å²	30	42.8 Å²	42.8	31%	0.309	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	71.5	-163.2	-175.8	0	0	0	0	0	112.3	E805 S811 F812	E805-G809 WeakPolarHBondContact O-CA 3.29Å; E805-G809 PolarHBondContact O-N 3.43Å; G809-S811 PolarHBondContact O-N 2.78Å; G809-F812 WeakPolarHBondContact O-CD1 2.97Å; G809-F812 PolarHBondContact O-N 3.49Å; G809-F812 VanDerWaalsContact O-N 3.09Å
810	D	76.9	Confident	87.3	Confident	145 Å²	145	41.6 Å²	41.6	78%	0.775	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-59.8	-15.4	-172.2	-60	-24.9	0	0	0	114.7	F812	D810-F812 VanDerWaalsContact C-N 3.32Å; D810-F812 PolarHBondContact O-N 3.09Å
811	S	83.3	Confident	87.4	Confident	42 Å²	42	41.6 Å²	41.6	29%	0.294	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-80.5	-6.6	179.1	66.2	0	0	0	0	114	V808 G809 T813 R814 H815	V808-S811 PolarHBondContact O-OG 2.9Å; G809-S811 PolarHBondContact O-N 2.78Å; S811-T813 PolarHBondContact O-N 2.81Å; S811-T813 VanDerWaalsContact O-N 3.11Å; S811-R814 WeakPolarHBondContact O-CB 2.99Å; S811-R814 PolarHBondContact O-N 2.95Å; S811-H815 PolarHBondContact O-CD2 2.68Å; S811-H815 PolarHBondContact O-N 3.42Å
812	F	88.6	Confident	87.5	Confident	11 Å²	11	40.9 Å²	40.9	5%	0.048	21%	0.213	C	C	.	.	H	α-helix	trans	-53.2	-39	-176.2	79.8	-84.7	0	0	0	112.7	E805 V808 G809 D810 R814 H815 Y816 P932 H933	E805-F812 HydrophobicContact CB-CD1 3.88Å; E805-F812 HydrophobicContact CB-CE1 3.79Å; E805-F812 HydrophobicContact CB-CG 4.35Å; E805-F812 HydrophobicContact CB-CZ 4.19Å; E805-F812 HydrophobicContact CG-CD1 3.95Å; E805-F812 HydrophobicContact CG-CE1 3.64Å; E805-F812 HydrophobicContact CG-CZ 4.35Å; V808-F812 HydrophobicContact CB-CB 4.34Å; G809-F812 WeakPolarHBondContact O-CD1 2.97Å; G809-F812 PolarHBondContact O-N 3.49Å; G809-F812 VanDerWaalsContact O-N 3.09Å; D810-F812 VanDerWaalsContact C-N 3.32Å; D810-F812 PolarHBondContact O-N 3.09Å; F812-R814 VanDerWaalsContact C-N 3.29Å; F812-R814 PolarHBondContact O-N 3.44Å; F812-H815 WeakPolarHBondContact O-CB 3.37Å; F812-H815 PolarHBondContact O-N 2.56Å; F812-H815 VanDerWaalsContact O-N 3.14Å; F812-Y816 HydrophobicContact CD2-CD2 4.01Å; F812-Y816 AromaticContact CD2-CE2 3.96Å; F812-Y816 HydrophobicContact CD2-CE2 3.96Å; F812-Y816 WeakPolarHBondContact O-CD2 3.42Å; F812-Y816 PolarHBondContact O-N 2.77Å; F812-Y816 VanDerWaalsContact O-N 3.09Å; F812-P932 HydrophobicContact CE2-CB 4.39Å; F812-P932 HydrophobicContact CE2-CG 4.44Å; F812-P932 HydrophobicContact CZ-CB 4.26Å; F812-P932 HydrophobicContact CZ-CG 4.3Å; F812-H933 AromaticContact CD2-CD2 3.68Å; F812-H933 AromaticContact CD2-NE2 3.75Å; F812-H933 AromaticContact CE2-CD2 3.56Å; F812-H933 AromaticContact CE2-CE1 3.84Å; F812-H933 AromaticContact CE2-CG 3.99Å; F812-H933 AromaticContact CE2-NE2 3.44Å; F812-H933 WeakPolarHBondContact CE2-NE2 3.39Å
813	T	90.8	Very high	87.8	Confident	50 Å²	50	39.9 Å²	39.9	31%	0.307	21%	0.206	S	C	.	.	H	α-helix	trans	-59.9	-37.5	178	55.8	0	0	0	0	112.4	S811 Y816 Y817 A936	S811-T813 PolarHBondContact O-N 2.81Å; S811-T813 VanDerWaalsContact O-N 3.11Å; T813-Y816 PolarHBondContact O-N 2.94Å; T813-Y817 WeakPolarHBondContact O-CB 3.43Å; T813-Y817 PolarHBondContact O-N 3.49Å; T813-A936 WeakPolarHBondContact O-CB 3.3Å
814	R	90.7	Very high	88.2	Confident	145 Å²	145	39.5 Å²	39.5	55%	0.547	20%	0.204	S	C	.	.	H	α-helix	trans	-66.7	-37.8	177.1	-58.8	-175.5	-177	-161.2	0.4	111.5	Y735 E741 S811 F812 Y817 F818	Y735-R814 VanDerWaalsContact OH-CB 3.23Å; Y735-R814 WeakPolarHBondContact OH-CB 3.23Å; E741-R814 IonicContact OE1-NH1 3.48Å; S811-R814 WeakPolarHBondContact O-CB 2.99Å; S811-R814 PolarHBondContact O-N 2.95Å; F812-R814 VanDerWaalsContact C-N 3.29Å; F812-R814 PolarHBondContact O-N 3.44Å; R814-Y817 PolarHBondContact O-N 2.9Å; R814-F818 WeakPolarHBondContact O-CB 3.36Å; R814-F818 PolarHBondContact O-N 3.1Å
815	H	91.6	Very high	88.5	Confident	23 Å²	23	39.6 Å²	39.6	11%	0.106	20%	0.204	C	C	.	.	H	α-helix	trans	-65.8	-43.5	175	-73.6	-79.7	0	0	0	112.4	Y731 Y735 F789 S811 F812 Y817 F818 L819	Y731-H815 AromaticContact CE1-ND1 3.72Å; Y731-H815 AromaticContact CZ-ND1 3.8Å; Y731-H815 PolarHBondContact OH-ND1 3.17Å; Y735-H815 AromaticContact CD1-CE1 3.96Å; Y735-H815 AromaticContact CD2-CE1 3.96Å; Y735-H815 AromaticContact CD2-ND1 3.79Å; Y735-H815 AromaticContact CE1-CE1 3.77Å; Y735-H815 AromaticContact CE2-CE1 3.8Å; Y735-H815 AromaticContact CE2-ND1 3.67Å; Y735-H815 AromaticContact CZ-CE1 3.69Å; Y735-H815 AromaticContact CZ-NE2 3.88Å; F789-H815 HydrophobicContact CD1-CB 4.08Å; F789-H815 HydrophobicContact CE1-CB 3.45Å; F789-H815 VanDerWaalsContact CE1-CB 3.45Å; F789-H815 AromaticContact CE1-CG 3.6Å; F789-H815 HydrophobicContact CZ-CB 3.87Å; F789-H815 AromaticContact CZ-CG 3.65Å; F789-H815 AromaticContact CZ-ND1 3.65Å; S811-H815 PolarHBondContact O-CD2 2.68Å; S811-H815 PolarHBondContact O-N 3.42Å; F812-H815 WeakPolarHBondContact O-CB 3.37Å; F812-H815 PolarHBondContact O-N 2.56Å; F812-H815 VanDerWaalsContact O-N 3.14Å; H815-Y817 PolarHBondContact O-N 2.92Å; H815-F818 PolarHBondContact O-N 3.31Å; H815-L819 WeakPolarHBondContact O-CB 3.21Å; H815-L819 WeakPolarHBondContact O-CG 3.37Å; H815-L819 PolarHBondContact O-N 3.22Å
816	Y	93.9	Very high	88.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.8	-41.2	173.9	-78.1	-77.4	0	0	0	112.4	F789 F790 P800 N801 A804 F812 T813 F818 L819 G820 H933 F937	F789-Y816 VanDerWaalsContact O-CZ 3.3Å; F789-Y816 PolarHBondContact O-OH 2.94Å; F790-Y816 HydrophobicContact CE2-CD1 4.26Å; F790-Y816 AromaticContact CE2-CE1 3.87Å; F790-Y816 HydrophobicContact CE2-CE1 3.87Å; F790-Y816 HydrophobicContact CZ-CD1 4.13Å; F790-Y816 AromaticContact CZ-CE1 3.85Å; F790-Y816 HydrophobicContact CZ-CE1 3.85Å; P800-Y816 HydrophobicContact CB-CE1 3.82Å; P800-Y816 HydrophobicContact CG-CE1 4.39Å; N801-Y816 PolarHBondContact N-OH 3.25Å; A804-Y816 HydrophobicContact CB-CE2 3.97Å; A804-Y816 WeakPolarHBondContact CB-OH 3.38Å; F812-Y816 HydrophobicContact CD2-CD2 4.01Å; F812-Y816 AromaticContact CD2-CE2 3.96Å; F812-Y816 HydrophobicContact CD2-CE2 3.96Å; F812-Y816 WeakPolarHBondContact O-CD2 3.42Å; F812-Y816 PolarHBondContact O-N 2.77Å; F812-Y816 VanDerWaalsContact O-N 3.09Å; T813-Y816 PolarHBondContact O-N 2.94Å; Y816-F818 VanDerWaalsContact C-N 3.33Å; Y816-F818 PolarHBondContact O-N 3.4Å; Y816-L819 PolarHBondContact O-N 2.84Å; Y816-G820 PolarHBondContact O-N 3.34Å; Y816-H933 HydrophobicContact CD1-CB 4.44Å; Y816-H933 HydrophobicContact CD2-CB 4.25Å; Y816-H933 HydrophobicContact CE1-CB 4.28Å; Y816-H933 HydrophobicContact CE2-CB 4.12Å; Y816-H933 AromaticContact CE2-CD2 3.39Å; Y816-H933 WeakPolarHBondContact CE2-CD2 3.25Å; Y816-H933 HydrophobicContact CG-CB 4.41Å; Y816-H933 AromaticContact CZ-CD2 3.66Å; Y816-F937 HydrophobicContact CD1-CD2 4.36Å; Y816-F937 WeakPolarHBondContact O-CA 3.49Å; Y816-F937 WeakPolarHBondContact O-CD2 3.21Å
817	Y	93.9	Very high	89.3	Confident	55 Å²	55	30.9 Å²	30.9	22%	0.216	16%	0.162	C	C	.	.	H	α-helix	trans	-58.7	-45.8	173.9	179.6	-94.8	0	0	0	111.3	P740 T813 R814 H815 G820 R821 A936 Q939 G940	P740-Y817 HydrophobicContact CB-CE1 3.96Å; P740-Y817 HydrophobicContact CG-CD1 4.27Å; P740-Y817 HydrophobicContact CG-CE1 3.8Å; T813-Y817 WeakPolarHBondContact O-CB 3.43Å; T813-Y817 PolarHBondContact O-N 3.49Å; R814-Y817 PolarHBondContact O-N 2.9Å; H815-Y817 PolarHBondContact O-N 2.92Å; Y817-G820 PolarHBondContact O-N 2.94Å; Y817-R821 HydrophobicContact CD1-CG 4.47Å; Y817-R821 HydrophobicContact CE1-CG 4.16Å; Y817-R821 WeakPolarHBondContact O-CG 3.27Å; Y817-R821 PolarHBondContact O-N 2.93Å; Y817-A936 WeakPolarHBondContact CA-O 2.89Å; Y817-Q939 HydrophobicContact CD2-CB 3.84Å; Y817-Q939 HydrophobicContact CE2-CB 3.88Å; Y817-G940 VanDerWaalsContact CD2-N 3.32Å; Y817-G940 VanDerWaalsContact O-CA 3.29Å; Y817-G940 WeakPolarHBondContact O-CA 3.22Å
818	F	94.1	Very high	89.9	Confident	1 Å²	1	26.9 Å²	26.9	0%	0.004	14%	0.142	C	C	.	.	H	α-helix	trans	-60.5	-51.2	175.3	178.6	-106.8	0	0	0	112.4	A734 Y735 L738 L778 R814 H815 Y816 G820 R821 I822	A734-F818 HydrophobicContact CB-CZ 4.06Å; A734-F818 WeakPolarHBondContact O-CZ 3.39Å; Y735-F818 HydrophobicContact CD2-CB 3.83Å; Y735-F818 AromaticContact CD2-CD1 3.76Å; Y735-F818 HydrophobicContact CD2-CD1 3.76Å; Y735-F818 HydrophobicContact CD2-CD2 4.18Å; Y735-F818 HydrophobicContact CD2-CE1 4.36Å; Y735-F818 AromaticContact CD2-CG 3.66Å; Y735-F818 HydrophobicContact CD2-CG 3.66Å; Y735-F818 HydrophobicContact CE2-CB 3.94Å; Y735-F818 HydrophobicContact CE2-CG 4.27Å; L738-F818 HydrophobicContact CB-CE2 3.88Å; L738-F818 HydrophobicContact CB-CZ 4.45Å; L778-F818 HydrophobicContact CD1-CE1 4.39Å; L778-F818 HydrophobicContact CD2-CZ 4.31Å; R814-F818 WeakPolarHBondContact O-CB 3.36Å; R814-F818 PolarHBondContact O-N 3.1Å; H815-F818 PolarHBondContact O-N 3.31Å; Y816-F818 VanDerWaalsContact C-N 3.33Å; Y816-F818 PolarHBondContact O-N 3.4Å; F818-G820 VanDerWaalsContact C-N 3.27Å; F818-G820 PolarHBondContact O-N 3.45Å; F818-R821 WeakPolarHBondContact O-CA 3.37Å; F818-R821 WeakPolarHBondContact O-CB 3.49Å; F818-R821 PolarHBondContact O-N 3.4Å; F818-I822 HydrophobicContact CD1-CG1 4.17Å; F818-I822 HydrophobicContact CD2-CD1 4.41Å; F818-I822 HydrophobicContact CD2-CG1 4.23Å; F818-I822 HydrophobicContact CE1-CD1 4.42Å; F818-I822 HydrophobicContact CE1-CG1 3.77Å; F818-I822 HydrophobicContact CE2-CD1 3.71Å; F818-I822 HydrophobicContact CE2-CG1 3.82Å; F818-I822 HydrophobicContact CG-CG1 4.39Å; F818-I822 HydrophobicContact CZ-CD1 3.71Å; F818-I822 HydrophobicContact CZ-CG1 3.56Å; F818-I822 WeakPolarHBondContact O-CG1 3.39Å; F818-I822 PolarHBondContact O-N 3.4Å
819	L	94	Very high	90.3	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-58.8	-39.2	178.5	-72.3	174.1	0	0	0	112.5	Y731 F783 F789 F790 H815 Y816 I822 L823 F937	Y731-L819 HydrophobicContact CE2-CD2 3.92Å; F783-L819 HydrophobicContact CE2-CD2 4.22Å; F783-L819 HydrophobicContact CZ-CB 4.35Å; F789-L819 HydrophobicContact CB-CD1 4.34Å; F789-L819 HydrophobicContact CD2-CD1 4.43Å; F789-L819 HydrophobicContact CG-CD1 4.39Å; F790-L819 HydrophobicContact CD2-CD1 4.46Å; F790-L819 HydrophobicContact CE2-CD1 3.76Å; H815-L819 WeakPolarHBondContact O-CB 3.21Å; H815-L819 WeakPolarHBondContact O-CG 3.37Å; H815-L819 PolarHBondContact O-N 3.22Å; Y816-L819 PolarHBondContact O-N 2.84Å; L819-I822 PolarHBondContact O-N 3.31Å; L819-L823 WeakPolarHBondContact O-CB 3.35Å; L819-L823 PolarHBondContact O-N 2.88Å; L819-F937 HydrophobicContact CB-CD2 4.27Å; L819-F937 HydrophobicContact CB-CE2 4.02Å
820	G	93.9	Very high	90.5	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61	-42.5	172.5	0	0	0	0	0	112.6	Y816 Y817 F818 G824 F937 L941	Y816-G820 PolarHBondContact O-N 3.34Å; Y817-G820 PolarHBondContact O-N 2.94Å; F818-G820 VanDerWaalsContact C-N 3.27Å; F818-G820 PolarHBondContact O-N 3.45Å; G820-G824 PolarHBondContact O-N 3.48Å; G820-F937 WeakPolarHBondContact CA-O 3.46Å; G820-L941 VanDerWaalsContact O-CA 3.32Å; G820-L941 WeakPolarHBondContact O-CA 3.46Å; G820-L941 PolarHBondContact O-N 2.85Å
821	R	93.1	Very high	90.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63	-46	175.7	-73.1	176.3	75.7	-144.1	14	112.3	L738 S739 P740 E743 P744 L746 Y817 F818 G824 K825 G940 N943 V944	L738-R821 PolarHBondContact O-NH1 3.08Å; S739-R821 VanDerWaalsContact C-NH1 3.35Å; P740-R821 VanDerWaalsContact N-NH1 3.13Å; E743-R821 PolarHBondContact O-NH2 3.11Å; P744-R821 PolarHBondContact O-NH2 2.92Å; L746-R821 HydrophobicContact CD2-CB 4.37Å; Y817-R821 HydrophobicContact CD1-CG 4.47Å; Y817-R821 HydrophobicContact CE1-CG 4.16Å; Y817-R821 WeakPolarHBondContact O-CG 3.27Å; Y817-R821 PolarHBondContact O-N 2.93Å; F818-R821 WeakPolarHBondContact O-CA 3.37Å; F818-R821 WeakPolarHBondContact O-CB 3.49Å; F818-R821 PolarHBondContact O-N 3.4Å; R821-G824 CarbonylContact O-C 3.49Å; R821-G824 WeakPolarHBondContact O-CA 3.34Å; R821-G824 PolarHBondContact O-N 3.2Å; R821-K825 PolarHBondContact O-N 3.28Å; R821-G940 WeakPolarHBondContact CA-O 3.14Å; R821-G940 WeakPolarHBondContact CG-O 3.25Å; R821-N943 HydrophobicContact CG-CB 4.17Å; R821-N943 PolarHBondContact NE-OD1 3.37Å; R821-N943 PolarHBondContact NH2-OD1 3.48Å; R821-V944 HydrophobicContact CB-CG2 4.39Å
822	I	94.4	Very high	90.7	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-65.6	-41.3	-179.6	-60.9	-51.3	0	0	0	110.9	L738 L746 L775 L778 L779 F818 L819 G824 K825 A826	L738-I822 HydrophobicContact CD1-CD1 4.37Å; L746-I822 HydrophobicContact CD2-CD1 3.88Å; L775-I822 HydrophobicContact CD1-CG2 3.33Å; L778-I822 HydrophobicContact CD2-CD1 4.12Å; L778-I822 HydrophobicContact CD2-CG1 4.01Å; L778-I822 HydrophobicContact CD2-CG2 3.68Å; L778-I822 HydrophobicContact CG-CG2 4.18Å; L779-I822 HydrophobicContact CD1-CG2 4.48Å; L779-I822 HydrophobicContact CD2-CB 4.26Å; L779-I822 HydrophobicContact CD2-CG2 3.63Å; L779-I822 HydrophobicContact CG-CG2 3.87Å; F818-I822 HydrophobicContact CD1-CG1 4.17Å; F818-I822 HydrophobicContact CD2-CD1 4.41Å; F818-I822 HydrophobicContact CD2-CG1 4.23Å; F818-I822 HydrophobicContact CE1-CD1 4.42Å; F818-I822 HydrophobicContact CE1-CG1 3.77Å; F818-I822 HydrophobicContact CE2-CD1 3.71Å; F818-I822 HydrophobicContact CE2-CG1 3.82Å; F818-I822 HydrophobicContact CG-CG1 4.39Å; F818-I822 HydrophobicContact CZ-CD1 3.71Å; F818-I822 HydrophobicContact CZ-CG1 3.56Å; F818-I822 WeakPolarHBondContact O-CG1 3.39Å; F818-I822 PolarHBondContact O-N 3.4Å; L819-I822 PolarHBondContact O-N 3.31Å; I822-G824 VanDerWaalsContact C-N 3.33Å; I822-G824 PolarHBondContact O-N 3.13Å; I822-K825 WeakPolarHBondContact O-CB 3.36Å; I822-K825 PolarHBondContact O-N 3.34Å; I822-A826 PolarHBondContact O-N 2.99Å
823	L	93.9	Very high	90.5	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-63.1	-40.5	172.2	-177.5	64.2	0	0	0	111.5	L779 L819 K825 A826 L827 L835 F837 F937 I962	L779-L823 HydrophobicContact CD2-CB 4.45Å; L819-L823 WeakPolarHBondContact O-CB 3.35Å; L819-L823 PolarHBondContact O-N 2.88Å; L823-K825 VanDerWaalsContact C-N 3.29Å; L823-K825 PolarHBondContact O-N 3.04Å; L823-A826 WeakPolarHBondContact O-CB 3.24Å; L823-A826 PolarHBondContact O-N 3.01Å; L823-L827 PolarHBondContact O-N 3.24Å; L823-L835 HydrophobicContact CD1-CD1 4.23Å; L823-F837 HydrophobicContact CD2-CE2 3.96Å; L823-F837 HydrophobicContact CD2-CZ 4.07Å; L823-F937 HydrophobicContact CB-CZ 4.37Å; L823-F937 HydrophobicContact CD2-CE1 4.02Å; L823-F937 HydrophobicContact CD2-CZ 3.62Å; L823-I962 HydrophobicContact CD1-CG2 4.13Å; L823-I962 HydrophobicContact CD2-CD1 4.32Å
824	G	93.2	Very high	90.1	Very high	0 Å²	0	23 Å²	23	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.4	-39.5	172.7	0	0	0	0	0	112.8	G820 R821 I822 L827 Y828 L941 V945	G820-G824 PolarHBondContact O-N 3.48Å; R821-G824 CarbonylContact O-C 3.49Å; R821-G824 WeakPolarHBondContact O-CA 3.34Å; R821-G824 PolarHBondContact O-N 3.2Å; I822-G824 VanDerWaalsContact C-N 3.33Å; I822-G824 PolarHBondContact O-N 3.13Å; G824-L827 PolarHBondContact O-N 3.23Å; G824-Y828 WeakPolarHBondContact O-CB 3.16Å; G824-Y828 PolarHBondContact O-N 3.45Å; G824-L941 VanDerWaalsContact CA-CD1 3.46Å; G824-V945 VanDerWaalsContact O-CG2 3.26Å; G824-V945 WeakPolarHBondContact O-CG2 3.47Å
825	K	91.9	Very high	89.9	Confident	1 Å²	1	16.4 Å²	16.4	0%	0.004	8%	0.08	C	C	.	.	H	α-helix	trans	-64.4	-41.5	174.2	-176.1	56.8	166.8	-176.8	0	112	L746 K748 I750 F771 L775 R821 I822 L823 L827 Y828 E829	L746-K825 HydrophobicContact CD2-CB 4.3Å; L746-K825 VanDerWaalsContact O-CD 3.3Å; L746-K825 WeakPolarHBondContact O-CD 3.28Å; L746-K825 VanDerWaalsContact O-CE 3.23Å; L746-K825 WeakPolarHBondContact O-CE 3.32Å; L746-K825 PolarHBondContact O-NZ 2.74Å; K748-K825 PolarHBondContact O-NZ 3.5Å; I750-K825 HydrophobicContact CD1-CD 4.42Å; I750-K825 HydrophobicContact CD1-CG 4.34Å; F771-K825 HydrophobicContact CZ-CG 4.13Å; L775-K825 HydrophobicContact CD2-CG 4.4Å; R821-K825 PolarHBondContact O-N 3.28Å; I822-K825 WeakPolarHBondContact O-CB 3.36Å; I822-K825 PolarHBondContact O-N 3.34Å; L823-K825 VanDerWaalsContact C-N 3.29Å; L823-K825 PolarHBondContact O-N 3.04Å; K825-L827 PolarHBondContact O-N 2.86Å; K825-Y828 PolarHBondContact O-N 3.33Å; K825-E829 HydrophobicContact CD-CG 3.98Å; K825-E829 WeakPolarHBondContact CE-OE1 3.42Å; K825-E829 IonicContact NZ-OE1 3.39Å; K825-E829 PolarHBondContact NZ-OE1 2.79Å; K825-E829 WeakPolarHBondContact O-CG 3.26Å; K825-E829 PolarHBondContact O-N 2.84Å
826	A	90.8	Very high	89.8	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.008	9%	0.091	C	C	.	.	H	α-helix	trans	-60	-45.8	174.6	0	0	0	0	0	111.9	L775 L779 I822 L823 E829 N830 M831 V833	L775-A826 HydrophobicContact CD2-CB 4Å; L779-A826 HydrophobicContact CD1-CB 3.95Å; I822-A826 PolarHBondContact O-N 2.99Å; L823-A826 WeakPolarHBondContact O-CB 3.24Å; L823-A826 PolarHBondContact O-N 3.01Å; A826-E829 PolarHBondContact O-N 3.36Å; A826-N830 PolarHBondContact O-N 2.88Å; A826-M831 HydrophobicContact CB-CE 4.07Å; A826-M831 PolarHBondContact O-N 3.17Å; A826-V833 HydrophobicContact CB-CG2 3.93Å
827	L	91.1	Very high	89.7	Confident	11 Å²	11	18.1 Å²	18.1	6%	0.058	9%	0.092	C	C	.	.	H	α-helix	trans	-63.5	-41.9	175.2	-71.6	173.7	0	0	0	112.3	L823 G824 K825 E829 N830 L941 V945 I962	L823-L827 PolarHBondContact O-N 3.24Å; G824-L827 PolarHBondContact O-N 3.23Å; K825-L827 PolarHBondContact O-N 2.86Å; L827-E829 VanDerWaalsContact C-N 3.29Å; L827-E829 PolarHBondContact O-N 2.89Å; L827-N830 PolarHBondContact O-N 3.34Å; L827-N830 VanDerWaalsContact O-N 3.15Å; L827-L941 HydrophobicContact CD1-CD1 4.2Å; L827-V945 HydrophobicContact CB-CG2 4.26Å; L827-I962 HydrophobicContact CD2-CG1 4.01Å
828	Y	90.4	Very high	89.4	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.2	-37.2	177.1	-166.7	-104.4	0	0	0	111.6	I704 D707 K708 K747 G824 K825 N830 V944	I704-Y828 HydrophobicContact CG1-CD2 4.37Å; I704-Y828 HydrophobicContact CG2-CD2 4Å; I704-Y828 HydrophobicContact CG2-CE2 4.19Å; I704-Y828 HydrophobicContact CG2-CG 4.37Å; I704-Y828 WeakPolarHBondContact CG2-O 3.41Å; D707-Y828 HydrophobicContact CB-CE2 4.46Å; D707-Y828 VanDerWaalsContact OD2-CE2 3.28Å; D707-Y828 WeakPolarHBondContact OD2-CE2 3.49Å; D707-Y828 PolarHBondContact OD2-OH 3.14Å; K708-Y828 WeakPolarHBondContact CA-OH 3.34Å; K708-Y828 HydrophobicContact CD-CE1 4.13Å; K708-Y828 WeakPolarHBondContact CE-O 3.48Å; K708-Y828 HydrophobicContact CG-CD1 4.24Å; K708-Y828 HydrophobicContact CG-CE1 3.4Å; K708-Y828 HydrophobicContact CG-CE2 4.31Å; K708-Y828 VanDerWaalsContact CG-CZ 3.45Å; K708-Y828 WeakPolarHBondContact CG-OH 3.26Å; K708-Y828 PolarHBondContact N-OH 2.85Å; K708-Y828 PolarHBondContact NZ-O 2.75Å; K747-Y828 HydrophobicContact CB-CE1 4.08Å; K747-Y828 HydrophobicContact CG-CE1 4.41Å; K747-Y828 HydrophobicContact CG-CE2 4.44Å; G824-Y828 WeakPolarHBondContact O-CB 3.16Å; G824-Y828 PolarHBondContact O-N 3.45Å; K825-Y828 PolarHBondContact O-N 3.33Å; Y828-N830 VanDerWaalsContact C-N 3.26Å; Y828-N830 PolarHBondContact O-N 3.48Å; Y828-V944 HydrophobicContact CG-CG1 4.17Å
829	E	85.6	Confident	88.9	Confident	44 Å²	44	17 Å²	17	21%	0.206	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	5.1	177.5	-59.2	-59.2	164.4	0	0	114.5	K708 F771 K825 A826 L827 M831	K708-E829 WeakPolarHBondContact CE-OE2 3.41Å; K708-E829 IonicContact NZ-OE2 2.63Å; K708-E829 PolarHBondContact NZ-OE2 3.33Å; F771-E829 HydrophobicContact CE1-CB 4.43Å; F771-E829 HydrophobicContact CE1-CG 3.94Å; F771-E829 HydrophobicContact CZ-CG 4.2Å; K825-E829 HydrophobicContact CD-CG 3.98Å; K825-E829 WeakPolarHBondContact CE-OE1 3.42Å; K825-E829 IonicContact NZ-OE1 3.39Å; K825-E829 PolarHBondContact NZ-OE1 2.79Å; K825-E829 WeakPolarHBondContact O-CG 3.26Å; K825-E829 PolarHBondContact O-N 2.84Å; A826-E829 PolarHBondContact O-N 3.36Å; L827-E829 VanDerWaalsContact C-N 3.29Å; L827-E829 PolarHBondContact O-N 2.89Å; E829-M831 PolarHBondContact O-N 2.81Å
830	N	84.4	Confident	88.5	Confident	74 Å²	74	17 Å²	17	40%	0.396	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	37.9	-173	-63.6	-43.7	0	0	0	112.3	A826 L827 Y828	A826-N830 PolarHBondContact O-N 2.88Å; L827-N830 PolarHBondContact O-N 3.34Å; L827-N830 VanDerWaalsContact O-N 3.15Å; Y828-N830 VanDerWaalsContact C-N 3.26Å; Y828-N830 PolarHBondContact O-N 3.48Å
831	M	82.2	Confident	88.2	Confident	21 Å²	21	17 Å²	17	10%	0.103	9%	0.092	C	C	.	.			trans	-97.9	123.6	179.9	-165.8	-177.2	80.9	0	0	110.4	R772 L775 A826 E829 V833	R772-M831 HydrophobicContact CB-SD 3.99Å; R772-M831 HydrophobicContact CG-SD 3.9Å; L775-M831 HydrophobicContact CB-CE 3.71Å; L775-M831 HydrophobicContact CB-SD 4.23Å; L775-M831 HydrophobicContact CD2-CE 3.43Å; L775-M831 VanDerWaalsContact CD2-CE 3.43Å; L775-M831 HydrophobicContact CD2-SD 3.96Å; L775-M831 HydrophobicContact CG-CE 3.45Å; L775-M831 VanDerWaalsContact CG-CE 3.45Å; L775-M831 HydrophobicContact CG-SD 4.37Å; A826-M831 HydrophobicContact CB-CE 4.07Å; A826-M831 PolarHBondContact O-N 3.17Å; E829-M831 PolarHBondContact O-N 2.81Å; M831-V833 HydrophobicContact CE-CG2 3.75Å
832	L	83.2	Confident	88	Confident	49 Å²	49	17 Å²	17	26%	0.257	9%	0.093	S	C	.	.			trans	-79.9	138.2	176.7	-58.6	178.7	0	0	0	110.7	I962	L832-I962 CarbonylContact C-O 3.57Å; L832-I962 WeakPolarHBondContact CA-O 3.35Å
833	V	83.9	Confident	87.5	Confident	3 Å²	3	18.6 Å²	18.6	2%	0.018	10%	0.104	C	C	.	.			trans	-135.1	130.8	-178.5	-163.8	0	0	0	0	109.9	L779 A826 M831 L835 I962 S963	L779-V833 HydrophobicContact CB-CG1 4.04Å; L779-V833 HydrophobicContact CD1-CB 4.27Å; L779-V833 HydrophobicContact CD1-CG1 3.83Å; L779-V833 HydrophobicContact CD1-CG2 3.66Å; A826-V833 HydrophobicContact CB-CG2 3.93Å; M831-V833 HydrophobicContact CE-CG2 3.75Å; V833-L835 VanDerWaalsContact C-N 3.27Å; V833-L835 HydrophobicContact CB-CG 4.43Å; V833-L835 HydrophobicContact CG1-CD1 4.03Å; V833-L835 HydrophobicContact CG1-CG 3.82Å; V833-L835 PolarHBondContact O-N 3.4Å; V833-I962 PolarHBondContact N-O 3.43Å; V833-S963 VanDerWaalsContact O-CA 3.25Å; V833-S963 WeakPolarHBondContact O-CA 3.27Å; V833-S963 WeakPolarHBondContact O-CB 3.5Å; V833-S963 PolarHBondContact O-OG 2.98Å
834	E	81.9	Confident	87	Confident	49 Å²	49	19.6 Å²	19.6	23%	0.229	11%	0.108	C	C	.	.			trans	-78	69.3	-178.7	-63.3	-173.9	161.4	0	0	112	K1011 S1017	E834-K1011 IonicContact OE1-NZ 3.93Å; E834-K1011 IonicContact OE2-NZ 2.9Å; E834-K1011 PolarHBondContact OE2-NZ 3.38Å; E834-S1017 WeakPolarHBondContact OE1-CB 3.36Å; E834-S1017 PolarHBondContact OE1-N 3.47Å; E834-S1017 PolarHBondContact OE1-OG 3.21Å
835	L	87.7	Confident	86.5	Confident	6 Å²	6	20.2 Å²	20.2	3%	0.031	11%	0.111	C	C	.	.			trans	-114.1	104.7	176.3	-62.9	176.6	0	0	0	110.2	L779 F783 L798 L823 V833 F837 Q959 S963	L779-L835 HydrophobicContact CB-CD1 4.41Å; L779-L835 HydrophobicContact CD2-CD1 4.47Å; F783-L835 HydrophobicContact CB-CD2 3.73Å; F783-L835 HydrophobicContact CD2-CD1 3.6Å; F783-L835 HydrophobicContact CD2-CD2 4.07Å; F783-L835 HydrophobicContact CE2-CD1 3.73Å; F783-L835 HydrophobicContact CG-CD1 4.03Å; F783-L835 HydrophobicContact CG-CD2 3.94Å; F783-L835 HydrophobicContact CZ-CD1 4.21Å; L798-L835 HydrophobicContact CD1-CD2 4.34Å; L823-L835 HydrophobicContact CD1-CD1 4.23Å; V833-L835 VanDerWaalsContact C-N 3.27Å; V833-L835 HydrophobicContact CB-CG 4.43Å; V833-L835 HydrophobicContact CG1-CD1 4.03Å; V833-L835 HydrophobicContact CG1-CG 3.82Å; V833-L835 PolarHBondContact O-N 3.4Å; L835-F837 HydrophobicContact CB-CD2 4.27Å; L835-F837 HydrophobicContact CB-CE2 3.7Å; L835-F837 HydrophobicContact CB-CZ 3.91Å; L835-F837 HydrophobicContact CD1-CE2 4.11Å; L835-F837 HydrophobicContact CD1-CZ 3.86Å; L835-F837 PolarHBondContact O-N 3.21Å; L835-F837 VanDerWaalsContact O-N 3.16Å; L835-Q959 PolarHBondContact O-NE2 3.44Å; L835-S963 PolarHBondContact N-OG 3.01Å; L835-S963 PolarHBondContact O-OG 3.33Å
836	P	88.1	Confident	85.8	Confident	52 Å²	52	21.5 Å²	21.5	34%	0.338	12%	0.118	S	C	.	.			trans	-81.4	92.4	-179.4	32	-33.5	0	0	0	110.3	L797 L798	L797-P836 CarbonylContact C-O 3.31Å; L797-P836 WeakPolarHBondContact CA-O 3.34Å; L797-P836 HydrophobicContact CD2-CB 3.99Å; L798-P836 PolarHBondContact N-O 2.93Å
837	F	91.1	Very high	84.6	Confident	6 Å²	6	22.6 Å²	22.6	3%	0.026	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-80.9	147.7	179.4	-69.3	-65.7	0	0	0	112.5	F783 F790 L798 L823 L835 F841 L842 I962	F783-F837 AromaticContact CD1-CE1 3.7Å; F783-F837 HydrophobicContact CD1-CE1 3.7Å; F783-F837 AromaticContact CD1-CZ 3.92Å; F783-F837 HydrophobicContact CD1-CZ 3.92Å; F783-F837 AromaticContact CE1-CE1 3.37Å; F783-F837 HydrophobicContact CE1-CE1 3.37Å; F783-F837 AromaticContact CE1-CZ 3.4Å; F783-F837 HydrophobicContact CE1-CZ 3.4Å; F783-F837 HydrophobicContact CZ-CE1 4.22Å; F783-F837 AromaticContact CZ-CZ 3.79Å; F783-F837 HydrophobicContact CZ-CZ 3.79Å; F790-F837 HydrophobicContact CE1-CE1 4.32Å; L798-F837 HydrophobicContact CB-CD1 4.09Å; L798-F837 HydrophobicContact CB-CE1 4.46Å; L823-F837 HydrophobicContact CD2-CE2 3.96Å; L823-F837 HydrophobicContact CD2-CZ 4.07Å; L835-F837 HydrophobicContact CB-CD2 4.27Å; L835-F837 HydrophobicContact CB-CE2 3.7Å; L835-F837 HydrophobicContact CB-CZ 3.91Å; L835-F837 HydrophobicContact CD1-CE2 4.11Å; L835-F837 HydrophobicContact CD1-CZ 3.86Å; L835-F837 PolarHBondContact O-N 3.21Å; L835-F837 VanDerWaalsContact O-N 3.16Å; F837-F841 HydrophobicContact CB-CD1 4.3Å; F837-F841 AromaticContact CD1-CD1 3.7Å; F837-F841 HydrophobicContact CD1-CD1 3.7Å; F837-F841 AromaticContact CD1-CE1 3.69Å; F837-F841 HydrophobicContact CD1-CE1 3.69Å; F837-F841 HydrophobicContact CE1-CD1 4.36Å; F837-F841 AromaticContact CE1-CE1 3.88Å; F837-F841 HydrophobicContact CE1-CE1 3.88Å; F837-F841 HydrophobicContact CG-CD1 4.2Å; F837-F841 HydrophobicContact CG-CE1 4.38Å; F837-L842 HydrophobicContact CB-CD1 4Å; F837-L842 HydrophobicContact CB-CD2 3.79Å; F837-L842 HydrophobicContact CB-CG 3.75Å; F837-L842 HydrophobicContact CD2-CD2 3.99Å; F837-L842 HydrophobicContact CG-CD2 4.04Å; F837-I962 HydrophobicContact CD2-CD1 3.95Å; F837-I962 HydrophobicContact CE2-CD1 3.98Å; F837-I962 HydrophobicContact CE2-CG2 4.29Å
838	A	89.1	Confident	82.6	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.152	C	C	.	.			trans	-68.3	138.9	170.8	0	0	0	0	0	110.8	T793 L797 L798 F840 F841 L842	T793-A838 HydrophobicContact CG2-CB 4.31Å; L797-A838 HydrophobicContact CB-CB 4.01Å; L798-A838 PolarHBondContact O-N 3.48Å; A838-F840 VanDerWaalsContact C-N 3.33Å; A838-F840 HydrophobicContact CB-CD1 3.67Å; A838-F840 HydrophobicContact CB-CE1 3.34Å; A838-F840 HydrophobicContact CB-CZ 4.07Å; A838-F840 PolarHBondContact O-N 3.27Å; A838-F841 WeakPolarHBondContact O-CB 3.26Å; A838-F841 PolarHBondContact O-N 3.44Å; A838-L842 PolarHBondContact O-N 3.02Å
839	S	83.9	Confident	80.3	Confident	33 Å²	33	30.2 Å²	30.2	23%	0.231	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-39.7	-174.3	61.9	0	0	0	0	113.1	F841 L842 S843 Q955	S839-F841 VanDerWaalsContact C-N 3.26Å; S839-F841 PolarHBondContact O-N 2.94Å; S839-L842 PolarHBondContact O-N 2.86Å; S839-S843 WeakPolarHBondContact O-CB 3.41Å; S839-S843 PolarHBondContact O-N 3.48Å; S839-Q955 PolarHBondContact O-OE1 3.32Å
840	F	84.5	Confident	78.3	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-31.4	176.3	76.1	-94.3	0	0	0	112.7	T793 Y799 A838 K844 H856 S859 L860 L926 I930	T793-F840 HydrophobicContact CG2-CE1 4.5Å; Y799-F840 HydrophobicContact CD1-CZ 4.3Å; Y799-F840 HydrophobicContact CD2-CZ 4.01Å; Y799-F840 HydrophobicContact CG-CE1 4.39Å; Y799-F840 AromaticContact CG-CZ 3.66Å; Y799-F840 HydrophobicContact CG-CZ 3.66Å; A838-F840 VanDerWaalsContact C-N 3.33Å; A838-F840 HydrophobicContact CB-CD1 3.67Å; A838-F840 HydrophobicContact CB-CE1 3.34Å; A838-F840 HydrophobicContact CB-CZ 4.07Å; A838-F840 PolarHBondContact O-N 3.27Å; F840-K844 WeakPolarHBondContact O-CG 3.49Å; F840-K844 PolarHBondContact O-N 2.86Å; F840-H856 HydrophobicContact CB-CB 3.88Å; F840-S859 WeakPolarHBondContact CD1-OG 3.36Å; F840-L860 HydrophobicContact CD1-CB 4.15Å; F840-L860 HydrophobicContact CE1-CB 3.85Å; F840-L860 HydrophobicContact CE1-CD1 3.78Å; F840-L860 HydrophobicContact CE1-CG 4.4Å; F840-L860 HydrophobicContact CE2-CD1 4.31Å; F840-L860 HydrophobicContact CZ-CB 4.25Å; F840-L860 HydrophobicContact CZ-CD1 3.49Å; F840-L860 VanDerWaalsContact CZ-CD1 3.49Å; F840-L860 HydrophobicContact CZ-CG 4.37Å; F840-L926 HydrophobicContact CB-CD2 4.32Å; F840-L926 HydrophobicContact CD2-CD2 4.13Å; F840-L926 HydrophobicContact CG-CD2 4.23Å; F840-I930 HydrophobicContact CD2-CD1 4.46Å; F840-I930 HydrophobicContact CE2-CD1 3.84Å
841	F	88.5	Confident	76.7	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-71.9	-46.9	176.9	173.3	-120.9	0	0	0	110.6	F790 P800 F837 A838 S839 S843 K844 L845 F937	F790-F841 HydrophobicContact CE1-CE1 4.21Å; F790-F841 HydrophobicContact CE1-CZ 4.26Å; P800-F841 VanDerWaalsContact CD-CD2 3.43Å; P800-F841 HydrophobicContact CG-CD2 3.62Å; P800-F841 HydrophobicContact CG-CE2 3.36Å; P800-F841 HydrophobicContact CG-CG 4.43Å; P800-F841 HydrophobicContact CG-CZ 3.99Å; F837-F841 HydrophobicContact CB-CD1 4.3Å; F837-F841 AromaticContact CD1-CD1 3.7Å; F837-F841 HydrophobicContact CD1-CD1 3.7Å; F837-F841 AromaticContact CD1-CE1 3.69Å; F837-F841 HydrophobicContact CD1-CE1 3.69Å; F837-F841 HydrophobicContact CE1-CD1 4.36Å; F837-F841 AromaticContact CE1-CE1 3.88Å; F837-F841 HydrophobicContact CE1-CE1 3.88Å; F837-F841 HydrophobicContact CG-CD1 4.2Å; F837-F841 HydrophobicContact CG-CE1 4.38Å; A838-F841 WeakPolarHBondContact O-CB 3.26Å; A838-F841 PolarHBondContact O-N 3.44Å; S839-F841 VanDerWaalsContact C-N 3.26Å; S839-F841 PolarHBondContact O-N 2.94Å; F841-S843 VanDerWaalsContact C-N 3.32Å; F841-S843 PolarHBondContact O-N 2.99Å; F841-K844 WeakPolarHBondContact O-CB 3.25Å; F841-K844 PolarHBondContact O-N 3.3Å; F841-K844 VanDerWaalsContact O-N 3.11Å; F841-L845 HydrophobicContact CE1-CD1 4Å; F841-L845 HydrophobicContact CE2-CD1 4.49Å; F841-L845 HydrophobicContact CE2-CD2 4.02Å; F841-L845 HydrophobicContact CE2-CG 4.33Å; F841-L845 HydrophobicContact CZ-CD1 4Å; F841-L845 HydrophobicContact CZ-CD2 4.12Å; F841-L845 HydrophobicContact CZ-CG 4.31Å; F841-L845 PolarHBondContact O-N 2.79Å; F841-F937 HydrophobicContact CE1-CE1 4.42Å; F841-F937 AromaticContact CZ-CD1 3.89Å; F841-F937 HydrophobicContact CZ-CD1 3.89Å; F841-F937 AromaticContact CZ-CE1 4Å; F841-F937 HydrophobicContact CZ-CE1 4Å; F841-F937 HydrophobicContact CZ-CG 4.15Å; F841-F937 HydrophobicContact CZ-CZ 4.34Å
842	L	88.1	Confident	75.6	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-61.3	-39.3	176.4	-66.1	-178.2	0	0	0	112.6	F837 A838 S839 K844 L845 L846 Q955 I958 Q959 I962	F837-L842 HydrophobicContact CB-CD1 4Å; F837-L842 HydrophobicContact CB-CD2 3.79Å; F837-L842 HydrophobicContact CB-CG 3.75Å; F837-L842 HydrophobicContact CD2-CD2 3.99Å; F837-L842 HydrophobicContact CG-CD2 4.04Å; A838-L842 PolarHBondContact O-N 3.02Å; S839-L842 PolarHBondContact O-N 2.86Å; L842-K844 VanDerWaalsContact C-N 3.26Å; L842-K844 PolarHBondContact O-N 2.83Å; L842-L845 HydrophobicContact CD2-CD1 4.13Å; L842-L845 WeakPolarHBondContact O-CB 3.39Å; L842-L845 PolarHBondContact O-N 3.44Å; L842-L845 VanDerWaalsContact O-N 3.14Å; L842-L846 PolarHBondContact O-N 3.47Å; L842-Q955 HydrophobicContact CB-CB 4.09Å; L842-Q955 WeakPolarHBondContact CD1-O 3.16Å; L842-I958 HydrophobicContact CD1-CG2 4.45Å; L842-I958 HydrophobicContact CD2-CG2 4.11Å; L842-Q959 HydrophobicContact CD1-CB 3.84Å; L842-I962 HydrophobicContact CD2-CD1 4.27Å
843	S	83.3	Confident	74.7	Confident	34 Å²	34	33 Å²	33	24%	0.238	21%	0.205	C	C	.	.	H	α-helix	trans	-56.7	-39.7	174.3	-172.6	0	0	0	0	112.4	S839 F841 L845 L846 G847	S839-S843 WeakPolarHBondContact O-CB 3.41Å; S839-S843 PolarHBondContact O-N 3.48Å; F841-S843 VanDerWaalsContact C-N 3.32Å; F841-S843 PolarHBondContact O-N 2.99Å; S843-L845 PolarHBondContact O-N 3.32Å; S843-L846 PolarHBondContact O-N 3.46Å; S843-G847 PolarHBondContact O-N 3.21Å
844	K	83.6	Confident	73.9	Confident	26 Å²	26	33.7 Å²	33.7	11%	0.113	21%	0.208	C	C	.	.	H	α-helix	trans	-68.3	-33.1	177.2	-71.1	170.8	-179.7	-67.1	0	113.7	F840 F841 L842 L846 V852 L926 N927 I930	F840-K844 WeakPolarHBondContact O-CG 3.49Å; F840-K844 PolarHBondContact O-N 2.86Å; F841-K844 WeakPolarHBondContact O-CB 3.25Å; F841-K844 PolarHBondContact O-N 3.3Å; F841-K844 VanDerWaalsContact O-N 3.11Å; L842-K844 VanDerWaalsContact C-N 3.26Å; L842-K844 PolarHBondContact O-N 2.83Å; K844-L846 VanDerWaalsContact C-N 3.26Å; K844-L846 PolarHBondContact O-N 3.35Å; K844-V852 HydrophobicContact CD-CG2 4.22Å; K844-V852 HydrophobicContact CG-CG2 3.51Å; K844-L926 WeakPolarHBondContact CE-O 3.43Å; K844-L926 VanDerWaalsContact NZ-C 3.34Å; K844-L926 PolarHBondContact NZ-O 3.18Å; K844-N927 PolarHBondContact NZ-OD1 3.1Å; K844-I930 HydrophobicContact CD-CD1 4.1Å
845	L	83.2	Confident	73.1	Confident	13 Å²	13	31.8 Å²	31.8	7%	0.068	20%	0.199	C	C	.	.	H	α-helix	trans	-66.4	-34.4	177.3	-61.6	-178.7	0	0	0	111.2	F841 L842 S843 F937 R938	F841-L845 HydrophobicContact CE1-CD1 4Å; F841-L845 HydrophobicContact CE2-CD1 4.49Å; F841-L845 HydrophobicContact CE2-CD2 4.02Å; F841-L845 HydrophobicContact CE2-CG 4.33Å; F841-L845 HydrophobicContact CZ-CD1 4Å; F841-L845 HydrophobicContact CZ-CD2 4.12Å; F841-L845 HydrophobicContact CZ-CG 4.31Å; F841-L845 PolarHBondContact O-N 2.79Å; L842-L845 HydrophobicContact CD2-CD1 4.13Å; L842-L845 WeakPolarHBondContact O-CB 3.39Å; L842-L845 PolarHBondContact O-N 3.44Å; L842-L845 VanDerWaalsContact O-N 3.14Å; S843-L845 PolarHBondContact O-N 3.32Å; L845-F937 HydrophobicContact CD1-CD1 4.04Å; L845-F937 HydrophobicContact CD1-CE1 3.76Å; L845-F937 HydrophobicContact CD2-CD1 3.59Å; L845-F937 HydrophobicContact CD2-CE1 4.2Å; L845-F937 HydrophobicContact CG-CD1 4.49Å; L845-R938 HydrophobicContact CD2-CB 4.11Å; L845-R938 WeakPolarHBondContact O-CD 3.2Å
846	L	76.6	Confident	72.5	Confident	27 Å²	27	32.4 Å²	32.4	14%	0.141	20%	0.202	C	C	.	.	H	α-helix	trans	-83.4	-32.9	-178.2	-71	171.3	0	0	0	114.6	L842 S843 K844 L950 F953 I958	L842-L846 PolarHBondContact O-N 3.47Å; S843-L846 PolarHBondContact O-N 3.46Å; K844-L846 VanDerWaalsContact C-N 3.26Å; K844-L846 PolarHBondContact O-N 3.35Å; L846-L950 HydrophobicContact CD2-CB 4.01Å; L846-L950 VanDerWaalsContact CD2-O 3.31Å; L846-L950 WeakPolarHBondContact CD2-O 3.47Å; L846-F953 VanDerWaalsContact CD1-O 3.31Å; L846-F953 WeakPolarHBondContact CD1-O 3.48Å; L846-I958 HydrophobicContact CD1-CD1 3.63Å; L846-I958 HydrophobicContact CD1-CG1 4.16Å; L846-I958 HydrophobicContact CD2-CD1 3.19Å; L846-I958 HydrophobicContact CD2-CG1 4.38Å; L846-I958 HydrophobicContact CG-CD1 3.61Å
847	G	65.3	Low	72.1	Confident	24 Å²	24	30 Å²	30	25%	0.247	19%	0.186	C	C	.	.			trans	-64.1	147.3	-172	0	0	0	0	0	115.6	S843 R938	S843-G847 PolarHBondContact O-N 3.21Å; G847-R938 PolarHBondContact O-NH1 2.9Å
848	T	49.8	Very low	71.4	Confident	89 Å²	89	31.4 Å²	31.4	55%	0.546	20%	0.199	S	C	.	.	S	Bend	trans	-88.2	-41.8	167.2	28.9	0	0	0	0	111.9	R951	T848-R951 VanDerWaalsContact CG2-CZ 3.42Å
849	S	43	Very low	70.8	Confident	82 Å²	82	32.9 Å²	32.9	57%	0.573	21%	0.209	S	C	*	.	S	Bend	trans	-96.5	132.4	169	42.9	0	0	0	0	109.4	D851	S849-D851 PolarHBondContact O-N 3.47Å
850	A	42.1	Very low	70.8	Confident	54 Å²	54	32.5 Å²	32.5	45%	0.446	21%	0.205	S	C	.	.			trans	-72.6	8.7	-172.9	0	0	0	0	0	114.7	V852 N927	A850-V852 PolarHBondContact O-N 3.07Å; A850-N927 PolarHBondContact O-OD1 2.69Å
851	D	51	Low	70.7	Confident	123 Å²	123	35.3 Å²	35.3	66%	0.658	22%	0.22	S	C	*	.			trans	-94.3	96.9	-168	-59.5	-18.3	0	0	0	109.9	S849	S849-D851 PolarHBondContact O-N 3.47Å
852	V	60.4	Low	70.3	Confident	15 Å²	15	37.3 Å²	37.3	9%	0.091	23%	0.233	C	C	.	.			trans	-80.3	133.3	169.1	178.7	0	0	0	0	108.4	K844 A850 H856 L926 N927	K844-V852 HydrophobicContact CD-CG2 4.22Å; K844-V852 HydrophobicContact CG-CG2 3.51Å; A850-V852 PolarHBondContact O-N 3.07Å; V852-H856 HydrophobicContact CG1-CB 3.3Å; V852-H856 WeakPolarHBondContact CG1-CD2 3.43Å; V852-L926 HydrophobicContact CG1-CD1 4.28Å; V852-N927 PolarHBondContact N-OD1 3.3Å
853	D	62.8	Low	70.1	Confident	55 Å²	55	42.7 Å²	42.7	29%	0.294	26%	0.258	S	S	.	.			trans	-57.5	146.8	177.8	-176	8.7	0	0	0	111.6	R616 H855 H856	R616-D853 IonicContact CZ-OD2 2.85Å; R616-D853 IonicContact NH1-OD2 3.78Å; R616-D853 PolarHBondContact NH1-OD2 3.19Å; R616-D853 IonicContact NH2-OD2 3.73Å; R616-D853 PolarHBondContact NH2-OD2 3.23Å; D853-H855 PolarHBondContact O-N 2.98Å; D853-H855 IonicContact OD1-CD2 2.85Å; D853-H855 PolarHBondContact OD1-CD2 2.83Å; D853-H855 IonicContact OD2-CD2 2.77Å; D853-H855 PolarHBondContact OD2-CD2 2.99Å; D853-H855 VanDerWaalsContact OD2-CD2 3.32Å; D853-H856 WeakPolarHBondContact O-CB 3.31Å; D853-H856 PolarHBondContact O-CD2 2.84Å; D853-H856 PolarHBondContact O-N 3.04Å
854	I	67.1	Low	70.1	Confident	18 Å²	18	42.8 Å²	42.8	9%	0.092	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-51.1	-33.3	-178.7	-119.2	167.1	0	0	0	112.1	H856 L857 Y865 I918 H919 A922	I854-H856 PolarHBondContact O-N 3.3Å; I854-L857 WeakPolarHBondContact O-CB 3.49Å; I854-L857 PolarHBondContact O-N 3.2Å; I854-Y865 HydrophobicContact CG2-CE2 4.46Å; I854-I918 HydrophobicContact CD1-CG2 3.76Å; I854-H919 HydrophobicContact CD1-CB 4.47Å; I854-H919 WeakPolarHBondContact CD1-ND1 3.31Å; I854-A922 HydrophobicContact CB-CB 4.44Å; I854-A922 HydrophobicContact CD1-CB 4Å; I854-A922 HydrophobicContact CG1-CB 3.21Å
855	H	66.1	Low	70.1	Confident	8 Å²	8	43.3 Å²	43.3	4%	0.037	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-67.9	-20.3	-176.2	-67	-64	0	0	0	113.5	H515 D516 R613 R616 D853 L857 A858 Y865	H515-H855 VanDerWaalsContact CA-CE1 3.46Å; H515-H855 WeakPolarHBondContact CA-CE1 3.34Å; H515-H855 AromaticContact CG-CE1 3.86Å; H515-H855 AromaticContact ND1-CE1 3.54Å; D516-H855 PolarHBondContact N-CE1 3.48Å; D516-H855 VanDerWaalsContact N-CE1 3.3Å; D516-H855 IonicContact OD2-CG 2.74Å; D516-H855 IonicContact OD2-ND1 3.85Å; D516-H855 PolarHBondContact OD2-ND1 3.18Å; R613-H855 PolarHBondContact NH1-CD2 3.08Å; R613-H855 PolarHBondContact NH1-NE2 3.38Å; R616-H855 PolarHBondContact NH2-CD2 2.92Å; R616-H855 VanDerWaalsContact NH2-CD2 3.27Å; D853-H855 PolarHBondContact O-N 2.98Å; D853-H855 IonicContact OD1-CD2 2.85Å; D853-H855 PolarHBondContact OD1-CD2 2.83Å; D853-H855 IonicContact OD2-CD2 2.77Å; D853-H855 PolarHBondContact OD2-CD2 2.99Å; D853-H855 VanDerWaalsContact OD2-CD2 3.32Å; H855-L857 PolarHBondContact O-N 2.85Å; H855-A858 WeakPolarHBondContact O-CB 3.24Å; H855-A858 PolarHBondContact O-N 3.21Å; H855-Y865 AromaticContact ND1-CE2 3.93Å; H855-Y865 AromaticContact ND1-CZ 3.86Å; H855-Y865 PolarHBondContact ND1-OH 2.76Å
856	H	74.1	Confident	70	Confident	19 Å²	19	49.8 Å²	49.8	9%	0.088	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-69.5	-15.3	170.5	-70	-86.8	0	0	0	112.6	F840 V852 D853 I854 A858 S859 L860 L926 Q955	F840-H856 HydrophobicContact CB-CB 3.88Å; V852-H856 HydrophobicContact CG1-CB 3.3Å; V852-H856 WeakPolarHBondContact CG1-CD2 3.43Å; D853-H856 WeakPolarHBondContact O-CB 3.31Å; D853-H856 PolarHBondContact O-CD2 2.84Å; D853-H856 PolarHBondContact O-N 3.04Å; I854-H856 PolarHBondContact O-N 3.3Å; H856-A858 PolarHBondContact O-N 3Å; H856-S859 PolarHBondContact O-N 3.05Å; H856-S859 PolarHBondContact O-OG 3.49Å; H856-L860 PolarHBondContact O-N 2.89Å; H856-L926 HydrophobicContact CB-CD1 4.21Å; H856-L926 HydrophobicContact CB-CD2 4.37Å; H856-Q955 PolarHBondContact CE1-OE1 3.43Å
857	L	80.3	Confident	70.4	Confident	1 Å²	1	53 Å²	53	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-59.8	-33.1	173.6	-173.4	70.2	0	0	0	111	I854 H855 S859 L860 D861 M864 Y865 L868 A922 R925 L926	I854-L857 WeakPolarHBondContact O-CB 3.49Å; I854-L857 PolarHBondContact O-N 3.2Å; H855-L857 PolarHBondContact O-N 2.85Å; L857-S859 PolarHBondContact O-N 3.4Å; L857-L860 HydrophobicContact CD1-CD2 4.11Å; L857-L860 PolarHBondContact O-N 3.29Å; L857-D861 CarbonylContact O-C 3.59Å; L857-D861 PolarHBondContact O-N 2.81Å; L857-M864 HydrophobicContact CD1-SD 4.06Å; L857-M864 HydrophobicContact CD2-CG 4.19Å; L857-M864 HydrophobicContact CD2-SD 4.27Å; L857-Y865 HydrophobicContact CB-CD2 4.24Å; L857-L868 HydrophobicContact CD2-CD1 3.5Å; L857-A922 HydrophobicContact CD2-CB 4.41Å; L857-R925 HydrophobicContact CD1-CB 4.12Å; L857-L926 HydrophobicContact CB-CD1 4.14Å; L857-L926 HydrophobicContact CD1-CG 4.39Å
858	A	76.1	Confident	71.3	Confident	37 Å²	37	52.6 Å²	52.6	31%	0.306	29%	0.289	S	S	.	.	H	α-helix	trans	-58.8	-31.1	174.6	0	0	0	0	0	112.9	H855 H856 P862 Y865	H855-A858 WeakPolarHBondContact O-CB 3.24Å; H855-A858 PolarHBondContact O-N 3.21Å; H856-A858 PolarHBondContact O-N 3Å; A858-P862 WeakPolarHBondContact O-CG 3.34Å; A858-Y865 HydrophobicContact CB-CD1 3.69Å; A858-Y865 HydrophobicContact CB-CD2 4.22Å; A858-Y865 HydrophobicContact CB-CE1 4.05Å; A858-Y865 HydrophobicContact CB-CG 3.77Å
859	S	76.5	Confident	72.6	Confident	30 Å²	30	50.7 Å²	50.7	21%	0.21	28%	0.276	C	S	.	.	H	α-helix	trans	-81.3	-19.7	176.9	69.9	0	0	0	0	114	F840 H856 L857	F840-S859 WeakPolarHBondContact CD1-OG 3.36Å; H856-S859 PolarHBondContact O-N 3.05Å; H856-S859 PolarHBondContact O-OG 3.49Å; L857-S859 PolarHBondContact O-N 3.4Å
860	L	83.5	Confident	74.5	Confident	25 Å²	25	52.6 Å²	52.6	13%	0.131	27%	0.274	C	S	.	.	H	α-helix	trans	-87.9	-55.5	175	172.7	66.4	0	0	0	110.4	Y799 F840 H856 L857 R925 L926	Y799-L860 HydrophobicContact CD2-CD1 4.11Å; Y799-L860 HydrophobicContact CE1-CD1 4.28Å; Y799-L860 HydrophobicContact CE2-CD1 3.87Å; Y799-L860 HydrophobicContact CG-CD1 4.43Å; F840-L860 HydrophobicContact CD1-CB 4.15Å; F840-L860 HydrophobicContact CE1-CB 3.85Å; F840-L860 HydrophobicContact CE1-CD1 3.78Å; F840-L860 HydrophobicContact CE1-CG 4.4Å; F840-L860 HydrophobicContact CE2-CD1 4.31Å; F840-L860 HydrophobicContact CZ-CB 4.25Å; F840-L860 HydrophobicContact CZ-CD1 3.49Å; F840-L860 VanDerWaalsContact CZ-CD1 3.49Å; F840-L860 HydrophobicContact CZ-CG 4.37Å; H856-L860 PolarHBondContact O-N 2.89Å; L857-L860 HydrophobicContact CD1-CD2 4.11Å; L857-L860 PolarHBondContact O-N 3.29Å; L860-R925 HydrophobicContact CD2-CB 4.27Å; L860-L926 HydrophobicContact CB-CD2 4.26Å; L860-L926 HydrophobicContact CD2-CD2 4.08Å
861	D	83.3	Confident	76.4	Confident	60 Å²	60	50.4 Å²	50.4	32%	0.321	25%	0.254	S	S	.	.			trans	-144	97.1	-177	-173	-22.6	0	0	0	109.9	L857 E863 M864 Y865	L857-D861 CarbonylContact O-C 3.59Å; L857-D861 PolarHBondContact O-N 2.81Å; D861-E863 PolarHBondContact O-N 2.77Å; D861-E863 WeakPolarHBondContact OD1-CB 3.45Å; D861-E863 PolarHBondContact OD1-N 3.31Å; D861-M864 HydrophobicContact CB-CB 3.87Å; D861-M864 VanDerWaalsContact CG-CB 3.45Å; D861-M864 PolarHBondContact O-N 3.15Å; D861-M864 PolarHBondContact OD1-N 2.9Å; D861-Y865 WeakPolarHBondContact O-CB 3.34Å; D861-Y865 PolarHBondContact O-N 3.17Å; D861-Y865 VanDerWaalsContact O-N 3.08Å
862	P	80.4	Confident	77.5	Confident	41 Å²	41	46.4 Å²	46.4	27%	0.266	23%	0.231	S	C	.	.	H	α-helix	trans	-60.3	-30.9	178.3	-22	30.3	0	0	0	113.7	A858 R866	A858-P862 WeakPolarHBondContact O-CG 3.34Å; P862-R866 WeakPolarHBondContact O-CG 3Å; P862-R866 PolarHBondContact O-N 3.22Å; P862-R866 VanDerWaalsContact O-N 3.09Å
863	E	83.1	Confident	78.1	Confident	115 Å²	115	49.7 Å²	49.7	54%	0.537	26%	0.255	S	S	.	.	H	α-helix	trans	-76.2	-46.3	-177	-171	178.3	167.1	0	0	110.8	D861 Y865 R866 N867	D861-E863 PolarHBondContact O-N 2.77Å; D861-E863 WeakPolarHBondContact OD1-CB 3.45Å; D861-E863 PolarHBondContact OD1-N 3.31Å; E863-Y865 VanDerWaalsContact C-N 3.27Å; E863-Y865 PolarHBondContact O-N 3.18Å; E863-R866 PolarHBondContact O-N 3.1Å; E863-R866 VanDerWaalsContact O-N 3.16Å; E863-N867 VanDerWaalsContact O-CG 3.29Å; E863-N867 PolarHBondContact O-N 3.29Å; E863-N867 PolarHBondContact O-ND2 2.89Å
864	M	84.3	Confident	79	Confident	36 Å²	36	49.9 Å²	49.9	18%	0.177	25%	0.252	C	S	.	.	H	α-helix	trans	-58.1	-42.7	172.9	-170.5	-177.4	-153.7	0	0	111.5	L857 D861 R866 N867 L868 V921 R925	L857-M864 HydrophobicContact CD1-SD 4.06Å; L857-M864 HydrophobicContact CD2-CG 4.19Å; L857-M864 HydrophobicContact CD2-SD 4.27Å; D861-M864 HydrophobicContact CB-CB 3.87Å; D861-M864 VanDerWaalsContact CG-CB 3.45Å; D861-M864 PolarHBondContact O-N 3.15Å; D861-M864 PolarHBondContact OD1-N 2.9Å; M864-R866 PolarHBondContact O-N 3.25Å; M864-N867 PolarHBondContact O-N 3.28Å; M864-L868 HydrophobicContact CG-CD1 4.29Å; M864-L868 HydrophobicContact CG-CG 4.48Å; M864-L868 WeakPolarHBondContact O-CG 3.44Å; M864-L868 PolarHBondContact O-N 2.96Å; M864-V921 HydrophobicContact CE-CG1 3.22Å; M864-V921 HydrophobicContact SD-CG1 4.49Å; M864-R925 HydrophobicContact CE-CG 3.86Å; M864-R925 HydrophobicContact SD-CG 3.82Å
865	Y	83.1	Confident	79.2	Confident	37 Å²	37	58 Å²	58	15%	0.145	29%	0.29	C	S	.	.	H	α-helix	trans	-60	-44.9	176	178.6	-104.6	0	0	0	112.3	I854 H855 L857 A858 D861 E863 N867 L869	I854-Y865 HydrophobicContact CG2-CE2 4.46Å; H855-Y865 AromaticContact ND1-CE2 3.93Å; H855-Y865 AromaticContact ND1-CZ 3.86Å; H855-Y865 PolarHBondContact ND1-OH 2.76Å; L857-Y865 HydrophobicContact CB-CD2 4.24Å; A858-Y865 HydrophobicContact CB-CD1 3.69Å; A858-Y865 HydrophobicContact CB-CD2 4.22Å; A858-Y865 HydrophobicContact CB-CE1 4.05Å; A858-Y865 HydrophobicContact CB-CG 3.77Å; D861-Y865 WeakPolarHBondContact O-CB 3.34Å; D861-Y865 PolarHBondContact O-N 3.17Å; D861-Y865 VanDerWaalsContact O-N 3.08Å; E863-Y865 VanDerWaalsContact C-N 3.27Å; E863-Y865 PolarHBondContact O-N 3.18Å; Y865-N867 PolarHBondContact O-N 3.46Å; Y865-L869 WeakPolarHBondContact O-CB 3.26Å; Y865-L869 PolarHBondContact O-N 3.4Å
866	R	81	Confident	80	Confident	149 Å²	149	59.2 Å²	59.2	56%	0.562	30%	0.304	S	S	*	.	H	α-helix	trans	-60.9	-43.4	174.9	-75.1	-174	-57.9	-114.6	2.3	112.1	P862 E863 M864 L869 F870	P862-R866 WeakPolarHBondContact O-CG 3Å; P862-R866 PolarHBondContact O-N 3.22Å; P862-R866 VanDerWaalsContact O-N 3.09Å; E863-R866 PolarHBondContact O-N 3.1Å; E863-R866 VanDerWaalsContact O-N 3.16Å; M864-R866 PolarHBondContact O-N 3.25Å; R866-L869 PolarHBondContact O-N 3.2Å; R866-F870 WeakPolarHBondContact O-CB 3.49Å; R866-F870 PolarHBondContact O-N 2.91Å
867	N	85.3	Confident	80.3	Confident	95 Å²	95	62 Å²	62	51%	0.508	32%	0.319	S	S	.	.	H	α-helix	trans	-66.7	-42	-178.7	-67.7	-16.3	0	0	0	112.3	E863 M864 Y865 L869 F870 L871	E863-N867 VanDerWaalsContact O-CG 3.29Å; E863-N867 PolarHBondContact O-N 3.29Å; E863-N867 PolarHBondContact O-ND2 2.89Å; M864-N867 PolarHBondContact O-N 3.28Å; Y865-N867 PolarHBondContact O-N 3.46Å; N867-L869 VanDerWaalsContact C-N 3.33Å; N867-F870 PolarHBondContact O-N 3.3Å; N867-L871 PolarHBondContact O-N 3.46Å; N867-L871 VanDerWaalsContact O-N 3.1Å
868	L	83.8	Confident	80.5	Confident	15 Å²	15	61.9 Å²	61.9	8%	0.079	32%	0.319	C	S	.	.	H	α-helix	trans	-67.1	-34.9	174.6	-69	179	0	0	0	112.2	L857 M864 L871 K872 Y917 I918 V921	L857-L868 HydrophobicContact CD2-CD1 3.5Å; M864-L868 HydrophobicContact CG-CD1 4.29Å; M864-L868 HydrophobicContact CG-CG 4.48Å; M864-L868 WeakPolarHBondContact O-CG 3.44Å; M864-L868 PolarHBondContact O-N 2.96Å; L868-L871 WeakPolarHBondContact O-CB 3.33Å; L868-L871 PolarHBondContact O-N 3.27Å; L868-K872 PolarHBondContact O-N 2.78Å; L868-Y917 HydrophobicContact CD2-CE1 4.14Å; L868-I918 HydrophobicContact CB-CG1 4.45Å; L868-I918 HydrophobicContact CB-CG2 4.23Å; L868-I918 HydrophobicContact CD2-CG1 4.37Å; L868-I918 WeakPolarHBondContact O-CD1 3.29Å; L868-V921 HydrophobicContact CD1-CB 4.29Å; L868-V921 HydrophobicContact CD1-CG1 3.87Å; L868-V921 HydrophobicContact CD2-CB 4.38Å; L868-V921 HydrophobicContact CD2-CG1 4.2Å
869	L	77.4	Confident	80.9	Confident	50 Å²	50	65 Å²	65	26%	0.262	33%	0.327	S	S	.	.	H	α-helix	trans	-69	-40.4	175.4	-171.7	63.6	0	0	0	111.4	Y865 R866 N867 L871 K872 S873	Y865-L869 WeakPolarHBondContact O-CB 3.26Å; Y865-L869 PolarHBondContact O-N 3.4Å; R866-L869 PolarHBondContact O-N 3.2Å; N867-L869 VanDerWaalsContact C-N 3.33Å; L869-L871 VanDerWaalsContact C-N 3.29Å; L869-L871 PolarHBondContact O-N 3.09Å; L869-K872 VanDerWaalsContact O-CB 3.29Å; L869-K872 WeakPolarHBondContact O-CB 3.4Å; L869-K872 PolarHBondContact O-N 3.19Å; L869-K872 VanDerWaalsContact O-N 3.07Å; L869-S873 PolarHBondContact O-N 2.65Å
870	F	82	Confident	81.3	Confident	121 Å²	121	70.9 Å²	70.9	53%	0.531	35%	0.351	S	S	.	.	H	α-helix	trans	-58.2	-41.6	173.7	177.6	-100.6	0	0	0	111.7	R866 N867 K872 S873 Y874	R866-F870 WeakPolarHBondContact O-CB 3.49Å; R866-F870 PolarHBondContact O-N 2.91Å; N867-F870 PolarHBondContact O-N 3.3Å; F870-K872 PolarHBondContact O-N 3.42Å; F870-S873 CarbonylContact O-C 3.58Å; F870-S873 PolarHBondContact O-N 2.97Å; F870-S873 VanDerWaalsContact O-N 3.15Å; F870-S873 PolarHBondContact O-OG 3.36Å; F870-Y874 HydrophobicContact CD1-CD2 4.48Å; F870-Y874 AromaticContact CE1-CD2 3.59Å; F870-Y874 HydrophobicContact CE1-CD2 3.59Å; F870-Y874 HydrophobicContact CE1-CE2 4.05Å; F870-Y874 AromaticContact CZ-CD2 3.66Å; F870-Y874 HydrophobicContact CZ-CD2 3.66Å; F870-Y874 HydrophobicContact CZ-CE2 4.05Å; F870-Y874 PolarHBondContact O-N 3.04Å
871	L	82.4	Confident	81.3	Confident	8 Å²	8	73.2 Å²	73.2	4%	0.042	36%	0.363	C	S	.	.	H	α-helix	trans	-59.5	-31.3	176.1	-172.7	64.9	0	0	0	112.9	N867 L868 L869 V878 L881 L883 Y917 I918	N867-L871 PolarHBondContact O-N 3.46Å; N867-L871 VanDerWaalsContact O-N 3.1Å; L868-L871 WeakPolarHBondContact O-CB 3.33Å; L868-L871 PolarHBondContact O-N 3.27Å; L869-L871 VanDerWaalsContact C-N 3.29Å; L869-L871 PolarHBondContact O-N 3.09Å; L871-V878 HydrophobicContact CD1-CG1 3.8Å; L871-L881 HydrophobicContact CD1-CD1 3.57Å; L871-L883 HydrophobicContact CD1-CD1 3.97Å; L871-L883 HydrophobicContact CD2-CD1 3.98Å; L871-Y917 HydrophobicContact CD2-CD1 3.57Å; L871-Y917 HydrophobicContact CD2-CE1 3.8Å; L871-I918 HydrophobicContact CB-CD1 4.43Å; L871-I918 HydrophobicContact CD2-CG1 4.17Å
872	K	73.9	Confident	81.4	Confident	40 Å²	40	73.5 Å²	73.5	17%	0.174	38%	0.381	C	S	.	.	H	α-helix	trans	-67.4	-44.9	175.8	-174.6	-175.2	176.6	-172.6	0	111.8	H515 E518 L868 L869 F870 Y874 R914 I915 I918	H515-K872 PolarHBondContact CD2-NZ 3.14Å; H515-K872 WeakPolarHBondContact NE2-CD 3.29Å; H515-K872 PolarHBondContact NE2-NZ 3.12Å; H515-K872 VanDerWaalsContact NE2-NZ 3.13Å; E518-K872 IonicContact OE1-NZ 3Å; E518-K872 PolarHBondContact OE1-NZ 2.87Å; E518-K872 IonicContact OE2-NZ 3.05Å; L868-K872 PolarHBondContact O-N 2.78Å; L869-K872 VanDerWaalsContact O-CB 3.29Å; L869-K872 WeakPolarHBondContact O-CB 3.4Å; L869-K872 PolarHBondContact O-N 3.19Å; L869-K872 VanDerWaalsContact O-N 3.07Å; F870-K872 PolarHBondContact O-N 3.42Å; K872-Y874 VanDerWaalsContact C-N 3.34Å; K872-R914 PolarHBondContact O-NH1 3.39Å; K872-R914 PolarHBondContact O-NH2 3.18Å; K872-I915 HydrophobicContact CD-CD1 4.38Å; K872-I915 HydrophobicContact CG-CD1 3.89Å; K872-I918 HydrophobicContact CB-CD1 3.97Å
873	S	74.4	Confident	81.8	Confident	84 Å²	84	74.2 Å²	74.2	59%	0.587	38%	0.382	S	S	*	.	H	α-helix	trans	-91.5	6.5	-177.1	57.8	0	0	0	0	113.7	L869 F870 E875	L869-S873 PolarHBondContact O-N 2.65Å; F870-S873 CarbonylContact O-C 3.58Å; F870-S873 PolarHBondContact O-N 2.97Å; F870-S873 VanDerWaalsContact O-N 3.15Å; F870-S873 PolarHBondContact O-OG 3.36Å; S873-E875 PolarHBondContact O-N 3.43Å
874	Y	80.1	Confident	82.2	Confident	58 Å²	58	71.1 Å²	71.1	23%	0.227	37%	0.369	C	S	.	.			trans	-67	124.3	178.9	-168	-109.8	0	0	0	110.4	F870 K872 G876 V878 L881 R914	F870-Y874 HydrophobicContact CD1-CD2 4.48Å; F870-Y874 AromaticContact CE1-CD2 3.59Å; F870-Y874 HydrophobicContact CE1-CD2 3.59Å; F870-Y874 HydrophobicContact CE1-CE2 4.05Å; F870-Y874 AromaticContact CZ-CD2 3.66Å; F870-Y874 HydrophobicContact CZ-CD2 3.66Å; F870-Y874 HydrophobicContact CZ-CE2 4.05Å; F870-Y874 PolarHBondContact O-N 3.04Å; K872-Y874 VanDerWaalsContact C-N 3.34Å; Y874-G876 WeakPolarHBondContact CD1-O 3.37Å; Y874-G876 VanDerWaalsContact CE1-CA 3.41Å; Y874-V878 HydrophobicContact CD1-CG2 4.14Å; Y874-L881 HydrophobicContact CD1-CD1 4.39Å; Y874-L881 HydrophobicContact CE1-CD1 4.34Å; Y874-R914 PolarHBondContact O-NH1 3.24Å
875	E	72.8	Confident	82.6	Confident	190 Å²	190	69.5 Å²	69.5	89%	0.888	36%	0.361	S	S	*	.			trans	-92.8	-14.9	-179.2	-62.9	-166.8	162.1	0	0	113.4	S873	S873-E875 PolarHBondContact O-N 3.43Å
876	G	81.8	Confident	83	Confident	33 Å²	33	68.4 Å²	68.4	34%	0.34	36%	0.358	S	S	.	.	S	Bend	trans	-79.3	-177.2	175.8	0	0	0	0	0	113.6	Y874 V878	Y874-G876 WeakPolarHBondContact CD1-O 3.37Å; Y874-G876 VanDerWaalsContact CE1-CA 3.41Å; G876-V878 PolarHBondContact O-N 3.21Å
877	D	80.5	Confident	83.4	Confident	76 Å²	76	61.8 Å²	61.8	41%	0.406	33%	0.334	S	S	.	.			trans	-73.6	116.7	174.6	-169.5	-2.6	0	0	0	110.6	E879 E880	D877-E879 PolarHBondContact O-N 3.01Å; D877-E879 PolarHBondContact OD1-N 3.34Å; D877-E879 VanDerWaalsContact OD1-N 3.08Å; D877-E880 HydrophobicContact CB-CG 4.02Å; D877-E880 PolarHBondContact O-N 3.47Å
878	V	84.6	Confident	83.4	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-67.3	-26.8	-177.9	-179	0	0	0	0	111.4	L871 Y874 G876 E880 L881 V909	L871-V878 HydrophobicContact CD1-CG1 3.8Å; Y874-V878 HydrophobicContact CD1-CG2 4.14Å; G876-V878 PolarHBondContact O-N 3.21Å; V878-E880 PolarHBondContact O-N 2.8Å; V878-L881 HydrophobicContact CG1-CD1 4.48Å; V878-L881 WeakPolarHBondContact O-CB 3.46Å; V878-L881 PolarHBondContact O-N 3.19Å; V878-V909 HydrophobicContact CG1-CB 4.37Å; V878-V909 HydrophobicContact CG1-CG1 3.83Å
879	E	84.1	Confident	83.4	Confident	102 Å²	102	60.6 Å²	60.6	48%	0.477	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-66.3	-28.4	179.6	-68	-174.4	-168.6	0	0	112.1	D877 L881 G882 T910	D877-E879 PolarHBondContact O-N 3.01Å; D877-E879 PolarHBondContact OD1-N 3.34Å; D877-E879 VanDerWaalsContact OD1-N 3.08Å; E879-L881 PolarHBondContact O-N 2.78Å; E879-G882 PolarHBondContact O-N 3.32Å; E879-G882 VanDerWaalsContact O-N 3.13Å; E879-T910 HydrophobicContact CG-CG2 3.84Å; E879-T910 WeakPolarHBondContact OE1-CB 3.39Å; E879-T910 WeakPolarHBondContact OE1-CG2 3.35Å
880	E	84.9	Confident	83.4	Confident	153 Å²	153	63.9 Å²	63.9	72%	0.715	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-65.5	-21.1	177.1	-67.3	-178.2	173.9	0	0	113.1	D877 V878 G882	D877-E880 HydrophobicContact CB-CG 4.02Å; D877-E880 PolarHBondContact O-N 3.47Å; V878-E880 PolarHBondContact O-N 2.8Å; E880-G882 PolarHBondContact O-N 3.25Å
881	L	84.8	Confident	82.9	Confident	74 Å²	74	59.9 Å²	59.9	39%	0.387	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-72.4	-8.6	176.7	-60.5	174.5	0	0	0	112.8	L871 Y874 V878 E879 L883	L871-L881 HydrophobicContact CD1-CD1 3.57Å; Y874-L881 HydrophobicContact CD1-CD1 4.39Å; Y874-L881 HydrophobicContact CE1-CD1 4.34Å; V878-L881 HydrophobicContact CG1-CD1 4.48Å; V878-L881 WeakPolarHBondContact O-CB 3.46Å; V878-L881 PolarHBondContact O-N 3.19Å; E879-L881 PolarHBondContact O-N 2.78Å; L881-L883 HydrophobicContact CB-CD1 4.19Å; L881-L883 HydrophobicContact CB-CG 4Å; L881-L883 HydrophobicContact CD1-CD1 4.34Å; L881-L883 PolarHBondContact O-N 2.78Å
882	G	84.2	Confident	82.2	Confident	66 Å²	66	65.5 Å²	65.5	68%	0.68	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	21.3	177.1	0	0	0	0	0	113.9	E879 E880	E879-G882 PolarHBondContact O-N 3.32Å; E879-G882 VanDerWaalsContact O-N 3.13Å; E880-G882 PolarHBondContact O-N 3.25Å
883	L	90.1	Very high	81.8	Confident	56 Å²	56	66.7 Å²	66.7	29%	0.293	39%	0.386	S	S	.	.			trans	-78.8	138.3	179.4	-62.7	175.8	0	0	0	110.3	L871 L881 V909 Y917	L871-L883 HydrophobicContact CD1-CD1 3.97Å; L871-L883 HydrophobicContact CD2-CD1 3.98Å; L881-L883 HydrophobicContact CB-CD1 4.19Å; L881-L883 HydrophobicContact CB-CG 4Å; L881-L883 HydrophobicContact CD1-CD1 4.34Å; L881-L883 PolarHBondContact O-N 2.78Å; L883-V909 HydrophobicContact CB-CB 3.89Å; L883-V909 HydrophobicContact CB-CG2 3.73Å; L883-V909 PolarHBondContact O-N 3.45Å; L883-Y917 HydrophobicContact CD1-CE1 4.28Å
884	N	91.6	Very high	81.8	Confident	51 Å²	51	69.1 Å²	69.1	27%	0.273	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-123.3	175.1	168.6	60	9.3	0	0	0	109.7	T886 K905 I907 Y917	N884-T886 PolarHBondContact O-N 2.99Å; N884-T886 PolarHBondContact OD1-OG1 2.87Å; N884-K905 PolarHBondContact ND2-O 3.29Å; N884-K905 VanDerWaalsContact ND2-O 3.13Å; N884-I907 WeakPolarHBondContact CA-O 3.43Å; N884-Y917 WeakPolarHBondContact O-CE2 3.46Å
885	F	91.5	Very high	81.6	Confident	1 Å²	1	69.9 Å²	69.9	0%	0.004	41%	0.407	C	S	.	.	S	Bend	trans	-79.6	54.3	-178.9	-76.2	-101.6	0	0	0	112	L900 K901 G904 I907 V909 N913 A916 Y917 L920	F885-L900 HydrophobicContact CB-CB 4.44Å; F885-L900 WeakPolarHBondContact O-CB 3.45Å; F885-L900 PolarHBondContact O-N 2.92Å; F885-K901 HydrophobicContact CB-CD 4.14Å; F885-K901 HydrophobicContact CB-CG 4.02Å; F885-K901 HydrophobicContact CD1-CD 3.64Å; F885-K901 HydrophobicContact CD1-CG 4.29Å; F885-K901 HydrophobicContact CD2-CD 4.44Å; F885-K901 HydrophobicContact CE1-CD 4.12Å; F885-K901 HydrophobicContact CG-CD 3.82Å; F885-K901 HydrophobicContact CG-CG 4.27Å; F885-G904 PolarHBondContact N-O 2.7Å; F885-I907 HydrophobicContact CD2-CB 4.08Å; F885-I907 HydrophobicContact CD2-CG2 3.8Å; F885-I907 WeakPolarHBondContact CD2-O 3.25Å; F885-I907 HydrophobicContact CE2-CG2 3.87Å; F885-I907 PolarHBondContact N-O 3.25Å; F885-V909 HydrophobicContact CD2-CG2 4.16Å; F885-V909 HydrophobicContact CE2-CG2 4Å; F885-N913 HydrophobicContact CZ-CB 4.05Å; F885-A916 HydrophobicContact CE1-CB 4.5Å; F885-Y917 HydrophobicContact CD1-CD2 4.14Å; F885-Y917 HydrophobicContact CE1-CD2 4.39Å; F885-Y917 HydrophobicContact CG-CD2 4.37Å; F885-L920 HydrophobicContact CD1-CD1 3.75Å; F885-L920 HydrophobicContact CE1-CD1 3.93Å
886	T	91.9	Very high	82.1	Confident	15 Å²	15	66.7 Å²	66.7	9%	0.092	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	157.8	176.9	74.5	0	0	0	0	112.2	N884 V897 V898 E899 K905	N884-T886 PolarHBondContact O-N 2.99Å; N884-T886 PolarHBondContact OD1-OG1 2.87Å; T886-V897 HydrophobicContact CG2-CG1 4.17Å; T886-V898 CarbonylContact C-O 3.48Å; T886-V898 WeakPolarHBondContact CA-O 3.46Å; T886-V898 WeakPolarHBondContact CB-O 3.42Å; T886-E899 HydrophobicContact CG2-CG 4.15Å; T886-K905 HydrophobicContact CG2-CB 4.28Å; T886-K905 HydrophobicContact CG2-CG 3.54Å
887	V	89.4	Confident	82.3	Confident	9 Å²	9	68.5 Å²	68.5	6%	0.055	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	135.4	171.8	173.7	0	0	0	0	108.5	V898 L900 V921 Y924	V887-V898 PolarHBondContact N-O 3.36Å; V887-V898 PolarHBondContact O-N 3.06Å; V887-L900 HydrophobicContact CG2-CD1 4.05Å; V887-L900 HydrophobicContact CG2-CD2 3.75Å; V887-L900 HydrophobicContact CG2-CG 4.11Å; V887-V921 HydrophobicContact CG2-CG1 4.33Å; V887-V921 HydrophobicContact CG2-CG2 4.13Å; V887-Y924 HydrophobicContact CB-CD1 4.25Å; V887-Y924 HydrophobicContact CB-CE1 4.28Å; V887-Y924 HydrophobicContact CG1-CD1 4.17Å; V887-Y924 HydrophobicContact CG1-CE1 4.04Å; V887-Y924 HydrophobicContact CG2-CD1 4.33Å
888	V	86.4	Confident	82.7	Confident	79 Å²	79	66.4 Å²	66.4	48%	0.479	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	123.5	174.1	-171.9	0	0	0	0	108.9	A895 Q896 V897 R925	V888-A895 HydrophobicContact CG1-CB 4.22Å; V888-Q896 WeakPolarHBondContact CA-O 3.28Å; V888-V897 HydrophobicContact CG2-CG2 4.34Å; V888-R925 PolarHBondContact O-NH2 3.15Å
889	N	83.7	Confident	83.1	Confident	6 Å²	6	69.9 Å²	69.9	3%	0.032	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.2	167	-66.7	-19.2	0	0	0	107.8	A895 Q896 Y924 R925 Q929	N889-A895 CarbonylContact O-C 3.24Å; N889-A895 WeakPolarHBondContact O-CA 3.38Å; N889-Q896 PolarHBondContact N-O 3.1Å; N889-Q896 PolarHBondContact O-N 2.93Å; N889-Y924 PolarHBondContact ND2-OH 3.24Å; N889-R925 PolarHBondContact OD1-NH1 2.85Å; N889-R925 PolarHBondContact OD1-NH2 3.41Å; N889-Q929 PolarHBondContact ND2-NE2 2.83Å
890	N	76.2	Confident	83.4	Confident	120 Å²	120	65.4 Å²	65.4	64%	0.642	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	80.3	176.4	-166.1	9.2	0	0	0	107.8
891	D	71.1	Confident	83.5	Confident	36 Å²	36	60.9 Å²	60.9	19%	0.193	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.1	-177.5	-66.8	-48.6	0	0	0	108.1	A803 M806 G893 E894	A803-D891 HydrophobicContact CB-CB 3.99Å; M806-D891 HydrophobicContact SD-CB 4.24Å; D891-G893 PolarHBondContact O-N 3.02Å; D891-E894 PolarHBondContact N-O 3.35Å; D891-E894 PolarHBondContact O-N 3.3Å; D891-E894 VanDerWaalsContact O-N 3.08Å
892	L	67.8	Low	83.7	Confident	126 Å²	126	63.4 Å²	63.4	66%	0.66	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	21.5	177.1	-56.3	170.3	0	0	0	115.7	M806 L807	M806-L892 HydrophobicContact CB-CD1 4.45Å; L807-L892 HydrophobicContact CD2-CD1 3.66Å; L807-L892 HydrophobicContact CD2-CD2 4.46Å; L807-L892 HydrophobicContact CG-CD1 4.13Å
893	G	66.3	Low	83.9	Confident	66 Å²	66	61.9 Å²	61.9	68%	0.68	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.4	-1.2	178.4	0	0	0	0	0	115	D891	D891-G893 PolarHBondContact O-N 3.02Å
894	E	73.3	Confident	83.8	Confident	134 Å²	134	59.2 Å²	59.2	63%	0.626	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	121.4	169.8	-68	-169.1	165.4	0	0	110.5	M806 D891 Q896	M806-E894 WeakPolarHBondContact CE-OE2 3.31Å; D891-E894 PolarHBondContact N-O 3.35Å; D891-E894 PolarHBondContact O-N 3.3Å; D891-E894 VanDerWaalsContact O-N 3.08Å; E894-Q896 PolarHBondContact O-N 3.14Å
895	A	76.3	Confident	83.7	Confident	75 Å²	75	61.5 Å²	61.5	62%	0.62	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	100.7	176.1	0	0	0	0	0	110	V888 N889	V888-A895 HydrophobicContact CG1-CB 4.22Å; N889-A895 CarbonylContact O-C 3.24Å; N889-A895 WeakPolarHBondContact O-CA 3.38Å
896	Q	82.8	Confident	83.6	Confident	123 Å²	123	68.2 Å²	68.2	58%	0.575	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.4	174.7	-165.3	-175.1	33.6	0	0	110.4	V888 N889 E894 V898	V888-Q896 WeakPolarHBondContact CA-O 3.28Å; N889-Q896 PolarHBondContact N-O 3.1Å; N889-Q896 PolarHBondContact O-N 2.93Å; E894-Q896 PolarHBondContact O-N 3.14Å; Q896-V898 HydrophobicContact CG-CG2 4.35Å
897	V	87.2	Confident	83.5	Confident	70 Å²	70	70.2 Å²	70.2	42%	0.424	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	117.2	175.5	-176.1	0	0	0	0	109.6	T886 V888	T886-V897 HydrophobicContact CG2-CG1 4.17Å; V888-V897 HydrophobicContact CG2-CG2 4.34Å
898	V	89.4	Confident	83.6	Confident	32 Å²	32	72.8 Å²	72.8	19%	0.194	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.4	-179.4	-177.2	0	0	0	0	110.2	T886 V887 Q896 Y924	T886-V898 CarbonylContact C-O 3.48Å; T886-V898 WeakPolarHBondContact CA-O 3.46Å; T886-V898 WeakPolarHBondContact CB-O 3.42Å; V887-V898 PolarHBondContact N-O 3.36Å; V887-V898 PolarHBondContact O-N 3.06Å; Q896-V898 HydrophobicContact CG-CG2 4.35Å; V898-Y924 HydrophobicContact CB-CE2 4.41Å; V898-Y924 HydrophobicContact CG1-CD2 4.47Å; V898-Y924 HydrophobicContact CG1-CE2 3.72Å
899	E	91.8	Very high	83.7	Confident	74 Å²	74	69 Å²	69	35%	0.346	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	130.1	175.2	-70.9	179	-149.9	0	0	111.2	T886 G903 G904 K905	T886-E899 HydrophobicContact CG2-CG 4.15Å; E899-G903 PolarHBondContact OE2-N 3.16Å; E899-G904 PolarHBondContact OE2-N 3.39Å; E899-K905 HydrophobicContact CG-CD 4.22Å; E899-K905 HydrophobicContact CG-CG 3.86Å; E899-K905 WeakPolarHBondContact OE1-CD 3.5Å; E899-K905 WeakPolarHBondContact OE1-CE 3.47Å; E899-K905 WeakPolarHBondContact OE1-CG 3.38Å; E899-K905 IonicContact OE1-NZ 3.9Å; E899-K905 PolarHBondContact OE1-NZ 3.11Å; E899-K905 VanDerWaalsContact OE1-NZ 3.13Å
900	L	90.2	Very high	83.8	Confident	8 Å²	8	70.1 Å²	70.1	4%	0.042	40%	0.404	C	S	.	.	S	Bend	trans	-78.9	-25.8	-178.9	-65.8	175.4	0	0	0	113.1	F885 V887 Y917 L920 V921 Y924	F885-L900 HydrophobicContact CB-CB 4.44Å; F885-L900 WeakPolarHBondContact O-CB 3.45Å; F885-L900 PolarHBondContact O-N 2.92Å; V887-L900 HydrophobicContact CG2-CD1 4.05Å; V887-L900 HydrophobicContact CG2-CD2 3.75Å; V887-L900 HydrophobicContact CG2-CG 4.11Å; L900-Y917 HydrophobicContact CD1-CD2 4.1Å; L900-Y917 HydrophobicContact CD1-CE2 3.99Å; L900-L920 HydrophobicContact CB-CB 4.09Å; L900-L920 HydrophobicContact CB-CD1 4.4Å; L900-L920 HydrophobicContact CD1-CB 4.12Å; L900-V921 HydrophobicContact CD1-CG2 3.52Å; L900-Y924 HydrophobicContact CD2-CD1 4.45Å; L900-Y924 HydrophobicContact CD2-CD2 4.46Å; L900-Y924 HydrophobicContact CD2-CG 3.93Å
901	K	87.3	Confident	84	Confident	57 Å²	57	68 Å²	68	25%	0.248	40%	0.396	C	S	.	.	S	Bend	trans	-146.5	159	178	71	-172.8	-172.6	-169.9	0	109.4	F885 G903 G904 I907 L920	F885-K901 HydrophobicContact CB-CD 4.14Å; F885-K901 HydrophobicContact CB-CG 4.02Å; F885-K901 HydrophobicContact CD1-CD 3.64Å; F885-K901 HydrophobicContact CD1-CG 4.29Å; F885-K901 HydrophobicContact CD2-CD 4.44Å; F885-K901 HydrophobicContact CE1-CD 4.12Å; F885-K901 HydrophobicContact CG-CD 3.82Å; F885-K901 HydrophobicContact CG-CG 4.27Å; K901-G903 PolarHBondContact O-N 3.45Å; K901-G904 WeakPolarHBondContact O-CA 3.27Å; K901-G904 PolarHBondContact O-N 2.91Å; K901-I907 HydrophobicContact CD-CD1 4.49Å; K901-L920 HydrophobicContact CB-CD1 4.39Å; K901-L920 HydrophobicContact CD-CD1 4.33Å
902	P	88.4	Confident	84.3	Confident	127 Å²	127	71 Å²	71	83%	0.825	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	127.5	179.5	-24.1	34.2	0	0	0	111.9	G904	P902-G904 VanDerWaalsContact C-N 3.29Å; P902-G904 PolarHBondContact O-N 3.3Å
903	G	89.1	Confident	85	Confident	34 Å²	34	66.6 Å²	66.6	35%	0.351	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	21.7	-177.2	0	0	0	0	0	113.5	E899 K901 K905 D906 I907	E899-G903 PolarHBondContact OE2-N 3.16Å; K901-G903 PolarHBondContact O-N 3.45Å; G903-K905 PolarHBondContact O-N 2.97Å; G903-D906 PolarHBondContact O-N 3.43Å; G903-I907 WeakPolarHBondContact O-CD1 3.34Å; G903-I907 WeakPolarHBondContact O-CG1 3.36Å
904	G	88.8	Confident	85.7	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-64.3	-25.1	-171.2	0	0	0	0	0	114.4	F885 E899 K901 P902 D906 I907	F885-G904 PolarHBondContact N-O 2.7Å; E899-G904 PolarHBondContact OE2-N 3.39Å; K901-G904 WeakPolarHBondContact O-CA 3.27Å; K901-G904 PolarHBondContact O-N 2.91Å; P902-G904 VanDerWaalsContact C-N 3.29Å; P902-G904 PolarHBondContact O-N 3.3Å; G904-D906 VanDerWaalsContact C-N 3.31Å; G904-D906 PolarHBondContact O-N 2.95Å; G904-I907 PolarHBondContact O-N 3.48Å
905	K	89.3	Confident	86	Confident	100 Å²	100	62.8 Å²	62.8	44%	0.435	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-61.8	-37.3	176.7	-79.1	172.8	-168.7	157	0	113.1	N884 T886 E899 G903	N884-K905 PolarHBondContact ND2-O 3.29Å; N884-K905 VanDerWaalsContact ND2-O 3.13Å; T886-K905 HydrophobicContact CG2-CB 4.28Å; T886-K905 HydrophobicContact CG2-CG 3.54Å; E899-K905 HydrophobicContact CG-CD 4.22Å; E899-K905 HydrophobicContact CG-CG 3.86Å; E899-K905 WeakPolarHBondContact OE1-CD 3.5Å; E899-K905 WeakPolarHBondContact OE1-CE 3.47Å; E899-K905 WeakPolarHBondContact OE1-CG 3.38Å; E899-K905 IonicContact OE1-NZ 3.9Å; E899-K905 PolarHBondContact OE1-NZ 3.11Å; E899-K905 VanDerWaalsContact OE1-NZ 3.13Å; G903-K905 PolarHBondContact O-N 2.97Å
906	D	89.6	Confident	86.2	Confident	141 Å²	141	61.5 Å²	61.5	75%	0.754	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-92.4	-2.5	-174	-56.1	-47.2	0	0	0	112.8	G903 G904 P908	G903-D906 PolarHBondContact O-N 3.43Å; G904-D906 VanDerWaalsContact C-N 3.31Å; G904-D906 PolarHBondContact O-N 2.95Å; D906-P908 WeakPolarHBondContact O-CD 3.48Å
907	I	90.1	Very high	86.3	Confident	57 Å²	57	56.8 Å²	56.8	29%	0.292	33%	0.333	S	S	.	.			trans	-104.4	110.4	-176.5	-59	165.1	0	0	0	108.9	N884 F885 K901 G903 G904	N884-I907 WeakPolarHBondContact CA-O 3.43Å; F885-I907 HydrophobicContact CD2-CB 4.08Å; F885-I907 HydrophobicContact CD2-CG2 3.8Å; F885-I907 WeakPolarHBondContact CD2-O 3.25Å; F885-I907 HydrophobicContact CE2-CG2 3.87Å; F885-I907 PolarHBondContact N-O 3.25Å; K901-I907 HydrophobicContact CD-CD1 4.49Å; G903-I907 WeakPolarHBondContact O-CD1 3.34Å; G903-I907 WeakPolarHBondContact O-CG1 3.36Å; G904-I907 PolarHBondContact O-N 3.48Å
908	P	90.4	Very high	86.2	Confident	63 Å²	63	54 Å²	54	41%	0.409	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-70.3	150.9	175.6	29	-34	0	0	0	111.2	D906 N913	D906-P908 WeakPolarHBondContact O-CD 3.48Å; P908-N913 PolarHBondContact O-ND2 3.25Å
909	V	88.8	Confident	85.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.324	C	S	.	.			trans	-82.1	123.9	171.5	-175.6	0	0	0	0	108.6	V878 L883 F885 N913 R914 Y917	V878-V909 HydrophobicContact CG1-CB 4.37Å; V878-V909 HydrophobicContact CG1-CG1 3.83Å; L883-V909 HydrophobicContact CB-CB 3.89Å; L883-V909 HydrophobicContact CB-CG2 3.73Å; L883-V909 PolarHBondContact O-N 3.45Å; F885-V909 HydrophobicContact CD2-CG2 4.16Å; F885-V909 HydrophobicContact CE2-CG2 4Å; V909-N913 VanDerWaalsContact CA-OD1 3.26Å; V909-N913 WeakPolarHBondContact CA-OD1 3.06Å; V909-R914 HydrophobicContact CG1-CB 4.17Å; V909-Y917 HydrophobicContact CG1-CD1 4.37Å; V909-Y917 HydrophobicContact CG1-CG 4.16Å; V909-Y917 HydrophobicContact CG2-CD1 4.33Å; V909-Y917 HydrophobicContact CG2-CD2 3.59Å; V909-Y917 HydrophobicContact CG2-CE2 4.08Å; V909-Y917 HydrophobicContact CG2-CG 3.73Å
910	T	86.6	Confident	85.5	Confident	29 Å²	29	54.7 Å²	54.7	18%	0.178	32%	0.318	C	S	.	.			trans	-122.6	165.9	-176.6	80.6	0	0	0	0	109.7	E879 A912 N913 R914	E879-T910 HydrophobicContact CG-CG2 3.84Å; E879-T910 WeakPolarHBondContact OE1-CB 3.39Å; E879-T910 WeakPolarHBondContact OE1-CG2 3.35Å; T910-A912 PolarHBondContact O-N 3.36Å; T910-A912 VanDerWaalsContact O-N 3.12Å; T910-A912 PolarHBondContact OG1-N 3.33Å; T910-N913 PolarHBondContact N-OD1 3.27Å; T910-N913 PolarHBondContact O-N 2.75Å; T910-N913 PolarHBondContact O-OD1 3.09Å; T910-R914 WeakPolarHBondContact O-CB 3.31Å; T910-R914 PolarHBondContact O-N 3.17Å
911	T	79.9	Confident	85.4	Confident	75 Å²	75	54.4 Å²	54.4	46%	0.46	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.5	177.8	-54.1	0	0	0	0	113.1
912	A	77.7	Confident	85.3	Confident	99 Å²	99	51.8 Å²	51.8	82%	0.818	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-29.5	178.3	0	0	0	0	0	113.2	T910	T910-A912 PolarHBondContact O-N 3.36Å; T910-A912 VanDerWaalsContact O-N 3.12Å; T910-A912 PolarHBondContact OG1-N 3.33Å
913	N	82	Confident	85.1	Confident	34 Å²	34	47.7 Å²	47.7	18%	0.182	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-3.2	-173.5	77.4	23.7	0	0	0	114.1	F885 P908 V909 T910 I915 A916 Y917	F885-N913 HydrophobicContact CZ-CB 4.05Å; P908-N913 PolarHBondContact O-ND2 3.25Å; V909-N913 VanDerWaalsContact CA-OD1 3.26Å; V909-N913 WeakPolarHBondContact CA-OD1 3.06Å; T910-N913 PolarHBondContact N-OD1 3.27Å; T910-N913 PolarHBondContact O-N 2.75Å; T910-N913 PolarHBondContact O-OD1 3.09Å; N913-I915 VanDerWaalsContact C-N 3.29Å; N913-I915 PolarHBondContact O-N 2.88Å; N913-A916 WeakPolarHBondContact O-CB 3.31Å; N913-A916 PolarHBondContact O-N 2.76Å; N913-Y917 PolarHBondContact O-N 3.26Å
914	R	80.9	Confident	85.1	Confident	52 Å²	52	47.1 Å²	47.1	20%	0.196	26%	0.264	C	S	.	.	H	α-helix	trans	-55.3	-37.8	-178.3	70.4	-176.8	176.6	179.9	-0.7	114.3	K872 Y874 V909 T910 A916 Y917 I918	K872-R914 PolarHBondContact O-NH1 3.39Å; K872-R914 PolarHBondContact O-NH2 3.18Å; Y874-R914 PolarHBondContact O-NH1 3.24Å; V909-R914 HydrophobicContact CG1-CB 4.17Å; T910-R914 WeakPolarHBondContact O-CB 3.31Å; T910-R914 PolarHBondContact O-N 3.17Å; R914-A916 VanDerWaalsContact C-N 3.35Å; R914-Y917 WeakPolarHBondContact O-CB 3.29Å; R914-Y917 PolarHBondContact O-N 3.15Å; R914-I918 VanDerWaalsContact O-CG1 3.32Å; R914-I918 WeakPolarHBondContact O-CG1 3.11Å; R914-I918 PolarHBondContact O-N 3.28Å
915	I	79.4	Confident	85	Confident	68 Å²	68	49.6 Å²	49.6	35%	0.349	27%	0.273	S	S	.	.	H	α-helix	trans	-65.1	-43	178.2	-58.7	-59.6	0	0	0	109.9	K872 N913 Y917 I918 H919	K872-I915 HydrophobicContact CD-CD1 4.38Å; K872-I915 HydrophobicContact CG-CD1 3.89Å; N913-I915 VanDerWaalsContact C-N 3.29Å; N913-I915 PolarHBondContact O-N 2.88Å; I915-Y917 VanDerWaalsContact C-N 3.32Å; I915-Y917 PolarHBondContact O-N 3.47Å; I915-I918 PolarHBondContact O-N 2.72Å; I915-H919 PolarHBondContact O-CD2 3.05Å; I915-H919 PolarHBondContact O-N 3.49Å
916	A	79.8	Confident	84.7	Confident	49 Å²	49	44.9 Å²	44.9	41%	0.405	25%	0.253	S	S	.	.	H	α-helix	trans	-63.5	-38.2	176.3	0	0	0	0	0	111.9	F885 N913 R914 L920	F885-A916 HydrophobicContact CE1-CB 4.5Å; N913-A916 WeakPolarHBondContact O-CB 3.31Å; N913-A916 PolarHBondContact O-N 2.76Å; R914-A916 VanDerWaalsContact C-N 3.35Å; A916-L920 WeakPolarHBondContact O-CB 3.25Å; A916-L920 VanDerWaalsContact O-CG 3.25Å; A916-L920 WeakPolarHBondContact O-CG 3.29Å; A916-L920 PolarHBondContact O-N 2.96Å
917	Y	86.3	Confident	84.4	Confident	24 Å²	24	38.8 Å²	38.8	9%	0.094	22%	0.22	C	C	.	.	H	α-helix	trans	-60.8	-50.2	173.6	174.7	-101.2	0	0	0	111.7	L868 L871 L883 N884 F885 L900 V909 N913 R914 I915 H919 L920 V921	L868-Y917 HydrophobicContact CD2-CE1 4.14Å; L871-Y917 HydrophobicContact CD2-CD1 3.57Å; L871-Y917 HydrophobicContact CD2-CE1 3.8Å; L883-Y917 HydrophobicContact CD1-CE1 4.28Å; N884-Y917 WeakPolarHBondContact O-CE2 3.46Å; F885-Y917 HydrophobicContact CD1-CD2 4.14Å; F885-Y917 HydrophobicContact CE1-CD2 4.39Å; F885-Y917 HydrophobicContact CG-CD2 4.37Å; L900-Y917 HydrophobicContact CD1-CD2 4.1Å; L900-Y917 HydrophobicContact CD1-CE2 3.99Å; V909-Y917 HydrophobicContact CG1-CD1 4.37Å; V909-Y917 HydrophobicContact CG1-CG 4.16Å; V909-Y917 HydrophobicContact CG2-CD1 4.33Å; V909-Y917 HydrophobicContact CG2-CD2 3.59Å; V909-Y917 HydrophobicContact CG2-CE2 4.08Å; V909-Y917 HydrophobicContact CG2-CG 3.73Å; N913-Y917 PolarHBondContact O-N 3.26Å; R914-Y917 WeakPolarHBondContact O-CB 3.29Å; R914-Y917 PolarHBondContact O-N 3.15Å; I915-Y917 VanDerWaalsContact C-N 3.32Å; I915-Y917 PolarHBondContact O-N 3.47Å; Y917-H919 VanDerWaalsContact C-N 3.34Å; Y917-H919 PolarHBondContact O-N 2.73Å; Y917-L920 PolarHBondContact O-N 2.9Å; Y917-L920 VanDerWaalsContact O-N 3.16Å; Y917-V921 HydrophobicContact CD1-CG2 4.2Å; Y917-V921 HydrophobicContact CD2-CG2 4.01Å; Y917-V921 HydrophobicContact CE1-CG2 3.84Å; Y917-V921 HydrophobicContact CE2-CG2 3.6Å; Y917-V921 HydrophobicContact CG-CG2 4.3Å; Y917-V921 VanDerWaalsContact O-CG2 3.31Å; Y917-V921 WeakPolarHBondContact O-CG2 3.02Å; Y917-V921 PolarHBondContact O-N 2.93Å
918	I	84.4	Confident	84.2	Confident	11 Å²	11	40.4 Å²	40.4	6%	0.056	23%	0.225	C	C	.	.	H	α-helix	trans	-56.4	-47.2	178.5	-67	162.7	0	0	0	111.2	I854 L868 L871 K872 R914 I915 A922	I854-I918 HydrophobicContact CD1-CG2 3.76Å; L868-I918 HydrophobicContact CB-CG1 4.45Å; L868-I918 HydrophobicContact CB-CG2 4.23Å; L868-I918 HydrophobicContact CD2-CG1 4.37Å; L868-I918 WeakPolarHBondContact O-CD1 3.29Å; L871-I918 HydrophobicContact CB-CD1 4.43Å; L871-I918 HydrophobicContact CD2-CG1 4.17Å; K872-I918 HydrophobicContact CB-CD1 3.97Å; R914-I918 VanDerWaalsContact O-CG1 3.32Å; R914-I918 WeakPolarHBondContact O-CG1 3.11Å; R914-I918 PolarHBondContact O-N 3.28Å; I915-I918 PolarHBondContact O-N 2.72Å; I918-A922 WeakPolarHBondContact O-CB 3.29Å; I918-A922 PolarHBondContact O-N 3.33Å; I918-A922 VanDerWaalsContact O-N 3.1Å
919	H	81.8	Confident	84	Confident	78 Å²	78	39 Å²	39	36%	0.361	21%	0.213	S	C	.	.	H	α-helix	trans	-60.6	-45.6	176.3	-78.5	-72.4	0	0	0	112.7	I854 I915 Y917 A922 D923	I854-H919 HydrophobicContact CD1-CB 4.47Å; I854-H919 WeakPolarHBondContact CD1-ND1 3.31Å; I915-H919 PolarHBondContact O-CD2 3.05Å; I915-H919 PolarHBondContact O-N 3.49Å; Y917-H919 VanDerWaalsContact C-N 3.34Å; Y917-H919 PolarHBondContact O-N 2.73Å; H919-A922 PolarHBondContact O-N 3.47Å; H919-D923 WeakPolarHBondContact O-CB 3.26Å; H919-D923 PolarHBondContact O-N 2.87Å
920	L	85.3	Confident	84	Confident	43 Å²	43	39.2 Å²	39.2	23%	0.225	21%	0.214	C	C	.	.	H	α-helix	trans	-68.3	-37.6	-178.4	-73.6	170.5	0	0	0	112.8	F885 L900 K901 A916 Y917 Y924	F885-L920 HydrophobicContact CD1-CD1 3.75Å; F885-L920 HydrophobicContact CE1-CD1 3.93Å; L900-L920 HydrophobicContact CB-CB 4.09Å; L900-L920 HydrophobicContact CB-CD1 4.4Å; L900-L920 HydrophobicContact CD1-CB 4.12Å; K901-L920 HydrophobicContact CB-CD1 4.39Å; K901-L920 HydrophobicContact CD-CD1 4.33Å; A916-L920 WeakPolarHBondContact O-CB 3.25Å; A916-L920 VanDerWaalsContact O-CG 3.25Å; A916-L920 WeakPolarHBondContact O-CG 3.29Å; A916-L920 PolarHBondContact O-N 2.96Å; Y917-L920 PolarHBondContact O-N 2.9Å; Y917-L920 VanDerWaalsContact O-N 3.16Å; L920-Y924 VanDerWaalsContact O-CB 3.28Å; L920-Y924 WeakPolarHBondContact O-CB 3.04Å; L920-Y924 PolarHBondContact O-N 2.82Å
921	V	88	Confident	84.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-47.3	176.2	173.7	0	0	0	0	110.7	M864 L868 V887 L900 Y917 Y924 R925	M864-V921 HydrophobicContact CE-CG1 3.22Å; M864-V921 HydrophobicContact SD-CG1 4.49Å; L868-V921 HydrophobicContact CD1-CB 4.29Å; L868-V921 HydrophobicContact CD1-CG1 3.87Å; L868-V921 HydrophobicContact CD2-CB 4.38Å; L868-V921 HydrophobicContact CD2-CG1 4.2Å; V887-V921 HydrophobicContact CG2-CG1 4.33Å; V887-V921 HydrophobicContact CG2-CG2 4.13Å; L900-V921 HydrophobicContact CD1-CG2 3.52Å; Y917-V921 HydrophobicContact CD1-CG2 4.2Å; Y917-V921 HydrophobicContact CD2-CG2 4.01Å; Y917-V921 HydrophobicContact CE1-CG2 3.84Å; Y917-V921 HydrophobicContact CE2-CG2 3.6Å; Y917-V921 HydrophobicContact CG-CG2 4.3Å; Y917-V921 VanDerWaalsContact O-CG2 3.31Å; Y917-V921 WeakPolarHBondContact O-CG2 3.02Å; Y917-V921 PolarHBondContact O-N 2.93Å; V921-Y924 PolarHBondContact O-N 3.36Å; V921-R925 PolarHBondContact O-N 3.4Å
922	A	84.8	Confident	84.5	Confident	2 Å²	2	44.5 Å²	44.5	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-42.3	178.9	0	0	0	0	0	112.1	I854 L857 I918 H919 Y924 R925 L926	I854-A922 HydrophobicContact CB-CB 4.44Å; I854-A922 HydrophobicContact CD1-CB 4Å; I854-A922 HydrophobicContact CG1-CB 3.21Å; L857-A922 HydrophobicContact CD2-CB 4.41Å; I918-A922 WeakPolarHBondContact O-CB 3.29Å; I918-A922 PolarHBondContact O-N 3.33Å; I918-A922 VanDerWaalsContact O-N 3.1Å; H919-A922 PolarHBondContact O-N 3.47Å; A922-Y924 VanDerWaalsContact C-N 3.3Å; A922-Y924 PolarHBondContact O-N 3.32Å; A922-R925 PolarHBondContact O-N 3.49Å; A922-L926 VanDerWaalsContact O-CB 3.31Å; A922-L926 WeakPolarHBondContact O-CB 3.3Å; A922-L926 WeakPolarHBondContact O-CG 3.23Å; A922-L926 PolarHBondContact O-N 2.97Å
923	D	84.5	Confident	85.2	Confident	41 Å²	41	40 Å²	40	22%	0.219	19%	0.191	C	C	.	.	H	α-helix	trans	-60.6	-40.2	173.4	178.7	57.7	0	0	0	111.6	H919 N927 K928	H919-D923 WeakPolarHBondContact O-CB 3.26Å; H919-D923 PolarHBondContact O-N 2.87Å; D923-N927 CarbonylContact O-C 3.55Å; D923-N927 VanDerWaalsContact O-CA 3.26Å; D923-N927 WeakPolarHBondContact O-CA 3.46Å; D923-N927 WeakPolarHBondContact O-CB 3.46Å; D923-N927 PolarHBondContact O-N 3.18Å; D923-N927 WeakPolarHBondContact OD1-CB 3.25Å; D923-N927 PolarHBondContact OD1-ND2 2.91Å; D923-K928 PolarHBondContact O-N 2.88Å; D923-K928 WeakPolarHBondContact OD2-CE 3.32Å; D923-K928 IonicContact OD2-NZ 2.82Å
924	Y	88.6	Confident	85.6	Confident	23 Å²	23	38.9 Å²	38.9	9%	0.09	19%	0.187	C	C	.	.	I	π-helix	trans	-62.5	-53.6	176.3	176.4	-102.7	0	0	0	112	V887 N889 V898 L900 L920 V921 A922 K928 Q929	V887-Y924 HydrophobicContact CB-CD1 4.25Å; V887-Y924 HydrophobicContact CB-CE1 4.28Å; V887-Y924 HydrophobicContact CG1-CD1 4.17Å; V887-Y924 HydrophobicContact CG1-CE1 4.04Å; V887-Y924 HydrophobicContact CG2-CD1 4.33Å; N889-Y924 PolarHBondContact ND2-OH 3.24Å; V898-Y924 HydrophobicContact CB-CE2 4.41Å; V898-Y924 HydrophobicContact CG1-CD2 4.47Å; V898-Y924 HydrophobicContact CG1-CE2 3.72Å; L900-Y924 HydrophobicContact CD2-CD1 4.45Å; L900-Y924 HydrophobicContact CD2-CD2 4.46Å; L900-Y924 HydrophobicContact CD2-CG 3.93Å; L920-Y924 VanDerWaalsContact O-CB 3.28Å; L920-Y924 WeakPolarHBondContact O-CB 3.04Å; L920-Y924 PolarHBondContact O-N 2.82Å; V921-Y924 PolarHBondContact O-N 3.36Å; A922-Y924 VanDerWaalsContact C-N 3.3Å; A922-Y924 PolarHBondContact O-N 3.32Å; Y924-K928 HydrophobicContact CD2-CB 3.94Å; Y924-K928 HydrophobicContact CD2-CD 4.24Å; Y924-K928 PolarHBondContact O-N 3.47Å; Y924-Q929 HydrophobicContact CE1-CB 4.43Å; Y924-Q929 WeakPolarHBondContact O-CB 3.28Å; Y924-Q929 PolarHBondContact O-N 3.42Å
925	R	86.6	Confident	86	Confident	52 Å²	52	39.8 Å²	39.8	20%	0.196	20%	0.195	C	C	.	.	I	π-helix	trans	-65.9	-44.5	-176.7	-72.3	-68.9	-168.8	-158.1	-3.7	113.1	L857 L860 M864 V888 N889 V921 A922	L857-R925 HydrophobicContact CD1-CB 4.12Å; L860-R925 HydrophobicContact CD2-CB 4.27Å; M864-R925 HydrophobicContact CE-CG 3.86Å; M864-R925 HydrophobicContact SD-CG 3.82Å; V888-R925 PolarHBondContact O-NH2 3.15Å; N889-R925 PolarHBondContact OD1-NH1 2.85Å; N889-R925 PolarHBondContact OD1-NH2 3.41Å; V921-R925 PolarHBondContact O-N 3.4Å; A922-R925 PolarHBondContact O-N 3.49Å
926	L	83.1	Confident	86.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-80.4	-48.8	-178.9	-67	168.9	0	0	0	110.8	F840 K844 V852 H856 L857 L860 A922 I930	F840-L926 HydrophobicContact CB-CD2 4.32Å; F840-L926 HydrophobicContact CD2-CD2 4.13Å; F840-L926 HydrophobicContact CG-CD2 4.23Å; K844-L926 WeakPolarHBondContact CE-O 3.43Å; K844-L926 VanDerWaalsContact NZ-C 3.34Å; K844-L926 PolarHBondContact NZ-O 3.18Å; V852-L926 HydrophobicContact CG1-CD1 4.28Å; H856-L926 HydrophobicContact CB-CD1 4.21Å; H856-L926 HydrophobicContact CB-CD2 4.37Å; L857-L926 HydrophobicContact CB-CD1 4.14Å; L857-L926 HydrophobicContact CD1-CG 4.39Å; L860-L926 HydrophobicContact CB-CD2 4.26Å; L860-L926 HydrophobicContact CD2-CD2 4.08Å; A922-L926 VanDerWaalsContact O-CB 3.31Å; A922-L926 WeakPolarHBondContact O-CB 3.3Å; A922-L926 WeakPolarHBondContact O-CG 3.23Å; A922-L926 PolarHBondContact O-N 2.97Å; L926-I930 WeakPolarHBondContact O-CG1 3.39Å
927	N	82.8	Confident	87.3	Confident	13 Å²	13	34.6 Å²	34.6	7%	0.07	16%	0.162	C	C	.	.	I	π-helix	trans	-100.8	-55.8	-165.6	-50.9	-36.9	0	0	0	112.7	K844 A850 V852 D923 R931	K844-N927 PolarHBondContact NZ-OD1 3.1Å; A850-N927 PolarHBondContact O-OD1 2.69Å; V852-N927 PolarHBondContact N-OD1 3.3Å; D923-N927 CarbonylContact O-C 3.55Å; D923-N927 VanDerWaalsContact O-CA 3.26Å; D923-N927 WeakPolarHBondContact O-CA 3.46Å; D923-N927 WeakPolarHBondContact O-CB 3.46Å; D923-N927 PolarHBondContact O-N 3.18Å; D923-N927 WeakPolarHBondContact OD1-CB 3.25Å; D923-N927 PolarHBondContact OD1-ND2 2.91Å; N927-R931 VanDerWaalsContact O-CB 3.3Å; N927-R931 WeakPolarHBondContact O-CB 3.28Å; N927-R931 PolarHBondContact O-N 3.38Å
928	K	86	Confident	87.5	Confident	92 Å²	92	36.8 Å²	36.8	40%	0.4	17%	0.17	S	C	.	.	I	π-helix	trans	-71.6	-48	-170.7	-63.2	178.8	173.2	165	0	113.1	D923 Y924 I930 R931	D923-K928 PolarHBondContact O-N 2.88Å; D923-K928 WeakPolarHBondContact OD2-CE 3.32Å; D923-K928 IonicContact OD2-NZ 2.82Å; Y924-K928 HydrophobicContact CD2-CB 3.94Å; Y924-K928 HydrophobicContact CD2-CD 4.24Å; Y924-K928 PolarHBondContact O-N 3.47Å; K928-I930 PolarHBondContact O-N 3.11Å; K928-R931 WeakPolarHBondContact O-CB 3.18Å; K928-R931 PolarHBondContact O-N 2.87Å
929	Q	87.2	Confident	87.8	Confident	32 Å²	32	41 Å²	41	15%	0.15	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-45.8	-170.4	-168.1	-179.5	15.4	0	0	112.3	P802 N889 Y924	P802-Q929 HydrophobicContact CB-CG 3.88Å; P802-Q929 VanDerWaalsContact CB-NE2 3.34Å; P802-Q929 HydrophobicContact CG-CG 4.4Å; N889-Q929 PolarHBondContact ND2-NE2 2.83Å; Y924-Q929 HydrophobicContact CE1-CB 4.43Å; Y924-Q929 WeakPolarHBondContact O-CB 3.28Å; Y924-Q929 PolarHBondContact O-N 3.42Å
930	I	88.5	Confident	88.3	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.026	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	5.7	-178.1	61.4	173.7	0	0	0	113.9	P802 F840 K844 L926 K928 H933 C934	P802-I930 HydrophobicContact CG-CG2 3.96Å; F840-I930 HydrophobicContact CD2-CD1 4.46Å; F840-I930 HydrophobicContact CE2-CD1 3.84Å; K844-I930 HydrophobicContact CD-CD1 4.1Å; L926-I930 WeakPolarHBondContact O-CG1 3.39Å; K928-I930 PolarHBondContact O-N 3.11Å; I930-H933 WeakPolarHBondContact O-CB 3.26Å; I930-H933 PolarHBondContact O-N 3.42Å; I930-C934 PolarHBondContact O-N 2.82Å; I930-C934 PolarHBondContact O-SG 3.22Å
931	R	88.1	Confident	88.6	Confident	162 Å²	162	35.6 Å²	35.6	61%	0.611	16%	0.163	S	C	*	.	H	α-helix	trans	-51.8	-51.9	-177	-171	170.8	173.2	162.9	-3.8	114.4	N927 K928 H933 C934 L935	N927-R931 VanDerWaalsContact O-CB 3.3Å; N927-R931 WeakPolarHBondContact O-CB 3.28Å; N927-R931 PolarHBondContact O-N 3.38Å; K928-R931 WeakPolarHBondContact O-CB 3.18Å; K928-R931 PolarHBondContact O-N 2.87Å; R931-H933 VanDerWaalsContact C-N 3.34Å; R931-H933 PolarHBondContact O-N 2.93Å; R931-C934 PolarHBondContact O-N 3.19Å; R931-L935 WeakPolarHBondContact O-CB 3.4Å; R931-L935 PolarHBondContact O-N 2.94Å
932	P	89.4	Confident	88.7	Confident	54 Å²	54	37.7 Å²	37.7	35%	0.351	18%	0.18	S	C	.	.	H	α-helix	trans	-64	-40.6	-177.6	23	-31.6	0	0	0	111.7	F812 L935 A936	F812-P932 HydrophobicContact CE2-CB 4.39Å; F812-P932 HydrophobicContact CE2-CG 4.44Å; F812-P932 HydrophobicContact CZ-CB 4.26Å; F812-P932 HydrophobicContact CZ-CG 4.3Å; P932-L935 PolarHBondContact O-N 3.32Å; P932-A936 WeakPolarHBondContact O-CB 3.49Å; P932-A936 PolarHBondContact O-N 2.96Å
933	H	91.2	Very high	89	Confident	3 Å²	3	40.1 Å²	40.1	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-57.8	-53.1	175.7	-45.7	78.6	0	0	0	111.6	P800 F812 Y816 I930 R931 L935 F937	P800-H933 HydrophobicContact CB-CB 3.83Å; P800-H933 HydrophobicContact CG-CB 4.49Å; F812-H933 AromaticContact CD2-CD2 3.68Å; F812-H933 AromaticContact CD2-NE2 3.75Å; F812-H933 AromaticContact CE2-CD2 3.56Å; F812-H933 AromaticContact CE2-CE1 3.84Å; F812-H933 AromaticContact CE2-CG 3.99Å; F812-H933 AromaticContact CE2-NE2 3.44Å; F812-H933 WeakPolarHBondContact CE2-NE2 3.39Å; Y816-H933 HydrophobicContact CD1-CB 4.44Å; Y816-H933 HydrophobicContact CD2-CB 4.25Å; Y816-H933 HydrophobicContact CE1-CB 4.28Å; Y816-H933 HydrophobicContact CE2-CB 4.12Å; Y816-H933 AromaticContact CE2-CD2 3.39Å; Y816-H933 WeakPolarHBondContact CE2-CD2 3.25Å; Y816-H933 HydrophobicContact CG-CB 4.41Å; Y816-H933 AromaticContact CZ-CD2 3.66Å; I930-H933 WeakPolarHBondContact O-CB 3.26Å; I930-H933 PolarHBondContact O-N 3.42Å; R931-H933 VanDerWaalsContact C-N 3.34Å; R931-H933 PolarHBondContact O-N 2.93Å; H933-L935 PolarHBondContact O-N 3.29Å; H933-F937 WeakPolarHBondContact O-CB 3.28Å; H933-F937 PolarHBondContact O-N 3.23Å
934	C	90.6	Very high	89.3	Confident	12 Å²	12	38.3 Å²	38.3	8%	0.081	18%	0.184	C	C	.	.	H	α-helix	trans	-64.2	-39	179.2	-68.1	0	0	0	0	112.4	I930 R931 R938	I930-C934 PolarHBondContact O-N 2.82Å; I930-C934 PolarHBondContact O-SG 3.22Å; R931-C934 PolarHBondContact O-N 3.19Å; C934-R938 WeakPolarHBondContact O-CB 3.32Å; C934-R938 PolarHBondContact O-N 3.35Å
935	L	90.4	Very high	89.3	Confident	71 Å²	71	37.2 Å²	37.2	37%	0.372	18%	0.179	S	C	.	.	H	α-helix	trans	-65.6	-48.1	-179.9	-177.5	65.8	0	0	0	111.1	R931 P932 H933 R938 Q939	R931-L935 WeakPolarHBondContact O-CB 3.4Å; R931-L935 PolarHBondContact O-N 2.94Å; P932-L935 PolarHBondContact O-N 3.32Å; H933-L935 PolarHBondContact O-N 3.29Å; L935-R938 PolarHBondContact O-N 2.92Å; L935-Q939 WeakPolarHBondContact O-CB 3.19Å; L935-Q939 VanDerWaalsContact O-CG 3.28Å; L935-Q939 WeakPolarHBondContact O-CG 3.11Å; L935-Q939 PolarHBondContact O-N 2.81Å
936	A	91.9	Very high	89.3	Confident	7 Å²	7	38 Å²	38	6%	0.058	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-47.3	178.1	0	0	0	0	0	111.2	T813 Y817 P932 R938 Q939 G940	T813-A936 WeakPolarHBondContact O-CB 3.3Å; Y817-A936 WeakPolarHBondContact CA-O 2.89Å; P932-A936 WeakPolarHBondContact O-CB 3.49Å; P932-A936 PolarHBondContact O-N 2.96Å; A936-R938 PolarHBondContact O-N 2.99Å; A936-Q939 PolarHBondContact O-N 3.2Å; A936-G940 PolarHBondContact O-N 2.9Å
937	F	93.4	Very high	89.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.9	-46.3	175.6	-170.5	-86.1	0	0	0	112.5	F783 F790 Y816 L819 G820 L823 F841 L845 H933 Q939 G940 L941	F783-F937 AromaticContact CE1-CE2 3.96Å; F783-F937 HydrophobicContact CE1-CE2 3.96Å; F783-F937 HydrophobicContact CE1-CZ 4.25Å; F783-F937 AromaticContact CZ-CE2 3.67Å; F783-F937 HydrophobicContact CZ-CE2 3.67Å; F783-F937 AromaticContact CZ-CZ 3.91Å; F783-F937 HydrophobicContact CZ-CZ 3.91Å; F790-F937 HydrophobicContact CZ-CD2 4.31Å; F790-F937 HydrophobicContact CZ-CE2 4.11Å; Y816-F937 HydrophobicContact CD1-CD2 4.36Å; Y816-F937 WeakPolarHBondContact O-CA 3.49Å; Y816-F937 WeakPolarHBondContact O-CD2 3.21Å; L819-F937 HydrophobicContact CB-CD2 4.27Å; L819-F937 HydrophobicContact CB-CE2 4.02Å; G820-F937 WeakPolarHBondContact CA-O 3.46Å; L823-F937 HydrophobicContact CB-CZ 4.37Å; L823-F937 HydrophobicContact CD2-CE1 4.02Å; L823-F937 HydrophobicContact CD2-CZ 3.62Å; F841-F937 HydrophobicContact CE1-CE1 4.42Å; F841-F937 AromaticContact CZ-CD1 3.89Å; F841-F937 HydrophobicContact CZ-CD1 3.89Å; F841-F937 AromaticContact CZ-CE1 4Å; F841-F937 HydrophobicContact CZ-CE1 4Å; F841-F937 HydrophobicContact CZ-CG 4.15Å; F841-F937 HydrophobicContact CZ-CZ 4.34Å; L845-F937 HydrophobicContact CD1-CD1 4.04Å; L845-F937 HydrophobicContact CD1-CE1 3.76Å; L845-F937 HydrophobicContact CD2-CD1 3.59Å; L845-F937 HydrophobicContact CD2-CE1 4.2Å; L845-F937 HydrophobicContact CG-CD1 4.49Å; H933-F937 WeakPolarHBondContact O-CB 3.28Å; H933-F937 PolarHBondContact O-N 3.23Å; F937-Q939 PolarHBondContact O-N 2.84Å; F937-G940 PolarHBondContact O-N 3.4Å; F937-L941 PolarHBondContact O-N 3.44Å
938	R	91.9	Very high	89.3	Confident	70 Å²	70	41.4 Å²	41.4	26%	0.264	20%	0.204	S	C	.	.	H	α-helix	trans	-64.1	-39.9	178.8	-173.8	-179.6	74.7	163.8	2	112.1	L845 G847 C934 L935 A936 G940 L941 A942 L947	L845-R938 HydrophobicContact CD2-CB 4.11Å; L845-R938 WeakPolarHBondContact O-CD 3.2Å; G847-R938 PolarHBondContact O-NH1 2.9Å; C934-R938 WeakPolarHBondContact O-CB 3.32Å; C934-R938 PolarHBondContact O-N 3.35Å; L935-R938 PolarHBondContact O-N 2.92Å; A936-R938 PolarHBondContact O-N 2.99Å; R938-G940 VanDerWaalsContact C-N 3.31Å; R938-L941 PolarHBondContact O-N 3.41Å; R938-A942 VanDerWaalsContact O-CB 3.31Å; R938-A942 WeakPolarHBondContact O-CB 3.38Å; R938-A942 PolarHBondContact O-N 2.75Å; R938-L947 HydrophobicContact CG-CD1 3.63Å; R938-L947 HydrophobicContact CG-CD2 4.47Å
939	Q	90.8	Very high	89.3	Confident	101 Å²	101	37.7 Å²	37.7	47%	0.472	19%	0.187	S	C	.	.	H	α-helix	trans	-63	-39.6	174.7	-75.2	171.3	-13.6	0	0	111.4	Y817 L935 A936 F937 A942 N943	Y817-Q939 HydrophobicContact CD2-CB 3.84Å; Y817-Q939 HydrophobicContact CE2-CB 3.88Å; L935-Q939 WeakPolarHBondContact O-CB 3.19Å; L935-Q939 VanDerWaalsContact O-CG 3.28Å; L935-Q939 WeakPolarHBondContact O-CG 3.11Å; L935-Q939 PolarHBondContact O-N 2.81Å; A936-Q939 PolarHBondContact O-N 3.2Å; F937-Q939 PolarHBondContact O-N 2.84Å; Q939-A942 PolarHBondContact O-N 3.15Å; Q939-N943 PolarHBondContact O-N 3.26Å; Q939-N943 VanDerWaalsContact O-N 3.15Å
940	G	91.6	Very high	89.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-47	174.3	0	0	0	0	0	112.5	Y817 R821 A936 F937 R938 A942 N943	Y817-G940 VanDerWaalsContact CD2-N 3.32Å; Y817-G940 VanDerWaalsContact O-CA 3.29Å; Y817-G940 WeakPolarHBondContact O-CA 3.22Å; R821-G940 WeakPolarHBondContact CA-O 3.14Å; R821-G940 WeakPolarHBondContact CG-O 3.25Å; A936-G940 PolarHBondContact O-N 2.9Å; F937-G940 PolarHBondContact O-N 3.4Å; R938-G940 VanDerWaalsContact C-N 3.31Å; G940-A942 VanDerWaalsContact C-N 3.3Å; G940-A942 PolarHBondContact O-N 3.05Å; G940-N943 WeakPolarHBondContact O-CB 3.12Å; G940-N943 PolarHBondContact O-N 3.03Å
941	L	91.7	Very high	89.1	Confident	7 Å²	7	39.4 Å²	39.4	4%	0.037	19%	0.192	C	C	.	.	H	α-helix	trans	-58.6	-43.8	175.3	-174.3	66.1	0	0	0	111.8	G820 G824 L827 F937 R938 N943 V944 V945 L947 L950	G820-L941 VanDerWaalsContact O-CA 3.32Å; G820-L941 WeakPolarHBondContact O-CA 3.46Å; G820-L941 PolarHBondContact O-N 2.85Å; G824-L941 VanDerWaalsContact CA-CD1 3.46Å; L827-L941 HydrophobicContact CD1-CD1 4.2Å; F937-L941 PolarHBondContact O-N 3.44Å; R938-L941 PolarHBondContact O-N 3.41Å; L941-N943 PolarHBondContact O-N 3.41Å; L941-V944 PolarHBondContact O-N 3.42Å; L941-V945 PolarHBondContact O-N 3.29Å; L941-L947 HydrophobicContact CB-CD2 4.45Å; L941-L947 HydrophobicContact CD2-CD2 3.95Å; L941-L947 HydrophobicContact CG-CD2 4.11Å; L941-L950 HydrophobicContact CD2-CD1 3.84Å; L941-L950 HydrophobicContact CG-CD1 4.28Å
942	A	89.9	Confident	89	Confident	44 Å²	44	31.8 Å²	31.8	36%	0.364	16%	0.164	S	C	.	.	H	α-helix	trans	-64.7	-23.5	179.9	0	0	0	0	0	114.2	R938 Q939 G940 V944 V945 L947	R938-A942 VanDerWaalsContact O-CB 3.31Å; R938-A942 WeakPolarHBondContact O-CB 3.38Å; R938-A942 PolarHBondContact O-N 2.75Å; Q939-A942 PolarHBondContact O-N 3.15Å; G940-A942 VanDerWaalsContact C-N 3.3Å; G940-A942 PolarHBondContact O-N 3.05Å; A942-V944 VanDerWaalsContact C-N 3.3Å; A942-V945 WeakPolarHBondContact CA-O 3.18Å; A942-L947 HydrophobicContact CB-CD1 3.8Å; A942-L947 HydrophobicContact CB-CD2 4.21Å; A942-L947 HydrophobicContact CB-CG 3.72Å
943	N	90.3	Very high	89	Confident	54 Å²	54	29.6 Å²	29.6	29%	0.289	15%	0.149	S	C	.	.	H	α-helix	trans	-65.8	-34.2	176.8	170.5	-106	0	0	0	111.5	P744 R821 Q939 G940 L941	P744-N943 PolarHBondContact O-ND2 3.49Å; R821-N943 HydrophobicContact CG-CB 4.17Å; R821-N943 PolarHBondContact NE-OD1 3.37Å; R821-N943 PolarHBondContact NH2-OD1 3.48Å; Q939-N943 PolarHBondContact O-N 3.26Å; Q939-N943 VanDerWaalsContact O-N 3.15Å; G940-N943 WeakPolarHBondContact O-CB 3.12Å; G940-N943 PolarHBondContact O-N 3.03Å; L941-N943 PolarHBondContact O-N 3.41Å
944	V	90.2	Very high	88.8	Confident	2 Å²	2	31 Å²	31	1%	0.012	16%	0.156	C	C	.	.	H	α-helix	trans	-102.4	-44	-177	-171.1	0	0	0	0	112	L746 K747 R821 Y828 L941 A942	L746-V944 HydrophobicContact CB-CG2 3.93Å; K747-V944 WeakPolarHBondContact CE-O 3.5Å; K747-V944 HydrophobicContact CG-CG1 4.35Å; R821-V944 HydrophobicContact CB-CG2 4.39Å; Y828-V944 HydrophobicContact CG-CG1 4.17Å; L941-V944 PolarHBondContact O-N 3.42Å; A942-V944 VanDerWaalsContact C-N 3.3Å
945	V	89.5	Confident	88.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.157	C	C	.	.	S	Bend	trans	-117.1	132.4	-178.6	-176.4	0	0	0	0	110.2	F700 G824 L827 L941 A942 L947 W949 L950	F700-V945 HydrophobicContact CE2-CG1 3.95Å; F700-V945 HydrophobicContact CZ-CG1 4.12Å; G824-V945 VanDerWaalsContact O-CG2 3.26Å; G824-V945 WeakPolarHBondContact O-CG2 3.47Å; L827-V945 HydrophobicContact CB-CG2 4.26Å; L941-V945 PolarHBondContact O-N 3.29Å; A942-V945 WeakPolarHBondContact CA-O 3.18Å; V945-L947 PolarHBondContact O-N 2.66Å; V945-W949 HydrophobicContact CG1-CE3 4.24Å; V945-L950 HydrophobicContact CG1-CD1 4.24Å; V945-L950 HydrophobicContact CG1-CD2 4.4Å; V945-L950 HydrophobicContact CG1-CG 4.14Å
946	N	85.9	Confident	88.3	Confident	70 Å²	70	33.4 Å²	33.4	37%	0.374	16%	0.164	S	C	.	.			trans	-66.3	117.8	175.7	-174.8	-11.9	0	0	0	110.5	E948 W949	N946-E948 PolarHBondContact O-N 3.33Å; N946-E948 VanDerWaalsContact O-N 3.16Å; N946-E948 WeakPolarHBondContact OD1-CB 3.29Å; N946-E948 PolarHBondContact OD1-N 3.12Å; N946-W949 HydrophobicContact CB-CD2 3.72Å; N946-W949 HydrophobicContact CB-CE3 4.08Å; N946-W949 HydrophobicContact CB-CG 4.08Å; N946-W949 HydrophobicContact CB-CH2 4.44Å; N946-W949 HydrophobicContact CB-CZ2 4.12Å; N946-W949 HydrophobicContact CB-CZ3 4.42Å; N946-W949 WeakPolarHBondContact O-CB 3.49Å; N946-W949 PolarHBondContact O-N 3.1Å
947	L	84.4	Confident	88.2	Confident	29 Å²	29	34.4 Å²	34.4	15%	0.152	17%	0.168	C	C	.	.	H	α-helix	trans	-59.7	-26.6	-179.2	-61.8	-178	0	0	0	113.3	R938 L941 A942 V945 W949 L950 R951	R938-L947 HydrophobicContact CG-CD1 3.63Å; R938-L947 HydrophobicContact CG-CD2 4.47Å; L941-L947 HydrophobicContact CB-CD2 4.45Å; L941-L947 HydrophobicContact CD2-CD2 3.95Å; L941-L947 HydrophobicContact CG-CD2 4.11Å; A942-L947 HydrophobicContact CB-CD1 3.8Å; A942-L947 HydrophobicContact CB-CD2 4.21Å; A942-L947 HydrophobicContact CB-CG 3.72Å; V945-L947 PolarHBondContact O-N 2.66Å; L947-W949 PolarHBondContact O-N 3.48Å; L947-L950 HydrophobicContact CD2-CD1 4.19Å; L947-L950 PolarHBondContact O-N 2.78Å; L947-L950 VanDerWaalsContact O-N 3.14Å; L947-R951 WeakPolarHBondContact O-CG 3.35Å; L947-R951 PolarHBondContact O-N 3.21Å
948	E	81.4	Confident	88.1	Confident	55 Å²	55	35 Å²	35	26%	0.257	17%	0.171	S	C	.	.	H	α-helix	trans	-63.3	-30.2	175.9	-60.8	-60.9	158.3	0	0	112	W649 N946 R951	W649-E948 HydrophobicContact CZ3-CB 4.27Å; N946-E948 PolarHBondContact O-N 3.33Å; N946-E948 VanDerWaalsContact O-N 3.16Å; N946-E948 WeakPolarHBondContact OD1-CB 3.29Å; N946-E948 PolarHBondContact OD1-N 3.12Å; E948-R951 IonicContact OE1-CZ 3.59Å; E948-R951 IonicContact OE1-NH1 3.87Å; E948-R951 PolarHBondContact OE1-NH1 3.1Å; E948-R951 IonicContact OE1-NH2 3.7Å; E948-R951 WeakPolarHBondContact OE2-CD 3.43Å; E948-R951 IonicContact OE2-CZ 3.32Å; E948-R951 IonicContact OE2-NE 3.44Å; E948-R951 IonicContact OE2-NH1 2.67Å; E948-R951 PolarHBondContact OE2-NH1 2.74Å
949	W	86.1	Confident	88	Confident	13 Å²	13	33 Å²	33	5%	0.049	17%	0.165	C	C	.	.	H	α-helix	trans	-72	-36.4	174.9	-53.3	-19.2	0	0	0	111.3	Y641 F700 L703 I704 D707 V945 N946 L947 R951 M952	Y641-W949 AromaticContact CD1-CD1 3.63Å; Y641-W949 AromaticContact CD1-NE1 3.33Å; Y641-W949 VanDerWaalsContact CD1-NE1 3.33Å; Y641-W949 AromaticContact CE1-CD1 3.52Å; Y641-W949 AromaticContact CE1-NE1 3.75Å; F700-W949 HydrophobicContact CD2-CB 3.83Å; F700-W949 HydrophobicContact CE2-CB 4.02Å; F700-W949 HydrophobicContact CE2-CE3 4.46Å; L703-W949 HydrophobicContact CB-CD2 4.12Å; L703-W949 HydrophobicContact CB-CE3 4.26Å; L703-W949 HydrophobicContact CB-CH2 4.41Å; L703-W949 HydrophobicContact CB-CZ2 4.26Å; L703-W949 HydrophobicContact CB-CZ3 4.41Å; L703-W949 HydrophobicContact CD1-CB 4.41Å; L703-W949 HydrophobicContact CD1-CD2 4.14Å; L703-W949 HydrophobicContact CD1-CG 3.86Å; I704-W949 HydrophobicContact CG1-CE3 4.33Å; I704-W949 HydrophobicContact CG1-CZ3 4.07Å; D707-W949 HydrophobicContact CB-CH2 3.93Å; V945-W949 HydrophobicContact CG1-CE3 4.24Å; N946-W949 HydrophobicContact CB-CD2 3.72Å; N946-W949 HydrophobicContact CB-CE3 4.08Å; N946-W949 HydrophobicContact CB-CG 4.08Å; N946-W949 HydrophobicContact CB-CH2 4.44Å; N946-W949 HydrophobicContact CB-CZ2 4.12Å; N946-W949 HydrophobicContact CB-CZ3 4.42Å; N946-W949 WeakPolarHBondContact O-CB 3.49Å; N946-W949 PolarHBondContact O-N 3.1Å; L947-W949 PolarHBondContact O-N 3.48Å; W949-R951 VanDerWaalsContact C-N 3.3Å; W949-R951 PolarHBondContact O-N 2.67Å; W949-M952 WeakPolarHBondContact O-CE 3.35Å; W949-M952 PolarHBondContact O-N 2.85Å
950	L	86.9	Confident	87.9	Confident	6 Å²	6	29.9 Å²	29.9	3%	0.031	15%	0.153	C	C	.	.	H	α-helix	trans	-70.4	-27.2	177.7	-65.2	178.3	0	0	0	112.2	F700 L846 L941 V945 L947 M952 F953 I958	F700-L950 HydrophobicContact CD2-CD2 4.48Å; F700-L950 HydrophobicContact CE2-CD2 3.6Å; F700-L950 HydrophobicContact CE2-CG 4.35Å; F700-L950 HydrophobicContact CZ-CD2 3.74Å; L846-L950 HydrophobicContact CD2-CB 4.01Å; L846-L950 VanDerWaalsContact CD2-O 3.31Å; L846-L950 WeakPolarHBondContact CD2-O 3.47Å; L941-L950 HydrophobicContact CD2-CD1 3.84Å; L941-L950 HydrophobicContact CG-CD1 4.28Å; V945-L950 HydrophobicContact CG1-CD1 4.24Å; V945-L950 HydrophobicContact CG1-CD2 4.4Å; V945-L950 HydrophobicContact CG1-CG 4.14Å; L947-L950 HydrophobicContact CD2-CD1 4.19Å; L947-L950 PolarHBondContact O-N 2.78Å; L947-L950 VanDerWaalsContact O-N 3.14Å; L950-M952 PolarHBondContact O-N 2.79Å; L950-M952 VanDerWaalsContact O-N 3.09Å; L950-F953 WeakPolarHBondContact O-CD2 3.43Å; L950-F953 PolarHBondContact O-N 3.44Å; L950-I958 HydrophobicContact CB-CD1 4.13Å
951	R	84.7	Confident	87.8	Confident	67 Å²	67	31 Å²	31	25%	0.253	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-13.3	176	-76.8	-176.1	-179.9	152.2	16	115	T848 L947 E948 W949 F953	T848-R951 VanDerWaalsContact CG2-CZ 3.42Å; L947-R951 WeakPolarHBondContact O-CG 3.35Å; L947-R951 PolarHBondContact O-N 3.21Å; E948-R951 IonicContact OE1-CZ 3.59Å; E948-R951 IonicContact OE1-NH1 3.87Å; E948-R951 PolarHBondContact OE1-NH1 3.1Å; E948-R951 IonicContact OE1-NH2 3.7Å; E948-R951 WeakPolarHBondContact OE2-CD 3.43Å; E948-R951 IonicContact OE2-CZ 3.32Å; E948-R951 IonicContact OE2-NE 3.44Å; E948-R951 IonicContact OE2-NH1 2.67Å; E948-R951 PolarHBondContact OE2-NH1 2.74Å; W949-R951 VanDerWaalsContact C-N 3.3Å; W949-R951 PolarHBondContact O-N 2.67Å; R951-F953 PolarHBondContact O-N 3.17Å
952	M	86.7	Confident	87.6	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.01	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-14.2	170.2	-65.1	-171.8	-67.8	0	0	112.2	L684 P688 R696 I699 F700 L703 W949 L950	L684-M952 HydrophobicContact CB-SD 4.46Å; L684-M952 HydrophobicContact CD2-SD 4.12Å; P688-M952 HydrophobicContact CB-CB 4.31Å; P688-M952 VanDerWaalsContact CB-O 3.28Å; P688-M952 WeakPolarHBondContact CB-O 3.19Å; R696-M952 WeakPolarHBondContact CD-O 3.48Å; R696-M952 PolarHBondContact NH1-O 3.43Å; I699-M952 HydrophobicContact CG2-CE 4.05Å; I699-M952 HydrophobicContact CG2-SD 4.17Å; F700-M952 HydrophobicContact CB-CE 4.24Å; L703-M952 HydrophobicContact CD1-CE 4.4Å; W949-M952 WeakPolarHBondContact O-CE 3.35Å; W949-M952 PolarHBondContact O-N 2.85Å; L950-M952 PolarHBondContact O-N 2.79Å; L950-M952 VanDerWaalsContact O-N 3.09Å
953	F	89.5	Confident	87.4	Confident	8 Å²	8	28.9 Å²	28.9	4%	0.035	14%	0.141	C	C	.	.	S	Bend	trans	-115.2	147.6	-173.3	-54.7	-75.3	0	0	0	111.7	F693 R696 V697 F700 L846 L950 R951 E957 I958 L961	F693-F953 AromaticContact CD2-CD1 3.87Å; F693-F953 HydrophobicContact CD2-CD1 3.87Å; F693-F953 AromaticContact CD2-CE1 3.98Å; F693-F953 HydrophobicContact CD2-CE1 3.98Å; F693-F953 AromaticContact CE2-CD1 3.63Å; F693-F953 HydrophobicContact CE2-CD1 3.63Å; F693-F953 AromaticContact CE2-CE1 3.8Å; F693-F953 HydrophobicContact CE2-CE1 3.8Å; R696-F953 HydrophobicContact CB-CD1 4.5Å; R696-F953 HydrophobicContact CB-CE1 3.67Å; R696-F953 HydrophobicContact CB-CZ 4.07Å; R696-F953 VanDerWaalsContact NH1-CD1 3.26Å; R696-F953 WeakPolarHBondContact O-CZ 3.25Å; V697-F953 HydrophobicContact CG2-CE1 3.82Å; V697-F953 HydrophobicContact CG2-CZ 4.28Å; F700-F953 HydrophobicContact CB-CE2 3.91Å; F700-F953 HydrophobicContact CB-CZ 3.79Å; F700-F953 HydrophobicContact CD2-CE2 4.09Å; F700-F953 AromaticContact CG-CE2 3.99Å; F700-F953 HydrophobicContact CG-CE2 3.99Å; F700-F953 HydrophobicContact CG-CZ 4.28Å; L846-F953 VanDerWaalsContact CD1-O 3.31Å; L846-F953 WeakPolarHBondContact CD1-O 3.48Å; L950-F953 WeakPolarHBondContact O-CD2 3.43Å; L950-F953 PolarHBondContact O-N 3.44Å; R951-F953 PolarHBondContact O-N 3.17Å; F953-E957 VanDerWaalsContact CA-OE2 3.31Å; F953-E957 WeakPolarHBondContact CA-OE2 3.29Å; F953-E957 HydrophobicContact CB-CB 3.95Å; F953-E957 HydrophobicContact CD1-CB 4.26Å; F953-I958 HydrophobicContact CB-CD1 4.4Å; F953-I958 HydrophobicContact CB-CG1 3.65Å; F953-L961 HydrophobicContact CB-CD1 4.42Å; F953-L961 HydrophobicContact CD1-CD1 3.91Å; F953-L961 HydrophobicContact CD2-CD1 3.51Å; F953-L961 HydrophobicContact CE1-CD1 4Å; F953-L961 HydrophobicContact CE2-CD1 3.6Å; F953-L961 HydrophobicContact CG-CD1 3.67Å; F953-L961 HydrophobicContact CZ-CD1 3.85Å
954	D	86.9	Confident	87	Confident	32 Å²	32	26.3 Å²	26.3	17%	0.171	13%	0.128	C	C	.	.			trans	-83.3	177.2	168.7	73	42.6	0	0	0	112.6	I615 Q956 E957 I958	I615-D954 HydrophobicContact CD1-CB 4.11Å; D954-Q956 VanDerWaalsContact C-N 3.33Å; D954-Q956 PolarHBondContact O-N 3.18Å; D954-Q956 WeakPolarHBondContact OD1-CA 3.42Å; D954-Q956 WeakPolarHBondContact OD1-CB 3.25Å; D954-Q956 PolarHBondContact OD1-N 3.15Å; D954-E957 PolarHBondContact N-OE2 2.97Å; D954-E957 PolarHBondContact O-N 2.97Å; D954-E957 WeakPolarHBondContact OD1-CG 3.31Å; D954-E957 PolarHBondContact OD1-N 3.12Å; D954-I958 WeakPolarHBondContact O-CG1 3.43Å; D954-I958 PolarHBondContact O-N 3.34Å
955	Q	86	Confident	86.5	Confident	23 Å²	23	26.5 Å²	26.5	11%	0.107	13%	0.129	C	C	.	.	H	α-helix	trans	-60.8	-34.7	-178.4	67.2	-170.7	19.9	0	0	113.9	S839 L842 H856 Q959	S839-Q955 PolarHBondContact O-OE1 3.32Å; L842-Q955 HydrophobicContact CB-CB 4.09Å; L842-Q955 WeakPolarHBondContact CD1-O 3.16Å; H856-Q955 PolarHBondContact CE1-OE1 3.43Å; Q955-Q959 PolarHBondContact O-N 3.01Å
956	Q	85.3	Confident	85.8	Confident	111 Å²	111	33.1 Å²	33.1	52%	0.519	16%	0.16	S	C	.	.	H	α-helix	trans	-78.7	-38.5	178.7	-68.6	-179.1	-13.3	0	0	110.4	I615 D954 Q959 V960	I615-Q956 HydrophobicContact CG2-CG 4.43Å; D954-Q956 VanDerWaalsContact C-N 3.33Å; D954-Q956 PolarHBondContact O-N 3.18Å; D954-Q956 WeakPolarHBondContact OD1-CA 3.42Å; D954-Q956 WeakPolarHBondContact OD1-CB 3.25Å; D954-Q956 PolarHBondContact OD1-N 3.15Å; Q956-Q959 WeakPolarHBondContact O-CB 3.45Å; Q956-Q959 PolarHBondContact O-N 3.37Å; Q956-V960 PolarHBondContact O-N 3.46Å; Q956-V960 VanDerWaalsContact O-N 3.11Å
957	E	89.9	Confident	85.5	Confident	28 Å²	28	33.9 Å²	33.9	13%	0.131	17%	0.167	C	C	.	.	H	α-helix	trans	-64.8	-39.5	177.4	-70.4	176.9	153.1	0	0	112.3	F693 R696 F953 D954 Q959 V960 L961	F693-E957 HydrophobicContact CD2-CB 4.03Å; F693-E957 HydrophobicContact CD2-CG 3.79Å; F693-E957 HydrophobicContact CE2-CB 3.6Å; F693-E957 HydrophobicContact CE2-CG 3.84Å; F693-E957 HydrophobicContact CG-CG 4.27Å; F693-E957 HydrophobicContact CZ-CB 4.1Å; F693-E957 HydrophobicContact CZ-CG 4.32Å; R696-E957 IonicContact CZ-OE1 2.75Å; R696-E957 IonicContact CZ-OE2 2.78Å; R696-E957 IonicContact NH1-OE1 3.83Å; R696-E957 PolarHBondContact NH1-OE1 2.7Å; R696-E957 IonicContact NH1-OE2 3.96Å; R696-E957 PolarHBondContact NH1-OE2 3Å; R696-E957 IonicContact NH2-OE1 3.79Å; R696-E957 PolarHBondContact NH2-OE1 2.78Å; R696-E957 IonicContact NH2-OE2 3.65Å; R696-E957 PolarHBondContact NH2-OE2 3.49Å; F953-E957 VanDerWaalsContact CA-OE2 3.31Å; F953-E957 WeakPolarHBondContact CA-OE2 3.29Å; F953-E957 HydrophobicContact CB-CB 3.95Å; F953-E957 HydrophobicContact CD1-CB 4.26Å; D954-E957 PolarHBondContact N-OE2 2.97Å; D954-E957 PolarHBondContact O-N 2.97Å; D954-E957 WeakPolarHBondContact OD1-CG 3.31Å; D954-E957 PolarHBondContact OD1-N 3.12Å; E957-Q959 VanDerWaalsContact C-N 3.33Å; E957-V960 WeakPolarHBondContact O-CB 3.28Å; E957-V960 PolarHBondContact O-N 3Å; E957-L961 PolarHBondContact O-N 3.38Å
958	I	90.1	Very high	85.4	Confident	12 Å²	12	36.8 Å²	36.8	6%	0.062	19%	0.187	C	C	.	.	H	α-helix	trans	-64	-39.1	172.3	-71.6	-158	0	0	0	111.7	L842 L846 L950 F953 D954 V960 L961 I962	L842-I958 HydrophobicContact CD1-CG2 4.45Å; L842-I958 HydrophobicContact CD2-CG2 4.11Å; L846-I958 HydrophobicContact CD1-CD1 3.63Å; L846-I958 HydrophobicContact CD1-CG1 4.16Å; L846-I958 HydrophobicContact CD2-CD1 3.19Å; L846-I958 HydrophobicContact CD2-CG1 4.38Å; L846-I958 HydrophobicContact CG-CD1 3.61Å; L950-I958 HydrophobicContact CB-CD1 4.13Å; F953-I958 HydrophobicContact CB-CD1 4.4Å; F953-I958 HydrophobicContact CB-CG1 3.65Å; D954-I958 WeakPolarHBondContact O-CG1 3.43Å; D954-I958 PolarHBondContact O-N 3.34Å; I958-V960 PolarHBondContact O-N 2.88Å; I958-L961 WeakPolarHBondContact O-CB 3.42Å; I958-L961 PolarHBondContact O-N 3.34Å; I958-L961 VanDerWaalsContact O-N 3.1Å; I958-I962 HydrophobicContact CG2-CD1 3.63Å; I958-I962 HydrophobicContact CG2-CG1 4.2Å; I958-I962 WeakPolarHBondContact O-CG1 3.34Å; I958-I962 PolarHBondContact O-N 3.32Å
959	Q	89.5	Confident	85.6	Confident	30 Å²	30	34.8 Å²	34.8	14%	0.14	18%	0.178	C	C	.	.	H	α-helix	trans	-59.4	-36.8	174.7	-175.7	60.3	60.7	0	0	111.4	L835 L842 Q955 Q956 E957 S963	L835-Q959 PolarHBondContact O-NE2 3.44Å; L842-Q959 HydrophobicContact CD1-CB 3.84Å; Q955-Q959 PolarHBondContact O-N 3.01Å; Q956-Q959 WeakPolarHBondContact O-CB 3.45Å; Q956-Q959 PolarHBondContact O-N 3.37Å; E957-Q959 VanDerWaalsContact C-N 3.33Å; Q959-S963 PolarHBondContact NE2-OG 3.26Å; Q959-S963 PolarHBondContact O-N 2.88Å
960	V	89.1	Confident	85.7	Confident	35 Å²	35	37.4 Å²	37.4	21%	0.212	20%	0.198	C	C	.	.	H	α-helix	trans	-70.6	-37.4	174.1	175.6	0	0	0	0	112	F693 Q956 E957 I958 I962 G964 A965 L1021	F693-V960 HydrophobicContact CE1-CB 4.27Å; F693-V960 HydrophobicContact CE1-CG1 3.84Å; F693-V960 HydrophobicContact CZ-CB 4.07Å; F693-V960 HydrophobicContact CZ-CG1 3.93Å; Q956-V960 PolarHBondContact O-N 3.46Å; Q956-V960 VanDerWaalsContact O-N 3.11Å; E957-V960 WeakPolarHBondContact O-CB 3.28Å; E957-V960 PolarHBondContact O-N 3Å; I958-V960 PolarHBondContact O-N 2.88Å; V960-I962 VanDerWaalsContact C-N 3.32Å; V960-I962 PolarHBondContact O-N 3.05Å; V960-G964 CarbonylContact O-C 3.58Å; V960-G964 WeakPolarHBondContact O-CA 3.5Å; V960-G964 PolarHBondContact O-N 3.4Å; V960-A965 HydrophobicContact CG1-CB 4.32Å; V960-L1021 HydrophobicContact CG1-CD1 4.27Å
961	L	89.2	Confident	85.8	Confident	23 Å²	23	38.4 Å²	38.4	12%	0.12	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-37.3	173.7	-75.4	174.4	0	0	0	112.7	V697 F953 E957 I958	V697-L961 HydrophobicContact CB-CD2 4.47Å; V697-L961 HydrophobicContact CG1-CD2 4.03Å; V697-L961 HydrophobicContact CG2-CD2 3.75Å; F953-L961 HydrophobicContact CB-CD1 4.42Å; F953-L961 HydrophobicContact CD1-CD1 3.91Å; F953-L961 HydrophobicContact CD2-CD1 3.51Å; F953-L961 HydrophobicContact CE1-CD1 4Å; F953-L961 HydrophobicContact CE2-CD1 3.6Å; F953-L961 HydrophobicContact CG-CD1 3.67Å; F953-L961 HydrophobicContact CZ-CD1 3.85Å; E957-L961 PolarHBondContact O-N 3.38Å; I958-L961 WeakPolarHBondContact O-CB 3.42Å; I958-L961 PolarHBondContact O-N 3.34Å; I958-L961 VanDerWaalsContact O-N 3.1Å
962	I	88.6	Confident	86	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-75.3	-49.8	179.4	-65.7	167.2	0	0	0	110.5	L823 L827 L832 V833 F837 L842 I958 V960	L823-I962 HydrophobicContact CD1-CG2 4.13Å; L823-I962 HydrophobicContact CD2-CD1 4.32Å; L827-I962 HydrophobicContact CD2-CG1 4.01Å; L832-I962 CarbonylContact C-O 3.57Å; L832-I962 WeakPolarHBondContact CA-O 3.35Å; V833-I962 PolarHBondContact N-O 3.43Å; F837-I962 HydrophobicContact CD2-CD1 3.95Å; F837-I962 HydrophobicContact CE2-CD1 3.98Å; F837-I962 HydrophobicContact CE2-CG2 4.29Å; L842-I962 HydrophobicContact CD2-CD1 4.27Å; I958-I962 HydrophobicContact CG2-CD1 3.63Å; I958-I962 HydrophobicContact CG2-CG1 4.2Å; I958-I962 WeakPolarHBondContact O-CG1 3.34Å; I958-I962 PolarHBondContact O-N 3.32Å; V960-I962 VanDerWaalsContact C-N 3.32Å; V960-I962 PolarHBondContact O-N 3.05Å
963	S	84.6	Confident	86.2	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.014	23%	0.23	C	C	.	.	H	α-helix	trans	-108	-6.3	-167.7	-58.1	0	0	0	0	115.8	V833 L835 Q959 R1018	V833-S963 VanDerWaalsContact O-CA 3.25Å; V833-S963 WeakPolarHBondContact O-CA 3.27Å; V833-S963 WeakPolarHBondContact O-CB 3.5Å; V833-S963 PolarHBondContact O-OG 2.98Å; L835-S963 PolarHBondContact N-OG 3.01Å; L835-S963 PolarHBondContact O-OG 3.33Å; Q959-S963 PolarHBondContact NE2-OG 3.26Å; Q959-S963 PolarHBondContact O-N 2.88Å; S963-R1018 WeakPolarHBondContact O-CB 3.48Å; S963-R1018 VanDerWaalsContact O-CD 3.31Å; S963-R1018 WeakPolarHBondContact O-CD 3.19Å
964	G	82.6	Confident	86.2	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.01	23%	0.23	C	C	.	.			trans	87.9	170.4	-174.4	0	0	0	0	0	113.5	V960	V960-G964 CarbonylContact O-C 3.58Å; V960-G964 WeakPolarHBondContact O-CA 3.5Å; V960-G964 PolarHBondContact O-N 3.4Å
965	A	79.5	Confident	86.4	Confident	6 Å²	6	45.7 Å²	45.7	5%	0.05	24%	0.243	C	C	.	.			trans	-76	136	-171	0	0	0	0	0	112.3	V960 V967 P1019 L1021	V960-A965 HydrophobicContact CG1-CB 4.32Å; A965-V967 HydrophobicContact CB-CG2 4.16Å; A965-V967 PolarHBondContact O-N 3.03Å; A965-V967 VanDerWaalsContact O-N 3.08Å; A965-P1019 PolarHBondContact N-O 3.05Å; A965-P1019 VanDerWaalsContact N-O 3.11Å; A965-L1021 HydrophobicContact CB-CD1 4.18Å
966	H	73.9	Confident	86.7	Confident	139 Å²	139	50.5 Å²	50.5	64%	0.644	27%	0.269	S	S	*	.			trans	-86.3	48.7	174.2	-159.5	-72.2	0	0	0	111.4
967	V	80.8	Confident	86.9	Confident	86 Å²	86	48.9 Å²	48.9	52%	0.521	26%	0.261	S	S	.	.	S	Bend	trans	-111.2	149.6	179.7	-177.7	0	0	0	0	108.3	A965 R1007	A965-V967 HydrophobicContact CB-CG2 4.16Å; A965-V967 PolarHBondContact O-N 3.03Å; A965-V967 VanDerWaalsContact O-N 3.08Å; V967-R1007 PolarHBondContact O-NH2 3.01Å
968	P	82.2	Confident	87	Confident	89 Å²	89	48 Å²	48	58%	0.578	26%	0.257	S	S	*	.			trans	-54.6	146.3	172	-26.6	35.6	0	0	0	112	C970 D1003	P968-C970 PolarHBondContact O-N 3.44Å; P968-D1003 WeakPolarHBondContact CA-OD1 3.32Å
969	I	85.4	Confident	87.2	Confident	13 Å²	13	52 Å²	52	7%	0.067	28%	0.278	C	S	.	.			trans	-71.4	117.2	-179.5	-66.5	167.7	0	0	0	109.5	L971 D1003 K1006 R1007 L1010 P1019 F1024	I969-L971 HydrophobicContact CG2-CD2 4.34Å; I969-L971 PolarHBondContact O-N 3.08Å; I969-D1003 PolarHBondContact N-OD1 3.27Å; I969-K1006 HydrophobicContact CB-CB 4.48Å; I969-K1006 HydrophobicContact CD1-CB 3.94Å; I969-K1006 WeakPolarHBondContact CD1-O 3.48Å; I969-R1007 HydrophobicContact CD1-CB 4.42Å; I969-R1007 HydrophobicContact CD1-CG 3.85Å; I969-L1010 HydrophobicContact CD1-CB 4Å; I969-L1010 HydrophobicContact CD1-CD2 3.83Å; I969-L1010 HydrophobicContact CG1-CD2 4.33Å; I969-P1019 HydrophobicContact CG1-CG 4.41Å; I969-F1024 HydrophobicContact CG2-CE2 3.98Å; I969-F1024 HydrophobicContact CG2-CZ 3.95Å
970	C	87.5	Confident	87.3	Confident	68 Å²	68	53 Å²	53	46%	0.459	28%	0.281	S	S	.	.			trans	-74.2	102.8	171.9	-173.5	0	0	0	0	109.6	P968 D972 D973 L974	P968-C970 PolarHBondContact O-N 3.44Å; C970-D972 VanDerWaalsContact C-N 3.33Å; C970-D972 PolarHBondContact O-N 3.28Å; C970-D973 HydrophobicContact CB-CB 3.93Å; C970-D973 PolarHBondContact O-N 3.42Å; C970-L974 PolarHBondContact O-N 2.94Å; C970-L974 VanDerWaalsContact O-N 3.11Å
971	L	89.3	Confident	87.3	Confident	27 Å²	27	53.1 Å²	53.1	14%	0.141	28%	0.284	C	S	.	.	H	α-helix	trans	-65.4	-35.8	-179.3	-71.6	-176	0	0	0	112.8	I969 D973 L974 K975 V998 E999 K1006	I969-L971 HydrophobicContact CG2-CD2 4.34Å; I969-L971 PolarHBondContact O-N 3.08Å; L971-D973 VanDerWaalsContact C-N 3.3Å; L971-D973 PolarHBondContact O-N 2.82Å; L971-L974 PolarHBondContact O-N 2.81Å; L971-K975 VanDerWaalsContact O-CB 3.28Å; L971-K975 WeakPolarHBondContact O-CB 3.39Å; L971-K975 PolarHBondContact O-N 2.93Å; L971-V998 HydrophobicContact CD1-CG1 4.22Å; L971-V998 HydrophobicContact CD2-CG1 3.67Å; L971-E999 HydrophobicContact CD1-CB 4.36Å; L971-K1006 HydrophobicContact CD1-CD 4.24Å; L971-K1006 HydrophobicContact CD2-CD 4.09Å; L971-K1006 HydrophobicContact CD2-CG 4.41Å; L971-K1006 HydrophobicContact CG-CD 4.19Å
972	D	89.6	Confident	87.1	Confident	117 Å²	117	54 Å²	54	63%	0.626	30%	0.298	S	S	*	.	H	α-helix	trans	-61	-42.7	177.5	-66.3	-35.6	0	0	0	111.1	C970 K975 N976	C970-D972 VanDerWaalsContact C-N 3.33Å; C970-D972 PolarHBondContact O-N 3.28Å; D972-K975 PolarHBondContact O-N 2.84Å; D972-N976 WeakPolarHBondContact O-CB 3.45Å; D972-N976 PolarHBondContact O-N 3.41Å; D972-N976 PolarHBondContact O-ND2 2.95Å; D972-N976 VanDerWaalsContact O-ND2 3.08Å
973	D	90.7	Very high	86.8	Confident	39 Å²	39	57 Å²	57	21%	0.209	33%	0.331	C	S	.	.	H	α-helix	trans	-65.4	-45.8	176.4	-170.6	51.5	0	0	0	111.5	C970 L971 K975 N976 F977 G1023 F1024	C970-D973 HydrophobicContact CB-CB 3.93Å; C970-D973 PolarHBondContact O-N 3.42Å; L971-D973 VanDerWaalsContact C-N 3.3Å; L971-D973 PolarHBondContact O-N 2.82Å; D973-K975 VanDerWaalsContact C-N 3.34Å; D973-K975 PolarHBondContact O-N 3.47Å; D973-N976 PolarHBondContact O-N 2.96Å; D973-F977 WeakPolarHBondContact O-CD2 3.27Å; D973-F977 PolarHBondContact O-N 3.38Å; D973-F977 WeakPolarHBondContact OD1-CD2 3.28Å; D973-F977 VanDerWaalsContact OD1-CE2 3.26Å; D973-F977 WeakPolarHBondContact OD1-CE2 3.19Å; D973-G1023 WeakPolarHBondContact OD2-CA 3.2Å; D973-F1024 HydrophobicContact CB-CD2 4.31Å; D973-F1024 WeakPolarHBondContact OD2-CD2 3.41Å; D973-F1024 PolarHBondContact OD2-N 3.37Å
974	L	90.1	Very high	87.2	Confident	7 Å²	7	57.4 Å²	57.4	4%	0.037	33%	0.332	C	S	.	.	H	α-helix	trans	-59.4	-44.8	176.6	-177.5	61.9	0	0	0	111.6	C970 L971 F977 T978 W995 F1024 F1031	C970-L974 PolarHBondContact O-N 2.94Å; C970-L974 VanDerWaalsContact O-N 3.11Å; L971-L974 PolarHBondContact O-N 2.81Å; L974-F977 CarbonylContact O-C 2.99Å; L974-F977 PolarHBondContact O-N 3.25Å; L974-T978 PolarHBondContact O-N 2.98Å; L974-T978 VanDerWaalsContact O-N 3.13Å; L974-T978 PolarHBondContact O-OG1 3.11Å; L974-W995 HydrophobicContact CD2-CH2 4.09Å; L974-W995 HydrophobicContact CD2-CZ3 4.16Å; L974-W995 HydrophobicContact CG-CH2 3.95Å; L974-W995 HydrophobicContact CG-CZ3 4.38Å; L974-F1024 HydrophobicContact CB-CD2 3.63Å; L974-F1024 HydrophobicContact CB-CE2 3.68Å; L974-F1024 HydrophobicContact CB-CG 4.19Å; L974-F1024 HydrophobicContact CB-CZ 4.29Å; L974-F1024 HydrophobicContact CD1-CB 4.4Å; L974-F1024 HydrophobicContact CD1-CD1 3.56Å; L974-F1024 HydrophobicContact CD1-CD2 3.98Å; L974-F1024 HydrophobicContact CD1-CE1 3.71Å; L974-F1024 HydrophobicContact CD1-CE2 4.09Å; L974-F1024 HydrophobicContact CD1-CG 3.7Å; L974-F1024 HydrophobicContact CD1-CZ 3.94Å; L974-F1024 HydrophobicContact CG-CD2 4.39Å; L974-F1024 HydrophobicContact CG-CE2 4.34Å; L974-F1024 HydrophobicContact CG-CZ 4.48Å; L974-F1031 HydrophobicContact CD1-CB 4.09Å; L974-F1031 HydrophobicContact CD1-CD1 4.45Å; L974-F1031 HydrophobicContact CD1-CD2 4.08Å; L974-F1031 HydrophobicContact CD1-CG 3.98Å
975	K	90.7	Very high	87.6	Confident	99 Å²	99	60.2 Å²	60.2	43%	0.43	35%	0.351	S	S	.	.	H	α-helix	trans	-64.8	-40.6	180	-176.1	174	-178.4	178.5	0	112.1	L971 D972 D973 F977 T978 W995	L971-K975 VanDerWaalsContact O-CB 3.28Å; L971-K975 WeakPolarHBondContact O-CB 3.39Å; L971-K975 PolarHBondContact O-N 2.93Å; D972-K975 PolarHBondContact O-N 2.84Å; D973-K975 VanDerWaalsContact C-N 3.34Å; D973-K975 PolarHBondContact O-N 3.47Å; K975-F977 VanDerWaalsContact C-N 3.3Å; K975-F977 PolarHBondContact O-N 3.29Å; K975-T978 PolarHBondContact O-N 3.3Å; K975-W995 HydrophobicContact CB-CD2 4.3Å; K975-W995 HydrophobicContact CB-CE3 4.4Å; K975-W995 HydrophobicContact CB-CH2 4.17Å; K975-W995 HydrophobicContact CB-CZ2 4.03Å; K975-W995 HydrophobicContact CB-CZ3 4.35Å; K975-W995 HydrophobicContact CD-CD2 4.04Å; K975-W995 HydrophobicContact CD-CG 3.97Å; K975-W995 HydrophobicContact CG-CD2 4.05Å; K975-W995 HydrophobicContact CG-CG 4.36Å; K975-W995 HydrophobicContact CG-CZ2 4.12Å
976	N	91.7	Very high	88	Confident	124 Å²	124	62.4 Å²	62.4	66%	0.663	37%	0.369	S	S	*	.	H	α-helix	trans	-64.5	-32.7	178.8	-74.4	-25.7	0	0	0	113.1	D972 D973	D972-N976 WeakPolarHBondContact O-CB 3.45Å; D972-N976 PolarHBondContact O-N 3.41Å; D972-N976 PolarHBondContact O-ND2 2.95Å; D972-N976 VanDerWaalsContact O-ND2 3.08Å; D973-N976 PolarHBondContact O-N 2.96Å
977	F	90.6	Very high	88.8	Confident	77 Å²	77	62 Å²	62	34%	0.338	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	18.1	-179.6	-64.6	-69.7	0	0	0	113.6	D973 L974 K975 F1024 K1025	D973-F977 WeakPolarHBondContact O-CD2 3.27Å; D973-F977 PolarHBondContact O-N 3.38Å; D973-F977 WeakPolarHBondContact OD1-CD2 3.28Å; D973-F977 VanDerWaalsContact OD1-CE2 3.26Å; D973-F977 WeakPolarHBondContact OD1-CE2 3.19Å; L974-F977 CarbonylContact O-C 2.99Å; L974-F977 PolarHBondContact O-N 3.25Å; K975-F977 VanDerWaalsContact C-N 3.3Å; K975-F977 PolarHBondContact O-N 3.29Å; F977-F1024 HydrophobicContact CB-CB 4.25Å; F977-K1025 HydrophobicContact CD1-CB 3.97Å; F977-K1025 HydrophobicContact CD1-CG 4.14Å; F977-K1025 HydrophobicContact CD2-CB 4.05Å; F977-K1025 HydrophobicContact CE1-CB 3.76Å; F977-K1025 HydrophobicContact CE1-CD 4.07Å; F977-K1025 HydrophobicContact CE1-CG 3.73Å; F977-K1025 HydrophobicContact CE2-CB 3.85Å; F977-K1025 HydrophobicContact CG-CB 4.13Å; F977-K1025 HydrophobicContact CZ-CB 3.71Å; F977-K1025 HydrophobicContact CZ-CD 4.07Å; F977-K1025 HydrophobicContact CZ-CG 4.02Å
978	T	92.3	Very high	89.4	Confident	9 Å²	9	60.2 Å²	60.2	6%	0.055	36%	0.358	C	S	.	.			trans	-89.3	127.8	173.4	-68.5	0	0	0	0	111.4	L974 K975 Y980 W995 F1031 I1033	L974-T978 PolarHBondContact O-N 2.98Å; L974-T978 VanDerWaalsContact O-N 3.13Å; L974-T978 PolarHBondContact O-OG1 3.11Å; K975-T978 PolarHBondContact O-N 3.3Å; T978-Y980 HydrophobicContact CG2-CD1 4.37Å; T978-Y980 HydrophobicContact CG2-CE1 3.8Å; T978-Y980 HydrophobicContact CG2-CE2 4.26Å; T978-Y980 WeakPolarHBondContact O-CE2 3.26Å; T978-W995 HydrophobicContact CG2-CZ2 4.15Å; T978-F1031 CarbonylContact C-O 3.59Å; T978-F1031 WeakPolarHBondContact CA-O 3.47Å; T978-F1031 HydrophobicContact CG2-CD1 3.7Å; T978-F1031 HydrophobicContact CG2-CE1 4.24Å; T978-F1031 WeakPolarHBondContact OG1-CD1 3.38Å; T978-I1033 HydrophobicContact CG2-CD1 4.18Å; T978-I1033 HydrophobicContact CG2-CG1 3.98Å
979	N	92.4	Very high	89.7	Confident	96 Å²	96	59.7 Å²	59.7	51%	0.513	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	149.7	170.4	-70.8	-24.8	0	0	0	111.2	F1031 C1032 I1033	N979-F1031 PolarHBondContact N-O 3.42Å; N979-C1032 HydrophobicContact CB-CB 4.28Å; N979-C1032 CarbonylContact O-C 3.53Å; N979-C1032 VanDerWaalsContact O-CA 3.23Å; N979-C1032 WeakPolarHBondContact O-CA 3.27Å; N979-I1033 PolarHBondContact O-N 3.32Å
980	Y	92.7	Very high	90	Very high	51 Å²	51	59.2 Å²	59.2	20%	0.2	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.7	176.3	-55	-82.3	0	0	0	109.9	T978 Y984 A986 I991 W995 I1033	T978-Y980 HydrophobicContact CG2-CD1 4.37Å; T978-Y980 HydrophobicContact CG2-CE1 3.8Å; T978-Y980 HydrophobicContact CG2-CE2 4.26Å; T978-Y980 WeakPolarHBondContact O-CE2 3.26Å; Y980-Y984 VanDerWaalsContact CB-O 3.25Å; Y980-Y984 WeakPolarHBondContact CB-O 3.34Å; Y980-A986 HydrophobicContact CD2-CB 4.29Å; Y980-A986 HydrophobicContact CE2-CB 3.78Å; Y980-I991 HydrophobicContact CD1-CD1 3.83Å; Y980-I991 HydrophobicContact CD1-CG1 3.97Å; Y980-I991 HydrophobicContact CD1-CG2 4.04Å; Y980-I991 HydrophobicContact CE1-CB 4.32Å; Y980-I991 HydrophobicContact CE1-CD1 3.91Å; Y980-I991 HydrophobicContact CE1-CG1 4.06Å; Y980-I991 HydrophobicContact CE1-CG2 3.3Å; Y980-W995 AromaticContact CZ-NE1 3.97Å; Y980-W995 PolarHBondContact OH-NE1 2.79Å; Y980-I1033 WeakPolarHBondContact CA-O 3.33Å; Y980-I1033 HydrophobicContact CD1-CB 4.11Å; Y980-I1033 HydrophobicContact CE1-CB 4.43Å; Y980-I1033 HydrophobicContact CE1-CD1 4.08Å; Y980-I1033 HydrophobicContact CE1-CG1 4.47Å
981	S	89.8	Confident	90.3	Very high	38 Å²	38	56 Å²	56	27%	0.266	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	169	-178	64.9	0	0	0	0	111.9	G983 Y984 I1033 H1034 N1035	S981-G983 VanDerWaalsContact C-N 3.35Å; S981-G983 PolarHBondContact O-N 3.48Å; S981-Y984 PolarHBondContact O-N 2.85Å; S981-I1033 PolarHBondContact N-O 2.97Å; S981-H1034 WeakPolarHBondContact OG-CB 3.43Å; S981-H1034 PolarHBondContact OG-ND1 2.86Å; S981-N1035 PolarHBondContact O-N 3.37Å
982	G	83.7	Confident	90.5	Very high	41 Å²	41	59.2 Å²	59.2	42%	0.423	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	25.4	179.8	0	0	0	0	0	114.6	N1035	G982-N1035 WeakPolarHBondContact O-CB 3.44Å; G982-N1035 PolarHBondContact O-ND2 3.04Å
983	G	83.6	Confident	90.6	Very high	68 Å²	68	55 Å²	55	70%	0.701	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.4	-9.5	-178.9	0	0	0	0	0	114.6	S981	S981-G983 VanDerWaalsContact C-N 3.35Å; S981-G983 PolarHBondContact O-N 3.48Å
984	Y	91.9	Very high	90.8	Very high	11 Å²	11	53.1 Å²	53.1	4%	0.043	31%	0.312	C	S	.	.			trans	-75.2	147.3	169.8	-69.4	-19.5	0	0	0	112.5	Y980 S981 H988 V990 I991 I1033 N1035 L1055 P1056 E1057	Y980-Y984 VanDerWaalsContact CB-O 3.25Å; Y980-Y984 WeakPolarHBondContact CB-O 3.34Å; S981-Y984 PolarHBondContact O-N 2.85Å; Y984-H988 AromaticContact CD1-CE1 3.77Å; Y984-H988 AromaticContact CD1-CG 3.85Å; Y984-H988 AromaticContact CD1-ND1 3.69Å; Y984-H988 AromaticContact CD1-NE2 3.97Å; Y984-H988 AromaticContact CE1-CE1 3.58Å; Y984-H988 AromaticContact CE1-ND1 3.8Å; Y984-V990 HydrophobicContact CE1-CB 4.42Å; Y984-I991 HydrophobicContact CD2-CD1 3.74Å; Y984-I991 HydrophobicContact CD2-CG1 4.32Å; Y984-I991 HydrophobicContact CE2-CD1 4.3Å; Y984-I991 HydrophobicContact CG-CD1 4.02Å; Y984-I991 HydrophobicContact CG-CG1 4.08Å; Y984-I1033 HydrophobicContact CD2-CG2 4.13Å; Y984-I1033 HydrophobicContact CE2-CG2 4.46Å; Y984-N1035 HydrophobicContact CD1-CB 4.4Å; Y984-N1035 HydrophobicContact CD2-CB 4.16Å; Y984-N1035 HydrophobicContact CE1-CB 4.16Å; Y984-N1035 VanDerWaalsContact CE2-CA 3.49Å; Y984-N1035 HydrophobicContact CE2-CB 3.95Å; Y984-N1035 HydrophobicContact CG-CB 4.4Å; Y984-L1055 HydrophobicContact CE2-CB 4.29Å; Y984-L1055 WeakPolarHBondContact CE2-O 3.3Å; Y984-L1055 PolarHBondContact OH-O 3.11Å; Y984-P1056 PolarHBondContact OH-O 3.31Å; Y984-E1057 HydrophobicContact CE1-CG 4.05Å; Y984-E1057 WeakPolarHBondContact OH-CA 3.42Å; Y984-E1057 VanDerWaalsContact OH-CG 3.23Å; Y984-E1057 WeakPolarHBondContact OH-CG 3.32Å; Y984-E1057 PolarHBondContact OH-N 2.86Å
985	S	91.1	Very high	91	Very high	59 Å²	59	53.4 Å²	53.4	41%	0.413	31%	0.312	S	S	.	.			trans	-141.1	165.7	172.3	67.4	0	0	0	0	108.9	N987 H988	S985-N987 PolarHBondContact O-N 3.44Å; S985-H988 VanDerWaalsContact O-CB 3.23Å; S985-H988 WeakPolarHBondContact O-CB 3.48Å; S985-H988 PolarHBondContact O-N 3.37Å
986	A	89	Confident	91	Very high	52 Å²	52	53.4 Å²	53.4	43%	0.43	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-25.8	179.1	0	0	0	0	0	113.7	Y980	Y980-A986 HydrophobicContact CD2-CB 4.29Å; Y980-A986 HydrophobicContact CE2-CB 3.78Å
987	N	90.7	Very high	91.1	Very high	131 Å²	131	47.7 Å²	47.7	70%	0.701	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	1.2	179.7	-64.4	-17	0	0	0	113.6	S985	S985-N987 PolarHBondContact O-N 3.44Å
988	H	92	Very high	91.2	Very high	49 Å²	49	44.1 Å²	44.1	23%	0.227	27%	0.268	C	S	.	.			trans	-69.4	135.3	-179	-169.3	-84.9	0	0	0	110.4	Y984 S985 V990 I991 Q992	Y984-H988 AromaticContact CD1-CE1 3.77Å; Y984-H988 AromaticContact CD1-CG 3.85Å; Y984-H988 AromaticContact CD1-ND1 3.69Å; Y984-H988 AromaticContact CD1-NE2 3.97Å; Y984-H988 AromaticContact CE1-CE1 3.58Å; Y984-H988 AromaticContact CE1-ND1 3.8Å; S985-H988 VanDerWaalsContact O-CB 3.23Å; S985-H988 WeakPolarHBondContact O-CB 3.48Å; S985-H988 PolarHBondContact O-N 3.37Å; H988-V990 VanDerWaalsContact C-N 3.32Å; H988-V990 WeakPolarHBondContact ND1-CB 3.45Å; H988-V990 PolarHBondContact ND1-N 2.63Å; H988-V990 PolarHBondContact O-N 3.37Å; H988-I991 HydrophobicContact CB-CB 4.3Å; H988-I991 HydrophobicContact CB-CG1 4.05Å; H988-I991 WeakPolarHBondContact O-CA 3.38Å; H988-I991 WeakPolarHBondContact O-CB 3.38Å; H988-I991 PolarHBondContact O-N 2.99Å; H988-Q992 PolarHBondContact O-N 2.85Å; H988-Q992 VanDerWaalsContact O-N 3.08Å
989	P	89.6	Confident	91.2	Very high	78 Å²	78	50.3 Å²	50.3	51%	0.506	30%	0.296	S	S	.	.	H	α-helix	trans	-53.5	-44	-176.2	-28.5	34.7	0	0	0	113.9	I991 Q992 I993	P989-I991 VanDerWaalsContact C-N 3.28Å; P989-I991 PolarHBondContact O-N 3.07Å; P989-Q992 PolarHBondContact O-N 2.81Å; P989-I993 WeakPolarHBondContact O-CG1 3.23Å; P989-I993 PolarHBondContact O-N 3.23Å
990	V	91.6	Very high	91.1	Very high	3 Å²	3	48 Å²	48	2%	0.018	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-36.6	176.6	179.4	0	0	0	0	112	Y984 H988 F994 L1055 E1057 M1064	Y984-V990 HydrophobicContact CE1-CB 4.42Å; H988-V990 VanDerWaalsContact C-N 3.32Å; H988-V990 WeakPolarHBondContact ND1-CB 3.45Å; H988-V990 PolarHBondContact ND1-N 2.63Å; H988-V990 PolarHBondContact O-N 3.37Å; V990-F994 WeakPolarHBondContact O-CB 3.35Å; V990-F994 PolarHBondContact O-N 3.45Å; V990-L1055 HydrophobicContact CG1-CD2 4.11Å; V990-E1057 HydrophobicContact CG2-CB 4.39Å; V990-M1064 HydrophobicContact CG1-CE 3.64Å; V990-M1064 WeakPolarHBondContact O-CE 3.5Å
991	I	93.6	Very high	91.1	Very high	0 Å²	0	46 Å²	46	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-73.8	-35.5	179.5	-65	-57.3	0	0	0	111.3	Y980 Y984 H988 P989 F994 W995 I1033	Y980-I991 HydrophobicContact CD1-CD1 3.83Å; Y980-I991 HydrophobicContact CD1-CG1 3.97Å; Y980-I991 HydrophobicContact CD1-CG2 4.04Å; Y980-I991 HydrophobicContact CE1-CB 4.32Å; Y980-I991 HydrophobicContact CE1-CD1 3.91Å; Y980-I991 HydrophobicContact CE1-CG1 4.06Å; Y980-I991 HydrophobicContact CE1-CG2 3.3Å; Y984-I991 HydrophobicContact CD2-CD1 3.74Å; Y984-I991 HydrophobicContact CD2-CG1 4.32Å; Y984-I991 HydrophobicContact CE2-CD1 4.3Å; Y984-I991 HydrophobicContact CG-CD1 4.02Å; Y984-I991 HydrophobicContact CG-CG1 4.08Å; H988-I991 HydrophobicContact CB-CB 4.3Å; H988-I991 HydrophobicContact CB-CG1 4.05Å; H988-I991 WeakPolarHBondContact O-CA 3.38Å; H988-I991 WeakPolarHBondContact O-CB 3.38Å; H988-I991 PolarHBondContact O-N 2.99Å; P989-I991 VanDerWaalsContact C-N 3.28Å; P989-I991 PolarHBondContact O-N 3.07Å; I991-F994 WeakPolarHBondContact O-CB 3.34Å; I991-F994 PolarHBondContact O-N 2.85Å; I991-W995 PolarHBondContact O-N 3.45Å; I991-W995 VanDerWaalsContact O-N 3.07Å; I991-I1033 HydrophobicContact CD1-CB 4.27Å; I991-I1033 HydrophobicContact CD1-CD1 4.27Å; I991-I1033 HydrophobicContact CD1-CG2 3.77Å
992	Q	92.4	Very high	91.1	Very high	94 Å²	94	47.9 Å²	47.9	44%	0.439	30%	0.297	S	S	.	.	H	α-helix	trans	-63.3	-48.2	173.5	-67.4	177.4	-19.4	0	0	110.6	H988 P989 F994 W995 E996	H988-Q992 PolarHBondContact O-N 2.85Å; H988-Q992 VanDerWaalsContact O-N 3.08Å; P989-Q992 PolarHBondContact O-N 2.81Å; Q992-F994 VanDerWaalsContact C-N 3.29Å; Q992-F994 PolarHBondContact O-N 2.98Å; Q992-W995 PolarHBondContact O-N 2.91Å; Q992-E996 WeakPolarHBondContact O-CG 3.32Å; Q992-E996 PolarHBondContact O-N 3.38Å
993	I	92.4	Very high	91.3	Very high	28 Å²	28	48.7 Å²	48.7	14%	0.144	29%	0.292	C	S	.	.	H	α-helix	trans	-59.1	-41.7	175.2	-64.1	168.6	0	0	0	110.7	P989 W995 E996 V997 C1059 Q1061 M1064	P989-I993 WeakPolarHBondContact O-CG1 3.23Å; P989-I993 PolarHBondContact O-N 3.23Å; I993-W995 PolarHBondContact O-N 2.79Å; I993-E996 PolarHBondContact O-N 3.14Å; I993-V997 HydrophobicContact CG2-CG2 4.29Å; I993-V997 WeakPolarHBondContact O-CB 3.48Å; I993-V997 VanDerWaalsContact O-CG2 3.27Å; I993-V997 WeakPolarHBondContact O-CG2 3.45Å; I993-V997 PolarHBondContact O-N 3.36Å; I993-C1059 VanDerWaalsContact CD1-O 3.32Å; I993-C1059 WeakPolarHBondContact CD1-O 3.48Å; I993-Q1061 HydrophobicContact CG2-CB 4.01Å; I993-Q1061 HydrophobicContact CG2-CG 4.16Å; I993-M1064 HydrophobicContact CB-CE 4.12Å; I993-M1064 HydrophobicContact CB-SD 4.37Å; I993-M1064 HydrophobicContact CG2-CB 4.49Å; I993-M1064 HydrophobicContact CG2-CE 3.83Å; I993-M1064 HydrophobicContact CG2-SD 3.8Å
994	F	94.3	Very high	91.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-56.6	-50.7	175.6	171.1	-94.7	0	0	0	112.2	V990 I991 Q992 E996 V997 V998 L1009 I1033 L1053 L1055 M1064 L1068	V990-F994 WeakPolarHBondContact O-CB 3.35Å; V990-F994 PolarHBondContact O-N 3.45Å; I991-F994 WeakPolarHBondContact O-CB 3.34Å; I991-F994 PolarHBondContact O-N 2.85Å; Q992-F994 VanDerWaalsContact C-N 3.29Å; Q992-F994 PolarHBondContact O-N 2.98Å; F994-E996 PolarHBondContact O-N 2.81Å; F994-V997 PolarHBondContact O-N 2.74Å; F994-V998 HydrophobicContact CD1-CG2 4.45Å; F994-V998 HydrophobicContact CD2-CG2 4.25Å; F994-V998 HydrophobicContact CE1-CG2 4.06Å; F994-V998 HydrophobicContact CE2-CG2 3.86Å; F994-V998 HydrophobicContact CZ-CG2 3.77Å; F994-V998 VanDerWaalsContact O-CG2 3.27Å; F994-V998 WeakPolarHBondContact O-CG2 3.45Å; F994-V998 PolarHBondContact O-N 3.49Å; F994-L1009 HydrophobicContact CZ-CD2 4.24Å; F994-I1033 HydrophobicContact CD1-CD1 3.72Å; F994-I1033 HydrophobicContact CE1-CD1 3.46Å; F994-I1033 VanDerWaalsContact CE1-CD1 3.46Å; F994-I1033 HydrophobicContact CG-CD1 4.42Å; F994-I1033 HydrophobicContact CZ-CD1 3.95Å; F994-L1053 HydrophobicContact CE2-CD2 3.59Å; F994-L1053 HydrophobicContact CZ-CD2 3.82Å; F994-L1055 HydrophobicContact CB-CD2 4.04Å; F994-L1055 HydrophobicContact CD2-CD2 3.85Å; F994-L1055 HydrophobicContact CG-CD2 4.11Å; F994-M1064 WeakPolarHBondContact CA-SD 3.45Å; F994-M1064 HydrophobicContact CB-CE 4.4Å; F994-M1064 HydrophobicContact CB-SD 3.74Å; F994-M1064 HydrophobicContact CD2-SD 4.42Å; F994-M1064 PolarHBondContact N-SD 3.17Å; F994-M1064 VanDerWaalsContact N-SD 3.4Å; F994-L1068 HydrophobicContact CD2-CD2 4.15Å; F994-L1068 HydrophobicContact CE2-CD2 3.83Å
995	W	94.4	Very high	91.3	Very high	13 Å²	13	53.2 Å²	53.2	5%	0.049	30%	0.295	C	S	.	.	H	α-helix	trans	-67.1	-36.2	179.8	-71.8	116.3	0	0	0	112.7	L974 K975 T978 Y980 I991 Q992 I993 V998 E999 I1033	L974-W995 HydrophobicContact CD2-CH2 4.09Å; L974-W995 HydrophobicContact CD2-CZ3 4.16Å; L974-W995 HydrophobicContact CG-CH2 3.95Å; L974-W995 HydrophobicContact CG-CZ3 4.38Å; K975-W995 HydrophobicContact CB-CD2 4.3Å; K975-W995 HydrophobicContact CB-CE3 4.4Å; K975-W995 HydrophobicContact CB-CH2 4.17Å; K975-W995 HydrophobicContact CB-CZ2 4.03Å; K975-W995 HydrophobicContact CB-CZ3 4.35Å; K975-W995 HydrophobicContact CD-CD2 4.04Å; K975-W995 HydrophobicContact CD-CG 3.97Å; K975-W995 HydrophobicContact CG-CD2 4.05Å; K975-W995 HydrophobicContact CG-CG 4.36Å; K975-W995 HydrophobicContact CG-CZ2 4.12Å; T978-W995 HydrophobicContact CG2-CZ2 4.15Å; Y980-W995 AromaticContact CZ-NE1 3.97Å; Y980-W995 PolarHBondContact OH-NE1 2.79Å; I991-W995 PolarHBondContact O-N 3.45Å; I991-W995 VanDerWaalsContact O-N 3.07Å; Q992-W995 PolarHBondContact O-N 2.91Å; I993-W995 PolarHBondContact O-N 2.79Å; W995-V998 PolarHBondContact O-N 3.37Å; W995-E999 WeakPolarHBondContact O-CB 3.47Å; W995-E999 PolarHBondContact O-N 2.73Å; W995-I1033 HydrophobicContact CZ2-CD1 4.43Å
996	E	91.9	Very high	91.3	Very high	100 Å²	100	52.1 Å²	52.1	47%	0.467	28%	0.283	S	S	.	.	H	α-helix	trans	-62.3	-42.3	173.3	-72.1	172.2	-169.8	0	0	112	Q992 I993 F994 E999 G1000	Q992-E996 WeakPolarHBondContact O-CG 3.32Å; Q992-E996 PolarHBondContact O-N 3.38Å; I993-E996 PolarHBondContact O-N 3.14Å; F994-E996 PolarHBondContact O-N 2.81Å; E996-E999 PolarHBondContact O-N 3.3Å; E996-G1000 PolarHBondContact O-N 2.97Å
997	V	93.2	Very high	91.2	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.024	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-46.1	175.7	167.6	0	0	0	0	111	I993 F994 G1000 F1001 Q1061 M1064 R1065	I993-V997 HydrophobicContact CG2-CG2 4.29Å; I993-V997 WeakPolarHBondContact O-CB 3.48Å; I993-V997 VanDerWaalsContact O-CG2 3.27Å; I993-V997 WeakPolarHBondContact O-CG2 3.45Å; I993-V997 PolarHBondContact O-N 3.36Å; F994-V997 PolarHBondContact O-N 2.74Å; V997-G1000 PolarHBondContact O-N 3.07Å; V997-F1001 HydrophobicContact CG1-CD1 4.49Å; V997-F1001 HydrophobicContact CG1-CE1 3.63Å; V997-F1001 HydrophobicContact CG1-CZ 4.01Å; V997-F1001 WeakPolarHBondContact O-CD1 3.37Å; V997-Q1061 HydrophobicContact CG2-CG 3.58Å; V997-M1064 HydrophobicContact CG2-CB 4.47Å; V997-M1064 HydrophobicContact CG2-CG 4.48Å; V997-M1064 HydrophobicContact CG2-SD 4.33Å; V997-R1065 HydrophobicContact CG1-CB 3.7Å; V997-R1065 HydrophobicContact CG1-CG 4.03Å; V997-R1065 HydrophobicContact CG2-CB 4.28Å
998	V	92.9	Very high	91.1	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-69.9	-30.8	-179.3	174.6	0	0	0	0	111.8	L971 F994 W995 G1000 F1001 K1006 L1009 L1068	L971-V998 HydrophobicContact CD1-CG1 4.22Å; L971-V998 HydrophobicContact CD2-CG1 3.67Å; F994-V998 HydrophobicContact CD1-CG2 4.45Å; F994-V998 HydrophobicContact CD2-CG2 4.25Å; F994-V998 HydrophobicContact CE1-CG2 4.06Å; F994-V998 HydrophobicContact CE2-CG2 3.86Å; F994-V998 HydrophobicContact CZ-CG2 3.77Å; F994-V998 VanDerWaalsContact O-CG2 3.27Å; F994-V998 WeakPolarHBondContact O-CG2 3.45Å; F994-V998 PolarHBondContact O-N 3.49Å; W995-V998 PolarHBondContact O-N 3.37Å; V998-G1000 VanDerWaalsContact C-N 3.26Å; V998-G1000 PolarHBondContact O-N 3.25Å; V998-F1001 HydrophobicContact CG2-CD2 4.49Å; V998-F1001 HydrophobicContact CG2-CE2 4.31Å; V998-F1001 VanDerWaalsContact O-CB 3.31Å; V998-F1001 WeakPolarHBondContact O-CB 3.43Å; V998-F1001 PolarHBondContact O-N 3.45Å; V998-F1001 VanDerWaalsContact O-N 3.09Å; V998-K1006 WeakPolarHBondContact O-CE 3.3Å; V998-L1009 HydrophobicContact CG1-CD2 3.96Å; V998-L1009 HydrophobicContact CG2-CD2 3.66Å; V998-L1068 HydrophobicContact CG2-CD2 4.22Å
999	E	92.8	Very high	91	Very high	139 Å²	139	46.9 Å²	46.9	65%	0.65	24%	0.243	S	C	*	.	H	α-helix	trans	-60.4	-40.2	173.3	-169.6	168.9	-166.2	0	0	111.1	L971 W995 E996 F1001 K1006	L971-E999 HydrophobicContact CD1-CB 4.36Å; W995-E999 WeakPolarHBondContact O-CB 3.47Å; W995-E999 PolarHBondContact O-N 2.73Å; E996-E999 PolarHBondContact O-N 3.3Å; E999-F1001 PolarHBondContact O-N 3.32Å; E999-K1006 PolarHBondContact O-NZ 3.15Å
1000	G	89.1	Confident	90.9	Very high	47 Å²	47	43.4 Å²	43.4	49%	0.485	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	9.5	173.4	0	0	0	0	0	115.9	E996 V997 V998 R1065	E996-G1000 PolarHBondContact O-N 2.97Å; V997-G1000 PolarHBondContact O-N 3.07Å; V998-G1000 VanDerWaalsContact C-N 3.26Å; V998-G1000 PolarHBondContact O-N 3.25Å; G1000-R1065 PolarHBondContact O-NH1 3.01Å
1001	F	92.6	Very high	90.5	Very high	9 Å²	9	47.6 Å²	47.6	4%	0.039	24%	0.238	C	C	.	.	S	Bend	trans	-82.8	149.1	171.5	-76.2	6.6	0	0	0	111.4	V997 V998 E999 E1005 K1006 L1009 R1065 L1068 L1069 I1072	V997-F1001 HydrophobicContact CG1-CD1 4.49Å; V997-F1001 HydrophobicContact CG1-CE1 3.63Å; V997-F1001 HydrophobicContact CG1-CZ 4.01Å; V997-F1001 WeakPolarHBondContact O-CD1 3.37Å; V998-F1001 HydrophobicContact CG2-CD2 4.49Å; V998-F1001 HydrophobicContact CG2-CE2 4.31Å; V998-F1001 VanDerWaalsContact O-CB 3.31Å; V998-F1001 WeakPolarHBondContact O-CB 3.43Å; V998-F1001 PolarHBondContact O-N 3.45Å; V998-F1001 VanDerWaalsContact O-N 3.09Å; E999-F1001 PolarHBondContact O-N 3.32Å; F1001-E1005 WeakPolarHBondContact CA-OE2 3.47Å; F1001-E1005 HydrophobicContact CB-CB 3.78Å; F1001-E1005 HydrophobicContact CD2-CB 3.88Å; F1001-E1005 HydrophobicContact CG-CB 3.87Å; F1001-K1006 HydrophobicContact CB-CG 3.74Å; F1001-K1006 WeakPolarHBondContact O-CE 3.4Å; F1001-K1006 PolarHBondContact O-NZ 2.8Å; F1001-L1009 HydrophobicContact CE2-CD2 4.33Å; F1001-R1065 HydrophobicContact CE1-CG 4.29Å; F1001-L1068 HydrophobicContact CE2-CD2 4.04Å; F1001-L1068 HydrophobicContact CZ-CD2 3.79Å; F1001-L1068 HydrophobicContact CZ-CG 4.24Å; F1001-L1069 HydrophobicContact CE1-CD2 4.03Å; F1001-L1069 HydrophobicContact CE1-CG 4.16Å; F1001-L1069 HydrophobicContact CE2-CD2 4.38Å; F1001-L1069 HydrophobicContact CZ-CD2 3.89Å; F1001-L1069 HydrophobicContact CZ-CG 4.09Å; F1001-I1072 HydrophobicContact CE2-CD1 4.21Å
1002	T	91	Very high	90.1	Very high	78 Å²	78	49.4 Å²	49.4	48%	0.479	25%	0.246	S	C	.	.			trans	-67.5	163.1	164	60.2	0	0	0	0	110.9	E1004 E1005 K1006	T1002-E1004 PolarHBondContact O-N 2.88Å; T1002-E1005 PolarHBondContact N-OE2 3.1Å; T1002-E1005 PolarHBondContact O-N 2.9Å; T1002-E1005 WeakPolarHBondContact OG1-CB 3.4Å; T1002-E1005 VanDerWaalsContact OG1-CG 3.27Å; T1002-E1005 WeakPolarHBondContact OG1-CG 3.32Å; T1002-E1005 PolarHBondContact OG1-N 3.25Å; T1002-E1005 PolarHBondContact OG1-OE2 3.35Å; T1002-K1006 WeakPolarHBondContact O-CG 3.49Å; T1002-K1006 PolarHBondContact O-N 3.3Å
1003	D	87.3	Confident	89.8	Confident	58 Å²	58	44.9 Å²	44.9	31%	0.31	23%	0.225	S	C	.	.	H	α-helix	trans	-59.3	-37.5	176.2	-170.5	62	0	0	0	111.3	P968 I969 K1006 R1007	P968-D1003 WeakPolarHBondContact CA-OD1 3.32Å; I969-D1003 PolarHBondContact N-OD1 3.27Å; D1003-K1006 PolarHBondContact O-N 3.23Å; D1003-R1007 WeakPolarHBondContact O-CB 3.27Å; D1003-R1007 WeakPolarHBondContact O-CG 3.44Å; D1003-R1007 PolarHBondContact O-N 2.66Å; D1003-R1007 IonicContact OD1-NH2 2.82Å; D1003-R1007 IonicContact OD2-CZ 2.72Å; D1003-R1007 VanDerWaalsContact OD2-CZ 3.22Å; D1003-R1007 IonicContact OD2-NE 2.84Å; D1003-R1007 PolarHBondContact OD2-NE 3.12Å; D1003-R1007 IonicContact OD2-NH2 3.33Å; D1003-R1007 PolarHBondContact OD2-NH2 3.4Å
1004	E	87	Confident	89.1	Confident	144 Å²	144	44.5 Å²	44.5	67%	0.673	22%	0.224	S	C	*	.	H	α-helix	trans	-63.5	-44.5	176	-65.3	-176.7	-176	0	0	112.7	T1002 R1007 K1008	T1002-E1004 PolarHBondContact O-N 2.88Å; E1004-R1007 WeakPolarHBondContact O-CB 3.44Å; E1004-R1007 PolarHBondContact O-N 3.16Å; E1004-K1008 WeakPolarHBondContact O-CG 3.38Å; E1004-K1008 PolarHBondContact O-N 3.31Å
1005	E	88.9	Confident	88.3	Confident	30 Å²	30	46.4 Å²	46.4	14%	0.14	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-39.2	175.4	-73.1	166.5	145.3	0	0	111.5	F1001 T1002 R1007 K1008 L1009 R1065 L1069	F1001-E1005 WeakPolarHBondContact CA-OE2 3.47Å; F1001-E1005 HydrophobicContact CB-CB 3.78Å; F1001-E1005 HydrophobicContact CD2-CB 3.88Å; F1001-E1005 HydrophobicContact CG-CB 3.87Å; T1002-E1005 PolarHBondContact N-OE2 3.1Å; T1002-E1005 PolarHBondContact O-N 2.9Å; T1002-E1005 WeakPolarHBondContact OG1-CB 3.4Å; T1002-E1005 VanDerWaalsContact OG1-CG 3.27Å; T1002-E1005 WeakPolarHBondContact OG1-CG 3.32Å; T1002-E1005 PolarHBondContact OG1-N 3.25Å; T1002-E1005 PolarHBondContact OG1-OE2 3.35Å; E1005-R1007 VanDerWaalsContact C-N 3.33Å; E1005-R1007 PolarHBondContact O-N 2.73Å; E1005-K1008 PolarHBondContact O-N 3.06Å; E1005-L1009 WeakPolarHBondContact O-CB 3.47Å; E1005-L1009 PolarHBondContact O-N 2.7Å; E1005-R1065 IonicContact OE1-NH2 3.38Å; E1005-R1065 IonicContact OE2-NH2 3.96Å; E1005-L1069 HydrophobicContact CB-CD2 4.46Å; E1005-L1069 HydrophobicContact CG-CD2 3.94Å; E1005-L1069 WeakPolarHBondContact OE1-CD2 3.44Å
1006	K	90.4	Very high	87.4	Confident	36 Å²	36	46.2 Å²	46.2	16%	0.157	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-40.7	173.5	-69.4	170.9	-173.4	174.7	0	111.4	I969 L971 V998 E999 F1001 T1002 D1003 L1009 L1010	I969-K1006 HydrophobicContact CB-CB 4.48Å; I969-K1006 HydrophobicContact CD1-CB 3.94Å; I969-K1006 WeakPolarHBondContact CD1-O 3.48Å; L971-K1006 HydrophobicContact CD1-CD 4.24Å; L971-K1006 HydrophobicContact CD2-CD 4.09Å; L971-K1006 HydrophobicContact CD2-CG 4.41Å; L971-K1006 HydrophobicContact CG-CD 4.19Å; V998-K1006 WeakPolarHBondContact O-CE 3.3Å; E999-K1006 PolarHBondContact O-NZ 3.15Å; F1001-K1006 HydrophobicContact CB-CG 3.74Å; F1001-K1006 WeakPolarHBondContact O-CE 3.4Å; F1001-K1006 PolarHBondContact O-NZ 2.8Å; T1002-K1006 WeakPolarHBondContact O-CG 3.49Å; T1002-K1006 PolarHBondContact O-N 3.3Å; D1003-K1006 PolarHBondContact O-N 3.23Å; K1006-L1009 PolarHBondContact O-N 2.63Å; K1006-L1010 WeakPolarHBondContact O-CB 3.43Å; K1006-L1010 PolarHBondContact O-N 2.76Å
1007	R	88.1	Confident	86.9	Confident	33 Å²	33	42.7 Å²	42.7	13%	0.125	22%	0.224	C	C	.	.	H	α-helix	trans	-66.1	-40.5	175	-72.6	-178.9	-169.9	-70.4	-9.4	112.2	V967 I969 D1003 E1004 E1005 L1010 K1011 S1017	V967-R1007 PolarHBondContact O-NH2 3.01Å; I969-R1007 HydrophobicContact CD1-CB 4.42Å; I969-R1007 HydrophobicContact CD1-CG 3.85Å; D1003-R1007 WeakPolarHBondContact O-CB 3.27Å; D1003-R1007 WeakPolarHBondContact O-CG 3.44Å; D1003-R1007 PolarHBondContact O-N 2.66Å; D1003-R1007 IonicContact OD1-NH2 2.82Å; D1003-R1007 IonicContact OD2-CZ 2.72Å; D1003-R1007 VanDerWaalsContact OD2-CZ 3.22Å; D1003-R1007 IonicContact OD2-NE 2.84Å; D1003-R1007 PolarHBondContact OD2-NE 3.12Å; D1003-R1007 IonicContact OD2-NH2 3.33Å; D1003-R1007 PolarHBondContact OD2-NH2 3.4Å; E1004-R1007 WeakPolarHBondContact O-CB 3.44Å; E1004-R1007 PolarHBondContact O-N 3.16Å; E1005-R1007 VanDerWaalsContact C-N 3.33Å; E1005-R1007 PolarHBondContact O-N 2.73Å; R1007-L1010 PolarHBondContact O-N 2.68Å; R1007-K1011 VanDerWaalsContact O-CB 3.25Å; R1007-K1011 WeakPolarHBondContact O-CB 3.29Å; R1007-K1011 PolarHBondContact O-N 3.14Å; R1007-S1017 VanDerWaalsContact CG-O 3.31Å; R1007-S1017 WeakPolarHBondContact CG-O 3.37Å; R1007-S1017 PolarHBondContact NH1-O 2.99Å
1008	K	87.5	Confident	86.4	Confident	83 Å²	83	45.4 Å²	45.4	36%	0.361	23%	0.234	S	C	.	.	H	α-helix	trans	-62.4	-43.5	173.2	-73.4	177.3	-176.8	176.2	0	111.1	E1004 E1005 K1011 F1012 I1072 E1073	E1004-K1008 WeakPolarHBondContact O-CG 3.38Å; E1004-K1008 PolarHBondContact O-N 3.31Å; E1005-K1008 PolarHBondContact O-N 3.06Å; K1008-K1011 PolarHBondContact O-N 3.32Å; K1008-F1012 VanDerWaalsContact O-CB 3.28Å; K1008-F1012 WeakPolarHBondContact O-CB 3.23Å; K1008-F1012 PolarHBondContact O-N 3.37Å; K1008-I1072 HydrophobicContact CB-CB 4.34Å; K1008-I1072 HydrophobicContact CB-CD1 3.99Å; K1008-I1072 HydrophobicContact CB-CG1 4.28Å; K1008-E1073 HydrophobicContact CD-CG 4.48Å; K1008-E1073 IonicContact NZ-OE1 3.77Å; K1008-E1073 PolarHBondContact NZ-OE1 3.3Å
1009	L	89.2	Confident	86	Confident	6 Å²	6	45.8 Å²	45.8	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-46.5	174.9	176.9	64.7	0	0	0	111.8	F994 V998 F1001 E1005 K1006 K1011 F1012 V1013 L1068 I1072	F994-L1009 HydrophobicContact CZ-CD2 4.24Å; V998-L1009 HydrophobicContact CG1-CD2 3.96Å; V998-L1009 HydrophobicContact CG2-CD2 3.66Å; F1001-L1009 HydrophobicContact CE2-CD2 4.33Å; E1005-L1009 WeakPolarHBondContact O-CB 3.47Å; E1005-L1009 PolarHBondContact O-N 2.7Å; K1006-L1009 PolarHBondContact O-N 2.63Å; L1009-K1011 VanDerWaalsContact C-N 3.3Å; L1009-K1011 PolarHBondContact O-N 2.97Å; L1009-F1012 WeakPolarHBondContact O-CB 3.45Å; L1009-F1012 PolarHBondContact O-N 2.9Å; L1009-V1013 HydrophobicContact CD1-CG2 4.35Å; L1009-V1013 WeakPolarHBondContact O-CG2 3.43Å; L1009-V1013 PolarHBondContact O-N 3.46Å; L1009-L1068 HydrophobicContact CD1-CD1 4.01Å; L1009-L1068 HydrophobicContact CD1-CD2 4.47Å; L1009-L1068 HydrophobicContact CD1-CG 4.46Å; L1009-I1072 HydrophobicContact CB-CG2 4.37Å; L1009-I1072 HydrophobicContact CD1-CG2 3.98Å
1010	L	88.2	Confident	85.5	Confident	5 Å²	5	40.1 Å²	40.1	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-61.9	-42.3	177.4	-174	64.3	0	0	0	110.8	I969 K1006 R1007 F1012 V1013 T1014 C1016 F1024	I969-L1010 HydrophobicContact CD1-CB 4Å; I969-L1010 HydrophobicContact CD1-CD2 3.83Å; I969-L1010 HydrophobicContact CG1-CD2 4.33Å; K1006-L1010 WeakPolarHBondContact O-CB 3.43Å; K1006-L1010 PolarHBondContact O-N 2.76Å; R1007-L1010 PolarHBondContact O-N 2.68Å; L1010-F1012 VanDerWaalsContact C-N 3.35Å; L1010-V1013 PolarHBondContact O-N 2.67Å; L1010-T1014 HydrophobicContact CD1-CG2 3.69Å; L1010-T1014 HydrophobicContact CG-CG2 4.44Å; L1010-T1014 WeakPolarHBondContact O-CA 3.38Å; L1010-T1014 WeakPolarHBondContact O-CB 3.31Å; L1010-T1014 PolarHBondContact O-N 3.13Å; L1010-T1014 PolarHBondContact O-OG1 3.39Å; L1010-C1016 CarbonylContact C-O 3.28Å; L1010-C1016 VanDerWaalsContact C-O 3.24Å; L1010-C1016 WeakPolarHBondContact CG-O 3.38Å; L1010-F1024 HydrophobicContact CD1-CE1 3.63Å; L1010-F1024 HydrophobicContact CD1-CZ 4.12Å; L1010-F1024 HydrophobicContact CD2-CE1 4.08Å; L1010-F1024 HydrophobicContact CD2-CZ 4.06Å
1011	K	84.4	Confident	85.1	Confident	92 Å²	92	40.4 Å²	40.4	40%	0.4	20%	0.202	S	C	.	.	H	α-helix	trans	-64.4	-38.8	175.1	-176.8	166.6	177.9	157.7	0	112.3	E834 R1007 K1008 L1009 V1013 S1015 C1016	E834-K1011 IonicContact OE1-NZ 3.93Å; E834-K1011 IonicContact OE2-NZ 2.9Å; E834-K1011 PolarHBondContact OE2-NZ 3.38Å; R1007-K1011 VanDerWaalsContact O-CB 3.25Å; R1007-K1011 WeakPolarHBondContact O-CB 3.29Å; R1007-K1011 PolarHBondContact O-N 3.14Å; K1008-K1011 PolarHBondContact O-N 3.32Å; L1009-K1011 VanDerWaalsContact C-N 3.3Å; L1009-K1011 PolarHBondContact O-N 2.97Å; K1011-V1013 VanDerWaalsContact C-N 3.31Å; K1011-V1013 PolarHBondContact O-N 3.49Å; K1011-S1015 WeakPolarHBondContact O-CA 3.46Å; K1011-S1015 PolarHBondContact O-N 3.01Å; K1011-C1016 VanDerWaalsContact CA-O 3.29Å; K1011-C1016 WeakPolarHBondContact CA-O 3.49Å; K1011-C1016 PolarHBondContact N-O 3.5Å; K1011-C1016 VanDerWaalsContact N-O 3.15Å
1012	F	85.2	Confident	84.6	Confident	37 Å²	37	42 Å²	42	16%	0.162	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-39.3	176.8	180	-108.5	0	0	0	111.8	K1008 L1009 L1010 P1044 A1046 T1048 L1053 A1071 I1072	K1008-F1012 VanDerWaalsContact O-CB 3.28Å; K1008-F1012 WeakPolarHBondContact O-CB 3.23Å; K1008-F1012 PolarHBondContact O-N 3.37Å; L1009-F1012 WeakPolarHBondContact O-CB 3.45Å; L1009-F1012 PolarHBondContact O-N 2.9Å; L1010-F1012 VanDerWaalsContact C-N 3.35Å; F1012-P1044 WeakPolarHBondContact CZ-O 3.33Å; F1012-A1046 HydrophobicContact CD1-CB 3.86Å; F1012-A1046 HydrophobicContact CE1-CB 3.63Å; F1012-A1046 HydrophobicContact CE2-CB 4.42Å; F1012-A1046 HydrophobicContact CG-CB 4.35Å; F1012-A1046 HydrophobicContact CZ-CB 3.94Å; F1012-A1046 WeakPolarHBondContact O-CB 3.47Å; F1012-T1048 WeakPolarHBondContact O-CG2 3.13Å; F1012-L1053 HydrophobicContact CD1-CD1 4.21Å; F1012-L1053 HydrophobicContact CE1-CD1 3.84Å; F1012-A1071 HydrophobicContact CZ-CB 4.13Å; F1012-I1072 HydrophobicContact CB-CB 4.29Å; F1012-I1072 HydrophobicContact CB-CG2 3.83Å; F1012-I1072 HydrophobicContact CD1-CG2 3.97Å; F1012-I1072 HydrophobicContact CG-CB 4.48Å; F1012-I1072 HydrophobicContact CG-CG2 3.86Å
1013	V	85.3	Confident	84.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-91.8	-28.5	-177.7	-176	0	0	0	0	113.5	L1009 L1010 K1011 F1031 T1048 N1051 L1053	L1009-V1013 HydrophobicContact CD1-CG2 4.35Å; L1009-V1013 WeakPolarHBondContact O-CG2 3.43Å; L1009-V1013 PolarHBondContact O-N 3.46Å; L1010-V1013 PolarHBondContact O-N 2.67Å; K1011-V1013 VanDerWaalsContact C-N 3.31Å; K1011-V1013 PolarHBondContact O-N 3.49Å; V1013-F1031 HydrophobicContact CB-CD2 4.28Å; V1013-F1031 HydrophobicContact CB-CE2 3.55Å; V1013-F1031 HydrophobicContact CB-CZ 4.26Å; V1013-F1031 HydrophobicContact CG1-CD2 3.73Å; V1013-F1031 HydrophobicContact CG1-CE2 3.34Å; V1013-F1031 HydrophobicContact CG1-CZ 3.99Å; V1013-F1031 HydrophobicContact CG2-CE2 3.82Å; V1013-F1031 HydrophobicContact CG2-CZ 4.04Å; V1013-T1048 VanDerWaalsContact O-CA 3.27Å; V1013-T1048 WeakPolarHBondContact O-CA 3.46Å; V1013-N1051 VanDerWaalsContact CG1-C 3.46Å; V1013-N1051 WeakPolarHBondContact CG1-O 3.42Å; V1013-N1051 WeakPolarHBondContact O-CA 3.34Å; V1013-L1053 HydrophobicContact CG1-CB 4.3Å; V1013-L1053 HydrophobicContact CG2-CB 3.93Å; V1013-L1053 HydrophobicContact CG2-CD1 4.03Å; V1013-L1053 HydrophobicContact CG2-CG 4.37Å
1014	T	77.9	Confident	84.2	Confident	20 Å²	20	36.4 Å²	36.4	12%	0.123	18%	0.181	C	C	.	.	H	α-helix	trans	-121	-1.9	-171	73.1	0	0	0	0	114.2	L1010 C1016 L1027 F1031 N1051	L1010-T1014 HydrophobicContact CD1-CG2 3.69Å; L1010-T1014 HydrophobicContact CG-CG2 4.44Å; L1010-T1014 WeakPolarHBondContact O-CA 3.38Å; L1010-T1014 WeakPolarHBondContact O-CB 3.31Å; L1010-T1014 PolarHBondContact O-N 3.13Å; L1010-T1014 PolarHBondContact O-OG1 3.39Å; T1014-C1016 PolarHBondContact O-N 2.99Å; T1014-C1016 VanDerWaalsContact O-N 3.12Å; T1014-C1016 PolarHBondContact OG1-N 2.95Å; T1014-C1016 PolarHBondContact OG1-O 3.37Å; T1014-C1016 VanDerWaalsContact OG1-O 3.1Å; T1014-L1027 HydrophobicContact CG2-CD2 4Å; T1014-F1031 HydrophobicContact CG2-CD2 4.3Å; T1014-N1051 WeakPolarHBondContact CA-OD1 3.43Å; T1014-N1051 WeakPolarHBondContact CB-OD1 3.27Å; T1014-N1051 HydrophobicContact CG2-CB 4.29Å
1015	S	76.2	Confident	84.1	Confident	39 Å²	39	36.2 Å²	36.2	27%	0.273	18%	0.178	S	C	.	.	S	Bend	trans	61.7	6	-170	-63.5	0	0	0	0	115.3	K1011 T1048	K1011-S1015 WeakPolarHBondContact O-CA 3.46Å; K1011-S1015 PolarHBondContact O-N 3.01Å; S1015-T1048 VanDerWaalsContact OG-CB 3.25Å; S1015-T1048 WeakPolarHBondContact OG-CB 3.48Å; S1015-T1048 WeakPolarHBondContact OG-CG2 3.39Å; S1015-T1048 PolarHBondContact OG-OG1 3.5Å
1016	C	76.3	Confident	83.6	Confident	10 Å²	10	39.1 Å²	39.1	7%	0.068	19%	0.192	C	C	.	.			trans	-126.3	131.5	177.6	-171.8	0	0	0	0	110.6	L1010 K1011 T1014 R1018	L1010-C1016 CarbonylContact C-O 3.28Å; L1010-C1016 VanDerWaalsContact C-O 3.24Å; L1010-C1016 WeakPolarHBondContact CG-O 3.38Å; K1011-C1016 VanDerWaalsContact CA-O 3.29Å; K1011-C1016 WeakPolarHBondContact CA-O 3.49Å; K1011-C1016 PolarHBondContact N-O 3.5Å; K1011-C1016 VanDerWaalsContact N-O 3.15Å; T1014-C1016 PolarHBondContact O-N 2.99Å; T1014-C1016 VanDerWaalsContact O-N 3.12Å; T1014-C1016 PolarHBondContact OG1-N 2.95Å; T1014-C1016 PolarHBondContact OG1-O 3.37Å; T1014-C1016 VanDerWaalsContact OG1-O 3.1Å; C1016-R1018 VanDerWaalsContact C-N 3.31Å; C1016-R1018 PolarHBondContact SG-N 3.4Å; C1016-R1018 PolarHBondContact SG-O 3.07Å
1017	S	81.5	Confident	83.1	Confident	25 Å²	25	38.8 Å²	38.8	18%	0.175	19%	0.191	C	C	.	.	S	Bend	trans	-84.1	-3.9	176.3	60.2	0	0	0	0	113.8	E834 R1007	E834-S1017 WeakPolarHBondContact OE1-CB 3.36Å; E834-S1017 PolarHBondContact OE1-N 3.47Å; E834-S1017 PolarHBondContact OE1-OG 3.21Å; R1007-S1017 VanDerWaalsContact CG-O 3.31Å; R1007-S1017 WeakPolarHBondContact CG-O 3.37Å; R1007-S1017 PolarHBondContact NH1-O 2.99Å
1018	R	83	Confident	82.2	Confident	61 Å²	61	45.9 Å²	45.9	23%	0.23	22%	0.219	C	C	.	.	S	Bend	trans	-118.3	135.1	-174.1	-60.1	-170.3	-172.7	173.5	2	111.1	S963 C1016	S963-R1018 WeakPolarHBondContact O-CB 3.48Å; S963-R1018 VanDerWaalsContact O-CD 3.31Å; S963-R1018 WeakPolarHBondContact O-CD 3.19Å; C1016-R1018 VanDerWaalsContact C-N 3.31Å; C1016-R1018 PolarHBondContact SG-N 3.4Å; C1016-R1018 PolarHBondContact SG-O 3.07Å
1019	P	83.5	Confident	81.7	Confident	10 Å²	10	43 Å²	43	7%	0.065	21%	0.209	C	C	.	.			trans	-68.7	152.5	176.4	29.2	-34.5	0	0	0	111.3	A965 I969 F1024	A965-P1019 PolarHBondContact N-O 3.05Å; A965-P1019 VanDerWaalsContact N-O 3.11Å; I969-P1019 HydrophobicContact CG1-CG 4.41Å; P1019-F1024 HydrophobicContact CB-CE1 4.26Å; P1019-F1024 HydrophobicContact CB-CE2 4.15Å; P1019-F1024 HydrophobicContact CB-CZ 3.73Å
1020	P	82.1	Confident	81.5	Confident	20 Å²	20	44.2 Å²	44.2	13%	0.13	22%	0.22	C	C	.	.			trans	-59.5	145	166.8	-17.8	30.2	0	0	0	110.9	L1022 G1023 L1027	P1020-L1022 VanDerWaalsContact C-N 3.32Å; P1020-L1022 PolarHBondContact O-N 3.3Å; P1020-G1023 PolarHBondContact O-N 3.48Å; P1020-L1027 HydrophobicContact CG-CB 4.34Å; P1020-L1027 HydrophobicContact CG-CD1 4.35Å
1021	L	81.7	Confident	81.6	Confident	52 Å²	52	44.1 Å²	44.1	27%	0.272	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-41.6	-177.1	-179.8	71.9	0	0	0	113.3	F693 V697 V960 A965 G1023	F693-L1021 HydrophobicContact CD1-CD1 4.04Å; F693-L1021 HydrophobicContact CD1-CD2 3.56Å; F693-L1021 HydrophobicContact CD1-CG 4.43Å; F693-L1021 HydrophobicContact CE1-CD1 3.65Å; F693-L1021 HydrophobicContact CE1-CD2 3.19Å; F693-L1021 HydrophobicContact CE1-CG 4.03Å; F693-L1021 HydrophobicContact CE2-CD2 4.38Å; F693-L1021 HydrophobicContact CG-CD2 4.32Å; F693-L1021 HydrophobicContact CZ-CD2 3.65Å; V697-L1021 HydrophobicContact CB-CD2 4.12Å; V697-L1021 HydrophobicContact CG1-CD2 4.37Å; V697-L1021 HydrophobicContact CG2-CD2 3.51Å; V960-L1021 HydrophobicContact CG1-CD1 4.27Å; A965-L1021 HydrophobicContact CB-CD1 4.18Å; L1021-G1023 PolarHBondContact O-N 3.37Å
1022	L	81.9	Confident	81.9	Confident	42 Å²	42	40.7 Å²	40.7	22%	0.22	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	16.5	-176.6	-60.6	178.2	0	0	0	112.9	E694 V697 K698 P1020 E1026	E694-L1022 HydrophobicContact CB-CD2 3.96Å; E694-L1022 HydrophobicContact CG-CD2 4.27Å; V697-L1022 HydrophobicContact CG1-CD1 4.24Å; V697-L1022 HydrophobicContact CG1-CG 4.5Å; K698-L1022 HydrophobicContact CG-CD1 3.66Å; K698-L1022 HydrophobicContact CG-CD2 4.32Å; P1020-L1022 VanDerWaalsContact C-N 3.32Å; P1020-L1022 PolarHBondContact O-N 3.3Å; L1022-E1026 HydrophobicContact CB-CG 3.76Å; L1022-E1026 HydrophobicContact CD1-CG 4.31Å
1023	G	83.8	Confident	82.3	Confident	14 Å²	14	39 Å²	39	14%	0.144	20%	0.199	C	C	.	.			trans	87.2	176.2	-178.5	0	0	0	0	0	114.3	D973 P1020 L1021 K1025 E1026	D973-G1023 WeakPolarHBondContact OD2-CA 3.2Å; P1020-G1023 PolarHBondContact O-N 3.48Å; L1021-G1023 PolarHBondContact O-N 3.37Å; G1023-K1025 PolarHBondContact O-N 2.91Å; G1023-E1026 PolarHBondContact O-N 3Å
1024	F	86	Confident	82.6	Confident	5 Å²	5	42 Å²	42	2%	0.022	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-71.9	-11.2	-175.2	-72.7	-73.1	0	0	0	114.2	I969 D973 L974 F977 L1010 P1019 E1026 L1027	I969-F1024 HydrophobicContact CG2-CE2 3.98Å; I969-F1024 HydrophobicContact CG2-CZ 3.95Å; D973-F1024 HydrophobicContact CB-CD2 4.31Å; D973-F1024 WeakPolarHBondContact OD2-CD2 3.41Å; D973-F1024 PolarHBondContact OD2-N 3.37Å; L974-F1024 HydrophobicContact CB-CD2 3.63Å; L974-F1024 HydrophobicContact CB-CE2 3.68Å; L974-F1024 HydrophobicContact CB-CG 4.19Å; L974-F1024 HydrophobicContact CB-CZ 4.29Å; L974-F1024 HydrophobicContact CD1-CB 4.4Å; L974-F1024 HydrophobicContact CD1-CD1 3.56Å; L974-F1024 HydrophobicContact CD1-CD2 3.98Å; L974-F1024 HydrophobicContact CD1-CE1 3.71Å; L974-F1024 HydrophobicContact CD1-CE2 4.09Å; L974-F1024 HydrophobicContact CD1-CG 3.7Å; L974-F1024 HydrophobicContact CD1-CZ 3.94Å; L974-F1024 HydrophobicContact CG-CD2 4.39Å; L974-F1024 HydrophobicContact CG-CE2 4.34Å; L974-F1024 HydrophobicContact CG-CZ 4.48Å; F977-F1024 HydrophobicContact CB-CB 4.25Å; L1010-F1024 HydrophobicContact CD1-CE1 3.63Å; L1010-F1024 HydrophobicContact CD1-CZ 4.12Å; L1010-F1024 HydrophobicContact CD2-CE1 4.08Å; L1010-F1024 HydrophobicContact CD2-CZ 4.06Å; P1019-F1024 HydrophobicContact CB-CE1 4.26Å; P1019-F1024 HydrophobicContact CB-CE2 4.15Å; P1019-F1024 HydrophobicContact CB-CZ 3.73Å; F1024-E1026 PolarHBondContact O-N 3.33Å; F1024-L1027 HydrophobicContact CD1-CD2 4.14Å; F1024-L1027 VanDerWaalsContact O-CB 3.23Å; F1024-L1027 WeakPolarHBondContact O-CB 3.27Å; F1024-L1027 PolarHBondContact O-N 3.48Å
1025	K	85.4	Confident	83.2	Confident	140 Å²	140	42.5 Å²	42.5	61%	0.609	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-57.1	-36	169.7	-174	-178.2	174.2	-173.1	0	112.8	F977 G1023 L1027	F977-K1025 HydrophobicContact CD1-CB 3.97Å; F977-K1025 HydrophobicContact CD1-CG 4.14Å; F977-K1025 HydrophobicContact CD2-CB 4.05Å; F977-K1025 HydrophobicContact CE1-CB 3.76Å; F977-K1025 HydrophobicContact CE1-CD 4.07Å; F977-K1025 HydrophobicContact CE1-CG 3.73Å; F977-K1025 HydrophobicContact CE2-CB 3.85Å; F977-K1025 HydrophobicContact CG-CB 4.13Å; F977-K1025 HydrophobicContact CZ-CB 3.71Å; F977-K1025 HydrophobicContact CZ-CD 4.07Å; F977-K1025 HydrophobicContact CZ-CG 4.02Å; G1023-K1025 PolarHBondContact O-N 2.91Å; K1025-L1027 VanDerWaalsContact C-N 3.26Å
1026	E	78.9	Confident	83.5	Confident	92 Å²	92	41.2 Å²	41.2	43%	0.43	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-83.9	-3.3	180	-62.8	-58.5	138.9	0	0	112.5	L1022 G1023 F1024 Y1028	L1022-E1026 HydrophobicContact CB-CG 3.76Å; L1022-E1026 HydrophobicContact CD1-CG 4.31Å; G1023-E1026 PolarHBondContact O-N 3Å; F1024-E1026 PolarHBondContact O-N 3.33Å; E1026-Y1028 PolarHBondContact O-N 3.08Å; E1026-Y1028 VanDerWaalsContact O-N 3.14Å
1027	L	79.6	Confident	83.9	Confident	28 Å²	28	42.2 Å²	42.2	15%	0.147	22%	0.22	C	C	.	.			trans	-72.5	107.9	172.7	-171.3	69.8	0	0	0	108.5	T1014 P1020 F1024 K1025 P1029 A1030 F1031 N1051	T1014-L1027 HydrophobicContact CG2-CD2 4Å; P1020-L1027 HydrophobicContact CG-CB 4.34Å; P1020-L1027 HydrophobicContact CG-CD1 4.35Å; F1024-L1027 HydrophobicContact CD1-CD2 4.14Å; F1024-L1027 VanDerWaalsContact O-CB 3.23Å; F1024-L1027 WeakPolarHBondContact O-CB 3.27Å; F1024-L1027 PolarHBondContact O-N 3.48Å; K1025-L1027 VanDerWaalsContact C-N 3.26Å; L1027-P1029 CarbonylContact C-O 3.5Å; L1027-P1029 CarbonylContact O-C 3.4Å; L1027-P1029 VanDerWaalsContact O-C 3.31Å; L1027-A1030 VanDerWaalsContact O-CA 3.29Å; L1027-A1030 WeakPolarHBondContact O-CA 3.4Å; L1027-A1030 PolarHBondContact O-N 3.41Å; L1027-F1031 HydrophobicContact CD2-CB 4.16Å; L1027-N1051 HydrophobicContact CD2-CB 4.45Å; L1027-N1051 WeakPolarHBondContact CG-ND2 3.49Å
1028	Y	69.1	Low	83.9	Confident	182 Å²	182	45.7 Å²	45.7	71%	0.714	24%	0.244	S	C	*	.	S	Bend	trans	-115.2	136	174.6	-176.3	-99.7	0	0	0	109.5	R772 E1026	R772-Y1028 PolarHBondContact NH1-O 3.23Å; R772-Y1028 PolarHBondContact NH2-O 3.16Å; E1026-Y1028 PolarHBondContact O-N 3.08Å; E1026-Y1028 VanDerWaalsContact O-N 3.14Å
1029	P	77.1	Confident	84	Confident	24 Å²	24	47.4 Å²	47.4	16%	0.156	26%	0.258	C	S	.	.	S	Bend	cis	-53.2	154	-20.7	-23.2	35.1	0	0	0	111.7	L1027 M1050 N1051	L1027-P1029 CarbonylContact C-O 3.5Å; L1027-P1029 CarbonylContact O-C 3.4Å; L1027-P1029 VanDerWaalsContact O-C 3.31Å; P1029-M1050 HydrophobicContact CG-SD 4.42Å; P1029-N1051 PolarHBondContact O-ND2 3.15Å
1030	A	84.7	Confident	83.8	Confident	31 Å²	31	50.8 Å²	50.8	26%	0.256	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-62.8	151.5	179.1	0	0	0	0	0	111.4	L1027 C1032	L1027-A1030 VanDerWaalsContact O-CA 3.29Å; L1027-A1030 WeakPolarHBondContact O-CA 3.4Å; L1027-A1030 PolarHBondContact O-N 3.41Å; A1030-C1032 PolarHBondContact O-N 2.89Å
1031	F	89.9	Confident	83.7	Confident	3 Å²	3	56.6 Å²	56.6	1%	0.013	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-57.4	128.8	174.4	-171.9	-86.4	0	0	0	109.3	L974 T978 N979 V1013 T1014 L1027 I1033 N1051	L974-F1031 HydrophobicContact CD1-CB 4.09Å; L974-F1031 HydrophobicContact CD1-CD1 4.45Å; L974-F1031 HydrophobicContact CD1-CD2 4.08Å; L974-F1031 HydrophobicContact CD1-CG 3.98Å; T978-F1031 CarbonylContact C-O 3.59Å; T978-F1031 WeakPolarHBondContact CA-O 3.47Å; T978-F1031 HydrophobicContact CG2-CD1 3.7Å; T978-F1031 HydrophobicContact CG2-CE1 4.24Å; T978-F1031 WeakPolarHBondContact OG1-CD1 3.38Å; N979-F1031 PolarHBondContact N-O 3.42Å; V1013-F1031 HydrophobicContact CB-CD2 4.28Å; V1013-F1031 HydrophobicContact CB-CE2 3.55Å; V1013-F1031 HydrophobicContact CB-CZ 4.26Å; V1013-F1031 HydrophobicContact CG1-CD2 3.73Å; V1013-F1031 HydrophobicContact CG1-CE2 3.34Å; V1013-F1031 HydrophobicContact CG1-CZ 3.99Å; V1013-F1031 HydrophobicContact CG2-CE2 3.82Å; V1013-F1031 HydrophobicContact CG2-CZ 4.04Å; T1014-F1031 HydrophobicContact CG2-CD2 4.3Å; L1027-F1031 HydrophobicContact CD2-CB 4.16Å; F1031-I1033 HydrophobicContact CD1-CG1 4.33Å; F1031-I1033 HydrophobicContact CE1-CD1 4.05Å; F1031-I1033 HydrophobicContact CE1-CG1 3.72Å; F1031-N1051 WeakPolarHBondContact CA-O 3.43Å
1032	C	90.8	Very high	83.8	Confident	20 Å²	20	58.5 Å²	58.5	14%	0.135	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	134.1	-173.9	-173.6	0	0	0	0	111.3	N979 A1030 N1051 L1052 L1053	N979-C1032 HydrophobicContact CB-CB 4.28Å; N979-C1032 CarbonylContact O-C 3.53Å; N979-C1032 VanDerWaalsContact O-CA 3.23Å; N979-C1032 WeakPolarHBondContact O-CA 3.27Å; A1030-C1032 PolarHBondContact O-N 2.89Å; C1032-N1051 PolarHBondContact N-O 3.09Å; C1032-L1052 HydrophobicContact CB-CD1 3.54Å; C1032-L1052 CarbonylContact O-C 3.51Å; C1032-L1052 VanDerWaalsContact O-CA 3.3Å; C1032-L1052 WeakPolarHBondContact O-CA 3.42Å; C1032-L1052 WeakPolarHBondContact SG-CD1 3.38Å; C1032-L1053 PolarHBondContact O-N 3.18Å
1033	I	93.7	Very high	83.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.9	172.4	-51.9	-177.9	0	0	0	108.9	T978 N979 Y980 S981 Y984 I991 F994 W995 F1031 L1053 L1055	T978-I1033 HydrophobicContact CG2-CD1 4.18Å; T978-I1033 HydrophobicContact CG2-CG1 3.98Å; N979-I1033 PolarHBondContact O-N 3.32Å; Y980-I1033 WeakPolarHBondContact CA-O 3.33Å; Y980-I1033 HydrophobicContact CD1-CB 4.11Å; Y980-I1033 HydrophobicContact CE1-CB 4.43Å; Y980-I1033 HydrophobicContact CE1-CD1 4.08Å; Y980-I1033 HydrophobicContact CE1-CG1 4.47Å; S981-I1033 PolarHBondContact N-O 2.97Å; Y984-I1033 HydrophobicContact CD2-CG2 4.13Å; Y984-I1033 HydrophobicContact CE2-CG2 4.46Å; I991-I1033 HydrophobicContact CD1-CB 4.27Å; I991-I1033 HydrophobicContact CD1-CD1 4.27Å; I991-I1033 HydrophobicContact CD1-CG2 3.77Å; F994-I1033 HydrophobicContact CD1-CD1 3.72Å; F994-I1033 HydrophobicContact CE1-CD1 3.46Å; F994-I1033 VanDerWaalsContact CE1-CD1 3.46Å; F994-I1033 HydrophobicContact CG-CD1 4.42Å; F994-I1033 HydrophobicContact CZ-CD1 3.95Å; W995-I1033 HydrophobicContact CZ2-CD1 4.43Å; F1031-I1033 HydrophobicContact CD1-CG1 4.33Å; F1031-I1033 HydrophobicContact CE1-CD1 4.05Å; F1031-I1033 HydrophobicContact CE1-CG1 3.72Å; I1033-L1053 CarbonylContact C-O 3.55Å; I1033-L1053 WeakPolarHBondContact CA-O 3.37Å; I1033-L1053 HydrophobicContact CG1-CB 4.49Å; I1033-L1055 HydrophobicContact CG2-CB 3.87Å; I1033-L1055 HydrophobicContact CG2-CD2 4.17Å
1034	H	91.8	Very high	84.1	Confident	65 Å²	65	58.7 Å²	58.7	30%	0.301	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	144	179.7	-170.6	77.2	0	0	0	110.9	S981 G1036 L1052 L1053 K1054 L1055	S981-H1034 WeakPolarHBondContact OG-CB 3.43Å; S981-H1034 PolarHBondContact OG-ND1 2.86Å; H1034-G1036 PolarHBondContact O-N 3.36Å; H1034-L1052 HydrophobicContact CB-CD1 3.77Å; H1034-L1052 HydrophobicContact CB-CD2 4.34Å; H1034-L1052 HydrophobicContact CB-CG 4.19Å; H1034-L1053 PolarHBondContact N-O 3.21Å; H1034-K1054 HydrophobicContact CB-CG 4.46Å; H1034-K1054 CarbonylContact O-C 3.5Å; H1034-K1054 WeakPolarHBondContact O-CA 3.43Å; H1034-L1055 PolarHBondContact O-N 3.01Å
1035	N	89.3	Confident	84.1	Confident	29 Å²	29	59.7 Å²	59.7	16%	0.155	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	116.5	173	-170.3	-15.7	0	0	0	111.1	S981 G982 Y984 G1037 E1057	S981-N1035 PolarHBondContact O-N 3.37Å; G982-N1035 WeakPolarHBondContact O-CB 3.44Å; G982-N1035 PolarHBondContact O-ND2 3.04Å; Y984-N1035 HydrophobicContact CD1-CB 4.4Å; Y984-N1035 HydrophobicContact CD2-CB 4.16Å; Y984-N1035 HydrophobicContact CE1-CB 4.16Å; Y984-N1035 VanDerWaalsContact CE2-CA 3.49Å; Y984-N1035 HydrophobicContact CE2-CB 3.95Å; Y984-N1035 HydrophobicContact CG-CB 4.4Å; N1035-G1037 VanDerWaalsContact C-N 3.29Å; N1035-G1037 PolarHBondContact OD1-N 2.83Å; N1035-E1057 PolarHBondContact ND2-OE1 2.78Å
1036	G	83	Confident	84	Confident	12 Å²	12	54.2 Å²	54.2	12%	0.124	29%	0.289	C	S	.	.			trans	-81.8	-1.7	-179.7	0	0	0	0	0	114.8	H1034 R1042 L1055	H1034-G1036 PolarHBondContact O-N 3.36Å; G1036-R1042 PolarHBondContact O-NH1 2.81Å; G1036-L1055 PolarHBondContact N-O 2.98Å
1037	G	85.3	Confident	84.1	Confident	31 Å²	31	50.8 Å²	50.8	32%	0.32	28%	0.275	S	S	.	.			trans	105.2	177	-175.4	0	0	0	0	0	113.1	N1035 P1056 E1057	N1035-G1037 VanDerWaalsContact C-N 3.29Å; N1035-G1037 PolarHBondContact OD1-N 2.83Å; G1037-P1056 WeakPolarHBondContact O-CA 3.23Å; G1037-E1057 PolarHBondContact O-N 2.81Å
1038	S	81.1	Confident	83.8	Confident	98 Å²	98	50.9 Å²	50.9	69%	0.685	28%	0.277	S	S	*	.	S	Bend	trans	-89.8	-0.3	-178.5	52.8	0	0	0	0	114.5	L1040	S1038-L1040 PolarHBondContact O-N 2.92Å
1039	D	84.4	Confident	83.6	Confident	97 Å²	97	43 Å²	43	52%	0.519	25%	0.248	S	C	.	.			trans	-76.7	108.8	176.9	-176.2	3	0	0	0	110.8	E1041 R1042	D1039-E1041 VanDerWaalsContact C-N 3.28Å; D1039-E1041 PolarHBondContact O-N 3.48Å; D1039-E1041 PolarHBondContact OD1-N 2.75Å; D1039-R1042 HydrophobicContact CB-CB 4.46Å
1040	L	80.1	Confident	83.4	Confident	81 Å²	81	46.3 Å²	46.3	42%	0.424	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-10.6	-177.6	-59.1	175.4	0	0	0	113.3	S1038 E1057 F1058	S1038-L1040 PolarHBondContact O-N 2.92Å; L1040-E1057 WeakPolarHBondContact CD2-O 3.11Å; L1040-F1058 HydrophobicContact CD2-CD1 3.87Å; L1040-F1058 HydrophobicContact CD2-CE1 4.39Å; L1040-F1058 WeakPolarHBondContact O-CE1 3.27Å
1041	E	80.9	Confident	83.4	Confident	142 Å²	142	45 Å²	45	66%	0.664	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-25.7	174.9	-72.8	-56.2	157.4	0	0	112.7	D1039 K1067	D1039-E1041 VanDerWaalsContact C-N 3.28Å; D1039-E1041 PolarHBondContact O-N 3.48Å; D1039-E1041 PolarHBondContact OD1-N 2.75Å; E1041-K1067 PolarHBondContact O-NZ 2.82Å; E1041-K1067 IonicContact OE2-NZ 2.74Å; E1041-K1067 PolarHBondContact OE2-NZ 3.37Å
1042	R	82.3	Confident	83.3	Confident	93 Å²	93	46.3 Å²	46.3	35%	0.351	26%	0.259	S	S	.	.	S	Bend	trans	-62.7	135.6	179.6	-164.6	178.6	-172.8	171.3	10.5	111.2	G1036 D1039 P1056 F1058 S1081	G1036-R1042 PolarHBondContact O-NH1 2.81Å; D1039-R1042 HydrophobicContact CB-CB 4.46Å; R1042-P1056 HydrophobicContact CB-CG 4.32Å; R1042-F1058 WeakPolarHBondContact O-CZ 3.47Å; R1042-S1081 PolarHBondContact NH2-OXT 3.36Å
1043	L	85.9	Confident	83.3	Confident	57 Å²	57	45.4 Å²	45.4	30%	0.298	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-75.6	151	172.6	-68.9	169.7	0	0	0	110.9	T1045 K1067 Y1070	L1043-T1045 PolarHBondContact O-N 3.09Å; L1043-K1067 HydrophobicContact CD2-CB 4.3Å; L1043-K1067 HydrophobicContact CD2-CD 3.68Å; L1043-Y1070 HydrophobicContact CD1-CD1 3.7Å; L1043-Y1070 HydrophobicContact CD1-CE1 3.71Å; L1043-Y1070 HydrophobicContact CD2-CD1 3.69Å; L1043-Y1070 HydrophobicContact CD2-CE1 4.41Å; L1043-Y1070 HydrophobicContact CD2-CG 4.5Å; L1043-Y1070 HydrophobicContact CG-CD1 4.37Å
1044	P	87.9	Confident	83.1	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.019	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-51.7	131.3	163.3	-24.3	33.4	0	0	0	110.1	F1012 L1053 K1054 L1055 F1058 L1068 A1071	F1012-P1044 WeakPolarHBondContact CZ-O 3.33Å; P1044-L1053 HydrophobicContact CB-CD1 4.22Å; P1044-K1054 WeakPolarHBondContact CA-O 3.46Å; P1044-L1055 HydrophobicContact CG-CD1 4.21Å; P1044-F1058 HydrophobicContact CG-CE2 4.04Å; P1044-L1068 HydrophobicContact CB-CD1 4.14Å; P1044-L1068 HydrophobicContact CG-CD1 4.07Å; P1044-A1071 HydrophobicContact CB-CB 4.25Å; P1044-A1071 HydrophobicContact CG-CB 4.38Å
1045	T	85.1	Confident	83	Confident	26 Å²	26	45.2 Å²	45.2	16%	0.16	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	149.9	176.3	49.3	0	0	0	0	109.2	L1043 K1054	L1043-T1045 PolarHBondContact O-N 3.09Å; T1045-K1054 PolarHBondContact N-O 2.93Å; T1045-K1054 VanDerWaalsContact N-O 3.11Å; T1045-K1054 WeakPolarHBondContact O-CA 3.2Å; T1045-K1054 WeakPolarHBondContact O-CB 3.45Å; T1045-K1054 PolarHBondContact O-N 3.44Å; T1045-K1054 WeakPolarHBondContact OG1-CB 3.33Å
1046	A	83.6	Confident	83.1	Confident	24 Å²	24	43.9 Å²	43.9	20%	0.198	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	147.5	177.5	0	0	0	0	0	110.9	F1012 T1048 L1052	F1012-A1046 HydrophobicContact CD1-CB 3.86Å; F1012-A1046 HydrophobicContact CE1-CB 3.63Å; F1012-A1046 HydrophobicContact CE2-CB 4.42Å; F1012-A1046 HydrophobicContact CG-CB 4.35Å; F1012-A1046 HydrophobicContact CZ-CB 3.94Å; F1012-A1046 WeakPolarHBondContact O-CB 3.47Å; A1046-T1048 HydrophobicContact CB-CG2 4.48Å; A1046-L1052 CarbonylContact C-O 3.58Å; A1046-L1052 VanDerWaalsContact CA-O 3.3Å; A1046-L1052 WeakPolarHBondContact CA-O 3.47Å
1047	S	80.1	Confident	83.4	Confident	21 Å²	21	46.6 Å²	46.6	15%	0.147	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	87.4	164.7	-54.8	0	0	0	0	107	C1049 M1050 N1051 L1052	S1047-C1049 PolarHBondContact O-N 3.03Å; S1047-M1050 PolarHBondContact O-N 3.22Å; S1047-N1051 PolarHBondContact O-N 2.79Å; S1047-L1052 PolarHBondContact N-O 3.19Å; S1047-L1052 PolarHBondContact O-N 2.81Å
1048	T	73.2	Confident	83.6	Confident	29 Å²	29	45.1 Å²	45.1	18%	0.178	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-59	-34.1	-171	53.7	0	0	0	0	113	F1012 V1013 S1015 A1046 M1050 N1051	F1012-T1048 WeakPolarHBondContact O-CG2 3.13Å; V1013-T1048 VanDerWaalsContact O-CA 3.27Å; V1013-T1048 WeakPolarHBondContact O-CA 3.46Å; S1015-T1048 VanDerWaalsContact OG-CB 3.25Å; S1015-T1048 WeakPolarHBondContact OG-CB 3.48Å; S1015-T1048 WeakPolarHBondContact OG-CG2 3.39Å; S1015-T1048 PolarHBondContact OG-OG1 3.5Å; A1046-T1048 HydrophobicContact CB-CG2 4.48Å; T1048-M1050 PolarHBondContact O-N 3.02Å; T1048-M1050 VanDerWaalsContact O-N 3.15Å; T1048-N1051 PolarHBondContact O-N 3.06Å; T1048-N1051 VanDerWaalsContact O-N 3.1Å; T1048-N1051 PolarHBondContact O-OD1 3.22Å
1049	C	66.1	Low	83.7	Confident	16 Å²	16	45.2 Å²	45.2	11%	0.108	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-40.6	-42.1	165.7	-71.5	0	0	0	0	115.4	G769 S1047	G769-C1049 PolarHBondContact O-SG 3.47Å; S1047-C1049 PolarHBondContact O-N 3.03Å
1050	M	73.3	Confident	83.9	Confident	95 Å²	95	44.4 Å²	44.4	47%	0.468	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-112.3	9.5	-174.9	-63.4	-62.8	-74.3	0	0	112.4	P1029 S1047 T1048 L1052	P1029-M1050 HydrophobicContact CG-SD 4.42Å; S1047-M1050 PolarHBondContact O-N 3.22Å; T1048-M1050 PolarHBondContact O-N 3.02Å; T1048-M1050 VanDerWaalsContact O-N 3.15Å; M1050-L1052 HydrophobicContact CB-CB 4.05Å; M1050-L1052 PolarHBondContact O-N 2.76Å
1051	N	84.3	Confident	84.4	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	40.2	-169.7	-63.4	-32.5	0	0	0	112.2	V1013 T1014 L1027 P1029 F1031 C1032 S1047 T1048	V1013-N1051 VanDerWaalsContact CG1-C 3.46Å; V1013-N1051 WeakPolarHBondContact CG1-O 3.42Å; V1013-N1051 WeakPolarHBondContact O-CA 3.34Å; T1014-N1051 WeakPolarHBondContact CA-OD1 3.43Å; T1014-N1051 WeakPolarHBondContact CB-OD1 3.27Å; T1014-N1051 HydrophobicContact CG2-CB 4.29Å; L1027-N1051 HydrophobicContact CD2-CB 4.45Å; L1027-N1051 WeakPolarHBondContact CG-ND2 3.49Å; P1029-N1051 PolarHBondContact O-ND2 3.15Å; F1031-N1051 WeakPolarHBondContact CA-O 3.43Å; C1032-N1051 PolarHBondContact N-O 3.09Å; S1047-N1051 PolarHBondContact O-N 2.79Å; T1048-N1051 PolarHBondContact O-N 3.06Å; T1048-N1051 VanDerWaalsContact O-N 3.1Å; T1048-N1051 PolarHBondContact O-OD1 3.22Å
1052	L	86.7	Confident	84.8	Confident	30 Å²	30	45.1 Å²	45.1	16%	0.157	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	122.2	-170.2	-173.6	74.3	0	0	0	111.2	C1032 H1034 A1046 S1047 M1050 K1054	C1032-L1052 HydrophobicContact CB-CD1 3.54Å; C1032-L1052 CarbonylContact O-C 3.51Å; C1032-L1052 VanDerWaalsContact O-CA 3.3Å; C1032-L1052 WeakPolarHBondContact O-CA 3.42Å; C1032-L1052 WeakPolarHBondContact SG-CD1 3.38Å; H1034-L1052 HydrophobicContact CB-CD1 3.77Å; H1034-L1052 HydrophobicContact CB-CD2 4.34Å; H1034-L1052 HydrophobicContact CB-CG 4.19Å; A1046-L1052 CarbonylContact C-O 3.58Å; A1046-L1052 VanDerWaalsContact CA-O 3.3Å; A1046-L1052 WeakPolarHBondContact CA-O 3.47Å; S1047-L1052 PolarHBondContact N-O 3.19Å; S1047-L1052 PolarHBondContact O-N 2.81Å; M1050-L1052 HydrophobicContact CB-CB 4.05Å; M1050-L1052 PolarHBondContact O-N 2.76Å; L1052-K1054 HydrophobicContact CD2-CG 4.33Å
1053	L	90.8	Very high	85.1	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.1	169.2	179.6	64.2	0	0	0	109.5	F994 F1012 V1013 C1032 I1033 H1034 P1044 L1055	F994-L1053 HydrophobicContact CE2-CD2 3.59Å; F994-L1053 HydrophobicContact CZ-CD2 3.82Å; F1012-L1053 HydrophobicContact CD1-CD1 4.21Å; F1012-L1053 HydrophobicContact CE1-CD1 3.84Å; V1013-L1053 HydrophobicContact CG1-CB 4.3Å; V1013-L1053 HydrophobicContact CG2-CB 3.93Å; V1013-L1053 HydrophobicContact CG2-CD1 4.03Å; V1013-L1053 HydrophobicContact CG2-CG 4.37Å; C1032-L1053 PolarHBondContact O-N 3.18Å; I1033-L1053 CarbonylContact C-O 3.55Å; I1033-L1053 WeakPolarHBondContact CA-O 3.37Å; I1033-L1053 HydrophobicContact CG1-CB 4.49Å; H1034-L1053 PolarHBondContact N-O 3.21Å; P1044-L1053 HydrophobicContact CB-CD1 4.22Å; L1053-L1055 PolarHBondContact O-N 3.45Å
1054	K	89.8	Confident	85.4	Confident	61 Å²	61	40.7 Å²	40.7	27%	0.265	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	104.5	170.7	-62	176.6	-174.7	173.7	0	108.3	H1034 P1044 T1045 L1052	H1034-K1054 HydrophobicContact CB-CG 4.46Å; H1034-K1054 CarbonylContact O-C 3.5Å; H1034-K1054 WeakPolarHBondContact O-CA 3.43Å; P1044-K1054 WeakPolarHBondContact CA-O 3.46Å; T1045-K1054 PolarHBondContact N-O 2.93Å; T1045-K1054 VanDerWaalsContact N-O 3.11Å; T1045-K1054 WeakPolarHBondContact O-CA 3.2Å; T1045-K1054 WeakPolarHBondContact O-CB 3.45Å; T1045-K1054 PolarHBondContact O-N 3.44Å; T1045-K1054 WeakPolarHBondContact OG1-CB 3.33Å; L1052-K1054 HydrophobicContact CD2-CG 4.33Å
1055	L	90.8	Very high	85.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.3	-175.3	-176.8	67.2	0	0	0	109.5	Y984 V990 F994 I1033 H1034 G1036 P1044 L1053 F1058 M1064	Y984-L1055 HydrophobicContact CE2-CB 4.29Å; Y984-L1055 WeakPolarHBondContact CE2-O 3.3Å; Y984-L1055 PolarHBondContact OH-O 3.11Å; V990-L1055 HydrophobicContact CG1-CD2 4.11Å; F994-L1055 HydrophobicContact CB-CD2 4.04Å; F994-L1055 HydrophobicContact CD2-CD2 3.85Å; F994-L1055 HydrophobicContact CG-CD2 4.11Å; I1033-L1055 HydrophobicContact CG2-CB 3.87Å; I1033-L1055 HydrophobicContact CG2-CD2 4.17Å; H1034-L1055 PolarHBondContact O-N 3.01Å; G1036-L1055 PolarHBondContact N-O 2.98Å; P1044-L1055 HydrophobicContact CG-CD1 4.21Å; L1053-L1055 PolarHBondContact O-N 3.45Å; L1055-F1058 HydrophobicContact CD1-CD2 4.11Å; L1055-F1058 HydrophobicContact CD1-CE2 4.25Å; L1055-M1064 HydrophobicContact CD2-CE 4.46Å
1056	P	90.8	Very high	85.8	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.006	25%	0.249	C	C	.	.			trans	-64	162.1	170.4	-22.3	33.7	0	0	0	113	Y984 G1037 R1042 F1058	Y984-P1056 PolarHBondContact OH-O 3.31Å; G1037-P1056 WeakPolarHBondContact O-CA 3.23Å; R1042-P1056 HydrophobicContact CB-CG 4.32Å; P1056-F1058 HydrophobicContact CB-CD2 4.46Å; P1056-F1058 HydrophobicContact CB-CE1 4.08Å; P1056-F1058 HydrophobicContact CB-CE2 3.98Å; P1056-F1058 HydrophobicContact CB-CZ 3.77Å; P1056-F1058 HydrophobicContact CG-CE2 3.95Å; P1056-F1058 HydrophobicContact CG-CZ 3.76Å; P1056-F1058 PolarHBondContact O-N 3.46Å
1057	E	89.3	Confident	86.1	Confident	69 Å²	69	47.5 Å²	47.5	32%	0.322	25%	0.248	S	C	.	.			trans	-73.5	60.4	-177.8	-68.3	-179.8	-179.5	0	0	114	Y984 V990 N1035 G1037 L1040 C1059	Y984-E1057 HydrophobicContact CE1-CG 4.05Å; Y984-E1057 WeakPolarHBondContact OH-CA 3.42Å; Y984-E1057 VanDerWaalsContact OH-CG 3.23Å; Y984-E1057 WeakPolarHBondContact OH-CG 3.32Å; Y984-E1057 PolarHBondContact OH-N 2.86Å; V990-E1057 HydrophobicContact CG2-CB 4.39Å; N1035-E1057 PolarHBondContact ND2-OE1 2.78Å; G1037-E1057 PolarHBondContact O-N 2.81Å; L1040-E1057 WeakPolarHBondContact CD2-O 3.11Å; E1057-C1059 PolarHBondContact O-N 2.87Å; E1057-C1059 VanDerWaalsContact O-N 3.17Å
1058	F	88.7	Confident	86.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.			trans	-71.1	109.3	174.2	-55.2	-56.3	0	0	0	110.8	L1040 R1042 P1044 L1055 P1056 L1063 M1064 K1067	L1040-F1058 HydrophobicContact CD2-CD1 3.87Å; L1040-F1058 HydrophobicContact CD2-CE1 4.39Å; L1040-F1058 WeakPolarHBondContact O-CE1 3.27Å; R1042-F1058 WeakPolarHBondContact O-CZ 3.47Å; P1044-F1058 HydrophobicContact CG-CE2 4.04Å; L1055-F1058 HydrophobicContact CD1-CD2 4.11Å; L1055-F1058 HydrophobicContact CD1-CE2 4.25Å; P1056-F1058 HydrophobicContact CB-CD2 4.46Å; P1056-F1058 HydrophobicContact CB-CE1 4.08Å; P1056-F1058 HydrophobicContact CB-CE2 3.98Å; P1056-F1058 HydrophobicContact CB-CZ 3.77Å; P1056-F1058 HydrophobicContact CG-CE2 3.95Å; P1056-F1058 HydrophobicContact CG-CZ 3.76Å; P1056-F1058 PolarHBondContact O-N 3.46Å; F1058-L1063 HydrophobicContact CD1-CD2 3.99Å; F1058-L1063 HydrophobicContact CD1-CG 4.19Å; F1058-M1064 HydrophobicContact CB-CB 3.9Å; F1058-M1064 HydrophobicContact CB-CE 3.77Å; F1058-M1064 HydrophobicContact CB-CG 4.36Å; F1058-M1064 HydrophobicContact CD2-CB 4.36Å; F1058-M1064 HydrophobicContact CD2-CG 4.22Å; F1058-M1064 HydrophobicContact CG-CB 4.42Å; F1058-M1064 VanDerWaalsContact O-CE 3.23Å; F1058-M1064 WeakPolarHBondContact O-CE 3.32Å; F1058-K1067 HydrophobicContact CE1-CG 4.4Å; F1058-K1067 HydrophobicContact CE2-CB 4.28Å; F1058-K1067 HydrophobicContact CZ-CB 4.07Å; F1058-K1067 HydrophobicContact CZ-CG 4.22Å
1059	C	83.9	Confident	87.3	Confident	100 Å²	100	46.4 Å²	46.4	68%	0.676	24%	0.239	S	C	*	.			trans	-87.9	-11.2	176	-62.4	0	0	0	0	113.7	I993 E1057	I993-C1059 VanDerWaalsContact CD1-O 3.32Å; I993-C1059 WeakPolarHBondContact CD1-O 3.48Å; E1057-C1059 PolarHBondContact O-N 2.87Å; E1057-C1059 VanDerWaalsContact O-N 3.17Å
1060	D	89.1	Confident	88.4	Confident	80 Å²	80	52.3 Å²	52.3	43%	0.428	26%	0.26	S	S	.	.			trans	-103.3	129.7	176.9	174.3	43.7	0	0	0	111.3	H1062 L1063 M1064	D1060-H1062 PolarHBondContact O-N 3.31Å; D1060-L1063 HydrophobicContact CB-CB 4Å; D1060-L1063 WeakPolarHBondContact OD2-CB 3.43Å; D1060-L1063 PolarHBondContact OD2-N 3.42Å; D1060-M1064 WeakPolarHBondContact O-CB 3.23Å; D1060-M1064 PolarHBondContact O-N 2.87Å
1061	Q	90.4	Very high	89	Confident	90 Å²	90	48.1 Å²	48.1	42%	0.421	24%	0.24	S	C	.	.	H	α-helix	trans	-65.2	-39.7	-176.7	-169.4	-177.9	13.2	0	0	112.1	I993 V997 R1065	I993-Q1061 HydrophobicContact CG2-CB 4.01Å; I993-Q1061 HydrophobicContact CG2-CG 4.16Å; V997-Q1061 HydrophobicContact CG2-CG 3.58Å; Q1061-R1065 WeakPolarHBondContact O-CB 3.32Å; Q1061-R1065 PolarHBondContact O-N 2.92Å
1062	H	89.2	Confident	89.2	Confident	148 Å²	148	48.3 Å²	48.3	69%	0.685	24%	0.241	S	C	*	.	H	α-helix	trans	-69.5	-45.5	179.8	-76.4	-70.1	0	0	0	111.6	D1060 M1064 R1065 S1066	D1060-H1062 PolarHBondContact O-N 3.31Å; H1062-M1064 PolarHBondContact O-N 2.8Å; H1062-R1065 PolarHBondContact O-N 3.33Å; H1062-S1066 PolarHBondContact O-N 3.21Å
1063	L	89.1	Confident	89.1	Confident	58 Å²	58	52 Å²	52	30%	0.304	26%	0.258	S	S	.	.	H	α-helix	trans	-58.9	-46.2	174.7	-176.6	63.1	0	0	0	111.7	F1058 D1060 S1066 K1067	F1058-L1063 HydrophobicContact CD1-CD2 3.99Å; F1058-L1063 HydrophobicContact CD1-CG 4.19Å; D1060-L1063 HydrophobicContact CB-CB 4Å; D1060-L1063 WeakPolarHBondContact OD2-CB 3.43Å; D1060-L1063 PolarHBondContact OD2-N 3.42Å; L1063-S1066 PolarHBondContact O-N 2.79Å; L1063-K1067 HydrophobicContact CD1-CG 4.04Å; L1063-K1067 HydrophobicContact CG-CG 4.48Å; L1063-K1067 WeakPolarHBondContact O-CB 3.22Å; L1063-K1067 WeakPolarHBondContact O-CG 3.32Å; L1063-K1067 PolarHBondContact O-N 3.08Å
1064	M	91.3	Very high	88.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60	-48.3	177.5	-176.3	178.6	-67.5	0	0	111.6	V990 I993 F994 V997 L1055 F1058 D1060 H1062 S1066 K1067 L1068	V990-M1064 HydrophobicContact CG1-CE 3.64Å; V990-M1064 WeakPolarHBondContact O-CE 3.5Å; I993-M1064 HydrophobicContact CB-CE 4.12Å; I993-M1064 HydrophobicContact CB-SD 4.37Å; I993-M1064 HydrophobicContact CG2-CB 4.49Å; I993-M1064 HydrophobicContact CG2-CE 3.83Å; I993-M1064 HydrophobicContact CG2-SD 3.8Å; F994-M1064 WeakPolarHBondContact CA-SD 3.45Å; F994-M1064 HydrophobicContact CB-CE 4.4Å; F994-M1064 HydrophobicContact CB-SD 3.74Å; F994-M1064 HydrophobicContact CD2-SD 4.42Å; F994-M1064 PolarHBondContact N-SD 3.17Å; F994-M1064 VanDerWaalsContact N-SD 3.4Å; V997-M1064 HydrophobicContact CG2-CB 4.47Å; V997-M1064 HydrophobicContact CG2-CG 4.48Å; V997-M1064 HydrophobicContact CG2-SD 4.33Å; L1055-M1064 HydrophobicContact CD2-CE 4.46Å; F1058-M1064 HydrophobicContact CB-CB 3.9Å; F1058-M1064 HydrophobicContact CB-CE 3.77Å; F1058-M1064 HydrophobicContact CB-CG 4.36Å; F1058-M1064 HydrophobicContact CD2-CB 4.36Å; F1058-M1064 HydrophobicContact CD2-CG 4.22Å; F1058-M1064 HydrophobicContact CG-CB 4.42Å; F1058-M1064 VanDerWaalsContact O-CE 3.23Å; F1058-M1064 WeakPolarHBondContact O-CE 3.32Å; D1060-M1064 WeakPolarHBondContact O-CB 3.23Å; D1060-M1064 PolarHBondContact O-N 2.87Å; H1062-M1064 PolarHBondContact O-N 2.8Å; M1064-S1066 PolarHBondContact O-N 3.39Å; M1064-K1067 PolarHBondContact O-N 3.09Å; M1064-L1068 WeakPolarHBondContact O-CB 3.23Å; M1064-L1068 PolarHBondContact O-N 2.94Å
1065	R	91.8	Very high	86.7	Confident	79 Å²	79	56.5 Å²	56.5	30%	0.298	30%	0.297	S	S	.	.	H	α-helix	trans	-58.7	-47.6	178.2	-178.6	170.9	-179.1	109.2	6.3	111.6	V997 G1000 F1001 E1005 Q1061 H1062 L1069	V997-R1065 HydrophobicContact CG1-CB 3.7Å; V997-R1065 HydrophobicContact CG1-CG 4.03Å; V997-R1065 HydrophobicContact CG2-CB 4.28Å; G1000-R1065 PolarHBondContact O-NH1 3.01Å; F1001-R1065 HydrophobicContact CE1-CG 4.29Å; E1005-R1065 IonicContact OE1-NH2 3.38Å; E1005-R1065 IonicContact OE2-NH2 3.96Å; Q1061-R1065 WeakPolarHBondContact O-CB 3.32Å; Q1061-R1065 PolarHBondContact O-N 2.92Å; H1062-R1065 PolarHBondContact O-N 3.33Å; R1065-L1069 HydrophobicContact CG-CD1 3.78Å; R1065-L1069 HydrophobicContact CG-CG 4.39Å; R1065-L1069 WeakPolarHBondContact O-CB 3.46Å; R1065-L1069 WeakPolarHBondContact O-CG 3Å; R1065-L1069 PolarHBondContact O-N 2.89Å
1066	S	90.1	Very high	84.6	Confident	78 Å²	78	59.2 Å²	59.2	55%	0.545	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-47.5	-178.7	-174.1	0	0	0	0	112.3	H1062 L1063 M1064 Y1070	H1062-S1066 PolarHBondContact O-N 3.21Å; L1063-S1066 PolarHBondContact O-N 2.79Å; M1064-S1066 PolarHBondContact O-N 3.39Å; S1066-Y1070 VanDerWaalsContact O-CB 3.25Å; S1066-Y1070 WeakPolarHBondContact O-CB 3.35Å; S1066-Y1070 PolarHBondContact O-N 2.83Å
1067	K	89.4	Confident	82.6	Confident	39 Å²	39	61.9 Å²	61.9	17%	0.17	35%	0.347	C	S	.	.	H	α-helix	trans	-70	-35.6	-178.9	-68.8	-85.5	-171.5	170.6	0	111.4	E1041 L1043 F1058 L1063 M1064 A1071	E1041-K1067 PolarHBondContact O-NZ 2.82Å; E1041-K1067 IonicContact OE2-NZ 2.74Å; E1041-K1067 PolarHBondContact OE2-NZ 3.37Å; L1043-K1067 HydrophobicContact CD2-CB 4.3Å; L1043-K1067 HydrophobicContact CD2-CD 3.68Å; F1058-K1067 HydrophobicContact CE1-CG 4.4Å; F1058-K1067 HydrophobicContact CE2-CB 4.28Å; F1058-K1067 HydrophobicContact CZ-CB 4.07Å; F1058-K1067 HydrophobicContact CZ-CG 4.22Å; L1063-K1067 HydrophobicContact CD1-CG 4.04Å; L1063-K1067 HydrophobicContact CG-CG 4.48Å; L1063-K1067 WeakPolarHBondContact O-CB 3.22Å; L1063-K1067 WeakPolarHBondContact O-CG 3.32Å; L1063-K1067 PolarHBondContact O-N 3.08Å; M1064-K1067 PolarHBondContact O-N 3.09Å; K1067-A1071 WeakPolarHBondContact O-CB 3.46Å; K1067-A1071 PolarHBondContact O-N 3.31Å
1068	L	89.3	Confident	80.3	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-69.3	-46.8	176.5	-171.8	63.9	0	0	0	112.1	F994 V998 F1001 L1009 P1044 M1064 Y1070 A1071 I1072	F994-L1068 HydrophobicContact CD2-CD2 4.15Å; F994-L1068 HydrophobicContact CE2-CD2 3.83Å; V998-L1068 HydrophobicContact CG2-CD2 4.22Å; F1001-L1068 HydrophobicContact CE2-CD2 4.04Å; F1001-L1068 HydrophobicContact CZ-CD2 3.79Å; F1001-L1068 HydrophobicContact CZ-CG 4.24Å; L1009-L1068 HydrophobicContact CD1-CD1 4.01Å; L1009-L1068 HydrophobicContact CD1-CD2 4.47Å; L1009-L1068 HydrophobicContact CD1-CG 4.46Å; P1044-L1068 HydrophobicContact CB-CD1 4.14Å; P1044-L1068 HydrophobicContact CG-CD1 4.07Å; M1064-L1068 WeakPolarHBondContact O-CB 3.23Å; M1064-L1068 PolarHBondContact O-N 2.94Å; L1068-Y1070 VanDerWaalsContact C-N 3.34Å; L1068-Y1070 PolarHBondContact O-N 3.2Å; L1068-A1071 PolarHBondContact O-N 2.85Å; L1068-I1072 WeakPolarHBondContact O-CG2 3.46Å; L1068-I1072 PolarHBondContact O-N 3.37Å
1069	L	89.8	Confident	77.9	Confident	27 Å²	27	72.3 Å²	72.3	14%	0.141	39%	0.394	C	S	.	.	H	α-helix	trans	-60.5	-44.8	174.8	-75.8	172.7	0	0	0	111.2	F1001 E1005 R1065 A1071 I1072 E1073	F1001-L1069 HydrophobicContact CE1-CD2 4.03Å; F1001-L1069 HydrophobicContact CE1-CG 4.16Å; F1001-L1069 HydrophobicContact CE2-CD2 4.38Å; F1001-L1069 HydrophobicContact CZ-CD2 3.89Å; F1001-L1069 HydrophobicContact CZ-CG 4.09Å; E1005-L1069 HydrophobicContact CB-CD2 4.46Å; E1005-L1069 HydrophobicContact CG-CD2 3.94Å; E1005-L1069 WeakPolarHBondContact OE1-CD2 3.44Å; R1065-L1069 HydrophobicContact CG-CD1 3.78Å; R1065-L1069 HydrophobicContact CG-CG 4.39Å; R1065-L1069 WeakPolarHBondContact O-CB 3.46Å; R1065-L1069 WeakPolarHBondContact O-CG 3Å; R1065-L1069 PolarHBondContact O-N 2.89Å; L1069-A1071 VanDerWaalsContact C-N 3.32Å; L1069-A1071 PolarHBondContact O-N 3.29Å; L1069-I1072 HydrophobicContact CD2-CD1 3.9Å; L1069-I1072 VanDerWaalsContact O-CG1 3.31Å; L1069-I1072 WeakPolarHBondContact O-CG1 3.05Å; L1069-I1072 PolarHBondContact O-N 2.99Å; L1069-E1073 WeakPolarHBondContact O-CB 3.43Å; L1069-E1073 VanDerWaalsContact O-CG 3.29Å; L1069-E1073 WeakPolarHBondContact O-CG 3.25Å; L1069-E1073 PolarHBondContact O-N 2.91Å
1070	Y	88.4	Confident	75.6	Confident	139 Å²	139	74.2 Å²	74.2	55%	0.545	40%	0.397	S	S	.	.	H	α-helix	trans	-58.3	-44.1	176.1	-172.3	-89.7	0	0	0	111.9	L1043 S1066 L1068 S1074	L1043-Y1070 HydrophobicContact CD1-CD1 3.7Å; L1043-Y1070 HydrophobicContact CD1-CE1 3.71Å; L1043-Y1070 HydrophobicContact CD2-CD1 3.69Å; L1043-Y1070 HydrophobicContact CD2-CE1 4.41Å; L1043-Y1070 HydrophobicContact CD2-CG 4.5Å; L1043-Y1070 HydrophobicContact CG-CD1 4.37Å; S1066-Y1070 VanDerWaalsContact O-CB 3.25Å; S1066-Y1070 WeakPolarHBondContact O-CB 3.35Å; S1066-Y1070 PolarHBondContact O-N 2.83Å; L1068-Y1070 VanDerWaalsContact C-N 3.34Å; L1068-Y1070 PolarHBondContact O-N 3.2Å; Y1070-S1074 WeakPolarHBondContact CE1-OG 3.23Å; Y1070-S1074 WeakPolarHBondContact O-CB 3.49Å; Y1070-S1074 PolarHBondContact O-N 3.5Å; Y1070-S1074 PolarHBondContact O-OG 3.31Å
1071	A	86.4	Confident	72.7	Confident	7 Å²	7	75.2 Å²	75.2	6%	0.058	41%	0.411	C	S	.	.	H	α-helix	trans	-64.7	-44.6	178.9	0	0	0	0	0	113	F1012 P1044 K1067 L1068 L1069 E1073	F1012-A1071 HydrophobicContact CZ-CB 4.13Å; P1044-A1071 HydrophobicContact CB-CB 4.25Å; P1044-A1071 HydrophobicContact CG-CB 4.38Å; K1067-A1071 WeakPolarHBondContact O-CB 3.46Å; K1067-A1071 PolarHBondContact O-N 3.31Å; L1068-A1071 PolarHBondContact O-N 2.85Å; L1069-A1071 VanDerWaalsContact C-N 3.32Å; L1069-A1071 PolarHBondContact O-N 3.29Å; A1071-E1073 VanDerWaalsContact C-N 3.33Å; A1071-E1073 PolarHBondContact O-N 3.19Å
1072	I	88.1	Confident	71.9	Confident	9 Å²	9	74.5 Å²	74.5	5%	0.046	41%	0.41	C	S	.	.	H	α-helix	trans	-73.1	-25.3	-178.9	69.7	179.8	0	0	0	112.7	F1001 K1008 L1009 F1012 L1068 L1069	F1001-I1072 HydrophobicContact CE2-CD1 4.21Å; K1008-I1072 HydrophobicContact CB-CB 4.34Å; K1008-I1072 HydrophobicContact CB-CD1 3.99Å; K1008-I1072 HydrophobicContact CB-CG1 4.28Å; L1009-I1072 HydrophobicContact CB-CG2 4.37Å; L1009-I1072 HydrophobicContact CD1-CG2 3.98Å; F1012-I1072 HydrophobicContact CB-CB 4.29Å; F1012-I1072 HydrophobicContact CB-CG2 3.83Å; F1012-I1072 HydrophobicContact CD1-CG2 3.97Å; F1012-I1072 HydrophobicContact CG-CB 4.48Å; F1012-I1072 HydrophobicContact CG-CG2 3.86Å; L1068-I1072 WeakPolarHBondContact O-CG2 3.46Å; L1068-I1072 PolarHBondContact O-N 3.37Å; L1069-I1072 HydrophobicContact CD2-CD1 3.9Å; L1069-I1072 VanDerWaalsContact O-CG1 3.31Å; L1069-I1072 WeakPolarHBondContact O-CG1 3.05Å; L1069-I1072 PolarHBondContact O-N 2.99Å
1073	E	83.6	Confident	71	Confident	108 Å²	108	70.6 Å²	70.6	51%	0.505	40%	0.396	S	S	.	.	H	α-helix	trans	-85.2	-35.7	177.7	-69.4	-171.7	149.2	0	0	112.7	K1008 L1069 A1071 S1075	K1008-E1073 HydrophobicContact CD-CG 4.48Å; K1008-E1073 IonicContact NZ-OE1 3.77Å; K1008-E1073 PolarHBondContact NZ-OE1 3.3Å; L1069-E1073 WeakPolarHBondContact O-CB 3.43Å; L1069-E1073 VanDerWaalsContact O-CG 3.29Å; L1069-E1073 WeakPolarHBondContact O-CG 3.25Å; L1069-E1073 PolarHBondContact O-N 2.91Å; A1071-E1073 VanDerWaalsContact C-N 3.33Å; A1071-E1073 PolarHBondContact O-N 3.19Å; E1073-S1075 PolarHBondContact O-N 3.46Å; E1073-S1075 VanDerWaalsContact O-N 3.17Å; E1073-S1075 PolarHBondContact O-OG 3.23Å
1074	S	74.1	Confident	69.9	Low	55 Å²	55	71.3 Å²	71.3	39%	0.385	40%	0.401	S	S	.	.	H	α-helix	trans	-68.4	-15	-175.3	-61.5	0	0	0	0	114.2	Y1070 A1076	Y1070-S1074 WeakPolarHBondContact CE1-OG 3.23Å; Y1070-S1074 WeakPolarHBondContact O-CB 3.49Å; Y1070-S1074 PolarHBondContact O-N 3.5Å; Y1070-S1074 PolarHBondContact O-OG 3.31Å; S1074-A1076 PolarHBondContact O-N 2.95Å
1075	S	56.2	Low	68.7	Low	100 Å²	100	75.5 Å²	75.5	70%	0.699	42%	0.424	S	S	*	.			trans	45.4	28.4	172.2	-56.2	0	0	0	0	115.4	E1073	E1073-S1075 PolarHBondContact O-N 3.46Å; E1073-S1075 VanDerWaalsContact O-N 3.17Å; E1073-S1075 PolarHBondContact O-OG 3.23Å
1076	A	47	Very low	67.2	Low	57 Å²	57	75.3 Å²	75.3	47%	0.471	43%	0.432	S	S	.	.			trans	-79.5	127.4	-176.4	0	0	0	0	0	109.6	S1074 L1080	S1074-A1076 PolarHBondContact O-N 2.95Å; A1076-L1080 HydrophobicContact CB-CD1 3.63Å
1077	G	49.1	Very low	65.7	Low	57 Å²	57	75.1 Å²	75.1	59%	0.588	43%	0.425	S	S	*	.			trans	-66.9	-175.2	179.1	0	0	0	0	0	113.6	E1079	G1077-E1079 PolarHBondContact O-N 2.8Å
1078	F	42.2	Very low	64	Low	91 Å²	91	77.7 Å²	77.7	40%	0.399	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-50.2	-8	-176.4	-93	-88.3	0	0	0	116.9	E773 L1080 S1081	E773-F1078 WeakPolarHBondContact OE2-CE2 3.4Å; F1078-L1080 PolarHBondContact O-N 3.05Å; F1078-S1081 PolarHBondContact O-OG 3.22Å
1079	E	37.9	Very low	62.1	Low	196 Å²	196	83.7 Å²	83.7	92%	0.916	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-72.4	-7.5	-175.5	-63.5	-172.9	163.3	0	0	114.8	G1077	G1077-E1079 PolarHBondContact O-N 2.8Å
1080	L	34.1	Very low	59.8	Low	140 Å²	140	88.4 Å²	88.4	73%	0.733	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-111.2	6.8	-178.8	-74.8	166.3	0	0	0	114.7	A1076 F1078	A1076-L1080 HydrophobicContact CB-CD1 3.63Å; F1078-L1080 PolarHBondContact O-N 3.05Å
1081	S	30.2	Very low	57.2	Low	102 Å²	102	83.8 Å²	83.8	71%	0.713	50%	0.501	S	S	*	.			trans	-87.4	0	-176.7	64.2	0	0	0	0	115	R1042 F1078	R1042-S1081 PolarHBondContact NH2-OXT 3.36Å; F1078-S1081 PolarHBondContact O-OG 3.22Å

Retrieved 1,081 of 1,081 residues in 350 ms (Link to these results)

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