A0A5K4FCC5_SCHMA Loading...

PH domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCC5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,100 aa.

						>A0A5K4FCC5_SCHMA|A0A5K4FCC5
MDDDELTQEILDQFDLICTQHQYNHVSAYSGENLNKHNLHSNKLSNCLSRSTSLDTKLGGCTQTSDFSPNDQTSTVGRHELERLKKEVSVLREELYMKLGELATIKESASRTKATDSDTISKLESHLKSERNDFQRKLSELNAQIAFREADYRLVCSELARMKEEVAFNKQVVNERSVEYSPASQILVSLTSPNPDPVSNHKLRTPVPRVPSTDFHLPAPVTPIPSKRYKVPPAGRMWDVDVTNNLNDKLKSNTTPQAIDKNVLLIDSDEITPSNASRKRQRCVVSPDTSPEHSMRQIPVSLADASVETTDLLHTTSRSHPLSYRIPSCAFSTTEPFNEFTKGNPEMLSELLDLSISIPRNDKSRSSIDNNPQTTLVTSSFARSEDSTWLLSDYYLTGLSKLLPRQSDILSGIQSSSDNYVSQLNLVVKRFSESVPYLIRRIEEQLKACIRVLLDPYNRYVKQPIKSCHYSDFQKVETEDIETAEKENEQPLSMDVSDDATSHEISYLGEDPFAGAPASQIVTSLTYPSQMKSISKQMVENSILMKGNKSCPSDIGYWFSTNPIVSDNKIINNNNNSADKTNSCPSLYHEIMISRSIQGINQLKYLATIINSYCPISFEMFDGINPDFTMDNDELLCIAKEFQNLIRTISGVLSRFINELIDVFFQMEEGKNPISSLSTTTLIQNELIGDSATNVTCSIDHSSFKQSQYTSSKRKSSISSFCIIVPLIVECLNLASVFAVFIKTDTNPLKNKVSDPAVNATNFSELNTCFPQLLNCIILTSEACFSQNDESTDITATTKNHCGSSLHTGITNFIKNRSVVTLKPLISFLRLWRQMIVQKHWPGGHCYDQWWDLDDQKFNSIISKDVRQQYIEELFGTSIKCGLLSLCSWVCQILNQFNDSTLLSNSLIYNNIEFNHSAEIQRINLLNEFSGMIAVLTQREDIIWPDNCYCKRQVYSTLVHLTTYPLQTLLTIPTSLLSSSSTYYQPTFTYNHILLIKQKYCLLAFGQLTRALIGLLWRHGDQSFQLYTDCLPDYFCLITNLSRWFQYSNRIQVIGSNNNSYQHESNKLNYSNNFILRPELIEELYDFESGLETPSNSNVF
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	65.4	Low	157 Å²	157	109.8 Å²	109.8	77%	0.773	56%	0.564	S	S	*	*				0	103.8	0	-82	172.2	53.5	0	0	105.8	E5 L6	M1-E5 WeakPolarHBondContact CA-OE2 3.46Å; M1-L6 HydrophobicContact CE-CB 4.19Å; M1-L6 HydrophobicContact CE-CD1 3.78Å
2	D	50.3	Low	66.5	Low	130 Å²	130	108.1 Å²	108.1	70%	0.695	56%	0.556	S	S	*	*			trans	-73.3	150.6	171.2	-67.2	-32.1	0	0	0	108.4	D4 E5 L6	D2-D4 PolarHBondContact O-N 3.35Å; D2-E5 WeakPolarHBondContact O-CB 3.4Å; D2-E5 PolarHBondContact O-N 3.03Å; D2-L6 PolarHBondContact O-N 3.41Å
3	D	65.3	Low	67.1	Low	132 Å²	132	108.9 Å²	108.9	71%	0.706	56%	0.556	S	S	*	*	H	α-helix	trans	-54.7	-26.8	-172.6	-74.7	-28.6	0	0	0	113.2	T7	D3-T7 WeakPolarHBondContact O-CB 3.36Å; D3-T7 PolarHBondContact O-N 3.27Å; D3-T7 PolarHBondContact O-OG1 3.31Å
4	D	60.7	Low	67.9	Low	136 Å²	136	110 Å²	110	73%	0.727	56%	0.555	S	S	*	*	H	α-helix	trans	-68.9	-34.5	177	-64.5	-31.4	0	0	0	112.6	D2 T7 Q8	D2-D4 PolarHBondContact O-N 3.35Å; D4-T7 PolarHBondContact O-N 2.88Å; D4-Q8 PolarHBondContact O-N 3.31Å
5	E	60.7	Low	68.5	Low	122 Å²	122	109.3 Å²	109.3	57%	0.57	55%	0.554	S	S	*	*	H	α-helix	trans	-71.5	-40.4	179.3	-159.2	175.1	-150.8	0	0	110.7	M1 D2 Q8 E9	M1-E5 WeakPolarHBondContact CA-OE2 3.46Å; D2-E5 WeakPolarHBondContact O-CB 3.4Å; D2-E5 PolarHBondContact O-N 3.03Å; E5-Q8 PolarHBondContact O-N 3.45Å; E5-E9 WeakPolarHBondContact O-CB 3.47Å; E5-E9 PolarHBondContact O-N 3.21Å
6	L	72.3	Confident	69.2	Low	75 Å²	75	109.2 Å²	109.2	39%	0.393	55%	0.554	S	S	.	*	H	α-helix	trans	-66	-38.5	173.3	-176.7	68.3	0	0	0	111.6	M1 D2 E9 I10	M1-L6 HydrophobicContact CE-CB 4.19Å; M1-L6 HydrophobicContact CE-CD1 3.78Å; D2-L6 PolarHBondContact O-N 3.41Å; L6-E9 PolarHBondContact O-N 3.14Å; L6-I10 HydrophobicContact CG-CD1 4.07Å; L6-I10 VanDerWaalsContact O-CG1 3.25Å; L6-I10 WeakPolarHBondContact O-CG1 3.39Å; L6-I10 PolarHBondContact O-N 3.27Å
7	T	71.9	Confident	69.5	Low	76 Å²	76	108.5 Å²	108.5	47%	0.466	55%	0.551	S	S	.	*	H	α-helix	trans	-65.9	-41.2	178.3	-52.4	0	0	0	0	111	D3 D4 I10 L11	D3-T7 WeakPolarHBondContact O-CB 3.36Å; D3-T7 PolarHBondContact O-N 3.27Å; D3-T7 PolarHBondContact O-OG1 3.31Å; D4-T7 PolarHBondContact O-N 2.88Å; T7-I10 PolarHBondContact O-N 3.12Å; T7-L11 HydrophobicContact CG2-CD1 4.43Å; T7-L11 WeakPolarHBondContact O-CG 3.47Å; T7-L11 PolarHBondContact O-N 3.49Å
8	Q	71.7	Confident	69.5	Low	92 Å²	92	105.4 Å²	105.4	43%	0.43	54%	0.54	S	S	.	.	H	α-helix	trans	-66.5	-40.4	175.8	-167.1	62.6	45.7	0	0	111.6	D4 E5 I10 L11 D12	D4-Q8 PolarHBondContact O-N 3.31Å; E5-Q8 PolarHBondContact O-N 3.45Å; Q8-I10 VanDerWaalsContact C-N 3.34Å; Q8-I10 PolarHBondContact O-N 3.1Å; Q8-L11 PolarHBondContact O-N 3.04Å; Q8-D12 PolarHBondContact NE2-OD1 2.98Å; Q8-D12 WeakPolarHBondContact O-CB 3.45Å; Q8-D12 PolarHBondContact O-N 3.02Å
9	E	75.6	Confident	69.7	Low	103 Å²	103	103.7 Å²	103.7	48%	0.481	54%	0.535	S	S	.	.	H	α-helix	trans	-65	-36.4	177	-165.6	173.6	-157.6	0	0	112.5	E5 L6 Q13	E5-E9 WeakPolarHBondContact O-CB 3.47Å; E5-E9 PolarHBondContact O-N 3.21Å; L6-E9 PolarHBondContact O-N 3.14Å; E9-Q13 WeakPolarHBondContact O-CB 3.48Å; E9-Q13 PolarHBondContact O-N 3.21Å
10	I	74.6	Confident	69.5	Low	97 Å²	97	104.1 Å²	104.1	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-66.5	-43	173	-69.1	166.5	0	0	0	111	L6 T7 Q8 Q13 F14	L6-I10 HydrophobicContact CG-CD1 4.07Å; L6-I10 VanDerWaalsContact O-CG1 3.25Å; L6-I10 WeakPolarHBondContact O-CG1 3.39Å; L6-I10 PolarHBondContact O-N 3.27Å; T7-I10 PolarHBondContact O-N 3.12Å; Q8-I10 VanDerWaalsContact C-N 3.34Å; Q8-I10 PolarHBondContact O-N 3.1Å; I10-Q13 PolarHBondContact O-N 3.24Å; I10-F14 WeakPolarHBondContact O-CB 3.44Å; I10-F14 PolarHBondContact O-N 3.15Å
11	L	75.7	Confident	69.1	Low	88 Å²	88	104.5 Å²	104.5	46%	0.461	53%	0.534	S	S	.	.	H	α-helix	trans	-64.8	-42.1	176.7	-74.9	169.5	0	0	0	111.4	T7 Q8 Q13 F14 D15	T7-L11 HydrophobicContact CG2-CD1 4.43Å; T7-L11 WeakPolarHBondContact O-CG 3.47Å; T7-L11 PolarHBondContact O-N 3.49Å; Q8-L11 PolarHBondContact O-N 3.04Å; L11-Q13 PolarHBondContact O-N 3.43Å; L11-F14 PolarHBondContact O-N 3.16Å; L11-D15 PolarHBondContact O-N 3.04Å
12	D	78.8	Confident	69.9	Low	89 Å²	89	103.5 Å²	103.5	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-65.2	-38.4	176.7	-69.1	-3.7	0	0	0	111.2	Q8 L16	Q8-D12 PolarHBondContact NE2-OD1 2.98Å; Q8-D12 WeakPolarHBondContact O-CB 3.45Å; Q8-D12 PolarHBondContact O-N 3.02Å; D12-L16 VanDerWaalsContact O-CB 3.3Å; D12-L16 WeakPolarHBondContact O-CB 3.46Å; D12-L16 PolarHBondContact O-N 2.88Å
13	Q	74.6	Confident	70.2	Confident	119 Å²	119	105.7 Å²	105.7	56%	0.556	53%	0.527	S	S	*	.	H	α-helix	trans	-65.2	-40.3	171.2	-89	-170.9	-1.1	0	0	112.2	E9 I10 L11 L16 I17	E9-Q13 WeakPolarHBondContact O-CB 3.48Å; E9-Q13 PolarHBondContact O-N 3.21Å; I10-Q13 PolarHBondContact O-N 3.24Å; L11-Q13 PolarHBondContact O-N 3.43Å; Q13-L16 PolarHBondContact O-N 3.45Å; Q13-I17 WeakPolarHBondContact O-CB 3.35Å; Q13-I17 VanDerWaalsContact O-CG1 3.23Å; Q13-I17 WeakPolarHBondContact O-CG1 3.39Å; Q13-I17 PolarHBondContact O-N 2.78Å
14	F	77.2	Confident	69.6	Low	124 Å²	124	104 Å²	104	54%	0.544	52%	0.519	S	S	.	.	H	α-helix	trans	-66.8	-43.4	178.8	-172.1	-96.6	0	0	0	111.3	I10 L11 L16 I17 C18	I10-F14 WeakPolarHBondContact O-CB 3.44Å; I10-F14 PolarHBondContact O-N 3.15Å; L11-F14 PolarHBondContact O-N 3.16Å; F14-L16 VanDerWaalsContact C-N 3.34Å; F14-I17 PolarHBondContact O-N 2.93Å; F14-C18 WeakPolarHBondContact CE1-SG 3.45Å; F14-C18 WeakPolarHBondContact O-CB 3.49Å; F14-C18 PolarHBondContact O-N 3.03Å; F14-C18 PolarHBondContact O-SG 3.12Å
15	D	77.7	Confident	69	Low	99 Å²	99	102.6 Å²	102.6	53%	0.529	51%	0.507	S	S	.	.	H	α-helix	trans	-63.6	-39.7	173.6	-85.4	-8.6	0	0	0	111	L11 C18 T19	L11-D15 PolarHBondContact O-N 3.04Å; D15-C18 PolarHBondContact O-N 3.26Å; D15-T19 WeakPolarHBondContact O-CB 3.24Å; D15-T19 PolarHBondContact O-N 3.44Å; D15-T19 PolarHBondContact O-OG1 2.75Å
16	L	80.2	Confident	68.4	Low	108 Å²	108	101.3 Å²	101.3	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-61.3	-45.7	173.8	-173.2	69.7	0	0	0	111.5	D12 Q13 F14 T19 Q20	D12-L16 VanDerWaalsContact O-CB 3.3Å; D12-L16 WeakPolarHBondContact O-CB 3.46Å; D12-L16 PolarHBondContact O-N 2.88Å; Q13-L16 PolarHBondContact O-N 3.45Å; F14-L16 VanDerWaalsContact C-N 3.34Å; L16-T19 PolarHBondContact O-N 2.95Å; L16-Q20 WeakPolarHBondContact O-CB 3.33Å; L16-Q20 PolarHBondContact O-N 2.73Å
17	I	74.2	Confident	67.1	Low	98 Å²	98	100.9 Å²	100.9	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-62	-45.6	176.4	-69.9	164.3	0	0	0	110.1	Q13 F14 Q20 H21	Q13-I17 WeakPolarHBondContact O-CB 3.35Å; Q13-I17 VanDerWaalsContact O-CG1 3.23Å; Q13-I17 WeakPolarHBondContact O-CG1 3.39Å; Q13-I17 PolarHBondContact O-N 2.78Å; F14-I17 PolarHBondContact O-N 2.93Å; I17-Q20 PolarHBondContact O-N 3.09Å; I17-H21 VanDerWaalsContact O-CB 3.29Å; I17-H21 WeakPolarHBondContact O-CB 3.41Å; I17-H21 PolarHBondContact O-N 3.16Å
18	C	69.5	Low	65.8	Low	52 Å²	52	100.9 Å²	100.9	35%	0.351	52%	0.518	S	S	.	.	H	α-helix	trans	-62.8	-45.6	178.6	-70.1	0	0	0	0	111.2	F14 D15 Q20 H21 Q22	F14-C18 WeakPolarHBondContact CE1-SG 3.45Å; F14-C18 WeakPolarHBondContact O-CB 3.49Å; F14-C18 PolarHBondContact O-N 3.03Å; F14-C18 PolarHBondContact O-SG 3.12Å; D15-C18 PolarHBondContact O-N 3.26Å; C18-Q20 VanDerWaalsContact C-N 3.31Å; C18-Q20 PolarHBondContact O-N 2.75Å; C18-H21 PolarHBondContact O-N 3.4Å; C18-Q22 VanDerWaalsContact O-CB 3.3Å; C18-Q22 WeakPolarHBondContact O-CB 3.47Å; C18-Q22 PolarHBondContact O-N 3.21Å
19	T	72	Confident	64.4	Low	73 Å²	73	104.2 Å²	104.2	45%	0.448	53%	0.528	S	S	.	.	H	α-helix	trans	-63.6	-39.2	177.9	-44.5	0	0	0	0	110.8	D15 L16 Q22 Y23	D15-T19 WeakPolarHBondContact O-CB 3.24Å; D15-T19 PolarHBondContact O-N 3.44Å; D15-T19 PolarHBondContact O-OG1 2.75Å; L16-T19 PolarHBondContact O-N 2.95Å; T19-Q22 PolarHBondContact O-N 3.41Å; T19-Y23 WeakPolarHBondContact O-CB 3.46Å; T19-Y23 PolarHBondContact O-N 3.1Å
20	Q	67.4	Low	62.3	Low	112 Å²	112	103.1 Å²	103.1	52%	0.523	53%	0.532	S	S	.	.	H	α-helix	trans	-72.4	-37.2	178.1	-164.2	160.9	10.7	0	0	112	L16 I17 C18 Q22 Y23 N24	L16-Q20 WeakPolarHBondContact O-CB 3.33Å; L16-Q20 PolarHBondContact O-N 2.73Å; I17-Q20 PolarHBondContact O-N 3.09Å; C18-Q20 VanDerWaalsContact C-N 3.31Å; C18-Q20 PolarHBondContact O-N 2.75Å; Q20-Q22 VanDerWaalsContact C-N 3.31Å; Q20-Y23 PolarHBondContact O-N 2.92Å; Q20-N24 VanDerWaalsContact O-CB 3.29Å; Q20-N24 WeakPolarHBondContact O-CB 3.29Å; Q20-N24 PolarHBondContact O-N 3.17Å; Q20-N24 PolarHBondContact O-ND2 3.36Å
21	H	59.6	Low	60.2	Low	112 Å²	112	102.1 Å²	102.1	52%	0.519	55%	0.546	S	S	.	.	H	α-helix	trans	-63.8	-40.1	171.3	-145.1	-81.9	0	0	0	110.5	I17 C18 N24 H25	I17-H21 VanDerWaalsContact O-CB 3.29Å; I17-H21 WeakPolarHBondContact O-CB 3.41Å; I17-H21 PolarHBondContact O-N 3.16Å; C18-H21 PolarHBondContact O-N 3.4Å; H21-N24 PolarHBondContact O-N 3.29Å; H21-H25 AromaticContact CE1-CD2 3.63Å; H21-H25 AromaticContact CE1-NE2 3.23Å; H21-H25 PolarHBondContact CE1-NE2 3.07Å; H21-H25 AromaticContact ND1-CD2 3.24Å; H21-H25 PolarHBondContact ND1-CD2 3.03Å; H21-H25 AromaticContact ND1-NE2 3.37Å; H21-H25 PolarHBondContact ND1-NE2 2.7Å; H21-H25 PolarHBondContact O-CD2 3.13Å; H21-H25 VanDerWaalsContact O-CD2 3.24Å; H21-H25 PolarHBondContact O-N 3.27Å
22	Q	58.7	Low	58.1	Low	137 Å²	137	106.4 Å²	106.4	64%	0.64	56%	0.563	S	S	*	*	H	α-helix	trans	-67.2	-41.9	176.1	-147.8	169	19.5	0	0	111.4	C18 T19 Q20 H25 V26	C18-Q22 VanDerWaalsContact O-CB 3.3Å; C18-Q22 WeakPolarHBondContact O-CB 3.47Å; C18-Q22 PolarHBondContact O-N 3.21Å; T19-Q22 PolarHBondContact O-N 3.41Å; Q20-Q22 VanDerWaalsContact C-N 3.31Å; Q22-H25 PolarHBondContact O-N 3.44Å; Q22-V26 WeakPolarHBondContact O-CB 3.05Å; Q22-V26 VanDerWaalsContact O-CG2 3.24Å; Q22-V26 WeakPolarHBondContact O-CG2 3.09Å; Q22-V26 PolarHBondContact O-N 3.11Å
23	Y	56.5	Low	55.8	Low	175 Å²	175	109.9 Å²	109.9	69%	0.686	58%	0.582	S	S	*	*	H	α-helix	trans	-65.7	-38.2	174.3	-122.7	-83.1	0	0	0	112.4	T19 Q20 V26 S27	T19-Y23 WeakPolarHBondContact O-CB 3.46Å; T19-Y23 PolarHBondContact O-N 3.1Å; Q20-Y23 PolarHBondContact O-N 2.92Å; Y23-V26 PolarHBondContact O-N 3.49Å; Y23-S27 VanDerWaalsContact O-CB 3.3Å; Y23-S27 WeakPolarHBondContact O-CB 3.08Å; Y23-S27 PolarHBondContact O-N 3.07Å; Y23-S27 PolarHBondContact O-OG 3.2Å
24	N	51.3	Low	53.7	Low	98 Å²	98	112.6 Å²	112.6	52%	0.524	60%	0.599	S	S	.	*	H	α-helix	trans	-67.4	-38.9	176.3	-73.6	-18	0	0	0	111.3	Q20 H21 S27 A28	Q20-N24 VanDerWaalsContact O-CB 3.29Å; Q20-N24 WeakPolarHBondContact O-CB 3.29Å; Q20-N24 PolarHBondContact O-N 3.17Å; Q20-N24 PolarHBondContact O-ND2 3.36Å; H21-N24 PolarHBondContact O-N 3.29Å; N24-S27 PolarHBondContact O-OG 3.41Å; N24-A28 WeakPolarHBondContact O-CB 3.31Å; N24-A28 PolarHBondContact O-N 2.95Å
25	H	48.3	Very low	51.4	Low	106 Å²	106	114.3 Å²	114.3	49%	0.491	61%	0.614	S	S	.	*	H	α-helix	trans	-71.3	-38.8	173.6	-83.9	-70.1	0	0	0	112.6	H21 Q22 A28 Y29	H21-H25 AromaticContact CE1-CD2 3.63Å; H21-H25 AromaticContact CE1-NE2 3.23Å; H21-H25 PolarHBondContact CE1-NE2 3.07Å; H21-H25 AromaticContact ND1-CD2 3.24Å; H21-H25 PolarHBondContact ND1-CD2 3.03Å; H21-H25 AromaticContact ND1-NE2 3.37Å; H21-H25 PolarHBondContact ND1-NE2 2.7Å; H21-H25 PolarHBondContact O-CD2 3.13Å; H21-H25 VanDerWaalsContact O-CD2 3.24Å; H21-H25 PolarHBondContact O-N 3.27Å; Q22-H25 PolarHBondContact O-N 3.44Å; H25-A28 PolarHBondContact O-N 3.34Å; H25-Y29 VanDerWaalsContact O-CD2 3.26Å; H25-Y29 WeakPolarHBondContact O-CD2 3.02Å
26	V	47.8	Very low	49.2	Very low	95 Å²	95	118.9 Å²	118.9	58%	0.576	63%	0.629	S	S	*	*	H	α-helix	trans	-70.1	-37.3	178	174.5	0	0	0	0	111.6	Q22 Y23 A28 Y29 S30	Q22-V26 WeakPolarHBondContact O-CB 3.05Å; Q22-V26 VanDerWaalsContact O-CG2 3.24Å; Q22-V26 WeakPolarHBondContact O-CG2 3.09Å; Q22-V26 PolarHBondContact O-N 3.11Å; Y23-V26 PolarHBondContact O-N 3.49Å; V26-A28 VanDerWaalsContact C-N 3.34Å; V26-A28 PolarHBondContact O-N 3Å; V26-Y29 PolarHBondContact O-N 3.18Å; V26-S30 PolarHBondContact O-N 2.9Å
27	S	45.7	Very low	46.7	Very low	66 Å²	66	121.8 Å²	121.8	46%	0.462	64%	0.639	S	S	.	*	H	α-helix	trans	-71.7	-26	177.4	60.1	0	0	0	0	113.7	Y23 N24 Y29	Y23-S27 VanDerWaalsContact O-CB 3.3Å; Y23-S27 WeakPolarHBondContact O-CB 3.08Å; Y23-S27 PolarHBondContact O-N 3.07Å; Y23-S27 PolarHBondContact O-OG 3.2Å; N24-S27 PolarHBondContact O-OG 3.41Å; S27-Y29 PolarHBondContact O-N 3.35Å
28	A	44.1	Very low	44.5	Very low	75 Å²	75	123.7 Å²	123.7	62%	0.62	65%	0.65	S	S	*	*	H	α-helix	trans	-66.3	-19.4	171.6	0	0	0	0	0	113	N24 H25 V26	N24-A28 WeakPolarHBondContact O-CB 3.31Å; N24-A28 PolarHBondContact O-N 2.95Å; H25-A28 PolarHBondContact O-N 3.34Å; V26-A28 VanDerWaalsContact C-N 3.34Å; V26-A28 PolarHBondContact O-N 3Å
29	Y	42.8	Very low	42.5	Very low	163 Å²	163	128.3 Å²	128.3	64%	0.639	67%	0.671	S	S	*	*	H	α-helix	trans	-107.9	-6	-178.7	-75.4	-72.9	0	0	0	115	H25 V26 S27 E504	H25-Y29 VanDerWaalsContact O-CD2 3.26Å; H25-Y29 WeakPolarHBondContact O-CD2 3.02Å; V26-Y29 PolarHBondContact O-N 3.18Å; S27-Y29 PolarHBondContact O-N 3.35Å; Y29-E504 WeakPolarHBondContact CE1-OE1 3.33Å; Y29-E504 PolarHBondContact OH-OE1 3.41Å
30	S	32.7	Very low	40.4	Very low	80 Å²	80	132.9 Å²	132.9	56%	0.559	69%	0.687	S	S	*	*			trans	-111.2	73.3	172.9	72.2	0	0	0	0	110.9	V26 E32	V26-S30 PolarHBondContact O-N 2.9Å; S30-E32 PolarHBondContact O-N 3.24Å; S30-E32 VanDerWaalsContact O-N 3.09Å
31	G	29.5	Very low	38.4	Very low	76 Å²	76	131.2 Å²	131.2	78%	0.784	69%	0.688	S	S	*	*			trans	-71.1	93.7	163.1	0	0	0	0	0	109.9
32	E	31.9	Very low	36.9	Very low	178 Å²	178	132.8 Å²	132.8	83%	0.832	70%	0.7	S	S	*	*	S	Bend	trans	-175.7	110.2	146	-105.2	174	-174.2	0	0	111.2	S30	S30-E32 PolarHBondContact O-N 3.24Å; S30-E32 VanDerWaalsContact O-N 3.09Å
33	N	29.6	Very low	35.4	Very low	161 Å²	161	135.1 Å²	135.1	86%	0.861	71%	0.708	S	S	*	*			trans	28.5	96	157.8	-68.2	-27.2	0	0	0	119.3
34	L	31.3	Very low	33.9	Very low	177 Å²	177	133.6 Å²	133.6	93%	0.927	71%	0.711	S	S	*	*			trans	-130.8	126.3	147.7	-112.7	105.1	0	0	0	112
35	N	29.1	Very low	32.6	Very low	159 Å²	159	133.3 Å²	133.3	85%	0.85	72%	0.717	S	S	*	*			trans	-60.7	142.5	-171.1	-75.6	-50	0	0	0	114.3	H37	N35-H37 PolarHBondContact O-N 3.32Å
36	K	30.4	Very low	31.7	Very low	195 Å²	195	135.7 Å²	135.7	85%	0.848	73%	0.733	S	S	*	*			trans	-37.7	127.9	149.9	-81.8	172.4	170.7	172	0	110.7
37	H	27.8	Very low	30.7	Very low	170 Å²	170	136.9 Å²	136.9	79%	0.787	74%	0.744	S	S	*	*			trans	-170.3	132.1	133.5	-103.9	-70.3	0	0	0	112.9	N35	N35-H37 PolarHBondContact O-N 3.32Å
38	N	29.2	Very low	29.7	Very low	137 Å²	137	141.9 Å²	141.9	73%	0.733	77%	0.765	S	S	*	*			trans	81.9	100.2	148.4	-62	-10.2	0	0	0	121.5
39	L	27.3	Very low	28.9	Very low	150 Å²	150	143 Å²	143	79%	0.785	77%	0.768	S	S	*	*				-16.8	135.8	128.9	-78.5	95.3	0	0	0	115.2
40	H	26.7	Very low	28	Very low	168 Å²	168	147 Å²	147	78%	0.778	78%	0.782	S	S	*	*				-178.7	138.1	99.9	-116.9	-68	0	0	0	112.9
41	S	27.1	Very low	27.7	Very low	78 Å²	78	148.8 Å²	148.8	55%	0.545	79%	0.794	S	S	.	*			trans	-37.7	139.8	158.2	56.6	0	0	0	0	114.8
42	N	27.7	Very low	27.6	Very low	144 Å²	144	151.3 Å²	151.3	77%	0.77	80%	0.795	S	S	*	*				174.8	116.4	121.7	-86.9	-23.6	0	0	0	112.4
43	K	26	Very low	27.4	Very low	186 Å²	186	148 Å²	148	81%	0.809	79%	0.791	S	S	*	*				39	128.2	127.8	-106.4	-179.3	178.4	177	0	119.7
44	L	26.7	Very low	27.3	Very low	144 Å²	144	148.3 Å²	148.3	75%	0.754	79%	0.792	S	S	*	*			trans	114.6	105.6	133.2	-73.3	154.7	0	0	0	118
45	S	24.2	Very low	26.9	Very low	92 Å²	92	146.8 Å²	146.8	64%	0.643	79%	0.785	S	S	*	*				67.6	121.4	122.2	70.3	0	0	0	0	120.4
46	N	27.6	Very low	26.9	Very low	155 Å²	155	144.7 Å²	144.7	83%	0.829	78%	0.778	S	S	*	*			trans	53.7	90	140.9	-68.2	-3.8	0	0	0	117.6
47	C	27	Very low	26.7	Very low	120 Å²	120	145 Å²	145	81%	0.811	78%	0.779	S	S	*	*			trans	-159.4	69.4	147.5	-93.6	0	0	0	0	110.2	S49	C47-S49 PolarHBondContact O-N 3.16Å
48	L	25.4	Very low	26.7	Very low	172 Å²	172	145 Å²	145	90%	0.901	78%	0.784	S	S	*	*			trans	-75.5	74.2	160.7	-77.5	169.9	0	0	0	108.9	R50	L48-R50 PolarHBondContact O-N 3.24Å
49	S	27.6	Very low	26.5	Very low	98 Å²	98	142.1 Å²	142.1	69%	0.685	79%	0.787	S	S	*	*			trans	-86.9	100.1	163.8	-68	0	0	0	0	107.8	C47 S51	C47-S49 PolarHBondContact O-N 3.16Å; S49-S51 PolarHBondContact O-N 3.09Å
50	R	23.8	Very low	26.2	Very low	247 Å²	247	138.7 Å²	138.7	93%	0.932	79%	0.787	S	S	*	*			trans	-39.4	93.6	172.6	-160.2	175.4	168.6	-168	-4.2	111.8	L48 T52	L48-R50 PolarHBondContact O-N 3.24Å; R50-T52 PolarHBondContact O-N 2.68Å
51	S	26.9	Very low	26.1	Very low	117 Å²	117	136.7 Å²	136.7	82%	0.818	79%	0.791	S	S	*	*			trans	-82.1	111.7	178.4	22	0	0	0	0	110.3	S49	S49-S51 PolarHBondContact O-N 3.09Å
52	T	27.7	Very low	26.1	Very low	129 Å²	129	139.3 Å²	139.3	79%	0.791	80%	0.804	S	S	*	*			trans	-59.6	140.4	170.9	45.4	0	0	0	0	112.2	R50	R50-T52 PolarHBondContact O-N 2.68Å
53	S	26.9	Very low	26.2	Very low	108 Å²	108	141.3 Å²	141.3	76%	0.755	81%	0.808	S	S	*	*			trans	-17.2	121.3	171.8	57.7	0	0	0	0	118	D55	S53-D55 PolarHBondContact O-N 3.4Å
54	L	26.4	Very low	26.2	Very low	168 Å²	168	139 Å²	139	88%	0.88	81%	0.81	S	S	*	*			trans	-6.1	106.4	141.9	-70.8	154.8	0	0	0	115.4
55	D	24.1	Very low	26.3	Very low	146 Å²	146	136.7 Å²	136.7	78%	0.781	81%	0.806	S	S	*	*			trans	-131.1	81.1	166.8	-151.7	2.7	0	0	0	107.5	S53	S53-D55 PolarHBondContact O-N 3.4Å
56	T	28.2	Very low	26.5	Very low	114 Å²	114	139.7 Å²	139.7	70%	0.699	82%	0.815	S	S	*	*			trans	-128.4	94.8	170	39	0	0	0	0	110.3	L58	T56-L58 PolarHBondContact O-N 2.89Å
57	K	25.9	Very low	26.7	Very low	203 Å²	203	142.3 Å²	142.3	88%	0.883	82%	0.819	S	S	*	*			trans	-42.5	103.4	160.4	-66.2	173.6	178	174.7	0	111.3
58	L	28.7	Very low	26.9	Very low	170 Å²	170	142.1 Å²	142.1	89%	0.89	82%	0.819	S	S	*	*			trans	-107.8	81.3	159.5	-92.6	146.7	0	0	0	107.6	T56	T56-L58 PolarHBondContact O-N 2.89Å
59	G	24	Very low	27.8	Very low	76 Å²	76	139.5 Å²	139.5	78%	0.784	81%	0.813	S	S	*	*			trans	-79.3	121.8	174.3	0	0	0	0	0	111.5
60	G	22.6	Very low	28	Very low	77 Å²	77	141.9 Å²	141.9	79%	0.794	82%	0.818	S	S	*	*			trans	64.8	98.9	134.3	0	0	0	0	0	118.8
61	C	24.7	Very low	28.5	Very low	126 Å²	126	135.7 Å²	135.7	85%	0.851	80%	0.803	S	S	*	*			trans	-140.5	94.2	144.1	-147.4	0	0	0	0	109.6
62	T	26.4	Very low	29.3	Very low	133 Å²	133	138.4 Å²	138.4	82%	0.816	80%	0.803	S	S	*	*			trans	-67.3	118.1	164.7	33	0	0	0	0	110.1
63	Q	29.7	Very low	29.9	Very low	186 Å²	186	138.6 Å²	138.6	87%	0.869	80%	0.804	S	S	*	*			trans	-141.9	105.2	145.6	-71.9	-165.2	8.7	0	0	109.6
64	T	26.2	Very low	31.2	Very low	137 Å²	137	138.1 Å²	138.1	84%	0.84	80%	0.801	S	S	*	*			trans	-75.3	127.9	162.9	45	0	0	0	0	109.5
65	S	28.7	Very low	32.5	Very low	97 Å²	97	135 Å²	135	68%	0.678	79%	0.789	S	S	*	*			trans	-153.4	104.8	154.1	61.8	0	0	0	0	110.8
66	D	29.2	Very low	33.9	Very low	155 Å²	155	133 Å²	133	83%	0.829	78%	0.782	S	S	*	*			trans	40	96.4	140.4	-56.1	-23.9	0	0	0	119.4
67	F	31.9	Very low	35.5	Very low	209 Å²	209	129.7 Å²	129.7	92%	0.917	77%	0.77	S	S	*	*			trans	-124.5	121.6	143.2	-82.2	-81.5	0	0	0	109.4
68	S	30.8	Very low	37.7	Very low	116 Å²	116	129 Å²	129	81%	0.811	76%	0.762	S	S	*	*			trans	-68.6	139.5	-172.7	-154.6	0	0	0	0	111.9
69	P	42.7	Very low	40	Very low	117 Å²	117	128.3 Å²	128.3	76%	0.76	75%	0.754	S	S	*	*			trans	-89.2	123.2	-173.7	33.9	-29	0	0	0	110.7
70	N	31.8	Very low	42.6	Very low	149 Å²	149	131.2 Å²	131.2	80%	0.797	75%	0.747	S	S	*	*			trans	-125.1	111.5	169.3	-117.9	17.6	0	0	0	111
71	D	34.3	Very low	45.4	Very low	116 Å²	116	132.7 Å²	132.7	62%	0.62	74%	0.736	S	S	*	*			trans	57.3	104	139.2	-68.2	-30.5	0	0	0	123.2	T73	D71-T73 PolarHBondContact O-N 2.83Å
72	Q	44.1	Very low	48.1	Very low	175 Å²	175	131 Å²	131	82%	0.818	72%	0.716	S	S	*	*	S	Bend		73.5	23.5	118.8	-70.3	-172.3	27.4	0	0	122.5
73	T	41.9	Very low	50.9	Low	132 Å²	132	133.5 Å²	133.5	81%	0.81	71%	0.71	S	S	*	*			trans	-117	1.6	166	41.3	0	0	0	0	116.1	D71	D71-T73 PolarHBondContact O-N 2.83Å
74	S	53	Low	53.5	Low	98 Å²	98	129.3 Å²	129.3	69%	0.685	69%	0.693	S	S	*	*			trans	-89.5	-2.3	-171.8	65.2	0	0	0	0	117
75	T	54.2	Low	56.5	Low	104 Å²	104	129 Å²	129	64%	0.638	68%	0.68	S	S	*	*	H	α-helix	trans	-78.8	-29.4	-175.4	46.4	0	0	0	0	113.9
76	V	52.1	Low	59.3	Low	103 Å²	103	131.3 Å²	131.3	62%	0.624	68%	0.678	S	S	*	*	H	α-helix	trans	-73.8	-43.7	-178.1	-179.1	0	0	0	0	111.4	R78 H79	V76-R78 VanDerWaalsContact C-N 3.3Å; V76-R78 PolarHBondContact O-N 2.96Å; V76-H79 PolarHBondContact O-N 3.17Å
77	G	62.8	Low	62.2	Low	44 Å²	44	128.9 Å²	128.9	45%	0.454	66%	0.662	S	S	.	*	H	α-helix	trans	-66	-27.7	179.6	0	0	0	0	0	114.2	H79 E80 L81	G77-H79 PolarHBondContact O-N 3.44Å; G77-E80 PolarHBondContact O-N 3.03Å; G77-L81 WeakPolarHBondContact O-CB 3.47Å; G77-L81 PolarHBondContact O-N 3.03Å
78	R	72.4	Confident	64.8	Low	188 Å²	188	123.1 Å²	123.1	71%	0.709	64%	0.643	S	S	*	*	H	α-helix	trans	-68.6	-34.9	178.7	-164	175.8	-171.8	168.9	3.5	112.4	V76 E82	V76-R78 VanDerWaalsContact C-N 3.3Å; V76-R78 PolarHBondContact O-N 2.96Å; R78-E82 WeakPolarHBondContact O-CG 3.38Å; R78-E82 PolarHBondContact O-N 3.39Å; R78-E82 VanDerWaalsContact O-N 3.16Å
79	H	76.2	Confident	67.5	Low	156 Å²	156	121 Å²	121	72%	0.722	63%	0.628	S	S	*	*	H	α-helix	trans	-71.4	-37.4	177.1	-92.1	-69.7	0	0	0	112.5	V76 G77 R83	V76-H79 PolarHBondContact O-N 3.17Å; G77-H79 PolarHBondContact O-N 3.44Å; H79-R83 WeakPolarHBondContact O-CB 3.45Å; H79-R83 PolarHBondContact O-N 2.75Å
80	E	78.6	Confident	69.8	Low	137 Å²	137	119.5 Å²	119.5	64%	0.64	62%	0.617	S	S	*	*	H	α-helix	trans	-68.4	-42.4	175.7	-71	-173.9	160	0	0	111.9	G77 E82 R83 L84	G77-E80 PolarHBondContact O-N 3.03Å; E80-E82 VanDerWaalsContact C-N 3.34Å; E80-E82 PolarHBondContact O-N 3.48Å; E80-R83 WeakPolarHBondContact O-CB 3.37Å; E80-R83 PolarHBondContact O-N 3.48Å; E80-R83 VanDerWaalsContact O-N 3.15Å; E80-L84 PolarHBondContact O-N 3.4Å
81	L	80.9	Confident	72.4	Confident	108 Å²	108	117.1 Å²	117.1	57%	0.565	60%	0.604	S	S	*	*	H	α-helix	trans	-61.2	-42.3	176.3	-172.8	67.2	0	0	0	112	G77 R83 L84 K85	G77-L81 WeakPolarHBondContact O-CB 3.47Å; G77-L81 PolarHBondContact O-N 3.03Å; L81-R83 VanDerWaalsContact C-N 3.34Å; L81-L84 PolarHBondContact O-N 2.92Å; L81-K85 WeakPolarHBondContact O-CB 3.19Å; L81-K85 PolarHBondContact O-N 3.32Å
82	E	82.3	Confident	75	Confident	92 Å²	92	116.8 Å²	116.8	43%	0.43	59%	0.594	S	S	.	*	H	α-helix	trans	-66.1	-34.5	175.2	-76.4	-66.3	160.4	0	0	112.6	R78 E80 K86	R78-E82 WeakPolarHBondContact O-CG 3.38Å; R78-E82 PolarHBondContact O-N 3.39Å; R78-E82 VanDerWaalsContact O-N 3.16Å; E80-E82 VanDerWaalsContact C-N 3.34Å; E80-E82 PolarHBondContact O-N 3.48Å; E82-K86 WeakPolarHBondContact O-CG 3.43Å; E82-K86 PolarHBondContact O-N 3.22Å
83	R	85.8	Confident	77.1	Confident	185 Å²	185	115 Å²	115	70%	0.698	59%	0.585	S	S	*	*	H	α-helix	trans	-66.5	-47.5	173.9	-178.4	-177.9	170.6	174.4	-2	111.1	H79 E80 L81 K85 K86 E87	H79-R83 WeakPolarHBondContact O-CB 3.45Å; H79-R83 PolarHBondContact O-N 2.75Å; E80-R83 WeakPolarHBondContact O-CB 3.37Å; E80-R83 PolarHBondContact O-N 3.48Å; E80-R83 VanDerWaalsContact O-N 3.15Å; L81-R83 VanDerWaalsContact C-N 3.34Å; R83-K85 VanDerWaalsContact C-N 3.32Å; R83-K85 PolarHBondContact O-N 3.26Å; R83-K86 WeakPolarHBondContact O-CB 3.08Å; R83-K86 PolarHBondContact O-N 3.47Å; R83-E87 PolarHBondContact O-N 2.94Å; R83-E87 VanDerWaalsContact O-N 3.09Å
84	L	83.9	Confident	79.4	Confident	97 Å²	97	113.7 Å²	113.7	51%	0.508	57%	0.57	S	S	.	*	H	α-helix	trans	-64.5	-38.5	-179.4	-151.9	78.8	0	0	0	111.3	E80 L81 K86 E87 V88	E80-L84 PolarHBondContact O-N 3.4Å; L81-L84 PolarHBondContact O-N 2.92Å; L84-K86 VanDerWaalsContact C-N 3.31Å; L84-K86 PolarHBondContact O-N 3.33Å; L84-E87 PolarHBondContact O-N 3.41Å; L84-E87 VanDerWaalsContact O-N 3.16Å; L84-V88 WeakPolarHBondContact O-CG2 3.45Å; L84-V88 PolarHBondContact O-N 2.9Å
85	K	88	Confident	81	Confident	130 Å²	130	114.1 Å²	114.1	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-61.7	-38	175.4	-170.2	175.3	-178.1	178.4	0	112.6	L81 R83 S89	L81-K85 WeakPolarHBondContact O-CB 3.19Å; L81-K85 PolarHBondContact O-N 3.32Å; R83-K85 VanDerWaalsContact C-N 3.32Å; R83-K85 PolarHBondContact O-N 3.26Å; K85-S89 WeakPolarHBondContact O-CB 3.47Å; K85-S89 PolarHBondContact O-N 2.96Å; K85-S89 VanDerWaalsContact O-N 3.12Å; K85-S89 PolarHBondContact O-OG 2.94Å
86	K	89.3	Confident	82.7	Confident	147 Å²	147	115.1 Å²	115.1	64%	0.639	56%	0.557	S	S	*	*	H	α-helix	trans	-65.9	-42.7	173	-74.7	178.3	-179.8	-179.5	0	111.6	E82 R83 L84 S89 V90	E82-K86 WeakPolarHBondContact O-CG 3.43Å; E82-K86 PolarHBondContact O-N 3.22Å; R83-K86 WeakPolarHBondContact O-CB 3.08Å; R83-K86 PolarHBondContact O-N 3.47Å; L84-K86 VanDerWaalsContact C-N 3.31Å; L84-K86 PolarHBondContact O-N 3.33Å; K86-S89 WeakPolarHBondContact O-CB 3.47Å; K86-S89 PolarHBondContact O-N 3.1Å; K86-V90 WeakPolarHBondContact O-CG2 3.32Å; K86-V90 PolarHBondContact O-N 2.94Å
87	E	89.6	Confident	84.5	Confident	104 Å²	104	116 Å²	116	49%	0.486	56%	0.556	S	S	.	*	H	α-helix	trans	-65	-44.9	179.5	-169.2	168.7	-177.4	0	0	112.5	R83 L84 S89 V90 L91	R83-E87 PolarHBondContact O-N 2.94Å; R83-E87 VanDerWaalsContact O-N 3.09Å; L84-E87 PolarHBondContact O-N 3.41Å; L84-E87 VanDerWaalsContact O-N 3.16Å; E87-S89 VanDerWaalsContact C-N 3.27Å; E87-S89 PolarHBondContact O-N 2.73Å; E87-V90 PolarHBondContact O-N 2.96Å; E87-L91 WeakPolarHBondContact O-CG 3Å; E87-L91 PolarHBondContact O-N 3.32Å
88	V	87.2	Confident	85.7	Confident	87 Å²	87	119.1 Å²	119.1	53%	0.527	56%	0.557	S	S	.	*	H	α-helix	trans	-61.2	-37	174	173.1	0	0	0	0	111.5	L84 L91 R92	L84-V88 WeakPolarHBondContact O-CG2 3.45Å; L84-V88 PolarHBondContact O-N 2.9Å; V88-L91 PolarHBondContact O-N 3.13Å; V88-R92 WeakPolarHBondContact O-CB 3.19Å; V88-R92 PolarHBondContact O-N 3.4Å
89	S	86.8	Confident	86.4	Confident	71 Å²	71	114.8 Å²	114.8	50%	0.497	55%	0.547	S	S	.	.	H	α-helix	trans	-65.6	-40.8	176.4	-58	0	0	0	0	112	K85 K86 E87 R92 E93	K85-S89 WeakPolarHBondContact O-CB 3.47Å; K85-S89 PolarHBondContact O-N 2.96Å; K85-S89 VanDerWaalsContact O-N 3.12Å; K85-S89 PolarHBondContact O-OG 2.94Å; K86-S89 WeakPolarHBondContact O-CB 3.47Å; K86-S89 PolarHBondContact O-N 3.1Å; E87-S89 VanDerWaalsContact C-N 3.27Å; E87-S89 PolarHBondContact O-N 2.73Å; S89-R92 PolarHBondContact O-N 3.38Å; S89-E93 PolarHBondContact O-N 3.1Å
90	V	90	Very high	87.1	Confident	87 Å²	87	109.1 Å²	109.1	53%	0.527	53%	0.532	S	S	.	.	H	α-helix	trans	-65.1	-46.3	175.8	172	0	0	0	0	111.1	K86 E87 R92 E93 E94	K86-V90 WeakPolarHBondContact O-CG2 3.32Å; K86-V90 PolarHBondContact O-N 2.94Å; E87-V90 PolarHBondContact O-N 2.96Å; V90-R92 VanDerWaalsContact C-N 3.26Å; V90-R92 PolarHBondContact O-N 2.65Å; V90-E93 PolarHBondContact O-N 3Å; V90-E94 PolarHBondContact O-N 3.22Å
91	L	87.7	Confident	87.5	Confident	98 Å²	98	106.5 Å²	106.5	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-61.7	-36	177.8	-73.4	170.9	0	0	0	112.1	E87 V88 E94 L95	E87-L91 WeakPolarHBondContact O-CG 3Å; E87-L91 PolarHBondContact O-N 3.32Å; V88-L91 PolarHBondContact O-N 3.13Å; L91-E94 PolarHBondContact O-N 3.14Å; L91-L95 WeakPolarHBondContact O-CB 3.43Å; L91-L95 PolarHBondContact O-N 2.93Å
92	R	88	Confident	87.6	Confident	109 Å²	109	107 Å²	107	41%	0.411	52%	0.522	S	S	.	.	H	α-helix	trans	-67.4	-42.4	176.4	-166.6	173.6	-167.8	-127.4	-2.7	111.6	V88 S89 V90 L95 Y96 D511	V88-R92 WeakPolarHBondContact O-CB 3.19Å; V88-R92 PolarHBondContact O-N 3.4Å; S89-R92 PolarHBondContact O-N 3.38Å; V90-R92 VanDerWaalsContact C-N 3.26Å; V90-R92 PolarHBondContact O-N 2.65Å; R92-L95 PolarHBondContact O-N 3.12Å; R92-Y96 HydrophobicContact CG-CD2 4.02Å; R92-Y96 HydrophobicContact CG-CE2 3.62Å; R92-Y96 PolarHBondContact NH2-OH 2.9Å; R92-Y96 WeakPolarHBondContact O-CD2 3.07Å; R92-Y96 PolarHBondContact O-N 3.06Å; R92-Y96 VanDerWaalsContact O-N 3.1Å; R92-D511 IonicContact CZ-OD2 3.38Å; R92-D511 VanDerWaalsContact CZ-OD2 3.25Å; R92-D511 VanDerWaalsContact NH1-CG 3.29Å; R92-D511 IonicContact NH1-OD1 3.66Å; R92-D511 IonicContact NH1-OD2 2.98Å; R92-D511 PolarHBondContact NH1-OD2 2.9Å; R92-D511 IonicContact NH2-OD2 3.76Å; R92-D511 PolarHBondContact NH2-OD2 3.49Å
93	E	88.5	Confident	87.8	Confident	138 Å²	138	105.5 Å²	105.5	65%	0.645	53%	0.525	S	S	*	.	H	α-helix	trans	-62	-42.4	173.9	-171.9	173.3	-173.5	0	0	111.6	S89 V90 Y96 M97	S89-E93 PolarHBondContact O-N 3.1Å; V90-E93 PolarHBondContact O-N 3Å; E93-Y96 PolarHBondContact O-N 2.7Å; E93-M97 WeakPolarHBondContact O-CG 3.49Å; E93-M97 PolarHBondContact O-N 3.28Å
94	E	89.1	Confident	87.9	Confident	104 Å²	104	101 Å²	101	49%	0.486	52%	0.518	S	S	.	.	H	α-helix	trans	-63.9	-41.9	176.4	-170.5	173.7	-174.6	0	0	112.4	V90 L91 Y96 M97 K98	V90-E94 PolarHBondContact O-N 3.22Å; L91-E94 PolarHBondContact O-N 3.14Å; E94-Y96 PolarHBondContact O-N 2.98Å; E94-M97 WeakPolarHBondContact O-CB 3.2Å; E94-M97 PolarHBondContact O-N 3.07Å; E94-K98 VanDerWaalsContact O-CG 3.29Å; E94-K98 WeakPolarHBondContact O-CG 3.49Å; E94-K98 PolarHBondContact O-N 3.16Å
95	L	88.6	Confident	88	Confident	107 Å²	107	101.1 Å²	101.1	56%	0.56	52%	0.519	S	S	*	.	H	α-helix	trans	-60.8	-44.5	175.4	-171.8	102.7	0	0	0	111.6	L91 R92 K98 L99	L91-L95 WeakPolarHBondContact O-CB 3.43Å; L91-L95 PolarHBondContact O-N 2.93Å; R92-L95 PolarHBondContact O-N 3.12Å; L95-K98 PolarHBondContact O-N 3.2Å; L95-L99 HydrophobicContact CD2-CD1 4.15Å; L95-L99 HydrophobicContact CG-CD1 4.38Å; L95-L99 WeakPolarHBondContact O-CG 3.46Å; L95-L99 PolarHBondContact O-N 3.26Å
96	Y	89.4	Confident	88	Confident	125 Å²	125	102.7 Å²	102.7	49%	0.49	53%	0.525	S	S	.	.	H	α-helix	trans	-65.9	-38.7	177.9	-76.9	-59.7	0	0	0	112.4	R92 E93 E94 L99 G100	R92-Y96 HydrophobicContact CG-CD2 4.02Å; R92-Y96 HydrophobicContact CG-CE2 3.62Å; R92-Y96 PolarHBondContact NH2-OH 2.9Å; R92-Y96 WeakPolarHBondContact O-CD2 3.07Å; R92-Y96 PolarHBondContact O-N 3.06Å; R92-Y96 VanDerWaalsContact O-N 3.1Å; E93-Y96 PolarHBondContact O-N 2.7Å; E94-Y96 PolarHBondContact O-N 2.98Å; Y96-L99 HydrophobicContact CD1-CD1 4.46Å; Y96-L99 PolarHBondContact O-N 2.66Å; Y96-G100 PolarHBondContact O-N 2.9Å
97	M	88.5	Confident	87.8	Confident	121 Å²	121	100.8 Å²	100.8	60%	0.596	52%	0.519	S	S	*	.	H	α-helix	trans	-57.3	-48.3	170.4	-81.7	-89	-69	0	0	111.4	E93 E94 L99 G100 E101	E93-M97 WeakPolarHBondContact O-CG 3.49Å; E93-M97 PolarHBondContact O-N 3.28Å; E94-M97 WeakPolarHBondContact O-CB 3.2Å; E94-M97 PolarHBondContact O-N 3.07Å; M97-L99 PolarHBondContact O-N 2.75Å; M97-G100 PolarHBondContact O-N 3.21Å; M97-G100 VanDerWaalsContact O-N 3.17Å; M97-E101 PolarHBondContact O-N 3.16Å
98	K	88.7	Confident	87.6	Confident	110 Å²	110	98.9 Å²	98.9	48%	0.478	52%	0.517	S	S	.	.	H	α-helix	trans	-64.9	-36.5	180	-69.3	-72.3	159	-152.3	0	113	E94 L95 E101 L102	E94-K98 VanDerWaalsContact O-CG 3.29Å; E94-K98 WeakPolarHBondContact O-CG 3.49Å; E94-K98 PolarHBondContact O-N 3.16Å; L95-K98 PolarHBondContact O-N 3.2Å; K98-E101 WeakPolarHBondContact CD-OE2 3.4Å; K98-E101 IonicContact NZ-OE1 3.39Å; K98-E101 PolarHBondContact NZ-OE1 3.1Å; K98-E101 IonicContact NZ-OE2 2.63Å; K98-E101 PolarHBondContact NZ-OE2 3.27Å; K98-E101 PolarHBondContact O-N 2.96Å; K98-L102 WeakPolarHBondContact O-CB 3.41Å; K98-L102 PolarHBondContact O-N 3.42Å
99	L	87.1	Confident	87.5	Confident	97 Å²	97	96.7 Å²	96.7	51%	0.508	51%	0.508	S	S	.	.	H	α-helix	trans	-65.6	-38.8	173.2	-76.8	167.6	0	0	0	112.1	L95 Y96 M97 L102 A103	L95-L99 HydrophobicContact CD2-CD1 4.15Å; L95-L99 HydrophobicContact CG-CD1 4.38Å; L95-L99 WeakPolarHBondContact O-CG 3.46Å; L95-L99 PolarHBondContact O-N 3.26Å; Y96-L99 HydrophobicContact CD1-CD1 4.46Å; Y96-L99 PolarHBondContact O-N 2.66Å; M97-L99 PolarHBondContact O-N 2.75Å; L99-L102 PolarHBondContact O-N 3.48Å; L99-A103 PolarHBondContact O-N 3.1Å
100	G	91.1	Very high	87.4	Confident	38 Å²	38	97 Å²	97	39%	0.392	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-46.5	173	0	0	0	0	0	112.5	Y96 M97 L102 A103 T104	Y96-G100 PolarHBondContact O-N 2.9Å; M97-G100 PolarHBondContact O-N 3.21Å; M97-G100 VanDerWaalsContact O-N 3.17Å; G100-L102 VanDerWaalsContact C-N 3.33Å; G100-L102 PolarHBondContact O-N 3.41Å; G100-A103 PolarHBondContact O-N 3.45Å; G100-T104 WeakPolarHBondContact O-CG2 3.46Å; G100-T104 PolarHBondContact O-N 2.72Å; G100-T104 VanDerWaalsContact O-N 3.1Å
101	E	87.1	Confident	87.2	Confident	81 Å²	81	100.7 Å²	100.7	38%	0.379	52%	0.515	S	S	.	.	H	α-helix	trans	-56.8	-46.9	174	-71.2	174.9	-176	0	0	111	M97 K98 A103 T104 I105	M97-E101 PolarHBondContact O-N 3.16Å; K98-E101 WeakPolarHBondContact CD-OE2 3.4Å; K98-E101 IonicContact NZ-OE1 3.39Å; K98-E101 PolarHBondContact NZ-OE1 3.1Å; K98-E101 IonicContact NZ-OE2 2.63Å; K98-E101 PolarHBondContact NZ-OE2 3.27Å; K98-E101 PolarHBondContact O-N 2.96Å; E101-A103 VanDerWaalsContact C-N 3.33Å; E101-A103 PolarHBondContact O-N 3.21Å; E101-T104 PolarHBondContact O-N 3.36Å; E101-T104 PolarHBondContact O-OG1 3.05Å; E101-I105 VanDerWaalsContact O-CG1 3.32Å; E101-I105 WeakPolarHBondContact O-CG1 3.41Å; E101-I105 PolarHBondContact O-N 3.44Å
102	L	83.3	Confident	87.1	Confident	119 Å²	119	99.5 Å²	99.5	62%	0.623	51%	0.511	S	S	*	.	H	α-helix	trans	-61.9	-39	-180	-153.5	84.2	0	0	0	112.7	K98 L99 G100 I105 K106	K98-L102 WeakPolarHBondContact O-CB 3.41Å; K98-L102 PolarHBondContact O-N 3.42Å; L99-L102 PolarHBondContact O-N 3.48Å; G100-L102 VanDerWaalsContact C-N 3.33Å; G100-L102 PolarHBondContact O-N 3.41Å; L102-I105 PolarHBondContact O-N 3.39Å; L102-K106 WeakPolarHBondContact O-CB 3.43Å; L102-K106 PolarHBondContact O-N 2.88Å
103	A	86.2	Confident	87	Confident	61 Å²	61	101.8 Å²	101.8	50%	0.504	52%	0.524	S	S	.	.	H	α-helix	trans	-64.5	-43.1	176.4	0	0	0	0	0	111.8	L99 G100 E101 I105 K106 E107	L99-A103 PolarHBondContact O-N 3.1Å; G100-A103 PolarHBondContact O-N 3.45Å; E101-A103 VanDerWaalsContact C-N 3.33Å; E101-A103 PolarHBondContact O-N 3.21Å; A103-I105 PolarHBondContact O-N 2.86Å; A103-K106 PolarHBondContact O-N 3.36Å; A103-E107 PolarHBondContact O-N 2.97Å
104	T	87.4	Confident	86.9	Confident	90 Å²	90	97.9 Å²	97.9	55%	0.552	52%	0.516	S	S	*	.	H	α-helix	trans	-64.9	-38.8	175.9	63.2	0	0	0	0	112.2	G100 E101 E107 S108	G100-T104 WeakPolarHBondContact O-CG2 3.46Å; G100-T104 PolarHBondContact O-N 2.72Å; G100-T104 VanDerWaalsContact O-N 3.1Å; E101-T104 PolarHBondContact O-N 3.36Å; E101-T104 PolarHBondContact O-OG1 3.05Å; T104-E107 PolarHBondContact O-N 3.43Å; T104-S108 WeakPolarHBondContact O-CB 3.41Å; T104-S108 PolarHBondContact O-N 3.03Å; T104-S108 PolarHBondContact O-OG 3.06Å
105	I	85.8	Confident	86.9	Confident	100 Å²	100	96.1 Å²	96.1	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-63.4	-44.4	175.1	-67.3	166.3	0	0	0	110	E101 L102 A103 E107 S108 A109	E101-I105 VanDerWaalsContact O-CG1 3.32Å; E101-I105 WeakPolarHBondContact O-CG1 3.41Å; E101-I105 PolarHBondContact O-N 3.44Å; L102-I105 PolarHBondContact O-N 3.39Å; A103-I105 PolarHBondContact O-N 2.86Å; I105-E107 PolarHBondContact O-N 2.79Å; I105-S108 WeakPolarHBondContact CA-OG 3.32Å; I105-S108 PolarHBondContact O-N 3.43Å; I105-S108 PolarHBondContact O-OG 3.37Å; I105-A109 WeakPolarHBondContact O-CB 3.28Å; I105-A109 PolarHBondContact O-N 2.68Å
106	K	89.2	Confident	86.8	Confident	163 Å²	163	93.9 Å²	93.9	71%	0.709	50%	0.501	S	S	*	.	H	α-helix	trans	-59.3	-44.4	176.9	-174.8	-178.6	178.5	-178.4	0	111.9	L102 A103 A109 S110	L102-K106 WeakPolarHBondContact O-CB 3.43Å; L102-K106 PolarHBondContact O-N 2.88Å; A103-K106 PolarHBondContact O-N 3.36Å; K106-A109 PolarHBondContact O-N 3.32Å; K106-S110 PolarHBondContact O-N 3.06Å
107	E	85	Confident	86.7	Confident	106 Å²	106	91.1 Å²	91.1	50%	0.495	50%	0.5	S	S	.	.	H	α-helix	trans	-65.7	-42.8	177.7	-166.9	-179.3	167.8	0	0	111.6	A103 T104 I105 A109 S110 R111	A103-E107 PolarHBondContact O-N 2.97Å; T104-E107 PolarHBondContact O-N 3.43Å; I105-E107 PolarHBondContact O-N 2.79Å; E107-A109 VanDerWaalsContact C-N 3.35Å; E107-A109 PolarHBondContact O-N 3.46Å; E107-S110 PolarHBondContact O-N 2.98Å; E107-R111 WeakPolarHBondContact O-CG 3.42Å; E107-R111 PolarHBondContact O-N 2.92Å; E107-R111 IonicContact OE1-CZ 2.68Å; E107-R111 IonicContact OE1-NE 3.67Å; E107-R111 IonicContact OE1-NH2 3.58Å; E107-R111 PolarHBondContact OE1-NH2 3.33Å
108	S	84.3	Confident	86.7	Confident	64 Å²	64	90.5 Å²	90.5	45%	0.448	50%	0.499	S	S	.	.	H	α-helix	trans	-61.5	-42	176.3	74.1	0	0	0	0	112.2	T104 I105 S110 R111 T112	T104-S108 WeakPolarHBondContact O-CB 3.41Å; T104-S108 PolarHBondContact O-N 3.03Å; T104-S108 PolarHBondContact O-OG 3.06Å; I105-S108 WeakPolarHBondContact CA-OG 3.32Å; I105-S108 PolarHBondContact O-N 3.43Å; I105-S108 PolarHBondContact O-OG 3.37Å; S108-S110 VanDerWaalsContact C-N 3.34Å; S108-S110 PolarHBondContact O-N 3.49Å; S108-R111 PolarHBondContact O-N 3.17Å; S108-T112 WeakPolarHBondContact O-CG2 3.37Å; S108-T112 PolarHBondContact O-N 3.43Å; S108-T112 PolarHBondContact O-OG1 3.48Å
109	A	84.8	Confident	86.7	Confident	41 Å²	41	88.1 Å²	88.1	34%	0.339	49%	0.493	S	S	.	.	H	α-helix	trans	-66.7	-33.9	177.5	0	0	0	0	0	112.6	I105 K106 E107 T112 K113	I105-A109 WeakPolarHBondContact O-CB 3.28Å; I105-A109 PolarHBondContact O-N 2.68Å; K106-A109 PolarHBondContact O-N 3.32Å; E107-A109 VanDerWaalsContact C-N 3.35Å; E107-A109 PolarHBondContact O-N 3.46Å; A109-T112 WeakPolarHBondContact CA-OG1 3.33Å; A109-T112 PolarHBondContact O-OG1 3.47Å; A109-K113 WeakPolarHBondContact O-CB 3.28Å; A109-K113 WeakPolarHBondContact O-CG 3Å; A109-K113 PolarHBondContact O-N 2.91Å
110	S	86	Confident	86.6	Confident	78 Å²	78	87.8 Å²	87.8	55%	0.545	49%	0.491	S	S	.	.	H	α-helix	trans	-66.8	-43.4	174.5	-169.5	0	0	0	0	111.3	K106 E107 S108 K113 A114	K106-S110 PolarHBondContact O-N 3.06Å; E107-S110 PolarHBondContact O-N 2.98Å; S108-S110 VanDerWaalsContact C-N 3.34Å; S108-S110 PolarHBondContact O-N 3.49Å; S110-K113 PolarHBondContact O-N 3.38Å; S110-A114 PolarHBondContact O-N 3.43Å
111	R	85	Confident	86.5	Confident	165 Å²	165	89.1 Å²	89.1	62%	0.623	49%	0.494	S	S	*	.	H	α-helix	trans	-63.7	-42	175.8	-67.5	179.9	-173.6	-161.5	4.1	112.2	E107 S108 A114 T115	E107-R111 WeakPolarHBondContact O-CG 3.42Å; E107-R111 PolarHBondContact O-N 2.92Å; E107-R111 IonicContact OE1-CZ 2.68Å; E107-R111 IonicContact OE1-NE 3.67Å; E107-R111 IonicContact OE1-NH2 3.58Å; E107-R111 PolarHBondContact OE1-NH2 3.33Å; S108-R111 PolarHBondContact O-N 3.17Å; R111-A114 PolarHBondContact O-N 2.89Å; R111-T115 PolarHBondContact O-N 3.42Å; R111-T115 VanDerWaalsContact O-N 3.07Å; R111-T115 PolarHBondContact O-OG1 3.48Å
112	T	86.2	Confident	86.6	Confident	72 Å²	72	92.4 Å²	92.4	44%	0.442	51%	0.508	S	S	.	.	H	α-helix	trans	-66.2	-39.1	176.4	54.4	0	0	0	0	112.1	S108 A109 A114 T115 D116	S108-T112 WeakPolarHBondContact O-CG2 3.37Å; S108-T112 PolarHBondContact O-N 3.43Å; S108-T112 PolarHBondContact O-OG1 3.48Å; A109-T112 WeakPolarHBondContact CA-OG1 3.33Å; A109-T112 PolarHBondContact O-OG1 3.47Å; T112-A114 VanDerWaalsContact C-N 3.31Å; T112-A114 PolarHBondContact O-N 3.2Å; T112-T115 WeakPolarHBondContact CA-OG1 3.34Å; T112-T115 PolarHBondContact O-N 3.22Å; T112-T115 PolarHBondContact O-OG1 2.97Å; T112-D116 WeakPolarHBondContact O-CB 3.49Å; T112-D116 PolarHBondContact O-N 3.38Å
113	K	86.7	Confident	86.9	Confident	157 Å²	157	91.2 Å²	91.2	68%	0.683	50%	0.501	S	S	*	.	H	α-helix	trans	-61.3	-39.5	174.1	-80.7	-177	178.3	-174.8	0	112.2	A109 S110 D116 S117	A109-K113 WeakPolarHBondContact O-CB 3.28Å; A109-K113 WeakPolarHBondContact O-CG 3Å; A109-K113 PolarHBondContact O-N 2.91Å; S110-K113 PolarHBondContact O-N 3.38Å; K113-D116 PolarHBondContact O-N 2.67Å; K113-S117 WeakPolarHBondContact O-CB 3.22Å; K113-S117 PolarHBondContact O-N 3.27Å
114	A	86.3	Confident	87	Confident	56 Å²	56	94.2 Å²	94.2	46%	0.463	51%	0.505	S	S	.	.	H	α-helix	trans	-63.9	-44.7	175.7	0	0	0	0	0	111.7	S110 R111 T112 D116 S117 D118	S110-A114 PolarHBondContact O-N 3.43Å; R111-A114 PolarHBondContact O-N 2.89Å; T112-A114 VanDerWaalsContact C-N 3.31Å; T112-A114 PolarHBondContact O-N 3.2Å; A114-D116 PolarHBondContact O-N 3.02Å; A114-S117 PolarHBondContact O-N 2.69Å; A114-D118 PolarHBondContact O-N 2.79Å; A114-D118 VanDerWaalsContact O-N 3.08Å
115	T	88.8	Confident	87.2	Confident	67 Å²	67	93.5 Å²	93.5	41%	0.411	50%	0.503	S	S	.	.	H	α-helix	trans	-65.5	-39.1	176.4	55.5	0	0	0	0	112.5	R111 T112 D118 T119	R111-T115 PolarHBondContact O-N 3.42Å; R111-T115 VanDerWaalsContact O-N 3.07Å; R111-T115 PolarHBondContact O-OG1 3.48Å; T112-T115 WeakPolarHBondContact CA-OG1 3.34Å; T112-T115 PolarHBondContact O-N 3.22Å; T112-T115 PolarHBondContact O-OG1 2.97Å; T115-D118 PolarHBondContact O-N 3.41Å; T115-T119 WeakPolarHBondContact O-CG2 3.33Å; T115-T119 PolarHBondContact O-N 3.19Å
116	D	86.7	Confident	87.4	Confident	61 Å²	61	93.4 Å²	93.4	33%	0.326	50%	0.501	S	S	.	.	H	α-helix	trans	-66	-42.4	178.5	-69.5	-7.1	0	0	0	110.2	T112 K113 A114 D118 T119 I120 N370	T112-D116 WeakPolarHBondContact O-CB 3.49Å; T112-D116 PolarHBondContact O-N 3.38Å; K113-D116 PolarHBondContact O-N 2.67Å; A114-D116 PolarHBondContact O-N 3.02Å; D116-D118 VanDerWaalsContact C-N 3.34Å; D116-D118 PolarHBondContact O-N 3.16Å; D116-T119 WeakPolarHBondContact CA-OG1 3.16Å; D116-T119 PolarHBondContact O-N 3.13Å; D116-T119 VanDerWaalsContact O-N 3.15Å; D116-T119 PolarHBondContact O-OG1 3.14Å; D116-I120 VanDerWaalsContact O-CG1 3.26Å; D116-I120 WeakPolarHBondContact O-CG1 3.16Å; D116-I120 PolarHBondContact O-N 2.99Å; D116-N370 PolarHBondContact OD1-ND2 3.45Å
117	S	86.9	Confident	87.4	Confident	67 Å²	67	89.9 Å²	89.9	47%	0.469	49%	0.489	S	S	.	.	H	α-helix	trans	-56.8	-45.3	173.5	-169.6	0	0	0	0	112	K113 A114 T119 I120 S121	K113-S117 WeakPolarHBondContact O-CB 3.22Å; K113-S117 PolarHBondContact O-N 3.27Å; A114-S117 PolarHBondContact O-N 2.69Å; S117-T119 VanDerWaalsContact C-N 3.35Å; S117-T119 PolarHBondContact O-N 3.3Å; S117-I120 PolarHBondContact O-N 3.31Å; S117-S121 PolarHBondContact O-N 3.45Å; S117-S121 PolarHBondContact O-OG 3.38Å
118	D	88	Confident	87.8	Confident	108 Å²	108	91.7 Å²	91.7	58%	0.578	50%	0.495	S	S	*	.	H	α-helix	trans	-63.8	-38	176.6	-81	-8.9	0	0	0	112.5	A114 T115 D116 K122	A114-D118 PolarHBondContact O-N 2.79Å; A114-D118 VanDerWaalsContact O-N 3.08Å; T115-D118 PolarHBondContact O-N 3.41Å; D116-D118 VanDerWaalsContact C-N 3.34Å; D116-D118 PolarHBondContact O-N 3.16Å; D118-K122 WeakPolarHBondContact O-CG 3.47Å; D118-K122 PolarHBondContact O-N 2.84Å; D118-K122 VanDerWaalsContact O-N 3.12Å
119	T	88.3	Confident	88.1	Confident	59 Å²	59	91.1 Å²	91.1	36%	0.362	49%	0.492	S	S	.	.	H	α-helix	trans	-68	-37.5	175.7	63.2	0	0	0	0	112.2	T115 D116 S117 K122 L123	T115-T119 WeakPolarHBondContact O-CG2 3.33Å; T115-T119 PolarHBondContact O-N 3.19Å; D116-T119 WeakPolarHBondContact CA-OG1 3.16Å; D116-T119 PolarHBondContact O-N 3.13Å; D116-T119 VanDerWaalsContact O-N 3.15Å; D116-T119 PolarHBondContact O-OG1 3.14Å; S117-T119 VanDerWaalsContact C-N 3.35Å; S117-T119 PolarHBondContact O-N 3.3Å; T119-K122 PolarHBondContact O-N 3.33Å; T119-L123 WeakPolarHBondContact O-CG 3.4Å; T119-L123 PolarHBondContact O-N 3.2Å
120	I	86.4	Confident	88.3	Confident	91 Å²	91	93 Å²	93	47%	0.467	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-48.6	175.9	-69.2	164	0	0	0	109.6	D116 S117 K122 L123 E124	D116-I120 VanDerWaalsContact O-CG1 3.26Å; D116-I120 WeakPolarHBondContact O-CG1 3.16Å; D116-I120 PolarHBondContact O-N 2.99Å; S117-I120 PolarHBondContact O-N 3.31Å; I120-K122 VanDerWaalsContact C-N 3.28Å; I120-K122 PolarHBondContact O-N 3.48Å; I120-L123 PolarHBondContact O-N 3.48Å; I120-L123 VanDerWaalsContact O-N 3.1Å; I120-E124 HydrophobicContact CG2-CG 4.35Å; I120-E124 WeakPolarHBondContact O-CG 3.21Å; I120-E124 PolarHBondContact O-N 2.72Å
121	S	88.1	Confident	88.5	Confident	65 Å²	65	97.9 Å²	97.9	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-59.7	-36.8	177.3	-62.8	0	0	0	0	112.9	S117 S125	S117-S121 PolarHBondContact O-N 3.45Å; S117-S121 PolarHBondContact O-OG 3.38Å; S121-S125 PolarHBondContact O-N 3.28Å; S121-S125 VanDerWaalsContact O-N 3.08Å
122	K	90	Very high	88.8	Confident	151 Å²	151	94.6 Å²	94.6	66%	0.657	50%	0.495	S	S	*	.	H	α-helix	trans	-65.2	-45.5	173.2	-76.2	175	-177.8	171.5	0	112.1	D118 T119 I120 E124 S125 H126	D118-K122 WeakPolarHBondContact O-CG 3.47Å; D118-K122 PolarHBondContact O-N 2.84Å; D118-K122 VanDerWaalsContact O-N 3.12Å; T119-K122 PolarHBondContact O-N 3.33Å; I120-K122 VanDerWaalsContact C-N 3.28Å; I120-K122 PolarHBondContact O-N 3.48Å; K122-E124 PolarHBondContact O-N 3.02Å; K122-S125 PolarHBondContact O-N 2.9Å; K122-S125 PolarHBondContact O-OG 3.21Å; K122-H126 PolarHBondContact O-N 3.07Å
123	L	88.5	Confident	88.9	Confident	94 Å²	94	95 Å²	95	49%	0.492	49%	0.494	S	S	.	.	H	α-helix	trans	-63.9	-39.2	178.1	-72.3	171.2	0	0	0	112.2	T119 I120 H126 L127	T119-L123 WeakPolarHBondContact O-CG 3.4Å; T119-L123 PolarHBondContact O-N 3.2Å; I120-L123 PolarHBondContact O-N 3.48Å; I120-L123 VanDerWaalsContact O-N 3.1Å; L123-H126 PolarHBondContact O-N 2.95Å; L123-L127 WeakPolarHBondContact O-CB 3.44Å; L123-L127 WeakPolarHBondContact O-CG 3.43Å; L123-L127 PolarHBondContact O-N 2.91Å
124	E	89	Confident	89	Confident	123 Å²	123	93.8 Å²	93.8	58%	0.575	49%	0.489	S	S	*	.	H	α-helix	trans	-62.7	-42.4	174.7	-72.7	179.8	160.6	0	0	111.8	I120 K122 H126 L127 K128	I120-E124 HydrophobicContact CG2-CG 4.35Å; I120-E124 WeakPolarHBondContact O-CG 3.21Å; I120-E124 PolarHBondContact O-N 2.72Å; K122-E124 PolarHBondContact O-N 3.02Å; E124-H126 VanDerWaalsContact C-N 3.32Å; E124-H126 PolarHBondContact O-N 3.08Å; E124-L127 PolarHBondContact O-N 3.43Å; E124-K128 WeakPolarHBondContact O-CB 3.36Å; E124-K128 PolarHBondContact O-N 3.24Å
125	S	90.5	Very high	89.3	Confident	75 Å²	75	96.8 Å²	96.8	52%	0.524	49%	0.493	S	S	.	.	H	α-helix	trans	-63.2	-38.9	175	78.3	0	0	0	0	112.3	S121 K122 K128 S129	S121-S125 PolarHBondContact O-N 3.28Å; S121-S125 VanDerWaalsContact O-N 3.08Å; K122-S125 PolarHBondContact O-N 2.9Å; K122-S125 PolarHBondContact O-OG 3.21Å; S125-K128 PolarHBondContact O-N 3.31Å; S125-S129 PolarHBondContact O-N 3.24Å
126	H	91.3	Very high	89.3	Confident	99 Å²	99	101.6 Å²	101.6	46%	0.458	50%	0.504	S	S	.	.	H	α-helix	trans	-66.8	-48.5	177	-172.1	-96.3	0	0	0	111.6	K122 L123 E124 K128 S129 E130	K122-H126 PolarHBondContact O-N 3.07Å; L123-H126 PolarHBondContact O-N 2.95Å; E124-H126 VanDerWaalsContact C-N 3.32Å; E124-H126 PolarHBondContact O-N 3.08Å; H126-K128 VanDerWaalsContact C-N 3.26Å; H126-K128 PolarHBondContact O-N 2.91Å; H126-S129 WeakPolarHBondContact O-CA 3.46Å; H126-S129 PolarHBondContact O-N 3.47Å; H126-S129 PolarHBondContact O-OG 2.76Å; H126-E130 IonicContact CE1-OE1 2.73Å; H126-E130 PolarHBondContact CE1-OE1 2.95Å; H126-E130 IonicContact ND1-OE1 2.69Å; H126-E130 PolarHBondContact O-N 3.4Å
127	L	89.5	Confident	89.6	Confident	88 Å²	88	105.1 Å²	105.1	46%	0.461	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-37.2	175.7	-78.7	170.4	0	0	0	112.3	L123 E124 S129 E130 R131	L123-L127 WeakPolarHBondContact O-CB 3.44Å; L123-L127 WeakPolarHBondContact O-CG 3.43Å; L123-L127 PolarHBondContact O-N 2.91Å; E124-L127 PolarHBondContact O-N 3.43Å; L127-S129 VanDerWaalsContact C-N 3.34Å; L127-E130 PolarHBondContact O-N 2.87Å; L127-R131 WeakPolarHBondContact O-CB 3.33Å; L127-R131 WeakPolarHBondContact O-CG 3.26Å; L127-R131 PolarHBondContact O-N 3.25Å
128	K	91.6	Very high	89.6	Confident	144 Å²	144	107.1 Å²	107.1	63%	0.626	52%	0.521	S	S	*	.	H	α-helix	trans	-63.6	-40.8	174	-169.8	175	-176.1	175.9	0	111.5	E124 S125 H126 N132	E124-K128 WeakPolarHBondContact O-CB 3.36Å; E124-K128 PolarHBondContact O-N 3.24Å; S125-K128 PolarHBondContact O-N 3.31Å; H126-K128 VanDerWaalsContact C-N 3.26Å; H126-K128 PolarHBondContact O-N 2.91Å; K128-N132 VanDerWaalsContact O-CG 3.24Å; K128-N132 PolarHBondContact O-N 2.93Å; K128-N132 PolarHBondContact O-ND2 3.31Å
129	S	91.3	Very high	89.6	Confident	53 Å²	53	105.1 Å²	105.1	37%	0.371	52%	0.516	S	S	.	.	H	α-helix	trans	-66.4	-43	176	71.7	0	0	0	0	112.6	S125 H126 L127 R131 N132 D133	S125-S129 PolarHBondContact O-N 3.24Å; H126-S129 WeakPolarHBondContact O-CA 3.46Å; H126-S129 PolarHBondContact O-N 3.47Å; H126-S129 PolarHBondContact O-OG 2.76Å; L127-S129 VanDerWaalsContact C-N 3.34Å; S129-R131 PolarHBondContact O-N 2.95Å; S129-N132 WeakPolarHBondContact O-CB 3.3Å; S129-N132 PolarHBondContact O-N 3.43Å; S129-D133 PolarHBondContact O-N 3.22Å
130	E	88.1	Confident	89.8	Confident	80 Å²	80	107.9 Å²	107.9	37%	0.374	52%	0.524	S	S	.	.	H	α-helix	trans	-63.5	-43.1	176.9	-74.2	-171.2	153.9	0	0	112	H126 L127 N132 D133 F134	H126-E130 IonicContact CE1-OE1 2.73Å; H126-E130 PolarHBondContact CE1-OE1 2.95Å; H126-E130 IonicContact ND1-OE1 2.69Å; H126-E130 PolarHBondContact O-N 3.4Å; L127-E130 PolarHBondContact O-N 2.87Å; E130-N132 VanDerWaalsContact C-N 3.28Å; E130-N132 PolarHBondContact O-N 3.23Å; E130-D133 PolarHBondContact O-N 3.31Å; E130-D133 VanDerWaalsContact O-N 3.16Å; E130-F134 HydrophobicContact CB-CD2 4.38Å; E130-F134 HydrophobicContact CB-CE2 4.32Å; E130-F134 WeakPolarHBondContact O-CD2 3.42Å; E130-F134 PolarHBondContact O-N 3.42Å
131	R	90.9	Very high	90	Very high	181 Å²	181	108 Å²	108	68%	0.683	53%	0.525	S	S	*	.	H	α-helix	trans	-58.7	-40.4	175.2	-76.9	-178.2	-170.8	158.7	4.5	112	L127 S129 F134 Q135	L127-R131 WeakPolarHBondContact O-CB 3.33Å; L127-R131 WeakPolarHBondContact O-CG 3.26Å; L127-R131 PolarHBondContact O-N 3.25Å; S129-R131 PolarHBondContact O-N 2.95Å; R131-F134 PolarHBondContact O-N 3.3Å; R131-Q135 WeakPolarHBondContact O-CB 3.38Å; R131-Q135 PolarHBondContact O-N 3.18Å
132	N	90.8	Very high	90.1	Very high	96 Å²	96	110.1 Å²	110.1	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-65.3	-39.4	176.9	-69.4	-21.2	0	0	0	111.9	K128 S129 E130 Q135 R136	K128-N132 VanDerWaalsContact O-CG 3.24Å; K128-N132 PolarHBondContact O-N 2.93Å; K128-N132 PolarHBondContact O-ND2 3.31Å; S129-N132 WeakPolarHBondContact O-CB 3.3Å; S129-N132 PolarHBondContact O-N 3.43Å; E130-N132 VanDerWaalsContact C-N 3.28Å; E130-N132 PolarHBondContact O-N 3.23Å; N132-Q135 PolarHBondContact O-N 3.24Å; N132-R136 PolarHBondContact O-N 2.81Å
133	D	89.6	Confident	90.1	Very high	80 Å²	80	105.9 Å²	105.9	43%	0.428	53%	0.525	S	S	.	.	H	α-helix	trans	-70.1	-40	176.5	-79.9	-13.5	0	0	0	112.3	S129 E130 R136 K137	S129-D133 PolarHBondContact O-N 3.22Å; E130-D133 PolarHBondContact O-N 3.31Å; E130-D133 VanDerWaalsContact O-N 3.16Å; D133-R136 PolarHBondContact O-N 3.32Å; D133-R136 IonicContact OD1-CZ 3.33Å; D133-R136 IonicContact OD1-NH1 3.35Å; D133-R136 PolarHBondContact OD1-NH1 3.37Å; D133-K137 WeakPolarHBondContact O-CG 3.21Å; D133-K137 PolarHBondContact O-N 3.01Å
134	F	88.2	Confident	90.3	Very high	131 Å²	131	106.4 Å²	106.4	58%	0.575	53%	0.525	S	S	*	.	H	α-helix	trans	-61.8	-43.6	172.1	-79.5	-62.5	0	0	0	111.6	E130 R131 R136 K137 L138	E130-F134 HydrophobicContact CB-CD2 4.38Å; E130-F134 HydrophobicContact CB-CE2 4.32Å; E130-F134 WeakPolarHBondContact O-CD2 3.42Å; E130-F134 PolarHBondContact O-N 3.42Å; R131-F134 PolarHBondContact O-N 3.3Å; F134-R136 VanDerWaalsContact C-N 3.31Å; F134-R136 PolarHBondContact O-N 3.29Å; F134-K137 PolarHBondContact O-N 3.45Å; F134-L138 WeakPolarHBondContact O-CB 3.39Å; F134-L138 PolarHBondContact O-N 2.74Å
135	Q	91.9	Very high	90.3	Very high	119 Å²	119	104.9 Å²	104.9	56%	0.556	52%	0.52	S	S	*	.	H	α-helix	trans	-60.6	-42.3	176.2	-173	64.2	16.1	0	0	111.2	R131 N132 K137 L138 S139	R131-Q135 WeakPolarHBondContact O-CB 3.38Å; R131-Q135 PolarHBondContact O-N 3.18Å; N132-Q135 PolarHBondContact O-N 3.24Å; Q135-K137 PolarHBondContact O-N 3.05Å; Q135-L138 PolarHBondContact O-N 3.17Å; Q135-S139 PolarHBondContact O-N 3.02Å; Q135-S139 PolarHBondContact O-OG 2.73Å; Q135-S139 VanDerWaalsContact O-OG 3.14Å
136	R	90.5	Very high	90.2	Very high	169 Å²	169	104 Å²	104	64%	0.638	52%	0.517	S	S	*	.	H	α-helix	trans	-61.2	-44.1	176.5	-164.5	-176	-70.1	141.9	-0.4	111.7	N132 D133 F134 S139 E140	N132-R136 PolarHBondContact O-N 2.81Å; D133-R136 PolarHBondContact O-N 3.32Å; D133-R136 IonicContact OD1-CZ 3.33Å; D133-R136 IonicContact OD1-NH1 3.35Å; D133-R136 PolarHBondContact OD1-NH1 3.37Å; F134-R136 VanDerWaalsContact C-N 3.31Å; F134-R136 PolarHBondContact O-N 3.29Å; R136-S139 PolarHBondContact O-N 2.82Å; R136-E140 PolarHBondContact O-N 2.69Å
137	K	91.4	Very high	90.1	Very high	135 Å²	135	106 Å²	106	59%	0.587	53%	0.525	S	S	*	.	H	α-helix	trans	-64.3	-39	175.3	-72.5	177.7	-179.4	176.9	0	112.7	D133 F134 Q135 E140 L141	D133-K137 WeakPolarHBondContact O-CG 3.21Å; D133-K137 PolarHBondContact O-N 3.01Å; F134-K137 PolarHBondContact O-N 3.45Å; Q135-K137 PolarHBondContact O-N 3.05Å; K137-E140 PolarHBondContact O-N 3.37Å; K137-L141 WeakPolarHBondContact O-CB 3.4Å; K137-L141 PolarHBondContact O-N 3.43Å
138	L	88.6	Confident	90	Very high	109 Å²	109	110 Å²	110	57%	0.571	53%	0.534	S	S	*	.	H	α-helix	trans	-64.3	-43.6	176.5	-117.8	160.6	0	0	0	111.2	F134 Q135 E140 L141 N142	F134-L138 WeakPolarHBondContact O-CB 3.39Å; F134-L138 PolarHBondContact O-N 2.74Å; Q135-L138 PolarHBondContact O-N 3.17Å; L138-E140 VanDerWaalsContact C-N 3.35Å; L138-L141 PolarHBondContact O-N 3Å; L138-N142 WeakPolarHBondContact O-CB 3.38Å; L138-N142 PolarHBondContact O-N 3.43Å
139	S	87.9	Confident	89.8	Confident	66 Å²	66	107.7 Å²	107.7	46%	0.462	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-40.4	174.2	-61.2	0	0	0	0	112.3	Q135 R136 N142 A143	Q135-S139 PolarHBondContact O-N 3.02Å; Q135-S139 PolarHBondContact O-OG 2.73Å; Q135-S139 VanDerWaalsContact O-OG 3.14Å; R136-S139 PolarHBondContact O-N 2.82Å; S139-N142 PolarHBondContact O-N 3.01Å; S139-A143 PolarHBondContact O-N 3.22Å
140	E	92	Very high	89.6	Confident	116 Å²	116	107.9 Å²	107.9	54%	0.542	53%	0.53	S	S	.	.	H	α-helix	trans	-63.6	-46.8	175.5	-175.3	177.7	-179.9	0	0	112	R136 K137 L138 N142 A143 Q144	R136-E140 PolarHBondContact O-N 2.69Å; K137-E140 PolarHBondContact O-N 3.37Å; L138-E140 VanDerWaalsContact C-N 3.35Å; E140-N142 VanDerWaalsContact C-N 3.31Å; E140-N142 PolarHBondContact O-N 2.95Å; E140-A143 WeakPolarHBondContact O-CB 3.46Å; E140-A143 PolarHBondContact O-N 3.41Å; E140-Q144 WeakPolarHBondContact O-CG 3.43Å; E140-Q144 PolarHBondContact O-N 3.49Å
141	L	90	Very high	89.7	Confident	93 Å²	93	107.5 Å²	107.5	49%	0.487	53%	0.53	S	S	.	.	H	α-helix	trans	-61.6	-41.3	176.7	-172.1	71	0	0	0	111.4	K137 L138 A143 Q144 I145	K137-L141 WeakPolarHBondContact O-CB 3.4Å; K137-L141 PolarHBondContact O-N 3.43Å; L138-L141 PolarHBondContact O-N 3Å; L141-A143 VanDerWaalsContact C-N 3.31Å; L141-A143 PolarHBondContact O-N 3.19Å; L141-Q144 PolarHBondContact O-N 3.35Å; L141-I145 HydrophobicContact CG-CD1 4.22Å; L141-I145 WeakPolarHBondContact O-CG1 3.49Å; L141-I145 PolarHBondContact O-N 3.13Å
142	N	90.9	Very high	89.5	Confident	110 Å²	110	106.6 Å²	106.6	59%	0.588	53%	0.528	S	S	*	.	H	α-helix	trans	-64.5	-37.4	178.1	-160.2	38.5	0	0	0	111.8	L138 S139 E140 I145 A146	L138-N142 WeakPolarHBondContact O-CB 3.38Å; L138-N142 PolarHBondContact O-N 3.43Å; S139-N142 PolarHBondContact O-N 3.01Å; E140-N142 VanDerWaalsContact C-N 3.31Å; E140-N142 PolarHBondContact O-N 2.95Å; N142-I145 PolarHBondContact O-N 3.17Å; N142-A146 WeakPolarHBondContact O-CB 3.47Å; N142-A146 PolarHBondContact O-N 2.88Å
143	A	90.3	Very high	89.3	Confident	63 Å²	63	110.2 Å²	110.2	52%	0.521	53%	0.534	S	S	.	.	H	α-helix	trans	-64.6	-40.5	173.3	0	0	0	0	0	112.2	S139 E140 L141 A146 F147	S139-A143 PolarHBondContact O-N 3.22Å; E140-A143 WeakPolarHBondContact O-CB 3.46Å; E140-A143 PolarHBondContact O-N 3.41Å; L141-A143 VanDerWaalsContact C-N 3.31Å; L141-A143 PolarHBondContact O-N 3.19Å; A143-A146 PolarHBondContact O-N 2.96Å; A143-F147 PolarHBondContact O-N 2.89Å
144	Q	91.5	Very high	89.3	Confident	105 Å²	105	111.5 Å²	111.5	49%	0.491	54%	0.541	S	S	.	.	H	α-helix	trans	-64.9	-39.7	175.7	-68	177.7	19.7	0	0	112.4	E140 L141 F147 R148	E140-Q144 WeakPolarHBondContact O-CG 3.43Å; E140-Q144 PolarHBondContact O-N 3.49Å; L141-Q144 PolarHBondContact O-N 3.35Å; Q144-F147 PolarHBondContact O-N 2.71Å; Q144-R148 VanDerWaalsContact O-CG 3.22Å; Q144-R148 WeakPolarHBondContact O-CG 3.4Å; Q144-R148 PolarHBondContact O-N 3.37Å
145	I	89.7	Confident	89.3	Confident	91 Å²	91	109.3 Å²	109.3	47%	0.467	54%	0.538	S	S	.	.	H	α-helix	trans	-64.5	-45.4	175.5	-68.4	168.2	0	0	0	110.4	L141 N142 F147 R148 E149	L141-I145 HydrophobicContact CG-CD1 4.22Å; L141-I145 WeakPolarHBondContact O-CG1 3.49Å; L141-I145 PolarHBondContact O-N 3.13Å; N142-I145 PolarHBondContact O-N 3.17Å; I145-F147 VanDerWaalsContact C-N 3.3Å; I145-F147 PolarHBondContact O-N 3.21Å; I145-R148 PolarHBondContact O-N 3.45Å; I145-E149 PolarHBondContact O-N 3.39Å
146	A	88.2	Confident	89	Confident	56 Å²	56	107.6 Å²	107.6	46%	0.463	54%	0.538	S	S	.	.	H	α-helix	trans	-60.3	-39.2	177.1	0	0	0	0	0	112.3	N142 A143 E149 A150	N142-A146 WeakPolarHBondContact O-CB 3.47Å; N142-A146 PolarHBondContact O-N 2.88Å; A143-A146 PolarHBondContact O-N 2.96Å; A146-E149 PolarHBondContact O-N 3.27Å; A146-A150 PolarHBondContact O-N 2.6Å
147	F	88.9	Confident	88.8	Confident	140 Å²	140	102.6 Å²	102.6	61%	0.614	53%	0.529	S	S	*	.	H	α-helix	trans	-63	-47.3	174.5	-173.7	-90.6	0	0	0	111.7	A143 Q144 I145 E149 A150 D151	A143-F147 PolarHBondContact O-N 2.89Å; Q144-F147 PolarHBondContact O-N 2.71Å; I145-F147 VanDerWaalsContact C-N 3.3Å; I145-F147 PolarHBondContact O-N 3.21Å; F147-E149 VanDerWaalsContact C-N 3.34Å; F147-E149 PolarHBondContact O-N 2.92Å; F147-A150 WeakPolarHBondContact O-CB 3.49Å; F147-A150 PolarHBondContact O-N 2.71Å; F147-D151 WeakPolarHBondContact CE1-OD2 3.47Å; F147-D151 PolarHBondContact O-N 3.33Å
148	R	87.7	Confident	88.5	Confident	174 Å²	174	99.8 Å²	99.8	66%	0.657	52%	0.518	S	S	*	.	H	α-helix	trans	-61.5	-41.5	176.6	-65.6	-106.1	-140.3	-161.3	2.6	112	Q144 I145 A150 D151 Y152	Q144-R148 VanDerWaalsContact O-CG 3.22Å; Q144-R148 WeakPolarHBondContact O-CG 3.4Å; Q144-R148 PolarHBondContact O-N 3.37Å; I145-R148 PolarHBondContact O-N 3.45Å; R148-A150 VanDerWaalsContact C-N 3.31Å; R148-A150 PolarHBondContact O-N 3.31Å; R148-D151 PolarHBondContact O-N 3.16Å; R148-Y152 WeakPolarHBondContact O-CD2 3.16Å; R148-Y152 PolarHBondContact O-N 3.37Å
149	E	87.2	Confident	88.3	Confident	95 Å²	95	100.2 Å²	100.2	44%	0.444	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-39.1	178.2	-165.3	-172	153.6	0	0	111.3	I145 A146 F147 Y152 R153	I145-E149 PolarHBondContact O-N 3.39Å; A146-E149 PolarHBondContact O-N 3.27Å; F147-E149 VanDerWaalsContact C-N 3.34Å; F147-E149 PolarHBondContact O-N 2.92Å; E149-Y152 PolarHBondContact O-N 3.02Å; E149-R153 WeakPolarHBondContact O-CG 3.39Å; E149-R153 PolarHBondContact O-N 3.1Å; E149-R153 IonicContact OE1-CZ 3.99Å; E149-R153 IonicContact OE1-NE 2.72Å; E149-R153 PolarHBondContact OE1-NE 3.28Å; E149-R153 VanDerWaalsContact OE1-NE 3.15Å; E149-R153 IonicContact OE1-NH2 2.95Å; E149-R153 PolarHBondContact OE1-NH2 3.26Å
150	A	87.9	Confident	88.2	Confident	56 Å²	56	99.9 Å²	99.9	46%	0.463	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-43.2	173.9	0	0	0	0	0	112	A146 F147 R148 R153 L154	A146-A150 PolarHBondContact O-N 2.6Å; F147-A150 WeakPolarHBondContact O-CB 3.49Å; F147-A150 PolarHBondContact O-N 2.71Å; R148-A150 VanDerWaalsContact C-N 3.31Å; R148-A150 PolarHBondContact O-N 3.31Å; A150-R153 PolarHBondContact O-N 2.94Å; A150-L154 PolarHBondContact O-N 2.65Å
151	D	90.4	Very high	88	Confident	72 Å²	72	99.2 Å²	99.2	39%	0.385	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-45	175.2	-73.7	-17.4	0	0	0	111.7	F147 R148 R153 L154 V155	F147-D151 WeakPolarHBondContact CE1-OD2 3.47Å; F147-D151 PolarHBondContact O-N 3.33Å; R148-D151 PolarHBondContact O-N 3.16Å; D151-R153 VanDerWaalsContact C-N 3.33Å; D151-R153 PolarHBondContact O-N 2.74Å; D151-L154 WeakPolarHBondContact O-CB 3.39Å; D151-L154 PolarHBondContact O-N 3.46Å; D151-V155 WeakPolarHBondContact O-CG2 3.47Å; D151-V155 PolarHBondContact O-N 3.43Å
152	Y	86.7	Confident	87.6	Confident	163 Å²	163	99.9 Å²	99.9	64%	0.639	52%	0.516	S	S	*	.	H	α-helix	trans	-62	-40	176.3	-81.6	-65.2	0	0	0	112.3	R148 E149 L154 V155 C156	R148-Y152 WeakPolarHBondContact O-CD2 3.16Å; R148-Y152 PolarHBondContact O-N 3.37Å; E149-Y152 PolarHBondContact O-N 3.02Å; Y152-L154 VanDerWaalsContact C-N 3.34Å; Y152-V155 PolarHBondContact O-N 2.97Å; Y152-C156 WeakPolarHBondContact O-CB 3.19Å; Y152-C156 PolarHBondContact O-N 3.09Å; Y152-C156 PolarHBondContact O-SG 2.93Å
153	R	86.1	Confident	87.2	Confident	171 Å²	171	102.3 Å²	102.3	65%	0.645	52%	0.521	S	S	*	.	H	α-helix	trans	-64.4	-39.2	175.9	-74	177.7	-177.4	-132	5.9	111.7	E149 A150 D151 C156 S157	E149-R153 WeakPolarHBondContact O-CG 3.39Å; E149-R153 PolarHBondContact O-N 3.1Å; E149-R153 IonicContact OE1-CZ 3.99Å; E149-R153 IonicContact OE1-NE 2.72Å; E149-R153 PolarHBondContact OE1-NE 3.28Å; E149-R153 VanDerWaalsContact OE1-NE 3.15Å; E149-R153 IonicContact OE1-NH2 2.95Å; E149-R153 PolarHBondContact OE1-NH2 3.26Å; A150-R153 PolarHBondContact O-N 2.94Å; D151-R153 VanDerWaalsContact C-N 3.33Å; D151-R153 PolarHBondContact O-N 2.74Å; R153-C156 PolarHBondContact O-N 3.22Å; R153-S157 PolarHBondContact O-N 3.49Å; R153-S157 PolarHBondContact O-OG 3.42Å
154	L	90	Very high	86.8	Confident	107 Å²	107	106.1 Å²	106.1	56%	0.56	53%	0.528	S	S	*	.	H	α-helix	trans	-64.3	-45.5	175.8	-175.6	71.3	0	0	0	111.9	A150 D151 Y152 C156 S157 E158	A150-L154 PolarHBondContact O-N 2.65Å; D151-L154 WeakPolarHBondContact O-CB 3.39Å; D151-L154 PolarHBondContact O-N 3.46Å; Y152-L154 VanDerWaalsContact C-N 3.34Å; L154-C156 VanDerWaalsContact C-N 3.33Å; L154-C156 PolarHBondContact O-N 2.89Å; L154-S157 WeakPolarHBondContact CA-OG 3.37Å; L154-S157 PolarHBondContact O-N 3.4Å; L154-S157 PolarHBondContact O-OG 3.49Å; L154-E158 PolarHBondContact O-N 3.37Å
155	V	87.9	Confident	86.2	Confident	86 Å²	86	105.7 Å²	105.7	52%	0.521	53%	0.526	S	S	.	.	H	α-helix	trans	-60.9	-44.8	176	173.2	0	0	0	0	110.3	D151 Y152 S157 E158 L159	D151-V155 WeakPolarHBondContact O-CG2 3.47Å; D151-V155 PolarHBondContact O-N 3.43Å; Y152-V155 PolarHBondContact O-N 2.97Å; V155-S157 VanDerWaalsContact C-N 3.34Å; V155-S157 PolarHBondContact O-N 3Å; V155-E158 PolarHBondContact O-N 3.44Å; V155-L159 WeakPolarHBondContact O-CB 3.47Å; V155-L159 PolarHBondContact O-N 3.38Å
156	C	85.3	Confident	85.6	Confident	83 Å²	83	105.5 Å²	105.5	56%	0.561	53%	0.529	S	S	*	.	H	α-helix	trans	-61	-40	176.8	-74.6	0	0	0	0	112.7	Y152 R153 L154 L159 A160	Y152-C156 WeakPolarHBondContact O-CB 3.19Å; Y152-C156 PolarHBondContact O-N 3.09Å; Y152-C156 PolarHBondContact O-SG 2.93Å; R153-C156 PolarHBondContact O-N 3.22Å; L154-C156 VanDerWaalsContact C-N 3.33Å; L154-C156 PolarHBondContact O-N 2.89Å; C156-L159 PolarHBondContact O-N 3.45Å; C156-A160 WeakPolarHBondContact O-CB 3.28Å; C156-A160 PolarHBondContact O-N 3.46Å
157	S	85.8	Confident	85	Confident	63 Å²	63	105.5 Å²	105.5	44%	0.441	53%	0.529	S	S	.	.	H	α-helix	trans	-68.9	-39.5	177.8	60.2	0	0	0	0	112.5	R153 L154 V155 A160 R161	R153-S157 PolarHBondContact O-N 3.49Å; R153-S157 PolarHBondContact O-OG 3.42Å; L154-S157 WeakPolarHBondContact CA-OG 3.37Å; L154-S157 PolarHBondContact O-N 3.4Å; L154-S157 PolarHBondContact O-OG 3.49Å; V155-S157 VanDerWaalsContact C-N 3.34Å; V155-S157 PolarHBondContact O-N 3Å; S157-A160 PolarHBondContact O-N 2.94Å; S157-R161 WeakPolarHBondContact O-CB 3.37Å; S157-R161 PolarHBondContact O-N 3.44Å
158	E	86.1	Confident	84	Confident	77 Å²	77	105.4 Å²	105.4	36%	0.36	53%	0.529	S	S	.	.	H	α-helix	trans	-66	-40.3	174.4	-84.1	-58.4	137.7	0	0	111.9	L154 V155 A160 R161 M162	L154-E158 PolarHBondContact O-N 3.37Å; V155-E158 PolarHBondContact O-N 3.44Å; E158-A160 VanDerWaalsContact C-N 3.31Å; E158-A160 PolarHBondContact O-N 3.39Å; E158-R161 WeakPolarHBondContact O-CB 3.42Å; E158-R161 PolarHBondContact O-N 2.85Å; E158-R161 IonicContact OE1-NE 3.95Å; E158-R161 PolarHBondContact OE1-NE 3.26Å; E158-R161 IonicContact OE2-CZ 2.7Å; E158-R161 IonicContact OE2-NE 3.87Å; E158-R161 PolarHBondContact OE2-NE 2.89Å; E158-R161 IonicContact OE2-NH2 2.88Å; E158-R161 PolarHBondContact OE2-NH2 3.14Å; E158-M162 WeakPolarHBondContact O-CG 3.3Å; E158-M162 PolarHBondContact O-N 3.23Å
159	L	84.3	Confident	82.9	Confident	118 Å²	118	102.3 Å²	102.3	62%	0.618	53%	0.525	S	S	*	.	H	α-helix	trans	-66.6	-35.9	178.3	-145.2	150.6	0	0	0	111.2	V155 C156 K163	V155-L159 WeakPolarHBondContact O-CB 3.47Å; V155-L159 PolarHBondContact O-N 3.38Å; C156-L159 PolarHBondContact O-N 3.45Å; L159-K163 WeakPolarHBondContact O-CB 3.45Å; L159-K163 PolarHBondContact O-N 3.22Å; L159-K163 VanDerWaalsContact O-N 3.09Å
160	A	85.5	Confident	81.5	Confident	58 Å²	58	104.7 Å²	104.7	48%	0.479	53%	0.534	S	S	.	.	H	α-helix	trans	-65.1	-43.9	171.2	0	0	0	0	0	112.1	C156 S157 E158 K163 E164	C156-A160 WeakPolarHBondContact O-CB 3.28Å; C156-A160 PolarHBondContact O-N 3.46Å; S157-A160 PolarHBondContact O-N 2.94Å; E158-A160 VanDerWaalsContact C-N 3.31Å; E158-A160 PolarHBondContact O-N 3.39Å; A160-K163 WeakPolarHBondContact O-CB 3.5Å; A160-K163 PolarHBondContact O-N 2.67Å; A160-E164 PolarHBondContact O-N 3.11Å
161	R	86.9	Confident	79.8	Confident	103 Å²	103	109.3 Å²	109.3	39%	0.389	55%	0.546	S	S	.	.	H	α-helix	trans	-61.7	-46.4	176.9	-168.7	-175.7	71.4	76.8	8.3	112.1	S157 E158 K163 E164 E165	S157-R161 WeakPolarHBondContact O-CB 3.37Å; S157-R161 PolarHBondContact O-N 3.44Å; E158-R161 WeakPolarHBondContact O-CB 3.42Å; E158-R161 PolarHBondContact O-N 2.85Å; E158-R161 IonicContact OE1-NE 3.95Å; E158-R161 PolarHBondContact OE1-NE 3.26Å; E158-R161 IonicContact OE2-CZ 2.7Å; E158-R161 IonicContact OE2-NE 3.87Å; E158-R161 PolarHBondContact OE2-NE 2.89Å; E158-R161 IonicContact OE2-NH2 2.88Å; E158-R161 PolarHBondContact OE2-NH2 3.14Å; R161-K163 VanDerWaalsContact C-N 3.29Å; R161-K163 PolarHBondContact O-N 2.99Å; R161-E164 PolarHBondContact O-N 2.96Å; R161-E164 VanDerWaalsContact O-N 3.17Å; R161-E165 IonicContact CZ-OE1 2.85Å; R161-E165 IonicContact NH1-OE1 2.69Å; R161-E165 PolarHBondContact NH1-OE1 3.37Å; R161-E165 IonicContact NH1-OE2 3.73Å; R161-E165 PolarHBondContact O-N 3.43Å
162	M	82.8	Confident	77.9	Confident	106 Å²	106	111 Å²	111	52%	0.522	56%	0.559	S	S	.	*	H	α-helix	trans	-61.4	-38.5	175.7	-71.9	-173.2	-178.4	0	0	111.9	E158 E164 E165 V166	E158-M162 WeakPolarHBondContact O-CG 3.3Å; E158-M162 PolarHBondContact O-N 3.23Å; M162-E164 VanDerWaalsContact C-N 3.31Å; M162-E164 PolarHBondContact O-N 2.89Å; M162-E165 PolarHBondContact O-N 3.2Å; M162-V166 VanDerWaalsContact O-CG2 3.27Å; M162-V166 WeakPolarHBondContact O-CG2 3.45Å; M162-V166 PolarHBondContact O-N 3.07Å
163	K	82.4	Confident	76.2	Confident	161 Å²	161	108 Å²	108	70%	0.7	56%	0.557	S	S	*	*	H	α-helix	trans	-64.6	-37.1	176.5	-173.8	-179.4	176.9	-176.3	0	112	L159 A160 R161 A167	L159-K163 WeakPolarHBondContact O-CB 3.45Å; L159-K163 PolarHBondContact O-N 3.22Å; L159-K163 VanDerWaalsContact O-N 3.09Å; A160-K163 WeakPolarHBondContact O-CB 3.5Å; A160-K163 PolarHBondContact O-N 2.67Å; R161-K163 VanDerWaalsContact C-N 3.29Å; R161-K163 PolarHBondContact O-N 2.99Å; K163-A167 WeakPolarHBondContact O-CB 3.47Å; K163-A167 PolarHBondContact O-N 3.04Å
164	E	80.7	Confident	74	Confident	143 Å²	143	105.5 Å²	105.5	67%	0.668	56%	0.556	S	S	*	*	H	α-helix	trans	-69	-43.3	175.4	-168.7	169.9	-165.5	0	0	111.8	A160 R161 M162 V166 A167 F168	A160-E164 PolarHBondContact O-N 3.11Å; R161-E164 PolarHBondContact O-N 2.96Å; R161-E164 VanDerWaalsContact O-N 3.17Å; M162-E164 VanDerWaalsContact C-N 3.31Å; M162-E164 PolarHBondContact O-N 2.89Å; E164-V166 VanDerWaalsContact C-N 3.34Å; E164-V166 PolarHBondContact O-N 3.43Å; E164-A167 WeakPolarHBondContact O-CB 3.31Å; E164-A167 PolarHBondContact O-N 3.2Å; E164-A167 VanDerWaalsContact O-N 3.15Å; E164-F168 WeakPolarHBondContact O-CB 3.47Å; E164-F168 PolarHBondContact O-N 3.31Å
165	E	79.7	Confident	71.6	Confident	97 Å²	97	109.5 Å²	109.5	45%	0.453	57%	0.572	S	S	.	*	H	α-helix	trans	-60.3	-40.7	173.5	-76.6	-179.1	170.9	0	0	112.4	R161 M162 A167 F168 N169	R161-E165 IonicContact CZ-OE1 2.85Å; R161-E165 IonicContact NH1-OE1 2.69Å; R161-E165 PolarHBondContact NH1-OE1 3.37Å; R161-E165 IonicContact NH1-OE2 3.73Å; R161-E165 PolarHBondContact O-N 3.43Å; M162-E165 PolarHBondContact O-N 3.2Å; E165-A167 VanDerWaalsContact C-N 3.35Å; E165-F168 PolarHBondContact O-N 2.83Å; E165-N169 WeakPolarHBondContact O-CB 3.31Å; E165-N169 PolarHBondContact O-N 3.02Å; E165-N169 PolarHBondContact O-ND2 2.84Å
166	V	77.5	Confident	69.3	Low	86 Å²	86	117 Å²	117	52%	0.521	59%	0.591	S	S	.	*	H	α-helix	trans	-66.3	-37.7	175.4	171.6	0	0	0	0	111.5	M162 E164 K170	M162-V166 VanDerWaalsContact O-CG2 3.27Å; M162-V166 WeakPolarHBondContact O-CG2 3.45Å; M162-V166 PolarHBondContact O-N 3.07Å; E164-V166 VanDerWaalsContact C-N 3.34Å; E164-V166 PolarHBondContact O-N 3.43Å; V166-K170 WeakPolarHBondContact O-CG 3.46Å; V166-K170 PolarHBondContact O-N 3.49Å; V166-K170 VanDerWaalsContact O-N 3.1Å
167	A	74.5	Confident	67	Low	57 Å²	57	116.1 Å²	116.1	47%	0.471	59%	0.586	S	S	.	*	H	α-helix	trans	-67	-41.6	175.4	0	0	0	0	0	111.6	K163 E164 E165 K170 Q171	K163-A167 WeakPolarHBondContact O-CB 3.47Å; K163-A167 PolarHBondContact O-N 3.04Å; E164-A167 WeakPolarHBondContact O-CB 3.31Å; E164-A167 PolarHBondContact O-N 3.2Å; E164-A167 VanDerWaalsContact O-N 3.15Å; E165-A167 VanDerWaalsContact C-N 3.35Å; A167-K170 WeakPolarHBondContact O-CB 3.34Å; A167-K170 PolarHBondContact O-N 3.11Å; A167-Q171 PolarHBondContact O-N 3.34Å
168	F	68	Low	65	Low	138 Å²	138	118.9 Å²	118.9	61%	0.605	60%	0.6	S	S	*	*	H	α-helix	trans	-66.1	-43.4	178.1	-156	-88.9	0	0	0	111.7	E164 E165 K170 Q171 V172	E164-F168 WeakPolarHBondContact O-CB 3.47Å; E164-F168 PolarHBondContact O-N 3.31Å; E165-F168 PolarHBondContact O-N 2.83Å; F168-K170 VanDerWaalsContact C-N 3.29Å; F168-K170 PolarHBondContact O-N 3.03Å; F168-Q171 WeakPolarHBondContact O-CB 3.42Å; F168-Q171 PolarHBondContact O-N 2.98Å; F168-V172 HydrophobicContact CD1-CG2 4.37Å; F168-V172 HydrophobicContact CE1-CG2 4.3Å; F168-V172 PolarHBondContact O-N 3.13Å
169	N	65.2	Low	62.7	Low	108 Å²	108	124.1 Å²	124.1	58%	0.578	63%	0.625	S	S	*	*	H	α-helix	trans	-63	-33.9	175.2	-78.1	-24.4	0	0	0	112.5	E165 Q171 V173	E165-N169 WeakPolarHBondContact O-CB 3.31Å; E165-N169 PolarHBondContact O-N 3.02Å; E165-N169 PolarHBondContact O-ND2 2.84Å; N169-Q171 VanDerWaalsContact C-N 3.32Å; N169-Q171 PolarHBondContact O-N 3.39Å; N169-V173 WeakPolarHBondContact O-CG2 3.29Å; N169-V173 PolarHBondContact O-N 2.6Å
170	K	57.7	Low	60.3	Low	146 Å²	146	125.3 Å²	125.3	64%	0.635	62%	0.622	S	S	*	*	H	α-helix	trans	-64.4	-36.4	171.6	-81.6	-176.8	178.1	-175.3	0	112.3	V166 A167 F168 V173 N174	V166-K170 WeakPolarHBondContact O-CG 3.46Å; V166-K170 PolarHBondContact O-N 3.49Å; V166-K170 VanDerWaalsContact O-N 3.1Å; A167-K170 WeakPolarHBondContact O-CB 3.34Å; A167-K170 PolarHBondContact O-N 3.11Å; F168-K170 VanDerWaalsContact C-N 3.29Å; F168-K170 PolarHBondContact O-N 3.03Å; K170-V173 PolarHBondContact O-N 3.12Å; K170-N174 WeakPolarHBondContact O-CB 3.36Å; K170-N174 PolarHBondContact O-N 2.82Å
171	Q	51.9	Low	58.2	Low	152 Å²	152	126 Å²	126	71%	0.71	62%	0.623	S	S	*	*	H	α-helix	trans	-70.9	-32	-177.7	-154.6	166.9	1.5	0	0	112.3	A167 F168 N169	A167-Q171 PolarHBondContact O-N 3.34Å; F168-Q171 WeakPolarHBondContact O-CB 3.42Å; F168-Q171 PolarHBondContact O-N 2.98Å; N169-Q171 VanDerWaalsContact C-N 3.32Å; N169-Q171 PolarHBondContact O-N 3.39Å
172	V	51.7	Low	56.3	Low	109 Å²	109	125.7 Å²	125.7	66%	0.661	63%	0.634	S	S	*	*	H	α-helix	trans	-75	-27	175.9	179.4	0	0	0	0	112.6	F168	F168-V172 HydrophobicContact CD1-CG2 4.37Å; F168-V172 HydrophobicContact CE1-CG2 4.3Å; F168-V172 PolarHBondContact O-N 3.13Å
173	V	50.6	Low	54.4	Low	99 Å²	99	123.5 Å²	123.5	60%	0.6	63%	0.634	S	S	*	*	H	α-helix	trans	-91.5	-8.8	-178.5	-179.5	0	0	0	0	112.8	N169 K170 E175	N169-V173 WeakPolarHBondContact O-CG2 3.29Å; N169-V173 PolarHBondContact O-N 2.6Å; K170-V173 PolarHBondContact O-N 3.12Å; V173-E175 VanDerWaalsContact C-N 3.28Å; V173-E175 PolarHBondContact O-N 3.23Å; V173-E175 VanDerWaalsContact O-N 3.1Å
174	N	40.3	Very low	52.5	Low	118 Å²	118	118.1 Å²	118.1	63%	0.631	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	9.6	-169.4	-153.3	26.7	0	0	0	116.5	K170	K170-N174 WeakPolarHBondContact O-CB 3.36Å; K170-N174 PolarHBondContact O-N 2.82Å
175	E	38.4	Very low	50.7	Low	192 Å²	192	115.7 Å²	115.7	90%	0.897	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-15.1	172.2	-84.7	-163	160.4	0	0	114.2	V173	V173-E175 VanDerWaalsContact C-N 3.28Å; V173-E175 PolarHBondContact O-N 3.23Å; V173-E175 VanDerWaalsContact O-N 3.1Å
176	R	39.3	Very low	49.1	Very low	242 Å²	242	116.4 Å²	116.4	91%	0.913	61%	0.61	S	S	*	*	S	Bend	trans	-152.7	74.9	175.4	-72.9	-171.4	179.8	159.9	0.4	113.5
177	S	38	Very low	47.5	Very low	65 Å²	65	117.7 Å²	117.7	46%	0.455	61%	0.614	S	S	.	*			trans	-163.7	118.9	152	50.6	0	0	0	0	111.7
178	V	43.6	Very low	45.9	Very low	122 Å²	122	119 Å²	119	74%	0.739	62%	0.615	S	S	*	*			trans	-53.6	132.4	171.4	173.4	0	0	0	0	110	Y180	V178-Y180 PolarHBondContact O-N 3.37Å
179	E	37.3	Very low	44.7	Very low	186 Å²	186	117.4 Å²	117.4	87%	0.869	62%	0.622	S	S	*	*			trans	-57	102.3	-177	-67.1	171.5	145.4	0	0	111.6
180	Y	34.2	Very low	43.7	Very low	143 Å²	143	118.7 Å²	118.7	56%	0.561	63%	0.628	S	S	*	*			trans	-97.8	135.3	157.1	-73.3	-75	0	0	0	108.5	V178	V178-Y180 PolarHBondContact O-N 3.37Å
181	S	42.1	Very low	42.6	Very low	73 Å²	73	116.8 Å²	116.8	51%	0.51	63%	0.629	S	S	.	*			trans	-51.6	145.4	172.3	-178.6	0	0	0	0	110.4	A183 S184 Q185	S181-A183 PolarHBondContact O-N 3.24Å; S181-S184 WeakPolarHBondContact O-CA 3.24Å; S181-S184 WeakPolarHBondContact O-CB 3.46Å; S181-S184 PolarHBondContact O-N 3.24Å; S181-Q185 PolarHBondContact O-N 3.41Å; S181-Q185 VanDerWaalsContact O-N 3.11Å
182	P	47	Very low	41.6	Very low	96 Å²	96	114.2 Å²	114.2	62%	0.623	63%	0.627	S	S	*	*	H	α-helix	trans	-51.7	-33	-175.6	-27.7	33.8	0	0	0	114.3	I186	P182-I186 WeakPolarHBondContact O-CG1 3.23Å; P182-I186 PolarHBondContact O-N 2.92Å
183	A	43.2	Very low	40.7	Very low	61 Å²	61	114.8 Å²	114.8	50%	0.504	63%	0.633	S	S	.	*	H	α-helix	trans	-70.1	-36.9	175.2	0	0	0	0	0	112.6	S181 I186 L187	S181-A183 PolarHBondContact O-N 3.24Å; A183-I186 PolarHBondContact O-N 2.86Å; A183-L187 WeakPolarHBondContact O-CG 3.39Å; A183-L187 PolarHBondContact O-N 3.39Å; A183-L187 VanDerWaalsContact O-N 3.09Å
184	S	42.7	Very low	39.8	Very low	47 Å²	47	117.3 Å²	117.3	33%	0.329	64%	0.644	S	S	.	*	H	α-helix	trans	-71.5	-31.5	178.3	-53.2	0	0	0	0	112.1	S181 V188	S181-S184 WeakPolarHBondContact O-CA 3.24Å; S181-S184 WeakPolarHBondContact O-CB 3.46Å; S181-S184 PolarHBondContact O-N 3.24Å; S184-V188 VanDerWaalsContact O-CB 3.28Å; S184-V188 WeakPolarHBondContact O-CB 3.48Å; S184-V188 WeakPolarHBondContact O-CG2 3.39Å; S184-V188 PolarHBondContact O-N 3.44Å
185	Q	41.9	Very low	39.5	Very low	93 Å²	93	117.1 Å²	117.1	44%	0.435	65%	0.649	S	S	.	*	H	α-helix	trans	-70.2	-35.4	173.5	-74.1	-174.2	-8.8	0	0	112.5	S181 S189	S181-Q185 PolarHBondContact O-N 3.41Å; S181-Q185 VanDerWaalsContact O-N 3.11Å; Q185-S189 WeakPolarHBondContact O-CB 3.3Å; Q185-S189 PolarHBondContact O-N 2.88Å; Q185-S189 PolarHBondContact O-OG 3.47Å
186	I	47	Very low	39	Very low	111 Å²	111	115.5 Å²	115.5	57%	0.569	65%	0.646	S	S	*	*	H	α-helix	trans	-67.6	-43.1	175.1	-64.3	170	0	0	0	110	P182 A183 S189 L190	P182-I186 WeakPolarHBondContact O-CG1 3.23Å; P182-I186 PolarHBondContact O-N 2.92Å; A183-I186 PolarHBondContact O-N 2.86Å; I186-S189 PolarHBondContact O-N 3.44Å; I186-L190 HydrophobicContact CG2-CD1 4.26Å; I186-L190 WeakPolarHBondContact O-CG 3.48Å; I186-L190 PolarHBondContact O-N 2.95Å
187	L	42.2	Very low	38.9	Very low	114 Å²	114	109.4 Å²	109.4	60%	0.597	64%	0.638	S	S	*	*	H	α-helix	trans	-67.4	-43.4	178.2	-71.5	169.9	0	0	0	112.3	A183 S189 L190 T191	A183-L187 WeakPolarHBondContact O-CG 3.39Å; A183-L187 PolarHBondContact O-N 3.39Å; A183-L187 VanDerWaalsContact O-N 3.09Å; L187-S189 VanDerWaalsContact C-N 3.34Å; L187-S189 PolarHBondContact O-N 3.37Å; L187-L190 PolarHBondContact O-N 3.13Å; L187-T191 PolarHBondContact O-N 3.06Å; L187-T191 VanDerWaalsContact O-N 3.17Å; L187-T191 PolarHBondContact O-OG1 2.67Å
188	V	42	Very low	38.5	Very low	83 Å²	83	112.9 Å²	112.9	50%	0.503	66%	0.656	S	S	.	*	H	α-helix	trans	-70.4	-30.7	177.9	174.5	0	0	0	0	111.9	S184 L190 T191	S184-V188 VanDerWaalsContact O-CB 3.28Å; S184-V188 WeakPolarHBondContact O-CB 3.48Å; S184-V188 WeakPolarHBondContact O-CG2 3.39Å; S184-V188 PolarHBondContact O-N 3.44Å; V188-L190 VanDerWaalsContact C-N 3.25Å; V188-L190 PolarHBondContact O-N 3.43Å; V188-T191 CarbonylContact O-C 3.43Å; V188-T191 PolarHBondContact O-N 3.27Å
189	S	43	Very low	37.7	Very low	105 Å²	105	111.1 Å²	111.1	73%	0.734	65%	0.649	S	S	*	*	H	α-helix	trans	-69.8	-23.3	174.5	-59.1	0	0	0	0	113	Q185 I186 L187	Q185-S189 WeakPolarHBondContact O-CB 3.3Å; Q185-S189 PolarHBondContact O-N 2.88Å; Q185-S189 PolarHBondContact O-OG 3.47Å; I186-S189 PolarHBondContact O-N 3.44Å; L187-S189 VanDerWaalsContact C-N 3.34Å; L187-S189 PolarHBondContact O-N 3.37Å
190	L	43.1	Very low	37.1	Very low	136 Å²	136	109.1 Å²	109.1	71%	0.712	65%	0.645	S	S	*	*	H	α-helix	trans	-88.1	-21	175.9	-71.3	169.1	0	0	0	112.7	I186 L187 V188	I186-L190 HydrophobicContact CG2-CD1 4.26Å; I186-L190 WeakPolarHBondContact O-CG 3.48Å; I186-L190 PolarHBondContact O-N 2.95Å; L187-L190 PolarHBondContact O-N 3.13Å; V188-L190 VanDerWaalsContact C-N 3.25Å; V188-L190 PolarHBondContact O-N 3.43Å
191	T	36.3	Very low	36.9	Very low	106 Å²	106	112 Å²	112	65%	0.65	66%	0.662	S	S	*	*	S	Bend	trans	-139	78.6	-175.9	61.6	0	0	0	0	111.9	L187 V188	L187-T191 PolarHBondContact O-N 3.06Å; L187-T191 VanDerWaalsContact O-N 3.17Å; L187-T191 PolarHBondContact O-OG1 2.67Å; V188-T191 CarbonylContact O-C 3.43Å; V188-T191 PolarHBondContact O-N 3.27Å
192	S	29.4	Very low	36.3	Very low	97 Å²	97	117.2 Å²	117.2	68%	0.678	68%	0.676	S	S	*	*			trans	-175.2	117.9	134.1	-162.5	0	0	0	0	112
193	P	33.4	Very low	35.3	Very low	122 Å²	122	119.9 Å²	119.9	79%	0.792	68%	0.684	S	S	*	*			trans	-78.2	134.6	162.3	30.6	-26.8	0	0	0	110.6
194	N	31.3	Very low	34.6	Very low	152 Å²	152	129 Å²	129	81%	0.813	71%	0.706	S	S	*	*			trans	75.4	109	163.1	-122.5	1	0	0	0	117.9
195	P	33.8	Very low	33.9	Very low	114 Å²	114	132.5 Å²	132.5	74%	0.74	73%	0.725	S	S	*	*			trans	-93	130.7	175.8	35.1	-26.5	0	0	0	110.5
196	D	28.9	Very low	33.6	Very low	158 Å²	158	133.7 Å²	133.7	85%	0.845	74%	0.741	S	S	*	*			trans	-124.6	135.8	158.8	-96.4	-34.4	0	0	0	110.6
197	P	36.5	Very low	32.6	Very low	113 Å²	113	134.6 Å²	134.6	73%	0.734	75%	0.751	S	S	*	*			trans	-107	127.9	-159.7	34.9	-21.5	0	0	0	111.7
198	V	29.6	Very low	32.3	Very low	139 Å²	139	134.6 Å²	134.6	84%	0.842	76%	0.758	S	S	*	*			trans	-133.2	95.6	167.4	-170.3	0	0	0	0	111.8
199	S	26.7	Very low	31.7	Very low	84 Å²	84	141.7 Å²	141.7	59%	0.587	78%	0.776	S	S	*	*			trans	9.1	124.9	144.2	64.1	0	0	0	0	121.4
200	N	25.8	Very low	31	Very low	145 Å²	145	142.9 Å²	142.9	78%	0.775	78%	0.778	S	S	*	*				54.6	104.1	121.3	-57.5	-28.3	0	0	0	119.4
201	H	30	Very low	30.8	Very low	202 Å²	202	142.1 Å²	142.1	94%	0.935	78%	0.782	S	S	*	*			trans	-132.8	131.1	141.7	-96.2	-75.3	0	0	0	113.2
202	K	27.7	Very low	30.5	Very low	183 Å²	183	142.9 Å²	142.9	80%	0.796	79%	0.791	S	S	*	*			trans	-68.5	141.7	-165.8	-77.4	166.8	167.5	173.9	0	115.3
203	L	26.8	Very low	30.4	Very low	152 Å²	152	143.9 Å²	143.9	80%	0.796	79%	0.794	S	S	*	*			trans	37.1	115.3	130.7	-73.1	119.3	0	0	0	118.8
204	R	28.7	Very low	30.3	Very low	253 Å²	253	144.8 Å²	144.8	96%	0.955	79%	0.792	S	S	*	*			trans	-131.6	117.6	146.3	-134.3	178.3	-173.2	-176.5	1.9	110.3
205	T	27.8	Very low	30.2	Very low	120 Å²	120	147.3 Å²	147.3	74%	0.736	80%	0.796	S	S	*	*			trans	-71.6	150.4	-174.5	8.5	0	0	0	0	112.7
206	P	35.3	Very low	30.1	Very low	118 Å²	118	149.9 Å²	149.9	77%	0.766	80%	0.798	S	S	*	*			trans	-91	144.7	-174.7	35.9	-30.7	0	0	0	111.8
207	V	26.4	Very low	30.1	Very low	130 Å²	130	150.1 Å²	150.1	79%	0.788	80%	0.798	S	S	*	*			trans	-112.4	124	171.6	177.8	0	0	0	0	109.3
208	P	36.9	Very low	30	Very low	114 Å²	114	150.4 Å²	150.4	74%	0.74	80%	0.8	S	S	*	*			trans	-89.9	139.3	179	34	-29.8	0	0	0	111.4
209	R	28.8	Very low	30.1	Very low	232 Å²	232	147.7 Å²	147.7	88%	0.875	79%	0.792	S	S	*	*			trans	-134.2	101	167.1	-101.9	-173	175.2	105.3	-1.7	111
210	V	27	Very low	30.3	Very low	130 Å²	130	149.3 Å²	149.3	79%	0.788	80%	0.801	S	S	*	*				29.6	134.7	130	-171.2	0	0	0	0	119
211	P	39.7	Very low	30.6	Very low	121 Å²	121	149.3 Å²	149.3	79%	0.786	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.2	137.2	-166.4	35.9	-31.8	0	0	0	113
212	S	30.4	Very low	30.7	Very low	121 Å²	121	145.2 Å²	145.2	85%	0.846	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-100	119	169.2	-59.9	0	0	0	0	109.3
213	T	26.2	Very low	31.1	Very low	119 Å²	119	141.4 Å²	141.4	73%	0.73	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-61	125.2	165.9	46.8	0	0	0	0	110.6
214	D	32	Very low	31.2	Very low	141 Å²	141	141.8 Å²	141.8	75%	0.754	79%	0.79	S	S	*	*			trans	-151.1	119.8	148.6	-89.1	-36.4	0	0	0	108.9	H216	D214-H216 PolarHBondContact O-N 3.04Å
215	F	29.2	Very low	31.3	Very low	205 Å²	205	135 Å²	135	90%	0.899	78%	0.779	S	S	*	*			trans	-67.8	92.1	-178.7	-74.6	-98	0	0	0	110
216	H	31.4	Very low	31.5	Very low	168 Å²	168	135 Å²	135	78%	0.778	78%	0.784	S	S	*	*			trans	-95.1	117	159.8	-68.6	-67.4	0	0	0	108.3	D214	D214-H216 PolarHBondContact O-N 3.04Å
217	L	29.5	Very low	31.3	Very low	162 Å²	162	137.8 Å²	137.8	85%	0.848	78%	0.784	S	S	*	*			trans	-43.9	137.5	162.7	-71	162.8	0	0	0	108.6	A219	L217-A219 PolarHBondContact O-N 3.46Å
218	P	33.2	Very low	31.4	Very low	120 Å²	120	143.2 Å²	143.2	78%	0.779	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-60	118.9	-170.9	23.9	-31.6	0	0	0	109
219	A	31.7	Very low	31	Very low	81 Å²	81	148.2 Å²	148.2	67%	0.669	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-56.2	128.2	171.4	0	0	0	0	0	108	L217 V221	L217-A219 PolarHBondContact O-N 3.46Å; A219-V221 PolarHBondContact O-N 3.18Å; A219-V221 VanDerWaalsContact O-N 3.09Å
220	P	30.9	Very low	31	Very low	119 Å²	119	146.6 Å²	146.6	77%	0.773	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-57.3	120.2	-177.9	20	-29.3	0	0	0	108.9	T222	P220-T222 PolarHBondContact O-N 3.48Å
221	V	33.8	Very low	31.1	Very low	144 Å²	144	146.1 Å²	146.1	87%	0.873	79%	0.792	S	S	*	*			trans	-67.7	104.8	-177.5	179.9	0	0	0	0	107.1	A219	A219-V221 PolarHBondContact O-N 3.18Å; A219-V221 VanDerWaalsContact O-N 3.09Å
222	T	30.4	Very low	30.5	Very low	117 Å²	117	144.8 Å²	144.8	72%	0.718	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-70.6	138.6	175.7	37	0	0	0	0	109.8	P220 I224	P220-T222 PolarHBondContact O-N 3.48Å; T222-I224 PolarHBondContact O-N 3.22Å
223	P	36.4	Very low	30.8	Very low	102 Å²	102	146 Å²	146	66%	0.662	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-68.4	132.8	-177.5	26.1	-32.1	0	0	0	110.7	P225	P223-P225 WeakPolarHBondContact O-CD 3.49Å
224	I	30.4	Very low	31.1	Very low	161 Å²	161	145 Å²	145	83%	0.826	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-73.5	118.8	173.3	-61.9	173.2	0	0	0	107.4	T222 S226	T222-I224 PolarHBondContact O-N 3.22Å; I224-S226 PolarHBondContact O-N 3.09Å; I224-S226 VanDerWaalsContact O-N 3.14Å
225	P	30.3	Very low	30.9	Very low	111 Å²	111	140.9 Å²	140.9	72%	0.721	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-63.4	118.3	-177.7	-19	30.6	0	0	0	110.7	P223 K227	P223-P225 WeakPolarHBondContact O-CD 3.49Å; P225-K227 PolarHBondContact O-N 3.3Å
226	S	31.6	Very low	31	Very low	120 Å²	120	141 Å²	141	84%	0.839	78%	0.777	S	S	*	*			trans	-59.5	111	166.9	-177.4	0	0	0	0	108.3	I224 R228	I224-S226 PolarHBondContact O-N 3.09Å; I224-S226 VanDerWaalsContact O-N 3.14Å; S226-R228 PolarHBondContact O-N 3.25Å
227	K	31.1	Very low	30.8	Very low	176 Å²	176	140.1 Å²	140.1	77%	0.765	78%	0.775	S	S	*	*			trans	-58.9	122.4	-178.1	-75	179.3	176.2	178.8	0	109.4	P225 Y229	P225-K227 PolarHBondContact O-N 3.3Å; K227-Y229 PolarHBondContact O-N 3.38Å
228	R	28.4	Very low	30.7	Very low	243 Å²	243	142.5 Å²	142.5	92%	0.917	77%	0.773	S	S	*	*			trans	-50.2	110.1	166.6	-68.5	-175.6	-176	-170.1	0.6	109.1	S226 K230	S226-R228 PolarHBondContact O-N 3.25Å; R228-K230 PolarHBondContact O-N 2.92Å
229	Y	29	Very low	30.3	Very low	219 Å²	219	142.5 Å²	142.5	86%	0.859	77%	0.767	S	S	*	*			trans	-61.1	117.9	152.1	-82.6	-85.4	0	0	0	106.1	K227 V231	K227-Y229 PolarHBondContact O-N 3.38Å; Y229-V231 PolarHBondContact O-N 2.85Å
230	K	28.3	Very low	30	Very low	199 Å²	199	144.3 Å²	144.3	87%	0.865	77%	0.769	S	S	*	*			trans	-60.7	105.5	166.2	-79.2	-176.6	176.4	-178.5	0	106.3	R228 P232	R228-K230 PolarHBondContact O-N 2.92Å; K230-P232 WeakPolarHBondContact O-CD 3.36Å
231	V	28.6	Very low	29.7	Very low	119 Å²	119	145.5 Å²	145.5	72%	0.721	77%	0.769	S	S	*	*			trans	-57.9	118.9	171.3	179.6	0	0	0	0	106.9	Y229	Y229-V231 PolarHBondContact O-N 2.85Å
232	P	28	Very low	29.2	Very low	94 Å²	94	143.9 Å²	143.9	61%	0.61	76%	0.759	S	S	*	*			trans	-60.9	136.8	176.5	-19.6	31.3	0	0	0	109.3	K230 A234 G235	K230-P232 WeakPolarHBondContact O-CD 3.36Å; P232-A234 PolarHBondContact O-N 3.12Å; P232-G235 PolarHBondContact O-N 3.21Å
233	P	37.1	Very low	29	Very low	145 Å²	145	143.7 Å²	143.7	94%	0.942	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	8.8	-171.1	-18.5	30.7	0	0	0	116.2
234	A	31.6	Very low	28.5	Very low	100 Å²	100	145.4 Å²	145.4	83%	0.826	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.7	10.9	-172.9	0	0	0	0	0	114.9	P232	P232-A234 PolarHBondContact O-N 3.12Å
235	G	27.8	Very low	28.3	Very low	53 Å²	53	145.1 Å²	145.1	55%	0.546	76%	0.762	S	S	.	*			trans	-109.9	98.1	180	0	0	0	0	0	112.7	P232 M237	P232-G235 PolarHBondContact O-N 3.21Å; G235-M237 PolarHBondContact O-N 3.11Å; G235-M237 VanDerWaalsContact O-N 3.08Å
236	R	31	Very low	28.1	Very low	207 Å²	207	146.8 Å²	146.8	78%	0.781	76%	0.764	S	S	*	*			trans	-60.9	109.6	159.1	-68	-167.9	-144.6	-115.5	5.3	107.1	W238	R236-W238 PolarHBondContact O-N 3.33Å
237	M	27.2	Very low	27.8	Very low	150 Å²	150	148.1 Å²	148.1	74%	0.739	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	126.2	175.3	-154.7	163.4	67	0	0	106.7	G235	G235-M237 PolarHBondContact O-N 3.11Å; G235-M237 VanDerWaalsContact O-N 3.08Å
238	W	28	Very low	27.7	Very low	213 Å²	213	148.3 Å²	148.3	81%	0.807	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	91.4	33.6	176.4	-38.7	107.1	0	0	0	118.5	R236 V240	R236-W238 PolarHBondContact O-N 3.33Å; W238-V240 PolarHBondContact O-N 3.42Å
239	D	24.9	Very low	27.6	Very low	120 Å²	120	145.4 Å²	145.4	64%	0.642	77%	0.765	S	S	*	*			trans	-77.4	96.4	151.6	-80	-36.3	0	0	0	108.2	D241	D239-D241 PolarHBondContact O-N 3.22Å
240	V	25.8	Very low	27.4	Very low	118 Å²	118	143.2 Å²	143.2	72%	0.715	77%	0.767	S	S	*	*			trans	-72.8	104	160.7	176.1	0	0	0	0	105.1	W238 V242	W238-V240 PolarHBondContact O-N 3.42Å; V240-V242 VanDerWaalsContact C-N 3.26Å; V240-V242 PolarHBondContact O-N 2.94Å
241	D	23.5	Very low	27.3	Very low	145 Å²	145	143 Å²	143	78%	0.775	77%	0.766	S	S	*	*			trans	-57.4	91	172.5	-76.8	-40.2	0	0	0	109.4	D239 T243	D239-D241 PolarHBondContact O-N 3.22Å; D241-T243 VanDerWaalsContact C-N 3.3Å; D241-T243 PolarHBondContact O-N 3.2Å
242	V	24.7	Very low	27.2	Very low	110 Å²	110	142 Å²	142	67%	0.667	76%	0.764	S	S	*	*			trans	-71.1	97	165.2	179.8	0	0	0	0	105.2	V240 N244	V240-V242 VanDerWaalsContact C-N 3.26Å; V240-V242 PolarHBondContact O-N 2.94Å; V242-N244 PolarHBondContact O-N 2.84Å
243	T	25.8	Very low	27	Very low	113 Å²	113	145.5 Å²	145.5	69%	0.693	78%	0.778	S	S	*	*			trans	-57.5	101.6	171.6	32	0	0	0	0	108.5	D241 N245	D241-T243 VanDerWaalsContact C-N 3.3Å; D241-T243 PolarHBondContact O-N 3.2Å; T243-N245 PolarHBondContact O-N 3.33Å
244	N	25.3	Very low	26.6	Very low	137 Å²	137	144.8 Å²	144.8	73%	0.733	77%	0.771	S	S	*	*			trans	-63.6	81.5	173	-79.9	-28.6	0	0	0	109.7	V242 L246	V242-N244 PolarHBondContact O-N 2.84Å; N244-L246 PolarHBondContact O-N 3.5Å
245	N	27.1	Very low	26.3	Very low	155 Å²	155	146.3 Å²	146.3	83%	0.829	77%	0.77	S	S	*	*			trans	-77.1	65.9	164.5	-76.1	-16.2	0	0	0	109.3	T243	T243-N245 PolarHBondContact O-N 3.33Å
246	L	26.3	Very low	26.3	Very low	146 Å²	146	149.7 Å²	149.7	76%	0.764	78%	0.783	S	S	*	*			trans	-120.2	76.2	167.2	-91.8	162	0	0	0	107	N244	N244-L246 PolarHBondContact O-N 3.5Å
247	N	25.5	Very low	26	Very low	148 Å²	148	148.3 Å²	148.3	79%	0.791	79%	0.785	S	S	*	*			trans	-173.7	54.3	154	-93.7	-26.2	0	0	0	112	K249	N247-K249 PolarHBondContact O-N 3.47Å
248	D	27.6	Very low	25.8	Very low	181 Å²	181	146 Å²	146	97%	0.968	79%	0.791	S	S	*	*			trans	-79.9	66.9	158	-84.9	-23.1	0	0	0	109.4
249	K	27.6	Very low	25.8	Very low	182 Å²	182	143.5 Å²	143.5	79%	0.791	79%	0.791	S	S	*	*			trans	-104.4	87.9	166.1	-138.5	177.7	-170.2	177	0	108.1	N247 K251	N247-K249 PolarHBondContact O-N 3.47Å; K249-K251 PolarHBondContact O-N 3.26Å
250	L	24.3	Very low	25.7	Very low	172 Å²	172	144 Å²	144	90%	0.901	79%	0.794	S	S	*	*			trans	25.8	92.1	144.1	-149.6	97.5	0	0	0	115.3
251	K	26.7	Very low	25.7	Very low	194 Å²	194	146.4 Å²	146.4	84%	0.843	79%	0.794	S	S	*	*			trans	-157.4	101	155.3	-111	164.3	-171.6	-175.9	0	112.5	K249	K249-K251 PolarHBondContact O-N 3.26Å
252	S	26.5	Very low	25.8	Very low	98 Å²	98	147.6 Å²	147.6	69%	0.685	80%	0.801	S	S	*	*			trans	48.6	106.2	140.2	58.1	0	0	0	0	119.3	T254	S252-T254 PolarHBondContact O-N 3.02Å
253	N	22.4	Very low	25.8	Very low	168 Å²	168	147.9 Å²	147.9	90%	0.898	80%	0.803	S	S	*	*			trans	-2.7	103.8	141.6	-65.2	-13.8	0	0	0	115
254	T	28.8	Very low	25.8	Very low	131 Å²	131	150.3 Å²	150.3	80%	0.804	81%	0.81	S	S	*	*			trans	-141.8	120.4	146.7	-36.9	0	0	0	0	108.6	S252	S252-T254 PolarHBondContact O-N 3.02Å
255	T	26.5	Very low	25.6	Very low	131 Å²	131	150.7 Å²	150.7	80%	0.804	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-52.9	140	-176	-15.5	0	0	0	0	112.2	Q257	T255-Q257 PolarHBondContact O-N 3.4Å
256	P	26.7	Very low	25.6	Very low	125 Å²	125	150.7 Å²	150.7	81%	0.812	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-78.1	120.1	-173	30.5	-31.9	0	0	0	111.1
257	Q	24.8	Very low	25.5	Very low	177 Å²	177	150.1 Å²	150.1	83%	0.827	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-92.2	118.5	165	-86.2	-173.8	-11.7	0	0	109.7	T255 I259	T255-Q257 PolarHBondContact O-N 3.4Å; Q257-I259 PolarHBondContact O-N 3.45Å
258	A	23.8	Very low	25.5	Very low	103 Å²	103	147.6 Å²	147.6	85%	0.851	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-61.5	123	167.2	0	0	0	0	0	110.1
259	I	26.3	Very low	25.5	Very low	159 Å²	159	147.1 Å²	147.1	82%	0.815	80%	0.799	S	S	*	*			trans	-126.3	112.4	161.1	-62	179.6	0	0	0	107.4	Q257	Q257-I259 PolarHBondContact O-N 3.45Å
260	D	24.8	Very low	25.3	Very low	131 Å²	131	147.4 Å²	147.4	70%	0.701	80%	0.803	S	S	*	*			trans	-57	140.4	176.3	-108.8	-47.5	0	0	0	112.9
261	K	24.6	Very low	25.4	Very low	168 Å²	168	146.8 Å²	146.8	73%	0.73	80%	0.799	S	S	*	*			trans	23.6	117.7	136.6	-63.3	170.9	-176.1	166	0	117.3
262	N	25.3	Very low	25.3	Very low	171 Å²	171	143.6 Å²	143.6	91%	0.914	80%	0.796	S	S	*	*				-148.8	102.3	129.5	-92.5	-29.2	0	0	0	110.5
263	V	24.3	Very low	25.3	Very low	116 Å²	116	144.2 Å²	144.2	70%	0.703	80%	0.798	S	S	*	*			trans	-62.1	121.3	163.5	170	0	0	0	0	108	L265	V263-L265 HydrophobicContact CG1-CD1 3.81Å; V263-L265 HydrophobicContact CG1-CG 3.9Å
264	L	25.6	Very low	25.4	Very low	163 Å²	163	141.5 Å²	141.5	85%	0.853	79%	0.792	S	S	*	*			trans	-107.8	96.3	159.6	-141.7	113.4	0	0	0	107.2
265	L	23	Very low	25.3	Very low	146 Å²	146	142.6 Å²	142.6	76%	0.764	79%	0.793	S	S	*	*			trans	-60.5	129	166.8	-87.6	134.4	0	0	0	109.4	V263	V263-L265 HydrophobicContact CG1-CD1 3.81Å; V263-L265 HydrophobicContact CG1-CG 3.9Å
266	I	26.1	Very low	25.2	Very low	155 Å²	155	141.3 Å²	141.3	80%	0.795	80%	0.796	S	S	*	*			trans	-111.3	115.2	154.9	-64.3	178.5	0	0	0	106
267	D	24.6	Very low	25.1	Very low	134 Å²	134	140.7 Å²	140.7	72%	0.717	80%	0.795	S	S	*	*			trans	-45.6	128.1	172.5	-98	-40.8	0	0	0	111.9
268	S	25.2	Very low	25.2	Very low	95 Å²	95	144.2 Å²	144.2	66%	0.664	80%	0.8	S	S	*	*				76.5	89.7	78.6	-54.9	0	0	0	0	113
269	D	26.8	Very low	25.3	Very low	170 Å²	170	148.9 Å²	148.9	91%	0.909	80%	0.801	S	S	*	*			trans	-111.5	117.4	149	-95.4	-29.2	0	0	0	108.4	I271	D269-I271 PolarHBondContact O-N 2.94Å
270	E	24.9	Very low	25.3	Very low	188 Å²	188	153.4 Å²	153.4	88%	0.879	81%	0.808	S	S	*	*			trans	-79.1	107.5	-165.7	-163.2	177.4	-166.7	0	0	110.5
271	I	26.4	Very low	25.3	Very low	159 Å²	159	156.3 Å²	156.3	82%	0.815	82%	0.817	S	S	*	*			trans	-116.6	97.9	167.9	-56.7	177.9	0	0	0	108.9	D269 P273	D269-I271 PolarHBondContact O-N 2.94Å; I271-P273 WeakPolarHBondContact O-CD 3.31Å
272	T	23.9	Very low	25.4	Very low	127 Å²	127	159.6 Å²	159.6	78%	0.779	83%	0.825	S	S	*	*			trans	-46.1	117.3	174.1	-18.7	0	0	0	0	113
273	P	26.2	Very low	25.2	Very low	112 Å²	112	157.2 Å²	157.2	73%	0.727	82%	0.821	S	S	*	*			trans	-86.9	114.8	176.9	28.9	-24.9	0	0	0	110.8	I271 N275	I271-P273 WeakPolarHBondContact O-CD 3.31Å; P273-N275 PolarHBondContact O-N 2.82Å
274	S	25.9	Very low	25.2	Very low	110 Å²	110	157.8 Å²	157.8	77%	0.769	82%	0.824	S	S	*	*			trans	-76.5	112.2	174.3	67	0	0	0	0	111
275	N	25.4	Very low	25.3	Very low	155 Å²	155	156.2 Å²	156.2	83%	0.829	82%	0.821	S	S	*	*			trans	-59.4	130.3	170.6	-73.1	-44.4	0	0	0	112.6	P273	P273-N275 PolarHBondContact O-N 2.82Å
276	A	25.3	Very low	25.4	Very low	103 Å²	103	153.4 Å²	153.4	85%	0.851	81%	0.813	S	S	*	*			trans	-142.1	77	159.3	0	0	0	0	0	110.7
277	S	23.8	Very low	25.6	Very low	113 Å²	113	151.8 Å²	151.8	79%	0.79	81%	0.813	S	S	*	*			trans	-84.6	114.4	158.6	52.6	0	0	0	0	109.3
278	R	28	Very low	25.6	Very low	251 Å²	251	152.2 Å²	152.2	95%	0.947	82%	0.815	S	S	*	*			trans	-118.4	103.7	162.2	-108	-177.4	-173.8	169.2	3	109.9
279	K	25.5	Very low	25.8	Very low	201 Å²	201	154.7 Å²	154.7	87%	0.874	83%	0.827	S	S	*	*			trans	-60.5	142.6	163.9	-75.8	171.7	171.4	174.7	0	110.4
280	R	25.9	Very low	25.8	Very low	254 Å²	254	151.1 Å²	151.1	96%	0.958	82%	0.815	S	S	*	*			trans	-120.1	146.3	143.6	-86.9	-172.2	171	-158.2	-0.2	109.6
281	Q	24.5	Very low	26.3	Very low	192 Å²	192	148.5 Å²	148.5	90%	0.897	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-80.4	125.4	-153.4	-173.8	169.1	-11.7	0	0	111.6
282	R	26.2	Very low	26.3	Very low	237 Å²	237	148.7 Å²	148.7	89%	0.894	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-67.3	130	171	-86.5	-178.5	177.6	170.8	-1.4	109.4	V284	R282-V284 PolarHBondContact O-N 2.88Å
283	C	22.7	Very low	26.5	Very low	121 Å²	121	150.4 Å²	150.4	82%	0.818	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-52.5	124.6	166.4	-80	0	0	0	0	109.8	V285	C283-V285 PolarHBondContact O-N 3.1Å; C283-V285 VanDerWaalsContact O-N 3.16Å
284	V	24.4	Very low	26.3	Very low	128 Å²	128	151 Å²	151	78%	0.776	82%	0.817	S	S	*	*			trans	-72.4	99.9	171.1	178.1	0	0	0	0	106.7	R282	R282-V284 PolarHBondContact O-N 2.88Å
285	V	27.1	Very low	26.3	Very low	130 Å²	130	154 Å²	154	79%	0.788	82%	0.821	S	S	*	*			trans	-86.9	105.4	159.7	178.9	0	0	0	0	105.2	C283	C283-V285 PolarHBondContact O-N 3.1Å; C283-V285 VanDerWaalsContact O-N 3.16Å
286	S	24.3	Very low	26.3	Very low	86 Å²	86	157.8 Å²	157.8	60%	0.601	82%	0.824	S	S	*	*			trans	-55.4	129	177.5	-62.6	0	0	0	0	110.4	D288	S286-D288 PolarHBondContact O-N 2.81Å
287	P	30.5	Very low	26.3	Very low	121 Å²	121	162 Å²	162	79%	0.786	83%	0.826	S	S	*	*			trans	-91.5	84.3	179.8	35.1	-28.9	0	0	0	109.2
288	D	25.1	Very low	26.4	Very low	144 Å²	144	163.4 Å²	163.4	77%	0.77	82%	0.823	S	S	*	*			trans	-121.8	82.5	169.8	-77.3	-36.3	0	0	0	108.9	S286	S286-D288 PolarHBondContact O-N 2.81Å
289	T	29.5	Very low	26.2	Very low	147 Å²	147	156.8 Å²	156.8	90%	0.902	81%	0.813	S	S	*	*	S	Bend	trans	-168.2	126.9	144.2	14.3	0	0	0	0	109.3
290	S	25.9	Very low	26.3	Very low	95 Å²	95	153.2 Å²	153.2	66%	0.664	81%	0.808	S	S	*	*			trans	-60.4	154.5	-165.9	43.7	0	0	0	0	116	E292	S290-E292 PolarHBondContact O-N 2.8Å
291	P	35.7	Very low	26.2	Very low	132 Å²	132	145.9 Å²	145.9	86%	0.857	80%	0.795	S	S	*	*			trans	-83.8	94.8	-179.7	34	-29.9	0	0	0	109.9
292	E	26.4	Very low	26.2	Very low	163 Å²	163	144.6 Å²	144.6	76%	0.762	79%	0.794	S	S	*	*			trans	-94.9	115.1	167.7	-81.9	-171.1	157.6	0	0	111.1	S290	S290-E292 PolarHBondContact O-N 2.8Å
293	H	27.3	Very low	26.1	Very low	164 Å²	164	137.3 Å²	137.3	76%	0.759	78%	0.784	S	S	*	*			trans	67.1	85.1	147.7	-68.9	69	0	0	0	116.7	M295	H293-M295 PolarHBondContact O-N 2.82Å
294	S	23	Very low	26.3	Very low	125 Å²	125	138.7 Å²	138.7	87%	0.874	78%	0.783	S	S	*	*			trans	-50.5	86.5	146.3	-172	0	0	0	0	110.1	R296	S294-R296 PolarHBondContact O-N 3.19Å
295	M	26	Very low	26.4	Very low	172 Å²	172	137.1 Å²	137.1	85%	0.847	78%	0.784	S	S	*	*			trans	-71.3	110.8	157.6	-89.3	-148.2	-175	0	0	106.9	H293 Q297	H293-M295 PolarHBondContact O-N 2.82Å; M295-Q297 PolarHBondContact O-N 3.15Å
296	R	25.1	Very low	26.3	Very low	234 Å²	234	135.3 Å²	135.3	88%	0.883	78%	0.777	S	S	*	*			trans	-38.5	104.2	161.2	-80.1	176.3	170.4	172.4	-3.6	109.2	S294 I298	S294-R296 PolarHBondContact O-N 3.19Å; R296-I298 VanDerWaalsContact C-N 3.29Å; R296-I298 PolarHBondContact O-N 3.05Å
297	Q	25.5	Very low	26.5	Very low	191 Å²	191	137.3 Å²	137.3	89%	0.893	79%	0.785	S	S	*	*			trans	-65.3	101	158.4	-79.1	-178.9	-13.9	0	0	106	M295	M295-Q297 PolarHBondContact O-N 3.15Å
298	I	25.4	Very low	26.2	Very low	143 Å²	143	139.3 Å²	139.3	73%	0.733	78%	0.784	S	S	*	*			trans	-51.3	127.7	162.1	-63.8	166.7	0	0	0	105.5	R296 V300	R296-I298 VanDerWaalsContact C-N 3.29Å; R296-I298 PolarHBondContact O-N 3.05Å; I298-V300 PolarHBondContact O-N 3.45Å
299	P	25.3	Very low	26.4	Very low	113 Å²	113	138.5 Å²	138.5	73%	0.734	78%	0.784	S	S	*	*			trans	-59.5	114.4	-176.8	24.6	-31.2	0	0	0	106.9	S301	P299-S301 PolarHBondContact O-N 3.34Å
300	V	26.7	Very low	26.2	Very low	126 Å²	126	137.4 Å²	137.4	76%	0.764	78%	0.778	S	S	*	*			trans	-59.9	100.5	167.1	176.2	0	0	0	0	104.2	I298 L302	I298-V300 PolarHBondContact O-N 3.45Å; V300-L302 PolarHBondContact O-N 3.09Å
301	S	23.2	Very low	26.1	Very low	99 Å²	99	139.5 Å²	139.5	69%	0.692	78%	0.782	S	S	*	*			trans	-51.6	110	162	56	0	0	0	0	104.8	P299 A303	P299-S301 PolarHBondContact O-N 3.34Å; S301-A303 PolarHBondContact O-N 3.39Å
302	L	24.9	Very low	25.6	Very low	166 Å²	166	140.3 Å²	140.3	87%	0.869	78%	0.778	S	S	*	*			trans	-59.4	90.9	161.3	-110.6	87	0	0	0	104.5	V300 D304	V300-L302 PolarHBondContact O-N 3.09Å; L302-D304 PolarHBondContact O-N 2.89Å
303	A	24.9	Very low	25.5	Very low	83 Å²	83	140.6 Å²	140.6	69%	0.686	78%	0.783	S	S	*	*			trans	-60.8	121.1	166.5	0	0	0	0	0	104.9	S301 A305	S301-A303 PolarHBondContact O-N 3.39Å; A303-A305 PolarHBondContact O-N 3.3Å
304	D	26.2	Very low	25.4	Very low	150 Å²	150	141.1 Å²	141.1	80%	0.802	79%	0.786	S	S	*	*			trans	-32.5	114.3	168.6	-65.7	-55.2	0	0	0	109.2	L302 S306	L302-D304 PolarHBondContact O-N 2.89Å; D304-S306 PolarHBondContact O-N 2.97Å
305	A	26.2	Very low	25.5	Very low	96 Å²	96	141.6 Å²	141.6	79%	0.793	78%	0.784	S	S	*	*			trans	-66.6	77.8	156	0	0	0	0	0	105.5	A303 V307	A303-A305 PolarHBondContact O-N 3.3Å; A305-V307 VanDerWaalsContact C-N 3.28Å; A305-V307 PolarHBondContact O-N 3.33Å
306	S	25.7	Very low	25.6	Very low	92 Å²	92	140.2 Å²	140.2	64%	0.643	79%	0.785	S	S	*	*			trans	-53.8	101.3	163.9	51.6	0	0	0	0	105.3	D304 E308	D304-S306 PolarHBondContact O-N 2.97Å; S306-E308 VanDerWaalsContact C-N 3.26Å; S306-E308 PolarHBondContact O-N 3.05Å
307	V	28.4	Very low	25.7	Very low	128 Å²	128	134.4 Å²	134.4	78%	0.776	78%	0.78	S	S	*	*			trans	-56	101.1	167.3	174.4	0	0	0	0	104.9	A305 T309	A305-V307 VanDerWaalsContact C-N 3.28Å; A305-V307 PolarHBondContact O-N 3.33Å; V307-T309 PolarHBondContact O-N 3.18Å
308	E	25	Very low	25.8	Very low	163 Å²	163	136.4 Å²	136.4	76%	0.762	78%	0.78	S	S	*	*			trans	-53.5	107.2	170.5	-76.4	-179.4	154.6	0	0	106.6	S306 T310	S306-E308 VanDerWaalsContact C-N 3.26Å; S306-E308 PolarHBondContact O-N 3.05Å; E308-T310 PolarHBondContact O-N 3.05Å
309	T	28.2	Very low	26	Very low	126 Å²	126	135.2 Å²	135.2	77%	0.773	78%	0.784	S	S	*	*			trans	-73.1	80.2	168.6	50	0	0	0	0	106.7	V307 D311	V307-T309 PolarHBondContact O-N 3.18Å; T309-D311 PolarHBondContact O-N 3.13Å
310	T	25.7	Very low	26	Very low	124 Å²	124	138.5 Å²	138.5	76%	0.761	79%	0.789	S	S	*	*			trans	-74.4	120	169.1	-38	0	0	0	0	107.7	E308 L312	E308-T310 PolarHBondContact O-N 3.05Å; T310-L312 PolarHBondContact O-N 3.34Å
311	D	24.4	Very low	26	Very low	140 Å²	140	138.4 Å²	138.4	75%	0.749	79%	0.791	S	S	*	*			trans	-52.1	128.8	-173.2	-70.8	-50.4	0	0	0	113.6	T309 L313	T309-D311 PolarHBondContact O-N 3.13Å; D311-L313 PolarHBondContact O-N 3.45Å
312	L	23.6	Very low	26.1	Very low	148 Å²	148	141.4 Å²	141.4	78%	0.775	80%	0.799	S	S	*	*			trans	22.9	87.4	146	-68.5	163	0	0	0	116.6	T310	T310-L312 PolarHBondContact O-N 3.34Å
313	L	24.6	Very low	26	Very low	169 Å²	169	139.1 Å²	139.1	89%	0.885	80%	0.797	S	S	*	*			trans	-119.9	104.4	145.4	-84.5	167.7	0	0	0	109.4	D311 T315	D311-L313 PolarHBondContact O-N 3.45Å; L313-T315 PolarHBondContact O-N 3.32Å; L313-T315 VanDerWaalsContact O-N 3.12Å
314	H	25.9	Very low	25.9	Very low	176 Å²	176	143.7 Å²	143.7	82%	0.815	80%	0.797	S	S	*	*			trans	-48.8	108.8	168.8	-82.3	-81	0	0	0	111.2
315	T	25.5	Very low	25.7	Very low	134 Å²	134	147.2 Å²	147.2	82%	0.822	80%	0.799	S	S	*	*			trans	-147.4	120.7	142.6	32.6	0	0	0	0	109.8	L313	L313-T315 PolarHBondContact O-N 3.32Å; L313-T315 VanDerWaalsContact O-N 3.12Å
316	T	27.4	Very low	25.5	Very low	143 Å²	143	150.3 Å²	150.3	88%	0.877	80%	0.801	S	S	*	*			trans	-49.9	122	173.1	43.1	0	0	0	0	114
317	S	27.1	Very low	25.3	Very low	112 Å²	112	150.6 Å²	150.6	78%	0.783	80%	0.801	S	S	*	*			trans	-165.3	113	136.8	72.9	0	0	0	0	113.6
318	R	28.6	Very low	25	Very low	234 Å²	234	150.4 Å²	150.4	88%	0.883	81%	0.805	S	S	*	*			trans	44.7	98.3	133.6	-62.9	-176.7	178.1	-177.7	-0.6	118	H320	R318-H320 PolarHBondContact O-N 2.92Å
319	S	28.8	Very low	24.9	Very low	117 Å²	117	147.1 Å²	147.1	82%	0.818	80%	0.799	S	S	*	*			trans	-45.1	123.4	156.4	49.8	0	0	0	0	113.4	P321	S319-P321 WeakPolarHBondContact O-CD 3.49Å
320	H	25	Very low	24.6	Very low	182 Å²	182	145.5 Å²	145.5	84%	0.843	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-66.5	120.3	167	-66.1	-74.9	0	0	0	110.9	R318	R318-H320 PolarHBondContact O-N 2.92Å
321	P	27.5	Very low	24.6	Very low	124 Å²	124	147.1 Å²	147.1	81%	0.805	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-82	134.8	167.8	23.7	-13.5	0	0	0	110	S319	S319-P321 WeakPolarHBondContact O-CD 3.49Å
322	L	25	Very low	24.5	Very low	163 Å²	163	145.6 Å²	145.6	85%	0.853	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-58.1	140.5	-178.8	-73.5	155.9	0	0	0	112.1	Y324	L322-Y324 PolarHBondContact O-N 3.04Å
323	S	22.3	Very low	24.7	Very low	118 Å²	118	144.5 Å²	144.5	83%	0.825	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-66.4	120.7	-179.2	36.6	0	0	0	0	112.4	R325	S323-R325 PolarHBondContact O-N 2.79Å
324	Y	23.4	Very low	24.7	Very low	178 Å²	178	142.6 Å²	142.6	70%	0.698	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-58.4	116.4	172.1	-80	-87.4	0	0	0	111.6	L322 E346	L322-Y324 PolarHBondContact O-N 3.04Å; Y324-E346 PolarHBondContact OH-OE2 3.23Å
325	R	21.8	Very low	24.7	Very low	225 Å²	225	143.5 Å²	143.5	85%	0.849	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-84.7	122.6	156.2	-110.3	-179.7	-179.8	178.7	-2.1	106.5	S323 P327	S323-R325 PolarHBondContact O-N 2.79Å; R325-P327 WeakPolarHBondContact O-CD 3.29Å
326	I	21.9	Very low	25	Very low	161 Å²	161	141.5 Å²	141.5	83%	0.826	78%	0.784	S	S	*	*			trans	-80.5	108.6	164	-59.9	169.4	0	0	0	106.3
327	P	22.2	Very low	25.1	Very low	98 Å²	98	139.2 Å²	139.2	64%	0.636	76%	0.763	S	S	*	*			trans	-82	119.4	165.5	2.1	20.4	0	0	0	106.4	R325 C329	R325-P327 WeakPolarHBondContact O-CD 3.29Å; P327-C329 PolarHBondContact O-N 3.36Å
328	S	21.3	Very low	25.3	Very low	123 Å²	123	138.8 Å²	138.8	86%	0.86	75%	0.752	S	S	*	*			trans	-60.6	91.5	158.6	43.2	0	0	0	0	107.5	A330	S328-A330 PolarHBondContact O-N 3.41Å
329	C	22.5	Very low	25.5	Very low	95 Å²	95	135 Å²	135	64%	0.642	74%	0.744	S	S	*	*			trans	-73.8	112.9	-177.7	-117.1	0	0	0	0	109.3	P327	P327-C329 PolarHBondContact O-N 3.36Å
330	A	21.8	Very low	25.7	Very low	92 Å²	92	132.6 Å²	132.6	76%	0.76	72%	0.719	S	S	*	*			trans	-74.3	118.3	150.4	0	0	0	0	0	106.1	S328 S332	S328-A330 PolarHBondContact O-N 3.41Å; A330-S332 PolarHBondContact O-N 3.22Å
331	F	26.3	Very low	26.2	Very low	157 Å²	157	127.8 Å²	127.8	69%	0.689	70%	0.702	S	S	*	*			trans	-58.1	109.2	-176.7	-68.4	-87.7	0	0	0	110.8	T333	F331-T333 PolarHBondContact O-N 3.1Å
332	S	22.1	Very low	26.4	Very low	108 Å²	108	129.7 Å²	129.7	76%	0.755	70%	0.698	S	S	*	*			trans	-82.6	99.8	160.8	49.8	0	0	0	0	107.8	A330 T334	A330-S332 PolarHBondContact O-N 3.22Å; S332-T334 VanDerWaalsContact C-N 3.31Å; S332-T334 PolarHBondContact O-N 3.01Å
333	T	27.5	Very low	26.9	Very low	126 Å²	126	124.9 Å²	124.9	77%	0.773	69%	0.688	S	S	*	*			trans	-68	85.4	171.9	47	0	0	0	0	109.8	F331	F331-T333 PolarHBondContact O-N 3.1Å
334	T	24.7	Very low	27.6	Very low	129 Å²	129	123.3 Å²	123.3	79%	0.791	67%	0.67	S	S	*	*			trans	170.2	79.5	153	41	0	0	0	0	110.4	S332	S332-T334 VanDerWaalsContact C-N 3.31Å; S332-T334 PolarHBondContact O-N 3.01Å
335	E	25.7	Very low	28.5	Very low	194 Å²	194	119.6 Å²	119.6	91%	0.907	67%	0.668	S	S	*	*			trans	-148.2	114.7	145.4	-80.8	-153.8	161	0	0	109.1
336	P	32.9	Very low	29.7	Very low	92 Å²	92	113.8 Å²	113.8	60%	0.597	65%	0.65	S	S	*	*			trans	-88.2	142.2	-173.6	29.2	-27	0	0	0	114.1	N338	P336-N338 PolarHBondContact O-N 3.42Å
337	F	29.3	Very low	31	Very low	96 Å²	96	108.3 Å²	108.3	42%	0.421	62%	0.622	S	S	.	*	S	Bend	trans	72.5	-7.2	150.3	-83	-93.7	0	0	0	123.4	Q423 V427	F337-Q423 HydrophobicContact CD2-CG 4.35Å; F337-Q423 HydrophobicContact CE1-CG 4.45Å; F337-Q423 HydrophobicContact CE2-CB 3.45Å; F337-Q423 VanDerWaalsContact CE2-CB 3.45Å; F337-Q423 HydrophobicContact CE2-CG 3.55Å; F337-Q423 HydrophobicContact CZ-CB 3.42Å; F337-Q423 VanDerWaalsContact CZ-CB 3.42Å; F337-Q423 HydrophobicContact CZ-CG 3.6Å; F337-V427 HydrophobicContact CE1-CG2 4.17Å; F337-V427 HydrophobicContact CZ-CG2 4.07Å
338	N	30.2	Very low	32.4	Very low	103 Å²	103	105.9 Å²	105.9	55%	0.551	60%	0.603	S	S	*	*			trans	-91.4	-6.1	-173.5	-84.3	-32.7	0	0	0	117.3	P336 K342	P336-N338 PolarHBondContact O-N 3.42Å; N338-K342 PolarHBondContact O-N 3.19Å
339	E	34.3	Very low	34	Very low	155 Å²	155	103 Å²	103	72%	0.724	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-33.6	-169.6	-140.4	171.7	-161.8	0	0	114.1
340	F	31.7	Very low	35.7	Very low	65 Å²	65	101.7 Å²	101.7	29%	0.285	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.5	-28.5	176.4	-99.9	-86.2	0	0	0	113.7	M347 L402 F431 I609 Y613	F340-M347 HydrophobicContact CD1-CE 3.66Å; F340-M347 HydrophobicContact CD2-CE 4.49Å; F340-M347 HydrophobicContact CE1-CE 3.22Å; F340-M347 HydrophobicContact CE2-CE 4.13Å; F340-M347 HydrophobicContact CG-CE 4.29Å; F340-M347 HydrophobicContact CZ-CE 3.49Å; F340-M347 VanDerWaalsContact CZ-CE 3.49Å; F340-L402 HydrophobicContact CE1-CD2 4.46Å; F340-F431 HydrophobicContact CE2-CZ 4.48Å; F340-F431 HydrophobicContact CZ-CZ 4.35Å; F340-I609 HydrophobicContact CE2-CG2 3.87Å; F340-I609 HydrophobicContact CZ-CD1 4.3Å; F340-I609 HydrophobicContact CZ-CG2 4.05Å; F340-Y613 WeakPolarHBondContact CD2-OH 3.48Å; F340-Y613 HydrophobicContact CE2-CE2 4.08Å
341	T	35.7	Very low	37.4	Very low	81 Å²	81	97.6 Å²	97.6	50%	0.497	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-26.5	-177.2	45.3	0	0	0	0	113.7	P404	T341-P404 HydrophobicContact CG2-CG 4.35Å
342	K	33	Very low	39	Very low	164 Å²	164	92.8 Å²	92.8	71%	0.713	51%	0.514	S	S	*	.	S	Bend	trans	-113.5	78.8	176.2	-78.4	-176.5	175.8	177.6	0	111.1	N338	N338-K342 PolarHBondContact O-N 3.19Å
343	G	34.9	Very low	40.8	Very low	62 Å²	62	91.8 Å²	91.8	64%	0.639	50%	0.5	S	S	*	.	S	Bend	trans	90.3	55.2	131.2	0	0	0	0	0	117.8
344	N	37.2	Very low	41.9	Very low	86 Å²	86	86.4 Å²	86.4	46%	0.46	47%	0.466	S	S	.	.			trans	-118.2	83.8	137.6	-140	-2.5	0	0	0	110.5	E346 M347	N344-E346 PolarHBondContact O-N 3.39Å; N344-M347 HydrophobicContact CB-CB 4.29Å; N344-M347 WeakPolarHBondContact O-CB 3.49Å; N344-M347 PolarHBondContact O-N 3.05Å
345	P	41	Very low	43.3	Very low	99 Å²	99	81.5 Å²	81.5	64%	0.643	44%	0.438	S	S	*	.	H	α-helix	trans	-54.8	-22.1	173	23.1	-33	0	0	0	112.2	M347 S349	P345-M347 VanDerWaalsContact C-N 3.3Å; P345-M347 PolarHBondContact O-N 3.28Å; P345-S349 WeakPolarHBondContact O-CB 3.47Å; P345-S349 PolarHBondContact O-N 3.39Å
346	E	46.9	Very low	44.2	Very low	103 Å²	103	77.1 Å²	77.1	48%	0.481	42%	0.419	S	S	.	.	H	α-helix	trans	-57.5	-40.1	170.1	-61.3	-176.4	169.3	0	0	111.9	Y324 N344 S349 E350	Y324-E346 PolarHBondContact OH-OE2 3.23Å; N344-E346 PolarHBondContact O-N 3.39Å; E346-S349 WeakPolarHBondContact O-CB 3.48Å; E346-S349 PolarHBondContact O-N 2.95Å; E346-E350 WeakPolarHBondContact O-CG 3.39Å; E346-E350 PolarHBondContact O-N 2.93Å
347	M	49.9	Very low	44.2	Very low	47 Å²	47	77 Å²	77	23%	0.232	42%	0.42	C	S	.	.	H	α-helix	trans	-71.1	-40.8	-174.3	-164.2	178.9	82.7	0	0	113.2	F340 N344 P345 L351 I609	F340-M347 HydrophobicContact CD1-CE 3.66Å; F340-M347 HydrophobicContact CD2-CE 4.49Å; F340-M347 HydrophobicContact CE1-CE 3.22Å; F340-M347 HydrophobicContact CE2-CE 4.13Å; F340-M347 HydrophobicContact CG-CE 4.29Å; F340-M347 HydrophobicContact CZ-CE 3.49Å; F340-M347 VanDerWaalsContact CZ-CE 3.49Å; N344-M347 HydrophobicContact CB-CB 4.29Å; N344-M347 WeakPolarHBondContact O-CB 3.49Å; N344-M347 PolarHBondContact O-N 3.05Å; P345-M347 VanDerWaalsContact C-N 3.3Å; P345-M347 PolarHBondContact O-N 3.28Å; M347-L351 PolarHBondContact O-N 2.7Å; M347-I609 HydrophobicContact CE-CD1 4.2Å; M347-I609 HydrophobicContact SD-CD1 3.72Å; M347-I609 HydrophobicContact SD-CG1 4.47Å
348	L	52.5	Low	44.1	Very low	46 Å²	46	79 Å²	79	24%	0.241	43%	0.434	C	S	.	.	H	α-helix	trans	-71.3	-34.3	172.1	-93.1	164.4	0	0	0	111.2	L351 L352 V377 L403	L348-L351 PolarHBondContact O-N 3.35Å; L348-L352 VanDerWaalsContact O-CB 3.28Å; L348-L352 WeakPolarHBondContact O-CB 3.26Å; L348-L352 WeakPolarHBondContact O-CD1 3.31Å; L348-L352 WeakPolarHBondContact O-CG 3.39Å; L348-L352 PolarHBondContact O-N 2.72Å; L348-V377 HydrophobicContact CD1-CG1 4.39Å; L348-L403 HydrophobicContact CD1-CD2 4.09Å; L348-L403 HydrophobicContact CD2-CD2 4.09Å
349	S	53.9	Low	44	Very low	63 Å²	63	79.3 Å²	79.3	44%	0.441	44%	0.442	S	S	.	.	H	α-helix	trans	-61.1	-49.4	174.2	-164.9	0	0	0	0	111	P345 E346 L351 L352 D353	P345-S349 WeakPolarHBondContact O-CB 3.47Å; P345-S349 PolarHBondContact O-N 3.39Å; E346-S349 WeakPolarHBondContact O-CB 3.48Å; E346-S349 PolarHBondContact O-N 2.95Å; S349-L351 VanDerWaalsContact C-N 3.31Å; S349-L351 PolarHBondContact O-N 3.24Å; S349-L352 CarbonylContact O-C 3.59Å; S349-L352 WeakPolarHBondContact O-CA 3.34Å; S349-L352 PolarHBondContact O-N 3.23Å; S349-D353 PolarHBondContact O-N 2.94Å; S349-D353 VanDerWaalsContact O-OD1 3.09Å
350	E	58.2	Low	43.6	Very low	67 Å²	67	82.6 Å²	82.6	31%	0.313	45%	0.448	S	S	.	.	H	α-helix	trans	-62.9	-35.1	180	-75	-176.4	147.7	0	0	113	E346 Q602 Y605	E346-E350 WeakPolarHBondContact O-CG 3.39Å; E346-E350 PolarHBondContact O-N 2.93Å; E350-Q602 PolarHBondContact O-NE2 2.91Å; E350-Y605 HydrophobicContact CB-CE2 4.31Å; E350-Y605 VanDerWaalsContact CD-CE2 3.44Å; E350-Y605 VanDerWaalsContact CD-CZ 3.46Å; E350-Y605 VanDerWaalsContact CD-OH 3.26Å; E350-Y605 HydrophobicContact CG-CE2 4.38Å; E350-Y605 PolarHBondContact OE1-OH 3.05Å; E350-Y605 WeakPolarHBondContact OE2-CE2 3.26Å; E350-Y605 PolarHBondContact OE2-OH 3.26Å
351	L	58.1	Low	43.3	Very low	7 Å²	7	85.6 Å²	85.6	4%	0.037	47%	0.467	C	S	.	.	H	α-helix	trans	-70.4	-40	171.1	-77.8	171.5	0	0	0	111.4	M347 L348 S349 D353 Y395 L399 L402 Q602	M347-L351 PolarHBondContact O-N 2.7Å; L348-L351 PolarHBondContact O-N 3.35Å; S349-L351 VanDerWaalsContact C-N 3.31Å; S349-L351 PolarHBondContact O-N 3.24Å; L351-D353 PolarHBondContact O-N 3.32Å; L351-Y395 WeakPolarHBondContact O-CE1 3.45Å; L351-Y395 PolarHBondContact O-OH 3.06Å; L351-L399 HydrophobicContact CB-CD2 3.87Å; L351-L399 HydrophobicContact CD1-CD2 4.32Å; L351-L399 HydrophobicContact CG-CD2 4.47Å; L351-L402 HydrophobicContact CD1-CD2 4.15Å; L351-Q602 HydrophobicContact CD2-CG 4.5Å; L351-Q602 PolarHBondContact O-NE2 2.85Å
352	L	60	Low	43	Very low	56 Å²	56	88.3 Å²	88.3	29%	0.293	48%	0.478	S	S	.	.	H	α-helix	trans	-70.8	-16.5	178.4	-73.2	165.9	0	0	0	113.4	L348 S349 L354 S355 L399	L348-L352 VanDerWaalsContact O-CB 3.28Å; L348-L352 WeakPolarHBondContact O-CB 3.26Å; L348-L352 WeakPolarHBondContact O-CD1 3.31Å; L348-L352 WeakPolarHBondContact O-CG 3.39Å; L348-L352 PolarHBondContact O-N 2.72Å; S349-L352 CarbonylContact O-C 3.59Å; S349-L352 WeakPolarHBondContact O-CA 3.34Å; S349-L352 PolarHBondContact O-N 3.23Å; L352-L354 PolarHBondContact O-N 2.85Å; L352-L354 VanDerWaalsContact O-N 3.11Å; L352-S355 WeakPolarHBondContact O-CA 3.29Å; L352-S355 WeakPolarHBondContact O-CB 3.37Å; L352-S355 PolarHBondContact O-N 2.82Å; L352-S355 PolarHBondContact O-OG 2.99Å; L352-L399 HydrophobicContact CD2-CD1 3.66Å; L352-L399 HydrophobicContact CG-CD1 4.36Å
353	D	59	Low	43	Very low	86 Å²	86	89.7 Å²	89.7	46%	0.46	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.5	-176.2	-74.3	-18.8	0	0	0	114.5	S349 L351	S349-D353 PolarHBondContact O-N 2.94Å; S349-D353 VanDerWaalsContact O-OD1 3.09Å; L351-D353 PolarHBondContact O-N 3.32Å
354	L	51.3	Low	42.7	Very low	13 Å²	13	91.9 Å²	91.9	7%	0.068	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-13.9	171.6	-76.8	-170.4	0	0	0	114.1	L352 Y395 I442	L352-L354 PolarHBondContact O-N 2.85Å; L352-L354 VanDerWaalsContact O-N 3.11Å; L354-Y395 HydrophobicContact CB-CE1 4.03Å; L354-I442 HydrophobicContact CD1-CG1 4.03Å
355	S	53.1	Low	42.2	Very low	27 Å²	27	99.1 Å²	99.1	19%	0.189	51%	0.511	C	S	.	.	S	Bend	trans	-73.5	133.6	175.2	68.9	0	0	0	0	109.5	L352 S357	L352-S355 WeakPolarHBondContact O-CA 3.29Å; L352-S355 WeakPolarHBondContact O-CB 3.37Å; L352-S355 PolarHBondContact O-N 2.82Å; L352-S355 PolarHBondContact O-OG 2.99Å; S355-S357 PolarHBondContact O-N 3.49Å
356	I	45.5	Very low	41.6	Very low	102 Å²	102	99 Å²	99	52%	0.523	51%	0.512	S	S	.	.			trans	-25.6	118.9	-166.6	-60.8	165.8	0	0	0	114.1	I358	I356-I358 VanDerWaalsContact C-N 3.3Å; I356-I358 HydrophobicContact CG2-CG1 4.25Å; I356-I358 PolarHBondContact O-N 3.3Å
357	S	32.4	Very low	40.8	Very low	88 Å²	88	99.5 Å²	99.5	62%	0.615	53%	0.527	S	S	*	.			trans	-57.1	84.6	168.8	48.6	0	0	0	0	111.5	S355	S355-S357 PolarHBondContact O-N 3.49Å
358	I	28.1	Very low	39.9	Very low	138 Å²	138	102.4 Å²	102.4	71%	0.708	54%	0.542	S	S	*	.			trans	-94.8	113.9	155.3	-58	175.4	0	0	0	104.6	I356 R360	I356-I358 VanDerWaalsContact C-N 3.3Å; I356-I358 HydrophobicContact CG2-CG1 4.25Å; I356-I358 PolarHBondContact O-N 3.3Å; I358-R360 PolarHBondContact O-N 3.07Å; I358-R360 VanDerWaalsContact O-N 3.12Å
359	P	28.3	Very low	38.7	Very low	111 Å²	111	108 Å²	108	72%	0.721	57%	0.572	S	S	*	*			trans	-56.5	126.6	173.9	25.1	-30.2	0	0	0	106.6	N361	P359-N361 VanDerWaalsContact C-N 3.35Å; P359-N361 PolarHBondContact O-N 3.29Å
360	R	25	Very low	37.4	Very low	224 Å²	224	110 Å²	110	85%	0.845	58%	0.578	S	S	*	*			trans	-37.1	99.4	175.3	-96.9	-177.6	170.3	157.1	-2.9	109.5	I358 D362	I358-R360 PolarHBondContact O-N 3.07Å; I358-R360 VanDerWaalsContact O-N 3.12Å; R360-D362 VanDerWaalsContact C-N 3.33Å; R360-D362 PolarHBondContact O-N 3.06Å
361	N	26	Very low	36	Very low	128 Å²	128	113.6 Å²	113.6	68%	0.684	60%	0.599	S	S	*	*			trans	-87.5	89.6	166.3	-148.4	-3.7	0	0	0	103.4	P359 K363	P359-N361 VanDerWaalsContact C-N 3.35Å; P359-N361 PolarHBondContact O-N 3.29Å; N361-K363 PolarHBondContact O-N 3.34Å
362	D	29.8	Very low	34.8	Very low	138 Å²	138	118.6 Å²	118.6	74%	0.738	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	33.1	-174.7	-85.5	-24.4	0	0	0	113.6	R360	R360-D362 VanDerWaalsContact C-N 3.33Å; R360-D362 PolarHBondContact O-N 3.06Å
363	K	32.7	Very low	33.3	Very low	193 Å²	193	123.3 Å²	123.3	84%	0.839	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	4.1	-175.6	-78.3	-172.6	176.7	178.9	0	116.4	N361	N361-K363 PolarHBondContact O-N 3.34Å
364	S	27.9	Very low	32	Very low	107 Å²	107	126.2 Å²	126.2	75%	0.748	67%	0.674	S	S	*	*			trans	-110.8	50	174.7	54.9	0	0	0	0	113.3	S366	S364-S366 PolarHBondContact O-N 3.46Å
365	R	26.7	Very low	31.2	Very low	239 Å²	239	128.7 Å²	128.7	90%	0.902	69%	0.689	S	S	*	*			trans	-94	76.9	162	-150	179.9	-166.7	-169.5	2.4	108.5
366	S	28.7	Very low	30.2	Very low	97 Å²	97	133.3 Å²	133.3	68%	0.678	71%	0.712	S	S	*	*			trans	-118.9	123.8	172.7	55.4	0	0	0	0	110.1	S364	S364-S366 PolarHBondContact O-N 3.46Å
367	S	29.5	Very low	30	Very low	112 Å²	112	131.8 Å²	131.8	78%	0.783	71%	0.707	S	S	*	*			trans	55.3	85.8	166.5	69.9	0	0	0	0	118.3
368	I	30.2	Very low	30	Very low	109 Å²	109	129.6 Å²	129.6	56%	0.559	69%	0.69	S	S	*	*			trans	-132.7	118.5	142.1	-60.7	-178.3	0	0	0	107.4
369	D	27.4	Very low	30.4	Very low	163 Å²	163	124.5 Å²	124.5	87%	0.872	67%	0.666	S	S	*	*			trans	-49.4	138	-178.1	-79.7	-52.1	0	0	0	113.8	N371	D369-N371 PolarHBondContact O-N 3.25Å; D369-N371 VanDerWaalsContact O-N 3.1Å
370	N	27.1	Very low	30.9	Very low	106 Å²	106	122.5 Å²	122.5	57%	0.567	66%	0.655	S	S	*	*			trans	-63.5	99.7	179.2	-72.3	-24.3	0	0	0	111.4	D116	D116-N370 PolarHBondContact OD1-ND2 3.45Å
371	N	28.6	Very low	31.3	Very low	141 Å²	141	113.7 Å²	113.7	75%	0.754	62%	0.623	S	S	*	*			trans	-141.9	109.8	150.3	-142.7	-7.9	0	0	0	109.5	D369 Q373	D369-N371 PolarHBondContact O-N 3.25Å; D369-N371 VanDerWaalsContact O-N 3.1Å; N371-Q373 PolarHBondContact O-N 3.43Å
372	P	33.5	Very low	32	Very low	112 Å²	112	110 Å²	110	73%	0.727	61%	0.611	S	S	*	*			trans	-84.1	38.7	-160	35.2	-36.7	0	0	0	114.2
373	Q	28.1	Very low	32.4	Very low	155 Å²	155	113.3 Å²	113.3	72%	0.724	61%	0.613	S	S	*	*	S	Bend	trans	-97.6	90.6	167.8	-69.8	-168.6	-6.7	0	0	109.7	N371 T375	N371-Q373 PolarHBondContact O-N 3.43Å; Q373-T375 VanDerWaalsContact C-N 3.31Å; Q373-T375 PolarHBondContact O-N 2.77Å; Q373-T375 PolarHBondContact O-OG1 2.81Å
374	T	31.6	Very low	32.7	Very low	147 Å²	147	105.3 Å²	105.3	90%	0.902	58%	0.581	S	S	*	*	S	Bend	trans	29.8	52.2	146.3	36.3	0	0	0	0	117.8
375	T	34.3	Very low	33.2	Very low	65 Å²	65	107 Å²	107	40%	0.399	58%	0.577	S	S	.	*			trans	-133.7	32.1	174.9	-32.6	0	0	0	0	112.1	Q373 S379	Q373-T375 VanDerWaalsContact C-N 3.31Å; Q373-T375 PolarHBondContact O-N 2.77Å; Q373-T375 PolarHBondContact O-OG1 2.81Å; T375-S379 WeakPolarHBondContact O-CB 3.44Å; T375-S379 PolarHBondContact O-N 3.02Å; T375-S379 PolarHBondContact O-OG 2.72Å
376	L	33.6	Very low	33.9	Very low	125 Å²	125	103.2 Å²	103.2	65%	0.654	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-4.1	-168.4	-146.8	111.4	0	0	0	116
377	V	40.1	Very low	34.6	Very low	70 Å²	70	99.4 Å²	99.4	42%	0.424	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-33.9	175.4	-177.8	0	0	0	0	112.1	L348 S379 S380	L348-V377 HydrophobicContact CD1-CG1 4.39Å; V377-S379 PolarHBondContact O-N 3.43Å; V377-S380 PolarHBondContact O-N 2.83Å; V377-S380 PolarHBondContact O-OG 3.49Å; V377-S380 VanDerWaalsContact O-OG 3.07Å
378	T	33	Very low	35.4	Very low	42 Å²	42	99.6 Å²	99.6	26%	0.258	54%	0.544	S	S	.	.	H	α-helix	trans	-64.3	-29.2	166.3	22.1	0	0	0	0	111.6	F381 A382	T378-F381 PolarHBondContact O-N 2.92Å; T378-A382 WeakPolarHBondContact O-CB 2.87Å; T378-A382 PolarHBondContact O-N 3.17Å
379	S	36.9	Very low	36.1	Very low	31 Å²	31	101.3 Å²	101.3	22%	0.217	54%	0.544	C	S	.	.	H	α-helix	trans	-69.6	-35.1	178.8	65.7	0	0	0	0	113.9	T375 V377 F381 R383	T375-S379 WeakPolarHBondContact O-CB 3.44Å; T375-S379 PolarHBondContact O-N 3.02Å; T375-S379 PolarHBondContact O-OG 2.72Å; V377-S379 PolarHBondContact O-N 3.43Å; S379-F381 VanDerWaalsContact C-N 3.29Å; S379-F381 PolarHBondContact O-N 2.92Å; S379-R383 WeakPolarHBondContact O-CB 3.19Å; S379-R383 PolarHBondContact O-N 3.05Å
380	S	38.2	Very low	36.9	Very low	68 Å²	68	94.2 Å²	94.2	48%	0.476	51%	0.506	S	S	.	.	H	α-helix	trans	-69.5	-28	178.8	30.4	0	0	0	0	112.2	V377 S384	V377-S380 PolarHBondContact O-N 2.83Å; V377-S380 PolarHBondContact O-OG 3.49Å; V377-S380 VanDerWaalsContact O-OG 3.07Å; S380-S384 WeakPolarHBondContact O-CB 3.29Å
381	F	34.6	Very low	37.9	Very low	39 Å²	39	95.2 Å²	95.2	17%	0.171	51%	0.511	C	S	.	.	H	α-helix	trans	-86.2	-41.7	170.6	-74.7	-92.4	0	0	0	112.6	T378 S379 R383 S384 L390 L403	T378-F381 PolarHBondContact O-N 2.92Å; S379-F381 VanDerWaalsContact C-N 3.29Å; S379-F381 PolarHBondContact O-N 2.92Å; F381-R383 PolarHBondContact O-N 2.85Å; F381-S384 PolarHBondContact O-N 3.25Å; F381-L390 HydrophobicContact CD1-CD1 4.35Å; F381-L390 HydrophobicContact CD1-CD2 3.65Å; F381-L390 HydrophobicContact CE1-CD2 3.64Å; F381-L403 HydrophobicContact CB-CD1 4.34Å; F381-L403 HydrophobicContact CD1-CD1 4.17Å; F381-L403 HydrophobicContact CD2-CD1 3.41Å; F381-L403 VanDerWaalsContact CD2-CD1 3.41Å; F381-L403 HydrophobicContact CE1-CD1 4.3Å; F381-L403 HydrophobicContact CE2-CD1 3.6Å; F381-L403 HydrophobicContact CG-CD1 3.72Å; F381-L403 HydrophobicContact CZ-CD1 4.05Å
382	A	39.2	Very low	39	Very low	52 Å²	52	92.4 Å²	92.4	43%	0.43	50%	0.502	S	S	.	.	H	α-helix	trans	-70.4	-28.8	-176.2	0	0	0	0	0	113.6	T378 S384	T378-A382 WeakPolarHBondContact O-CB 2.87Å; T378-A382 PolarHBondContact O-N 3.17Å; A382-S384 PolarHBondContact O-N 3.05Å
383	R	38.7	Very low	40.3	Very low	207 Å²	207	87.4 Å²	87.4	78%	0.781	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-0.9	177.2	-143.9	173.2	-173.2	166.4	1	112.9	S379 F381	S379-R383 WeakPolarHBondContact O-CB 3.19Å; S379-R383 PolarHBondContact O-N 3.05Å; F381-R383 PolarHBondContact O-N 2.85Å
384	S	38.1	Very low	42.2	Very low	24 Å²	24	82.1 Å²	82.1	17%	0.168	44%	0.443	C	S	.	.			trans	-121.8	21.1	-161.9	-152.5	0	0	0	0	113.7	S380 F381 A382 D386 S387	S380-S384 WeakPolarHBondContact O-CB 3.29Å; F381-S384 PolarHBondContact O-N 3.25Å; A382-S384 PolarHBondContact O-N 3.05Å; S384-D386 PolarHBondContact O-N 3.26Å; S384-D386 VanDerWaalsContact O-N 3.13Å; S384-S387 PolarHBondContact O-N 2.86Å; S384-S387 PolarHBondContact O-OG 3.47Å; S384-S387 WeakPolarHBondContact OG-CB 3.29Å; S384-S387 PolarHBondContact OG-OG 2.82Å
385	E	39.5	Very low	44.1	Very low	143 Å²	143	75.2 Å²	75.2	67%	0.668	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-26	172.6	-71.9	-171.4	156.6	0	0	112.2
386	D	42.1	Very low	45.7	Very low	159 Å²	159	72.6 Å²	72.6	85%	0.85	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-0.3	176.9	-73.2	-23.7	0	0	0	114.6	S384 T388	S384-D386 PolarHBondContact O-N 3.26Å; S384-D386 VanDerWaalsContact O-N 3.13Å; D386-T388 PolarHBondContact O-N 2.75Å; D386-T388 VanDerWaalsContact O-N 3.11Å
387	S	42.6	Very low	47.4	Very low	18 Å²	18	67.7 Å²	67.7	13%	0.126	36%	0.359	C	S	.	.			trans	-80.5	104.8	-178.8	76.4	0	0	0	0	110.7	S384 W389 L390	S384-S387 PolarHBondContact O-N 2.86Å; S384-S387 PolarHBondContact O-OG 3.47Å; S384-S387 WeakPolarHBondContact OG-CB 3.29Å; S384-S387 PolarHBondContact OG-OG 2.82Å; S387-W389 VanDerWaalsContact CB-CD1 3.5Å; S387-W389 VanDerWaalsContact CB-NE1 3.28Å; S387-W389 PolarHBondContact O-N 2.88Å; S387-W389 PolarHBondContact OG-NE1 3.33Å; S387-L390 PolarHBondContact O-N 2.6Å; S387-L390 VanDerWaalsContact O-N 3.1Å; S387-L390 VanDerWaalsContact OG-CD1 3.31Å; S387-L390 WeakPolarHBondContact OG-CD1 3.18Å
388	T	45.7	Very low	48.9	Very low	115 Å²	115	64.3 Å²	64.3	71%	0.706	34%	0.339	S	S	*	.	H	α-helix	trans	-52.1	-24.2	180	45.9	0	0	0	0	114.1	D386 S392	D386-T388 PolarHBondContact O-N 2.75Å; D386-T388 VanDerWaalsContact O-N 3.11Å; T388-S392 PolarHBondContact O-N 3.28Å
389	W	44.9	Very low	50.7	Low	145 Å²	145	62.5 Å²	62.5	55%	0.549	33%	0.327	S	S	.	.	H	α-helix	trans	-73.9	-38.9	178.1	66.7	-84.2	0	0	0	113.3	S387 L391 S392 D393 L396	S387-W389 VanDerWaalsContact CB-CD1 3.5Å; S387-W389 VanDerWaalsContact CB-NE1 3.28Å; S387-W389 PolarHBondContact O-N 2.88Å; S387-W389 PolarHBondContact OG-NE1 3.33Å; W389-L391 VanDerWaalsContact C-N 3.28Å; W389-L391 PolarHBondContact O-N 2.82Å; W389-S392 WeakPolarHBondContact CA-OG 3.23Å; W389-S392 PolarHBondContact O-N 3.4Å; W389-S392 PolarHBondContact O-OG 2.79Å; W389-D393 PolarHBondContact O-N 2.85Å; W389-L396 HydrophobicContact CE3-CD1 3.61Å; W389-L396 HydrophobicContact CZ3-CD1 3.4Å; W389-L396 VanDerWaalsContact CZ3-CD1 3.4Å
390	L	44.8	Very low	52.1	Low	15 Å²	15	62.9 Å²	62.9	8%	0.079	33%	0.33	C	S	.	.	H	α-helix	trans	-63.4	-35.2	175.8	-111.1	138.6	0	0	0	112.2	F381 S387 S392 L396 T397	F381-L390 HydrophobicContact CD1-CD1 4.35Å; F381-L390 HydrophobicContact CD1-CD2 3.65Å; F381-L390 HydrophobicContact CE1-CD2 3.64Å; S387-L390 PolarHBondContact O-N 2.6Å; S387-L390 VanDerWaalsContact O-N 3.1Å; S387-L390 VanDerWaalsContact OG-CD1 3.31Å; S387-L390 WeakPolarHBondContact OG-CD1 3.18Å; L390-S392 VanDerWaalsContact C-N 3.31Å; L390-L396 HydrophobicContact CD2-CB 4.27Å; L390-T397 PolarHBondContact O-OG1 3.36Å
391	L	48.3	Very low	53.6	Low	126 Å²	126	62.5 Å²	62.5	66%	0.66	32%	0.32	S	S	*	.	H	α-helix	trans	-73.2	-22.5	174.5	-75.2	154	0	0	0	112.9	W389	W389-L391 VanDerWaalsContact C-N 3.28Å; W389-L391 PolarHBondContact O-N 2.82Å
392	S	50.9	Low	55.1	Low	82 Å²	82	61.5 Å²	61.5	57%	0.573	32%	0.316	S	S	*	.	H	α-helix	trans	-85.4	-32.8	-177.1	73.4	0	0	0	0	113.6	T388 W389 L390	T388-S392 PolarHBondContact O-N 3.28Å; W389-S392 WeakPolarHBondContact CA-OG 3.23Å; W389-S392 PolarHBondContact O-N 3.4Å; W389-S392 PolarHBondContact O-OG 2.79Å; L390-S392 VanDerWaalsContact C-N 3.31Å
393	D	60.2	Low	56.4	Low	7 Å²	7	60 Å²	60	4%	0.037	30%	0.301	C	S	.	.			trans	-96.6	108.6	177.8	-168.6	-15.2	0	0	0	110.3	W389 Y395 L396 T397	W389-D393 PolarHBondContact O-N 2.85Å; D393-Y395 PolarHBondContact O-N 3.16Å; D393-Y395 VanDerWaalsContact O-N 3.12Å; D393-Y395 WeakPolarHBondContact OD1-CB 3.47Å; D393-Y395 PolarHBondContact OD1-N 2.97Å; D393-L396 HydrophobicContact CB-CB 4.15Å; D393-L396 HydrophobicContact CB-CD1 3.96Å; D393-L396 HydrophobicContact CB-CG 4.08Å; D393-L396 PolarHBondContact O-N 3.25Å; D393-L396 VanDerWaalsContact O-N 3.14Å; D393-T397 PolarHBondContact O-N 3.33Å; D393-T397 PolarHBondContact O-OG1 3.35Å
394	Y	69.6	Low	57.2	Low	45 Å²	45	51.2 Å²	51.2	18%	0.176	27%	0.271	C	S	.	.	H	α-helix	trans	-52.5	-34.5	176.9	-66.2	-75.9	0	0	0	112.1	T397 G398 Y437	Y394-T397 WeakPolarHBondContact O-CB 3.38Å; Y394-T397 PolarHBondContact O-N 3.5Å; Y394-G398 PolarHBondContact O-N 3.32Å; Y394-Y437 AromaticContact CD1-CD1 3.95Å; Y394-Y437 HydrophobicContact CD1-CD1 3.95Å; Y394-Y437 HydrophobicContact CD1-CE1 4.09Å; Y394-Y437 WeakPolarHBondContact O-CB 3.2Å
395	Y	71	Confident	57.9	Low	1 Å²	1	57.7 Å²	57.7	0%	0.004	29%	0.291	C	S	.	.	H	α-helix	trans	-67.1	-47	-179.6	-170.4	-105.9	0	0	0	111.9	L351 L354 D393 T397 G398 L399 L438 R441 Q602	L351-Y395 WeakPolarHBondContact O-CE1 3.45Å; L351-Y395 PolarHBondContact O-OH 3.06Å; L354-Y395 HydrophobicContact CB-CE1 4.03Å; D393-Y395 PolarHBondContact O-N 3.16Å; D393-Y395 VanDerWaalsContact O-N 3.12Å; D393-Y395 WeakPolarHBondContact OD1-CB 3.47Å; D393-Y395 PolarHBondContact OD1-N 2.97Å; Y395-T397 VanDerWaalsContact C-N 3.3Å; Y395-T397 PolarHBondContact O-N 3.24Å; Y395-G398 WeakPolarHBondContact O-CA 3.41Å; Y395-G398 PolarHBondContact O-N 2.95Å; Y395-G398 VanDerWaalsContact O-N 3.08Å; Y395-L399 HydrophobicContact CD1-CD1 3.98Å; Y395-L399 HydrophobicContact CD1-CG 4.44Å; Y395-L399 HydrophobicContact CE1-CD1 3.62Å; Y395-L399 HydrophobicContact CE1-CG 4.16Å; Y395-L399 PolarHBondContact O-N 3.04Å; Y395-L438 HydrophobicContact CD2-CD2 3.68Å; Y395-L438 HydrophobicContact CE2-CB 4.32Å; Y395-L438 HydrophobicContact CE2-CD2 3.5Å; Y395-L438 VanDerWaalsContact CE2-CD2 3.5Å; Y395-L438 HydrophobicContact CG-CD2 4.34Å; Y395-R441 HydrophobicContact CD2-CB 3.48Å; Y395-R441 VanDerWaalsContact CD2-CB 3.48Å; Y395-R441 HydrophobicContact CD2-CG 3.63Å; Y395-R441 HydrophobicContact CE2-CB 4.3Å; Y395-R441 HydrophobicContact CE2-CG 4.33Å; Y395-R441 HydrophobicContact CG-CB 4.08Å; Y395-R441 HydrophobicContact CG-CG 3.9Å; Y395-Q602 PolarHBondContact OH-NE2 3.18Å; Y395-Q602 PolarHBondContact OH-OE1 2.93Å
396	L	67.4	Low	57.9	Low	10 Å²	10	56.7 Å²	56.7	5%	0.052	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-36.2	175.1	-68.6	177.9	0	0	0	111.8	W389 L390 D393 G398 L399 S400	W389-L396 HydrophobicContact CE3-CD1 3.61Å; W389-L396 HydrophobicContact CZ3-CD1 3.4Å; W389-L396 VanDerWaalsContact CZ3-CD1 3.4Å; L390-L396 HydrophobicContact CD2-CB 4.27Å; D393-L396 HydrophobicContact CB-CB 4.15Å; D393-L396 HydrophobicContact CB-CD1 3.96Å; D393-L396 HydrophobicContact CB-CG 4.08Å; D393-L396 PolarHBondContact O-N 3.25Å; D393-L396 VanDerWaalsContact O-N 3.14Å; L396-G398 VanDerWaalsContact C-N 3.32Å; L396-G398 PolarHBondContact O-N 3.05Å; L396-L399 HydrophobicContact CD2-CD1 4.34Å; L396-L399 PolarHBondContact O-N 3.47Å; L396-S400 WeakPolarHBondContact O-CB 3.34Å; L396-S400 PolarHBondContact O-N 2.7Å; L396-S400 PolarHBondContact O-OG 2.77Å
397	T	70.2	Confident	57.8	Low	22 Å²	22	52.4 Å²	52.4	14%	0.135	27%	0.269	C	S	.	.	H	α-helix	trans	-58.6	-45.2	170.1	-62	0	0	0	0	110.6	L390 D393 Y394 Y395 S400 K401 Y437	L390-T397 PolarHBondContact O-OG1 3.36Å; D393-T397 PolarHBondContact O-N 3.33Å; D393-T397 PolarHBondContact O-OG1 3.35Å; Y394-T397 WeakPolarHBondContact O-CB 3.38Å; Y394-T397 PolarHBondContact O-N 3.5Å; Y395-T397 VanDerWaalsContact C-N 3.3Å; Y395-T397 PolarHBondContact O-N 3.24Å; T397-S400 PolarHBondContact O-N 2.82Å; T397-S400 PolarHBondContact O-OG 3.31Å; T397-K401 HydrophobicContact CG2-CD 4.46Å; T397-K401 WeakPolarHBondContact O-CG 3.37Å; T397-K401 PolarHBondContact O-N 3.3Å; T397-K401 VanDerWaalsContact O-N 3.14Å; T397-Y437 HydrophobicContact CG2-CD1 4.38Å; T397-Y437 HydrophobicContact CG2-CE1 4.31Å
398	G	71.7	Confident	57.9	Low	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-47.1	174.9	0	0	0	0	0	113.2	Y394 Y395 L396 K401 L402 S434	Y394-G398 PolarHBondContact O-N 3.32Å; Y395-G398 WeakPolarHBondContact O-CA 3.41Å; Y395-G398 PolarHBondContact O-N 2.95Å; Y395-G398 VanDerWaalsContact O-N 3.08Å; L396-G398 VanDerWaalsContact C-N 3.32Å; L396-G398 PolarHBondContact O-N 3.05Å; G398-K401 PolarHBondContact O-N 3.02Å; G398-L402 PolarHBondContact O-N 2.87Å; G398-S434 WeakPolarHBondContact O-CB 3.47Å
399	L	69.3	Low	57.7	Low	3 Å²	3	51.5 Å²	51.5	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-41.7	177.1	-69	177.5	0	0	0	112.4	L351 L352 Y395 L396 K401 L402 L403 L438	L351-L399 HydrophobicContact CB-CD2 3.87Å; L351-L399 HydrophobicContact CD1-CD2 4.32Å; L351-L399 HydrophobicContact CG-CD2 4.47Å; L352-L399 HydrophobicContact CD2-CD1 3.66Å; L352-L399 HydrophobicContact CG-CD1 4.36Å; Y395-L399 HydrophobicContact CD1-CD1 3.98Å; Y395-L399 HydrophobicContact CD1-CG 4.44Å; Y395-L399 HydrophobicContact CE1-CD1 3.62Å; Y395-L399 HydrophobicContact CE1-CG 4.16Å; Y395-L399 PolarHBondContact O-N 3.04Å; L396-L399 HydrophobicContact CD2-CD1 4.34Å; L396-L399 PolarHBondContact O-N 3.47Å; L399-K401 PolarHBondContact O-N 2.84Å; L399-L402 WeakPolarHBondContact O-CB 3.4Å; L399-L402 PolarHBondContact O-N 3.45Å; L399-L402 VanDerWaalsContact O-N 3.13Å; L399-L403 PolarHBondContact O-N 2.87Å; L399-L438 HydrophobicContact CD2-CD2 3.79Å; L399-L438 HydrophobicContact CG-CD2 3.85Å
400	S	67.2	Low	57.1	Low	39 Å²	39	50.3 Å²	50.3	27%	0.273	26%	0.262	S	S	.	.	H	α-helix	trans	-61.7	-33.4	178.1	75.8	0	0	0	0	112.6	L396 T397	L396-S400 WeakPolarHBondContact O-CB 3.34Å; L396-S400 PolarHBondContact O-N 2.7Å; L396-S400 PolarHBondContact O-OG 2.77Å; T397-S400 PolarHBondContact O-N 2.82Å; T397-S400 PolarHBondContact O-OG 3.31Å
401	K	68.8	Low	57	Low	61 Å²	61	53.2 Å²	53.2	27%	0.265	28%	0.283	S	S	.	.	H	α-helix	trans	-76.5	-26.7	176.7	-71.9	179.1	175.6	-169.4	0	113.2	T397 G398 L399 E433 Y437	T397-K401 HydrophobicContact CG2-CD 4.46Å; T397-K401 WeakPolarHBondContact O-CG 3.37Å; T397-K401 PolarHBondContact O-N 3.3Å; T397-K401 VanDerWaalsContact O-N 3.14Å; G398-K401 PolarHBondContact O-N 3.02Å; L399-K401 PolarHBondContact O-N 2.84Å; K401-E433 HydrophobicContact CD-CB 4.35Å; K401-E433 WeakPolarHBondContact CD-O 3.46Å; K401-Y437 HydrophobicContact CD-CD2 4.45Å; K401-Y437 HydrophobicContact CD-CE2 4.24Å; K401-Y437 PolarHBondContact NZ-OH 2.85Å; K401-Y437 VanDerWaalsContact NZ-OH 3.13Å
402	L	66.6	Low	56.6	Low	17 Å²	17	49.1 Å²	49.1	9%	0.089	27%	0.271	C	S	.	.	H	α-helix	trans	-74.1	-32.4	176.1	-167.6	71.3	0	0	0	111.5	F340 L351 G398 L399 F431	F340-L402 HydrophobicContact CE1-CD2 4.46Å; L351-L402 HydrophobicContact CD1-CD2 4.15Å; G398-L402 PolarHBondContact O-N 2.87Å; L399-L402 WeakPolarHBondContact O-CB 3.4Å; L399-L402 PolarHBondContact O-N 3.45Å; L399-L402 VanDerWaalsContact O-N 3.13Å; L402-F431 HydrophobicContact CD1-CD1 3.85Å; L402-F431 HydrophobicContact CD1-CE1 3.63Å; L402-F431 HydrophobicContact CD1-CG 4.42Å; L402-F431 HydrophobicContact CD1-CZ 4.01Å
403	L	66.1	Low	56.1	Low	22 Å²	22	51.7 Å²	51.7	12%	0.115	28%	0.277	C	S	.	.	S	Bend	trans	-70.6	135.8	179.6	-74.2	164.9	0	0	0	111.8	L348 F381 L399 R405	L348-L403 HydrophobicContact CD1-CD2 4.09Å; L348-L403 HydrophobicContact CD2-CD2 4.09Å; F381-L403 HydrophobicContact CB-CD1 4.34Å; F381-L403 HydrophobicContact CD1-CD1 4.17Å; F381-L403 HydrophobicContact CD2-CD1 3.41Å; F381-L403 VanDerWaalsContact CD2-CD1 3.41Å; F381-L403 HydrophobicContact CE1-CD1 4.3Å; F381-L403 HydrophobicContact CE2-CD1 3.6Å; F381-L403 HydrophobicContact CG-CD1 3.72Å; F381-L403 HydrophobicContact CZ-CD1 4.05Å; L399-L403 PolarHBondContact O-N 2.87Å; L403-R405 PolarHBondContact O-N 3.45Å
404	P	56.8	Low	55.1	Low	22 Å²	22	59.6 Å²	59.6	14%	0.143	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-62.5	130.2	177.6	22	-29.8	0	0	0	111.4	T341 I409	T341-P404 HydrophobicContact CG2-CG 4.35Å; P404-I409 HydrophobicContact CB-CD1 4.49Å; P404-I409 HydrophobicContact CB-CG1 4.35Å
405	R	52.9	Low	53.7	Low	159 Å²	159	60.3 Å²	60.3	60%	0.6	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-70.5	144.2	167.9	-69.4	-176.7	175.5	175.5	-3.5	109.5	L403 S407 D408	L403-R405 PolarHBondContact O-N 3.45Å; R405-S407 WeakPolarHBondContact CB-OG 3.46Å; R405-S407 PolarHBondContact O-N 3.11Å; R405-S407 VanDerWaalsContact O-N 3.1Å; R405-D408 WeakPolarHBondContact O-CB 3.39Å; R405-D408 PolarHBondContact O-N 3.42Å
406	Q	38.8	Very low	52.2	Low	122 Å²	122	64.7 Å²	64.7	57%	0.57	36%	0.356	S	S	*	.	H	α-helix	trans	-57	-28.9	-179.2	-146.3	171.9	10.8	0	0	112.3	D408 L410	Q406-D408 VanDerWaalsContact C-N 3.32Å; Q406-D408 PolarHBondContact O-N 2.89Å; Q406-L410 PolarHBondContact O-N 3.48Å
407	S	40.4	Very low	51.2	Low	69 Å²	69	69.5 Å²	69.5	48%	0.483	39%	0.39	S	S	.	.	H	α-helix	trans	-61.4	-33.7	172.2	53	0	0	0	0	114.2	R405 L410 S411	R405-S407 WeakPolarHBondContact CB-OG 3.46Å; R405-S407 PolarHBondContact O-N 3.11Å; R405-S407 VanDerWaalsContact O-N 3.1Å; S407-L410 PolarHBondContact O-N 2.92Å; S407-S411 PolarHBondContact O-N 3.08Å; S407-S411 PolarHBondContact O-OG 3.33Å
408	D	43.5	Very low	49.9	Very low	43 Å²	43	74.9 Å²	74.9	23%	0.23	42%	0.418	C	S	.	.	H	α-helix	trans	-81.2	-30.4	-173.2	-57.6	-7.5	0	0	0	110.7	R405 Q406 L410 S411 G412 R430	R405-D408 WeakPolarHBondContact O-CB 3.39Å; R405-D408 PolarHBondContact O-N 3.42Å; Q406-D408 VanDerWaalsContact C-N 3.32Å; Q406-D408 PolarHBondContact O-N 2.89Å; D408-L410 VanDerWaalsContact C-N 3.34Å; D408-S411 WeakPolarHBondContact CA-OG 3.17Å; D408-S411 PolarHBondContact O-OG 2.92Å; D408-G412 PolarHBondContact O-N 3.44Å; D408-G412 VanDerWaalsContact O-N 3.16Å; D408-R430 VanDerWaalsContact CG-NH2 3.34Å; D408-R430 IonicContact OD2-CZ 3.82Å; D408-R430 IonicContact OD2-NE 2.81Å; D408-R430 IonicContact OD2-NH2 3.2Å; D408-R430 PolarHBondContact OD2-NH2 3.13Å
409	I	41.8	Very low	49.3	Very low	72 Å²	72	78.7 Å²	78.7	37%	0.369	44%	0.439	S	S	.	.	H	α-helix	trans	-67.2	-39.3	172.8	-57.3	173.2	0	0	0	109.9	P404 I413	P404-I409 HydrophobicContact CB-CD1 4.49Å; P404-I409 HydrophobicContact CB-CG1 4.35Å; I409-I413 HydrophobicContact CG2-CD1 4.42Å; I409-I413 WeakPolarHBondContact O-CD1 3.21Å; I409-I413 WeakPolarHBondContact O-CG1 3.43Å
410	L	33.4	Very low	49	Very low	120 Å²	120	84.8 Å²	84.8	63%	0.628	46%	0.462	S	S	*	.	H	α-helix	trans	-72.3	-32.4	-179.3	-71.8	168.4	0	0	0	113.1	Q406 S407 D408	Q406-L410 PolarHBondContact O-N 3.48Å; S407-L410 PolarHBondContact O-N 2.92Å; D408-L410 VanDerWaalsContact C-N 3.34Å
411	S	42.4	Very low	48.8	Very low	76 Å²	76	84.4 Å²	84.4	53%	0.531	46%	0.459	S	S	.	.	H	α-helix	trans	-77.8	-35.7	176.6	49.8	0	0	0	0	113	S407 D408 I413 Q414	S407-S411 PolarHBondContact O-N 3.08Å; S407-S411 PolarHBondContact O-OG 3.33Å; D408-S411 WeakPolarHBondContact CA-OG 3.17Å; D408-S411 PolarHBondContact O-OG 2.92Å; S411-I413 VanDerWaalsContact C-N 3.29Å; S411-I413 PolarHBondContact O-N 3.32Å; S411-Q414 PolarHBondContact O-N 3.46Å
412	G	39.5	Very low	48.6	Very low	39 Å²	39	84.1 Å²	84.1	40%	0.402	46%	0.464	S	S	.	.	H	α-helix	trans	-66.7	-23.9	179.8	0	0	0	0	0	115.1	D408 Q414	D408-G412 PolarHBondContact O-N 3.44Å; D408-G412 VanDerWaalsContact O-N 3.16Å; G412-Q414 VanDerWaalsContact C-N 3.29Å; G412-Q414 PolarHBondContact O-N 2.73Å
413	I	40.1	Very low	48.5	Very low	136 Å²	136	85.9 Å²	85.9	70%	0.697	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-19	179.7	-65.2	166.7	0	0	0	112	I409 S411	I409-I413 HydrophobicContact CG2-CD1 4.42Å; I409-I413 WeakPolarHBondContact O-CD1 3.21Å; I409-I413 WeakPolarHBondContact O-CG1 3.43Å; S411-I413 VanDerWaalsContact C-N 3.29Å; S411-I413 PolarHBondContact O-N 3.32Å
414	Q	40.4	Very low	48.3	Very low	174 Å²	174	85.2 Å²	85.2	81%	0.813	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-12.7	-175.1	-72.9	-173.9	-3.2	0	0	115.3	S411 G412 S416	S411-Q414 PolarHBondContact O-N 3.46Å; G412-Q414 VanDerWaalsContact C-N 3.29Å; G412-Q414 PolarHBondContact O-N 2.73Å; Q414-S416 PolarHBondContact O-N 2.88Å
415	S	38.7	Very low	48.9	Very low	59 Å²	59	86.8 Å²	86.8	41%	0.413	48%	0.476	S	S	.	.	S	Bend	trans	-92.2	98.3	177.5	61.7	0	0	0	0	111.1
416	S	39.5	Very low	49.7	Very low	93 Å²	93	82.5 Å²	82.5	65%	0.65	46%	0.464	S	S	*	.			trans	-41.8	131.2	162.9	48.2	0	0	0	0	112.3	Q414 D418	Q414-S416 PolarHBondContact O-N 2.88Å; S416-D418 PolarHBondContact O-N 3.42Å
417	S	46.1	Very low	51.1	Low	111 Å²	111	77.3 Å²	77.3	78%	0.776	44%	0.441	S	S	*	.	S	Bend	trans	21.1	-19.3	163.8	60.1	0	0	0	0	123.9
418	D	43.5	Very low	52.6	Low	135 Å²	135	74.3 Å²	74.3	72%	0.722	42%	0.419	S	S	*	.			trans	-108.2	17.9	-157.2	-67.2	0.7	0	0	0	114	S416	S416-D418 PolarHBondContact O-N 3.42Å
419	N	59.5	Low	54	Low	80 Å²	80	78.2 Å²	78.2	43%	0.428	43%	0.434	S	S	.	.			trans	-137.8	44.1	-175.3	-118.6	-21.5	0	0	0	115.2	V421 S422 Q423	N419-V421 PolarHBondContact O-N 2.95Å; N419-S422 PolarHBondContact ND2-OG 3.25Å; N419-S422 PolarHBondContact O-N 3.22Å; N419-S422 VanDerWaalsContact O-N 3.09Å; N419-S422 PolarHBondContact OD1-OG 3.47Å; N419-Q423 PolarHBondContact O-N 2.94Å
420	Y	62.1	Low	55.6	Low	131 Å²	131	77 Å²	77	51%	0.514	43%	0.425	S	S	.	.	H	α-helix	trans	-48.9	-39.9	169.6	176.5	-98	0	0	0	112.3	Q423 L424 P615	Y420-Q423 WeakPolarHBondContact O-CB 3.41Å; Y420-Q423 PolarHBondContact O-N 3.19Å; Y420-L424 HydrophobicContact CE1-CD2 4.48Å; Y420-L424 WeakPolarHBondContact O-CB 3.16Å; Y420-L424 PolarHBondContact O-N 3.4Å; Y420-P615 HydrophobicContact CE1-CB 4.49Å
421	V	63.5	Low	57.6	Low	32 Å²	32	71.5 Å²	71.5	19%	0.194	40%	0.396	C	S	.	.	H	α-helix	trans	-65.3	-44.8	177.8	-177.2	0	0	0	0	111.7	N419 Q423 L424 N425 E634 L635 I638	N419-V421 PolarHBondContact O-N 2.95Å; V421-Q423 VanDerWaalsContact C-N 3.32Å; V421-Q423 PolarHBondContact O-N 3.42Å; V421-L424 PolarHBondContact O-N 2.98Å; V421-N425 WeakPolarHBondContact O-CB 3.44Å; V421-N425 PolarHBondContact O-N 2.86Å; V421-N425 PolarHBondContact O-ND2 3.17Å; V421-E634 HydrophobicContact CG1-CB 4.01Å; V421-E634 WeakPolarHBondContact CG1-OE2 3.37Å; V421-L635 HydrophobicContact CG2-CD1 3.83Å; V421-L635 HydrophobicContact CG2-CG 4.28Å; V421-I638 HydrophobicContact CG1-CD1 3.91Å
422	S	65.3	Low	59.2	Low	54 Å²	54	69.8 Å²	69.8	38%	0.378	38%	0.384	S	S	.	.	H	α-helix	trans	-63.1	-39.6	176.1	-68.7	0	0	0	0	112.3	N419 N425 L426	N419-S422 PolarHBondContact ND2-OG 3.25Å; N419-S422 PolarHBondContact O-N 3.22Å; N419-S422 VanDerWaalsContact O-N 3.09Å; N419-S422 PolarHBondContact OD1-OG 3.47Å; S422-N425 WeakPolarHBondContact O-CB 3.33Å; S422-N425 PolarHBondContact O-N 2.9Å; S422-L426 PolarHBondContact O-N 3.07Å
423	Q	63.6	Low	61	Low	55 Å²	55	71.9 Å²	71.9	26%	0.257	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-45.6	174.3	-91.6	180	7.9	0	0	111.9	F337 N419 Y420 V421 L426 V427	F337-Q423 HydrophobicContact CD2-CG 4.35Å; F337-Q423 HydrophobicContact CE1-CG 4.45Å; F337-Q423 HydrophobicContact CE2-CB 3.45Å; F337-Q423 VanDerWaalsContact CE2-CB 3.45Å; F337-Q423 HydrophobicContact CE2-CG 3.55Å; F337-Q423 HydrophobicContact CZ-CB 3.42Å; F337-Q423 VanDerWaalsContact CZ-CB 3.42Å; F337-Q423 HydrophobicContact CZ-CG 3.6Å; N419-Q423 PolarHBondContact O-N 2.94Å; Y420-Q423 WeakPolarHBondContact O-CB 3.41Å; Y420-Q423 PolarHBondContact O-N 3.19Å; V421-Q423 VanDerWaalsContact C-N 3.32Å; V421-Q423 PolarHBondContact O-N 3.42Å; Q423-L426 WeakPolarHBondContact O-CB 3.49Å; Q423-L426 PolarHBondContact O-N 3.48Å; Q423-V427 WeakPolarHBondContact O-CG2 3.3Å; Q423-V427 PolarHBondContact O-N 2.89Å
424	L	63.3	Low	62.8	Low	7 Å²	7	65.4 Å²	65.4	4%	0.037	35%	0.35	C	S	.	.	H	α-helix	trans	-65.9	-41.2	177	-167.5	72.9	0	0	0	111.7	Y420 V421 L426 V427 V428 Y613 P615 I638 F642	Y420-L424 HydrophobicContact CE1-CD2 4.48Å; Y420-L424 WeakPolarHBondContact O-CB 3.16Å; Y420-L424 PolarHBondContact O-N 3.4Å; V421-L424 PolarHBondContact O-N 2.98Å; L424-L426 VanDerWaalsContact C-N 3.3Å; L424-L426 PolarHBondContact O-N 2.88Å; L424-V427 PolarHBondContact O-N 2.79Å; L424-V427 VanDerWaalsContact O-N 3.14Å; L424-V428 WeakPolarHBondContact O-CG2 3.28Å; L424-V428 PolarHBondContact O-N 2.8Å; L424-Y613 WeakPolarHBondContact CD1-O 3.48Å; L424-P615 HydrophobicContact CD2-CB 4.13Å; L424-P615 HydrophobicContact CD2-CG 3.6Å; L424-I638 HydrophobicContact CB-CD1 4.21Å; L424-I638 HydrophobicContact CD2-CB 4.44Å; L424-I638 HydrophobicContact CD2-CD1 3.94Å; L424-I638 HydrophobicContact CD2-CG2 3.44Å; L424-I638 VanDerWaalsContact CD2-CG2 3.44Å; L424-I638 HydrophobicContact CG-CD1 4.25Å; L424-I638 HydrophobicContact CG-CG2 3.85Å; L424-F642 HydrophobicContact CD1-CE2 4.22Å; L424-F642 HydrophobicContact CD1-CZ 4.45Å; L424-F642 HydrophobicContact CG-CE2 4.37Å
425	N	69.1	Low	64.6	Low	56 Å²	56	57.1 Å²	57.1	30%	0.299	31%	0.312	S	S	.	.	H	α-helix	trans	-56.1	-41.9	173.1	-93.2	-37.8	0	0	0	112.2	V421 S422 K429 I638	V421-N425 WeakPolarHBondContact O-CB 3.44Å; V421-N425 PolarHBondContact O-N 2.86Å; V421-N425 PolarHBondContact O-ND2 3.17Å; S422-N425 WeakPolarHBondContact O-CB 3.33Å; S422-N425 PolarHBondContact O-N 2.9Å; N425-K429 VanDerWaalsContact O-CB 3.28Å; N425-K429 WeakPolarHBondContact O-CB 3.18Å; N425-K429 PolarHBondContact O-N 2.61Å; N425-I638 HydrophobicContact CB-CD1 4.38Å; N425-I638 VanDerWaalsContact OD1-CD1 3.28Å; N425-I638 WeakPolarHBondContact OD1-CD1 3.2Å; N425-I638 WeakPolarHBondContact OD1-CG1 3.39Å
426	L	68.8	Low	66.5	Low	69 Å²	69	57.5 Å²	57.5	36%	0.361	31%	0.313	S	S	.	.	H	α-helix	trans	-62.7	-43.5	176.6	-166.5	86.2	0	0	0	111.5	S422 Q423 L424 K429 R430	S422-L426 PolarHBondContact O-N 3.07Å; Q423-L426 WeakPolarHBondContact O-CB 3.49Å; Q423-L426 PolarHBondContact O-N 3.48Å; L424-L426 VanDerWaalsContact C-N 3.3Å; L424-L426 PolarHBondContact O-N 2.88Å; L426-K429 PolarHBondContact O-N 3.26Å; L426-R430 WeakPolarHBondContact O-CG 3.29Å; L426-R430 PolarHBondContact O-N 3.14Å
427	V	68.2	Low	68.2	Low	12 Å²	12	56.1 Å²	56.1	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-50	178.5	174.4	0	0	0	0	110.6	F337 Q423 L424 K429 R430 F431 Y613	F337-V427 HydrophobicContact CE1-CG2 4.17Å; F337-V427 HydrophobicContact CZ-CG2 4.07Å; Q423-V427 WeakPolarHBondContact O-CG2 3.3Å; Q423-V427 PolarHBondContact O-N 2.89Å; L424-V427 PolarHBondContact O-N 2.79Å; L424-V427 VanDerWaalsContact O-N 3.14Å; V427-K429 VanDerWaalsContact C-N 3.31Å; V427-K429 PolarHBondContact O-N 2.99Å; V427-R430 PolarHBondContact O-N 3.43Å; V427-R430 VanDerWaalsContact O-N 3.16Å; V427-F431 HydrophobicContact CG1-CD2 3.65Å; V427-F431 HydrophobicContact CG1-CE2 3.57Å; V427-F431 VanDerWaalsContact O-CD2 3.28Å; V427-F431 WeakPolarHBondContact O-CD2 3.28Å; V427-F431 PolarHBondContact O-N 3.18Å; V427-Y613 HydrophobicContact CG1-CD1 4.09Å; V427-Y613 HydrophobicContact CG1-CD2 4.4Å; V427-Y613 HydrophobicContact CG1-CE1 4.4Å; V427-Y613 HydrophobicContact CG1-CG 4.1Å
428	V	71.5	Confident	69.7	Low	6 Å²	6	50.9 Å²	50.9	4%	0.036	26%	0.257	C	S	.	.	H	α-helix	trans	-56	-47.3	177	174.5	0	0	0	0	110.8	L424 R430 F431 S432 I638 E641 F642	L424-V428 WeakPolarHBondContact O-CG2 3.28Å; L424-V428 PolarHBondContact O-N 2.8Å; V428-R430 VanDerWaalsContact C-N 3.33Å; V428-R430 PolarHBondContact O-N 3.07Å; V428-F431 PolarHBondContact O-N 3.05Å; V428-S432 WeakPolarHBondContact O-CB 3.39Å; V428-S432 PolarHBondContact O-N 3.4Å; V428-S432 PolarHBondContact O-OG 2.92Å; V428-I638 HydrophobicContact CG2-CB 4.37Å; V428-I638 HydrophobicContact CG2-CG1 4.43Å; V428-I638 HydrophobicContact CG2-CG2 3.5Å; V428-I638 VanDerWaalsContact CG2-CG2 3.5Å; V428-E641 HydrophobicContact CG1-CB 3.45Å; V428-E641 VanDerWaalsContact CG1-CB 3.45Å; V428-E641 HydrophobicContact CG1-CG 4.16Å; V428-F642 HydrophobicContact CB-CZ 4.44Å; V428-F642 HydrophobicContact CG2-CD1 4.49Å; V428-F642 HydrophobicContact CG2-CD2 3.86Å; V428-F642 HydrophobicContact CG2-CE1 3.98Å; V428-F642 HydrophobicContact CG2-CE2 3.26Å; V428-F642 HydrophobicContact CG2-CG 4.46Å; V428-F642 HydrophobicContact CG2-CZ 3.33Å
429	K	74.4	Confident	71.5	Confident	125 Å²	125	44.9 Å²	44.9	54%	0.543	23%	0.225	S	C	.	.	H	α-helix	trans	-58.5	-45.8	178.7	-173.9	175.9	178	-179.6	0	111.2	N425 L426 V427 F431 S432 E433	N425-K429 VanDerWaalsContact O-CB 3.28Å; N425-K429 WeakPolarHBondContact O-CB 3.18Å; N425-K429 PolarHBondContact O-N 2.61Å; L426-K429 PolarHBondContact O-N 3.26Å; V427-K429 VanDerWaalsContact C-N 3.31Å; V427-K429 PolarHBondContact O-N 2.99Å; K429-F431 PolarHBondContact O-N 3.22Å; K429-S432 WeakPolarHBondContact CA-OG 3.27Å; K429-S432 PolarHBondContact O-N 3.48Å; K429-S432 PolarHBondContact O-OG 3.35Å; K429-E433 WeakPolarHBondContact CE-OE1 3.31Å; K429-E433 WeakPolarHBondContact O-CG 3.43Å; K429-E433 PolarHBondContact O-N 3.4Å
430	R	73.9	Confident	72.3	Confident	46 Å²	46	45.1 Å²	45.1	17%	0.174	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-44.8	176	-73.2	-177	-173.5	161.3	1.6	112.9	D408 L426 V427 V428 E433 S434	D408-R430 VanDerWaalsContact CG-NH2 3.34Å; D408-R430 IonicContact OD2-CZ 3.82Å; D408-R430 IonicContact OD2-NE 2.81Å; D408-R430 IonicContact OD2-NH2 3.2Å; D408-R430 PolarHBondContact OD2-NH2 3.13Å; L426-R430 WeakPolarHBondContact O-CG 3.29Å; L426-R430 PolarHBondContact O-N 3.14Å; V427-R430 PolarHBondContact O-N 3.43Å; V427-R430 VanDerWaalsContact O-N 3.16Å; V428-R430 VanDerWaalsContact C-N 3.33Å; V428-R430 PolarHBondContact O-N 3.07Å; R430-E433 PolarHBondContact O-N 2.96Å; R430-S434 WeakPolarHBondContact O-CB 3.47Å; R430-S434 PolarHBondContact O-N 3.47Å; R430-S434 PolarHBondContact O-OG 3.34Å
431	F	77.2	Confident	72.9	Confident	6 Å²	6	39.5 Å²	39.5	3%	0.026	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-43.8	175.3	-82	-75.6	0	0	0	111.5	F340 L402 V427 V428 K429 E433 S434 V435 I609 I610 Y613 L645	F340-F431 HydrophobicContact CE2-CZ 4.48Å; F340-F431 HydrophobicContact CZ-CZ 4.35Å; L402-F431 HydrophobicContact CD1-CD1 3.85Å; L402-F431 HydrophobicContact CD1-CE1 3.63Å; L402-F431 HydrophobicContact CD1-CG 4.42Å; L402-F431 HydrophobicContact CD1-CZ 4.01Å; V427-F431 HydrophobicContact CG1-CD2 3.65Å; V427-F431 HydrophobicContact CG1-CE2 3.57Å; V427-F431 VanDerWaalsContact O-CD2 3.28Å; V427-F431 WeakPolarHBondContact O-CD2 3.28Å; V427-F431 PolarHBondContact O-N 3.18Å; V428-F431 PolarHBondContact O-N 3.05Å; K429-F431 PolarHBondContact O-N 3.22Å; F431-E433 VanDerWaalsContact C-N 3.25Å; F431-E433 PolarHBondContact O-N 3.43Å; F431-S434 WeakPolarHBondContact CA-OG 3.41Å; F431-S434 PolarHBondContact O-N 3.5Å; F431-S434 PolarHBondContact O-OG 3.23Å; F431-V435 HydrophobicContact CB-CG2 4.27Å; F431-V435 HydrophobicContact CD1-CG2 3.91Å; F431-V435 WeakPolarHBondContact O-CB 3.41Å; F431-V435 WeakPolarHBondContact O-CG2 3.06Å; F431-V435 PolarHBondContact O-N 3.32Å; F431-I609 HydrophobicContact CE1-CG2 4.21Å; F431-I609 HydrophobicContact CE2-CG2 4.46Å; F431-I609 HydrophobicContact CZ-CG2 3.57Å; F431-I610 HydrophobicContact CD1-CD1 4.44Å; F431-I610 HydrophobicContact CD1-CG1 4.04Å; F431-I610 HydrophobicContact CE1-CG1 4.22Å; F431-I610 HydrophobicContact CG-CG1 4.49Å; F431-Y613 HydrophobicContact CE2-CD2 4.32Å; F431-L645 HydrophobicContact CB-CD1 3.79Å
432	S	75.2	Confident	73.6	Confident	39 Å²	39	38 Å²	38	27%	0.273	19%	0.188	S	C	.	.	H	α-helix	trans	-60.5	-34	178.3	76	0	0	0	0	113	V428 K429 P436	V428-S432 WeakPolarHBondContact O-CB 3.39Å; V428-S432 PolarHBondContact O-N 3.4Å; V428-S432 PolarHBondContact O-OG 2.92Å; K429-S432 WeakPolarHBondContact CA-OG 3.27Å; K429-S432 PolarHBondContact O-N 3.48Å; K429-S432 PolarHBondContact O-OG 3.35Å; S432-P436 WeakPolarHBondContact O-CD 3.39Å; S432-P436 WeakPolarHBondContact O-CG 3.5Å
433	E	77.5	Confident	74.2	Confident	83 Å²	83	37.1 Å²	37.1	39%	0.388	18%	0.179	S	C	.	.	H	α-helix	trans	-84.6	-24.7	179.5	-71.2	179.7	-166.6	0	0	113.7	K401 K429 R430 F431 Y437	K401-E433 HydrophobicContact CD-CB 4.35Å; K401-E433 WeakPolarHBondContact CD-O 3.46Å; K429-E433 WeakPolarHBondContact CE-OE1 3.31Å; K429-E433 WeakPolarHBondContact O-CG 3.43Å; K429-E433 PolarHBondContact O-N 3.4Å; R430-E433 PolarHBondContact O-N 2.96Å; F431-E433 VanDerWaalsContact C-N 3.25Å; F431-E433 PolarHBondContact O-N 3.43Å; E433-Y437 WeakPolarHBondContact O-CD2 3.36Å; E433-Y437 WeakPolarHBondContact O-CE2 3.49Å
434	S	77.8	Confident	74.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-97.9	-44.9	-175	53.7	0	0	0	0	113.2	G398 R430 F431 P436 Y437 L438	G398-S434 WeakPolarHBondContact O-CB 3.47Å; R430-S434 WeakPolarHBondContact O-CB 3.47Å; R430-S434 PolarHBondContact O-N 3.47Å; R430-S434 PolarHBondContact O-OG 3.34Å; F431-S434 WeakPolarHBondContact CA-OG 3.41Å; F431-S434 PolarHBondContact O-N 3.5Å; F431-S434 PolarHBondContact O-OG 3.23Å; S434-P436 VanDerWaalsContact C-CD 3.49Å; S434-Y437 WeakPolarHBondContact O-CB 3.14Å; S434-Y437 PolarHBondContact O-N 3.23Å; S434-L438 PolarHBondContact O-N 3.25Å
435	V	78.5	Confident	75.4	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-55.4	-42.7	-174	169.6	0	0	0	0	113	F431 Y437 L438 I439 I610 L645 I649	F431-V435 HydrophobicContact CB-CG2 4.27Å; F431-V435 HydrophobicContact CD1-CG2 3.91Å; F431-V435 WeakPolarHBondContact O-CB 3.41Å; F431-V435 WeakPolarHBondContact O-CG2 3.06Å; F431-V435 PolarHBondContact O-N 3.32Å; V435-Y437 VanDerWaalsContact C-N 3.26Å; V435-Y437 PolarHBondContact O-N 3.17Å; V435-L438 PolarHBondContact O-N 3.25Å; V435-I439 HydrophobicContact CG1-CD1 3.4Å; V435-I439 HydrophobicContact CG1-CG1 3.94Å; V435-I439 WeakPolarHBondContact O-CB 3.45Å; V435-I439 VanDerWaalsContact O-CG1 3.3Å; V435-I439 WeakPolarHBondContact O-CG1 3.48Å; V435-I439 PolarHBondContact O-N 3.49Å; V435-I610 HydrophobicContact CG2-CD1 4.45Å; V435-L645 HydrophobicContact CB-CD2 3.79Å; V435-L645 HydrophobicContact CG1-CD2 3.93Å; V435-L645 HydrophobicContact CG2-CD2 4.18Å; V435-I649 HydrophobicContact CG1-CG1 4.4Å
436	P	78.6	Confident	76	Confident	67 Å²	67	34.1 Å²	34.1	44%	0.435	16%	0.162	S	C	.	.	H	α-helix	trans	-59.2	-34.8	178.1	-26.1	35.9	0	0	0	113.9	S432 S434 R440	S432-P436 WeakPolarHBondContact O-CD 3.39Å; S432-P436 WeakPolarHBondContact O-CG 3.5Å; S434-P436 VanDerWaalsContact C-CD 3.49Å; P436-R440 PolarHBondContact O-N 3.45Å
437	Y	74.7	Confident	76.5	Confident	64 Å²	64	34.7 Å²	34.7	25%	0.251	16%	0.162	S	C	.	.	H	α-helix	trans	-73.5	-42.6	178.2	-68.3	-88.9	0	0	0	111.7	Y394 T397 K401 E433 S434 V435 R440	Y394-Y437 AromaticContact CD1-CD1 3.95Å; Y394-Y437 HydrophobicContact CD1-CD1 3.95Å; Y394-Y437 HydrophobicContact CD1-CE1 4.09Å; Y394-Y437 WeakPolarHBondContact O-CB 3.2Å; T397-Y437 HydrophobicContact CG2-CD1 4.38Å; T397-Y437 HydrophobicContact CG2-CE1 4.31Å; K401-Y437 HydrophobicContact CD-CD2 4.45Å; K401-Y437 HydrophobicContact CD-CE2 4.24Å; K401-Y437 PolarHBondContact NZ-OH 2.85Å; K401-Y437 VanDerWaalsContact NZ-OH 3.13Å; E433-Y437 WeakPolarHBondContact O-CD2 3.36Å; E433-Y437 WeakPolarHBondContact O-CE2 3.49Å; S434-Y437 WeakPolarHBondContact O-CB 3.14Å; S434-Y437 PolarHBondContact O-N 3.23Å; V435-Y437 VanDerWaalsContact C-N 3.26Å; V435-Y437 PolarHBondContact O-N 3.17Å; Y437-R440 PolarHBondContact O-N 2.95Å
438	L	76.8	Confident	76.7	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-63.6	-45.7	177.1	-62.8	174.8	0	0	0	111	Y395 L399 S434 V435 R440 R441 I442 L606	Y395-L438 HydrophobicContact CD2-CD2 3.68Å; Y395-L438 HydrophobicContact CE2-CB 4.32Å; Y395-L438 HydrophobicContact CE2-CD2 3.5Å; Y395-L438 VanDerWaalsContact CE2-CD2 3.5Å; Y395-L438 HydrophobicContact CG-CD2 4.34Å; L399-L438 HydrophobicContact CD2-CD2 3.79Å; L399-L438 HydrophobicContact CG-CD2 3.85Å; S434-L438 PolarHBondContact O-N 3.25Å; V435-L438 PolarHBondContact O-N 3.25Å; L438-R440 VanDerWaalsContact C-N 3.31Å; L438-R440 PolarHBondContact O-N 3.01Å; L438-R441 PolarHBondContact O-N 3.4Å; L438-I442 WeakPolarHBondContact O-CG1 3.19Å; L438-I442 PolarHBondContact O-N 3.31Å; L438-L606 HydrophobicContact CB-CD1 4.48Å; L438-L606 HydrophobicContact CD1-CD1 4.31Å; L438-L606 HydrophobicContact CD1-CD2 4.15Å
439	I	81.3	Confident	77	Confident	8 Å²	8	34.5 Å²	34.5	4%	0.041	16%	0.162	C	C	.	.	H	α-helix	trans	-58.8	-42.2	178.3	-75.7	177.6	0	0	0	111.5	V435 R441 I442 E443 L603 T648 I649 V652	V435-I439 HydrophobicContact CG1-CD1 3.4Å; V435-I439 HydrophobicContact CG1-CG1 3.94Å; V435-I439 WeakPolarHBondContact O-CB 3.45Å; V435-I439 VanDerWaalsContact O-CG1 3.3Å; V435-I439 WeakPolarHBondContact O-CG1 3.48Å; V435-I439 PolarHBondContact O-N 3.49Å; I439-R441 VanDerWaalsContact C-N 3.3Å; I439-R441 PolarHBondContact O-N 3.45Å; I439-I442 PolarHBondContact O-N 3.46Å; I439-I442 VanDerWaalsContact O-N 3.17Å; I439-E443 WeakPolarHBondContact O-CB 3.43Å; I439-E443 PolarHBondContact O-N 2.76Å; I439-L603 HydrophobicContact CG1-CD2 4.47Å; I439-T648 HydrophobicContact CD1-CG2 3.65Å; I439-I649 HydrophobicContact CD1-CG1 3.7Å; I439-I649 HydrophobicContact CG1-CG1 4.43Å; I439-V652 HydrophobicContact CG2-CG2 3.38Å
440	R	77.6	Confident	77.1	Confident	86 Å²	86	29.1 Å²	29.1	33%	0.325	14%	0.139	S	C	.	.	H	α-helix	trans	-57.7	-43.3	-178.3	-175.5	176.5	179.2	162.5	1.9	112	P436 Y437 L438 E444	P436-R440 PolarHBondContact O-N 3.45Å; Y437-R440 PolarHBondContact O-N 2.95Å; L438-R440 VanDerWaalsContact C-N 3.31Å; L438-R440 PolarHBondContact O-N 3.01Å; R440-E444 IonicContact NE-OE1 3.77Å; R440-E444 WeakPolarHBondContact O-CG 3.28Å; R440-E444 PolarHBondContact O-N 2.95Å
441	R	75	Confident	77.1	Confident	12 Å²	12	34.7 Å²	34.7	5%	0.045	16%	0.16	C	C	.	.	H	α-helix	trans	-65.5	-44.8	177	-179.6	59.7	168.5	-169	-11.8	111.6	Y395 L438 I439 E443 E444 Q445 S550 C551	Y395-R441 HydrophobicContact CD2-CB 3.48Å; Y395-R441 VanDerWaalsContact CD2-CB 3.48Å; Y395-R441 HydrophobicContact CD2-CG 3.63Å; Y395-R441 HydrophobicContact CE2-CB 4.3Å; Y395-R441 HydrophobicContact CE2-CG 4.33Å; Y395-R441 HydrophobicContact CG-CB 4.08Å; Y395-R441 HydrophobicContact CG-CG 3.9Å; L438-R441 PolarHBondContact O-N 3.4Å; I439-R441 VanDerWaalsContact C-N 3.3Å; I439-R441 PolarHBondContact O-N 3.45Å; R441-E443 VanDerWaalsContact C-N 3.34Å; R441-E444 PolarHBondContact O-N 3.39Å; R441-Q445 WeakPolarHBondContact O-CG 3.47Å; R441-Q445 PolarHBondContact O-N 3.39Å; R441-S550 PolarHBondContact NH1-O 3.07Å; R441-C551 PolarHBondContact NH1-SG 2.87Å; R441-C551 VanDerWaalsContact NH1-SG 3.37Å
442	I	76.9	Confident	76.7	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-44.3	179.4	-63.8	168.2	0	0	0	110	L354 L438 I439 E444 Q445 L446 Q602 L603	L354-I442 HydrophobicContact CD1-CG1 4.03Å; L438-I442 WeakPolarHBondContact O-CG1 3.19Å; L438-I442 PolarHBondContact O-N 3.31Å; I439-I442 PolarHBondContact O-N 3.46Å; I439-I442 VanDerWaalsContact O-N 3.17Å; I442-E444 PolarHBondContact O-N 3.34Å; I442-Q445 PolarHBondContact O-N 3.06Å; I442-L446 HydrophobicContact CG2-CD1 4.06Å; I442-L446 HydrophobicContact CG2-CG 4.35Å; I442-L446 VanDerWaalsContact O-CG 3.31Å; I442-L446 WeakPolarHBondContact O-CG 3.34Å; I442-L446 PolarHBondContact O-N 3.44Å; I442-Q602 HydrophobicContact CD1-CB 4.15Å; I442-L603 HydrophobicContact CB-CD2 4.47Å; I442-L603 HydrophobicContact CD1-CD2 3.51Å; I442-L603 HydrophobicContact CD1-CG 4.05Å; I442-L603 HydrophobicContact CG2-CD1 3.91Å; I442-L603 HydrophobicContact CG2-CD2 4.1Å; I442-L603 HydrophobicContact CG2-CG 3.9Å
443	E	79.5	Confident	76.4	Confident	36 Å²	36	33.5 Å²	33.5	17%	0.168	15%	0.152	C	C	.	.	H	α-helix	trans	-62.1	-40.3	176.3	-170.9	179	149.5	0	0	112.2	I439 R441 Q445 L446 K447 V652 R655	I439-E443 WeakPolarHBondContact O-CB 3.43Å; I439-E443 PolarHBondContact O-N 2.76Å; R441-E443 VanDerWaalsContact C-N 3.34Å; E443-Q445 VanDerWaalsContact C-N 3.35Å; E443-Q445 PolarHBondContact O-N 3.17Å; E443-L446 PolarHBondContact O-N 3.2Å; E443-K447 HydrophobicContact CG-CD 4.41Å; E443-K447 WeakPolarHBondContact O-CB 3.48Å; E443-K447 WeakPolarHBondContact O-CG 3.37Å; E443-K447 PolarHBondContact O-N 3.24Å; E443-K447 WeakPolarHBondContact OE1-CE 3.27Å; E443-K447 IonicContact OE1-NZ 3.84Å; E443-K447 PolarHBondContact OE1-NZ 3.17Å; E443-V652 HydrophobicContact CB-CG1 4.26Å; E443-V652 HydrophobicContact CG-CG1 4.44Å; E443-R655 IonicContact OE1-CZ 2.75Å; E443-R655 IonicContact OE1-NH1 2.73Å; E443-R655 PolarHBondContact OE1-NH1 3.28Å; E443-R655 IonicContact OE1-NH2 3.25Å; E443-R655 IonicContact OE2-CZ 3.88Å; E443-R655 IonicContact OE2-NH1 2.9Å; E443-R655 PolarHBondContact OE2-NH1 2.93Å; E443-R655 IonicContact OE2-NH2 3.48Å; E443-R655 PolarHBondContact OE2-NH2 3.1Å
444	E	76.2	Confident	75.9	Confident	38 Å²	38	31.9 Å²	31.9	18%	0.178	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-39.9	174.1	-76.7	178.1	-177.1	0	0	112.4	R440 R441 I442 A448 S550	R440-E444 IonicContact NE-OE1 3.77Å; R440-E444 WeakPolarHBondContact O-CG 3.28Å; R440-E444 PolarHBondContact O-N 2.95Å; R441-E444 PolarHBondContact O-N 3.39Å; I442-E444 PolarHBondContact O-N 3.34Å; E444-A448 WeakPolarHBondContact O-CB 3.34Å; E444-A448 PolarHBondContact O-N 3.41Å; E444-S550 PolarHBondContact OE2-OG 2.98Å
445	Q	75.9	Confident	75.2	Confident	10 Å²	10	35.1 Å²	35.1	5%	0.047	16%	0.163	C	C	.	.	H	α-helix	trans	-66.7	-45.6	175.9	-66.9	-60.1	-27.2	0	0	111.7	R441 I442 E443 K447 A448 C449 C551	R441-Q445 WeakPolarHBondContact O-CG 3.47Å; R441-Q445 PolarHBondContact O-N 3.39Å; I442-Q445 PolarHBondContact O-N 3.06Å; E443-Q445 VanDerWaalsContact C-N 3.35Å; E443-Q445 PolarHBondContact O-N 3.17Å; Q445-K447 PolarHBondContact O-N 3.48Å; Q445-A448 WeakPolarHBondContact O-CB 3.41Å; Q445-A448 PolarHBondContact O-N 3.05Å; Q445-A448 VanDerWaalsContact O-N 3.13Å; Q445-C449 PolarHBondContact O-N 3.44Å; Q445-C551 PolarHBondContact NE2-SG 3.4Å; Q445-C551 VanDerWaalsContact NE2-SG 3.43Å
446	L	79.8	Confident	73.9	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-60.4	-44.2	177.2	-68.6	176.5	0	0	0	111.6	I442 E443 A448 C449 I450 I600 V652 F656	I442-L446 HydrophobicContact CG2-CD1 4.06Å; I442-L446 HydrophobicContact CG2-CG 4.35Å; I442-L446 VanDerWaalsContact O-CG 3.31Å; I442-L446 WeakPolarHBondContact O-CG 3.34Å; I442-L446 PolarHBondContact O-N 3.44Å; E443-L446 PolarHBondContact O-N 3.2Å; L446-A448 VanDerWaalsContact C-N 3.32Å; L446-A448 PolarHBondContact O-N 3.06Å; L446-C449 WeakPolarHBondContact O-CB 3.42Å; L446-C449 PolarHBondContact O-N 3.04Å; L446-I450 PolarHBondContact O-N 2.93Å; L446-I600 HydrophobicContact CD2-CD1 4.29Å; L446-I600 HydrophobicContact CD2-CG1 4.09Å; L446-V652 HydrophobicContact CD1-CG1 4.14Å; L446-F656 HydrophobicContact CB-CD2 3.64Å; L446-F656 HydrophobicContact CB-CE2 3.84Å; L446-F656 HydrophobicContact CB-CG 4.31Å; L446-F656 HydrophobicContact CD1-CB 4.26Å; L446-F656 HydrophobicContact CD1-CD2 4.29Å; L446-F656 HydrophobicContact CD1-CG 4.11Å; L446-F656 HydrophobicContact CD2-CD1 4.23Å; L446-F656 HydrophobicContact CD2-CD2 4.05Å; L446-F656 HydrophobicContact CD2-CE1 4.01Å; L446-F656 HydrophobicContact CD2-CE2 3.8Å; L446-F656 HydrophobicContact CD2-CG 4.23Å; L446-F656 HydrophobicContact CD2-CZ 3.79Å; L446-F656 HydrophobicContact CG-CD2 4.19Å; L446-F656 HydrophobicContact CG-CE2 4.33Å; L446-F656 HydrophobicContact CG-CG 4.44Å
447	K	79.4	Confident	72.1	Confident	82 Å²	82	42.5 Å²	42.5	36%	0.357	19%	0.189	S	C	.	.	H	α-helix	trans	-64.9	-33.9	174.1	-74.7	178.4	-176.8	170.2	0	113.2	E443 Q445 C449 R451	E443-K447 HydrophobicContact CG-CD 4.41Å; E443-K447 WeakPolarHBondContact O-CB 3.48Å; E443-K447 WeakPolarHBondContact O-CG 3.37Å; E443-K447 PolarHBondContact O-N 3.24Å; E443-K447 WeakPolarHBondContact OE1-CE 3.27Å; E443-K447 IonicContact OE1-NZ 3.84Å; E443-K447 PolarHBondContact OE1-NZ 3.17Å; Q445-K447 PolarHBondContact O-N 3.48Å; K447-C449 VanDerWaalsContact C-N 3.34Å; K447-R451 WeakPolarHBondContact O-CG 3.32Å; K447-R451 PolarHBondContact O-N 3.12Å; K447-R451 VanDerWaalsContact O-N 3.17Å; K447-R451 PolarHBondContact O-NE 3.42Å
448	A	73.4	Confident	70.3	Confident	13 Å²	13	43.5 Å²	43.5	11%	0.107	20%	0.199	C	C	.	.	H	α-helix	trans	-66	-40.9	174	0	0	0	0	0	110.6	E444 Q445 L446 R451 V452 M592	E444-A448 WeakPolarHBondContact O-CB 3.34Å; E444-A448 PolarHBondContact O-N 3.41Å; Q445-A448 WeakPolarHBondContact O-CB 3.41Å; Q445-A448 PolarHBondContact O-N 3.05Å; Q445-A448 VanDerWaalsContact O-N 3.13Å; L446-A448 VanDerWaalsContact C-N 3.32Å; L446-A448 PolarHBondContact O-N 3.06Å; A448-R451 PolarHBondContact O-N 2.92Å; A448-V452 VanDerWaalsContact O-CG2 3.31Å; A448-V452 WeakPolarHBondContact O-CG2 3.31Å; A448-V452 PolarHBondContact O-N 3.34Å; A448-M592 HydrophobicContact CB-CE 3.43Å; A448-M592 VanDerWaalsContact CB-CE 3.43Å
449	C	78	Confident	68	Low	1 Å²	1	53.9 Å²	53.9	1%	0.007	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-48	173.5	-173.4	0	0	0	0	112.5	Q445 L446 K447 R451 V452 L453 S596	Q445-C449 PolarHBondContact O-N 3.44Å; L446-C449 WeakPolarHBondContact O-CB 3.42Å; L446-C449 PolarHBondContact O-N 3.04Å; K447-C449 VanDerWaalsContact C-N 3.34Å; C449-R451 VanDerWaalsContact C-N 3.31Å; C449-R451 PolarHBondContact O-N 2.99Å; C449-V452 PolarHBondContact O-N 3.1Å; C449-V452 VanDerWaalsContact O-N 3.13Å; C449-L453 WeakPolarHBondContact O-CG 3.39Å; C449-L453 PolarHBondContact O-N 3.37Å; C449-S596 WeakPolarHBondContact CB-OG 3.25Å
450	I	75.8	Confident	65.9	Low	11 Å²	11	61.8 Å²	61.8	6%	0.056	27%	0.269	C	S	.	.	H	α-helix	trans	-56.8	-44	176.8	-64.6	-61.3	0	0	0	111.7	L446 V452 L453 L454 F656 E659 L660 V663	L446-I450 PolarHBondContact O-N 2.93Å; I450-V452 PolarHBondContact O-N 3.27Å; I450-L453 PolarHBondContact O-N 2.82Å; I450-L454 HydrophobicContact CG2-CD1 4.01Å; I450-L454 HydrophobicContact CG2-CG 4.46Å; I450-L454 WeakPolarHBondContact O-CG 3.4Å; I450-L454 PolarHBondContact O-N 2.9Å; I450-F656 HydrophobicContact CD1-CD2 4.16Å; I450-F656 HydrophobicContact CD1-CE2 3.7Å; I450-F656 HydrophobicContact CD1-CZ 4.46Å; I450-F656 HydrophobicContact CG1-CD2 4.1Å; I450-F656 HydrophobicContact CG1-CE2 3.81Å; I450-E659 HydrophobicContact CD1-CB 4.07Å; I450-E659 HydrophobicContact CG1-CB 4.06Å; I450-E659 HydrophobicContact CG2-CB 4.36Å; I450-L660 HydrophobicContact CD1-CB 4.09Å; I450-V663 HydrophobicContact CD1-CG2 4.04Å; I450-V663 HydrophobicContact CG2-CG2 3.87Å
451	R	73.3	Confident	63.6	Low	163 Å²	163	63 Å²	63	62%	0.615	29%	0.285	S	S	*	.	H	α-helix	trans	-63	-39.9	177.4	-76.2	-178	-72.8	-166.1	0.8	113.1	K447 A448 C449 L453 L454 D455	K447-R451 WeakPolarHBondContact O-CG 3.32Å; K447-R451 PolarHBondContact O-N 3.12Å; K447-R451 VanDerWaalsContact O-N 3.17Å; K447-R451 PolarHBondContact O-NE 3.42Å; A448-R451 PolarHBondContact O-N 2.92Å; C449-R451 VanDerWaalsContact C-N 3.31Å; C449-R451 PolarHBondContact O-N 2.99Å; R451-L453 VanDerWaalsContact C-N 3.32Å; R451-L454 PolarHBondContact O-N 3.26Å; R451-D455 PolarHBondContact O-N 3.44Å
452	V	69.6	Low	61.3	Low	18 Å²	18	71.9 Å²	71.9	11%	0.109	32%	0.324	C	S	.	.	H	α-helix	trans	-66.6	-37.4	176.5	173.5	0	0	0	0	111.1	A448 C449 I450 D455 Y588 H589 M592	A448-V452 VanDerWaalsContact O-CG2 3.31Å; A448-V452 WeakPolarHBondContact O-CG2 3.31Å; A448-V452 PolarHBondContact O-N 3.34Å; C449-V452 PolarHBondContact O-N 3.1Å; C449-V452 VanDerWaalsContact O-N 3.13Å; I450-V452 PolarHBondContact O-N 3.27Å; V452-D455 CarbonylContact O-C 3.6Å; V452-Y588 HydrophobicContact CB-CE1 4.44Å; V452-Y588 HydrophobicContact CG1-CD1 4.15Å; V452-Y588 HydrophobicContact CG1-CE1 4.03Å; V452-Y588 HydrophobicContact CG2-CD1 4.4Å; V452-Y588 HydrophobicContact CG2-CE1 3.48Å; V452-Y588 VanDerWaalsContact CG2-CE1 3.48Å; V452-H589 PolarHBondContact O-NE2 3.02Å; V452-M592 HydrophobicContact CG2-CE 4.21Å; V452-M592 HydrophobicContact CG2-CG 4.37Å
453	L	68.7	Low	58.8	Low	2 Å²	2	79.7 Å²	79.7	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-66.6	-42.4	174.5	-66.4	174.7	0	0	0	111.7	C449 I450 R451 I593 V663 M667 I724	C449-L453 WeakPolarHBondContact O-CG 3.39Å; C449-L453 PolarHBondContact O-N 3.37Å; I450-L453 PolarHBondContact O-N 2.82Å; R451-L453 VanDerWaalsContact C-N 3.32Å; L453-I593 HydrophobicContact CD2-CD1 4.36Å; L453-V663 HydrophobicContact CB-CG1 3.82Å; L453-V663 HydrophobicContact CD1-CG1 4.49Å; L453-M667 WeakPolarHBondContact O-CE 3.33Å; L453-I724 HydrophobicContact CD1-CD1 4.09Å; L453-I724 HydrophobicContact CD1-CG1 4.42Å; L453-I724 HydrophobicContact CD2-CD1 3.67Å; L453-I724 HydrophobicContact CD2-CG1 3.9Å; L453-I724 HydrophobicContact CG-CD1 4.49Å
454	L	68	Low	56.4	Low	50 Å²	50	83.2 Å²	83.2	26%	0.262	39%	0.387	S	S	.	.	H	α-helix	trans	-70.9	-30	-179.6	-71	173.9	0	0	0	114.3	I450 R451 P456 V663 Q666	I450-L454 HydrophobicContact CG2-CD1 4.01Å; I450-L454 HydrophobicContact CG2-CG 4.46Å; I450-L454 WeakPolarHBondContact O-CG 3.4Å; I450-L454 PolarHBondContact O-N 2.9Å; R451-L454 PolarHBondContact O-N 3.26Å; L454-P456 VanDerWaalsContact C-CD 3.42Å; L454-P456 VanDerWaalsContact O-CD 3.29Å; L454-P456 WeakPolarHBondContact O-CD 3.2Å; L454-V663 HydrophobicContact CD1-CG2 4.47Å; L454-V663 HydrophobicContact CD2-CB 4.22Å; L454-V663 HydrophobicContact CD2-CG1 4.26Å; L454-V663 HydrophobicContact CD2-CG2 3.79Å; L454-V663 HydrophobicContact CG-CG2 3.89Å; L454-Q666 HydrophobicContact CD2-CB 4.34Å; L454-Q666 VanDerWaalsContact CD2-OE1 3.31Å
455	D	62.5	Low	54.1	Low	67 Å²	67	89.3 Å²	89.3	36%	0.358	42%	0.419	S	S	.	.			trans	-120.1	73.6	-179.7	-168.2	4.1	0	0	0	112	R451 V452 Y457 N458	R451-D455 PolarHBondContact O-N 3.44Å; V452-D455 CarbonylContact O-C 3.6Å; D455-Y457 PolarHBondContact O-N 3.45Å; D455-Y457 VanDerWaalsContact OD1-O 3.05Å; D455-N458 PolarHBondContact OD1-N 2.85Å; D455-N458 PolarHBondContact OD2-OD1 3.38Å
456	P	50.5	Low	51.8	Low	47 Å²	47	97.7 Å²	97.7	31%	0.305	46%	0.455	S	S	.	.	S	Bend	trans	-68.7	-19.9	179.7	26.6	-32.8	0	0	0	112.5	L454	L454-P456 VanDerWaalsContact C-CD 3.42Å; L454-P456 VanDerWaalsContact O-CD 3.29Å; L454-P456 WeakPolarHBondContact O-CD 3.2Å
457	Y	40.9	Very low	49.3	Very low	176 Å²	176	101.6 Å²	101.6	69%	0.69	48%	0.483	S	S	*	.			trans	-125	78.8	179.3	-60.1	-78.5	0	0	0	109	D455 R459	D455-Y457 PolarHBondContact O-N 3.45Å; D455-Y457 VanDerWaalsContact OD1-O 3.05Å; Y457-R459 PolarHBondContact O-N 2.98Å
458	N	37.1	Very low	46.6	Very low	85 Å²	85	103.5 Å²	103.5	46%	0.455	51%	0.505	S	S	.	.			trans	-58.1	73.7	159.7	-120.2	-39	0	0	0	108.6	D455 Y460	D455-N458 PolarHBondContact OD1-N 2.85Å; D455-N458 PolarHBondContact OD2-OD1 3.38Å; N458-Y460 HydrophobicContact CB-CD2 4.15Å; N458-Y460 HydrophobicContact CB-CE2 4.14Å; N458-Y460 PolarHBondContact O-N 3.03Å; N458-Y460 WeakPolarHBondContact OD1-CE2 3.48Å
459	R	29.5	Very low	44.3	Very low	220 Å²	220	110.7 Å²	110.7	83%	0.83	54%	0.536	S	S	*	.			trans	-71.4	77.3	165	-84.1	-173.1	-173	173.9	4.4	103.9	Y457 V461	Y457-R459 PolarHBondContact O-N 2.98Å; R459-V461 PolarHBondContact O-N 3.37Å
460	Y	35.6	Very low	41.8	Very low	174 Å²	174	121.6 Å²	121.6	68%	0.682	58%	0.579	S	S	*	*			trans	-58.9	94.1	153.4	-79.6	-81.3	0	0	0	105.8	N458 K462	N458-Y460 HydrophobicContact CB-CD2 4.15Å; N458-Y460 HydrophobicContact CB-CE2 4.14Å; N458-Y460 PolarHBondContact O-N 3.03Å; N458-Y460 WeakPolarHBondContact OD1-CE2 3.48Å; Y460-K462 PolarHBondContact O-N 2.91Å; Y460-K462 VanDerWaalsContact O-N 3.07Å
461	V	31.1	Very low	39.5	Very low	111 Å²	111	125.6 Å²	125.6	67%	0.673	61%	0.608	S	S	*	*			trans	-45.9	118	166.4	172.3	0	0	0	0	105	R459 Q463	R459-V461 PolarHBondContact O-N 3.37Å; V461-Q463 HydrophobicContact CG1-CG 4.32Å; V461-Q463 PolarHBondContact O-N 3.34Å
462	K	26	Very low	37.3	Very low	199 Å²	199	125 Å²	125	87%	0.865	62%	0.617	S	S	*	*			trans	-53.4	83.7	162.4	-73.4	178.7	174.8	-179.3	0	107.1	Y460 P464	Y460-K462 PolarHBondContact O-N 2.91Å; Y460-K462 VanDerWaalsContact O-N 3.07Å; K462-P464 VanDerWaalsContact O-CD 3.24Å; K462-P464 WeakPolarHBondContact O-CD 3.38Å
463	Q	24.7	Very low	35.2	Very low	165 Å²	165	134.8 Å²	134.8	77%	0.771	66%	0.658	S	S	*	*			trans	-75	110.1	153.3	-78	-168	-5	0	0	103.8	V461 I465	V461-Q463 HydrophobicContact CG1-CG 4.32Å; V461-Q463 PolarHBondContact O-N 3.34Å; Q463-I465 PolarHBondContact O-N 3.16Å; Q463-I465 VanDerWaalsContact O-N 3.09Å
464	P	28.6	Very low	33.2	Very low	110 Å²	110	142.9 Å²	142.9	71%	0.714	70%	0.696	S	S	*	*			trans	-56.3	125.3	174.3	24.9	-30.8	0	0	0	105.9	K462 K466	K462-P464 VanDerWaalsContact O-CD 3.24Å; K462-P464 WeakPolarHBondContact O-CD 3.38Å; P464-K466 PolarHBondContact O-N 2.89Å
465	I	27.5	Very low	31.1	Very low	165 Å²	165	150.2 Å²	150.2	85%	0.846	73%	0.726	S	S	*	*			trans	-52.8	91.3	170.5	-60.6	161.4	0	0	0	105.5	Q463 S467	Q463-I465 PolarHBondContact O-N 3.16Å; Q463-I465 VanDerWaalsContact O-N 3.09Å; I465-S467 VanDerWaalsContact C-N 3.27Å; I465-S467 PolarHBondContact O-N 2.98Å
466	K	27.7	Very low	29.4	Very low	186 Å²	186	153.4 Å²	153.4	81%	0.809	75%	0.748	S	S	*	*			trans	-67.1	104.6	159.6	-85	-172.4	174.9	-177.3	0	102.6	P464 C468	P464-K466 PolarHBondContact O-N 2.89Å; K466-C468 VanDerWaalsContact C-N 3.28Å; K466-C468 PolarHBondContact O-N 3.44Å
467	S	26.6	Very low	28	Very low	89 Å²	89	159.7 Å²	159.7	62%	0.622	77%	0.773	S	S	*	*			trans	-50.4	97.9	172.1	57.9	0	0	0	0	107.7	I465 H469	I465-S467 VanDerWaalsContact C-N 3.27Å; I465-S467 PolarHBondContact O-N 2.98Å; S467-H469 VanDerWaalsContact C-N 3.3Å; S467-H469 PolarHBondContact O-N 3.29Å
468	C	23.1	Very low	27.3	Very low	121 Å²	121	157.1 Å²	157.1	82%	0.818	78%	0.776	S	S	*	*			trans	-67.9	99.7	169.7	-84	0	0	0	0	105.8	K466 Y470	K466-C468 VanDerWaalsContact C-N 3.28Å; K466-C468 PolarHBondContact O-N 3.44Å; C468-Y470 PolarHBondContact O-N 2.71Å
469	H	26.2	Very low	26.7	Very low	164 Å²	164	161.4 Å²	161.4	76%	0.759	79%	0.793	S	S	*	*			trans	-54.2	122.2	167	-87.3	-79.2	0	0	0	108.4	S467 S471	S467-H469 VanDerWaalsContact C-N 3.3Å; S467-H469 PolarHBondContact O-N 3.29Å; H469-S471 PolarHBondContact O-N 3.39Å
470	Y	24.8	Very low	26.5	Very low	231 Å²	231	158 Å²	158	91%	0.906	79%	0.791	S	S	*	*	S	Bend	trans	-56.5	96.1	170.3	-113.2	-101.1	0	0	0	109.9	C468	C468-Y470 PolarHBondContact O-N 2.71Å
471	S	26.5	Very low	26.2	Very low	95 Å²	95	157.8 Å²	157.8	66%	0.664	80%	0.8	S	S	*	*			trans	-161.2	143.6	157.1	-43	0	0	0	0	108	H469	H469-S471 PolarHBondContact O-N 3.39Å
472	D	27.2	Very low	25.8	Very low	151 Å²	151	160.9 Å²	160.9	81%	0.807	81%	0.807	S	S	*	*			trans	87.3	46.7	163.1	-47.8	-19.3	0	0	0	117.7	Q474	D472-Q474 PolarHBondContact O-N 2.93Å
473	F	25.4	Very low	25.8	Very low	223 Å²	223	157.8 Å²	157.8	98%	0.978	81%	0.805	S	S	*	*			trans	-78.6	75.4	141.3	-86.3	-82.3	0	0	0	109.5
474	Q	26.7	Very low	25.7	Very low	172 Å²	172	153.9 Å²	153.9	80%	0.804	80%	0.801	S	S	*	*			trans	-133.2	76.1	165.6	-136.8	175.3	25.9	0	0	110.8	D472	D472-Q474 PolarHBondContact O-N 2.93Å
475	K	25	Very low	25.4	Very low	203 Å²	203	157 Å²	157	88%	0.883	81%	0.807	S	S	*	*			trans	37.5	89.6	134.3	-158.7	-173.8	-165	-173.7	0	116.9
476	V	26.2	Very low	25.5	Very low	135 Å²	135	159 Å²	159	82%	0.818	81%	0.809	S	S	*	*			trans	-148	118.5	148.9	-179.2	0	0	0	0	109.5
477	E	22.6	Very low	25.2	Very low	179 Å²	179	158 Å²	158	84%	0.836	81%	0.807	S	S	*	*			trans	-67.4	134.5	162.1	-63.6	165.2	148.5	0	0	109.3
478	T	25.6	Very low	25.1	Very low	122 Å²	122	160.2 Å²	160.2	75%	0.748	81%	0.812	S	S	*	*			trans	162	125.9	132.2	32.9	0	0	0	0	112.9
479	E	24.9	Very low	25.4	Very low	175 Å²	175	162.8 Å²	162.8	82%	0.818	81%	0.812	S	S	*	*			trans	52.8	115.6	140	-60.8	-176.4	170.1	0	0	122
480	D	23.8	Very low	25.5	Very low	149 Å²	149	163.8 Å²	163.8	80%	0.797	82%	0.817	S	S	*	*			trans	26.7	122.1	133.3	-59.9	-25.9	0	0	0	119.8
481	I	29.7	Very low	26.1	Very low	169 Å²	169	158.6 Å²	158.6	87%	0.867	81%	0.812	S	S	*	*			trans	-168.5	126	131.8	-91.3	145.3	0	0	0	109.3
482	E	22.7	Very low	26.1	Very low	175 Å²	175	162.5 Å²	162.5	82%	0.818	82%	0.824	S	S	*	*			trans	-59.1	145.1	165.4	-66.3	171.2	126.9	0	0	112
483	T	26.8	Very low	26.1	Very low	134 Å²	134	160.7 Å²	160.7	82%	0.822	82%	0.823	S	S	*	*				165.7	123.8	119.2	36.4	0	0	0	0	113.9
484	A	23	Very low	26.1	Very low	84 Å²	84	158.8 Å²	158.8	69%	0.694	82%	0.82	S	S	*	*			trans	47.2	118.1	132.5	0	0	0	0	0	123.2
485	E	22.2	Very low	25.9	Very low	176 Å²	176	158.5 Å²	158.5	82%	0.822	82%	0.823	S	S	*	*				53.5	118.4	126.5	-60.4	-176.6	169.1	0	0	120.8
486	K	29.2	Very low	26.2	Very low	205 Å²	205	155.3 Å²	155.3	89%	0.891	82%	0.821	S	S	*	*				-177.1	145.9	107.7	-100.2	172.5	-177.3	178.6	0	114.3
487	E	21.7	Very low	26.3	Very low	166 Å²	166	153.9 Å²	153.9	78%	0.776	82%	0.817	S	S	*	*			trans	-73	164.4	179.2	-58	169.8	128.2	0	0	114.5
488	N	23.9	Very low	26.5	Very low	136 Å²	136	153 Å²	153	73%	0.727	82%	0.818	S	S	*	*			trans	117.4	138.4	133.5	-76.1	-31.7	0	0	0	120.2
489	E	29.7	Very low	26.5	Very low	175 Å²	175	154.6 Å²	154.6	82%	0.818	82%	0.822	S	S	*	*			trans	104.7	89	153.3	-73.9	170.2	-160.1	0	0	121.1
490	Q	27.4	Very low	26.7	Very low	185 Å²	185	150 Å²	150	86%	0.864	81%	0.814	S	S	*	*				60.4	139.7	123	-91.2	-178.5	-16.8	0	0	123.9
491	P	37.8	Very low	27	Very low	122 Å²	122	149.4 Å²	149.4	79%	0.792	82%	0.816	S	S	*	*			trans	-100.5	144	-171.7	38.6	-29.8	0	0	0	114.1
492	L	27	Very low	26.9	Very low	177 Å²	177	146.8 Å²	146.8	93%	0.927	81%	0.813	S	S	*	*			trans	-104.5	123.3	172	-86	153.3	0	0	0	110.7
493	S	26.4	Very low	27.1	Very low	112 Å²	112	147.2 Å²	147.2	78%	0.783	81%	0.814	S	S	*	*			trans	-71.3	139.3	168	50.2	0	0	0	0	112
494	M	25.3	Very low	27.2	Very low	184 Å²	184	147.4 Å²	147.4	91%	0.906	81%	0.806	S	S	*	*			trans	-149.3	114.4	159.6	-155	132.8	-172.4	0	0	111
495	D	23.9	Very low	27.4	Very low	165 Å²	165	150.6 Å²	150.6	88%	0.882	81%	0.809	S	S	*	*			trans	-73.5	136.4	166.5	-82.6	-43.9	0	0	0	110.5
496	V	31.1	Very low	27.7	Very low	136 Å²	136	147.5 Å²	147.5	82%	0.824	81%	0.807	S	S	*	*			trans	-144.3	122	154.5	-177.5	0	0	0	0	110.4
497	S	27.9	Very low	27.9	Very low	106 Å²	106	148.2 Å²	148.2	74%	0.741	81%	0.806	S	S	*	*			trans	-37.8	135.5	174.7	-166.6	0	0	0	0	118.9
498	D	26.2	Very low	28.5	Very low	159 Å²	159	148.3 Å²	148.3	85%	0.85	81%	0.811	S	S	*	*			trans	-88.8	132.9	160	-80.9	-41.3	0	0	0	110.2
499	D	26.3	Very low	28.9	Very low	157 Å²	157	145.4 Å²	145.4	84%	0.84	81%	0.813	S	S	*	*			trans	-153.9	125.6	160.7	-127.8	-10.3	0	0	0	113.2
500	A	27.9	Very low	29.1	Very low	79 Å²	79	146.6 Å²	146.6	65%	0.653	82%	0.819	S	S	*	*			trans	46.3	121.6	152.8	0	0	0	0	0	122.5
501	T	31.6	Very low	29.6	Very low	136 Å²	136	140.8 Å²	140.8	83%	0.834	79%	0.793	S	S	*	*				-174.4	125.4	107.6	23.4	0	0	0	0	113.3
502	S	26.4	Very low	30.1	Very low	114 Å²	114	140.1 Å²	140.1	80%	0.797	79%	0.789	S	S	*	*			trans	-86.9	135.6	178.2	47.1	0	0	0	0	112.5
503	H	28.4	Very low	30.8	Very low	183 Å²	183	139.8 Å²	139.8	85%	0.847	78%	0.781	S	S	*	*			trans	-108.8	111.4	172.2	-82.2	-68.5	0	0	0	111.3
504	E	27.4	Very low	31.2	Very low	139 Å²	139	139 Å²	139	65%	0.65	78%	0.781	S	S	*	*			trans	-79.7	138.4	168.5	-78.9	178.3	144.9	0	0	111.6	Y29	Y29-E504 WeakPolarHBondContact CE1-OE1 3.33Å; Y29-E504 PolarHBondContact OH-OE1 3.41Å
505	I	28.6	Very low	31.7	Very low	150 Å²	150	133.9 Å²	133.9	77%	0.769	78%	0.775	S	S	*	*			trans	-120.4	118.1	177.9	-62.9	172.2	0	0	0	109.3
506	S	27.9	Very low	32.1	Very low	112 Å²	112	129.6 Å²	129.6	78%	0.783	76%	0.763	S	S	*	*			trans	-86.6	133.3	179.3	-69	0	0	0	0	113.5
507	Y	33.9	Very low	32.3	Very low	220 Å²	220	128.1 Å²	128.1	86%	0.863	76%	0.756	S	S	*	*			trans	24	128.8	134.3	-133.7	-101	0	0	0	119.4
508	L	32.8	Very low	32.9	Very low	167 Å²	167	127.2 Å²	127.2	87%	0.874	76%	0.755	S	S	*	*			trans	172.6	127.2	139.4	-94.1	166.1	0	0	0	114.4
509	G	33.3	Very low	33.4	Very low	75 Å²	75	124.5 Å²	124.5	77%	0.773	75%	0.749	S	S	*	*			trans	117.3	111.6	132.2	0	0	0	0	0	119
510	E	32.7	Very low	33.7	Very low	200 Å²	200	125.6 Å²	125.6	94%	0.935	75%	0.749	S	S	*	*			trans	-66	156.3	-179.7	-67.4	170.4	147.6	0	0	116.1
511	D	39.7	Very low	34.1	Very low	63 Å²	63	128.5 Å²	128.5	34%	0.337	75%	0.752	S	S	.	*			trans	-80	122.9	-170.4	-171.7	-20.2	0	0	0	114	R92 F513	R92-D511 IonicContact CZ-OD2 3.38Å; R92-D511 VanDerWaalsContact CZ-OD2 3.25Å; R92-D511 VanDerWaalsContact NH1-CG 3.29Å; R92-D511 IonicContact NH1-OD1 3.66Å; R92-D511 IonicContact NH1-OD2 2.98Å; R92-D511 PolarHBondContact NH1-OD2 2.9Å; R92-D511 IonicContact NH2-OD2 3.76Å; R92-D511 PolarHBondContact NH2-OD2 3.49Å; D511-F513 PolarHBondContact O-N 3.44Å; D511-F513 PolarHBondContact OD1-N 2.87Å
512	P	46.9	Very low	34.1	Very low	109 Å²	109	128.2 Å²	128.2	71%	0.708	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	2.4	-178.1	30	-32.4	0	0	0	116.3
513	F	41.3	Very low	34.4	Very low	169 Å²	169	129 Å²	129	74%	0.741	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	20.9	179.8	-63.7	-73.3	0	0	0	115.3	D511 G515	D511-F513 PolarHBondContact O-N 3.44Å; D511-F513 PolarHBondContact OD1-N 2.87Å; F513-G515 PolarHBondContact O-N 3.32Å
514	A	36.5	Very low	34.3	Very low	96 Å²	96	125.5 Å²	125.5	79%	0.793	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	96.3	166.5	0	0	0	0	0	110.7
515	G	34.3	Very low	34.4	Very low	76 Å²	76	126.4 Å²	126.4	78%	0.784	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	131.4	-0.5	165.5	0	0	0	0	0	118.4	F513	F513-G515 PolarHBondContact O-N 3.32Å
516	A	32.3	Very low	34.2	Very low	76 Å²	76	125.6 Å²	125.6	63%	0.628	76%	0.757	S	S	*	*			trans	-92.4	125	176.9	0	0	0	0	0	112.1
517	P	35.6	Very low	34.1	Very low	104 Å²	104	129.8 Å²	129.8	68%	0.675	76%	0.757	S	S	*	*			trans	-70.4	145.1	-179.3	25.7	-31.5	0	0	0	112.8	S519	P517-S519 PolarHBondContact O-N 3.28Å
518	A	41.2	Very low	34	Very low	87 Å²	87	125.2 Å²	125.2	72%	0.719	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-58.9	-9.7	-164.7	0	0	0	0	0	117.3	Q520	A518-Q520 PolarHBondContact O-N 3.08Å
519	S	36	Very low	33.7	Very low	103 Å²	103	122.5 Å²	122.5	72%	0.72	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-79.8	-7.5	-172.8	56.9	0	0	0	0	115.6	P517	P517-S519 PolarHBondContact O-N 3.28Å
520	Q	33	Very low	33.4	Very low	179 Å²	179	127.8 Å²	127.8	84%	0.836	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-96.9	2.4	177.2	-77.2	-172.4	-13.4	0	0	114.7	A518 V522	A518-Q520 PolarHBondContact O-N 3.08Å; Q520-V522 VanDerWaalsContact C-N 3.29Å; Q520-V522 PolarHBondContact O-N 3.42Å
521	I	37	Very low	33.1	Very low	141 Å²	141	127.5 Å²	127.5	72%	0.723	76%	0.755	S	S	*	*			trans	-86.3	73.8	173.6	-49.2	175.3	0	0	0	108.4
522	V	29.9	Very low	32.4	Very low	129 Å²	129	134.1 Å²	134.1	78%	0.782	78%	0.78	S	S	*	*			trans	-119.7	91.7	168.8	-176.7	0	0	0	0	107.6	Q520	Q520-V522 VanDerWaalsContact C-N 3.29Å; Q520-V522 PolarHBondContact O-N 3.42Å
523	T	32.6	Very low	31.4	Very low	131 Å²	131	134.5 Å²	134.5	80%	0.804	79%	0.786	S	S	*	*			trans	-106.5	133.5	170.5	34.4	0	0	0	0	110.5
524	S	27.5	Very low	30.7	Very low	110 Å²	110	134.5 Å²	134.5	77%	0.769	79%	0.792	S	S	*	*			trans	-66.2	125.2	-161.5	-29.9	0	0	0	0	114.1	T526	S524-T526 PolarHBondContact O-N 3.04Å; S524-T526 VanDerWaalsContact O-N 3.1Å
525	L	28.4	Very low	30.2	Very low	157 Å²	157	134.8 Å²	134.8	82%	0.822	79%	0.788	S	S	*	*			trans	-54	107.5	168.8	-87.3	139.4	0	0	0	111.4
526	T	25.8	Very low	29.7	Very low	134 Å²	134	141.3 Å²	141.3	82%	0.822	79%	0.794	S	S	*	*			trans	-95.6	102.7	167.2	-52.2	0	0	0	0	108.1	S524	S524-T526 PolarHBondContact O-N 3.04Å; S524-T526 VanDerWaalsContact O-N 3.1Å
527	Y	26.1	Very low	29.3	Very low	200 Å²	200	146 Å²	146	78%	0.784	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.9	128.1	176.6	-95.4	-93.9	0	0	0	111	S529	Y527-S529 PolarHBondContact O-N 3.34Å
528	P	30.4	Very low	28.7	Very low	124 Å²	124	149.4 Å²	149.4	81%	0.805	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72	125	174.3	27	-29.8	0	0	0	110.5
529	S	27.1	Very low	27.9	Very low	109 Å²	109	149.7 Å²	149.7	76%	0.762	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-69.6	131	-176.4	49.7	0	0	0	0	114	Y527	Y527-S529 PolarHBondContact O-N 3.34Å
530	Q	27.8	Very low	27.3	Very low	186 Å²	186	153.2 Å²	153.2	87%	0.869	81%	0.81	S	S	*	*			trans	59.1	86.5	146.9	-62.2	-170.1	-11	0	0	118.2	K532	Q530-K532 PolarHBondContact O-N 3.01Å
531	M	25	Very low	27	Very low	195 Å²	195	150.5 Å²	150.5	96%	0.961	80%	0.801	S	S	*	*			trans	-59.9	115.1	152.7	-92.6	177	152.8	0	0	110	S533	M531-S533 PolarHBondContact O-N 3.44Å
532	K	26.3	Very low	26.4	Very low	201 Å²	201	149.1 Å²	149.1	87%	0.874	80%	0.804	S	S	*	*			trans	-61.6	118.3	169.6	-85.1	174.8	174.1	173.7	0	109.7	Q530 I534	Q530-K532 PolarHBondContact O-N 3.01Å; K532-I534 PolarHBondContact O-N 3.27Å; K532-I534 VanDerWaalsContact O-N 3.14Å
533	S	25.1	Very low	26.4	Very low	118 Å²	118	150.4 Å²	150.4	83%	0.825	81%	0.805	S	S	*	*			trans	-57.2	108.2	170.2	51.9	0	0	0	0	110.9	M531 S535	M531-S533 PolarHBondContact O-N 3.44Å; S533-S535 PolarHBondContact O-N 2.98Å
534	I	26.5	Very low	26.2	Very low	169 Å²	169	151.4 Å²	151.4	87%	0.867	81%	0.805	S	S	*	*			trans	-74.3	114.1	167.5	-64.8	170.9	0	0	0	106.9	K532	K532-I534 PolarHBondContact O-N 3.27Å; K532-I534 VanDerWaalsContact O-N 3.14Å
535	S	25.6	Very low	26.3	Very low	102 Å²	102	151.7 Å²	151.7	71%	0.713	80%	0.795	S	S	*	*			trans	-62.3	129.1	-177.7	52.5	0	0	0	0	111.9	S533 Q537	S533-S535 PolarHBondContact O-N 2.98Å; S535-Q537 PolarHBondContact O-N 2.97Å
536	K	25.3	Very low	26.2	Very low	212 Å²	212	153 Å²	153	92%	0.922	79%	0.794	S	S	*	*			trans	-51.2	104.2	169.4	-73.8	175.2	173.3	178.4	0	110.7
537	Q	22.8	Very low	26.4	Very low	176 Å²	176	149 Å²	149	82%	0.822	78%	0.78	S	S	*	*			trans	-90.7	107.9	158.5	-112.2	179.2	-4.2	0	0	108	S535 V539	S535-Q537 PolarHBondContact O-N 2.97Å; Q537-V539 PolarHBondContact O-N 2.69Å; Q537-V539 VanDerWaalsContact O-N 3.12Å
538	M	22.4	Very low	26.7	Very low	175 Å²	175	145.8 Å²	145.8	86%	0.862	78%	0.776	S	S	*	*			trans	-67.8	98	172.5	-166.8	172.1	178	0	0	107.4
539	V	25.6	Very low	26.8	Very low	92 Å²	92	147.9 Å²	147.9	56%	0.558	77%	0.773	S	S	*	*			trans	-120.3	99.5	169.3	-178.7	0	0	0	0	106.3	Q537 N541	Q537-V539 PolarHBondContact O-N 2.69Å; Q537-V539 VanDerWaalsContact O-N 3.12Å; V539-N541 HydrophobicContact CG1-CB 4.33Å; V539-N541 WeakPolarHBondContact CG1-ND2 3.36Å; V539-N541 PolarHBondContact O-N 3.41Å
540	E	23.7	Very low	27.2	Very low	177 Å²	177	144.1 Å²	144.1	83%	0.827	75%	0.746	S	S	*	*			trans	-61.4	85.4	163.4	-76.1	178.7	147.9	0	0	108.5
541	N	25.4	Very low	27.4	Very low	123 Å²	123	136.6 Å²	136.6	66%	0.658	71%	0.714	S	S	*	*			trans	-106.6	105.3	164.9	-82.1	-15.8	0	0	0	107.4	V539 I543	V539-N541 HydrophobicContact CG1-CB 4.33Å; V539-N541 WeakPolarHBondContact CG1-ND2 3.36Å; V539-N541 PolarHBondContact O-N 3.41Å; N541-I543 PolarHBondContact O-N 3.44Å
542	S	25.5	Very low	27.9	Very low	112 Å²	112	131 Å²	131	78%	0.783	69%	0.693	S	S	*	*			trans	-38.1	110	160.5	53.6	0	0	0	0	109	L544	S542-L544 PolarHBondContact O-N 3.03Å
543	I	29.1	Very low	28.2	Very low	156 Å²	156	126.2 Å²	126.2	80%	0.8	68%	0.684	S	S	*	*			trans	-69.1	84.5	177.2	-59.3	173.2	0	0	0	106.5	N541 M545	N541-I543 PolarHBondContact O-N 3.44Å; I543-M545 PolarHBondContact O-N 3.02Å; I543-M545 VanDerWaalsContact O-N 3.1Å
544	L	27.9	Very low	28.5	Very low	152 Å²	152	127.3 Å²	127.3	80%	0.796	68%	0.681	S	S	*	*			trans	-59.6	109.7	161	-164.4	91	0	0	0	105.5	S542 K546	S542-L544 PolarHBondContact O-N 3.03Å; L544-K546 VanDerWaalsContact C-N 3.33Å; L544-K546 PolarHBondContact O-N 3.02Å
545	M	29.8	Very low	28.8	Very low	116 Å²	116	122.2 Å²	122.2	57%	0.571	66%	0.655	S	S	*	*			trans	-46.1	82.1	-176	-69.1	-87.4	179.7	0	0	113.2	I543 G547	I543-M545 PolarHBondContact O-N 3.02Å; I543-M545 VanDerWaalsContact O-N 3.1Å; M545-G547 PolarHBondContact O-N 3.03Å
546	K	27.5	Very low	28.8	Very low	183 Å²	183	119.8 Å²	119.8	80%	0.796	65%	0.646	S	S	*	*			trans	-75.9	114.3	168.8	-91.4	-176.1	174.4	-179.7	0	108.5	L544 N548	L544-K546 VanDerWaalsContact C-N 3.33Å; L544-K546 PolarHBondContact O-N 3.02Å; K546-N548 PolarHBondContact O-N 3.44Å; K546-N548 VanDerWaalsContact O-N 3.17Å
547	G	30.2	Very low	28.9	Very low	51 Å²	51	117.1 Å²	117.1	53%	0.526	63%	0.631	S	S	.	*			trans	-72.8	100.3	-169.6	0	0	0	0	0	113.8	M545	M545-G547 PolarHBondContact O-N 3.03Å
548	N	32.2	Very low	29.2	Very low	132 Å²	132	119.8 Å²	119.8	71%	0.706	63%	0.634	S	S	*	*			trans	-80.4	115	155.1	-71.2	-9.8	0	0	0	107.5	K546 S550	K546-N548 PolarHBondContact O-N 3.44Å; K546-N548 VanDerWaalsContact O-N 3.17Å; N548-S550 PolarHBondContact O-N 3.38Å
549	K	31.8	Very low	29.3	Very low	168 Å²	168	119.4 Å²	119.4	73%	0.73	63%	0.628	S	S	*	*			trans	-68.2	117.8	177.4	-68.4	175.5	-179.5	171.6	0	108.2
550	S	36.1	Very low	29.3	Very low	30 Å²	30	120 Å²	120	21%	0.21	64%	0.636	C	S	.	*			trans	-80.7	-12.2	-177.8	35.7	0	0	0	0	114	R441 E444 N548	R441-S550 PolarHBondContact NH1-O 3.07Å; E444-S550 PolarHBondContact OE2-OG 2.98Å; N548-S550 PolarHBondContact O-N 3.38Å
551	C	32.6	Very low	29.4	Very low	28 Å²	28	117.6 Å²	117.6	19%	0.189	63%	0.633	C	S	.	*	S	Bend	trans	-77.4	125.6	170.7	-70.5	0	0	0	0	108.5	R441 Q445 S553	R441-C551 PolarHBondContact NH1-SG 2.87Å; R441-C551 VanDerWaalsContact NH1-SG 3.37Å; Q445-C551 PolarHBondContact NE2-SG 3.4Å; Q445-C551 VanDerWaalsContact NE2-SG 3.43Å; C551-S553 PolarHBondContact O-N 3.23Å
552	P	33.8	Very low	29.4	Very low	79 Å²	79	117.4 Å²	117.4	51%	0.513	63%	0.632	S	S	.	*			trans	-59.9	108.7	167.5	24	-29.1	0	0	0	107.1	D554 I555	P552-D554 PolarHBondContact O-N 3.45Å; P552-I555 HydrophobicContact CG-CG1 4.44Å
553	S	34.2	Very low	29.4	Very low	99 Å²	99	117.2 Å²	117.2	69%	0.692	63%	0.629	S	S	*	*	S	Bend	trans	-60.8	-24.9	171.4	-42	0	0	0	0	110.4	C551	C551-S553 PolarHBondContact O-N 3.23Å
554	D	30.4	Very low	29.2	Very low	142 Å²	142	117.7 Å²	117.7	76%	0.759	63%	0.631	S	S	*	*			trans	-111.9	73.8	-176.1	-60.1	-43.7	0	0	0	110.4	P552 G556	P552-D554 PolarHBondContact O-N 3.45Å; D554-G556 PolarHBondContact O-N 2.92Å
555	I	32.8	Very low	29.2	Very low	62 Å²	62	116.4 Å²	116.4	32%	0.318	63%	0.629	S	S	.	*			trans	-71	94	151	-63.8	173	0	0	0	104.3	P552 Y557 Y588	P552-I555 HydrophobicContact CG-CG1 4.44Å; I555-Y557 PolarHBondContact O-N 2.91Å; I555-Y588 HydrophobicContact CD1-CE2 4.33Å
556	G	26.7	Very low	29.1	Very low	51 Å²	51	115.5 Å²	115.5	53%	0.526	63%	0.634	S	S	.	*			trans	-43.6	125.1	179.4	0	0	0	0	0	110.1	D554 W558	D554-G556 PolarHBondContact O-N 2.92Å; G556-W558 PolarHBondContact O-N 2.83Å
557	Y	27.4	Very low	29	Very low	155 Å²	155	114.2 Å²	114.2	61%	0.608	64%	0.636	S	S	*	*			trans	-51.1	108.2	-176.3	-85	-99.2	0	0	0	110.5	I555 F559	I555-Y557 PolarHBondContact O-N 2.91Å; Y557-F559 HydrophobicContact CD1-CE2 4.35Å; Y557-F559 HydrophobicContact CG-CE2 4.37Å; Y557-F559 PolarHBondContact O-N 3.45Å
558	W	27.1	Very low	28.9	Very low	232 Å²	232	119.8 Å²	119.8	88%	0.879	65%	0.654	S	S	*	*			trans	-73.2	81.2	173.9	-68.4	67.1	0	0	0	108.3	G556 S560	G556-W558 PolarHBondContact O-N 2.83Å; W558-S560 PolarHBondContact O-N 3.31Å; W558-S560 VanDerWaalsContact O-N 3.1Å
559	F	25.1	Very low	28.7	Very low	168 Å²	168	122.6 Å²	122.6	74%	0.737	66%	0.66	S	S	*	*			trans	-70.9	102.9	163.2	-76.5	-78.3	0	0	0	107.4	Y557 T561	Y557-F559 HydrophobicContact CD1-CE2 4.35Å; Y557-F559 HydrophobicContact CG-CE2 4.37Å; Y557-F559 PolarHBondContact O-N 3.45Å; F559-T561 PolarHBondContact O-N 3.34Å
560	S	26	Very low	28.4	Very low	105 Å²	105	122.4 Å²	122.4	73%	0.734	67%	0.665	S	S	*	*			trans	-58.3	90.2	164	170.6	0	0	0	0	108.4	W558 N562	W558-S560 PolarHBondContact O-N 3.31Å; W558-S560 VanDerWaalsContact O-N 3.1Å; S560-N562 PolarHBondContact O-N 2.9Å; S560-N562 VanDerWaalsContact O-N 3.07Å
561	T	25.6	Very low	27.9	Very low	125 Å²	125	128.2 Å²	128.2	77%	0.767	69%	0.692	S	S	*	*			trans	-64.5	108.5	164.3	48.2	0	0	0	0	106.7	F559	F559-T561 PolarHBondContact O-N 3.34Å
562	N	25.3	Very low	27.7	Very low	120 Å²	120	134 Å²	134	64%	0.642	72%	0.721	S	S	*	*			trans	-45.4	134.9	175.5	-77.5	-33	0	0	0	110.1	S560 I564	S560-N562 PolarHBondContact O-N 2.9Å; S560-N562 VanDerWaalsContact O-N 3.07Å; N562-I564 PolarHBondContact O-N 3.44Å
563	P	26	Very low	27.3	Very low	108 Å²	108	137.8 Å²	137.8	70%	0.701	74%	0.737	S	S	*	*			trans	-61.4	124.3	-178.9	25.9	-32.1	0	0	0	108.4	V565	P563-V565 VanDerWaalsContact C-N 3.29Å; P563-V565 PolarHBondContact O-N 2.87Å
564	I	25.6	Very low	27	Very low	165 Å²	165	140 Å²	140	85%	0.846	74%	0.741	S	S	*	*			trans	-62	96.4	171.4	-61.8	169.4	0	0	0	106	N562 S566	N562-I564 PolarHBondContact O-N 3.44Å; I564-S566 VanDerWaalsContact C-N 3.34Å; I564-S566 PolarHBondContact O-N 3.06Å
565	V	27.7	Very low	26.9	Very low	126 Å²	126	141 Å²	141	76%	0.764	75%	0.746	S	S	*	*			trans	-67.9	102.2	164.6	176.7	0	0	0	0	105.4	P563 D567	P563-V565 VanDerWaalsContact C-N 3.29Å; P563-V565 PolarHBondContact O-N 2.87Å; V565-D567 PolarHBondContact O-N 2.86Å
566	S	26.6	Very low	26.7	Very low	97 Å²	97	146.4 Å²	146.4	68%	0.678	78%	0.776	S	S	*	*			trans	-55	105.1	167.4	53	0	0	0	0	108.9	I564	I564-S566 VanDerWaalsContact C-N 3.34Å; I564-S566 PolarHBondContact O-N 3.06Å
567	D	26.2	Very low	26.7	Very low	156 Å²	156	148.5 Å²	148.5	83%	0.834	78%	0.783	S	S	*	*			trans	-160.3	112.8	141.4	-96	-26.2	0	0	0	109.1	V565 K569	V565-D567 PolarHBondContact O-N 2.86Å; D567-K569 PolarHBondContact O-N 3.36Å
568	N	27.9	Very low	26.9	Very low	168 Å²	168	146 Å²	146	90%	0.898	79%	0.794	S	S	*	*			trans	-56.5	96.7	-179.8	-73.4	-31.9	0	0	0	111.5
569	K	27.4	Very low	27.1	Very low	190 Å²	190	141.8 Å²	141.8	83%	0.826	79%	0.789	S	S	*	*			trans	-133.7	103.2	149.9	-91.9	-175.8	179.8	173.2	0	109.2	D567 I571	D567-K569 PolarHBondContact O-N 3.36Å; K569-I571 PolarHBondContact O-N 3.18Å
570	I	25.8	Very low	27.4	Very low	165 Å²	165	143 Å²	143	85%	0.846	79%	0.794	S	S	*	*			trans	-55.2	96.6	168.3	-59.7	166	0	0	0	107.4
571	I	26.1	Very low	27.6	Very low	151 Å²	151	143.3 Å²	143.3	77%	0.774	79%	0.791	S	S	*	*			trans	-93.7	111.6	167.2	-62.8	178.2	0	0	0	106.1	K569 N573	K569-I571 PolarHBondContact O-N 3.18Å; I571-N573 PolarHBondContact O-N 3.42Å
572	N	27.3	Very low	27.7	Very low	150 Å²	150	145.5 Å²	145.5	80%	0.802	80%	0.798	S	S	*	*			trans	-45.4	119.9	179.3	-111.3	-20.1	0	0	0	112.1	N574	N572-N574 PolarHBondContact O-N 3.31Å
573	N	26.7	Very low	28.1	Very low	158 Å²	158	143.9 Å²	143.9	85%	0.845	80%	0.797	S	S	*	*			trans	-63.2	98.2	166	-96	-22.5	0	0	0	109.1	I571	I571-N573 PolarHBondContact O-N 3.42Å
574	N	27.4	Very low	28.5	Very low	147 Å²	147	142.8 Å²	142.8	79%	0.786	79%	0.791	S	S	*	*			trans	-167.6	88.2	153.8	-95.1	-19.6	0	0	0	107.6	N572	N572-N574 PolarHBondContact O-N 3.31Å
575	N	27.9	Very low	29.2	Very low	161 Å²	161	138.5 Å²	138.5	86%	0.861	77%	0.773	S	S	*	*			trans	-174	123.5	143.1	-89	-25.2	0	0	0	109.7	S577	N575-S577 PolarHBondContact O-N 3.27Å
576	N	28.3	Very low	30.5	Very low	177 Å²	177	135.7 Å²	135.7	95%	0.947	76%	0.759	S	S	*	*			trans	-59.3	95.1	175.7	-66.1	-42	0	0	0	111.1
577	S	27.7	Very low	31.9	Very low	94 Å²	94	135.7 Å²	135.7	66%	0.657	75%	0.751	S	S	*	*			trans	-116.5	109.4	155.9	68.1	0	0	0	0	109.3	N575 D579	N575-S577 PolarHBondContact O-N 3.27Å; S577-D579 PolarHBondContact O-N 3.04Å
578	A	31	Very low	33.5	Very low	103 Å²	103	133.1 Å²	133.1	85%	0.851	73%	0.731	S	S	*	*			trans	-73.1	68.9	173	0	0	0	0	0	109.9
579	D	31	Very low	35.3	Very low	143 Å²	143	126 Å²	126	77%	0.765	69%	0.692	S	S	*	*			trans	-132.7	50.1	173	-84.6	-33	0	0	0	110.2	S577 T581	S577-D579 PolarHBondContact O-N 3.04Å; D579-T581 VanDerWaalsContact C-N 3.31Å; D579-T581 PolarHBondContact O-N 3.15Å; D579-T581 VanDerWaalsContact O-N 3.1Å
580	K	31	Very low	37	Very low	195 Å²	195	122.5 Å²	122.5	85%	0.848	68%	0.679	S	S	*	*			trans	-80.4	82.6	165.4	-78.1	-173.7	177.4	-179	0	109.7	N582	K580-N582 PolarHBondContact O-N 2.83Å
581	T	30.7	Very low	39	Very low	111 Å²	111	118.1 Å²	118.1	68%	0.681	66%	0.656	S	S	*	*			trans	26.3	84.7	139.6	59	0	0	0	0	117	D579	D579-T581 VanDerWaalsContact C-N 3.31Å; D579-T581 PolarHBondContact O-N 3.15Å; D579-T581 VanDerWaalsContact O-N 3.1Å
582	N	29.2	Very low	41.1	Very low	170 Å²	170	111.4 Å²	111.4	91%	0.909	62%	0.621	S	S	*	*			trans	-87.3	95.6	159.1	-84	-18	0	0	0	109.5	K580	K580-N582 PolarHBondContact O-N 2.83Å
583	S	32.7	Very low	43.2	Very low	87 Å²	87	104.6 Å²	104.6	61%	0.608	59%	0.585	S	S	*	*			trans	-144	129.6	169.5	57.5	0	0	0	0	106.4
584	C	33.9	Very low	45.2	Very low	85 Å²	85	99.8 Å²	99.8	57%	0.574	56%	0.564	S	S	*	*			cis	-154	96.6	26.5	-85.2	0	0	0	0	110.9	S586	C584-S586 PolarHBondContact O-N 2.85Å
585	P	40.9	Very low	47.3	Very low	74 Å²	74	95.9 Å²	95.9	48%	0.481	54%	0.538	S	S	.	.	H	α-helix	trans	-62.6	-25.4	162.8	-22.4	33.5	0	0	0	112.7	L587 Y588 H589	P585-L587 PolarHBondContact O-N 2.91Å; P585-Y588 PolarHBondContact O-N 3.36Å; P585-H589 PolarHBondContact O-N 2.73Å; P585-H589 PolarHBondContact O-ND1 3.11Å
586	S	54.9	Low	49.6	Very low	68 Å²	68	88.3 Å²	88.3	48%	0.476	50%	0.497	S	S	.	.	H	α-helix	trans	-64.2	-39.7	-172.5	58.3	0	0	0	0	114.6	C584 Y588 H589 E590	C584-S586 PolarHBondContact O-N 2.85Å; S586-Y588 VanDerWaalsContact C-N 3.35Å; S586-Y588 PolarHBondContact O-N 3.21Å; S586-H589 PolarHBondContact O-N 2.92Å; S586-E590 PolarHBondContact O-N 2.87Å
587	L	56.8	Low	51.8	Low	97 Å²	97	81.5 Å²	81.5	51%	0.508	46%	0.461	S	S	.	.	H	α-helix	trans	-65.8	-39.7	-177.1	-174.7	69.5	0	0	0	111.5	P585 E590 I591	P585-L587 PolarHBondContact O-N 2.91Å; L587-E590 PolarHBondContact O-N 3.19Å; L587-I591 HydrophobicContact CD1-CD1 4.46Å; L587-I591 HydrophobicContact CD2-CD1 4.46Å; L587-I591 HydrophobicContact CG-CD1 3.95Å; L587-I591 VanDerWaalsContact O-CG1 3.27Å; L587-I591 WeakPolarHBondContact O-CG1 3.35Å; L587-I591 PolarHBondContact O-N 3.27Å
588	Y	58.8	Low	54	Low	102 Å²	102	80.2 Å²	80.2	40%	0.4	44%	0.444	S	S	.	.	H	α-helix	trans	-65.4	-41.7	177.4	178.8	-105.4	0	0	0	111.9	V452 I555 P585 S586 E590 I591 M592	V452-Y588 HydrophobicContact CB-CE1 4.44Å; V452-Y588 HydrophobicContact CG1-CD1 4.15Å; V452-Y588 HydrophobicContact CG1-CE1 4.03Å; V452-Y588 HydrophobicContact CG2-CD1 4.4Å; V452-Y588 HydrophobicContact CG2-CE1 3.48Å; V452-Y588 VanDerWaalsContact CG2-CE1 3.48Å; I555-Y588 HydrophobicContact CD1-CE2 4.33Å; P585-Y588 PolarHBondContact O-N 3.36Å; S586-Y588 VanDerWaalsContact C-N 3.35Å; S586-Y588 PolarHBondContact O-N 3.21Å; Y588-E590 VanDerWaalsContact C-N 3.33Å; Y588-E590 PolarHBondContact O-N 2.67Å; Y588-I591 PolarHBondContact O-N 3.41Å; Y588-M592 HydrophobicContact CD1-CG 4.36Å; Y588-M592 HydrophobicContact CD2-CG 4.29Å; Y588-M592 HydrophobicContact CE1-CG 3.98Å; Y588-M592 HydrophobicContact CE2-CG 3.88Å; Y588-M592 HydrophobicContact CE2-SD 4.21Å; Y588-M592 WeakPolarHBondContact O-CB 3.45Å; Y588-M592 VanDerWaalsContact O-CG 3.26Å; Y588-M592 WeakPolarHBondContact O-CG 3.5Å; Y588-M592 PolarHBondContact O-N 2.92Å
589	H	65.1	Low	56.1	Low	18 Å²	18	75.3 Å²	75.3	8%	0.083	40%	0.404	C	S	.	.	H	α-helix	trans	-60.1	-44.9	174.5	-72.6	69.6	0	0	0	111.2	V452 P585 S586 M592 I593	V452-H589 PolarHBondContact O-NE2 3.02Å; P585-H589 PolarHBondContact O-N 2.73Å; P585-H589 PolarHBondContact O-ND1 3.11Å; S586-H589 PolarHBondContact O-N 2.92Å; H589-M592 PolarHBondContact O-N 3.05Å; H589-I593 WeakPolarHBondContact O-CB 3.36Å; H589-I593 VanDerWaalsContact O-CG1 3.28Å; H589-I593 WeakPolarHBondContact O-CG1 3.42Å; H589-I593 PolarHBondContact O-N 2.85Å
590	E	64.4	Low	58.2	Low	117 Å²	117	68.5 Å²	68.5	55%	0.547	37%	0.368	S	S	.	.	H	α-helix	trans	-63.3	-44.7	179.3	-170.8	175.2	-176.1	0	0	112.3	S586 L587 Y588 M592 I593 S594	S586-E590 PolarHBondContact O-N 2.87Å; L587-E590 PolarHBondContact O-N 3.19Å; Y588-E590 VanDerWaalsContact C-N 3.33Å; Y588-E590 PolarHBondContact O-N 2.67Å; E590-M592 PolarHBondContact O-N 3.35Å; E590-I593 PolarHBondContact O-N 3.12Å; E590-S594 VanDerWaalsContact O-CB 3.3Å; E590-S594 WeakPolarHBondContact O-CB 3.36Å; E590-S594 PolarHBondContact O-N 3.42Å
591	I	66.8	Low	60.1	Low	73 Å²	73	61.1 Å²	61.1	37%	0.374	34%	0.338	S	S	.	.	H	α-helix	trans	-62	-44.2	176.3	-67.9	166.2	0	0	0	110.8	L587 Y588 S594 R595	L587-I591 HydrophobicContact CD1-CD1 4.46Å; L587-I591 HydrophobicContact CD2-CD1 4.46Å; L587-I591 HydrophobicContact CG-CD1 3.95Å; L587-I591 VanDerWaalsContact O-CG1 3.27Å; L587-I591 WeakPolarHBondContact O-CG1 3.35Å; L587-I591 PolarHBondContact O-N 3.27Å; Y588-I591 PolarHBondContact O-N 3.41Å; I591-S594 PolarHBondContact O-N 3.41Å; I591-R595 WeakPolarHBondContact O-CG 3.26Å; I591-R595 PolarHBondContact O-N 3.05Å
592	M	71.2	Confident	62.1	Low	9 Å²	9	56 Å²	56	4%	0.044	31%	0.306	C	S	.	.	H	α-helix	trans	-67.3	-38.1	-179.5	-71.5	-64.2	-80.5	0	0	112.3	A448 V452 Y588 H589 E590 S596	A448-M592 HydrophobicContact CB-CE 3.43Å; A448-M592 VanDerWaalsContact CB-CE 3.43Å; V452-M592 HydrophobicContact CG2-CE 4.21Å; V452-M592 HydrophobicContact CG2-CG 4.37Å; Y588-M592 HydrophobicContact CD1-CG 4.36Å; Y588-M592 HydrophobicContact CD2-CG 4.29Å; Y588-M592 HydrophobicContact CE1-CG 3.98Å; Y588-M592 HydrophobicContact CE2-CG 3.88Å; Y588-M592 HydrophobicContact CE2-SD 4.21Å; Y588-M592 WeakPolarHBondContact O-CB 3.45Å; Y588-M592 VanDerWaalsContact O-CG 3.26Å; Y588-M592 WeakPolarHBondContact O-CG 3.5Å; Y588-M592 PolarHBondContact O-N 2.92Å; H589-M592 PolarHBondContact O-N 3.05Å; E590-M592 PolarHBondContact O-N 3.35Å; M592-S596 WeakPolarHBondContact O-CB 3.39Å; M592-S596 PolarHBondContact O-N 3.38Å; M592-S596 PolarHBondContact O-OG 3.35Å
593	I	70.9	Confident	64.4	Low	8 Å²	8	48 Å²	48	4%	0.041	26%	0.263	C	S	.	.	H	α-helix	trans	-68.4	-44	175	-71.2	166.6	0	0	0	110.5	L453 H589 E590 R595 S596 I597 I723	L453-I593 HydrophobicContact CD2-CD1 4.36Å; H589-I593 WeakPolarHBondContact O-CB 3.36Å; H589-I593 VanDerWaalsContact O-CG1 3.28Å; H589-I593 WeakPolarHBondContact O-CG1 3.42Å; H589-I593 PolarHBondContact O-N 2.85Å; E590-I593 PolarHBondContact O-N 3.12Å; I593-R595 VanDerWaalsContact C-N 3.34Å; I593-R595 PolarHBondContact O-N 3.05Å; I593-S596 WeakPolarHBondContact O-CB 3.37Å; I593-S596 PolarHBondContact O-N 3.3Å; I593-S596 VanDerWaalsContact O-N 3.07Å; I593-I597 HydrophobicContact CG2-CD1 3.85Å; I593-I597 HydrophobicContact CG2-CG1 4.4Å; I593-I597 WeakPolarHBondContact O-CG1 3.31Å; I593-I597 PolarHBondContact O-N 2.86Å; I593-I723 HydrophobicContact CB-CG2 4.39Å; I593-I723 HydrophobicContact CD1-CB 3.84Å; I593-I723 HydrophobicContact CD1-CG2 3.33Å; I593-I723 HydrophobicContact CG1-CG2 4.43Å; I593-I723 HydrophobicContact CG2-CG2 4.35Å; I593-I723 WeakPolarHBondContact CG2-O 3.47Å
594	S	69.3	Low	66.4	Low	57 Å²	57	46.8 Å²	46.8	40%	0.399	25%	0.247	S	C	.	.	H	α-helix	trans	-57.1	-45.8	175.8	-176.2	0	0	0	0	111.9	E590 I591 S596 I597 Q598	E590-S594 VanDerWaalsContact O-CB 3.3Å; E590-S594 WeakPolarHBondContact O-CB 3.36Å; E590-S594 PolarHBondContact O-N 3.42Å; I591-S594 PolarHBondContact O-N 3.41Å; S594-S596 VanDerWaalsContact C-N 3.3Å; S594-S596 PolarHBondContact O-N 2.9Å; S594-I597 PolarHBondContact O-N 3.11Å; S594-Q598 WeakPolarHBondContact O-CG 3.45Å; S594-Q598 PolarHBondContact O-N 3.5Å
595	R	70.7	Confident	68.1	Low	65 Å²	65	46.5 Å²	46.5	25%	0.245	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-35.1	174.7	-75.2	-179.4	172	-170.8	-3.8	113.2	I591 I593 Q598 G599	I591-R595 WeakPolarHBondContact O-CG 3.26Å; I591-R595 PolarHBondContact O-N 3.05Å; I593-R595 VanDerWaalsContact C-N 3.34Å; I593-R595 PolarHBondContact O-N 3.05Å; R595-Q598 WeakPolarHBondContact O-CB 3.38Å; R595-Q598 PolarHBondContact O-N 3.28Å; R595-G599 PolarHBondContact O-N 2.99Å
596	S	76.5	Confident	69.6	Low	1 Å²	1	43 Å²	43	1%	0.007	21%	0.212	C	C	.	.	H	α-helix	trans	-71.3	-39	177.7	-58.9	0	0	0	0	111.9	C449 M592 I593 S594 Q598 G599 I600	C449-S596 WeakPolarHBondContact CB-OG 3.25Å; M592-S596 WeakPolarHBondContact O-CB 3.39Å; M592-S596 PolarHBondContact O-N 3.38Å; M592-S596 PolarHBondContact O-OG 3.35Å; I593-S596 WeakPolarHBondContact O-CB 3.37Å; I593-S596 PolarHBondContact O-N 3.3Å; I593-S596 VanDerWaalsContact O-N 3.07Å; S594-S596 VanDerWaalsContact C-N 3.3Å; S594-S596 PolarHBondContact O-N 2.9Å; S596-Q598 VanDerWaalsContact C-N 3.33Å; S596-G599 PolarHBondContact O-N 3.3Å; S596-I600 WeakPolarHBondContact O-CG1 3.48Å; S596-I600 PolarHBondContact O-N 3.07Å
597	I	74.5	Confident	70.3	Confident	34 Å²	34	39.8 Å²	39.8	17%	0.174	19%	0.189	C	C	.	.	H	α-helix	trans	-60.3	-44.7	171.6	-67.2	163.2	0	0	0	110.2	I593 S594 G599 I600 N601 P726 L727 E730	I593-I597 HydrophobicContact CG2-CD1 3.85Å; I593-I597 HydrophobicContact CG2-CG1 4.4Å; I593-I597 WeakPolarHBondContact O-CG1 3.31Å; I593-I597 PolarHBondContact O-N 2.86Å; S594-I597 PolarHBondContact O-N 3.11Å; I597-G599 VanDerWaalsContact C-N 3.35Å; I597-G599 PolarHBondContact O-N 3.39Å; I597-I600 PolarHBondContact O-N 2.76Å; I597-N601 PolarHBondContact O-N 2.63Å; I597-N601 PolarHBondContact O-ND2 3.07Å; I597-P726 HydrophobicContact CD1-CB 3.82Å; I597-L727 HydrophobicContact CG1-CB 4.34Å; I597-L727 HydrophobicContact CG1-CD1 3.86Å; I597-E730 HydrophobicContact CG2-CG 4.25Å
598	Q	73.8	Confident	70.8	Confident	67 Å²	67	38.7 Å²	38.7	31%	0.313	19%	0.186	S	C	.	.	H	α-helix	trans	-59.3	-44.8	174.1	-71.5	172.4	-17.9	0	0	111.6	S594 R595 S596 I600 N601 Q602	S594-Q598 WeakPolarHBondContact O-CG 3.45Å; S594-Q598 PolarHBondContact O-N 3.5Å; R595-Q598 WeakPolarHBondContact O-CB 3.38Å; R595-Q598 PolarHBondContact O-N 3.28Å; S596-Q598 VanDerWaalsContact C-N 3.33Å; Q598-I600 VanDerWaalsContact C-N 3.35Å; Q598-I600 PolarHBondContact O-N 2.92Å; Q598-N601 PolarHBondContact O-N 2.93Å; Q598-Q602 WeakPolarHBondContact O-CG 3.3Å; Q598-Q602 PolarHBondContact O-N 3.14Å
599	G	74.2	Confident	71.2	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-58.8	-41.9	175.2	0	0	0	0	0	113.5	R595 S596 I597 Q602 L603	R595-G599 PolarHBondContact O-N 2.99Å; S596-G599 PolarHBondContact O-N 3.3Å; I597-G599 VanDerWaalsContact C-N 3.35Å; I597-G599 PolarHBondContact O-N 3.39Å; G599-Q602 PolarHBondContact O-N 3.27Å; G599-L603 WeakPolarHBondContact O-CG 3.4Å; G599-L603 PolarHBondContact O-N 3.31Å; G599-L603 VanDerWaalsContact O-N 3.08Å
600	I	75.4	Confident	71.3	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.8	-41.1	175.3	-67.7	161.9	0	0	0	111.2	L446 S596 I597 Q598 Q602 L603 K604 F656 L727 E730 C731 L734	L446-I600 HydrophobicContact CD2-CD1 4.29Å; L446-I600 HydrophobicContact CD2-CG1 4.09Å; S596-I600 WeakPolarHBondContact O-CG1 3.48Å; S596-I600 PolarHBondContact O-N 3.07Å; I597-I600 PolarHBondContact O-N 2.76Å; Q598-I600 VanDerWaalsContact C-N 3.35Å; Q598-I600 PolarHBondContact O-N 2.92Å; I600-Q602 VanDerWaalsContact C-N 3.31Å; I600-Q602 PolarHBondContact O-N 3.11Å; I600-L603 WeakPolarHBondContact O-CB 3.38Å; I600-L603 PolarHBondContact O-N 2.94Å; I600-L603 VanDerWaalsContact O-N 3.13Å; I600-K604 PolarHBondContact O-N 3.37Å; I600-F656 HydrophobicContact CD1-CE1 4.19Å; I600-L727 HydrophobicContact CD1-CD1 3.42Å; I600-L727 VanDerWaalsContact CD1-CD1 3.42Å; I600-L727 HydrophobicContact CD1-CG 4.22Å; I600-E730 HydrophobicContact CG2-CB 3.83Å; I600-C731 WeakPolarHBondContact CD1-SG 3.4Å; I600-L734 HydrophobicContact CG2-CB 4.23Å; I600-L734 HydrophobicContact CG2-CD2 3.83Å
601	N	72.2	Confident	71.3	Confident	40 Å²	40	31.2 Å²	31.2	21%	0.214	16%	0.157	C	C	.	.	H	α-helix	trans	-61.6	-40.4	175.3	-73.9	-24.2	0	0	0	111.4	I597 Q598 L603 K604 Y605	I597-N601 PolarHBondContact O-N 2.63Å; I597-N601 PolarHBondContact O-ND2 3.07Å; Q598-N601 PolarHBondContact O-N 2.93Å; N601-L603 VanDerWaalsContact C-N 3.33Å; N601-L603 PolarHBondContact O-N 2.83Å; N601-K604 WeakPolarHBondContact O-CA 3.4Å; N601-K604 VanDerWaalsContact O-CB 3.26Å; N601-K604 WeakPolarHBondContact O-CB 3.33Å; N601-K604 PolarHBondContact O-N 3.5Å; N601-K604 VanDerWaalsContact O-N 3.11Å; N601-Y605 HydrophobicContact CB-CD2 4.49Å; N601-Y605 HydrophobicContact CB-CE2 4Å; N601-Y605 WeakPolarHBondContact O-CD2 3.41Å; N601-Y605 VanDerWaalsContact O-CG 3.31Å; N601-Y605 PolarHBondContact O-N 2.94Å
602	Q	71.6	Confident	71.1	Confident	3 Å²	3	30.6 Å²	30.6	1%	0.014	16%	0.159	C	C	.	.	H	α-helix	trans	-61.4	-39.8	172.8	-68.8	-174.9	-5.9	0	0	112.7	E350 L351 Y395 I442 Q598 G599 I600 K604 Y605 L606	E350-Q602 PolarHBondContact O-NE2 2.91Å; L351-Q602 HydrophobicContact CD2-CG 4.5Å; L351-Q602 PolarHBondContact O-NE2 2.85Å; Y395-Q602 PolarHBondContact OH-NE2 3.18Å; Y395-Q602 PolarHBondContact OH-OE1 2.93Å; I442-Q602 HydrophobicContact CD1-CB 4.15Å; Q598-Q602 WeakPolarHBondContact O-CG 3.3Å; Q598-Q602 PolarHBondContact O-N 3.14Å; G599-Q602 PolarHBondContact O-N 3.27Å; I600-Q602 VanDerWaalsContact C-N 3.31Å; I600-Q602 PolarHBondContact O-N 3.11Å; Q602-K604 VanDerWaalsContact C-N 3.32Å; Q602-K604 PolarHBondContact O-N 3.4Å; Q602-Y605 PolarHBondContact O-N 3.09Å; Q602-L606 WeakPolarHBondContact O-CB 3.4Å; Q602-L606 VanDerWaalsContact O-CG 3.31Å; Q602-L606 WeakPolarHBondContact O-CG 3.23Å; Q602-L606 PolarHBondContact O-N 3.41Å
603	L	76.9	Confident	70.6	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-62.7	-39.5	172.6	-65	-178.4	0	0	0	112	I439 I442 G599 I600 N601 L606 A607 I649 V652 L734	I439-L603 HydrophobicContact CG1-CD2 4.47Å; I442-L603 HydrophobicContact CB-CD2 4.47Å; I442-L603 HydrophobicContact CD1-CD2 3.51Å; I442-L603 HydrophobicContact CD1-CG 4.05Å; I442-L603 HydrophobicContact CG2-CD1 3.91Å; I442-L603 HydrophobicContact CG2-CD2 4.1Å; I442-L603 HydrophobicContact CG2-CG 3.9Å; G599-L603 WeakPolarHBondContact O-CG 3.4Å; G599-L603 PolarHBondContact O-N 3.31Å; G599-L603 VanDerWaalsContact O-N 3.08Å; I600-L603 WeakPolarHBondContact O-CB 3.38Å; I600-L603 PolarHBondContact O-N 2.94Å; I600-L603 VanDerWaalsContact O-N 3.13Å; N601-L603 VanDerWaalsContact C-N 3.33Å; N601-L603 PolarHBondContact O-N 2.83Å; L603-L606 PolarHBondContact O-N 3.48Å; L603-A607 VanDerWaalsContact O-CB 3.27Å; L603-A607 WeakPolarHBondContact O-CB 3.49Å; L603-A607 PolarHBondContact O-N 2.87Å; L603-I649 HydrophobicContact CB-CG2 4.08Å; L603-I649 HydrophobicContact CD1-CG2 4.31Å; L603-I649 HydrophobicContact CD2-CG2 3.86Å; L603-I649 HydrophobicContact CG-CG2 4.29Å; L603-V652 HydrophobicContact CD1-CG1 4.49Å; L603-L734 HydrophobicContact CB-CD2 3.65Å; L603-L734 HydrophobicContact CD1-CD2 4.22Å
604	K	75	Confident	70.1	Confident	62 Å²	62	33 Å²	33	27%	0.27	17%	0.17	S	C	.	.	H	α-helix	trans	-61.2	-44.1	174.6	-171.8	-176.5	179.4	179.5	0	111.9	I600 N601 Q602 A607 T608 E730 L734	I600-K604 PolarHBondContact O-N 3.37Å; N601-K604 WeakPolarHBondContact O-CA 3.4Å; N601-K604 VanDerWaalsContact O-CB 3.26Å; N601-K604 WeakPolarHBondContact O-CB 3.33Å; N601-K604 PolarHBondContact O-N 3.5Å; N601-K604 VanDerWaalsContact O-N 3.11Å; Q602-K604 VanDerWaalsContact C-N 3.32Å; Q602-K604 PolarHBondContact O-N 3.4Å; K604-A607 PolarHBondContact O-N 2.85Å; K604-T608 WeakPolarHBondContact O-CB 3.42Å; K604-T608 PolarHBondContact O-N 3.03Å; K604-T608 PolarHBondContact O-OG1 3.06Å; K604-E730 IonicContact NZ-OE2 2.73Å; K604-L734 VanDerWaalsContact CA-CD1 3.41Å; K604-L734 HydrophobicContact CB-CD1 3.75Å; K604-L734 HydrophobicContact CG-CD1 4.21Å
605	Y	70.4	Confident	69.1	Low	79 Å²	79	32.3 Å²	32.3	31%	0.31	16%	0.164	S	C	.	.	H	α-helix	trans	-64.9	-48	176.4	-64.2	-52	0	0	0	111.6	E350 N601 Q602 A607 T608 I609	E350-Y605 HydrophobicContact CB-CE2 4.31Å; E350-Y605 VanDerWaalsContact CD-CE2 3.44Å; E350-Y605 VanDerWaalsContact CD-CZ 3.46Å; E350-Y605 VanDerWaalsContact CD-OH 3.26Å; E350-Y605 HydrophobicContact CG-CE2 4.38Å; E350-Y605 PolarHBondContact OE1-OH 3.05Å; E350-Y605 WeakPolarHBondContact OE2-CE2 3.26Å; E350-Y605 PolarHBondContact OE2-OH 3.26Å; N601-Y605 HydrophobicContact CB-CD2 4.49Å; N601-Y605 HydrophobicContact CB-CE2 4Å; N601-Y605 WeakPolarHBondContact O-CD2 3.41Å; N601-Y605 VanDerWaalsContact O-CG 3.31Å; N601-Y605 PolarHBondContact O-N 2.94Å; Q602-Y605 PolarHBondContact O-N 3.09Å; Y605-A607 VanDerWaalsContact C-N 3.31Å; Y605-A607 PolarHBondContact O-N 3.24Å; Y605-T608 PolarHBondContact O-N 2.98Å; Y605-I609 VanDerWaalsContact O-CG1 3.24Å; Y605-I609 WeakPolarHBondContact O-CG1 3.3Å; Y605-I609 PolarHBondContact O-N 3.47Å
606	L	71.8	Confident	67.9	Low	2 Å²	2	30.1 Å²	30.1	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-57.2	-45.1	175.3	-72	170.1	0	0	0	111.5	L438 Q602 L603 T608 I609 I610 I649	L438-L606 HydrophobicContact CB-CD1 4.48Å; L438-L606 HydrophobicContact CD1-CD1 4.31Å; L438-L606 HydrophobicContact CD1-CD2 4.15Å; Q602-L606 WeakPolarHBondContact O-CB 3.4Å; Q602-L606 VanDerWaalsContact O-CG 3.31Å; Q602-L606 WeakPolarHBondContact O-CG 3.23Å; Q602-L606 PolarHBondContact O-N 3.41Å; L603-L606 PolarHBondContact O-N 3.48Å; L606-T608 PolarHBondContact O-N 3.36Å; L606-I609 PolarHBondContact O-N 2.99Å; L606-I610 WeakPolarHBondContact O-CB 3.24Å; L606-I610 WeakPolarHBondContact O-CD1 3.01Å; L606-I610 WeakPolarHBondContact O-CG1 3.39Å; L606-I610 PolarHBondContact O-N 3.1Å; L606-I649 HydrophobicContact CB-CD1 4.39Å
607	A	70.7	Confident	66.2	Low	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-41.5	177.7	0	0	0	0	0	112.5	L603 K604 Y605 N611 V737 F738	L603-A607 VanDerWaalsContact O-CB 3.27Å; L603-A607 WeakPolarHBondContact O-CB 3.49Å; L603-A607 PolarHBondContact O-N 2.87Å; K604-A607 PolarHBondContact O-N 2.85Å; Y605-A607 VanDerWaalsContact C-N 3.31Å; Y605-A607 PolarHBondContact O-N 3.24Å; A607-N611 WeakPolarHBondContact O-CB 3.39Å; A607-N611 PolarHBondContact O-N 3.27Å; A607-V737 HydrophobicContact CB-CG1 4.25Å; A607-F738 HydrophobicContact CB-CE1 3.89Å; A607-F738 HydrophobicContact CB-CE2 4.43Å; A607-F738 HydrophobicContact CB-CZ 3.6Å
608	T	67.2	Low	64.7	Low	73 Å²	73	35.7 Å²	35.7	45%	0.448	19%	0.191	S	C	.	.	H	α-helix	trans	-68.6	-39.3	-179.8	-54.5	0	0	0	0	111.7	K604 Y605 L606 N611 S612	K604-T608 WeakPolarHBondContact O-CB 3.42Å; K604-T608 PolarHBondContact O-N 3.03Å; K604-T608 PolarHBondContact O-OG1 3.06Å; Y605-T608 PolarHBondContact O-N 2.98Å; L606-T608 PolarHBondContact O-N 3.36Å; T608-N611 VanDerWaalsContact O-CB 3.3Å; T608-N611 WeakPolarHBondContact O-CB 3.26Å; T608-N611 PolarHBondContact O-N 2.97Å; T608-S612 PolarHBondContact O-N 2.98Å; T608-S612 VanDerWaalsContact O-N 3.11Å
609	I	66.2	Low	62.9	Low	23 Å²	23	40.9 Å²	40.9	12%	0.118	22%	0.215	C	C	.	.	H	α-helix	trans	-68.1	-47.4	176.1	-64.7	167.1	0	0	0	109.9	F340 M347 F431 Y605 L606 N611 S612 Y613	F340-I609 HydrophobicContact CE2-CG2 3.87Å; F340-I609 HydrophobicContact CZ-CD1 4.3Å; F340-I609 HydrophobicContact CZ-CG2 4.05Å; M347-I609 HydrophobicContact CE-CD1 4.2Å; M347-I609 HydrophobicContact SD-CD1 3.72Å; M347-I609 HydrophobicContact SD-CG1 4.47Å; F431-I609 HydrophobicContact CE1-CG2 4.21Å; F431-I609 HydrophobicContact CE2-CG2 4.46Å; F431-I609 HydrophobicContact CZ-CG2 3.57Å; Y605-I609 VanDerWaalsContact O-CG1 3.24Å; Y605-I609 WeakPolarHBondContact O-CG1 3.3Å; Y605-I609 PolarHBondContact O-N 3.47Å; L606-I609 PolarHBondContact O-N 2.99Å; I609-N611 PolarHBondContact O-N 2.92Å; I609-S612 PolarHBondContact O-N 3.28Å; I609-S612 PolarHBondContact O-OG 3.12Å; I609-Y613 HydrophobicContact CG2-CD2 3.95Å; I609-Y613 HydrophobicContact CG2-CE2 3.69Å; I609-Y613 WeakPolarHBondContact O-CD2 2.94Å; I609-Y613 PolarHBondContact O-N 3.42Å
610	I	67.5	Low	60.9	Low	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-56.9	-35.8	175.6	-70.5	165.1	0	0	0	110.7	F431 V435 L606 Y613 C614 F642 L645 I646 I649	F431-I610 HydrophobicContact CD1-CD1 4.44Å; F431-I610 HydrophobicContact CD1-CG1 4.04Å; F431-I610 HydrophobicContact CE1-CG1 4.22Å; F431-I610 HydrophobicContact CG-CG1 4.49Å; V435-I610 HydrophobicContact CG2-CD1 4.45Å; L606-I610 WeakPolarHBondContact O-CB 3.24Å; L606-I610 WeakPolarHBondContact O-CD1 3.01Å; L606-I610 WeakPolarHBondContact O-CG1 3.39Å; L606-I610 PolarHBondContact O-N 3.1Å; I610-Y613 PolarHBondContact O-N 3.08Å; I610-C614 PolarHBondContact O-N 2.95Å; I610-C614 VanDerWaalsContact O-N 3.16Å; I610-F642 HydrophobicContact CG2-CD1 3.67Å; I610-F642 HydrophobicContact CG2-CE1 4.25Å; I610-F642 HydrophobicContact CG2-CG 4.49Å; I610-L645 HydrophobicContact CD1-CB 4.35Å; I610-I646 HydrophobicContact CG2-CD1 3.88Å; I610-I646 HydrophobicContact CG2-CG1 3.76Å; I610-I649 HydrophobicContact CD1-CD1 3.82Å
611	N	64.7	Low	58.9	Low	57 Å²	57	51.5 Å²	51.5	31%	0.305	27%	0.265	S	S	.	.	H	α-helix	trans	-63.8	-42.3	175.3	-162.5	34.6	0	0	0	113.3	A607 T608 I609 Y613 C614 F741	A607-N611 WeakPolarHBondContact O-CB 3.39Å; A607-N611 PolarHBondContact O-N 3.27Å; T608-N611 VanDerWaalsContact O-CB 3.3Å; T608-N611 WeakPolarHBondContact O-CB 3.26Å; T608-N611 PolarHBondContact O-N 2.97Å; I609-N611 PolarHBondContact O-N 2.92Å; N611-Y613 PolarHBondContact O-N 2.65Å; N611-C614 PolarHBondContact O-N 3.45Å; N611-F741 HydrophobicContact CB-CE1 4.47Å; N611-F741 HydrophobicContact CB-CZ 3.8Å; N611-F741 WeakPolarHBondContact OD1-CE1 2.96Å; N611-F741 WeakPolarHBondContact OD1-CZ 3.05Å
612	S	63	Low	57.2	Low	60 Å²	60	55 Å²	55	42%	0.42	28%	0.283	S	S	.	.	H	α-helix	trans	-67.6	-24.4	-177.9	67.8	0	0	0	0	112.9	T608 I609	T608-S612 PolarHBondContact O-N 2.98Å; T608-S612 VanDerWaalsContact O-N 3.11Å; I609-S612 PolarHBondContact O-N 3.28Å; I609-S612 PolarHBondContact O-OG 3.12Å
613	Y	61.2	Low	55.4	Low	51 Å²	51	58 Å²	58	20%	0.2	32%	0.316	C	S	.	.	H	α-helix	trans	-92.2	-14.4	175.5	-69.7	-75.6	0	0	0	114.4	F340 L424 V427 F431 I609 I610 N611 P615	F340-Y613 WeakPolarHBondContact CD2-OH 3.48Å; F340-Y613 HydrophobicContact CE2-CE2 4.08Å; L424-Y613 WeakPolarHBondContact CD1-O 3.48Å; V427-Y613 HydrophobicContact CG1-CD1 4.09Å; V427-Y613 HydrophobicContact CG1-CD2 4.4Å; V427-Y613 HydrophobicContact CG1-CE1 4.4Å; V427-Y613 HydrophobicContact CG1-CG 4.1Å; F431-Y613 HydrophobicContact CE2-CD2 4.32Å; I609-Y613 HydrophobicContact CG2-CD2 3.95Å; I609-Y613 HydrophobicContact CG2-CE2 3.69Å; I609-Y613 WeakPolarHBondContact O-CD2 2.94Å; I609-Y613 PolarHBondContact O-N 3.42Å; I610-Y613 PolarHBondContact O-N 3.08Å; N611-Y613 PolarHBondContact O-N 2.65Å; Y613-P615 WeakPolarHBondContact O-CD 3.15Å; Y613-P615 VanDerWaalsContact O-N 3.11Å
614	C	59.8	Low	53.2	Low	17 Å²	17	62.7 Å²	62.7	12%	0.115	34%	0.34	C	S	.	.			trans	-66.6	112.2	177.6	-169.7	0	0	0	0	108.6	I610 N611 I616	I610-C614 PolarHBondContact O-N 2.95Å; I610-C614 VanDerWaalsContact O-N 3.16Å; N611-C614 PolarHBondContact O-N 3.45Å; C614-I616 PolarHBondContact O-N 3.38Å
615	P	47.1	Very low	51	Low	42 Å²	42	64.9 Å²	64.9	27%	0.273	35%	0.354	S	S	.	.			trans	-73.6	14.7	-166.8	30.9	-37.4	0	0	0	114.2	Y420 L424 Y613 L635	Y420-P615 HydrophobicContact CE1-CB 4.49Å; L424-P615 HydrophobicContact CD2-CB 4.13Å; L424-P615 HydrophobicContact CD2-CG 3.6Å; Y613-P615 WeakPolarHBondContact O-CD 3.15Å; Y613-P615 VanDerWaalsContact O-N 3.11Å; P615-L635 HydrophobicContact CG-CD2 4.11Å
616	I	45.6	Very low	49.7	Very low	20 Å²	20	66.4 Å²	66.4	10%	0.103	37%	0.374	C	S	.	.			trans	-134	108.6	-163.7	-58.5	139.3	0	0	0	109.6	C614 F618 F621 A639	C614-I616 PolarHBondContact O-N 3.38Å; I616-F618 HydrophobicContact CG2-CB 4.41Å; I616-F618 HydrophobicContact CG2-CD1 4.03Å; I616-F618 HydrophobicContact CG2-CE1 4.49Å; I616-F618 HydrophobicContact CG2-CG 4.14Å; I616-F618 PolarHBondContact O-N 3.08Å; I616-F618 VanDerWaalsContact O-N 3.15Å; I616-F621 HydrophobicContact CB-CE2 4.02Å; I616-F621 HydrophobicContact CD1-CE2 3.51Å; I616-F621 HydrophobicContact CD1-CZ 3.89Å; I616-F621 HydrophobicContact CG1-CE2 3.52Å; I616-F621 HydrophobicContact CG1-CZ 4.02Å; I616-F621 HydrophobicContact CG2-CD2 3.5Å; I616-F621 VanDerWaalsContact CG2-CD2 3.5Å; I616-F621 HydrophobicContact CG2-CE2 3.27Å; I616-F621 HydrophobicContact CG2-CZ 4.42Å; I616-A639 HydrophobicContact CD1-CB 3.6Å
617	S	42.3	Very low	48	Very low	84 Å²	84	72.9 Å²	72.9	59%	0.587	41%	0.408	S	S	*	.			trans	-62.3	104.9	142.5	55.1	0	0	0	0	106.5	E619 M620	S617-E619 PolarHBondContact O-N 2.98Å; S617-M620 PolarHBondContact O-N 3Å
618	F	41.9	Very low	46.1	Very low	67 Å²	67	80 Å²	80	29%	0.294	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-53.7	-15	-169	-76.8	-83.5	0	0	0	115	I616 M620 F621	I616-F618 HydrophobicContact CG2-CB 4.41Å; I616-F618 HydrophobicContact CG2-CD1 4.03Å; I616-F618 HydrophobicContact CG2-CE1 4.49Å; I616-F618 HydrophobicContact CG2-CG 4.14Å; I616-F618 PolarHBondContact O-N 3.08Å; I616-F618 VanDerWaalsContact O-N 3.15Å; F618-M620 PolarHBondContact O-N 3.45Å; F618-F621 PolarHBondContact O-N 3.15Å
619	E	36.2	Very low	44.6	Very low	176 Å²	176	82.6 Å²	82.6	82%	0.822	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-59.6	-24.9	171.9	-65.8	-176.4	161.2	0	0	114.7	S617 F621	S617-E619 PolarHBondContact O-N 2.98Å; E619-F621 VanDerWaalsContact C-N 3.27Å; E619-F621 PolarHBondContact O-N 3.03Å
620	M	31.5	Very low	43.3	Very low	123 Å²	123	87.5 Å²	87.5	61%	0.606	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-71.5	-17.9	-177.9	-115.1	-178.2	176.8	0	0	113.9	S617 F618 I624	S617-M620 PolarHBondContact O-N 3Å; F618-M620 PolarHBondContact O-N 3.45Å; M620-I624 WeakPolarHBondContact O-CD1 3.29Å; M620-I624 WeakPolarHBondContact O-CG1 3.39Å
621	F	34	Very low	42.3	Very low	102 Å²	102	95.4 Å²	95.4	45%	0.447	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-82	-20	-177.2	-78.2	-68.6	0	0	0	114.8	I616 F618 E619	I616-F621 HydrophobicContact CB-CE2 4.02Å; I616-F621 HydrophobicContact CD1-CE2 3.51Å; I616-F621 HydrophobicContact CD1-CZ 3.89Å; I616-F621 HydrophobicContact CG1-CE2 3.52Å; I616-F621 HydrophobicContact CG1-CZ 4.02Å; I616-F621 HydrophobicContact CG2-CD2 3.5Å; I616-F621 VanDerWaalsContact CG2-CD2 3.5Å; I616-F621 HydrophobicContact CG2-CE2 3.27Å; I616-F621 HydrophobicContact CG2-CZ 4.42Å; F618-F621 PolarHBondContact O-N 3.15Å; E619-F621 VanDerWaalsContact C-N 3.27Å; E619-F621 PolarHBondContact O-N 3.03Å
622	D	37.9	Very low	41.8	Very low	112 Å²	112	96.7 Å²	96.7	60%	0.599	53%	0.529	S	S	*	.	S	Bend	trans	-88.6	-12.1	-178.6	-73.1	-18.5	0	0	0	113.5
623	G	32.1	Very low	41.9	Very low	68 Å²	68	99.9 Å²	99.9	70%	0.701	54%	0.541	S	S	*	.	S	Bend	trans	-105.9	-8	-173.3	0	0	0	0	0	116.1	N625	G623-N625 PolarHBondContact O-N 3.2Å
624	I	30.4	Very low	42.2	Very low	99 Å²	99	102.7 Å²	102.7	51%	0.508	56%	0.556	S	S	.	*			trans	-83.9	105.3	-174.6	-60.9	170.2	0	0	0	109.2	M620 F628	M620-I624 WeakPolarHBondContact O-CD1 3.29Å; M620-I624 WeakPolarHBondContact O-CG1 3.39Å; I624-F628 HydrophobicContact CG2-CB 3.76Å
625	N	30.2	Very low	42.4	Very low	107 Å²	107	104.1 Å²	104.1	57%	0.572	56%	0.562	S	S	*	*			trans	-37.3	127	166.3	-152.6	9.5	0	0	0	110.3	G623 D627 F628	G623-N625 PolarHBondContact O-N 3.2Å; N625-D627 PolarHBondContact O-N 3.45Å; N625-F628 PolarHBondContact O-N 2.9Å
626	P	42.2	Very low	43.3	Very low	112 Å²	112	105.8 Å²	105.8	73%	0.727	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-2.7	-174.2	23.6	-33.7	0	0	0	114.9
627	D	36.2	Very low	44.5	Very low	137 Å²	137	108.3 Å²	108.3	73%	0.733	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-5.9	173.8	-67.9	-22.9	0	0	0	113.9	N625 T629	N625-D627 PolarHBondContact O-N 3.45Å; D627-T629 VanDerWaalsContact C-N 3.3Å; D627-T629 PolarHBondContact O-N 3.2Å
628	F	31.7	Very low	45.7	Very low	151 Å²	151	104.3 Å²	104.3	66%	0.662	56%	0.559	S	S	*	*			trans	-87.4	72.5	164.8	-97.7	-84.4	0	0	0	110.2	I624 N625 M630	I624-F628 HydrophobicContact CG2-CB 3.76Å; N625-F628 PolarHBondContact O-N 2.9Å; F628-M630 HydrophobicContact CD1-CG 3.9Å; F628-M630 PolarHBondContact O-N 2.74Å
629	T	35.9	Very low	46.8	Very low	127 Å²	127	101.4 Å²	101.4	78%	0.779	55%	0.548	S	S	*	.			trans	-73	71.6	160.5	53.5	0	0	0	0	108.8	D627	D627-T629 VanDerWaalsContact C-N 3.3Å; D627-T629 PolarHBondContact O-N 3.2Å
630	M	38.7	Very low	48.4	Very low	126 Å²	126	98 Å²	98	62%	0.621	53%	0.53	S	S	*	.			trans	-84	129.8	159.5	-73.6	-98.8	-83.2	0	0	106.6	F628 N632	F628-M630 HydrophobicContact CD1-CG 3.9Å; F628-M630 PolarHBondContact O-N 2.74Å; M630-N632 WeakPolarHBondContact O-CB 3.42Å; M630-N632 PolarHBondContact O-N 3.47Å
631	D	45.8	Very low	50.4	Low	166 Å²	166	96 Å²	96	89%	0.888	52%	0.519	S	S	*	.			trans	-56.6	59.3	-179.9	-71.9	-45	0	0	0	113.8	D633	D631-D633 PolarHBondContact O-N 3.03Å
632	N	53.9	Low	52.2	Low	84 Å²	84	91.1 Å²	91.1	45%	0.449	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	17.1	-168.3	-78.6	-28.7	0	0	0	113.9	M630 E634 L635 L636	M630-N632 WeakPolarHBondContact O-CB 3.42Å; M630-N632 PolarHBondContact O-N 3.47Å; N632-E634 PolarHBondContact O-N 3.02Å; N632-E634 VanDerWaalsContact O-N 3.17Å; N632-L635 PolarHBondContact O-N 2.89Å; N632-L635 VanDerWaalsContact O-N 3.11Å; N632-L636 PolarHBondContact O-N 2.88Å
633	D	64.6	Low	53.6	Low	126 Å²	126	87.9 Å²	87.9	67%	0.674	48%	0.479	S	S	*	.	H	α-helix	trans	-54.2	-36.3	178.9	-77.7	-23.4	0	0	0	111.6	D631 L636 C637	D631-D633 PolarHBondContact O-N 3.03Å; D633-L636 PolarHBondContact O-N 3.39Å; D633-C637 WeakPolarHBondContact O-CB 3.46Å; D633-C637 PolarHBondContact O-N 2.72Å; D633-C637 PolarHBondContact O-SG 3.31Å; D633-C637 VanDerWaalsContact O-SG 3.33Å
634	E	67.4	Low	55.6	Low	111 Å²	111	87.6 Å²	87.6	52%	0.519	46%	0.461	S	S	.	.	H	α-helix	trans	-66.3	-46.1	176.2	-70.4	-167.6	171.7	0	0	113.4	V421 N632 L636 C637 I638	V421-E634 HydrophobicContact CG1-CB 4.01Å; V421-E634 WeakPolarHBondContact CG1-OE2 3.37Å; N632-E634 PolarHBondContact O-N 3.02Å; N632-E634 VanDerWaalsContact O-N 3.17Å; E634-L636 VanDerWaalsContact C-N 3.28Å; E634-L636 PolarHBondContact O-N 3.28Å; E634-C637 WeakPolarHBondContact O-CB 3.3Å; E634-C637 PolarHBondContact O-N 3.26Å; E634-I638 VanDerWaalsContact O-CG1 3.32Å; E634-I638 WeakPolarHBondContact O-CG1 3.45Å; E634-I638 PolarHBondContact O-N 2.54Å
635	L	65	Low	57.6	Low	47 Å²	47	83.4 Å²	83.4	25%	0.246	44%	0.44	C	S	.	.	H	α-helix	trans	-63.4	-37.5	177.2	-101.5	141.8	0	0	0	111.3	V421 P615 N632 I638 A639	V421-L635 HydrophobicContact CG2-CD1 3.83Å; V421-L635 HydrophobicContact CG2-CG 4.28Å; P615-L635 HydrophobicContact CG-CD2 4.11Å; N632-L635 PolarHBondContact O-N 2.89Å; N632-L635 VanDerWaalsContact O-N 3.11Å; L635-I638 PolarHBondContact O-N 3.01Å; L635-A639 WeakPolarHBondContact O-CB 3.48Å; L635-A639 PolarHBondContact O-N 3.19Å
636	L	65.6	Low	59.5	Low	76 Å²	76	78.8 Å²	78.8	40%	0.398	42%	0.415	S	S	.	.	H	α-helix	trans	-66.3	-41.3	174.3	-175.8	63.5	0	0	0	111.6	N632 D633 E634 A639 K640	N632-L636 PolarHBondContact O-N 2.88Å; D633-L636 PolarHBondContact O-N 3.39Å; E634-L636 VanDerWaalsContact C-N 3.28Å; E634-L636 PolarHBondContact O-N 3.28Å; L636-A639 PolarHBondContact O-N 3.28Å; L636-K640 VanDerWaalsContact O-CG 3.31Å; L636-K640 WeakPolarHBondContact O-CG 3.47Å; L636-K640 PolarHBondContact O-N 3.12Å
637	C	70.1	Confident	60.9	Low	73 Å²	73	80.4 Å²	80.4	49%	0.493	41%	0.407	S	S	.	.	H	α-helix	trans	-60.5	-45.6	172.9	-80.1	0	0	0	0	111.8	D633 E634 A639 K640 E641	D633-C637 WeakPolarHBondContact O-CB 3.46Å; D633-C637 PolarHBondContact O-N 2.72Å; D633-C637 PolarHBondContact O-SG 3.31Å; D633-C637 VanDerWaalsContact O-SG 3.33Å; E634-C637 WeakPolarHBondContact O-CB 3.3Å; E634-C637 PolarHBondContact O-N 3.26Å; C637-A639 PolarHBondContact O-N 2.82Å; C637-K640 WeakPolarHBondContact O-CB 3.36Å; C637-K640 PolarHBondContact O-N 3.4Å; C637-E641 PolarHBondContact O-N 3.4Å
638	I	67.6	Low	62.6	Low	1 Å²	1	77.1 Å²	77.1	1%	0.005	39%	0.392	C	S	.	.	H	α-helix	trans	-58.8	-48.2	175.9	-70.9	167.1	0	0	0	111.3	V421 L424 N425 V428 E634 L635 K640 E641 F642	V421-I638 HydrophobicContact CG1-CD1 3.91Å; L424-I638 HydrophobicContact CB-CD1 4.21Å; L424-I638 HydrophobicContact CD2-CB 4.44Å; L424-I638 HydrophobicContact CD2-CD1 3.94Å; L424-I638 HydrophobicContact CD2-CG2 3.44Å; L424-I638 VanDerWaalsContact CD2-CG2 3.44Å; L424-I638 HydrophobicContact CG-CD1 4.25Å; L424-I638 HydrophobicContact CG-CG2 3.85Å; N425-I638 HydrophobicContact CB-CD1 4.38Å; N425-I638 VanDerWaalsContact OD1-CD1 3.28Å; N425-I638 WeakPolarHBondContact OD1-CD1 3.2Å; N425-I638 WeakPolarHBondContact OD1-CG1 3.39Å; V428-I638 HydrophobicContact CG2-CB 4.37Å; V428-I638 HydrophobicContact CG2-CG1 4.43Å; V428-I638 HydrophobicContact CG2-CG2 3.5Å; V428-I638 VanDerWaalsContact CG2-CG2 3.5Å; E634-I638 VanDerWaalsContact O-CG1 3.32Å; E634-I638 WeakPolarHBondContact O-CG1 3.45Å; E634-I638 PolarHBondContact O-N 2.54Å; L635-I638 PolarHBondContact O-N 3.01Å; I638-K640 VanDerWaalsContact C-N 3.29Å; I638-K640 PolarHBondContact O-N 3.17Å; I638-E641 PolarHBondContact O-N 3.27Å; I638-F642 HydrophobicContact CG2-CD2 3.77Å; I638-F642 HydrophobicContact CG2-CE2 3.67Å; I638-F642 WeakPolarHBondContact O-CD2 3.38Å; I638-F642 PolarHBondContact O-N 3.1Å
639	A	66.7	Low	64.7	Low	6 Å²	6	70 Å²	70	5%	0.05	36%	0.36	C	S	.	.	H	α-helix	trans	-60.6	-39.6	179.1	0	0	0	0	0	111.8	I616 L635 L636 C637 F642 Q643	I616-A639 HydrophobicContact CD1-CB 3.6Å; L635-A639 WeakPolarHBondContact O-CB 3.48Å; L635-A639 PolarHBondContact O-N 3.19Å; L636-A639 PolarHBondContact O-N 3.28Å; C637-A639 PolarHBondContact O-N 2.82Å; A639-F642 PolarHBondContact O-N 2.97Å; A639-Q643 VanDerWaalsContact O-CG 3.31Å; A639-Q643 WeakPolarHBondContact O-CG 3.43Å; A639-Q643 PolarHBondContact O-N 2.94Å
640	K	69.8	Low	66.4	Low	105 Å²	105	65.8 Å²	65.8	46%	0.457	34%	0.336	S	S	.	.	H	α-helix	trans	-64	-40.3	175.5	-75.9	172.4	178.4	174	0	112.4	L636 C637 I638 Q643 N644	L636-K640 VanDerWaalsContact O-CG 3.31Å; L636-K640 WeakPolarHBondContact O-CG 3.47Å; L636-K640 PolarHBondContact O-N 3.12Å; C637-K640 WeakPolarHBondContact O-CB 3.36Å; C637-K640 PolarHBondContact O-N 3.4Å; I638-K640 VanDerWaalsContact C-N 3.29Å; I638-K640 PolarHBondContact O-N 3.17Å; K640-Q643 WeakPolarHBondContact O-CB 3.37Å; K640-Q643 PolarHBondContact O-N 3.45Å; K640-N644 VanDerWaalsContact O-CG 3.25Å; K640-N644 PolarHBondContact O-N 3.48Å; K640-N644 PolarHBondContact O-ND2 3.01Å
641	E	72.8	Confident	68	Low	79 Å²	79	61 Å²	61	37%	0.369	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-43.1	177.3	-75.6	-55.5	130	0	0	112.3	V428 C637 I638 Q643 N644 L645	V428-E641 HydrophobicContact CG1-CB 3.45Å; V428-E641 VanDerWaalsContact CG1-CB 3.45Å; V428-E641 HydrophobicContact CG1-CG 4.16Å; C637-E641 PolarHBondContact O-N 3.4Å; I638-E641 PolarHBondContact O-N 3.27Å; E641-Q643 VanDerWaalsContact C-N 3.29Å; E641-Q643 PolarHBondContact O-N 3.22Å; E641-N644 WeakPolarHBondContact O-CB 3.21Å; E641-N644 PolarHBondContact O-N 3.4Å; E641-N644 VanDerWaalsContact O-N 3.13Å; E641-L645 WeakPolarHBondContact O-CG 3.26Å; E641-L645 PolarHBondContact O-N 2.98Å
642	F	71.5	Confident	69.3	Low	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.4	-41.7	172.3	-79.6	-55.2	0	0	0	112.1	L424 V428 I610 I638 A639 N644 L645 I646	L424-F642 HydrophobicContact CD1-CE2 4.22Å; L424-F642 HydrophobicContact CD1-CZ 4.45Å; L424-F642 HydrophobicContact CG-CE2 4.37Å; V428-F642 HydrophobicContact CB-CZ 4.44Å; V428-F642 HydrophobicContact CG2-CD1 4.49Å; V428-F642 HydrophobicContact CG2-CD2 3.86Å; V428-F642 HydrophobicContact CG2-CE1 3.98Å; V428-F642 HydrophobicContact CG2-CE2 3.26Å; V428-F642 HydrophobicContact CG2-CG 4.46Å; V428-F642 HydrophobicContact CG2-CZ 3.33Å; I610-F642 HydrophobicContact CG2-CD1 3.67Å; I610-F642 HydrophobicContact CG2-CE1 4.25Å; I610-F642 HydrophobicContact CG2-CG 4.49Å; I638-F642 HydrophobicContact CG2-CD2 3.77Å; I638-F642 HydrophobicContact CG2-CE2 3.67Å; I638-F642 WeakPolarHBondContact O-CD2 3.38Å; I638-F642 PolarHBondContact O-N 3.1Å; A639-F642 PolarHBondContact O-N 2.97Å; F642-N644 VanDerWaalsContact C-N 3.33Å; F642-N644 PolarHBondContact O-N 3.31Å; F642-L645 HydrophobicContact CD1-CD1 4.38Å; F642-L645 PolarHBondContact O-N 3.27Å; F642-I646 WeakPolarHBondContact O-CD1 3.47Å; F642-I646 VanDerWaalsContact O-CG1 3.3Å; F642-I646 WeakPolarHBondContact O-CG1 3.38Å; F642-I646 PolarHBondContact O-N 3.01Å
643	Q	67.5	Low	70.5	Confident	44 Å²	44	49.6 Å²	49.6	21%	0.206	26%	0.259	C	S	.	.	H	α-helix	trans	-61.2	-39.8	174.2	-74.9	174.6	-4.8	0	0	112.5	A639 K640 E641 I646 R647	A639-Q643 VanDerWaalsContact O-CG 3.31Å; A639-Q643 WeakPolarHBondContact O-CG 3.43Å; A639-Q643 PolarHBondContact O-N 2.94Å; K640-Q643 WeakPolarHBondContact O-CB 3.37Å; K640-Q643 PolarHBondContact O-N 3.45Å; E641-Q643 VanDerWaalsContact C-N 3.29Å; E641-Q643 PolarHBondContact O-N 3.22Å; Q643-I646 PolarHBondContact O-N 3.12Å; Q643-R647 VanDerWaalsContact O-CB 3.23Å; Q643-R647 WeakPolarHBondContact O-CB 3.47Å; Q643-R647 PolarHBondContact O-N 3.28Å
644	N	73.3	Confident	70.8	Confident	63 Å²	63	45 Å²	45	34%	0.337	24%	0.236	S	C	.	.	H	α-helix	trans	-64	-41.5	176.4	-70.4	-21.2	0	0	0	111.7	K640 E641 F642 R647 T648	K640-N644 VanDerWaalsContact O-CG 3.25Å; K640-N644 PolarHBondContact O-N 3.48Å; K640-N644 PolarHBondContact O-ND2 3.01Å; E641-N644 WeakPolarHBondContact O-CB 3.21Å; E641-N644 PolarHBondContact O-N 3.4Å; E641-N644 VanDerWaalsContact O-N 3.13Å; F642-N644 VanDerWaalsContact C-N 3.33Å; F642-N644 PolarHBondContact O-N 3.31Å; N644-R647 PolarHBondContact O-N 3.45Å; N644-R647 PolarHBondContact OD1-NH1 2.88Å; N644-T648 PolarHBondContact O-N 3.15Å; N644-T648 PolarHBondContact O-OG1 3Å
645	L	72.3	Confident	71.2	Confident	10 Å²	10	45 Å²	45	5%	0.052	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-48.5	176.3	-71	166	0	0	0	111.5	F431 V435 I610 E641 F642 R647 T648 I649	F431-L645 HydrophobicContact CB-CD1 3.79Å; V435-L645 HydrophobicContact CB-CD2 3.79Å; V435-L645 HydrophobicContact CG1-CD2 3.93Å; V435-L645 HydrophobicContact CG2-CD2 4.18Å; I610-L645 HydrophobicContact CD1-CB 4.35Å; E641-L645 WeakPolarHBondContact O-CG 3.26Å; E641-L645 PolarHBondContact O-N 2.98Å; F642-L645 HydrophobicContact CD1-CD1 4.38Å; F642-L645 PolarHBondContact O-N 3.27Å; L645-R647 VanDerWaalsContact C-N 3.33Å; L645-R647 PolarHBondContact O-N 3.48Å; L645-T648 WeakPolarHBondContact O-CB 3.5Å; L645-T648 PolarHBondContact O-N 2.9Å; L645-T648 VanDerWaalsContact O-N 3.13Å; L645-I649 WeakPolarHBondContact O-CG1 3.39Å; L645-I649 PolarHBondContact O-N 2.99Å
646	I	71.3	Confident	71.8	Confident	10 Å²	10	43 Å²	43	5%	0.051	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-43.5	177.7	-69.8	159.3	0	0	0	111.1	I610 F642 Q643 T648 I649 S650 F738 F741	I610-I646 HydrophobicContact CG2-CD1 3.88Å; I610-I646 HydrophobicContact CG2-CG1 3.76Å; F642-I646 WeakPolarHBondContact O-CD1 3.47Å; F642-I646 VanDerWaalsContact O-CG1 3.3Å; F642-I646 WeakPolarHBondContact O-CG1 3.38Å; F642-I646 PolarHBondContact O-N 3.01Å; Q643-I646 PolarHBondContact O-N 3.12Å; I646-T648 VanDerWaalsContact C-N 3.26Å; I646-T648 PolarHBondContact O-N 3.45Å; I646-I649 PolarHBondContact O-N 2.94Å; I646-S650 PolarHBondContact O-N 3.41Å; I646-F738 HydrophobicContact CG2-CD1 3.85Å; I646-F738 HydrophobicContact CG2-CE1 3.95Å; I646-F741 HydrophobicContact CD1-CD1 3.47Å; I646-F741 VanDerWaalsContact CD1-CD1 3.47Å; I646-F741 HydrophobicContact CD1-CD2 4.31Å; I646-F741 HydrophobicContact CD1-CE1 3.49Å; I646-F741 VanDerWaalsContact CD1-CE1 3.49Å; I646-F741 HydrophobicContact CD1-CE2 4.35Å; I646-F741 HydrophobicContact CD1-CG 3.89Å; I646-F741 HydrophobicContact CD1-CZ 3.94Å; I646-F741 HydrophobicContact CG1-CD1 4.46Å; I646-F741 HydrophobicContact CG1-CD2 4.49Å; I646-F741 HydrophobicContact CG1-CE1 4.48Å; I646-F741 HydrophobicContact CG1-CG 4.45Å; I646-F741 HydrophobicContact CG2-CB 3.52Å; I646-F741 HydrophobicContact CG2-CD1 4.33Å; I646-F741 HydrophobicContact CG2-CD2 3.59Å; I646-F741 HydrophobicContact CG2-CE2 4.33Å; I646-F741 HydrophobicContact CG2-CG 3.58Å
647	R	71.5	Confident	72.2	Confident	147 Å²	147	39.9 Å²	39.9	56%	0.555	20%	0.204	S	C	*	.	H	α-helix	trans	-61.7	-35.7	176.2	-172.7	-177.4	-66.2	113.4	-1.3	111.9	Q643 N644 L645 S650 G651	Q643-R647 VanDerWaalsContact O-CB 3.23Å; Q643-R647 WeakPolarHBondContact O-CB 3.47Å; Q643-R647 PolarHBondContact O-N 3.28Å; N644-R647 PolarHBondContact O-N 3.45Å; N644-R647 PolarHBondContact OD1-NH1 2.88Å; L645-R647 VanDerWaalsContact C-N 3.33Å; L645-R647 PolarHBondContact O-N 3.48Å; R647-S650 PolarHBondContact O-OG 2.9Å; R647-G651 PolarHBondContact O-N 3.18Å
648	T	72.7	Confident	72.2	Confident	68 Å²	68	38.7 Å²	38.7	42%	0.417	19%	0.193	S	C	.	.	H	α-helix	trans	-65.7	-44.9	176	-53.4	0	0	0	0	110.6	I439 N644 L645 I646 G651 V652	I439-T648 HydrophobicContact CD1-CG2 3.65Å; N644-T648 PolarHBondContact O-N 3.15Å; N644-T648 PolarHBondContact O-OG1 3Å; L645-T648 WeakPolarHBondContact O-CB 3.5Å; L645-T648 PolarHBondContact O-N 2.9Å; L645-T648 VanDerWaalsContact O-N 3.13Å; I646-T648 VanDerWaalsContact C-N 3.26Å; I646-T648 PolarHBondContact O-N 3.45Å; T648-G651 PolarHBondContact O-N 3.27Å; T648-V652 WeakPolarHBondContact O-CG2 3.33Å; T648-V652 PolarHBondContact O-N 3.03Å
649	I	74	Confident	72.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.3	-45.6	178.1	-55.8	164.2	0	0	0	111.2	V435 I439 L603 L606 I610 L645 I646 G651 V652 L653 F738	V435-I649 HydrophobicContact CG1-CG1 4.4Å; I439-I649 HydrophobicContact CD1-CG1 3.7Å; I439-I649 HydrophobicContact CG1-CG1 4.43Å; L603-I649 HydrophobicContact CB-CG2 4.08Å; L603-I649 HydrophobicContact CD1-CG2 4.31Å; L603-I649 HydrophobicContact CD2-CG2 3.86Å; L603-I649 HydrophobicContact CG-CG2 4.29Å; L606-I649 HydrophobicContact CB-CD1 4.39Å; I610-I649 HydrophobicContact CD1-CD1 3.82Å; L645-I649 WeakPolarHBondContact O-CG1 3.39Å; L645-I649 PolarHBondContact O-N 2.99Å; I646-I649 PolarHBondContact O-N 2.94Å; I649-G651 PolarHBondContact O-N 3.34Å; I649-V652 WeakPolarHBondContact O-CB 3.5Å; I649-V652 PolarHBondContact O-N 2.62Å; I649-V652 VanDerWaalsContact O-N 3.11Å; I649-L653 PolarHBondContact O-N 3.22Å; I649-L653 VanDerWaalsContact O-N 3.12Å; I649-F738 HydrophobicContact CB-CE1 4.03Å; I649-F738 HydrophobicContact CB-CZ 3.66Å; I649-F738 HydrophobicContact CG2-CE1 4.11Å; I649-F738 HydrophobicContact CG2-CE2 3.82Å; I649-F738 HydrophobicContact CG2-CZ 3.23Å
650	S	73	Confident	72.9	Confident	39 Å²	39	41.8 Å²	41.8	27%	0.273	21%	0.206	S	C	.	.	H	α-helix	trans	-63	-34	178.4	82.5	0	0	0	0	111.8	I646 R647 V652 L653 S654	I646-S650 PolarHBondContact O-N 3.41Å; R647-S650 PolarHBondContact O-OG 2.9Å; S650-V652 VanDerWaalsContact C-N 3.34Å; S650-V652 PolarHBondContact O-N 2.63Å; S650-L653 PolarHBondContact O-N 2.81Å; S650-S654 WeakPolarHBondContact O-CB 3.49Å; S650-S654 PolarHBondContact O-N 3.23Å
651	G	71.9	Confident	72.9	Confident	26 Å²	26	36.8 Å²	36.8	27%	0.268	19%	0.185	S	C	.	.	H	α-helix	trans	-65.5	-32.1	174.4	0	0	0	0	0	113.8	R647 T648 I649 R655	R647-G651 PolarHBondContact O-N 3.18Å; T648-G651 PolarHBondContact O-N 3.27Å; I649-G651 PolarHBondContact O-N 3.34Å; G651-R655 WeakPolarHBondContact O-CB 3.09Å; G651-R655 VanDerWaalsContact O-CG 3.29Å; G651-R655 WeakPolarHBondContact O-CG 3.08Å; G651-R655 PolarHBondContact O-N 3.36Å; G651-R655 PolarHBondContact O-NE 3.48Å
652	V	73	Confident	72.7	Confident	4 Å²	4	36 Å²	36	2%	0.024	18%	0.183	C	C	.	.	H	α-helix	trans	-70.1	-46.6	172.8	177.2	0	0	0	0	110	I439 E443 L446 L603 T648 I649 S650 S654 R655 F656	I439-V652 HydrophobicContact CG2-CG2 3.38Å; E443-V652 HydrophobicContact CB-CG1 4.26Å; E443-V652 HydrophobicContact CG-CG1 4.44Å; L446-V652 HydrophobicContact CD1-CG1 4.14Å; L603-V652 HydrophobicContact CD1-CG1 4.49Å; T648-V652 WeakPolarHBondContact O-CG2 3.33Å; T648-V652 PolarHBondContact O-N 3.03Å; I649-V652 WeakPolarHBondContact O-CB 3.5Å; I649-V652 PolarHBondContact O-N 2.62Å; I649-V652 VanDerWaalsContact O-N 3.11Å; S650-V652 VanDerWaalsContact C-N 3.34Å; S650-V652 PolarHBondContact O-N 2.63Å; V652-S654 PolarHBondContact O-N 2.9Å; V652-R655 PolarHBondContact O-N 3.39Å; V652-F656 WeakPolarHBondContact O-CB 3.3Å; V652-F656 PolarHBondContact O-N 2.98Å
653	L	78.2	Confident	72.5	Confident	7 Å²	7	36.2 Å²	36.2	4%	0.037	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-45.8	178.5	-179.6	64.1	0	0	0	112	I649 S650 R655 F656 I657 C731 L734 A735 F738	I649-L653 PolarHBondContact O-N 3.22Å; I649-L653 VanDerWaalsContact O-N 3.12Å; S650-L653 PolarHBondContact O-N 2.81Å; L653-R655 PolarHBondContact O-N 2.93Å; L653-F656 PolarHBondContact O-N 3.11Å; L653-I657 HydrophobicContact CD1-CD1 4.13Å; L653-I657 HydrophobicContact CD1-CG1 4.36Å; L653-I657 HydrophobicContact CG-CD1 3.89Å; L653-I657 HydrophobicContact CG-CG1 4.49Å; L653-I657 WeakPolarHBondContact O-CG1 3.47Å; L653-I657 PolarHBondContact O-N 3.39Å; L653-C731 HydrophobicContact CD1-CB 4.3Å; L653-L734 HydrophobicContact CD1-CD2 4.1Å; L653-L734 HydrophobicContact CD2-CB 4.25Å; L653-L734 HydrophobicContact CD2-CD2 4.13Å; L653-L734 HydrophobicContact CD2-CG 3.87Å; L653-A735 HydrophobicContact CD2-CB 4.09Å; L653-F738 HydrophobicContact CD2-CD2 3.73Å; L653-F738 HydrophobicContact CD2-CE2 4.17Å
654	S	72.2	Confident	72.4	Confident	29 Å²	29	34.6 Å²	34.6	20%	0.203	18%	0.177	C	C	.	.	H	α-helix	trans	-63.6	-41.1	-179.9	176.7	0	0	0	0	112.1	S650 V652 F656 I657 N658 Q772	S650-S654 WeakPolarHBondContact O-CB 3.49Å; S650-S654 PolarHBondContact O-N 3.23Å; V652-S654 PolarHBondContact O-N 2.9Å; S654-F656 VanDerWaalsContact C-N 3.35Å; S654-I657 PolarHBondContact O-N 3.35Å; S654-N658 PolarHBondContact O-N 3.18Å; S654-N658 VanDerWaalsContact O-N 3.09Å; S654-N658 PolarHBondContact O-ND2 2.99Å; S654-Q772 WeakPolarHBondContact OG-CG 3.31Å
655	R	74.5	Confident	72	Confident	111 Å²	111	33.1 Å²	33.1	42%	0.419	17%	0.167	S	C	.	.	H	α-helix	trans	-62.4	-44	174.7	-75.7	-179.2	-70.7	143.4	-0.1	111.3	E443 G651 V652 L653 N658 E659	E443-R655 IonicContact OE1-CZ 2.75Å; E443-R655 IonicContact OE1-NH1 2.73Å; E443-R655 PolarHBondContact OE1-NH1 3.28Å; E443-R655 IonicContact OE1-NH2 3.25Å; E443-R655 IonicContact OE2-CZ 3.88Å; E443-R655 IonicContact OE2-NH1 2.9Å; E443-R655 PolarHBondContact OE2-NH1 2.93Å; E443-R655 IonicContact OE2-NH2 3.48Å; E443-R655 PolarHBondContact OE2-NH2 3.1Å; G651-R655 WeakPolarHBondContact O-CB 3.09Å; G651-R655 VanDerWaalsContact O-CG 3.29Å; G651-R655 WeakPolarHBondContact O-CG 3.08Å; G651-R655 PolarHBondContact O-N 3.36Å; G651-R655 PolarHBondContact O-NE 3.48Å; V652-R655 PolarHBondContact O-N 3.39Å; L653-R655 PolarHBondContact O-N 2.93Å; R655-N658 PolarHBondContact O-N 3.41Å; R655-E659 WeakPolarHBondContact O-CG 3.34Å; R655-E659 PolarHBondContact O-N 3.33Å
656	F	78.2	Confident	71.6	Confident	5 Å²	5	36.4 Å²	36.4	2%	0.022	18%	0.183	C	C	.	.	H	α-helix	trans	-63.2	-44.1	177.4	-178.3	-112.5	0	0	0	112.9	L446 I450 I600 V652 L653 S654 N658 E659 L660 L727 C731	L446-F656 HydrophobicContact CB-CD2 3.64Å; L446-F656 HydrophobicContact CB-CE2 3.84Å; L446-F656 HydrophobicContact CB-CG 4.31Å; L446-F656 HydrophobicContact CD1-CB 4.26Å; L446-F656 HydrophobicContact CD1-CD2 4.29Å; L446-F656 HydrophobicContact CD1-CG 4.11Å; L446-F656 HydrophobicContact CD2-CD1 4.23Å; L446-F656 HydrophobicContact CD2-CD2 4.05Å; L446-F656 HydrophobicContact CD2-CE1 4.01Å; L446-F656 HydrophobicContact CD2-CE2 3.8Å; L446-F656 HydrophobicContact CD2-CG 4.23Å; L446-F656 HydrophobicContact CD2-CZ 3.79Å; L446-F656 HydrophobicContact CG-CD2 4.19Å; L446-F656 HydrophobicContact CG-CE2 4.33Å; L446-F656 HydrophobicContact CG-CG 4.44Å; I450-F656 HydrophobicContact CD1-CD2 4.16Å; I450-F656 HydrophobicContact CD1-CE2 3.7Å; I450-F656 HydrophobicContact CD1-CZ 4.46Å; I450-F656 HydrophobicContact CG1-CD2 4.1Å; I450-F656 HydrophobicContact CG1-CE2 3.81Å; I600-F656 HydrophobicContact CD1-CE1 4.19Å; V652-F656 WeakPolarHBondContact O-CB 3.3Å; V652-F656 PolarHBondContact O-N 2.98Å; L653-F656 PolarHBondContact O-N 3.11Å; S654-F656 VanDerWaalsContact C-N 3.35Å; F656-N658 VanDerWaalsContact C-N 3.29Å; F656-N658 PolarHBondContact O-N 3.15Å; F656-E659 PolarHBondContact O-N 3.07Å; F656-L660 HydrophobicContact CE1-CD1 3.74Å; F656-L660 HydrophobicContact CE2-CD1 4.43Å; F656-L660 HydrophobicContact CZ-CD1 3.64Å; F656-L660 VanDerWaalsContact O-CB 3.26Å; F656-L660 WeakPolarHBondContact O-CB 3.49Å; F656-L660 PolarHBondContact O-N 3.44Å; F656-L727 HydrophobicContact CE1-CD2 4.37Å; F656-L727 HydrophobicContact CE1-CG 4.25Å; F656-L727 HydrophobicContact CZ-CD1 4.42Å; F656-L727 HydrophobicContact CZ-CD2 3.86Å; F656-L727 HydrophobicContact CZ-CG 4.21Å; F656-C731 VanDerWaalsContact CE1-SG 3.55Å
657	I	75	Confident	71	Confident	10 Å²	10	38.6 Å²	38.6	5%	0.051	19%	0.193	C	C	.	.	H	α-helix	trans	-57.2	-44	175.1	-76.3	171.4	0	0	0	111	L653 S654 L660 I661 N775 L779	L653-I657 HydrophobicContact CD1-CD1 4.13Å; L653-I657 HydrophobicContact CD1-CG1 4.36Å; L653-I657 HydrophobicContact CG-CD1 3.89Å; L653-I657 HydrophobicContact CG-CG1 4.49Å; L653-I657 WeakPolarHBondContact O-CG1 3.47Å; L653-I657 PolarHBondContact O-N 3.39Å; S654-I657 PolarHBondContact O-N 3.35Å; I657-L660 PolarHBondContact O-N 2.96Å; I657-I661 HydrophobicContact CG2-CD1 4.21Å; I657-I661 WeakPolarHBondContact O-CG1 3.2Å; I657-I661 PolarHBondContact O-N 3.34Å; I657-I661 VanDerWaalsContact O-N 3.12Å; I657-N775 HydrophobicContact CG2-CB 4.3Å; I657-L779 HydrophobicContact CB-CD1 4.46Å; I657-L779 HydrophobicContact CG2-CD1 3.74Å
658	N	70.5	Confident	70.2	Confident	48 Å²	48	35.3 Å²	35.3	26%	0.257	18%	0.184	S	C	.	.	H	α-helix	trans	-66.1	-46.9	178.9	-66.6	-17.2	0	0	0	111.9	S654 R655 F656 L660 I661 D662 N775	S654-N658 PolarHBondContact O-N 3.18Å; S654-N658 VanDerWaalsContact O-N 3.09Å; S654-N658 PolarHBondContact O-ND2 2.99Å; R655-N658 PolarHBondContact O-N 3.41Å; F656-N658 VanDerWaalsContact C-N 3.29Å; F656-N658 PolarHBondContact O-N 3.15Å; N658-L660 VanDerWaalsContact C-N 3.26Å; N658-L660 PolarHBondContact O-N 3.46Å; N658-I661 PolarHBondContact O-N 2.99Å; N658-D662 PolarHBondContact O-N 3.45Å; N658-D662 VanDerWaalsContact O-N 3.1Å; N658-N775 PolarHBondContact OD1-ND2 3.34Å
659	E	73.9	Confident	69.3	Low	68 Å²	68	37 Å²	37	32%	0.318	19%	0.187	S	C	.	.	H	α-helix	trans	-59.4	-40.2	176.3	-73.6	-178.8	-177.2	0	0	111.2	I450 R655 F656 I661 D662 V663	I450-E659 HydrophobicContact CD1-CB 4.07Å; I450-E659 HydrophobicContact CG1-CB 4.06Å; I450-E659 HydrophobicContact CG2-CB 4.36Å; R655-E659 WeakPolarHBondContact O-CG 3.34Å; R655-E659 PolarHBondContact O-N 3.33Å; F656-E659 PolarHBondContact O-N 3.07Å; E659-I661 VanDerWaalsContact C-N 3.32Å; E659-I661 PolarHBondContact O-N 2.8Å; E659-D662 PolarHBondContact O-N 2.82Å; E659-V663 WeakPolarHBondContact O-CG2 3.39Å; E659-V663 PolarHBondContact O-N 3.2Å
660	L	73.9	Confident	67.9	Low	4 Å²	4	39.9 Å²	39.9	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-66.9	-32.9	-179.6	-163.2	143.7	0	0	0	112.2	I450 F656 I657 N658 V663 F664 I724 L727 I728 L779	I450-L660 HydrophobicContact CD1-CB 4.09Å; F656-L660 HydrophobicContact CE1-CD1 3.74Å; F656-L660 HydrophobicContact CE2-CD1 4.43Å; F656-L660 HydrophobicContact CZ-CD1 3.64Å; F656-L660 VanDerWaalsContact O-CB 3.26Å; F656-L660 WeakPolarHBondContact O-CB 3.49Å; F656-L660 PolarHBondContact O-N 3.44Å; I657-L660 PolarHBondContact O-N 2.96Å; N658-L660 VanDerWaalsContact C-N 3.26Å; N658-L660 PolarHBondContact O-N 3.46Å; L660-V663 WeakPolarHBondContact O-CB 2.97Å; L660-V663 PolarHBondContact O-N 3.03Å; L660-F664 HydrophobicContact CD2-CD2 3.86Å; L660-F664 HydrophobicContact CD2-CE2 3.41Å; L660-F664 VanDerWaalsContact CD2-CE2 3.41Å; L660-F664 WeakPolarHBondContact O-CD2 3.47Å; L660-F664 PolarHBondContact O-N 3.43Å; L660-F664 VanDerWaalsContact O-N 3.17Å; L660-I724 HydrophobicContact CD1-CG2 4.41Å; L660-L727 HydrophobicContact CD1-CD2 3.93Å; L660-L727 HydrophobicContact CD1-CG 4.47Å; L660-I728 HydrophobicContact CD2-CD1 4.12Å; L660-I728 HydrophobicContact CD2-CG1 3.94Å; L660-L779 HydrophobicContact CD2-CD1 4.33Å; L660-L779 HydrophobicContact CD2-CD2 3.31Å; L660-L779 HydrophobicContact CD2-CG 4.45Å
661	I	70	Confident	66	Low	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.8	-40	172.2	-70.1	166.4	0	0	0	111.7	I657 N658 E659 V663 F664 F665 N775 L779	I657-I661 HydrophobicContact CG2-CD1 4.21Å; I657-I661 WeakPolarHBondContact O-CG1 3.2Å; I657-I661 PolarHBondContact O-N 3.34Å; I657-I661 VanDerWaalsContact O-N 3.12Å; N658-I661 PolarHBondContact O-N 2.99Å; E659-I661 VanDerWaalsContact C-N 3.32Å; E659-I661 PolarHBondContact O-N 2.8Å; I661-V663 PolarHBondContact O-N 2.84Å; I661-F664 WeakPolarHBondContact O-CB 2.87Å; I661-F664 PolarHBondContact O-N 2.8Å; I661-F665 HydrophobicContact CG2-CD2 3.65Å; I661-F665 HydrophobicContact CG2-CE2 3.5Å; I661-F665 WeakPolarHBondContact O-CD2 3.4Å; I661-F665 PolarHBondContact O-N 3.48Å; I661-N775 HydrophobicContact CD1-CB 3.05Å; I661-N775 VanDerWaalsContact CD1-O 3.32Å; I661-N775 WeakPolarHBondContact CD1-O 3.42Å; I661-L779 HydrophobicContact CB-CD2 4.49Å; I661-L779 HydrophobicContact CD1-CD1 3.95Å; I661-L779 HydrophobicContact CD1-CD2 4.33Å; I661-L779 HydrophobicContact CD1-CG 3.78Å; I661-L779 HydrophobicContact CG1-CD1 3.8Å; I661-L779 HydrophobicContact CG1-CD2 3.39Å; I661-L779 HydrophobicContact CG1-CG 3.37Å
662	D	68.9	Low	64	Low	64 Å²	64	50 Å²	50	34%	0.342	26%	0.256	S	S	.	.	H	α-helix	trans	-64.3	-34.5	176.8	-65.9	-26.7	0	0	0	110.8	N658 E659 Q666 R867	N658-D662 PolarHBondContact O-N 3.45Å; N658-D662 VanDerWaalsContact O-N 3.1Å; E659-D662 PolarHBondContact O-N 2.82Å; D662-Q666 VanDerWaalsContact O-CB 3.29Å; D662-Q666 WeakPolarHBondContact O-CB 3.47Å; D662-Q666 WeakPolarHBondContact O-CG 3.2Å; D662-Q666 PolarHBondContact O-N 3.33Å; D662-R867 IonicContact OD1-CZ 3.45Å; D662-R867 IonicContact OD1-NH2 3.66Å; D662-R867 PolarHBondContact OD1-NH2 3.49Å
663	V	66.8	Low	62	Low	4 Å²	4	53.6 Å²	53.6	2%	0.024	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-45.4	169.4	177	0	0	0	0	111.2	I450 L453 L454 E659 L660 I661 Q666 M667	I450-V663 HydrophobicContact CD1-CG2 4.04Å; I450-V663 HydrophobicContact CG2-CG2 3.87Å; L453-V663 HydrophobicContact CB-CG1 3.82Å; L453-V663 HydrophobicContact CD1-CG1 4.49Å; L454-V663 HydrophobicContact CD1-CG2 4.47Å; L454-V663 HydrophobicContact CD2-CB 4.22Å; L454-V663 HydrophobicContact CD2-CG1 4.26Å; L454-V663 HydrophobicContact CD2-CG2 3.79Å; L454-V663 HydrophobicContact CG-CG2 3.89Å; E659-V663 WeakPolarHBondContact O-CG2 3.39Å; E659-V663 PolarHBondContact O-N 3.2Å; L660-V663 WeakPolarHBondContact O-CB 2.97Å; L660-V663 PolarHBondContact O-N 3.03Å; I661-V663 PolarHBondContact O-N 2.84Å; V663-Q666 PolarHBondContact O-N 3.39Å; V663-M667 HydrophobicContact CG1-CG 4.28Å; V663-M667 HydrophobicContact CG1-SD 4.18Å; V663-M667 WeakPolarHBondContact O-CB 3.43Å; V663-M667 WeakPolarHBondContact O-CG 2.98Å; V663-M667 PolarHBondContact O-N 3.3Å
664	F	64.9	Low	59.5	Low	10 Å²	10	60.9 Å²	60.9	4%	0.044	32%	0.316	C	S	.	.	H	α-helix	trans	-57	-54.4	178	-88.5	-77.8	0	0	0	111.6	L660 I661 Q666 M667 E668 F721 I728 L779 E782	L660-F664 HydrophobicContact CD2-CD2 3.86Å; L660-F664 HydrophobicContact CD2-CE2 3.41Å; L660-F664 VanDerWaalsContact CD2-CE2 3.41Å; L660-F664 WeakPolarHBondContact O-CD2 3.47Å; L660-F664 PolarHBondContact O-N 3.43Å; L660-F664 VanDerWaalsContact O-N 3.17Å; I661-F664 WeakPolarHBondContact O-CB 2.87Å; I661-F664 PolarHBondContact O-N 2.8Å; F664-Q666 PolarHBondContact O-N 3.11Å; F664-M667 PolarHBondContact O-N 3.33Å; F664-E668 WeakPolarHBondContact O-CB 3.37Å; F664-E668 PolarHBondContact O-N 3.01Å; F664-F721 AromaticContact CD1-CD1 3.97Å; F664-F721 HydrophobicContact CD1-CD1 3.97Å; F664-F721 AromaticContact CD1-CE1 3.23Å; F664-F721 HydrophobicContact CD1-CE1 3.23Å; F664-F721 AromaticContact CD1-CZ 3.91Å; F664-F721 HydrophobicContact CD1-CZ 3.91Å; F664-F721 AromaticContact CE1-CD1 3.3Å; F664-F721 HydrophobicContact CE1-CD1 3.3Å; F664-F721 AromaticContact CE1-CE1 3.08Å; F664-F721 HydrophobicContact CE1-CE1 3.08Å; F664-F721 HydrophobicContact CE1-CG 4.47Å; F664-F721 HydrophobicContact CE1-CZ 4.1Å; F664-F721 HydrophobicContact CG-CE1 4.18Å; F664-F721 AromaticContact CZ-CD1 3.93Å; F664-F721 HydrophobicContact CZ-CD1 3.93Å; F664-F721 AromaticContact CZ-CE1 3.92Å; F664-F721 HydrophobicContact CZ-CE1 3.92Å; F664-I728 HydrophobicContact CE2-CD1 3.68Å; F664-I728 HydrophobicContact CZ-CD1 3.55Å; F664-L779 HydrophobicContact CD2-CD2 3.43Å; F664-L779 VanDerWaalsContact CD2-CD2 3.43Å; F664-L779 HydrophobicContact CE2-CD2 3.34Å; F664-L779 HydrophobicContact CZ-CD2 4.47Å; F664-E782 HydrophobicContact CD1-CB 3.88Å; F664-E782 HydrophobicContact CD1-CG 4.29Å; F664-E782 HydrophobicContact CE1-CB 3.67Å; F664-E782 HydrophobicContact CZ-CB 4.3Å
665	F	64.6	Low	57.4	Low	31 Å²	31	65.3 Å²	65.3	14%	0.136	35%	0.347	C	S	.	.	H	α-helix	trans	-65.1	-37.9	-179	-75.2	-67.6	0	0	0	112.5	I661 E668 E669 I778 V866 R867	I661-F665 HydrophobicContact CG2-CD2 3.65Å; I661-F665 HydrophobicContact CG2-CE2 3.5Å; I661-F665 WeakPolarHBondContact O-CD2 3.4Å; I661-F665 PolarHBondContact O-N 3.48Å; F665-E668 PolarHBondContact O-N 2.88Å; F665-E669 WeakPolarHBondContact O-CB 3.39Å; F665-E669 VanDerWaalsContact O-CG 3.31Å; F665-E669 WeakPolarHBondContact O-CG 3.4Å; F665-E669 PolarHBondContact O-N 3.12Å; F665-I778 HydrophobicContact CE2-CG2 4.28Å; F665-I778 HydrophobicContact CZ-CD1 4.47Å; F665-I778 HydrophobicContact CZ-CG2 4.12Å; F665-V866 HydrophobicContact CD1-CG1 4.44Å; F665-V866 HydrophobicContact CE1-CG1 4.06Å; F665-R867 HydrophobicContact CE2-CG 3.75Å; F665-R867 HydrophobicContact CZ-CG 3.88Å
666	Q	63.8	Low	55.1	Low	80 Å²	80	65 Å²	65	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-68	-39.7	177.9	-73.8	175.7	40.4	0	0	112.7	L454 D662 V663 F664 E668	L454-Q666 HydrophobicContact CD2-CB 4.34Å; L454-Q666 VanDerWaalsContact CD2-OE1 3.31Å; D662-Q666 VanDerWaalsContact O-CB 3.29Å; D662-Q666 WeakPolarHBondContact O-CB 3.47Å; D662-Q666 WeakPolarHBondContact O-CG 3.2Å; D662-Q666 PolarHBondContact O-N 3.33Å; V663-Q666 PolarHBondContact O-N 3.39Å; F664-Q666 PolarHBondContact O-N 3.11Å; Q666-E668 VanDerWaalsContact C-N 3.32Å
667	M	59.3	Low	52.6	Low	56 Å²	56	73.2 Å²	73.2	28%	0.276	41%	0.406	S	S	.	.	H	α-helix	trans	-64.6	-37.8	173.7	-79.1	-166.3	154.7	0	0	112	L453 V663 F664 F721	L453-M667 WeakPolarHBondContact O-CE 3.33Å; V663-M667 HydrophobicContact CG1-CG 4.28Å; V663-M667 HydrophobicContact CG1-SD 4.18Å; V663-M667 WeakPolarHBondContact O-CB 3.43Å; V663-M667 WeakPolarHBondContact O-CG 2.98Å; V663-M667 PolarHBondContact O-N 3.3Å; F664-M667 PolarHBondContact O-N 3.33Å; M667-F721 HydrophobicContact CB-CZ 4.06Å; M667-F721 HydrophobicContact SD-CE1 4.26Å; M667-F721 HydrophobicContact SD-CE2 4.33Å; M667-F721 HydrophobicContact SD-CZ 3.79Å
668	E	54.8	Low	50.2	Low	77 Å²	77	77.8 Å²	77.8	36%	0.36	44%	0.438	S	S	.	.	H	α-helix	trans	-73.6	-39.6	-179.2	-165.4	-179.1	172.8	0	0	112.7	F664 F665 Q666 G670 F813	F664-E668 WeakPolarHBondContact O-CB 3.37Å; F664-E668 PolarHBondContact O-N 3.01Å; F665-E668 PolarHBondContact O-N 2.88Å; Q666-E668 VanDerWaalsContact C-N 3.32Å; E668-G670 PolarHBondContact O-N 3.25Å; E668-G670 VanDerWaalsContact O-N 3.16Å; E668-F813 HydrophobicContact CG-CZ 4.1Å; E668-F813 WeakPolarHBondContact OE1-CE1 3.44Å; E668-F813 WeakPolarHBondContact OE1-CZ 3.27Å
669	E	54	Low	48	Very low	103 Å²	103	81.8 Å²	81.8	48%	0.481	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-11.8	176.4	-74	-172.7	139.2	0	0	113.3	F665 K671	F665-E669 WeakPolarHBondContact O-CB 3.39Å; F665-E669 VanDerWaalsContact O-CG 3.31Å; F665-E669 WeakPolarHBondContact O-CG 3.4Å; F665-E669 PolarHBondContact O-N 3.12Å; E669-K671 HydrophobicContact CB-CB 4.45Å; E669-K671 HydrophobicContact CB-CD 4.24Å; E669-K671 HydrophobicContact CB-CG 4Å; E669-K671 PolarHBondContact O-N 3.39Å; E669-K671 IonicContact OE1-NZ 3.01Å; E669-K671 PolarHBondContact OE1-NZ 3.38Å; E669-K671 VanDerWaalsContact OE2-CD 3.23Å; E669-K671 WeakPolarHBondContact OE2-CD 3.39Å; E669-K671 WeakPolarHBondContact OE2-CE 3.44Å; E669-K671 IonicContact OE2-NZ 3.96Å; E669-K671 PolarHBondContact OE2-NZ 3.11Å
670	G	45.3	Very low	45.5	Very low	61 Å²	61	84.9 Å²	84.9	63%	0.629	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	16.2	-176.2	0	0	0	0	0	113.4	E668 N672	E668-G670 PolarHBondContact O-N 3.25Å; E668-G670 VanDerWaalsContact O-N 3.16Å; G670-N672 PolarHBondContact O-N 3.31Å
671	K	32.9	Very low	43.1	Very low	130 Å²	130	91 Å²	91	57%	0.565	53%	0.526	S	S	*	.			trans	-75.5	110.9	179.6	-73.7	-179	-164.7	154.6	0	108.6	E669	E669-K671 HydrophobicContact CB-CB 4.45Å; E669-K671 HydrophobicContact CB-CD 4.24Å; E669-K671 HydrophobicContact CB-CG 4Å; E669-K671 PolarHBondContact O-N 3.39Å; E669-K671 IonicContact OE1-NZ 3.01Å; E669-K671 PolarHBondContact OE1-NZ 3.38Å; E669-K671 VanDerWaalsContact OE2-CD 3.23Å; E669-K671 WeakPolarHBondContact OE2-CD 3.39Å; E669-K671 WeakPolarHBondContact OE2-CE 3.44Å; E669-K671 IonicContact OE2-NZ 3.96Å; E669-K671 PolarHBondContact OE2-NZ 3.11Å
672	N	29.8	Very low	40.9	Very low	149 Å²	149	97.9 Å²	97.9	80%	0.797	56%	0.562	S	S	*	*			trans	-54.8	127.4	169.3	-74.3	-37.7	0	0	0	109.8	G670 I674	G670-N672 PolarHBondContact O-N 3.31Å; N672-I674 VanDerWaalsContact C-N 3.31Å; N672-I674 PolarHBondContact O-N 3.06Å
673	P	29.8	Very low	38.7	Very low	78 Å²	78	101.9 Å²	101.9	51%	0.506	58%	0.582	S	S	.	*	S	Bend	trans	-82.2	71.7	-173.4	33.6	-35.1	0	0	0	110.7
674	I	26.5	Very low	36.6	Very low	160 Å²	160	109.6 Å²	109.6	82%	0.821	62%	0.618	S	S	*	*			trans	-145.7	77.7	167.2	-43.9	174.1	0	0	0	109.8	N672	N672-I674 VanDerWaalsContact C-N 3.31Å; N672-I674 PolarHBondContact O-N 3.06Å
675	S	27.6	Very low	34.5	Very low	122 Å²	122	116.3 Å²	116.3	85%	0.853	65%	0.654	S	S	*	*	S	Bend	trans	-150.8	-3.6	154.9	62.4	0	0	0	0	116.1
676	S	26.6	Very low	32.5	Very low	104 Å²	104	123.5 Å²	123.5	73%	0.727	69%	0.688	S	S	*	*	S	Bend	trans	-139.8	18.3	-175.7	61.8	0	0	0	0	117.5
677	L	25.6	Very low	30.6	Very low	179 Å²	179	127.2 Å²	127.2	94%	0.937	71%	0.71	S	S	*	*			trans	-107.6	86	164.9	-123.2	81.5	0	0	0	110.3	T679	L677-T679 PolarHBondContact O-N 3.32Å; L677-T679 VanDerWaalsContact O-N 3.16Å
678	S	24.4	Very low	28.8	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	73%	0.732	S	S	*	*			trans	-60.8	111.3	175.7	-53.7	0	0	0	0	111.2	T680	S678-T680 PolarHBondContact O-N 3.48Å
679	T	23.8	Very low	27.2	Very low	132 Å²	132	131.4 Å²	131.4	81%	0.81	75%	0.753	S	S	*	*			trans	23.9	83.1	144.3	48.1	0	0	0	0	116.7	L677	L677-T679 PolarHBondContact O-N 3.32Å; L677-T679 VanDerWaalsContact O-N 3.16Å
680	T	22.8	Very low	25.7	Very low	133 Å²	133	134.1 Å²	134.1	82%	0.816	77%	0.77	S	S	*	*			trans	-93.4	107.3	148.3	40.2	0	0	0	0	108.6	S678 L682	S678-T680 PolarHBondContact O-N 3.48Å; T680-L682 PolarHBondContact O-N 3.38Å
681	T	23.9	Very low	24.7	Very low	134 Å²	134	137 Å²	137	82%	0.822	78%	0.781	S	S	*	*			trans	-49.5	115.9	176.2	36.5	0	0	0	0	111.7
682	L	23.6	Very low	24.3	Very low	143 Å²	143	135.4 Å²	135.4	75%	0.749	79%	0.792	S	S	*	*			trans	-95.4	102.3	179.3	-162.1	131.6	0	0	0	107.7	T680 Q684	T680-L682 PolarHBondContact O-N 3.38Å; L682-Q684 HydrophobicContact CD2-CG 3.9Å; L682-Q684 PolarHBondContact O-N 3.08Å
683	I	21.5	Very low	24	Very low	148 Å²	148	135 Å²	135	76%	0.759	80%	0.795	S	S	*	*			trans	-77.3	104.8	172.2	-62.1	173.9	0	0	0	106.8
684	Q	22.6	Very low	23.6	Very low	166 Å²	166	138.8 Å²	138.8	78%	0.776	81%	0.811	S	S	*	*			trans	-72.5	124.2	171.7	-74.5	175.7	-46.9	0	0	109.4	L682	L682-Q684 HydrophobicContact CD2-CG 3.9Å; L682-Q684 PolarHBondContact O-N 3.08Å
685	N	22.1	Very low	23.4	Very low	151 Å²	151	137.9 Å²	137.9	81%	0.807	81%	0.813	S	S	*	*			trans	-116.8	109.6	162.4	-79.3	-12.3	0	0	0	108
686	E	21.6	Very low	23.2	Very low	182 Å²	182	138.4 Å²	138.4	85%	0.85	81%	0.811	S	S	*	*			trans	-63.7	137.2	169	-66.6	173.6	134.7	0	0	110.6
687	L	23.5	Very low	23	Very low	158 Å²	158	139.2 Å²	139.2	83%	0.827	82%	0.815	S	S	*	*			trans	-165.3	109.7	148.7	-108.7	133	0	0	0	113.3
688	I	21.5	Very low	22.8	Very low	144 Å²	144	136.5 Å²	136.5	74%	0.738	81%	0.811	S	S	*	*			trans	45.5	102	137.2	-46.4	179	0	0	0	117.3
689	G	21.7	Very low	22.9	Very low	78 Å²	78	137.3 Å²	137.3	80%	0.804	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-93.4	129.1	169.8	0	0	0	0	0	112.4
690	D	22.4	Very low	22.8	Very low	159 Å²	159	137.9 Å²	137.9	85%	0.85	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-89.9	132.8	171.2	-81.4	-30.7	0	0	0	111.3
691	S	24.5	Very low	23	Very low	123 Å²	123	138.8 Å²	138.8	86%	0.86	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.6	118.3	-178.8	53.2	0	0	0	0	112.4
692	A	25.2	Very low	23	Very low	95 Å²	95	136.8 Å²	136.8	79%	0.785	79%	0.79	S	S	*	*			trans	-134.1	134.2	164.9	0	0	0	0	0	110.7
693	T	23.1	Very low	23.1	Very low	142 Å²	142	134.5 Å²	134.5	87%	0.871	79%	0.786	S	S	*	*			trans	-63.3	140.6	-162.2	41.1	0	0	0	0	116.4
694	N	21.9	Very low	23.3	Very low	156 Å²	156	136.3 Å²	136.3	83%	0.834	79%	0.789	S	S	*	*			trans	-61.6	132.7	-178.2	-60.4	-34.7	0	0	0	114.4
695	V	22.1	Very low	23.4	Very low	141 Å²	141	137.8 Å²	137.8	86%	0.855	79%	0.793	S	S	*	*			trans	-129	114.7	156.8	-178.2	0	0	0	0	108.5	C697	V695-C697 PolarHBondContact O-N 3.09Å
696	T	23.5	Very low	23.5	Very low	134 Å²	134	138.5 Å²	138.5	82%	0.822	79%	0.791	S	S	*	*			trans	-71.7	115.9	-179.3	-0.6	0	0	0	0	110.4	S698	T696-S698 PolarHBondContact O-N 3.31Å
697	C	22.9	Very low	23.8	Very low	120 Å²	120	133.4 Å²	133.4	81%	0.811	78%	0.776	S	S	*	*			trans	-71.7	108.9	166.9	-93.2	0	0	0	0	109.7	V695 I699	V695-C697 PolarHBondContact O-N 3.09Å; C697-I699 PolarHBondContact O-N 2.84Å; C697-I699 VanDerWaalsContact O-N 3.07Å
698	S	21.3	Very low	23.8	Very low	122 Å²	122	135.2 Å²	135.2	85%	0.853	78%	0.78	S	S	*	*			trans	-69.7	97.1	162.7	-66.2	0	0	0	0	109.1	T696 D700	T696-S698 PolarHBondContact O-N 3.31Å; S698-D700 PolarHBondContact O-N 3.37Å
699	I	25.8	Very low	24.1	Very low	122 Å²	122	137.9 Å²	137.9	63%	0.626	78%	0.782	S	S	*	*			trans	-74	117.1	161.1	-63.9	171.3	0	0	0	106.2	C697 H701	C697-I699 PolarHBondContact O-N 2.84Å; C697-I699 VanDerWaalsContact O-N 3.07Å; I699-H701 PolarHBondContact O-CD2 3.08Å; I699-H701 PolarHBondContact O-N 3.04Å
700	D	22.4	Very low	24.2	Very low	144 Å²	144	140.3 Å²	140.3	77%	0.77	78%	0.782	S	S	*	*			trans	-63.1	93.8	175.1	-118.6	-24.4	0	0	0	109.3	S698 S702	S698-D700 PolarHBondContact O-N 3.37Å; D700-S702 PolarHBondContact O-N 2.82Å
701	H	25.2	Very low	24.3	Very low	153 Å²	153	138.5 Å²	138.5	71%	0.708	78%	0.782	S	S	*	*			trans	-73.1	22	176.5	-73.5	-67.4	0	0	0	113.6	I699 S703 F704	I699-H701 PolarHBondContact O-CD2 3.08Å; I699-H701 PolarHBondContact O-N 3.04Å; H701-S703 PolarHBondContact O-N 3.01Å; H701-S703 VanDerWaalsContact O-N 3.09Å; H701-F704 PolarHBondContact O-N 3Å
702	S	25.3	Very low	24.4	Very low	91 Å²	91	137.5 Å²	137.5	64%	0.636	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-5.9	-169.7	61.1	0	0	0	0	115.1	D700	D700-S702 PolarHBondContact O-N 2.82Å
703	S	25.7	Very low	24.5	Very low	96 Å²	96	143.3 Å²	143.3	67%	0.671	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-4.7	177.1	60.1	0	0	0	0	115.7	H701	H701-S703 PolarHBondContact O-N 3.01Å; H701-S703 VanDerWaalsContact O-N 3.09Å
704	F	24.5	Very low	24.6	Very low	185 Å²	185	147.5 Å²	147.5	81%	0.811	78%	0.782	S	S	*	*			trans	-106.3	70	165.2	-93.6	-88.8	0	0	0	108.9	H701 Q706	H701-F704 PolarHBondContact O-N 3Å; F704-Q706 PolarHBondContact O-N 2.99Å
705	K	24.6	Very low	24.8	Very low	198 Å²	198	150 Å²	150	86%	0.861	79%	0.785	S	S	*	*			trans	-66.2	85.2	155.7	-84.5	-173.9	178.3	177.7	0	106.7	S707	K705-S707 VanDerWaalsContact C-N 3.27Å; K705-S707 PolarHBondContact O-N 2.65Å
706	Q	25.8	Very low	25	Very low	165 Å²	165	147.8 Å²	147.8	77%	0.771	78%	0.776	S	S	*	*			trans	-50.9	103.5	161.7	-164.1	162.9	13.7	0	0	105	F704 Q708	F704-Q706 PolarHBondContact O-N 2.99Å; Q706-Q708 PolarHBondContact O-N 3.33Å
707	S	26.8	Very low	25.4	Very low	76 Å²	76	146 Å²	146	53%	0.531	77%	0.769	S	S	.	*			trans	-47.4	127	-179.7	38.4	0	0	0	0	106.9	K705 Y709	K705-S707 VanDerWaalsContact C-N 3.27Å; K705-S707 PolarHBondContact O-N 2.65Å; S707-Y709 PolarHBondContact O-N 3.23Å; S707-Y709 WeakPolarHBondContact OG-CD2 3.25Å
708	Q	24.3	Very low	25.8	Very low	196 Å²	196	146.7 Å²	146.7	92%	0.916	76%	0.763	S	S	*	*			trans	-64.6	68.7	172.9	-71.4	177.4	-17.9	0	0	108.4	Q706 T710	Q706-Q708 PolarHBondContact O-N 3.33Å; Q708-T710 PolarHBondContact O-N 2.88Å
709	Y	26.5	Very low	26.9	Very low	200 Å²	200	141.9 Å²	141.9	78%	0.784	73%	0.73	S	S	*	*			trans	-83.5	101.5	161.7	-83.2	-79.3	0	0	0	105.8	S707 S711	S707-Y709 PolarHBondContact O-N 3.23Å; S707-Y709 WeakPolarHBondContact OG-CD2 3.25Å; Y709-S711 PolarHBondContact O-N 3.25Å; Y709-S711 VanDerWaalsContact O-N 3.09Å
710	T	25.2	Very low	27.9	Very low	128 Å²	128	138 Å²	138	79%	0.785	71%	0.713	S	S	*	*			trans	-38.6	113.4	166.8	43.9	0	0	0	0	110.7	Q708 S712	Q708-T710 PolarHBondContact O-N 2.88Å; T710-S712 PolarHBondContact O-N 2.9Å
711	S	24.1	Very low	29.3	Very low	122 Å²	122	133.7 Å²	133.7	85%	0.853	69%	0.688	S	S	*	*	S	Bend	trans	41.6	80	144	168.2	0	0	0	0	116.1	Y709	Y709-S711 PolarHBondContact O-N 3.25Å; Y709-S711 VanDerWaalsContact O-N 3.09Å
712	S	26.4	Very low	30.8	Very low	102 Å²	102	129.3 Å²	129.3	71%	0.713	67%	0.674	S	S	*	*			trans	-150.6	133.7	137.5	72.4	0	0	0	0	110	T710 R714	T710-S712 PolarHBondContact O-N 2.9Å; S712-R714 PolarHBondContact O-N 2.9Å
713	K	27.1	Very low	32.4	Very low	217 Å²	217	127.2 Å²	127.2	94%	0.943	66%	0.655	S	S	*	*			trans	-55.8	88.6	-176.4	-68.1	168.9	173.4	175.5	0	111.7
714	R	25.2	Very low	34.5	Very low	230 Å²	230	122.8 Å²	122.8	87%	0.868	62%	0.624	S	S	*	*			trans	-107.9	110.5	157.1	-83.3	-170.8	-176.4	-177.1	0.8	108.2	S712 S716	S712-R714 PolarHBondContact O-N 2.9Å; R714-S716 PolarHBondContact O-N 3.02Å
715	K	26.6	Very low	36.7	Very low	208 Å²	208	115 Å²	115	90%	0.904	59%	0.592	S	S	*	*			trans	-60.1	101.7	169.9	-70.1	175.6	176	178	0	107.4	S717	K715-S717 VanDerWaalsContact C-N 3.26Å; K715-S717 PolarHBondContact O-N 3.11Å
716	S	26.1	Very low	39	Very low	94 Å²	94	108.6 Å²	108.6	66%	0.657	57%	0.57	S	S	*	*			trans	-77.5	77.6	173.3	58	0	0	0	0	109.1	R714 I718	R714-S716 PolarHBondContact O-N 3.02Å; S716-I718 VanDerWaalsContact C-N 3.29Å; S716-I718 PolarHBondContact O-N 2.76Å; S716-I718 VanDerWaalsContact O-N 3.08Å
717	S	30.8	Very low	41.4	Very low	96 Å²	96	100.8 Å²	100.8	67%	0.671	53%	0.533	S	S	*	.			trans	-72.8	92.9	160	49.4	0	0	0	0	106.9	K715 S719	K715-S717 VanDerWaalsContact C-N 3.26Å; K715-S717 PolarHBondContact O-N 3.11Å; S717-S719 PolarHBondContact O-N 3.26Å
718	I	31.8	Very low	43.8	Very low	136 Å²	136	97.3 Å²	97.3	70%	0.697	51%	0.509	S	S	*	.			trans	-54.7	114.4	165.3	-64.6	166.9	0	0	0	105.4	S716 S720	S716-I718 VanDerWaalsContact C-N 3.29Å; S716-I718 PolarHBondContact O-N 2.76Å; S716-I718 VanDerWaalsContact O-N 3.08Å; I718-S720 PolarHBondContact O-N 3.47Å
719	S	43.9	Very low	46.3	Very low	20 Å²	20	88.7 Å²	88.7	14%	0.14	47%	0.47	C	S	.	.			trans	-59.9	136	-176.7	80.8	0	0	0	0	108.7	S717 F721 C722	S717-S719 PolarHBondContact O-N 3.26Å; S719-F721 PolarHBondContact O-N 3.37Å; S719-C722 PolarHBondContact O-N 2.95Å; S719-C722 VanDerWaalsContact O-N 3.08Å; S719-C722 PolarHBondContact OG-N 3.07Å; S719-C722 PolarHBondContact OG-SG 3.19Å
720	S	47.8	Very low	48.7	Very low	41 Å²	41	81.1 Å²	81.1	29%	0.287	44%	0.442	S	S	.	.	H	α-helix	trans	-50.5	-31.5	174.7	-169.9	0	0	0	0	111.2	I718 C722 I723	I718-S720 PolarHBondContact O-N 3.47Å; S720-C722 PolarHBondContact O-N 3.1Å; S720-I723 WeakPolarHBondContact O-CB 3.39Å; S720-I723 PolarHBondContact O-N 3.09Å
721	F	52.7	Low	51.3	Low	54 Å²	54	75.3 Å²	75.3	24%	0.237	41%	0.406	C	S	.	.	H	α-helix	trans	-64.3	-35.2	179.7	-74.7	-67.4	0	0	0	114.9	F664 M667 S719 I723 I724 V725	F664-F721 AromaticContact CD1-CD1 3.97Å; F664-F721 HydrophobicContact CD1-CD1 3.97Å; F664-F721 AromaticContact CD1-CE1 3.23Å; F664-F721 HydrophobicContact CD1-CE1 3.23Å; F664-F721 AromaticContact CD1-CZ 3.91Å; F664-F721 HydrophobicContact CD1-CZ 3.91Å; F664-F721 AromaticContact CE1-CD1 3.3Å; F664-F721 HydrophobicContact CE1-CD1 3.3Å; F664-F721 AromaticContact CE1-CE1 3.08Å; F664-F721 HydrophobicContact CE1-CE1 3.08Å; F664-F721 HydrophobicContact CE1-CG 4.47Å; F664-F721 HydrophobicContact CE1-CZ 4.1Å; F664-F721 HydrophobicContact CG-CE1 4.18Å; F664-F721 AromaticContact CZ-CD1 3.93Å; F664-F721 HydrophobicContact CZ-CD1 3.93Å; F664-F721 AromaticContact CZ-CE1 3.92Å; F664-F721 HydrophobicContact CZ-CE1 3.92Å; M667-F721 HydrophobicContact CB-CZ 4.06Å; M667-F721 HydrophobicContact SD-CE1 4.26Å; M667-F721 HydrophobicContact SD-CE2 4.33Å; M667-F721 HydrophobicContact SD-CZ 3.79Å; S719-F721 PolarHBondContact O-N 3.37Å; F721-I723 PolarHBondContact O-N 3.36Å; F721-I723 VanDerWaalsContact O-N 3.15Å; F721-I724 HydrophobicContact CD1-CD1 4.02Å; F721-I724 HydrophobicContact CE1-CD1 4.33Å; F721-I724 PolarHBondContact O-N 2.76Å; F721-V725 PolarHBondContact O-N 3.24Å
722	C	55.7	Low	53.9	Low	61 Å²	61	69.6 Å²	69.6	41%	0.412	37%	0.366	S	S	.	.	H	α-helix	trans	-59.4	-29.2	176.5	-74.4	0	0	0	0	112.1	S719 S720 I724	S719-C722 PolarHBondContact O-N 2.95Å; S719-C722 VanDerWaalsContact O-N 3.08Å; S719-C722 PolarHBondContact OG-N 3.07Å; S719-C722 PolarHBondContact OG-SG 3.19Å; S720-C722 PolarHBondContact O-N 3.1Å; C722-I724 VanDerWaalsContact C-N 3.33Å
723	I	59.5	Low	56.3	Low	47 Å²	47	65.5 Å²	65.5	24%	0.241	34%	0.336	C	S	.	.	H	α-helix	trans	-74.7	-27.1	179	-41.6	179.7	0	0	0	110.7	I593 S720 F721 P726	I593-I723 HydrophobicContact CB-CG2 4.39Å; I593-I723 HydrophobicContact CD1-CB 3.84Å; I593-I723 HydrophobicContact CD1-CG2 3.33Å; I593-I723 HydrophobicContact CG1-CG2 4.43Å; I593-I723 HydrophobicContact CG2-CG2 4.35Å; I593-I723 WeakPolarHBondContact CG2-O 3.47Å; S720-I723 WeakPolarHBondContact O-CB 3.39Å; S720-I723 PolarHBondContact O-N 3.09Å; F721-I723 PolarHBondContact O-N 3.36Å; F721-I723 VanDerWaalsContact O-N 3.15Å; I723-P726 WeakPolarHBondContact O-CD 3.43Å
724	I	68.3	Low	58.6	Low	2 Å²	2	55.1 Å²	55.1	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-83.8	-22.2	-177.9	-50.8	172.8	0	0	0	112	L453 L660 F721 C722 L727 I728	L453-I724 HydrophobicContact CD1-CD1 4.09Å; L453-I724 HydrophobicContact CD1-CG1 4.42Å; L453-I724 HydrophobicContact CD2-CD1 3.67Å; L453-I724 HydrophobicContact CD2-CG1 3.9Å; L453-I724 HydrophobicContact CG-CD1 4.49Å; L660-I724 HydrophobicContact CD1-CG2 4.41Å; F721-I724 HydrophobicContact CD1-CD1 4.02Å; F721-I724 HydrophobicContact CE1-CD1 4.33Å; F721-I724 PolarHBondContact O-N 2.76Å; C722-I724 VanDerWaalsContact C-N 3.33Å; I724-L727 HydrophobicContact CG2-CB 4.48Å; I724-L727 HydrophobicContact CG2-CD2 4.31Å; I724-L727 WeakPolarHBondContact O-CA 3.46Å; I724-L727 WeakPolarHBondContact O-CB 3.35Å; I724-L727 PolarHBondContact O-N 3.2Å; I724-I728 HydrophobicContact CG2-CD1 3.84Å; I724-I728 HydrophobicContact CG2-CG1 4.02Å; I724-I728 PolarHBondContact O-N 3.31Å; I724-I728 VanDerWaalsContact O-N 3.1Å
725	V	71.6	Confident	61.1	Low	23 Å²	23	44.8 Å²	44.8	14%	0.139	26%	0.255	C	S	.	.	H	α-helix	trans	-50.7	-48.1	-178.1	170.6	0	0	0	0	113.9	F721 L727 I728 V729 T821 P824	F721-V725 PolarHBondContact O-N 3.24Å; V725-L727 VanDerWaalsContact C-N 3.28Å; V725-L727 PolarHBondContact O-N 2.92Å; V725-I728 PolarHBondContact O-N 3Å; V725-V729 HydrophobicContact CG1-CG2 4.41Å; V725-V729 WeakPolarHBondContact O-CG2 3.47Å; V725-V729 PolarHBondContact O-N 3.47Å; V725-T821 HydrophobicContact CG1-CG2 3.85Å; V725-P824 HydrophobicContact CG1-CG 4.32Å
726	P	73.2	Confident	63.2	Low	63 Å²	63	35.4 Å²	35.4	41%	0.409	22%	0.215	S	C	.	.	H	α-helix	trans	-62.9	-34.5	178.5	-20.9	34.2	0	0	0	112.9	I597 I723 V729 E730	I597-P726 HydrophobicContact CD1-CB 3.82Å; I723-P726 WeakPolarHBondContact O-CD 3.43Å; P726-V729 PolarHBondContact O-N 2.65Å; P726-E730 PolarHBondContact O-N 3.26Å
727	L	75.6	Confident	65.3	Low	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-43.6	177.2	-169.3	68.8	0	0	0	111.1	I597 I600 F656 L660 I724 V725 E730 C731	I597-L727 HydrophobicContact CG1-CB 4.34Å; I597-L727 HydrophobicContact CG1-CD1 3.86Å; I600-L727 HydrophobicContact CD1-CD1 3.42Å; I600-L727 VanDerWaalsContact CD1-CD1 3.42Å; I600-L727 HydrophobicContact CD1-CG 4.22Å; F656-L727 HydrophobicContact CE1-CD2 4.37Å; F656-L727 HydrophobicContact CE1-CG 4.25Å; F656-L727 HydrophobicContact CZ-CD1 4.42Å; F656-L727 HydrophobicContact CZ-CD2 3.86Å; F656-L727 HydrophobicContact CZ-CG 4.21Å; L660-L727 HydrophobicContact CD1-CD2 3.93Å; L660-L727 HydrophobicContact CD1-CG 4.47Å; I724-L727 HydrophobicContact CG2-CB 4.48Å; I724-L727 HydrophobicContact CG2-CD2 4.31Å; I724-L727 WeakPolarHBondContact O-CA 3.46Å; I724-L727 WeakPolarHBondContact O-CB 3.35Å; I724-L727 PolarHBondContact O-N 3.2Å; V725-L727 VanDerWaalsContact C-N 3.28Å; V725-L727 PolarHBondContact O-N 2.92Å; L727-E730 PolarHBondContact O-N 3.02Å; L727-C731 PolarHBondContact O-N 3.07Å; L727-C731 PolarHBondContact O-SG 3.08Å
728	I	76.7	Confident	67.2	Low	3 Å²	3	28.4 Å²	28.4	2%	0.015	16%	0.163	C	C	.	.	H	α-helix	trans	-67.1	-42.8	177.9	-65.8	168	0	0	0	110.9	L660 F664 I724 V725 E730 C731 L732 L779 A783	L660-I728 HydrophobicContact CD2-CD1 4.12Å; L660-I728 HydrophobicContact CD2-CG1 3.94Å; F664-I728 HydrophobicContact CE2-CD1 3.68Å; F664-I728 HydrophobicContact CZ-CD1 3.55Å; I724-I728 HydrophobicContact CG2-CD1 3.84Å; I724-I728 HydrophobicContact CG2-CG1 4.02Å; I724-I728 PolarHBondContact O-N 3.31Å; I724-I728 VanDerWaalsContact O-N 3.1Å; V725-I728 PolarHBondContact O-N 3Å; I728-E730 PolarHBondContact O-N 2.69Å; I728-C731 WeakPolarHBondContact O-CB 3.33Å; I728-C731 PolarHBondContact O-N 3.28Å; I728-L732 HydrophobicContact CG2-CD1 4Å; I728-L732 HydrophobicContact CG2-CG 4.4Å; I728-L732 WeakPolarHBondContact O-CG 3.5Å; I728-L732 PolarHBondContact O-N 3.49Å; I728-L779 HydrophobicContact CG2-CB 4.4Å; I728-A783 HydrophobicContact CB-CB 4.45Å; I728-A783 HydrophobicContact CD1-CB 3.67Å; I728-A783 HydrophobicContact CG2-CB 4.07Å
729	V	76.6	Confident	68.7	Low	16 Å²	16	22 Å²	22	10%	0.097	13%	0.131	C	C	.	.	H	α-helix	trans	-58.3	-46.8	176.7	167.3	0	0	0	0	111.1	V725 P726 L732 N733 K823 P824	V725-V729 HydrophobicContact CG1-CG2 4.41Å; V725-V729 WeakPolarHBondContact O-CG2 3.47Å; V725-V729 PolarHBondContact O-N 3.47Å; P726-V729 PolarHBondContact O-N 2.65Å; V729-L732 PolarHBondContact O-N 3.3Å; V729-N733 WeakPolarHBondContact O-CB 3.33Å; V729-N733 VanDerWaalsContact O-CG 3.29Å; V729-N733 PolarHBondContact O-N 2.87Å; V729-N733 PolarHBondContact O-ND2 3.47Å; V729-K823 HydrophobicContact CG2-CB 3.76Å; V729-P824 HydrophobicContact CG2-CG 4.17Å
730	E	78.4	Confident	69.5	Low	41 Å²	41	23 Å²	23	19%	0.192	14%	0.136	C	C	.	.	H	α-helix	trans	-69.2	-34.7	177.4	-70.3	-49.9	138.7	0	0	112.9	I597 I600 K604 P726 L727 I728 L732 N733 L734	I597-E730 HydrophobicContact CG2-CG 4.25Å; I600-E730 HydrophobicContact CG2-CB 3.83Å; K604-E730 IonicContact NZ-OE2 2.73Å; P726-E730 PolarHBondContact O-N 3.26Å; L727-E730 PolarHBondContact O-N 3.02Å; I728-E730 PolarHBondContact O-N 2.69Å; E730-L732 PolarHBondContact O-N 2.93Å; E730-N733 PolarHBondContact O-N 3.43Å; E730-L734 VanDerWaalsContact O-CB 3.29Å; E730-L734 WeakPolarHBondContact O-CB 2.95Å; E730-L734 PolarHBondContact O-N 2.96Å
731	C	78.6	Confident	69.9	Low	5 Å²	5	22.4 Å²	22.4	3%	0.034	13%	0.128	C	C	.	.	H	α-helix	trans	-59.8	-46.4	172.2	-71.6	0	0	0	0	112.1	I600 L653 F656 L727 I728 L734 A735	I600-C731 WeakPolarHBondContact CD1-SG 3.4Å; L653-C731 HydrophobicContact CD1-CB 4.3Å; F656-C731 VanDerWaalsContact CE1-SG 3.55Å; L727-C731 PolarHBondContact O-N 3.07Å; L727-C731 PolarHBondContact O-SG 3.08Å; I728-C731 WeakPolarHBondContact O-CB 3.33Å; I728-C731 PolarHBondContact O-N 3.28Å; C731-L734 PolarHBondContact O-N 3.05Å; C731-A735 WeakPolarHBondContact O-CB 3.32Å; C731-A735 PolarHBondContact O-N 2.85Å
732	L	79.1	Confident	69.9	Low	2 Å²	2	22.6 Å²	22.6	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-67.5	-39.7	179.3	-69	171.8	0	0	0	111.8	I728 V729 E730 L734 A735 S736 C776 T780 P824 F828 L831	I728-L732 HydrophobicContact CG2-CD1 4Å; I728-L732 HydrophobicContact CG2-CG 4.4Å; I728-L732 WeakPolarHBondContact O-CG 3.5Å; I728-L732 PolarHBondContact O-N 3.49Å; V729-L732 PolarHBondContact O-N 3.3Å; E730-L732 PolarHBondContact O-N 2.93Å; L732-L734 VanDerWaalsContact C-N 3.35Å; L732-A735 PolarHBondContact O-N 2.81Å; L732-S736 PolarHBondContact O-N 3.01Å; L732-C776 HydrophobicContact CD2-CB 3.82Å; L732-T780 WeakPolarHBondContact CD1-OG1 3.4Å; L732-P824 HydrophobicContact CD1-CB 4.47Å; L732-F828 HydrophobicContact CD1-CB 4.45Å; L732-L831 HydrophobicContact CD2-CD2 4.26Å
733	N	76.2	Confident	69.3	Low	16 Å²	16	25.5 Å²	25.5	9%	0.086	14%	0.137	C	C	.	.	H	α-helix	trans	-61.9	-44	173.6	-75.3	-34.7	0	0	0	111.3	V729 E730 S736 V737 R830	V729-N733 WeakPolarHBondContact O-CB 3.33Å; V729-N733 VanDerWaalsContact O-CG 3.29Å; V729-N733 PolarHBondContact O-N 2.87Å; V729-N733 PolarHBondContact O-ND2 3.47Å; E730-N733 PolarHBondContact O-N 3.43Å; N733-S736 WeakPolarHBondContact O-CB 3.46Å; N733-S736 PolarHBondContact O-N 2.82Å; N733-S736 PolarHBondContact O-OG 3.27Å; N733-V737 PolarHBondContact O-N 3.29Å; N733-R830 PolarHBondContact OD1-NH1 2.88Å
734	L	76.1	Confident	68.3	Low	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.9	-41.4	176.7	-177.7	56.3	0	0	0	111.8	I600 L603 K604 L653 E730 C731 L732 S736 V737 F738	I600-L734 HydrophobicContact CG2-CB 4.23Å; I600-L734 HydrophobicContact CG2-CD2 3.83Å; L603-L734 HydrophobicContact CB-CD2 3.65Å; L603-L734 HydrophobicContact CD1-CD2 4.22Å; K604-L734 VanDerWaalsContact CA-CD1 3.41Å; K604-L734 HydrophobicContact CB-CD1 3.75Å; K604-L734 HydrophobicContact CG-CD1 4.21Å; L653-L734 HydrophobicContact CD1-CD2 4.1Å; L653-L734 HydrophobicContact CD2-CB 4.25Å; L653-L734 HydrophobicContact CD2-CD2 4.13Å; L653-L734 HydrophobicContact CD2-CG 3.87Å; E730-L734 VanDerWaalsContact O-CB 3.29Å; E730-L734 WeakPolarHBondContact O-CB 2.95Å; E730-L734 PolarHBondContact O-N 2.96Å; C731-L734 PolarHBondContact O-N 3.05Å; L732-L734 VanDerWaalsContact C-N 3.35Å; L734-S736 PolarHBondContact O-N 3.32Å; L734-V737 WeakPolarHBondContact O-CB 3.46Å; L734-V737 PolarHBondContact O-N 2.75Å; L734-F738 HydrophobicContact CD1-CD2 3.99Å; L734-F738 HydrophobicContact CD1-CE2 3.43Å; L734-F738 VanDerWaalsContact CD1-CE2 3.43Å; L734-F738 HydrophobicContact CD1-CZ 4.19Å; L734-F738 HydrophobicContact CD2-CE2 4.03Å; L734-F738 HydrophobicContact CG-CD2 3.89Å; L734-F738 HydrophobicContact CG-CE2 3.53Å; L734-F738 VanDerWaalsContact O-CD2 3.28Å; L734-F738 WeakPolarHBondContact O-CD2 2.66Å; L734-F738 PolarHBondContact O-N 3.38Å
735	A	77	Confident	66.6	Low	13 Å²	13	30 Å²	30	11%	0.107	16%	0.162	C	C	.	.	H	α-helix	trans	-58.4	-37.2	173.4	0	0	0	0	0	111.4	L653 C731 L732 V737 F738 A739 L831	L653-A735 HydrophobicContact CD2-CB 4.09Å; C731-A735 WeakPolarHBondContact O-CB 3.32Å; C731-A735 PolarHBondContact O-N 2.85Å; L732-A735 PolarHBondContact O-N 2.81Å; A735-V737 VanDerWaalsContact C-N 3.27Å; A735-V737 PolarHBondContact O-N 2.92Å; A735-F738 CarbonylContact O-C 3.2Å; A735-F738 PolarHBondContact O-N 3.29Å; A735-F738 VanDerWaalsContact O-N 3.11Å; A735-A739 PolarHBondContact O-N 3.3Å; A735-L831 HydrophobicContact CB-CD1 4Å; A735-L831 HydrophobicContact CB-CD2 4.18Å
736	S	72	Confident	64.8	Low	10 Å²	10	32.3 Å²	32.3	7%	0.07	18%	0.176	C	C	.	.	H	α-helix	trans	-64.8	-30.6	176.5	81.8	0	0	0	0	113.2	L732 N733 L734	L732-S736 PolarHBondContact O-N 3.01Å; N733-S736 WeakPolarHBondContact O-CB 3.46Å; N733-S736 PolarHBondContact O-N 2.82Å; N733-S736 PolarHBondContact O-OG 3.27Å; L734-S736 PolarHBondContact O-N 3.32Å
737	V	70	Confident	62.6	Low	35 Å²	35	35.9 Å²	35.9	21%	0.212	19%	0.192	C	C	.	.	H	α-helix	trans	-70.5	-41.8	171.8	178.2	0	0	0	0	109.8	A607 N733 L734 A735 A739 V740	A607-V737 HydrophobicContact CB-CG1 4.25Å; N733-V737 PolarHBondContact O-N 3.29Å; L734-V737 WeakPolarHBondContact O-CB 3.46Å; L734-V737 PolarHBondContact O-N 2.75Å; A735-V737 VanDerWaalsContact C-N 3.27Å; A735-V737 PolarHBondContact O-N 2.92Å; V737-A739 VanDerWaalsContact C-N 3.31Å; V737-A739 PolarHBondContact O-N 3.11Å; V737-V740 PolarHBondContact O-N 2.66Å
738	F	70.3	Confident	60.6	Low	8 Å²	8	39.8 Å²	39.8	4%	0.035	22%	0.218	C	C	.	.	H	α-helix	trans	-69.6	-25.6	179.1	-75.8	-62.2	0	0	0	114.7	A607 I646 I649 L653 L734 A735 V740 F741	A607-F738 HydrophobicContact CB-CE1 3.89Å; A607-F738 HydrophobicContact CB-CE2 4.43Å; A607-F738 HydrophobicContact CB-CZ 3.6Å; I646-F738 HydrophobicContact CG2-CD1 3.85Å; I646-F738 HydrophobicContact CG2-CE1 3.95Å; I649-F738 HydrophobicContact CB-CE1 4.03Å; I649-F738 HydrophobicContact CB-CZ 3.66Å; I649-F738 HydrophobicContact CG2-CE1 4.11Å; I649-F738 HydrophobicContact CG2-CE2 3.82Å; I649-F738 HydrophobicContact CG2-CZ 3.23Å; L653-F738 HydrophobicContact CD2-CD2 3.73Å; L653-F738 HydrophobicContact CD2-CE2 4.17Å; L734-F738 HydrophobicContact CD1-CD2 3.99Å; L734-F738 HydrophobicContact CD1-CE2 3.43Å; L734-F738 VanDerWaalsContact CD1-CE2 3.43Å; L734-F738 HydrophobicContact CD1-CZ 4.19Å; L734-F738 HydrophobicContact CD2-CE2 4.03Å; L734-F738 HydrophobicContact CG-CD2 3.89Å; L734-F738 HydrophobicContact CG-CE2 3.53Å; L734-F738 VanDerWaalsContact O-CD2 3.28Å; L734-F738 WeakPolarHBondContact O-CD2 2.66Å; L734-F738 PolarHBondContact O-N 3.38Å; A735-F738 CarbonylContact O-C 3.2Å; A735-F738 PolarHBondContact O-N 3.29Å; A735-F738 VanDerWaalsContact O-N 3.11Å; F738-V740 PolarHBondContact O-N 2.73Å; F738-F741 HydrophobicContact CD1-CD2 4.02Å; F738-F741 PolarHBondContact O-N 3.03Å
739	A	64.2	Low	58.3	Low	1 Å²	1	46.5 Å²	46.5	1%	0.008	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-22.1	175.5	0	0	0	0	0	112.7	A735 V737 F741 L831 Q834 M835 H840	A735-A739 PolarHBondContact O-N 3.3Å; V737-A739 VanDerWaalsContact C-N 3.31Å; V737-A739 PolarHBondContact O-N 3.11Å; A739-F741 VanDerWaalsContact C-N 3.26Å; A739-F741 PolarHBondContact O-N 3.06Å; A739-L831 HydrophobicContact CB-CD1 4.11Å; A739-Q834 HydrophobicContact CB-CB 3.9Å; A739-M835 HydrophobicContact CB-CG 3.9Å; A739-H840 PolarHBondContact O-CD2 3.33Å; A739-H840 PolarHBondContact O-NE2 2.85Å
740	V	59.5	Low	56	Low	41 Å²	41	54.9 Å²	54.9	25%	0.248	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.9	174.8	179.6	0	0	0	0	113.3	V737 F738	V737-V740 PolarHBondContact O-N 2.66Å; F738-V740 PolarHBondContact O-N 2.73Å
741	F	55.6	Low	53.7	Low	30 Å²	30	60.6 Å²	60.6	13%	0.132	32%	0.32	C	S	.	.	S	Bend	trans	-109.2	-4.1	-168.8	-58.3	-68	0	0	0	115.3	N611 I646 F738 A739 K743	N611-F741 HydrophobicContact CB-CE1 4.47Å; N611-F741 HydrophobicContact CB-CZ 3.8Å; N611-F741 WeakPolarHBondContact OD1-CE1 2.96Å; N611-F741 WeakPolarHBondContact OD1-CZ 3.05Å; I646-F741 HydrophobicContact CD1-CD1 3.47Å; I646-F741 VanDerWaalsContact CD1-CD1 3.47Å; I646-F741 HydrophobicContact CD1-CD2 4.31Å; I646-F741 HydrophobicContact CD1-CE1 3.49Å; I646-F741 VanDerWaalsContact CD1-CE1 3.49Å; I646-F741 HydrophobicContact CD1-CE2 4.35Å; I646-F741 HydrophobicContact CD1-CG 3.89Å; I646-F741 HydrophobicContact CD1-CZ 3.94Å; I646-F741 HydrophobicContact CG1-CD1 4.46Å; I646-F741 HydrophobicContact CG1-CD2 4.49Å; I646-F741 HydrophobicContact CG1-CE1 4.48Å; I646-F741 HydrophobicContact CG1-CG 4.45Å; I646-F741 HydrophobicContact CG2-CB 3.52Å; I646-F741 HydrophobicContact CG2-CD1 4.33Å; I646-F741 HydrophobicContact CG2-CD2 3.59Å; I646-F741 HydrophobicContact CG2-CE2 4.33Å; I646-F741 HydrophobicContact CG2-CG 3.58Å; F738-F741 HydrophobicContact CD1-CD2 4.02Å; F738-F741 PolarHBondContact O-N 3.03Å; A739-F741 VanDerWaalsContact C-N 3.26Å; A739-F741 PolarHBondContact O-N 3.06Å; F741-K743 VanDerWaalsContact C-N 3.29Å; F741-K743 PolarHBondContact O-N 3.16Å
742	I	52.7	Low	51.1	Low	57 Å²	57	69.4 Å²	69.4	29%	0.292	36%	0.357	S	S	.	.			trans	-74.8	85.6	-178.7	-60.9	174.7	0	0	0	107.2	T744 C769 H840	I742-T744 PolarHBondContact O-N 3.36Å; I742-C769 VanDerWaalsContact CG2-SG 3.52Å; I742-H840 PolarHBondContact O-CE1 3.43Å; I742-H840 PolarHBondContact O-ND1 3.32Å; I742-H840 PolarHBondContact O-NE2 3.23Å; I742-H840 VanDerWaalsContact O-NE2 3.07Å
743	K	44.9	Very low	48.9	Very low	123 Å²	123	75.9 Å²	75.9	54%	0.535	40%	0.397	S	S	.	.			trans	-56.8	110.5	170	-95.5	-167.8	170.9	-163.6	0	109.4	F741	F741-K743 VanDerWaalsContact C-N 3.29Å; F741-K743 PolarHBondContact O-N 3.16Å
744	T	37.3	Very low	46.7	Very low	27 Å²	27	80 Å²	80	17%	0.166	43%	0.427	C	S	.	.			trans	-82.4	125.2	147.8	49.4	0	0	0	0	105.1	I742 T746 E765	I742-T744 PolarHBondContact O-N 3.36Å; T744-T746 PolarHBondContact O-N 3.09Å; T744-E765 VanDerWaalsContact C-OE2 3.26Å; T744-E765 WeakPolarHBondContact CA-OE2 3.49Å; T744-E765 WeakPolarHBondContact CB-OE2 3.37Å; T744-E765 HydrophobicContact CG2-CB 4.32Å
745	D	32.4	Very low	44.5	Very low	115 Å²	115	86.5 Å²	86.5	62%	0.615	46%	0.462	S	S	*	.			trans	-64.2	90.7	176.2	-80.9	-34.3	0	0	0	106.7	N747 E765	D745-N747 PolarHBondContact O-N 3.5Å; D745-E765 PolarHBondContact N-OE2 3.42Å
746	T	33.8	Very low	42.6	Very low	72 Å²	72	91.6 Å²	91.6	44%	0.442	49%	0.494	S	S	.	.			trans	-68.4	90.9	173.9	46.5	0	0	0	0	106.5	T744 P748	T744-T746 PolarHBondContact O-N 3.09Å; T746-P748 VanDerWaalsContact C-N 3.32Å; T746-P748 WeakPolarHBondContact O-CD 3.26Å; T746-P748 VanDerWaalsContact O-N 3.17Å
747	N	28.5	Very low	40.9	Very low	139 Å²	139	95.3 Å²	95.3	74%	0.743	53%	0.525	S	S	*	.			trans	-64.2	103.5	146.2	-90.4	-46.4	0	0	0	104.7	D745 L749	D745-N747 PolarHBondContact O-N 3.5Å; N747-L749 PolarHBondContact O-N 2.58Å
748	P	32.4	Very low	39.3	Very low	82 Å²	82	98.5 Å²	98.5	53%	0.532	54%	0.544	S	S	.	.			trans	-63.7	123.3	179.6	28.4	-30.3	0	0	0	105.7	T746 K750	T746-P748 VanDerWaalsContact C-N 3.32Å; T746-P748 WeakPolarHBondContact O-CD 3.26Å; T746-P748 VanDerWaalsContact O-N 3.17Å; P748-K750 PolarHBondContact O-N 2.89Å
749	L	29.4	Very low	37.4	Very low	144 Å²	144	103.5 Å²	103.5	75%	0.754	57%	0.571	S	S	*	*			trans	-34.7	85.3	171	-76.8	145.5	0	0	0	110.6	N747 N751	N747-L749 PolarHBondContact O-N 2.58Å; L749-N751 VanDerWaalsContact C-N 3.28Å; L749-N751 PolarHBondContact O-N 3.44Å
750	K	27.4	Very low	35.9	Very low	191 Å²	191	107.3 Å²	107.3	83%	0.83	60%	0.603	S	S	*	*			trans	-72	98.8	169.3	-97.2	-176.8	177.7	172.3	0	104.2	P748 K752	P748-K750 PolarHBondContact O-N 2.89Å; K750-K752 VanDerWaalsContact C-N 3.32Å; K750-K752 PolarHBondContact O-N 3.07Å
751	N	29.6	Very low	34.6	Very low	162 Å²	162	109 Å²	109	87%	0.866	61%	0.614	S	S	*	*			trans	-27.9	93.1	162.4	-76.3	-27.4	0	0	0	111	L749	L749-N751 VanDerWaalsContact C-N 3.28Å; L749-N751 PolarHBondContact O-N 3.44Å
752	K	25.8	Very low	33.6	Very low	189 Å²	189	111.7 Å²	111.7	82%	0.822	63%	0.629	S	S	*	*			trans	-136.2	99	159.7	-78.1	-162.7	177.6	-177.3	0	107	K750 S754	K750-K752 VanDerWaalsContact C-N 3.32Å; K750-K752 PolarHBondContact O-N 3.07Å; K752-S754 PolarHBondContact O-N 3.45Å
753	V	32	Very low	32.6	Very low	138 Å²	138	114.4 Å²	114.4	84%	0.836	64%	0.639	S	S	*	*			trans	-33.3	132.8	154.1	178.6	0	0	0	0	109.3
754	S	30.2	Very low	32.1	Very low	102 Å²	102	111.7 Å²	111.7	71%	0.713	64%	0.636	S	S	*	*			trans	63	87	166.7	50.6	0	0	0	0	117.8	K752	K752-S754 PolarHBondContact O-N 3.45Å
755	D	29.5	Very low	32.2	Very low	137 Å²	137	113.2 Å²	113.2	73%	0.733	64%	0.641	S	S	*	*				-166.6	123	122	-105.9	-28.8	0	0	0	111.2	A757	D755-A757 PolarHBondContact O-N 2.96Å
756	P	38.1	Very low	32.4	Very low	120 Å²	120	109.8 Å²	109.8	78%	0.779	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	10	-173.4	30.6	-34.1	0	0	0	114.8
757	A	35.4	Very low	32.9	Very low	88 Å²	88	109.2 Å²	109.2	73%	0.727	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-3.7	-176.2	0	0	0	0	0	115	D755	D755-A757 PolarHBondContact O-N 2.96Å
758	V	36.5	Very low	33.9	Very low	103 Å²	103	106.8 Å²	106.8	62%	0.624	61%	0.607	S	S	*	*	S	Bend	trans	-109.9	4.6	-173.7	-170.1	0	0	0	0	113.7	A760 T761	V758-A760 PolarHBondContact O-N 3.15Å; V758-T761 PolarHBondContact O-OG1 3.15Å
759	N	30.5	Very low	35	Very low	112 Å²	112	104.3 Å²	104.3	60%	0.599	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-1.7	178.3	-76.5	-5.1	0	0	0	114.8	F763	N759-F763 WeakPolarHBondContact O-CD2 3.49Å
760	A	32.6	Very low	36.4	Very low	81 Å²	81	98.2 Å²	98.2	67%	0.669	56%	0.559	S	S	*	*	H	α-helix	trans	-76.5	-19.6	-178.9	0	0	0	0	0	114.2	V758	V758-A760 PolarHBondContact O-N 3.15Å
761	T	32.3	Very low	38	Very low	78 Å²	78	92.1 Å²	92.1	48%	0.479	54%	0.538	S	S	.	.	H	α-helix	trans	-80.4	-35.1	-177.1	49.2	0	0	0	0	113.1	V758 F763 S764	V758-T761 PolarHBondContact O-OG1 3.15Å; T761-F763 VanDerWaalsContact C-N 3.3Å; T761-F763 PolarHBondContact O-N 2.78Å; T761-S764 PolarHBondContact O-N 3.15Å; T761-S764 PolarHBondContact O-OG 3.17Å
762	N	34.2	Very low	39.7	Very low	85 Å²	85	87.5 Å²	87.5	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-67.2	-28.5	-176.8	-68.8	-1.4	0	0	0	113.3
763	F	32.3	Very low	41.7	Very low	114 Å²	114	78.8 Å²	78.8	50%	0.5	47%	0.474	S	S	.	.	H	α-helix	trans	-77.9	-26.6	178	-77.5	-82.8	0	0	0	113	N759 T761 E765 L766 N767	N759-F763 WeakPolarHBondContact O-CD2 3.49Å; T761-F763 VanDerWaalsContact C-N 3.3Å; T761-F763 PolarHBondContact O-N 2.78Å; F763-E765 PolarHBondContact O-N 3.3Å; F763-L766 PolarHBondContact O-N 3.26Å; F763-N767 PolarHBondContact O-N 2.74Å; F763-N767 PolarHBondContact O-OD1 3.44Å
764	S	34.5	Very low	43.3	Very low	67 Å²	67	73.7 Å²	73.7	47%	0.469	44%	0.442	S	S	.	.	H	α-helix	trans	-65	-27.7	-177.7	72.9	0	0	0	0	113.3	T761	T761-S764 PolarHBondContact O-N 3.15Å; T761-S764 PolarHBondContact O-OG 3.17Å
765	E	38.4	Very low	45.1	Very low	58 Å²	58	69.2 Å²	69.2	27%	0.271	41%	0.41	S	S	.	.	H	α-helix	trans	-84.5	-40.5	179.8	-68	-179	-162.8	0	0	112.5	T744 D745 F763 N767 T768	T744-E765 VanDerWaalsContact C-OE2 3.26Å; T744-E765 WeakPolarHBondContact CA-OE2 3.49Å; T744-E765 WeakPolarHBondContact CB-OE2 3.37Å; T744-E765 HydrophobicContact CG2-CB 4.32Å; D745-E765 PolarHBondContact N-OE2 3.42Å; F763-E765 PolarHBondContact O-N 3.3Å; E765-N767 PolarHBondContact O-N 3.32Å; E765-T768 PolarHBondContact O-N 3.11Å; E765-T768 PolarHBondContact O-OG1 3.42Å
766	L	38.1	Very low	47.1	Very low	44 Å²	44	62.9 Å²	62.9	23%	0.23	38%	0.377	C	S	.	.	H	α-helix	trans	-55.2	-36.8	172	-126.6	91.6	0	0	0	111	F763 T768 C769 F770 H840 W841	F763-L766 PolarHBondContact O-N 3.26Å; L766-T768 PolarHBondContact O-N 3.4Å; L766-T768 VanDerWaalsContact O-N 3.15Å; L766-C769 PolarHBondContact O-N 2.84Å; L766-F770 WeakPolarHBondContact O-CB 3.32Å; L766-F770 PolarHBondContact O-N 2.74Å; L766-H840 WeakPolarHBondContact CD1-O 3.39Å; L766-W841 HydrophobicContact CD2-CE3 3.75Å; L766-W841 HydrophobicContact CD2-CH2 3.73Å; L766-W841 HydrophobicContact CD2-CZ3 3.23Å; L766-W841 HydrophobicContact CG-CE3 3.98Å; L766-W841 HydrophobicContact CG-CZ3 3.75Å
767	N	42.9	Very low	48.6	Very low	60 Å²	60	57.2 Å²	57.2	32%	0.321	34%	0.34	S	S	.	.	H	α-helix	trans	-61	-21.3	179.1	-78.3	-6.5	0	0	0	114	F763 E765 P771 D855	F763-N767 PolarHBondContact O-N 2.74Å; F763-N767 PolarHBondContact O-OD1 3.44Å; E765-N767 PolarHBondContact O-N 3.32Å; N767-P771 VanDerWaalsContact O-CD 3.29Å; N767-P771 WeakPolarHBondContact O-CD 3.04Å; N767-D855 PolarHBondContact ND2-OD2 3.26Å
768	T	50.3	Low	50.1	Low	87 Å²	87	53.2 Å²	53.2	53%	0.534	31%	0.306	S	S	.	.	H	α-helix	trans	-80.6	-30.4	-175.8	63.9	0	0	0	0	114.1	E765 L766 Q772	E765-T768 PolarHBondContact O-N 3.11Å; E765-T768 PolarHBondContact O-OG1 3.42Å; L766-T768 PolarHBondContact O-N 3.4Å; L766-T768 VanDerWaalsContact O-N 3.15Å; T768-Q772 PolarHBondContact O-NE2 3.05Å; T768-Q772 PolarHBondContact O-OE1 3.08Å
769	C	55.2	Low	51.8	Low	30 Å²	30	48.6 Å²	48.6	20%	0.203	28%	0.278	C	S	.	.	H	α-helix	trans	-104.1	-17.3	-179.3	-61.7	0	0	0	0	113.3	I742 L766 Q772 L773	I742-C769 VanDerWaalsContact CG2-SG 3.52Å; L766-C769 PolarHBondContact O-N 2.84Å; C769-Q772 PolarHBondContact O-N 3.43Å; C769-Q772 PolarHBondContact O-OE1 2.85Å; C769-L773 PolarHBondContact O-N 3.31Å
770	F	58.1	Low	53.9	Low	17 Å²	17	43.2 Å²	43.2	8%	0.075	25%	0.249	C	C	.	.	H	α-helix	trans	-57.8	-45.1	-177.5	-176.3	-106.3	0	0	0	113.4	L766 Q772 L773 L774 W841 W850 W851	L766-F770 WeakPolarHBondContact O-CB 3.32Å; L766-F770 PolarHBondContact O-N 2.74Å; F770-Q772 VanDerWaalsContact C-N 3.31Å; F770-Q772 PolarHBondContact O-N 3.4Å; F770-L773 PolarHBondContact O-N 2.77Å; F770-L774 HydrophobicContact CZ-CD1 4.41Å; F770-L774 WeakPolarHBondContact O-CB 3.34Å; F770-L774 PolarHBondContact O-N 3.47Å; F770-W841 AromaticContact CD2-CH2 3.48Å; F770-W841 HydrophobicContact CD2-CH2 3.48Å; F770-W841 VanDerWaalsContact CD2-CH2 3.48Å; F770-W841 AromaticContact CD2-CZ3 3.69Å; F770-W841 HydrophobicContact CD2-CZ3 3.69Å; F770-W841 AromaticContact CE2-CH2 3.69Å; F770-W841 HydrophobicContact CE2-CH2 3.69Å; F770-W841 HydrophobicContact CE2-CZ2 4.47Å; F770-W841 HydrophobicContact CE2-CZ3 4.37Å; F770-W850 AromaticContact CE2-CE3 3.92Å; F770-W850 HydrophobicContact CE2-CE3 3.92Å; F770-W850 HydrophobicContact CE2-CZ3 4.2Å; F770-W850 WeakPolarHBondContact CE2-O 3.19Å; F770-W851 HydrophobicContact CZ-CB 3.93Å
771	P	61	Low	55.8	Low	62 Å²	62	39.4 Å²	39.4	40%	0.403	22%	0.217	S	C	.	.	H	α-helix	trans	-60.8	-38.4	177.4	-23.4	34.5	0	0	0	113.1	N767 L774 N775	N767-P771 VanDerWaalsContact O-CD 3.29Å; N767-P771 WeakPolarHBondContact O-CD 3.04Å; P771-L774 WeakPolarHBondContact O-CB 3.19Å; P771-L774 PolarHBondContact O-N 2.89Å; P771-N775 VanDerWaalsContact O-CB 3.31Å; P771-N775 WeakPolarHBondContact O-CB 3.25Å; P771-N775 VanDerWaalsContact O-CG 3.29Å; P771-N775 PolarHBondContact O-N 3.48Å
772	Q	66.8	Low	57.7	Low	66 Å²	66	36.5 Å²	36.5	31%	0.308	20%	0.198	S	C	.	.	H	α-helix	trans	-71.5	-37.7	178.9	-61.3	82.5	-9.6	0	0	111.2	S654 T768 C769 F770 L774 N775 C776	S654-Q772 WeakPolarHBondContact OG-CG 3.31Å; T768-Q772 PolarHBondContact O-NE2 3.05Å; T768-Q772 PolarHBondContact O-OE1 3.08Å; C769-Q772 PolarHBondContact O-N 3.43Å; C769-Q772 PolarHBondContact O-OE1 2.85Å; F770-Q772 VanDerWaalsContact C-N 3.31Å; F770-Q772 PolarHBondContact O-N 3.4Å; Q772-L774 VanDerWaalsContact C-N 3.33Å; Q772-N775 WeakPolarHBondContact O-CB 3.07Å; Q772-N775 PolarHBondContact O-N 2.86Å; Q772-C776 PolarHBondContact O-N 3.39Å; Q772-C776 PolarHBondContact O-SG 3.46Å
773	L	66	Low	59.4	Low	6 Å²	6	32.9 Å²	32.9	3%	0.031	18%	0.18	C	C	.	.	H	α-helix	trans	-63.3	-41.9	173.8	-179.4	60.9	0	0	0	111.3	C769 F770 N775 C776 I777 F828 W832 M835 W841	C769-L773 PolarHBondContact O-N 3.31Å; F770-L773 PolarHBondContact O-N 2.77Å; L773-N775 VanDerWaalsContact C-N 3.31Å; L773-N775 PolarHBondContact O-N 3.37Å; L773-C776 WeakPolarHBondContact O-CA 3.27Å; L773-C776 WeakPolarHBondContact O-CB 3.49Å; L773-C776 PolarHBondContact O-N 3.21Å; L773-C776 VanDerWaalsContact O-N 3.12Å; L773-I777 WeakPolarHBondContact O-CG1 3.45Å; L773-I777 PolarHBondContact O-N 2.79Å; L773-F828 HydrophobicContact CD1-CE2 3.98Å; L773-F828 HydrophobicContact CD1-CZ 4.44Å; L773-W832 HydrophobicContact CD1-CE3 3.99Å; L773-W832 HydrophobicContact CD1-CZ3 4.1Å; L773-W832 HydrophobicContact CD2-CE3 4.21Å; L773-W832 HydrophobicContact CD2-CH2 4.35Å; L773-W832 HydrophobicContact CD2-CZ3 3.68Å; L773-W832 HydrophobicContact CG-CZ3 4.12Å; L773-M835 HydrophobicContact CD1-SD 3.78Å; L773-M835 HydrophobicContact CD2-CE 4.14Å; L773-M835 HydrophobicContact CD2-SD 4.32Å; L773-W841 HydrophobicContact CD2-CD2 4.41Å; L773-W841 HydrophobicContact CD2-CE3 4.35Å
774	L	66.2	Low	61.1	Low	30 Å²	30	27.4 Å²	27.4	16%	0.157	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-44.8	176.9	-159.8	66.4	0	0	0	111.8	F770 P771 Q772 C776 I777 I778 I871	F770-L774 HydrophobicContact CZ-CD1 4.41Å; F770-L774 WeakPolarHBondContact O-CB 3.34Å; F770-L774 PolarHBondContact O-N 3.47Å; P771-L774 WeakPolarHBondContact O-CB 3.19Å; P771-L774 PolarHBondContact O-N 2.89Å; Q772-L774 VanDerWaalsContact C-N 3.33Å; L774-C776 VanDerWaalsContact C-N 3.32Å; L774-C776 PolarHBondContact O-N 3.11Å; L774-I777 HydrophobicContact CD1-CD1 4.41Å; L774-I777 WeakPolarHBondContact O-CB 3.35Å; L774-I777 PolarHBondContact O-N 3.25Å; L774-I777 VanDerWaalsContact O-N 3.08Å; L774-I778 WeakPolarHBondContact O-CG1 3.44Å; L774-I778 PolarHBondContact O-N 2.99Å; L774-I778 VanDerWaalsContact O-N 3.08Å; L774-I871 HydrophobicContact CD1-CD1 3.24Å; L774-I871 HydrophobicContact CD1-CG1 4.04Å; L774-I871 HydrophobicContact CD1-CG2 4.31Å; L774-I871 HydrophobicContact CD2-CD1 3.39Å; L774-I871 HydrophobicContact CG-CD1 3.25Å; L774-I871 HydrophobicContact CG-CG1 4.35Å
775	N	68.2	Low	62.8	Low	8 Å²	8	25 Å²	25	4%	0.043	14%	0.137	C	C	.	.	H	α-helix	trans	-57.7	-43.3	172.3	-86.1	1.5	0	0	0	111.7	I657 N658 I661 P771 Q772 L773 I777 I778 L779	I657-N775 HydrophobicContact CG2-CB 4.3Å; N658-N775 PolarHBondContact OD1-ND2 3.34Å; I661-N775 HydrophobicContact CD1-CB 3.05Å; I661-N775 VanDerWaalsContact CD1-O 3.32Å; I661-N775 WeakPolarHBondContact CD1-O 3.42Å; P771-N775 VanDerWaalsContact O-CB 3.31Å; P771-N775 WeakPolarHBondContact O-CB 3.25Å; P771-N775 VanDerWaalsContact O-CG 3.29Å; P771-N775 PolarHBondContact O-N 3.48Å; Q772-N775 WeakPolarHBondContact O-CB 3.07Å; Q772-N775 PolarHBondContact O-N 2.86Å; L773-N775 VanDerWaalsContact C-N 3.31Å; L773-N775 PolarHBondContact O-N 3.37Å; N775-I777 VanDerWaalsContact C-N 3.33Å; N775-I777 PolarHBondContact O-N 2.84Å; N775-I778 PolarHBondContact O-N 3.32Å; N775-L779 WeakPolarHBondContact O-CB 3.49Å; N775-L779 WeakPolarHBondContact O-CG 3.49Å; N775-L779 PolarHBondContact O-N 2.83Å
776	C	70.9	Confident	63.6	Low	5 Å²	5	23.4 Å²	23.4	3%	0.034	13%	0.133	C	C	.	.	H	α-helix	trans	-63.4	-34	173.1	-67.3	0	0	0	0	113.5	L732 Q772 L773 L774 T780 F828 L831	L732-C776 HydrophobicContact CD2-CB 3.82Å; Q772-C776 PolarHBondContact O-N 3.39Å; Q772-C776 PolarHBondContact O-SG 3.46Å; L773-C776 WeakPolarHBondContact O-CA 3.27Å; L773-C776 WeakPolarHBondContact O-CB 3.49Å; L773-C776 PolarHBondContact O-N 3.21Å; L773-C776 VanDerWaalsContact O-N 3.12Å; L774-C776 VanDerWaalsContact C-N 3.32Å; L774-C776 PolarHBondContact O-N 3.11Å; C776-T780 VanDerWaalsContact O-CB 3.26Å; C776-T780 WeakPolarHBondContact O-CB 3.47Å; C776-T780 PolarHBondContact O-N 3.29Å; C776-T780 PolarHBondContact O-OG1 3.42Å; C776-F828 HydrophobicContact CB-CD2 4.41Å; C776-F828 HydrophobicContact CB-CE2 4.48Å; C776-L831 HydrophobicContact CB-CD2 4.27Å
777	I	69.6	Low	64.2	Low	1 Å²	1	26.5 Å²	26.5	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-63.9	-50.4	175.4	-66.8	167.5	0	0	0	110.1	L773 L774 N775 L779 T780 S781 F828 L874 F875 W889	L773-I777 WeakPolarHBondContact O-CG1 3.45Å; L773-I777 PolarHBondContact O-N 2.79Å; L774-I777 HydrophobicContact CD1-CD1 4.41Å; L774-I777 WeakPolarHBondContact O-CB 3.35Å; L774-I777 PolarHBondContact O-N 3.25Å; L774-I777 VanDerWaalsContact O-N 3.08Å; N775-I777 VanDerWaalsContact C-N 3.33Å; N775-I777 PolarHBondContact O-N 2.84Å; I777-L779 VanDerWaalsContact C-N 3.34Å; I777-L779 PolarHBondContact O-N 3.21Å; I777-T780 WeakPolarHBondContact O-CB 3.4Å; I777-T780 PolarHBondContact O-N 3.46Å; I777-T780 VanDerWaalsContact O-N 3.12Å; I777-S781 PolarHBondContact O-N 3.16Å; I777-S781 PolarHBondContact O-OG 3.05Å; I777-F828 HydrophobicContact CD1-CZ 4.17Å; I777-F828 HydrophobicContact CG1-CE1 4.5Å; I777-F828 HydrophobicContact CG1-CE2 3.49Å; I777-F828 VanDerWaalsContact CG1-CE2 3.49Å; I777-F828 HydrophobicContact CG1-CZ 3.46Å; I777-F828 VanDerWaalsContact CG1-CZ 3.46Å; I777-L874 HydrophobicContact CG2-CD2 3.71Å; I777-F875 HydrophobicContact CD1-CE2 4.25Å; I777-F875 HydrophobicContact CD1-CZ 4.24Å; I777-F875 HydrophobicContact CG2-CE2 3.94Å; I777-F875 HydrophobicContact CG2-CZ 3.78Å; I777-W889 HydrophobicContact CG2-CH2 4.36Å
778	I	67.8	Low	64.4	Low	3 Å²	3	26.6 Å²	26.6	2%	0.015	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-44.5	179.7	-62.2	168.9	0	0	0	110.6	F665 L774 N775 T780 S781 E782 R867 Y870 I871	F665-I778 HydrophobicContact CE2-CG2 4.28Å; F665-I778 HydrophobicContact CZ-CD1 4.47Å; F665-I778 HydrophobicContact CZ-CG2 4.12Å; L774-I778 WeakPolarHBondContact O-CG1 3.44Å; L774-I778 PolarHBondContact O-N 2.99Å; L774-I778 VanDerWaalsContact O-N 3.08Å; N775-I778 PolarHBondContact O-N 3.32Å; I778-T780 VanDerWaalsContact C-N 3.29Å; I778-T780 PolarHBondContact O-N 3.29Å; I778-S781 PolarHBondContact O-N 2.99Å; I778-S781 PolarHBondContact O-OG 3.36Å; I778-E782 PolarHBondContact O-N 3.47Å; I778-R867 HydrophobicContact CD1-CB 3.93Å; I778-R867 HydrophobicContact CD1-CG 4.13Å; I778-Y870 HydrophobicContact CG1-CD1 4.08Å; I778-Y870 HydrophobicContact CG1-CE1 4.39Å; I778-Y870 HydrophobicContact CG2-CD1 4.45Å; I778-Y870 HydrophobicContact CG2-CE1 4.31Å; I778-I871 HydrophobicContact CD1-CD1 4.21Å; I778-I871 HydrophobicContact CD1-CG1 4.4Å; I778-I871 HydrophobicContact CG1-CG1 4.23Å
779	L	71.4	Confident	63.8	Low	6 Å²	6	30.2 Å²	30.2	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-60.2	-41.6	175.1	-75	178.7	0	0	0	112.5	I657 L660 I661 F664 I728 N775 I777 A783	I657-L779 HydrophobicContact CB-CD1 4.46Å; I657-L779 HydrophobicContact CG2-CD1 3.74Å; L660-L779 HydrophobicContact CD2-CD1 4.33Å; L660-L779 HydrophobicContact CD2-CD2 3.31Å; L660-L779 HydrophobicContact CD2-CG 4.45Å; I661-L779 HydrophobicContact CB-CD2 4.49Å; I661-L779 HydrophobicContact CD1-CD1 3.95Å; I661-L779 HydrophobicContact CD1-CD2 4.33Å; I661-L779 HydrophobicContact CD1-CG 3.78Å; I661-L779 HydrophobicContact CG1-CD1 3.8Å; I661-L779 HydrophobicContact CG1-CD2 3.39Å; I661-L779 HydrophobicContact CG1-CG 3.37Å; F664-L779 HydrophobicContact CD2-CD2 3.43Å; F664-L779 VanDerWaalsContact CD2-CD2 3.43Å; F664-L779 HydrophobicContact CE2-CD2 3.34Å; F664-L779 HydrophobicContact CZ-CD2 4.47Å; I728-L779 HydrophobicContact CG2-CB 4.4Å; N775-L779 WeakPolarHBondContact O-CB 3.49Å; N775-L779 WeakPolarHBondContact O-CG 3.49Å; N775-L779 PolarHBondContact O-N 2.83Å; I777-L779 VanDerWaalsContact C-N 3.34Å; I777-L779 PolarHBondContact O-N 3.21Å; L779-A783 WeakPolarHBondContact O-CB 3.32Å; L779-A783 PolarHBondContact O-N 3.48Å
780	T	75.7	Confident	62.9	Low	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.5	-43.8	-179.2	-60.7	0	0	0	0	111	L732 C776 I777 I778 C784 P824 L825 F828 W889	L732-T780 WeakPolarHBondContact CD1-OG1 3.4Å; C776-T780 VanDerWaalsContact O-CB 3.26Å; C776-T780 WeakPolarHBondContact O-CB 3.47Å; C776-T780 PolarHBondContact O-N 3.29Å; C776-T780 PolarHBondContact O-OG1 3.42Å; I777-T780 WeakPolarHBondContact O-CB 3.4Å; I777-T780 PolarHBondContact O-N 3.46Å; I777-T780 VanDerWaalsContact O-N 3.12Å; I778-T780 VanDerWaalsContact C-N 3.29Å; I778-T780 PolarHBondContact O-N 3.29Å; T780-C784 PolarHBondContact O-N 3.2Å; T780-C784 PolarHBondContact O-SG 2.99Å; T780-P824 HydrophobicContact CG2-CB 4.01Å; T780-L825 HydrophobicContact CG2-CB 4.36Å; T780-F828 HydrophobicContact CG2-CB 3.76Å; T780-F828 HydrophobicContact CG2-CG 4.29Å; T780-W889 HydrophobicContact CG2-CH2 3.71Å; T780-W889 HydrophobicContact CG2-CZ2 4.22Å
781	S	72.8	Confident	61.7	Low	0 Å²	0	40 Å²	40	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-53.6	178.8	57.2	0	0	0	0	110.5	I777 I778 A783 C784 F785 Y870	I777-S781 PolarHBondContact O-N 3.16Å; I777-S781 PolarHBondContact O-OG 3.05Å; I778-S781 PolarHBondContact O-N 2.99Å; I778-S781 PolarHBondContact O-OG 3.36Å; S781-A783 VanDerWaalsContact C-N 3.31Å; S781-A783 PolarHBondContact O-N 2.81Å; S781-C784 PolarHBondContact O-N 3.49Å; S781-F785 WeakPolarHBondContact O-CD2 3.36Å; S781-F785 WeakPolarHBondContact O-CE2 3.49Å; S781-Y870 VanDerWaalsContact OG-CE1 3.32Å; S781-Y870 WeakPolarHBondContact OG-CE1 3.35Å; S781-Y870 PolarHBondContact OG-OH 2.75Å
782	E	71.7	Confident	60.2	Low	18 Å²	18	41.2 Å²	41.2	8%	0.084	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-36.7	-179.4	-74.5	-56.3	124.4	0	0	112.7	F664 I778 C784 F785 R817 Y870	F664-E782 HydrophobicContact CD1-CB 3.88Å; F664-E782 HydrophobicContact CD1-CG 4.29Å; F664-E782 HydrophobicContact CE1-CB 3.67Å; F664-E782 HydrophobicContact CZ-CB 4.3Å; I778-E782 PolarHBondContact O-N 3.47Å; E782-C784 PolarHBondContact O-N 3.08Å; E782-F785 PolarHBondContact O-N 3.25Å; E782-R817 IonicContact OE1-NH1 2.66Å; E782-R817 IonicContact OE2-NH1 3.9Å; E782-R817 PolarHBondContact OE2-NH1 3.45Å; E782-Y870 WeakPolarHBondContact OE1-CE2 3.48Å; E782-Y870 VanDerWaalsContact OE1-CZ 3.3Å; E782-Y870 PolarHBondContact OE1-OH 3.22Å
783	A	68.8	Low	58.4	Low	8 Å²	8	44.9 Å²	44.9	7%	0.066	25%	0.246	C	C	.	.	H	α-helix	trans	-69.5	-19	177.3	0	0	0	0	0	114.3	I728 L779 S781 P824	I728-A783 HydrophobicContact CB-CB 4.45Å; I728-A783 HydrophobicContact CD1-CB 3.67Å; I728-A783 HydrophobicContact CG2-CB 4.07Å; L779-A783 WeakPolarHBondContact O-CB 3.32Å; L779-A783 PolarHBondContact O-N 3.48Å; S781-A783 VanDerWaalsContact C-N 3.31Å; S781-A783 PolarHBondContact O-N 2.81Å; A783-P824 HydrophobicContact CB-CB 3.93Å; A783-P824 HydrophobicContact CB-CG 3.64Å
784	C	69.4	Low	56.9	Low	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-82.3	-27.4	177.5	-70.8	0	0	0	0	112.3	T780 S781 E782 V819 V820	T780-C784 PolarHBondContact O-N 3.2Å; T780-C784 PolarHBondContact O-SG 2.99Å; S781-C784 PolarHBondContact O-N 3.49Å; E782-C784 PolarHBondContact O-N 3.08Å; C784-V819 HydrophobicContact CB-CG1 4.24Å; C784-V819 CarbonylContact O-C 3.58Å; C784-V819 WeakPolarHBondContact O-CA 3.37Å; C784-V819 WeakPolarHBondContact O-CG1 3.4Å; C784-V820 PolarHBondContact O-N 3.48Å
785	F	69.1	Low	55.1	Low	15 Å²	15	56.1 Å²	56.1	7%	0.066	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-91.9	148.9	-171.3	-67.9	-63.9	0	0	0	114.1	S781 E782 I814 R817 S818 V819 Q896	S781-F785 WeakPolarHBondContact O-CD2 3.36Å; S781-F785 WeakPolarHBondContact O-CE2 3.49Å; E782-F785 PolarHBondContact O-N 3.25Å; F785-I814 HydrophobicContact CE2-CG2 4.36Å; F785-I814 HydrophobicContact CZ-CG2 4.01Å; F785-R817 HydrophobicContact CB-CB 3.94Å; F785-R817 HydrophobicContact CD1-CB 3.77Å; F785-R817 HydrophobicContact CG-CB 4.08Å; F785-S818 CarbonylContact C-O 3.57Å; F785-V819 HydrophobicContact CD1-CG2 3.84Å; F785-V819 HydrophobicContact CE1-CG2 3.66Å; F785-Q896 VanDerWaalsContact CE1-OE1 3.31Å
786	S	56.1	Low	53.4	Low	26 Å²	26	59.5 Å²	59.5	18%	0.182	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-77.9	158.5	168	70.2	0	0	0	0	111.2	R817 S818 V820	S786-R817 WeakPolarHBondContact O-CD 3.27Å; S786-R817 WeakPolarHBondContact O-CG 3.43Å; S786-S818 WeakPolarHBondContact CB-O 3.48Å; S786-S818 WeakPolarHBondContact CB-OG 3.39Å; S786-S818 PolarHBondContact N-O 2.91Å; S786-S818 PolarHBondContact OG-N 3.46Å; S786-S818 PolarHBondContact OG-O 3.5Å; S786-S818 PolarHBondContact OG-OG 3.3Å; S786-V820 VanDerWaalsContact CB-CG2 3.5Å
787	Q	50.7	Low	51.4	Low	108 Å²	108	65.2 Å²	65.2	51%	0.505	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-65.4	153.2	169.8	-162.3	172.4	10.5	0	0	110.8	D789	Q787-D789 PolarHBondContact O-N 3.25Å
788	N	47.3	Very low	49.5	Very low	63 Å²	63	71.3 Å²	71.3	34%	0.337	41%	0.411	S	S	.	.			trans	-66.1	113.4	173.9	-64.7	-13.9	0	0	0	109.6	E790 F813 R817	N788-E790 PolarHBondContact O-N 3.46Å; N788-F813 VanDerWaalsContact ND2-CD2 3.27Å; N788-F813 WeakPolarHBondContact ND2-CD2 3.38Å; N788-F813 WeakPolarHBondContact ND2-CE2 3.33Å; N788-R817 WeakPolarHBondContact OD1-CG 3.45Å; N788-R817 PolarHBondContact OD1-NE 2.95Å
789	D	37	Very low	47.8	Very low	162 Å²	162	80.7 Å²	80.7	87%	0.866	45%	0.451	S	S	*	.			trans	-74.1	-5.4	169.4	-88.2	-17.8	0	0	0	112.5	Q787 S791	Q787-D789 PolarHBondContact O-N 3.25Å; D789-S791 PolarHBondContact O-N 3.44Å
790	E	36.2	Very low	45.8	Very low	141 Å²	141	87.1 Å²	87.1	66%	0.659	49%	0.486	S	S	*	.			trans	-96.4	76.1	175	-71.8	-169.3	167	0	0	111.3	N788 T792	N788-E790 PolarHBondContact O-N 3.46Å; E790-T792 HydrophobicContact CB-CG2 4.29Å; E790-T792 HydrophobicContact CG-CG2 4.22Å; E790-T792 PolarHBondContact O-N 3.49Å; E790-T792 VanDerWaalsContact O-N 3.09Å
791	S	33.2	Very low	43.5	Very low	112 Å²	112	94.8 Å²	94.8	78%	0.783	52%	0.521	S	S	*	.			trans	-73.4	62	137.9	66.7	0	0	0	0	107.7	D789 D793	D789-S791 PolarHBondContact O-N 3.44Å; S791-D793 PolarHBondContact O-N 3.26Å
792	T	29.6	Very low	41.6	Very low	87 Å²	87	101.1 Å²	101.1	53%	0.534	56%	0.564	S	S	.	*			trans	-67.7	113.4	162	32.1	0	0	0	0	105.5	E790 I794	E790-T792 HydrophobicContact CB-CG2 4.29Å; E790-T792 HydrophobicContact CG-CG2 4.22Å; E790-T792 PolarHBondContact O-N 3.49Å; E790-T792 VanDerWaalsContact O-N 3.09Å; T792-I794 WeakPolarHBondContact O-CG1 3.26Å; T792-I794 PolarHBondContact O-N 3.4Å
793	D	29.4	Very low	39.7	Very low	144 Å²	144	102.8 Å²	102.8	77%	0.77	59%	0.586	S	S	*	*			trans	-32.1	89.3	175.3	-71.1	-45.7	0	0	0	113.3	S791 T795	S791-D793 PolarHBondContact O-N 3.26Å; D793-T795 PolarHBondContact O-N 2.89Å
794	I	33	Very low	37.9	Very low	153 Å²	153	106 Å²	106	79%	0.785	61%	0.608	S	S	*	*			trans	-87.3	41.7	156.9	-42.2	-177.7	0	0	0	107.8	T792 A796	T792-I794 WeakPolarHBondContact O-CG1 3.26Å; T792-I794 PolarHBondContact O-N 3.4Å; I794-A796 PolarHBondContact O-N 2.8Å
795	T	30.3	Very low	36.4	Very low	119 Å²	119	109.9 Å²	109.9	73%	0.73	64%	0.635	S	S	*	*			trans	-82	72.6	154.8	43.6	0	0	0	0	108.2	D793	D793-T795 PolarHBondContact O-N 2.89Å
796	A	31.1	Very low	34.9	Very low	79 Å²	79	113.2 Å²	113.2	65%	0.653	65%	0.653	S	S	*	*			trans	171.2	88.8	151	0	0	0	0	0	110.1	I794	I794-A796 PolarHBondContact O-N 2.8Å
797	T	28.6	Very low	33.9	Very low	124 Å²	124	116.5 Å²	116.5	76%	0.761	67%	0.666	S	S	*	*			trans	-178.8	92.6	130.2	26.3	0	0	0	0	109.7
798	T	30	Very low	33.2	Very low	130 Å²	130	115.6 Å²	115.6	80%	0.798	67%	0.667	S	S	*	*			trans	36	105.2	136.6	51.1	0	0	0	0	118.9
799	K	31.6	Very low	33	Very low	199 Å²	199	114.1 Å²	114.1	87%	0.865	67%	0.667	S	S	*	*	S	Bend	trans	31.1	120.2	134.7	-74.9	179	175.1	177.6	0	117.8
800	N	31.1	Very low	33.3	Very low	142 Å²	142	107 Å²	107	76%	0.759	63%	0.629	S	S	*	*			trans	102.4	31.4	147.2	-58.6	-7	0	0	0	120.5
801	H	27.5	Very low	33.6	Very low	160 Å²	160	103.3 Å²	103.3	74%	0.741	62%	0.616	S	S	*	*			trans	-135.1	79.1	160.1	-74.9	-49.5	0	0	0	112.4	G803	H801-G803 PolarHBondContact O-N 3.39Å
802	C	31.3	Very low	34.1	Very low	133 Å²	133	102 Å²	102	90%	0.899	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	17.3	-179.5	-161.1	0	0	0	0	114
803	G	33.4	Very low	34.9	Very low	54 Å²	54	99.4 Å²	99.4	56%	0.557	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	-34.3	178.9	0	0	0	0	0	114.4	H801	H801-G803 PolarHBondContact O-N 3.39Å
804	S	30.3	Very low	36	Very low	74 Å²	74	93.4 Å²	93.4	52%	0.517	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-19.2	-173.4	52.4	0	0	0	0	114.1	L806 T808	S804-L806 VanDerWaalsContact C-N 3.33Å; S804-L806 PolarHBondContact O-N 3.33Å; S804-T808 PolarHBondContact O-OG1 2.93Å
805	S	37.2	Very low	37	Very low	82 Å²	82	93.6 Å²	93.6	57%	0.573	55%	0.545	S	S	*	.	H	α-helix	trans	-73.7	-22.7	-179.5	65.3	0	0	0	0	113.6	G809	S805-G809 PolarHBondContact O-N 2.97Å; S805-G809 VanDerWaalsContact O-N 3.17Å
806	L	38.3	Very low	38.2	Very low	85 Å²	85	93.3 Å²	93.3	45%	0.445	54%	0.539	S	S	.	.	H	α-helix	trans	-69.1	-42.6	179.1	-155	81.8	0	0	0	111.2	S804 G809 I810	S804-L806 VanDerWaalsContact C-N 3.33Å; S804-L806 PolarHBondContact O-N 3.33Å; L806-G809 WeakPolarHBondContact O-CA 3.48Å; L806-G809 PolarHBondContact O-N 2.9Å; L806-G809 VanDerWaalsContact O-N 3.12Å; L806-I810 HydrophobicContact CD2-CD1 4.17Å; L806-I810 HydrophobicContact CG-CD1 4.02Å; L806-I810 HydrophobicContact CG-CG1 4.5Å; L806-I810 WeakPolarHBondContact O-CG1 3.38Å; L806-I810 PolarHBondContact O-N 3.39Å
807	H	35.5	Very low	39.8	Very low	95 Å²	95	90.9 Å²	90.9	44%	0.44	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-45.2	-177.6	-74.5	-58.2	0	0	0	114.1	G809 T811 Q869 E873	H807-G809 PolarHBondContact O-N 3.25Å; H807-T811 PolarHBondContact O-OG1 3.47Å; H807-T811 VanDerWaalsContact O-OG1 3.07Å; H807-Q869 PolarHBondContact CE1-OE1 3.31Å; H807-E873 IonicContact ND1-OE1 3.31Å
808	T	35.6	Very low	41.6	Very low	89 Å²	89	87.7 Å²	87.7	55%	0.546	50%	0.495	S	S	.	.	H	α-helix	trans	-73.5	-19.9	174.5	-17.8	0	0	0	0	111.6	S804 N812	S804-T808 PolarHBondContact O-OG1 2.93Å; T808-N812 WeakPolarHBondContact O-CB 3.36Å; T808-N812 PolarHBondContact O-ND2 2.86Å
809	G	42.5	Very low	43.4	Very low	32 Å²	32	81.5 Å²	81.5	33%	0.33	46%	0.458	S	S	.	.	H	α-helix	trans	-66.5	-68.4	172.5	0	0	0	0	0	110.5	S805 L806 H807 T811 N812 F813	S805-G809 PolarHBondContact O-N 2.97Å; S805-G809 VanDerWaalsContact O-N 3.17Å; L806-G809 WeakPolarHBondContact O-CA 3.48Å; L806-G809 PolarHBondContact O-N 2.9Å; L806-G809 VanDerWaalsContact O-N 3.12Å; H807-G809 PolarHBondContact O-N 3.25Å; G809-T811 VanDerWaalsContact C-N 3.35Å; G809-T811 PolarHBondContact O-N 3.1Å; G809-N812 CarbonylContact O-C 3.13Å; G809-N812 PolarHBondContact O-N 3Å; G809-N812 VanDerWaalsContact O-N 3.1Å; G809-F813 WeakPolarHBondContact O-CB 3.29Å; G809-F813 PolarHBondContact O-N 3.23Å
810	I	43.2	Very low	45.2	Very low	13 Å²	13	75.7 Å²	75.7	7%	0.067	44%	0.439	C	S	.	.	H	α-helix	trans	-58.5	-41.3	-168.5	-58.5	164.4	0	0	0	112.2	L806 N812 F813 I814 Y870 E873	L806-I810 HydrophobicContact CD2-CD1 4.17Å; L806-I810 HydrophobicContact CG-CD1 4.02Å; L806-I810 HydrophobicContact CG-CG1 4.5Å; L806-I810 WeakPolarHBondContact O-CG1 3.38Å; L806-I810 PolarHBondContact O-N 3.39Å; I810-N812 PolarHBondContact O-N 3.24Å; I810-F813 VanDerWaalsContact O-CB 3.25Å; I810-F813 WeakPolarHBondContact O-CB 3.45Å; I810-F813 PolarHBondContact O-N 3.36Å; I810-F813 VanDerWaalsContact O-N 3.11Å; I810-I814 HydrophobicContact CG2-CD1 4.17Å; I810-I814 PolarHBondContact O-N 2.91Å; I810-Y870 HydrophobicContact CG2-CD2 4.24Å; I810-E873 WeakPolarHBondContact CB-OE2 3.07Å; I810-E873 HydrophobicContact CG2-CB 4.12Å; I810-E873 HydrophobicContact CG2-CG 4.44Å; I810-E873 WeakPolarHBondContact CG2-OE2 3.31Å
811	T	43.3	Very low	47.4	Very low	63 Å²	63	69.6 Å²	69.6	39%	0.387	41%	0.406	S	S	.	.	H	α-helix	trans	-65.5	-38.8	177.4	47.4	0	0	0	0	114.2	H807 G809 F813 E873	H807-T811 PolarHBondContact O-OG1 3.47Å; H807-T811 VanDerWaalsContact O-OG1 3.07Å; G809-T811 VanDerWaalsContact C-N 3.35Å; G809-T811 PolarHBondContact O-N 3.1Å; T811-F813 VanDerWaalsContact C-N 3.33Å; T811-E873 HydrophobicContact CG2-CG 4.23Å; T811-E873 WeakPolarHBondContact CG2-OE2 3.35Å; T811-E873 PolarHBondContact N-OE2 2.68Å
812	N	43.6	Very low	50	Low	85 Å²	85	62 Å²	62	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-75.4	-27.7	172	-74.2	-34.3	0	0	0	111.3	T808 G809 I810 N816	T808-N812 WeakPolarHBondContact O-CB 3.36Å; T808-N812 PolarHBondContact O-ND2 2.86Å; G809-N812 CarbonylContact O-C 3.13Å; G809-N812 PolarHBondContact O-N 3Å; G809-N812 VanDerWaalsContact O-N 3.1Å; I810-N812 PolarHBondContact O-N 3.24Å; N812-N816 VanDerWaalsContact O-CB 3.27Å; N812-N816 WeakPolarHBondContact O-CB 3.32Å; N812-N816 PolarHBondContact O-N 3.36Å; N812-N816 VanDerWaalsContact O-N 3.11Å; N812-N816 PolarHBondContact O-ND2 3.45Å
813	F	45.6	Very low	52.4	Low	33 Å²	33	58.4 Å²	58.4	15%	0.145	34%	0.34	C	S	.	.	H	α-helix	trans	-70	-44.7	-176	-170.3	-97.5	0	0	0	112.8	E668 N788 G809 I810 T811 R817	E668-F813 HydrophobicContact CG-CZ 4.1Å; E668-F813 WeakPolarHBondContact OE1-CE1 3.44Å; E668-F813 WeakPolarHBondContact OE1-CZ 3.27Å; N788-F813 VanDerWaalsContact ND2-CD2 3.27Å; N788-F813 WeakPolarHBondContact ND2-CD2 3.38Å; N788-F813 WeakPolarHBondContact ND2-CE2 3.33Å; G809-F813 WeakPolarHBondContact O-CB 3.29Å; G809-F813 PolarHBondContact O-N 3.23Å; I810-F813 VanDerWaalsContact O-CB 3.25Å; I810-F813 WeakPolarHBondContact O-CB 3.45Å; I810-F813 PolarHBondContact O-N 3.36Å; I810-F813 VanDerWaalsContact O-N 3.11Å; T811-F813 VanDerWaalsContact C-N 3.33Å; F813-R817 VanDerWaalsContact CE1-NH2 3.34Å; F813-R817 WeakPolarHBondContact O-CD 3.11Å; F813-R817 VanDerWaalsContact O-CG 3.32Å; F813-R817 WeakPolarHBondContact O-CG 3.41Å
814	I	53.3	Low	54.7	Low	17 Å²	17	55.8 Å²	55.8	9%	0.087	31%	0.314	C	S	.	.	H	α-helix	trans	-70.4	-35	177.3	-61.5	172.2	0	0	0	110.9	F785 I810 E873 L874 Q896	F785-I814 HydrophobicContact CE2-CG2 4.36Å; F785-I814 HydrophobicContact CZ-CG2 4.01Å; I810-I814 HydrophobicContact CG2-CD1 4.17Å; I810-I814 PolarHBondContact O-N 2.91Å; I814-E873 HydrophobicContact CD1-CB 4.47Å; I814-L874 HydrophobicContact CD1-CB 4.42Å; I814-L874 HydrophobicContact CD1-CD1 4.2Å; I814-L874 HydrophobicContact CG2-CD1 4.49Å; I814-Q896 PolarHBondContact O-NE2 3.17Å
815	K	54.3	Low	57.3	Low	157 Å²	157	52.3 Å²	52.3	68%	0.683	29%	0.289	S	S	*	.	H	α-helix	trans	-75.3	-30.8	-177	-74.5	-177.5	179.5	176	0	113.8
816	N	55.4	Low	59.6	Low	114 Å²	114	48.9 Å²	48.9	61%	0.61	26%	0.264	S	S	*	.	H	α-helix	trans	-93.2	-7.7	-172.6	-66.5	-9.7	0	0	0	114.1	N812	N812-N816 VanDerWaalsContact O-CB 3.27Å; N812-N816 WeakPolarHBondContact O-CB 3.32Å; N812-N816 PolarHBondContact O-N 3.36Å; N812-N816 VanDerWaalsContact O-N 3.11Å; N812-N816 PolarHBondContact O-ND2 3.45Å
817	R	64.2	Low	61.6	Low	28 Å²	28	45 Å²	45	11%	0.106	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-86.2	132.5	179.4	-73.6	175.6	170.6	-160	-9.3	111.6	E782 F785 S786 N788 F813	E782-R817 IonicContact OE1-NH1 2.66Å; E782-R817 IonicContact OE2-NH1 3.9Å; E782-R817 PolarHBondContact OE2-NH1 3.45Å; F785-R817 HydrophobicContact CB-CB 3.94Å; F785-R817 HydrophobicContact CD1-CB 3.77Å; F785-R817 HydrophobicContact CG-CB 4.08Å; S786-R817 WeakPolarHBondContact O-CD 3.27Å; S786-R817 WeakPolarHBondContact O-CG 3.43Å; N788-R817 WeakPolarHBondContact OD1-CG 3.45Å; N788-R817 PolarHBondContact OD1-NE 2.95Å; F813-R817 VanDerWaalsContact CE1-NH2 3.34Å; F813-R817 WeakPolarHBondContact O-CD 3.11Å; F813-R817 VanDerWaalsContact O-CG 3.32Å; F813-R817 WeakPolarHBondContact O-CG 3.41Å
818	S	65.7	Low	64	Low	56 Å²	56	40.6 Å²	40.6	39%	0.392	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-75.9	140.7	173.2	71.5	0	0	0	0	110.3	F785 S786	F785-S818 CarbonylContact C-O 3.57Å; S786-S818 WeakPolarHBondContact CB-O 3.48Å; S786-S818 WeakPolarHBondContact CB-OG 3.39Å; S786-S818 PolarHBondContact N-O 2.91Å; S786-S818 PolarHBondContact OG-N 3.46Å; S786-S818 PolarHBondContact OG-O 3.5Å; S786-S818 PolarHBondContact OG-OG 3.3Å
819	V	68.3	Low	66.4	Low	1 Å²	1	36.3 Å²	36.3	1%	0.006	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-83.5	120.8	176.6	176.8	0	0	0	0	108.9	C784 F785 L822 I893 Q896 F897 S900	C784-V819 HydrophobicContact CB-CG1 4.24Å; C784-V819 CarbonylContact O-C 3.58Å; C784-V819 WeakPolarHBondContact O-CA 3.37Å; C784-V819 WeakPolarHBondContact O-CG1 3.4Å; F785-V819 HydrophobicContact CD1-CG2 3.84Å; F785-V819 HydrophobicContact CE1-CG2 3.66Å; V819-L822 HydrophobicContact CG1-CD2 4.3Å; V819-I893 HydrophobicContact CG1-CG2 3.93Å; V819-I893 HydrophobicContact CG2-CG2 4.25Å; V819-Q896 HydrophobicContact CB-CB 4.42Å; V819-Q896 HydrophobicContact CG2-CB 3.64Å; V819-F897 HydrophobicContact CB-CB 4.05Å; V819-F897 HydrophobicContact CB-CD2 4.33Å; V819-F897 HydrophobicContact CG1-CB 3.93Å; V819-F897 HydrophobicContact CG1-CD2 3.85Å; V819-F897 HydrophobicContact CG1-CG 4.34Å; V819-S900 PolarHBondContact O-OG 2.87Å
820	V	69.8	Low	68.3	Low	77 Å²	77	38.3 Å²	38.3	47%	0.467	20%	0.195	S	C	.	.			trans	-87.6	-32.8	-176.3	-175.2	0	0	0	0	111.8	C784 S786	C784-V820 PolarHBondContact O-N 3.48Å; S786-V820 VanDerWaalsContact CB-CG2 3.5Å
821	T	76.9	Confident	70.1	Confident	14 Å²	14	38.1 Å²	38.1	9%	0.086	20%	0.195	C	C	.	.			trans	-154.7	149.9	-177.8	-178.7	0	0	0	0	112.2	V725 K823 P824 Q921	V725-T821 HydrophobicContact CG1-CG2 3.85Å; T821-K823 WeakPolarHBondContact OG1-CG 3.17Å; T821-K823 PolarHBondContact OG1-N 2.93Å; T821-K823 VanDerWaalsContact OG1-N 3.15Å; T821-P824 HydrophobicContact CG2-CG 4.35Å; T821-Q921 PolarHBondContact OG1-OE1 2.93Å
822	L	82.9	Confident	71.9	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	-95.7	-4.2	172.8	-57.9	173.9	0	0	0	113	V819 L825 I826 I893 L894 F897 Q921 R922 L925	V819-L822 HydrophobicContact CG1-CD2 4.3Å; L822-L825 PolarHBondContact O-N 3.27Å; L822-L825 VanDerWaalsContact O-N 3.15Å; L822-I826 HydrophobicContact CB-CD1 4.12Å; L822-I826 HydrophobicContact CB-CG1 4.48Å; L822-I826 VanDerWaalsContact O-CG1 3.26Å; L822-I826 WeakPolarHBondContact O-CG1 3.5Å; L822-I826 PolarHBondContact O-N 3.05Å; L822-I893 HydrophobicContact CD2-CG2 3.51Å; L822-L894 HydrophobicContact CD1-CD1 4.17Å; L822-F897 HydrophobicContact CD1-CD1 3.54Å; L822-F897 HydrophobicContact CD1-CE1 3.72Å; L822-F897 HydrophobicContact CD1-CG 4.03Å; L822-F897 HydrophobicContact CD1-CZ 4.35Å; L822-F897 HydrophobicContact CD2-CB 3.88Å; L822-F897 HydrophobicContact CD2-CD1 4.26Å; L822-F897 HydrophobicContact CD2-CD2 4.27Å; L822-F897 HydrophobicContact CD2-CG 3.88Å; L822-F897 HydrophobicContact CG-CB 4.34Å; L822-F897 HydrophobicContact CG-CD1 3.82Å; L822-F897 HydrophobicContact CG-CD2 4.03Å; L822-F897 HydrophobicContact CG-CE1 4.03Å; L822-F897 HydrophobicContact CG-CE2 4.25Å; L822-F897 HydrophobicContact CG-CG 3.79Å; L822-F897 HydrophobicContact CG-CZ 4.23Å; L822-Q921 HydrophobicContact CB-CB 4.25Å; L822-Q921 HydrophobicContact CD1-CB 4.3Å; L822-R922 HydrophobicContact CD1-CG 4.24Å; L822-L925 HydrophobicContact CD1-CD2 4.13Å
823	K	81.8	Confident	73.7	Confident	57 Å²	57	33.5 Å²	33.5	25%	0.248	16%	0.163	C	C	.	.	H	α-helix	trans	-57.2	-42.2	-174.6	-69.6	-177.3	179.7	-172.6	0	114	V729 T821 I826 S827 H916 Q921	V729-K823 HydrophobicContact CG2-CB 3.76Å; T821-K823 WeakPolarHBondContact OG1-CG 3.17Å; T821-K823 PolarHBondContact OG1-N 2.93Å; T821-K823 VanDerWaalsContact OG1-N 3.15Å; K823-I826 PolarHBondContact O-N 2.95Å; K823-S827 PolarHBondContact O-N 2.94Å; K823-S827 PolarHBondContact O-OG 2.78Å; K823-H916 PolarHBondContact NZ-CE1 3.43Å; K823-H916 PolarHBondContact NZ-ND1 3.13Å; K823-H916 VanDerWaalsContact NZ-ND1 3.16Å; K823-Q921 HydrophobicContact CG-CG 4.42Å
824	P	81.9	Confident	75.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-46.3	175.5	-21.6	33.7	0	0	0	111.3	V725 V729 L732 T780 A783 T821 I826 S827 F828	V725-P824 HydrophobicContact CG1-CG 4.32Å; V729-P824 HydrophobicContact CG2-CG 4.17Å; L732-P824 HydrophobicContact CD1-CB 4.47Å; T780-P824 HydrophobicContact CG2-CB 4.01Å; A783-P824 HydrophobicContact CB-CB 3.93Å; A783-P824 HydrophobicContact CB-CG 3.64Å; T821-P824 HydrophobicContact CG2-CG 4.35Å; P824-I826 PolarHBondContact O-N 3.09Å; P824-S827 PolarHBondContact O-N 3.21Å; P824-S827 VanDerWaalsContact O-N 3.11Å; P824-F828 WeakPolarHBondContact O-CB 3.22Å; P824-F828 PolarHBondContact O-N 2.84Å
825	L	84.6	Confident	76.1	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.5	-43.2	178.5	-178.7	64.2	0	0	0	112.3	T780 L822 S827 F828 L829 W889 V890 I893 L925	T780-L825 HydrophobicContact CG2-CB 4.36Å; L822-L825 PolarHBondContact O-N 3.27Å; L822-L825 VanDerWaalsContact O-N 3.15Å; L825-S827 VanDerWaalsContact C-N 3.31Å; L825-S827 PolarHBondContact O-N 3.09Å; L825-F828 PolarHBondContact O-N 3.22Å; L825-L829 HydrophobicContact CG-CD1 4.4Å; L825-L829 WeakPolarHBondContact O-CG 3.35Å; L825-L829 PolarHBondContact O-N 2.66Å; L825-W889 HydrophobicContact CD1-CE3 4.09Å; L825-W889 HydrophobicContact CD1-CH2 3.86Å; L825-W889 HydrophobicContact CD1-CZ2 4.34Å; L825-W889 HydrophobicContact CD1-CZ3 3.73Å; L825-V890 HydrophobicContact CD1-CG2 4.29Å; L825-V890 HydrophobicContact CD2-CG2 4.39Å; L825-I893 HydrophobicContact CD1-CD1 4.31Å; L825-I893 HydrophobicContact CD2-CB 4.12Å; L825-I893 HydrophobicContact CD2-CD1 4.12Å; L825-I893 HydrophobicContact CD2-CG2 3.89Å; L825-L925 HydrophobicContact CD2-CD1 3.89Å; L825-L925 HydrophobicContact CG-CD1 4.15Å
826	I	84.8	Confident	77	Confident	11 Å²	11	26.5 Å²	26.5	6%	0.056	13%	0.134	C	C	.	.	H	α-helix	trans	-60.6	-42.8	176.2	-65.8	164.2	0	0	0	110.7	L822 K823 P824 L829 R830 Q921 N924 L925 E928	L822-I826 HydrophobicContact CB-CD1 4.12Å; L822-I826 HydrophobicContact CB-CG1 4.48Å; L822-I826 VanDerWaalsContact O-CG1 3.26Å; L822-I826 WeakPolarHBondContact O-CG1 3.5Å; L822-I826 PolarHBondContact O-N 3.05Å; K823-I826 PolarHBondContact O-N 2.95Å; P824-I826 PolarHBondContact O-N 3.09Å; I826-L829 PolarHBondContact O-N 3.38Å; I826-R830 PolarHBondContact O-N 3.11Å; I826-Q921 HydrophobicContact CD1-CB 4.43Å; I826-Q921 WeakPolarHBondContact CD1-O 3.23Å; I826-N924 HydrophobicContact CD1-CB 3.97Å; I826-N924 HydrophobicContact CG2-CB 4.36Å; I826-L925 HydrophobicContact CD1-CB 4.49Å; I826-L925 HydrophobicContact CG1-CB 4.16Å; I826-L925 HydrophobicContact CG1-CD1 4.23Å; I826-E928 HydrophobicContact CG2-CB 4.47Å; I826-E928 HydrophobicContact CG2-CG 3.69Å
827	S	81	Confident	78	Confident	4 Å²	4	24 Å²	24	3%	0.028	12%	0.122	C	C	.	.	H	α-helix	trans	-69.6	-37.5	179.9	-51	0	0	0	0	111.5	K823 P824 L825 R830 L831	K823-S827 PolarHBondContact O-N 2.94Å; K823-S827 PolarHBondContact O-OG 2.78Å; P824-S827 PolarHBondContact O-N 3.21Å; P824-S827 VanDerWaalsContact O-N 3.11Å; L825-S827 VanDerWaalsContact C-N 3.31Å; L825-S827 PolarHBondContact O-N 3.09Å; S827-R830 WeakPolarHBondContact O-CB 3.49Å; S827-R830 PolarHBondContact O-N 3.17Å; S827-L831 PolarHBondContact O-N 3Å
828	F	86.1	Confident	78.1	Confident	1 Å²	1	25.7 Å²	25.7	0%	0.004	13%	0.131	C	C	.	.	H	α-helix	trans	-64	-45.3	172.4	176.1	-96.6	0	0	0	112.3	L732 L773 C776 I777 T780 P824 L825 R830 L831 W832 L886 W889	L732-F828 HydrophobicContact CD1-CB 4.45Å; L773-F828 HydrophobicContact CD1-CE2 3.98Å; L773-F828 HydrophobicContact CD1-CZ 4.44Å; C776-F828 HydrophobicContact CB-CD2 4.41Å; C776-F828 HydrophobicContact CB-CE2 4.48Å; I777-F828 HydrophobicContact CD1-CZ 4.17Å; I777-F828 HydrophobicContact CG1-CE1 4.5Å; I777-F828 HydrophobicContact CG1-CE2 3.49Å; I777-F828 VanDerWaalsContact CG1-CE2 3.49Å; I777-F828 HydrophobicContact CG1-CZ 3.46Å; I777-F828 VanDerWaalsContact CG1-CZ 3.46Å; T780-F828 HydrophobicContact CG2-CB 3.76Å; T780-F828 HydrophobicContact CG2-CG 4.29Å; P824-F828 WeakPolarHBondContact O-CB 3.22Å; P824-F828 PolarHBondContact O-N 2.84Å; L825-F828 PolarHBondContact O-N 3.22Å; F828-R830 PolarHBondContact O-N 3.02Å; F828-L831 WeakPolarHBondContact O-CB 3.4Å; F828-L831 PolarHBondContact O-N 3.43Å; F828-L831 VanDerWaalsContact O-N 3.15Å; F828-W832 HydrophobicContact CE1-CD2 4.43Å; F828-W832 AromaticContact CE1-CE3 3.83Å; F828-W832 HydrophobicContact CE1-CE3 3.83Å; F828-W832 HydrophobicContact CE1-CZ3 4.44Å; F828-W832 HydrophobicContact CE2-CE3 4.17Å; F828-W832 HydrophobicContact CZ-CD2 4.32Å; F828-W832 AromaticContact CZ-CE3 3.34Å; F828-W832 HydrophobicContact CZ-CE3 3.34Å; F828-W832 AromaticContact CZ-CZ3 3.75Å; F828-W832 HydrophobicContact CZ-CZ3 3.75Å; F828-W832 WeakPolarHBondContact O-CB 3.37Å; F828-W832 PolarHBondContact O-N 2.05Å; F828-L886 HydrophobicContact CE1-CD1 4.15Å; F828-W889 HydrophobicContact CD1-CH2 4.29Å; F828-W889 AromaticContact CD1-CZ3 3.79Å; F828-W889 HydrophobicContact CD1-CZ3 3.79Å; F828-W889 HydrophobicContact CE1-CH2 4.48Å; F828-W889 AromaticContact CE1-CZ3 3.71Å; F828-W889 HydrophobicContact CE1-CZ3 3.71Å; F828-W889 HydrophobicContact CZ-CZ3 4.44Å
829	L	84.9	Confident	78.3	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62	-34.2	175.9	-72.5	172.9	0	0	0	112	L825 I826 W832 R833 L886 V890 L925 E928 F929 M932	L825-L829 HydrophobicContact CG-CD1 4.4Å; L825-L829 WeakPolarHBondContact O-CG 3.35Å; L825-L829 PolarHBondContact O-N 2.66Å; I826-L829 PolarHBondContact O-N 3.38Å; L829-W832 PolarHBondContact O-N 3.49Å; L829-R833 WeakPolarHBondContact O-CB 3.4Å; L829-R833 PolarHBondContact O-N 3.21Å; L829-L886 HydrophobicContact CD2-CD1 4.13Å; L829-L886 HydrophobicContact CD2-CD2 4.28Å; L829-V890 HydrophobicContact CD1-CG2 4.41Å; L829-V890 HydrophobicContact CD2-CG2 4.34Å; L829-L925 HydrophobicContact CD1-CD1 3.53Å; L829-E928 HydrophobicContact CB-CB 4.3Å; L829-F929 HydrophobicContact CD1-CB 4.13Å; L829-F929 HydrophobicContact CD1-CD2 4.24Å; L829-F929 HydrophobicContact CD2-CD2 4.15Å; L829-M932 HydrophobicContact CD2-CE 4.42Å; L829-M932 HydrophobicContact CD2-SD 3.89Å
830	R	83.5	Confident	78.1	Confident	73 Å²	73	29.2 Å²	29.2	28%	0.275	14%	0.14	S	C	.	.	H	α-helix	trans	-65	-46.3	172.6	-174.3	179.8	-65	144.6	-2.9	111.8	N733 I826 S827 F828 R833 Q834 E928	N733-R830 PolarHBondContact OD1-NH1 2.88Å; I826-R830 PolarHBondContact O-N 3.11Å; S827-R830 WeakPolarHBondContact O-CB 3.49Å; S827-R830 PolarHBondContact O-N 3.17Å; F828-R830 PolarHBondContact O-N 3.02Å; R830-R833 PolarHBondContact O-N 3.08Å; R830-Q834 WeakPolarHBondContact O-CG 3.48Å; R830-Q834 PolarHBondContact O-N 3.21Å; R830-E928 IonicContact CZ-OE1 2.74Å; R830-E928 VanDerWaalsContact CZ-OE1 3.31Å; R830-E928 IonicContact NE-OE1 3.15Å; R830-E928 PolarHBondContact NE-OE1 3.12Å; R830-E928 IonicContact NE-OE2 2.68Å; R830-E928 IonicContact NH2-OE1 3.37Å; R830-E928 PolarHBondContact NH2-OE1 3.02Å
831	L	80.7	Confident	77.8	Confident	10 Å²	10	25.8 Å²	25.8	5%	0.052	12%	0.118	C	C	.	.	H	α-helix	trans	-56.6	-50.8	172.3	168.1	63.3	0	0	0	111	L732 A735 A739 C776 S827 F828 R833 Q834 M835	L732-L831 HydrophobicContact CD2-CD2 4.26Å; A735-L831 HydrophobicContact CB-CD1 4Å; A735-L831 HydrophobicContact CB-CD2 4.18Å; A739-L831 HydrophobicContact CB-CD1 4.11Å; C776-L831 HydrophobicContact CB-CD2 4.27Å; S827-L831 PolarHBondContact O-N 3Å; F828-L831 WeakPolarHBondContact O-CB 3.4Å; F828-L831 PolarHBondContact O-N 3.43Å; F828-L831 VanDerWaalsContact O-N 3.15Å; L831-R833 PolarHBondContact O-N 3.25Å; L831-Q834 PolarHBondContact O-N 2.92Å; L831-Q834 VanDerWaalsContact O-N 3.1Å; L831-M835 HydrophobicContact CD1-CG 4.17Å; L831-M835 HydrophobicContact CD1-SD 4.18Å; L831-M835 HydrophobicContact CG-SD 4.32Å; L831-M835 WeakPolarHBondContact O-CG 3.39Å; L831-M835 PolarHBondContact O-N 2.9Å
832	W	80.8	Confident	77.3	Confident	7 Å²	7	27 Å²	27	3%	0.027	13%	0.126	C	C	.	.	H	α-helix	trans	-60	-44	-179.6	-167.1	-84.4	0	0	0	112	L773 F828 L829 Q834 M835 I836 W841 W850 M932	L773-W832 HydrophobicContact CD1-CE3 3.99Å; L773-W832 HydrophobicContact CD1-CZ3 4.1Å; L773-W832 HydrophobicContact CD2-CE3 4.21Å; L773-W832 HydrophobicContact CD2-CH2 4.35Å; L773-W832 HydrophobicContact CD2-CZ3 3.68Å; L773-W832 HydrophobicContact CG-CZ3 4.12Å; F828-W832 HydrophobicContact CE1-CD2 4.43Å; F828-W832 AromaticContact CE1-CE3 3.83Å; F828-W832 HydrophobicContact CE1-CE3 3.83Å; F828-W832 HydrophobicContact CE1-CZ3 4.44Å; F828-W832 HydrophobicContact CE2-CE3 4.17Å; F828-W832 HydrophobicContact CZ-CD2 4.32Å; F828-W832 AromaticContact CZ-CE3 3.34Å; F828-W832 HydrophobicContact CZ-CE3 3.34Å; F828-W832 AromaticContact CZ-CZ3 3.75Å; F828-W832 HydrophobicContact CZ-CZ3 3.75Å; F828-W832 WeakPolarHBondContact O-CB 3.37Å; F828-W832 PolarHBondContact O-N 2.05Å; L829-W832 PolarHBondContact O-N 3.49Å; W832-Q834 VanDerWaalsContact C-N 3.34Å; W832-Q834 PolarHBondContact O-N 3.28Å; W832-M835 PolarHBondContact O-N 2.91Å; W832-I836 HydrophobicContact CG-CD1 4.4Å; W832-I836 WeakPolarHBondContact O-CG1 3.37Å; W832-I836 PolarHBondContact O-N 3.07Å; W832-W841 AromaticContact CE2-CD1 3.9Å; W832-W841 AromaticContact CH2-NE1 3.54Å; W832-W841 AromaticContact CZ2-CD1 3.51Å; W832-W841 AromaticContact CZ2-NE1 3.27Å; W832-W841 VanDerWaalsContact CZ2-NE1 3.27Å; W832-W850 HydrophobicContact CH2-CH2 4.25Å; W832-W850 AromaticContact CH2-CZ3 3.93Å; W832-W850 HydrophobicContact CH2-CZ3 3.93Å; W832-M932 HydrophobicContact CG-SD 4.23Å
833	R	81.8	Confident	76.4	Confident	43 Å²	43	27 Å²	27	16%	0.162	13%	0.127	C	C	.	.	H	α-helix	trans	-56.5	-48.2	173.1	-178.9	177.6	71.4	-146.6	-9.7	111.1	L829 R830 L831 M835 I836 V837 E928 G931 M932 V935	L829-R833 WeakPolarHBondContact O-CB 3.4Å; L829-R833 PolarHBondContact O-N 3.21Å; R830-R833 PolarHBondContact O-N 3.08Å; L831-R833 PolarHBondContact O-N 3.25Å; R833-M835 VanDerWaalsContact C-N 3.34Å; R833-M835 PolarHBondContact O-N 3.37Å; R833-I836 PolarHBondContact O-N 2.95Å; R833-V837 HydrophobicContact CG-CG2 4.38Å; R833-V837 WeakPolarHBondContact O-CG2 3.47Å; R833-V837 PolarHBondContact O-N 3.43Å; R833-E928 IonicContact CZ-OE2 3.51Å; R833-E928 IonicContact NH1-OE2 2.67Å; R833-E928 PolarHBondContact NH1-OE2 3.33Å; R833-E928 IonicContact NH2-OE1 2.71Å; R833-E928 IonicContact NH2-OE2 3.49Å; R833-E928 PolarHBondContact NH2-OE2 3.31Å; R833-G931 WeakPolarHBondContact CD-O 3.42Å; R833-M932 HydrophobicContact CB-CB 4.13Å; R833-M932 HydrophobicContact CB-CG 4.34Å; R833-M932 HydrophobicContact CG-CB 4.47Å; R833-V935 HydrophobicContact CG-CB 4.31Å; R833-V935 HydrophobicContact CG-CG2 3.83Å
834	Q	76.5	Confident	75.2	Confident	50 Å²	50	24.3 Å²	24.3	23%	0.234	12%	0.115	C	C	.	.	H	α-helix	trans	-63.7	-40.1	-179.9	-66.4	-60.2	-11.3	0	0	111.9	A739 R830 L831 W832 I836 V837 Q838	A739-Q834 HydrophobicContact CB-CB 3.9Å; R830-Q834 WeakPolarHBondContact O-CG 3.48Å; R830-Q834 PolarHBondContact O-N 3.21Å; L831-Q834 PolarHBondContact O-N 2.92Å; L831-Q834 VanDerWaalsContact O-N 3.1Å; W832-Q834 VanDerWaalsContact C-N 3.34Å; W832-Q834 PolarHBondContact O-N 3.28Å; Q834-I836 VanDerWaalsContact C-N 3.28Å; Q834-I836 PolarHBondContact O-N 3.24Å; Q834-V837 PolarHBondContact O-N 2.99Å; Q834-Q838 WeakPolarHBondContact O-CB 3.37Å; Q834-Q838 WeakPolarHBondContact O-CG 3.38Å; Q834-Q838 PolarHBondContact O-N 3.01Å
835	M	72.9	Confident	74.4	Confident	11 Å²	11	24.8 Å²	24.8	5%	0.054	12%	0.117	C	C	.	.	H	α-helix	trans	-61.8	-35.2	174.2	-68.5	-174.7	72.7	0	0	112.9	A739 L773 L831 W832 R833 K839 H840 W841	A739-M835 HydrophobicContact CB-CG 3.9Å; L773-M835 HydrophobicContact CD1-SD 3.78Å; L773-M835 HydrophobicContact CD2-CE 4.14Å; L773-M835 HydrophobicContact CD2-SD 4.32Å; L831-M835 HydrophobicContact CD1-CG 4.17Å; L831-M835 HydrophobicContact CD1-SD 4.18Å; L831-M835 HydrophobicContact CG-SD 4.32Å; L831-M835 WeakPolarHBondContact O-CG 3.39Å; L831-M835 PolarHBondContact O-N 2.9Å; W832-M835 PolarHBondContact O-N 2.91Å; R833-M835 VanDerWaalsContact C-N 3.34Å; R833-M835 PolarHBondContact O-N 3.37Å; M835-K839 PolarHBondContact O-N 3.48Å; M835-H840 HydrophobicContact CE-CB 4.44Å; M835-H840 PolarHBondContact O-N 3.27Å; M835-H840 VanDerWaalsContact O-N 3.09Å; M835-W841 HydrophobicContact CB-CB 4.27Å; M835-W841 PolarHBondContact O-N 3.39Å
836	I	73.3	Confident	73.1	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-70.7	-45.4	174	-64.2	159.3	0	0	0	110.9	W832 R833 Q834 Q838 K839 M932 V935 L936 R939 I942	W832-I836 HydrophobicContact CG-CD1 4.4Å; W832-I836 WeakPolarHBondContact O-CG1 3.37Å; W832-I836 PolarHBondContact O-N 3.07Å; R833-I836 PolarHBondContact O-N 2.95Å; Q834-I836 VanDerWaalsContact C-N 3.28Å; Q834-I836 PolarHBondContact O-N 3.24Å; I836-Q838 PolarHBondContact O-N 3.44Å; I836-K839 PolarHBondContact O-N 3.46Å; I836-K839 VanDerWaalsContact O-N 3.11Å; I836-M932 HydrophobicContact CD1-CG 3.84Å; I836-V935 HydrophobicContact CB-CG1 4.27Å; I836-V935 HydrophobicContact CG2-CG1 3.75Å; I836-L936 HydrophobicContact CD1-CD1 4.11Å; I836-L936 HydrophobicContact CD1-CD2 3.68Å; I836-L936 HydrophobicContact CD1-CG 3.8Å; I836-L936 HydrophobicContact CG1-CD2 4.1Å; I836-L936 HydrophobicContact CG2-CD2 3.59Å; I836-L936 HydrophobicContact CG2-CG 4.08Å; I836-R939 VanDerWaalsContact O-CD 3.25Å; I836-R939 WeakPolarHBondContact O-CD 3.35Å; I836-R939 PolarHBondContact O-NH1 3.21Å; I836-I942 HydrophobicContact CG2-CD1 4.42Å
837	V	74.6	Confident	71.4	Confident	60 Å²	60	35.1 Å²	35.1	36%	0.364	16%	0.164	S	C	.	.	H	α-helix	trans	-53.1	-44.2	178.1	171.8	0	0	0	0	109.9	R833 Q834 K839 V935	R833-V837 HydrophobicContact CG-CG2 4.38Å; R833-V837 WeakPolarHBondContact O-CG2 3.47Å; R833-V837 PolarHBondContact O-N 3.43Å; Q834-V837 PolarHBondContact O-N 2.99Å; V837-K839 PolarHBondContact O-N 3.48Å; V837-V935 HydrophobicContact CB-CG1 4.22Å; V837-V935 HydrophobicContact CG2-CB 4.18Å; V837-V935 HydrophobicContact CG2-CG1 3.41Å; V837-V935 VanDerWaalsContact CG2-CG1 3.41Å; V837-V935 HydrophobicContact CG2-CG2 3.68Å
838	Q	68.2	Low	69.9	Low	64 Å²	64	38.1 Å²	38.1	30%	0.299	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	6.8	-174.2	-58.6	-67.6	-16.8	0	0	114.1	Q834 I836 H840	Q834-Q838 WeakPolarHBondContact O-CB 3.37Å; Q834-Q838 WeakPolarHBondContact O-CG 3.38Å; Q834-Q838 PolarHBondContact O-N 3.01Å; I836-Q838 PolarHBondContact O-N 3.44Å; Q838-H840 WeakPolarHBondContact CB-NE2 3.23Å; Q838-H840 PolarHBondContact O-CE1 2.77Å; Q838-H840 PolarHBondContact O-N 3.47Å; Q838-H840 VanDerWaalsContact O-N 3.11Å; Q838-H840 PolarHBondContact O-ND1 2.99Å
839	K	69.1	Low	68.3	Low	118 Å²	118	43.5 Å²	43.5	51%	0.513	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	9.6	179.6	-49.7	-171.6	178.2	171.2	0	116.5	M835 I836 V837 W841	M835-K839 PolarHBondContact O-N 3.48Å; I836-K839 PolarHBondContact O-N 3.46Å; I836-K839 VanDerWaalsContact O-N 3.11Å; V837-K839 PolarHBondContact O-N 3.48Å; K839-W841 PolarHBondContact O-N 2.88Å
840	H	63.4	Low	66.9	Low	14 Å²	14	44.6 Å²	44.6	7%	0.065	21%	0.209	C	C	.	.	S	Bend	trans	-67.8	-23.8	174.7	-54.4	-26.9	0	0	0	112.9	A739 I742 L766 M835 Q838	A739-H840 PolarHBondContact O-CD2 3.33Å; A739-H840 PolarHBondContact O-NE2 2.85Å; I742-H840 PolarHBondContact O-CE1 3.43Å; I742-H840 PolarHBondContact O-ND1 3.32Å; I742-H840 PolarHBondContact O-NE2 3.23Å; I742-H840 VanDerWaalsContact O-NE2 3.07Å; L766-H840 WeakPolarHBondContact CD1-O 3.39Å; M835-H840 HydrophobicContact CE-CB 4.44Å; M835-H840 PolarHBondContact O-N 3.27Å; M835-H840 VanDerWaalsContact O-N 3.09Å; Q838-H840 WeakPolarHBondContact CB-NE2 3.23Å; Q838-H840 PolarHBondContact O-CE1 2.77Å; Q838-H840 PolarHBondContact O-N 3.47Å; Q838-H840 VanDerWaalsContact O-N 3.11Å; Q838-H840 PolarHBondContact O-ND1 2.99Å
841	W	65	Low	65.6	Low	4 Å²	4	43 Å²	43	2%	0.015	20%	0.204	C	C	.	.			trans	-130.7	130.4	179.5	-160.3	-108.6	0	0	0	111.3	L766 F770 L773 W832 M835 K839 G843 W850 R939	L766-W841 HydrophobicContact CD2-CE3 3.75Å; L766-W841 HydrophobicContact CD2-CH2 3.73Å; L766-W841 HydrophobicContact CD2-CZ3 3.23Å; L766-W841 HydrophobicContact CG-CE3 3.98Å; L766-W841 HydrophobicContact CG-CZ3 3.75Å; F770-W841 AromaticContact CD2-CH2 3.48Å; F770-W841 HydrophobicContact CD2-CH2 3.48Å; F770-W841 VanDerWaalsContact CD2-CH2 3.48Å; F770-W841 AromaticContact CD2-CZ3 3.69Å; F770-W841 HydrophobicContact CD2-CZ3 3.69Å; F770-W841 AromaticContact CE2-CH2 3.69Å; F770-W841 HydrophobicContact CE2-CH2 3.69Å; F770-W841 HydrophobicContact CE2-CZ2 4.47Å; F770-W841 HydrophobicContact CE2-CZ3 4.37Å; L773-W841 HydrophobicContact CD2-CD2 4.41Å; L773-W841 HydrophobicContact CD2-CE3 4.35Å; W832-W841 AromaticContact CE2-CD1 3.9Å; W832-W841 AromaticContact CH2-NE1 3.54Å; W832-W841 AromaticContact CZ2-CD1 3.51Å; W832-W841 AromaticContact CZ2-NE1 3.27Å; W832-W841 VanDerWaalsContact CZ2-NE1 3.27Å; M835-W841 HydrophobicContact CB-CB 4.27Å; M835-W841 PolarHBondContact O-N 3.39Å; K839-W841 PolarHBondContact O-N 2.88Å; W841-G843 PolarHBondContact O-N 3.34Å; W841-W850 HydrophobicContact CH2-CB 4.37Å; W841-W850 AromaticContact CH2-CE3 3.93Å; W841-W850 HydrophobicContact CH2-CE3 3.93Å; W841-W850 HydrophobicContact CZ2-CB 3.91Å; W841-W850 HydrophobicContact CZ2-CD2 4.04Å; W841-W850 AromaticContact CZ2-CE3 3.33Å; W841-W850 HydrophobicContact CZ2-CE3 3.33Å; W841-W850 HydrophobicContact CZ2-CG 4.3Å; W841-W850 HydrophobicContact CZ2-CZ3 4.12Å; W841-R939 PolarHBondContact O-NH1 3.12Å
842	P	65.3	Low	63.9	Low	40 Å²	40	45.8 Å²	45.8	26%	0.26	22%	0.218	S	C	.	.			trans	-78.8	-1.6	-178.9	31.1	-35.1	0	0	0	113.5	G844 I942	P842-G844 VanDerWaalsContact C-N 3.35Å; P842-I942 WeakPolarHBondContact O-CD1 3.28Å; P842-I942 WeakPolarHBondContact O-CG1 3.24Å
843	G	64.2	Low	62.1	Low	1 Å²	1	48 Å²	48	1%	0.01	23%	0.231	C	C	.	.			trans	84.3	4.5	-179.9	0	0	0	0	0	114.9	W841 H845	W841-G843 PolarHBondContact O-N 3.34Å; G843-H845 PolarHBondContact O-CE1 3.42Å; G843-H845 PolarHBondContact O-ND1 3.47Å
844	G	57.4	Low	60.1	Low	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.252	C	S	.	.			trans	55.2	58.7	167.2	0	0	0	0	0	114.6	P842 C881 G882 L883	P842-G844 VanDerWaalsContact C-N 3.35Å; G844-C881 CarbonylContact O-C 3.5Å; G844-C881 PolarHBondContact O-SG 3.49Å; G844-G882 WeakPolarHBondContact O-CA 3.47Å; G844-G882 PolarHBondContact O-N 3.43Å; G844-L883 PolarHBondContact O-N 3.31Å; G844-L883 VanDerWaalsContact O-N 3.11Å
845	H	65.1	Low	58.3	Low	9 Å²	9	52.6 Å²	52.6	4%	0.042	26%	0.26	C	S	.	.			trans	-93.7	166.9	173.9	-59	-27.7	0	0	0	112.5	G843 Y847 D848 L883 I942 W944	G843-H845 PolarHBondContact O-CE1 3.42Å; G843-H845 PolarHBondContact O-ND1 3.47Å; H845-Y847 PolarHBondContact O-N 2.91Å; H845-D848 PolarHBondContact O-N 3.48Å; H845-D848 VanDerWaalsContact O-N 3.09Å; H845-L883 VanDerWaalsContact CE1-CB 3.45Å; H845-L883 WeakPolarHBondContact CE1-CB 3.33Å; H845-L883 WeakPolarHBondContact CE1-CD2 3.43Å; H845-L883 WeakPolarHBondContact ND1-CB 3.26Å; H845-I942 WeakPolarHBondContact CD2-CG2 3.43Å; H845-W944 AromaticContact CD2-CD1 3.19Å; H845-W944 AromaticContact CD2-NE1 3.26Å; H845-W944 PolarHBondContact CD2-NE1 3.04Å; H845-W944 VanDerWaalsContact CD2-NE1 3.26Å; H845-W944 AromaticContact CE1-CE2 3.98Å; H845-W944 AromaticContact CE1-NE1 3.3Å; H845-W944 PolarHBondContact CE1-NE1 3.42Å; H845-W944 VanDerWaalsContact CE1-NE1 3.3Å; H845-W944 AromaticContact CG-CD1 3.46Å; H845-W944 VanDerWaalsContact CG-CD1 3.46Å; H845-W944 AromaticContact CG-NE1 3.44Å; H845-W944 AromaticContact ND1-CD1 3.95Å; H845-W944 AromaticContact ND1-NE1 3.42Å; H845-W944 PolarHBondContact ND1-NE1 3.09Å; H845-W944 AromaticContact NE2-CD1 3.59Å; H845-W944 AromaticContact NE2-CE2 3.7Å; H845-W944 AromaticContact NE2-NE1 3.15Å; H845-W944 PolarHBondContact NE2-NE1 3.35Å; H845-W944 VanDerWaalsContact NE2-NE1 3.15Å
846	C	55.7	Low	56.7	Low	54 Å²	54	60.2 Å²	60.2	37%	0.365	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	13.3	-160	-154.8	0	0	0	0	119.6	C881 C948	C846-C881 HydrophobicContact CB-CB 4.35Å; C846-C948 HydrophobicContact CB-CB 3.98Å
847	Y	50.3	Low	55.1	Low	174 Å²	174	69 Å²	69	68%	0.682	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	-20.3	170.2	-72	-69	0	0	0	113.4	H845 P945	H845-Y847 PolarHBondContact O-N 2.91Å; Y847-P945 HydrophobicContact CD2-CG 3.97Å; Y847-P945 HydrophobicContact CE2-CB 3.66Å; Y847-P945 HydrophobicContact CE2-CG 3.54Å
848	D	49.4	Very low	53.2	Low	68 Å²	68	73 Å²	73	36%	0.364	35%	0.346	S	S	.	.			trans	-101.2	111.1	-179.8	-56	-37.4	0	0	0	108	H845 W850	H845-D848 PolarHBondContact O-N 3.48Å; H845-D848 VanDerWaalsContact O-N 3.09Å; D848-W850 PolarHBondContact O-N 3.31Å
849	Q	51.7	Low	51.4	Low	113 Å²	113	76.2 Å²	76.2	53%	0.528	37%	0.366	S	S	.	.			trans	-58.5	82.3	155.8	-93	170.3	-37.7	0	0	107.5	W851 D852	Q849-W851 PolarHBondContact O-N 3.43Å; Q849-D852 HydrophobicContact CB-CB 3.61Å; Q849-D852 HydrophobicContact CG-CB 3.78Å; Q849-D852 PolarHBondContact NE2-OD2 3.02Å; Q849-D852 PolarHBondContact O-N 3.25Å
850	W	55.1	Low	49.7	Very low	23 Å²	23	75 Å²	75	9%	0.087	37%	0.372	C	S	.	.	S	Bend	trans	-73.3	-9.8	-170.5	69.2	-79	0	0	0	113.6	F770 W832 W841 D848 F875 I879 G882	F770-W850 AromaticContact CE2-CE3 3.92Å; F770-W850 HydrophobicContact CE2-CE3 3.92Å; F770-W850 HydrophobicContact CE2-CZ3 4.2Å; F770-W850 WeakPolarHBondContact CE2-O 3.19Å; W832-W850 HydrophobicContact CH2-CH2 4.25Å; W832-W850 AromaticContact CH2-CZ3 3.93Å; W832-W850 HydrophobicContact CH2-CZ3 3.93Å; W841-W850 HydrophobicContact CH2-CB 4.37Å; W841-W850 AromaticContact CH2-CE3 3.93Å; W841-W850 HydrophobicContact CH2-CE3 3.93Å; W841-W850 HydrophobicContact CZ2-CB 3.91Å; W841-W850 HydrophobicContact CZ2-CD2 4.04Å; W841-W850 AromaticContact CZ2-CE3 3.33Å; W841-W850 HydrophobicContact CZ2-CE3 3.33Å; W841-W850 HydrophobicContact CZ2-CG 4.3Å; W841-W850 HydrophobicContact CZ2-CZ3 4.12Å; D848-W850 PolarHBondContact O-N 3.31Å; W850-F875 HydrophobicContact CH2-CE2 4.42Å; W850-I879 HydrophobicContact CZ2-CG2 3.45Å; W850-I879 VanDerWaalsContact CZ2-CG2 3.45Å; W850-I879 PolarHBondContact NE1-O 3Å; W850-G882 VanDerWaalsContact CZ2-CA 3.43Å
851	W	57.6	Low	48.3	Very low	41 Å²	41	80.5 Å²	80.5	16%	0.155	40%	0.4	C	S	.	.	S	Bend	trans	-124.1	-5.5	173.8	76.2	82	0	0	0	114.1	F770 Q849 L853 I879	F770-W851 HydrophobicContact CZ-CB 3.93Å; Q849-W851 PolarHBondContact O-N 3.43Å; W851-L853 VanDerWaalsContact C-N 3.33Å; W851-L853 PolarHBondContact O-N 3.47Å; W851-I879 HydrophobicContact CD2-CB 3.7Å; W851-I879 HydrophobicContact CD2-CD1 3.89Å; W851-I879 HydrophobicContact CD2-CG1 4.28Å; W851-I879 HydrophobicContact CD2-CG2 3.98Å; W851-I879 HydrophobicContact CE3-CB 3.45Å; W851-I879 VanDerWaalsContact CE3-CB 3.45Å; W851-I879 HydrophobicContact CE3-CD1 4.35Å; W851-I879 HydrophobicContact CE3-CG1 4.46Å; W851-I879 HydrophobicContact CE3-CG2 3.4Å; W851-I879 VanDerWaalsContact CE3-CG2 3.4Å; W851-I879 HydrophobicContact CG-CD1 4.36Å; W851-I879 HydrophobicContact CH2-CB 3.27Å; W851-I879 HydrophobicContact CH2-CG1 4.4Å; W851-I879 HydrophobicContact CH2-CG2 4.06Å; W851-I879 WeakPolarHBondContact CH2-O 3.36Å; W851-I879 HydrophobicContact CZ2-CB 3.38Å; W851-I879 HydrophobicContact CZ2-CD1 4.43Å; W851-I879 HydrophobicContact CZ2-CG1 4.05Å; W851-I879 HydrophobicContact CZ2-CG2 4.44Å; W851-I879 HydrophobicContact CZ3-CB 3.3Å; W851-I879 HydrophobicContact CZ3-CG2 3.52Å; W851-I879 WeakPolarHBondContact CZ3-O 3.38Å
852	D	44.7	Very low	46.7	Very low	67 Å²	67	87.5 Å²	87.5	36%	0.358	44%	0.436	S	S	.	.			trans	-78.5	93.2	-177.2	-136.3	-9.9	0	0	0	107.8	Q849 D854	Q849-D852 HydrophobicContact CB-CB 3.61Å; Q849-D852 HydrophobicContact CG-CB 3.78Å; Q849-D852 PolarHBondContact NE2-OD2 3.02Å; Q849-D852 PolarHBondContact O-N 3.25Å; D852-D854 PolarHBondContact O-N 2.88Å
853	L	42.9	Very low	45.3	Very low	55 Å²	55	90.1 Å²	90.1	29%	0.288	46%	0.456	S	S	.	.			trans	-68.5	64.7	171.2	-73.7	154.3	0	0	0	108.7	W851 D855 F858	W851-L853 VanDerWaalsContact C-N 3.33Å; W851-L853 PolarHBondContact O-N 3.47Å; L853-D855 PolarHBondContact O-N 2.89Å; L853-F858 HydrophobicContact CD2-CD2 4.13Å; L853-F858 HydrophobicContact CD2-CE2 4.23Å
854	D	38.9	Very low	44.4	Very low	114 Å²	114	96.1 Å²	96.1	61%	0.61	48%	0.482	S	S	*	.			trans	-70.6	13.9	164	-93.8	-18.5	0	0	0	111.5	D852 Q856	D852-D854 PolarHBondContact O-N 2.88Å; D854-Q856 VanDerWaalsContact C-N 3.29Å; D854-Q856 PolarHBondContact O-N 3.44Å
855	D	39.1	Very low	44.4	Very low	75 Å²	75	100.1 Å²	100.1	40%	0.401	50%	0.503	S	S	.	.			trans	-64.3	95.8	157.3	-86.5	-25.6	0	0	0	108.1	N767 L853 K857 F858	N767-D855 PolarHBondContact ND2-OD2 3.26Å; L853-D855 PolarHBondContact O-N 2.89Å; D855-K857 PolarHBondContact O-N 3.12Å; D855-F858 PolarHBondContact O-N 2.96Å
856	Q	39.2	Very low	44.3	Very low	170 Å²	170	102.6 Å²	102.6	79%	0.794	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.7	-9.3	169.2	-68.6	-179.7	-10.6	0	0	114.6	D854	D854-Q856 VanDerWaalsContact C-N 3.29Å; D854-Q856 PolarHBondContact O-N 3.44Å
857	K	40.3	Very low	44.5	Very low	186 Å²	186	102.7 Å²	102.7	81%	0.809	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-29.7	170.1	-78.1	-177.2	175.7	176.9	0	114.4	D855	D855-K857 PolarHBondContact O-N 3.12Å
858	F	34.7	Very low	45.1	Very low	142 Å²	142	97.3 Å²	97.3	62%	0.623	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-82.1	-22.2	177.3	-88.4	-78.9	0	0	0	113.5	L853 D855 S860	L853-F858 HydrophobicContact CD2-CD2 4.13Å; L853-F858 HydrophobicContact CD2-CE2 4.23Å; D855-F858 PolarHBondContact O-N 2.96Å; F858-S860 VanDerWaalsContact C-N 3.25Å; F858-S860 PolarHBondContact O-N 2.96Å
859	N	29.6	Very low	45.7	Very low	133 Å²	133	95.7 Å²	95.7	71%	0.711	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-73.5	-7.9	-176.6	-82.4	-28.1	0	0	0	115.2
860	S	35.1	Very low	46.3	Very low	91 Å²	91	90.5 Å²	90.5	64%	0.636	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-93.7	-18	-170	64	0	0	0	0	115.9	F858	F858-S860 VanDerWaalsContact C-N 3.25Å; F858-S860 PolarHBondContact O-N 2.96Å
861	I	32.2	Very low	46.8	Very low	130 Å²	130	90 Å²	90	67%	0.667	46%	0.457	S	S	*	.	S	Bend	trans	-148.3	107.9	-176	-56.5	178.9	0	0	0	110.3
862	I	32.8	Very low	47.1	Very low	151 Å²	151	90.5 Å²	90.5	77%	0.774	46%	0.461	S	S	*	.	S	Bend	trans	90.4	126.4	163.6	-55.3	155.1	0	0	0	115.3
863	S	35.6	Very low	48.1	Very low	95 Å²	95	89.5 Å²	89.5	66%	0.664	45%	0.454	S	S	*	.	S	Bend	trans	-20	135.8	175	55.6	0	0	0	0	115.8	D865	S863-D865 PolarHBondContact O-N 3.29Å
864	K	45.1	Very low	49.2	Very low	128 Å²	128	87 Å²	87	56%	0.557	44%	0.441	S	S	*	.	S	Bend	trans	-25.9	104	161.7	-79.7	-169.7	170.5	-157.1	0	109.8	V866 Q869	K864-V866 PolarHBondContact O-N 3.21Å; K864-Q869 HydrophobicContact CB-CG 4.33Å; K864-Q869 PolarHBondContact O-NE2 3.49Å
865	D	58.2	Low	50.5	Low	83 Å²	83	82.7 Å²	82.7	44%	0.444	42%	0.417	S	S	.	.			trans	-52.1	135	-174.3	-171	-11.6	0	0	0	108.1	S863 R867 Q868 Q869	S863-D865 PolarHBondContact O-N 3.29Å; D865-R867 HydrophobicContact CB-CB 4.45Å; D865-R867 PolarHBondContact O-N 3.23Å; D865-R867 WeakPolarHBondContact OD1-CG 3.08Å; D865-R867 PolarHBondContact OD1-N 3Å; D865-Q868 WeakPolarHBondContact O-CB 3.42Å; D865-Q868 PolarHBondContact O-N 3.22Å; D865-Q869 PolarHBondContact O-N 3.43Å
866	V	61.8	Low	51.4	Low	61 Å²	61	80.6 Å²	80.6	37%	0.37	41%	0.413	S	S	.	.	H	α-helix	trans	-51.1	-32.6	177.2	176.4	0	0	0	0	109.8	F665 K864 Q869 Y870	F665-V866 HydrophobicContact CD1-CG1 4.44Å; F665-V866 HydrophobicContact CE1-CG1 4.06Å; K864-V866 PolarHBondContact O-N 3.21Å; V866-Q869 PolarHBondContact O-N 3.07Å; V866-Y870 WeakPolarHBondContact O-CB 3.1Å; V866-Y870 PolarHBondContact O-N 3.37Å
867	R	60.9	Low	51.9	Low	57 Å²	57	79.4 Å²	79.4	22%	0.215	42%	0.418	C	S	.	.	H	α-helix	trans	-56.4	-50.5	172.6	-61.9	-179.7	-178.4	177.8	1.8	112.5	D662 F665 I778 D865 Q869 Y870 I871	D662-R867 IonicContact OD1-CZ 3.45Å; D662-R867 IonicContact OD1-NH2 3.66Å; D662-R867 PolarHBondContact OD1-NH2 3.49Å; F665-R867 HydrophobicContact CE2-CG 3.75Å; F665-R867 HydrophobicContact CZ-CG 3.88Å; I778-R867 HydrophobicContact CD1-CB 3.93Å; I778-R867 HydrophobicContact CD1-CG 4.13Å; D865-R867 HydrophobicContact CB-CB 4.45Å; D865-R867 PolarHBondContact O-N 3.23Å; D865-R867 WeakPolarHBondContact OD1-CG 3.08Å; D865-R867 PolarHBondContact OD1-N 3Å; R867-Q869 VanDerWaalsContact C-N 3.34Å; R867-Q869 PolarHBondContact O-N 3.39Å; R867-Y870 WeakPolarHBondContact O-CB 3.43Å; R867-Y870 PolarHBondContact O-N 2.98Å; R867-I871 WeakPolarHBondContact O-CD1 3.33Å; R867-I871 VanDerWaalsContact O-CG1 3.3Å; R867-I871 WeakPolarHBondContact O-CG1 3.46Å; R867-I871 PolarHBondContact O-N 3.36Å
868	Q	61.8	Low	52.5	Low	61 Å²	61	74.4 Å²	74.4	29%	0.285	41%	0.406	S	S	.	.	H	α-helix	trans	-61.9	-42.4	-179.8	-174.8	174.4	3.3	0	0	111.7	D865 I871 E872	D865-Q868 WeakPolarHBondContact O-CB 3.42Å; D865-Q868 PolarHBondContact O-N 3.22Å; Q868-I871 PolarHBondContact O-N 2.93Å; Q868-E872 WeakPolarHBondContact O-CG 3.27Å; Q868-E872 PolarHBondContact O-N 2.9Å
869	Q	62.9	Low	53.5	Low	34 Å²	34	67.8 Å²	67.8	16%	0.159	38%	0.377	C	S	.	.	H	α-helix	trans	-64.3	-43.2	178.3	-61.3	-177.7	20.2	0	0	111.5	H807 K864 D865 V866 R867 I871 E872 E873	H807-Q869 PolarHBondContact CE1-OE1 3.31Å; K864-Q869 HydrophobicContact CB-CG 4.33Å; K864-Q869 PolarHBondContact O-NE2 3.49Å; D865-Q869 PolarHBondContact O-N 3.43Å; V866-Q869 PolarHBondContact O-N 3.07Å; R867-Q869 VanDerWaalsContact C-N 3.34Å; R867-Q869 PolarHBondContact O-N 3.39Å; Q869-I871 PolarHBondContact O-N 3.09Å; Q869-E872 PolarHBondContact O-N 3.35Å; Q869-E873 WeakPolarHBondContact O-CG 3.46Å; Q869-E873 PolarHBondContact O-N 3.37Å
870	Y	64.8	Low	55.1	Low	4 Å²	4	68.4 Å²	68.4	2%	0.016	37%	0.373	C	S	.	.	H	α-helix	trans	-56.6	-39.2	175.6	-178.7	-83.9	0	0	0	112	I778 S781 E782 I810 V866 R867 E873 L874	I778-Y870 HydrophobicContact CG1-CD1 4.08Å; I778-Y870 HydrophobicContact CG1-CE1 4.39Å; I778-Y870 HydrophobicContact CG2-CD1 4.45Å; I778-Y870 HydrophobicContact CG2-CE1 4.31Å; S781-Y870 VanDerWaalsContact OG-CE1 3.32Å; S781-Y870 WeakPolarHBondContact OG-CE1 3.35Å; S781-Y870 PolarHBondContact OG-OH 2.75Å; E782-Y870 WeakPolarHBondContact OE1-CE2 3.48Å; E782-Y870 VanDerWaalsContact OE1-CZ 3.3Å; E782-Y870 PolarHBondContact OE1-OH 3.22Å; I810-Y870 HydrophobicContact CG2-CD2 4.24Å; V866-Y870 WeakPolarHBondContact O-CB 3.1Å; V866-Y870 PolarHBondContact O-N 3.37Å; R867-Y870 WeakPolarHBondContact O-CB 3.43Å; R867-Y870 PolarHBondContact O-N 2.98Å; Y870-E873 PolarHBondContact O-N 2.84Å; Y870-L874 HydrophobicContact CE1-CB 4.47Å; Y870-L874 HydrophobicContact CE1-CD1 4.42Å; Y870-L874 HydrophobicContact CE1-CD2 4.36Å; Y870-L874 VanDerWaalsContact O-CB 3.31Å; Y870-L874 WeakPolarHBondContact O-CB 3.5Å; Y870-L874 PolarHBondContact O-N 2.93Å
871	I	64.8	Low	56.7	Low	11 Å²	11	64.1 Å²	64.1	6%	0.056	34%	0.344	C	S	.	.	H	α-helix	trans	-73.6	-41.8	-179.8	-63.6	148.2	0	0	0	112.1	L774 I778 R867 Q868 Q869 E873 L874 F875 I879	L774-I871 HydrophobicContact CD1-CD1 3.24Å; L774-I871 HydrophobicContact CD1-CG1 4.04Å; L774-I871 HydrophobicContact CD1-CG2 4.31Å; L774-I871 HydrophobicContact CD2-CD1 3.39Å; L774-I871 HydrophobicContact CG-CD1 3.25Å; L774-I871 HydrophobicContact CG-CG1 4.35Å; I778-I871 HydrophobicContact CD1-CD1 4.21Å; I778-I871 HydrophobicContact CD1-CG1 4.4Å; I778-I871 HydrophobicContact CG1-CG1 4.23Å; R867-I871 WeakPolarHBondContact O-CD1 3.33Å; R867-I871 VanDerWaalsContact O-CG1 3.3Å; R867-I871 WeakPolarHBondContact O-CG1 3.46Å; R867-I871 PolarHBondContact O-N 3.36Å; Q868-I871 PolarHBondContact O-N 2.93Å; Q869-I871 PolarHBondContact O-N 3.09Å; I871-E873 PolarHBondContact O-N 3.36Å; I871-L874 PolarHBondContact O-N 3.41Å; I871-F875 HydrophobicContact CG2-CD2 3.59Å; I871-F875 HydrophobicContact CG2-CE2 3.84Å; I871-F875 PolarHBondContact O-N 2.89Å; I871-I879 HydrophobicContact CG2-CD1 4.34Å
872	E	64.8	Low	58.6	Low	53 Å²	53	58 Å²	58	25%	0.248	31%	0.313	C	S	.	.	H	α-helix	trans	-57.1	-36.5	172.9	-74.5	176.7	-172.3	0	0	110.7	Q868 Q869 G876	Q868-E872 WeakPolarHBondContact O-CG 3.27Å; Q868-E872 PolarHBondContact O-N 2.9Å; Q869-E872 PolarHBondContact O-N 3.35Å; E872-G876 CarbonylContact O-C 3.46Å; E872-G876 WeakPolarHBondContact O-CA 3.47Å; E872-G876 PolarHBondContact O-N 2.98Å
873	E	65	Low	60.7	Low	45 Å²	45	50.9 Å²	50.9	21%	0.21	28%	0.276	C	S	.	.	H	α-helix	trans	-77.4	-38.8	175.5	-68.5	-166.6	-156.1	0	0	113.4	H807 I810 T811 I814 Q869 Y870 I871	H807-E873 IonicContact ND1-OE1 3.31Å; I810-E873 WeakPolarHBondContact CB-OE2 3.07Å; I810-E873 HydrophobicContact CG2-CB 4.12Å; I810-E873 HydrophobicContact CG2-CG 4.44Å; I810-E873 WeakPolarHBondContact CG2-OE2 3.31Å; T811-E873 HydrophobicContact CG2-CG 4.23Å; T811-E873 WeakPolarHBondContact CG2-OE2 3.35Å; T811-E873 PolarHBondContact N-OE2 2.68Å; I814-E873 HydrophobicContact CD1-CB 4.47Å; Q869-E873 WeakPolarHBondContact O-CG 3.46Å; Q869-E873 PolarHBondContact O-N 3.37Å; Y870-E873 PolarHBondContact O-N 2.84Å; I871-E873 PolarHBondContact O-N 3.36Å
874	L	66.3	Low	62.6	Low	4 Å²	4	48.6 Å²	48.6	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-62.7	-46.4	178.5	-173.8	74	0	0	0	112.2	I777 I814 Y870 I871 W889	I777-L874 HydrophobicContact CG2-CD2 3.71Å; I814-L874 HydrophobicContact CD1-CB 4.42Å; I814-L874 HydrophobicContact CD1-CD1 4.2Å; I814-L874 HydrophobicContact CG2-CD1 4.49Å; Y870-L874 HydrophobicContact CE1-CB 4.47Å; Y870-L874 HydrophobicContact CE1-CD1 4.42Å; Y870-L874 HydrophobicContact CE1-CD2 4.36Å; Y870-L874 VanDerWaalsContact O-CB 3.31Å; Y870-L874 WeakPolarHBondContact O-CB 3.5Å; Y870-L874 PolarHBondContact O-N 2.93Å; I871-L874 PolarHBondContact O-N 3.41Å; L874-W889 HydrophobicContact CD2-CZ2 4.35Å
875	F	65.7	Low	64	Low	23 Å²	23	42.9 Å²	42.9	10%	0.101	23%	0.232	C	C	.	.	H	α-helix	trans	-94.7	-17.2	-177.4	-68.4	-58.6	0	0	0	114	I777 W850 I871 I879 W889	I777-F875 HydrophobicContact CD1-CE2 4.25Å; I777-F875 HydrophobicContact CD1-CZ 4.24Å; I777-F875 HydrophobicContact CG2-CE2 3.94Å; I777-F875 HydrophobicContact CG2-CZ 3.78Å; W850-F875 HydrophobicContact CH2-CE2 4.42Å; I871-F875 HydrophobicContact CG2-CD2 3.59Å; I871-F875 HydrophobicContact CG2-CE2 3.84Å; I871-F875 PolarHBondContact O-N 2.89Å; F875-I879 HydrophobicContact CB-CD1 3.86Å; F875-I879 HydrophobicContact CB-CG1 3.8Å; F875-I879 HydrophobicContact CB-CG2 4.35Å; F875-I879 HydrophobicContact CD2-CD1 4.16Å; F875-I879 HydrophobicContact CG-CD1 4.47Å; F875-W889 HydrophobicContact CD1-CB 4Å; F875-W889 HydrophobicContact CD1-CG 4.36Å; F875-W889 HydrophobicContact CE1-CB 3.8Å; F875-W889 AromaticContact CE1-CD2 3.93Å; F875-W889 HydrophobicContact CE1-CD2 3.93Å; F875-W889 AromaticContact CE1-CE3 3.91Å; F875-W889 HydrophobicContact CE1-CE3 3.91Å; F875-W889 AromaticContact CE1-CG 3.9Å; F875-W889 HydrophobicContact CE1-CG 3.9Å; F875-W889 HydrophobicContact CZ-CE3 4.28Å
876	G	58.2	Low	65.1	Low	31 Å²	31	39.1 Å²	39.1	32%	0.32	21%	0.212	S	C	.	.			trans	90.3	156.2	-174.7	0	0	0	0	0	113.9	E872 S878 I879	E872-G876 CarbonylContact O-C 3.46Å; E872-G876 WeakPolarHBondContact O-CA 3.47Å; E872-G876 PolarHBondContact O-N 2.98Å; G876-S878 PolarHBondContact O-N 3.45Å; G876-I879 VanDerWaalsContact O-CG1 3.26Å; G876-I879 WeakPolarHBondContact O-CG1 3.48Å
877	T	49.1	Very low	66.1	Low	144 Å²	144	36.2 Å²	36.2	88%	0.883	20%	0.195	S	C	*	.	S	Bend	trans	-68.7	6.1	-159.6	53.7	0	0	0	0	117.6
878	S	54.1	Low	67	Low	81 Å²	81	35.3 Å²	35.3	57%	0.566	20%	0.197	S	C	*	.			trans	-146.2	80.2	170.3	75.4	0	0	0	0	110.9	G876 K880	G876-S878 PolarHBondContact O-N 3.45Å; S878-K880 PolarHBondContact O-N 3.49Å
879	I	55.7	Low	67.9	Low	3 Å²	3	32.5 Å²	32.5	2%	0.015	18%	0.184	C	C	.	.			trans	-71.8	21.4	-174.1	-44.7	168.6	0	0	0	111.2	W850 W851 I871 F875 G876 C881 S885	W850-I879 HydrophobicContact CZ2-CG2 3.45Å; W850-I879 VanDerWaalsContact CZ2-CG2 3.45Å; W850-I879 PolarHBondContact NE1-O 3Å; W851-I879 HydrophobicContact CD2-CB 3.7Å; W851-I879 HydrophobicContact CD2-CD1 3.89Å; W851-I879 HydrophobicContact CD2-CG1 4.28Å; W851-I879 HydrophobicContact CD2-CG2 3.98Å; W851-I879 HydrophobicContact CE3-CB 3.45Å; W851-I879 VanDerWaalsContact CE3-CB 3.45Å; W851-I879 HydrophobicContact CE3-CD1 4.35Å; W851-I879 HydrophobicContact CE3-CG1 4.46Å; W851-I879 HydrophobicContact CE3-CG2 3.4Å; W851-I879 VanDerWaalsContact CE3-CG2 3.4Å; W851-I879 HydrophobicContact CG-CD1 4.36Å; W851-I879 HydrophobicContact CH2-CB 3.27Å; W851-I879 HydrophobicContact CH2-CG1 4.4Å; W851-I879 HydrophobicContact CH2-CG2 4.06Å; W851-I879 WeakPolarHBondContact CH2-O 3.36Å; W851-I879 HydrophobicContact CZ2-CB 3.38Å; W851-I879 HydrophobicContact CZ2-CD1 4.43Å; W851-I879 HydrophobicContact CZ2-CG1 4.05Å; W851-I879 HydrophobicContact CZ2-CG2 4.44Å; W851-I879 HydrophobicContact CZ3-CB 3.3Å; W851-I879 HydrophobicContact CZ3-CG2 3.52Å; W851-I879 WeakPolarHBondContact CZ3-O 3.38Å; I871-I879 HydrophobicContact CG2-CD1 4.34Å; F875-I879 HydrophobicContact CB-CD1 3.86Å; F875-I879 HydrophobicContact CB-CG1 3.8Å; F875-I879 HydrophobicContact CB-CG2 4.35Å; F875-I879 HydrophobicContact CD2-CD1 4.16Å; F875-I879 HydrophobicContact CG-CD1 4.47Å; G876-I879 VanDerWaalsContact O-CG1 3.26Å; G876-I879 WeakPolarHBondContact O-CG1 3.48Å; I879-C881 CarbonylContact O-C 3.49Å; I879-C881 WeakPolarHBondContact O-CA 3.32Å; I879-C881 PolarHBondContact O-N 3.31Å; I879-S885 WeakPolarHBondContact CA-OG 3.35Å; I879-S885 WeakPolarHBondContact CG2-OG 3.13Å
880	K	62	Low	69	Low	146 Å²	146	30.9 Å²	30.9	64%	0.635	18%	0.176	S	C	*	.	S	Bend	trans	-43.5	-25.9	-164.7	-72.7	-172.4	179.3	-176.8	0	115.5	S878	S878-K880 PolarHBondContact O-N 3.49Å
881	C	69.3	Low	69.9	Low	2 Å²	2	31.4 Å²	31.4	1%	0.014	18%	0.18	C	C	.	.	S	Bend	trans	-125.9	118.9	166.3	176.7	0	0	0	0	109.9	G844 C846 I879 L883 L884 S885 C948 C950	G844-C881 CarbonylContact O-C 3.5Å; G844-C881 PolarHBondContact O-SG 3.49Å; C846-C881 HydrophobicContact CB-CB 4.35Å; I879-C881 CarbonylContact O-C 3.49Å; I879-C881 WeakPolarHBondContact O-CA 3.32Å; I879-C881 PolarHBondContact O-N 3.31Å; C881-L883 VanDerWaalsContact C-N 3.3Å; C881-L883 PolarHBondContact O-N 3.41Å; C881-L884 HydrophobicContact CB-CB 3.79Å; C881-L884 WeakPolarHBondContact O-CB 3.49Å; C881-L884 PolarHBondContact O-N 2.93Å; C881-L884 VanDerWaalsContact O-N 3.08Å; C881-L884 PolarHBondContact SG-N 3.26Å; C881-L884 VanDerWaalsContact SG-N 3.44Å; C881-S885 PolarHBondContact O-N 3.14Å; C881-S885 PolarHBondContact O-OG 2.84Å; C881-C948 VanDerWaalsContact SG-SG 3.66Å; C881-C950 HydrophobicContact CB-CB 4.43Å; C881-C950 WeakPolarHBondContact SG-CB 3.35Å
882	G	70.8	Confident	70.6	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-33.7	177.3	0	0	0	0	0	114	G844 W850 L884 S885 L886	G844-G882 WeakPolarHBondContact O-CA 3.47Å; G844-G882 PolarHBondContact O-N 3.43Å; W850-G882 VanDerWaalsContact CZ2-CA 3.43Å; G882-L884 VanDerWaalsContact C-N 3.34Å; G882-S885 PolarHBondContact O-N 3.12Å; G882-L886 VanDerWaalsContact O-CB 3.31Å; G882-L886 WeakPolarHBondContact O-CB 3.28Å; G882-L886 PolarHBondContact O-N 3.23Å
883	L	77.3	Confident	71.4	Confident	1 Å²	1	33 Å²	33	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-65.3	-38.8	171.3	-178	70.4	0	0	0	112	G844 H845 C881 S885 L886 C887 M932 I933 L936 W944 C950 V954	G844-L883 PolarHBondContact O-N 3.31Å; G844-L883 VanDerWaalsContact O-N 3.11Å; H845-L883 VanDerWaalsContact CE1-CB 3.45Å; H845-L883 WeakPolarHBondContact CE1-CB 3.33Å; H845-L883 WeakPolarHBondContact CE1-CD2 3.43Å; H845-L883 WeakPolarHBondContact ND1-CB 3.26Å; C881-L883 VanDerWaalsContact C-N 3.3Å; C881-L883 PolarHBondContact O-N 3.41Å; L883-S885 VanDerWaalsContact C-N 3.35Å; L883-L886 PolarHBondContact O-N 3.25Å; L883-C887 WeakPolarHBondContact O-CB 3.22Å; L883-C887 PolarHBondContact O-N 2.71Å; L883-C887 PolarHBondContact O-SG 3.35Å; L883-M932 HydrophobicContact CD1-CE 4.41Å; L883-I933 HydrophobicContact CD1-CD1 4.24Å; L883-L936 HydrophobicContact CD1-CD1 4.12Å; L883-W944 HydrophobicContact CD2-CZ2 3.44Å; L883-W944 VanDerWaalsContact CD2-CZ2 3.44Å; L883-C950 HydrophobicContact CB-CB 4.45Å; L883-C950 HydrophobicContact CD2-CB 4.21Å; L883-V954 HydrophobicContact CD1-CG2 4.46Å; L883-V954 HydrophobicContact CD2-CG2 3.55Å; L883-V954 HydrophobicContact CG-CG2 4.09Å
884	L	77	Confident	72.3	Confident	48 Å²	48	31.1 Å²	31.1	25%	0.251	18%	0.179	S	C	.	.	H	α-helix	trans	-62	-47.4	176.1	-179.5	64.8	0	0	0	110.1	C881 G882 L886 C887 S888 C950 Q953	C881-L884 HydrophobicContact CB-CB 3.79Å; C881-L884 WeakPolarHBondContact O-CB 3.49Å; C881-L884 PolarHBondContact O-N 2.93Å; C881-L884 VanDerWaalsContact O-N 3.08Å; C881-L884 PolarHBondContact SG-N 3.26Å; C881-L884 VanDerWaalsContact SG-N 3.44Å; G882-L884 VanDerWaalsContact C-N 3.34Å; L884-L886 PolarHBondContact O-N 3.24Å; L884-C887 PolarHBondContact O-N 2.93Å; L884-S888 PolarHBondContact O-N 3.12Å; L884-S888 PolarHBondContact O-OG 3.05Å; L884-C950 HydrophobicContact CB-CB 4.03Å; L884-Q953 HydrophobicContact CD1-CB 3.56Å; L884-Q953 HydrophobicContact CD1-CG 3.81Å
885	S	74.3	Confident	73	Confident	7 Å²	7	34.1 Å²	34.1	5%	0.049	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-41.5	177.1	-66	0	0	0	0	112.7	I879 C881 G882 L883 S888 W889	I879-S885 WeakPolarHBondContact CA-OG 3.35Å; I879-S885 WeakPolarHBondContact CG2-OG 3.13Å; C881-S885 PolarHBondContact O-N 3.14Å; C881-S885 PolarHBondContact O-OG 2.84Å; G882-S885 PolarHBondContact O-N 3.12Å; L883-S885 VanDerWaalsContact C-N 3.35Å; S885-S888 PolarHBondContact O-N 3.4Å; S885-W889 VanDerWaalsContact O-CB 3.27Å; S885-W889 WeakPolarHBondContact O-CB 3.47Å; S885-W889 PolarHBondContact O-N 3.48Å
886	L	80.1	Confident	73.6	Confident	5 Å²	5	35 Å²	35	3%	0.026	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-45.6	174.5	-179.1	62.2	0	0	0	111.7	F828 L829 G882 L883 L884 S888 W889 V890 M932	F828-L886 HydrophobicContact CE1-CD1 4.15Å; L829-L886 HydrophobicContact CD2-CD1 4.13Å; L829-L886 HydrophobicContact CD2-CD2 4.28Å; G882-L886 VanDerWaalsContact O-CB 3.31Å; G882-L886 WeakPolarHBondContact O-CB 3.28Å; G882-L886 PolarHBondContact O-N 3.23Å; L883-L886 PolarHBondContact O-N 3.25Å; L884-L886 PolarHBondContact O-N 3.24Å; L886-S888 VanDerWaalsContact C-N 3.34Å; L886-S888 PolarHBondContact O-N 3.45Å; L886-W889 HydrophobicContact CD1-CE3 3.85Å; L886-W889 HydrophobicContact CD1-CZ3 4.24Å; L886-W889 PolarHBondContact O-N 2.68Å; L886-V890 HydrophobicContact CD1-CG2 4.18Å; L886-V890 HydrophobicContact CG-CG2 4.47Å; L886-V890 WeakPolarHBondContact O-CB 3.49Å; L886-V890 VanDerWaalsContact O-CG2 3.28Å; L886-V890 WeakPolarHBondContact O-CG2 3.13Å; L886-V890 PolarHBondContact O-N 2.85Å; L886-M932 HydrophobicContact CD2-CE 3.72Å; L886-M932 HydrophobicContact CD2-SD 3.73Å
887	C	82.7	Confident	74.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.6	-44	176.4	-72.2	0	0	0	0	111.8	L883 L884 C891 Q953	L883-C887 WeakPolarHBondContact O-CB 3.22Å; L883-C887 PolarHBondContact O-N 2.71Å; L883-C887 PolarHBondContact O-SG 3.35Å; L884-C887 PolarHBondContact O-N 2.93Å; C887-C891 WeakPolarHBondContact O-CB 3.21Å; C887-C891 PolarHBondContact O-N 3.46Å; C887-C891 VanDerWaalsContact O-N 3.07Å; C887-C891 PolarHBondContact O-SG 3.45Å; C887-C891 VanDerWaalsContact O-SG 3.39Å; C887-Q953 HydrophobicContact CB-CB 4.37Å; C887-Q953 HydrophobicContact CB-CG 3.59Å
888	S	79.8	Confident	76	Confident	37 Å²	37	27.1 Å²	27.1	26%	0.259	14%	0.144	S	C	.	.	H	α-helix	trans	-62.8	-44.5	175.9	-67.4	0	0	0	0	111.7	L884 S885 L886 C891 Q892	L884-S888 PolarHBondContact O-N 3.12Å; L884-S888 PolarHBondContact O-OG 3.05Å; S885-S888 PolarHBondContact O-N 3.4Å; L886-S888 VanDerWaalsContact C-N 3.34Å; L886-S888 PolarHBondContact O-N 3.45Å; S888-C891 PolarHBondContact O-N 3.4Å; S888-Q892 WeakPolarHBondContact O-CB 3.43Å; S888-Q892 VanDerWaalsContact O-CG 3.27Å; S888-Q892 WeakPolarHBondContact O-CG 3.35Å; S888-Q892 PolarHBondContact O-N 3.48Å
889	W	80.7	Confident	76.9	Confident	3 Å²	3	28.7 Å²	28.7	1%	0.011	15%	0.146	C	C	.	.	H	α-helix	trans	-63.8	-46	179.3	-177	48.2	0	0	0	112.4	I777 T780 L825 F828 L874 F875 S885 L886 C891 Q892 I893	I777-W889 HydrophobicContact CG2-CH2 4.36Å; T780-W889 HydrophobicContact CG2-CH2 3.71Å; T780-W889 HydrophobicContact CG2-CZ2 4.22Å; L825-W889 HydrophobicContact CD1-CE3 4.09Å; L825-W889 HydrophobicContact CD1-CH2 3.86Å; L825-W889 HydrophobicContact CD1-CZ2 4.34Å; L825-W889 HydrophobicContact CD1-CZ3 3.73Å; F828-W889 HydrophobicContact CD1-CH2 4.29Å; F828-W889 AromaticContact CD1-CZ3 3.79Å; F828-W889 HydrophobicContact CD1-CZ3 3.79Å; F828-W889 HydrophobicContact CE1-CH2 4.48Å; F828-W889 AromaticContact CE1-CZ3 3.71Å; F828-W889 HydrophobicContact CE1-CZ3 3.71Å; F828-W889 HydrophobicContact CZ-CZ3 4.44Å; L874-W889 HydrophobicContact CD2-CZ2 4.35Å; F875-W889 HydrophobicContact CD1-CB 4Å; F875-W889 HydrophobicContact CD1-CG 4.36Å; F875-W889 HydrophobicContact CE1-CB 3.8Å; F875-W889 AromaticContact CE1-CD2 3.93Å; F875-W889 HydrophobicContact CE1-CD2 3.93Å; F875-W889 AromaticContact CE1-CE3 3.91Å; F875-W889 HydrophobicContact CE1-CE3 3.91Å; F875-W889 AromaticContact CE1-CG 3.9Å; F875-W889 HydrophobicContact CE1-CG 3.9Å; F875-W889 HydrophobicContact CZ-CE3 4.28Å; S885-W889 VanDerWaalsContact O-CB 3.27Å; S885-W889 WeakPolarHBondContact O-CB 3.47Å; S885-W889 PolarHBondContact O-N 3.48Å; L886-W889 HydrophobicContact CD1-CE3 3.85Å; L886-W889 HydrophobicContact CD1-CZ3 4.24Å; L886-W889 PolarHBondContact O-N 2.68Å; W889-C891 VanDerWaalsContact C-N 3.34Å; W889-C891 PolarHBondContact O-N 3.36Å; W889-Q892 PolarHBondContact O-N 3.4Å; W889-I893 HydrophobicContact CD2-CD1 4.13Å; W889-I893 VanDerWaalsContact CE2-CD1 3.4Å; W889-I893 HydrophobicContact CG-CD1 4.35Å; W889-I893 HydrophobicContact CZ2-CD1 3.73Å; W889-I893 PolarHBondContact O-N 3.41Å
890	V	85.5	Confident	77.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60	-43.8	175.8	170.5	0	0	0	0	111.2	L825 L829 L886 L894 L925 F929 T957 L961	L825-V890 HydrophobicContact CD1-CG2 4.29Å; L825-V890 HydrophobicContact CD2-CG2 4.39Å; L829-V890 HydrophobicContact CD1-CG2 4.41Å; L829-V890 HydrophobicContact CD2-CG2 4.34Å; L886-V890 HydrophobicContact CD1-CG2 4.18Å; L886-V890 HydrophobicContact CG-CG2 4.47Å; L886-V890 WeakPolarHBondContact O-CB 3.49Å; L886-V890 VanDerWaalsContact O-CG2 3.28Å; L886-V890 WeakPolarHBondContact O-CG2 3.13Å; L886-V890 PolarHBondContact O-N 2.85Å; V890-L894 WeakPolarHBondContact O-CB 3.22Å; V890-L894 PolarHBondContact O-N 2.85Å; V890-L925 HydrophobicContact CG1-CD1 4.4Å; V890-L925 HydrophobicContact CG1-CD2 4.39Å; V890-F929 HydrophobicContact CG1-CD2 4.39Å; V890-F929 HydrophobicContact CG2-CD2 4.27Å; V890-F929 HydrophobicContact CG2-CE2 4.32Å; V890-T957 HydrophobicContact CG1-CG2 4.46Å; V890-L961 HydrophobicContact CG1-CD1 4.41Å; V890-L961 HydrophobicContact CG1-CD2 4.04Å
891	C	83.8	Confident	77.4	Confident	15 Å²	15	24.1 Å²	24.1	10%	0.101	13%	0.132	C	C	.	.	H	α-helix	trans	-64.4	-42.1	176.4	-77.3	0	0	0	0	112.4	C887 S888 W889 L894 N895 T957	C887-C891 WeakPolarHBondContact O-CB 3.21Å; C887-C891 PolarHBondContact O-N 3.46Å; C887-C891 VanDerWaalsContact O-N 3.07Å; C887-C891 PolarHBondContact O-SG 3.45Å; C887-C891 VanDerWaalsContact O-SG 3.39Å; S888-C891 PolarHBondContact O-N 3.4Å; W889-C891 VanDerWaalsContact C-N 3.34Å; W889-C891 PolarHBondContact O-N 3.36Å; C891-L894 PolarHBondContact O-N 2.77Å; C891-N895 WeakPolarHBondContact O-CB 2.99Å; C891-N895 PolarHBondContact O-N 3.45Å; C891-N895 PolarHBondContact O-ND2 2.87Å; C891-T957 PolarHBondContact SG-OG1 3.35Å
892	Q	80.9	Confident	76.8	Confident	97 Å²	97	29.3 Å²	29.3	45%	0.453	16%	0.159	S	C	.	.	H	α-helix	trans	-62.8	-50.2	178.3	-76.6	173.5	1	0	0	111.6	S888 W889 L894 N895 Q896	S888-Q892 WeakPolarHBondContact O-CB 3.43Å; S888-Q892 VanDerWaalsContact O-CG 3.27Å; S888-Q892 WeakPolarHBondContact O-CG 3.35Å; S888-Q892 PolarHBondContact O-N 3.48Å; W889-Q892 PolarHBondContact O-N 3.4Å; Q892-L894 VanDerWaalsContact C-N 3.34Å; Q892-L894 PolarHBondContact O-N 3.46Å; Q892-N895 PolarHBondContact O-N 3.24Å; Q892-Q896 WeakPolarHBondContact O-CG 3.38Å; Q892-Q896 PolarHBondContact O-N 2.97Å
893	I	80.5	Confident	75.5	Confident	1 Å²	1	37 Å²	37	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-44.8	178	-69.6	-179	0	0	0	110.4	V819 L822 L825 W889 N895 Q896 F897	V819-I893 HydrophobicContact CG1-CG2 3.93Å; V819-I893 HydrophobicContact CG2-CG2 4.25Å; L822-I893 HydrophobicContact CD2-CG2 3.51Å; L825-I893 HydrophobicContact CD1-CD1 4.31Å; L825-I893 HydrophobicContact CD2-CB 4.12Å; L825-I893 HydrophobicContact CD2-CD1 4.12Å; L825-I893 HydrophobicContact CD2-CG2 3.89Å; W889-I893 HydrophobicContact CD2-CD1 4.13Å; W889-I893 VanDerWaalsContact CE2-CD1 3.4Å; W889-I893 HydrophobicContact CG-CD1 4.35Å; W889-I893 HydrophobicContact CZ2-CD1 3.73Å; W889-I893 PolarHBondContact O-N 3.41Å; I893-N895 PolarHBondContact O-N 2.9Å; I893-Q896 PolarHBondContact O-N 2.83Å; I893-F897 VanDerWaalsContact O-CB 3.26Å; I893-F897 WeakPolarHBondContact O-CB 3.35Å; I893-F897 PolarHBondContact O-N 3.49Å
894	L	83.7	Confident	73.8	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-42.7	179.3	177.6	62.6	0	0	0	111.7	L822 V890 C891 Q892 F897 N898 R922 L925 L961	L822-L894 HydrophobicContact CD1-CD1 4.17Å; V890-L894 WeakPolarHBondContact O-CB 3.22Å; V890-L894 PolarHBondContact O-N 2.85Å; C891-L894 PolarHBondContact O-N 2.77Å; Q892-L894 VanDerWaalsContact C-N 3.34Å; Q892-L894 PolarHBondContact O-N 3.46Å; L894-F897 PolarHBondContact O-N 3.08Å; L894-N898 WeakPolarHBondContact CG-ND2 3.35Å; L894-N898 PolarHBondContact O-N 3.44Å; L894-N898 PolarHBondContact O-ND2 2.95Å; L894-R922 HydrophobicContact CD1-CG 4.08Å; L894-L925 HydrophobicContact CB-CD2 4.33Å; L894-L925 HydrophobicContact CD1-CD2 4.22Å; L894-L961 HydrophobicContact CD2-CD2 3.4Å; L894-L961 VanDerWaalsContact CD2-CD2 3.4Å
895	N	82.4	Confident	72	Confident	66 Å²	66	44.5 Å²	44.5	35%	0.353	25%	0.245	S	C	.	.	H	α-helix	trans	-63.2	-48.7	179.4	-71	-14.5	0	0	0	111.2	C891 Q892 I893 F897 N898 D899 H960	C891-N895 WeakPolarHBondContact O-CB 2.99Å; C891-N895 PolarHBondContact O-N 3.45Å; C891-N895 PolarHBondContact O-ND2 2.87Å; Q892-N895 PolarHBondContact O-N 3.24Å; I893-N895 PolarHBondContact O-N 2.9Å; N895-F897 VanDerWaalsContact C-N 3.27Å; N895-F897 PolarHBondContact O-N 3.02Å; N895-N898 PolarHBondContact O-N 2.77Å; N895-N898 VanDerWaalsContact O-N 3.14Å; N895-D899 VanDerWaalsContact O-CG 3.28Å; N895-D899 PolarHBondContact O-N 3.04Å; N895-H960 PolarHBondContact OD1-NE2 3.06Å
896	Q	78.2	Confident	70.4	Confident	42 Å²	42	48.6 Å²	48.6	20%	0.196	27%	0.274	C	S	.	.	H	α-helix	trans	-61.5	-36.1	175.7	-71.6	174.8	-31.3	0	0	112.3	F785 I814 V819 Q892 I893 D899 S900	F785-Q896 VanDerWaalsContact CE1-OE1 3.31Å; I814-Q896 PolarHBondContact O-NE2 3.17Å; V819-Q896 HydrophobicContact CB-CB 4.42Å; V819-Q896 HydrophobicContact CG2-CB 3.64Å; Q892-Q896 WeakPolarHBondContact O-CG 3.38Å; Q892-Q896 PolarHBondContact O-N 2.97Å; I893-Q896 PolarHBondContact O-N 2.83Å; Q896-D899 PolarHBondContact O-N 3.35Å; Q896-S900 PolarHBondContact O-N 3.32Å; Q896-S900 PolarHBondContact O-OG 3.38Å
897	F	79.2	Confident	68.4	Low	2 Å²	2	55 Å²	55	1%	0.009	31%	0.307	C	S	.	.	H	α-helix	trans	-65.9	-42.6	174.3	-176.7	-105.3	0	0	0	111.9	V819 L822 I893 L894 N895 D899 S900 T901 A918 R922	V819-F897 HydrophobicContact CB-CB 4.05Å; V819-F897 HydrophobicContact CB-CD2 4.33Å; V819-F897 HydrophobicContact CG1-CB 3.93Å; V819-F897 HydrophobicContact CG1-CD2 3.85Å; V819-F897 HydrophobicContact CG1-CG 4.34Å; L822-F897 HydrophobicContact CD1-CD1 3.54Å; L822-F897 HydrophobicContact CD1-CE1 3.72Å; L822-F897 HydrophobicContact CD1-CG 4.03Å; L822-F897 HydrophobicContact CD1-CZ 4.35Å; L822-F897 HydrophobicContact CD2-CB 3.88Å; L822-F897 HydrophobicContact CD2-CD1 4.26Å; L822-F897 HydrophobicContact CD2-CD2 4.27Å; L822-F897 HydrophobicContact CD2-CG 3.88Å; L822-F897 HydrophobicContact CG-CB 4.34Å; L822-F897 HydrophobicContact CG-CD1 3.82Å; L822-F897 HydrophobicContact CG-CD2 4.03Å; L822-F897 HydrophobicContact CG-CE1 4.03Å; L822-F897 HydrophobicContact CG-CE2 4.25Å; L822-F897 HydrophobicContact CG-CG 3.79Å; L822-F897 HydrophobicContact CG-CZ 4.23Å; I893-F897 VanDerWaalsContact O-CB 3.26Å; I893-F897 WeakPolarHBondContact O-CB 3.35Å; I893-F897 PolarHBondContact O-N 3.49Å; L894-F897 PolarHBondContact O-N 3.08Å; N895-F897 VanDerWaalsContact C-N 3.27Å; N895-F897 PolarHBondContact O-N 3.02Å; F897-D899 VanDerWaalsContact C-N 3.34Å; F897-S900 PolarHBondContact O-N 2.94Å; F897-S900 PolarHBondContact O-OG 3.32Å; F897-T901 HydrophobicContact CD1-CG2 4.2Å; F897-T901 HydrophobicContact CD2-CG2 4.04Å; F897-T901 HydrophobicContact CE1-CG2 3.82Å; F897-T901 HydrophobicContact CE2-CG2 3.64Å; F897-T901 HydrophobicContact CG-CG2 4.33Å; F897-T901 HydrophobicContact CZ-CG2 3.54Å; F897-T901 WeakPolarHBondContact O-CB 3.4Å; F897-T901 WeakPolarHBondContact O-CG2 3.46Å; F897-T901 PolarHBondContact O-N 3.23Å; F897-T901 PolarHBondContact O-OG1 2.93Å; F897-A918 HydrophobicContact CE1-CB 3.84Å; F897-A918 HydrophobicContact CZ-CB 3.66Å; F897-R922 HydrophobicContact CD1-CG 4.49Å; F897-R922 HydrophobicContact CE1-CG 4.27Å
898	N	78.1	Confident	66.7	Low	7 Å²	7	56.4 Å²	56.4	4%	0.037	32%	0.315	C	S	.	.	H	α-helix	trans	-63.1	-42.8	175.9	-69	-38	0	0	0	111.3	L894 N895 S900 T901 L902 R922 Y964	L894-N898 WeakPolarHBondContact CG-ND2 3.35Å; L894-N898 PolarHBondContact O-N 3.44Å; L894-N898 PolarHBondContact O-ND2 2.95Å; N895-N898 PolarHBondContact O-N 2.77Å; N895-N898 VanDerWaalsContact O-N 3.14Å; N898-S900 VanDerWaalsContact C-N 3.29Å; N898-S900 PolarHBondContact O-N 3.14Å; N898-T901 PolarHBondContact O-N 2.79Å; N898-T901 PolarHBondContact O-OG1 3.42Å; N898-L902 VanDerWaalsContact O-CG 3.25Å; N898-L902 WeakPolarHBondContact O-CG 3.41Å; N898-L902 PolarHBondContact O-N 3.31Å; N898-R922 WeakPolarHBondContact OD1-CD 3.37Å; N898-R922 PolarHBondContact OD1-NH1 3.03Å; N898-Y964 HydrophobicContact CB-CE2 4.23Å; N898-Y964 WeakPolarHBondContact ND2-CE2 3.08Å; N898-Y964 WeakPolarHBondContact OD1-CE2 3.49Å
899	D	72.1	Confident	64.8	Low	114 Å²	114	63.1 Å²	63.1	61%	0.61	34%	0.336	S	S	*	.	H	α-helix	trans	-60.7	-39.8	177.3	-66.2	-22.9	0	0	0	111.6	N895 Q896 F897	N895-D899 VanDerWaalsContact O-CG 3.28Å; N895-D899 PolarHBondContact O-N 3.04Å; Q896-D899 PolarHBondContact O-N 3.35Å; F897-D899 VanDerWaalsContact C-N 3.34Å
900	S	66.7	Low	63.1	Low	37 Å²	37	67.3 Å²	67.3	26%	0.259	36%	0.358	S	S	.	.	H	α-helix	trans	-72.1	-37.8	177.3	73.5	0	0	0	0	113.7	V819 Q896 F897 N898	V819-S900 PolarHBondContact O-OG 2.87Å; Q896-S900 PolarHBondContact O-N 3.32Å; Q896-S900 PolarHBondContact O-OG 3.38Å; F897-S900 PolarHBondContact O-N 2.94Å; F897-S900 PolarHBondContact O-OG 3.32Å; N898-S900 VanDerWaalsContact C-N 3.29Å; N898-S900 PolarHBondContact O-N 3.14Å
901	T	62.7	Low	61.1	Low	16 Å²	16	71.4 Å²	71.4	10%	0.098	38%	0.38	C	S	.	.	H	α-helix	trans	-87.8	-16.5	-171.6	52.2	0	0	0	0	114.1	F897 N898 L903 S904 A918	F897-T901 HydrophobicContact CD1-CG2 4.2Å; F897-T901 HydrophobicContact CD2-CG2 4.04Å; F897-T901 HydrophobicContact CE1-CG2 3.82Å; F897-T901 HydrophobicContact CE2-CG2 3.64Å; F897-T901 HydrophobicContact CG-CG2 4.33Å; F897-T901 HydrophobicContact CZ-CG2 3.54Å; F897-T901 WeakPolarHBondContact O-CB 3.4Å; F897-T901 WeakPolarHBondContact O-CG2 3.46Å; F897-T901 PolarHBondContact O-N 3.23Å; F897-T901 PolarHBondContact O-OG1 2.93Å; N898-T901 PolarHBondContact O-N 2.79Å; N898-T901 PolarHBondContact O-OG1 3.42Å; T901-L903 PolarHBondContact O-N 3.06Å; T901-S904 PolarHBondContact O-N 3.29Å; T901-S904 PolarHBondContact O-OG 3.03Å; T901-S904 VanDerWaalsContact O-OG 3.04Å; T901-A918 HydrophobicContact CG2-CB 3.89Å
902	L	56.3	Low	59.2	Low	111 Å²	111	77 Å²	77	58%	0.581	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-21.5	174.1	-85	166.2	0	0	0	113.2	N898	N898-L902 VanDerWaalsContact O-CG 3.25Å; N898-L902 WeakPolarHBondContact O-CG 3.41Å; N898-L902 PolarHBondContact O-N 3.31Å
903	L	43.1	Very low	57.8	Low	164 Å²	164	76.2 Å²	76.2	86%	0.859	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-13.4	176	-70.5	162.6	0	0	0	114.4	T901	T901-L903 PolarHBondContact O-N 3.06Å
904	S	42.3	Very low	56.3	Low	70 Å²	70	76.3 Å²	76.3	49%	0.49	40%	0.404	S	S	.	.			trans	-121.8	46.7	-166	65.2	0	0	0	0	114	T901 S906	T901-S904 PolarHBondContact O-N 3.29Å; T901-S904 PolarHBondContact O-OG 3.03Å; T901-S904 VanDerWaalsContact O-OG 3.04Å; S904-S906 PolarHBondContact O-N 3.22Å
905	N	39.7	Very low	54.8	Low	135 Å²	135	80.3 Å²	80.3	72%	0.722	43%	0.426	S	S	*	.			trans	-74.6	67.1	166.2	-74.3	-22.7	0	0	0	110.2
906	S	40	Very low	53.6	Low	94 Å²	94	82.4 Å²	82.4	66%	0.657	43%	0.433	S	S	*	.			trans	-77.9	127.4	171	71	0	0	0	0	109.8	S904 I908	S904-S906 PolarHBondContact O-N 3.22Å; S906-I908 PolarHBondContact O-N 3.42Å
907	L	38.1	Very low	53.2	Low	138 Å²	138	81.1 Å²	81.1	72%	0.723	43%	0.429	S	S	*	.			trans	-53.4	118.3	173.1	-71.6	161.3	0	0	0	110.1	Y909	L907-Y909 HydrophobicContact CB-CD2 4.25Å; L907-Y909 HydrophobicContact CB-CE2 3.97Å; L907-Y909 PolarHBondContact O-N 2.99Å
908	I	46.5	Very low	53	Low	31 Å²	31	82.1 Å²	82.1	16%	0.159	44%	0.438	C	S	.	.			trans	-70.6	114.1	177.3	-62.5	162.9	0	0	0	108	S906 E913 F914	S906-I908 PolarHBondContact O-N 3.42Å; I908-E913 HydrophobicContact CG2-CB 4.27Å; I908-F914 HydrophobicContact CG2-CB 4.07Å; I908-F914 HydrophobicContact CG2-CD2 4.41Å
909	Y	39.8	Very low	53	Low	178 Å²	178	84.3 Å²	84.3	70%	0.698	45%	0.447	S	S	*	.			trans	-99.7	-20.7	176.8	-90.9	-87.2	0	0	0	112.8	L907 E913	L907-Y909 HydrophobicContact CB-CD2 4.25Å; L907-Y909 HydrophobicContact CB-CE2 3.97Å; L907-Y909 PolarHBondContact O-N 2.99Å; Y909-E913 PolarHBondContact N-OE2 3.26Å
910	N	45.7	Very low	53.3	Low	91 Å²	91	79 Å²	79	49%	0.487	42%	0.419	S	S	.	.	S	Bend	trans	-134	155.3	-171.4	-68.3	-42.2	0	0	0	115.1	I912 E913 F914	N910-I912 PolarHBondContact O-N 2.93Å; N910-E913 HydrophobicContact CB-CG 4.48Å; N910-E913 PolarHBondContact N-OE2 3.01Å; N910-E913 PolarHBondContact O-N 3.43Å; N910-F914 PolarHBondContact O-N 3.39Å
911	N	43.6	Very low	54.1	Low	85 Å²	85	78 Å²	78	46%	0.455	41%	0.41	S	S	.	.	H	α-helix	trans	-60.4	-28.5	175.8	-74.9	-15	0	0	0	113.8	F914 N915 I993	N911-F914 WeakPolarHBondContact O-CB 3.49Å; N911-N915 PolarHBondContact O-N 2.93Å; N911-I993 WeakPolarHBondContact OD1-CG1 3.47Å
912	I	43.1	Very low	55.1	Low	133 Å²	133	78.4 Å²	78.4	68%	0.682	41%	0.41	S	S	*	.	H	α-helix	trans	-74.3	-46.7	176.8	-59.6	174.1	0	0	0	109.5	N910 F914 N915 H916	N910-I912 PolarHBondContact O-N 2.93Å; I912-F914 PolarHBondContact O-N 3.14Å; I912-N915 PolarHBondContact O-N 2.96Å; I912-H916 PolarHBondContact O-CD2 3.34Å; I912-H916 PolarHBondContact O-N 3.39Å
913	E	51.4	Low	56.4	Low	80 Å²	80	73.1 Å²	73.1	37%	0.374	38%	0.383	S	S	.	.	H	α-helix	trans	-59.2	-35.5	173.7	-71.9	174.5	176	0	0	111.8	I908 Y909 N910 H916 S917	I908-E913 HydrophobicContact CG2-CB 4.27Å; Y909-E913 PolarHBondContact N-OE2 3.26Å; N910-E913 HydrophobicContact CB-CG 4.48Å; N910-E913 PolarHBondContact N-OE2 3.01Å; N910-E913 PolarHBondContact O-N 3.43Å; E913-H916 CarbonylContact O-C 3.58Å; E913-H916 PolarHBondContact O-N 2.93Å; E913-S917 PolarHBondContact O-N 3.49Å
914	F	50.2	Low	58.4	Low	4 Å²	4	67.4 Å²	67.4	2%	0.018	35%	0.353	C	S	.	.	H	α-helix	trans	-54.3	-59.3	176.9	-179.2	-104.9	0	0	0	112.5	I908 N910 N911 I912 H916 S917 I920 I993 I996 K997	I908-F914 HydrophobicContact CG2-CB 4.07Å; I908-F914 HydrophobicContact CG2-CD2 4.41Å; N910-F914 PolarHBondContact O-N 3.39Å; N911-F914 WeakPolarHBondContact O-CB 3.49Å; I912-F914 PolarHBondContact O-N 3.14Å; F914-H916 PolarHBondContact O-N 2.96Å; F914-H916 VanDerWaalsContact O-N 3.09Å; F914-S917 WeakPolarHBondContact O-CB 3.26Å; F914-S917 PolarHBondContact O-N 3.21Å; F914-S917 PolarHBondContact O-OG 3.02Å; F914-I920 HydrophobicContact CD1-CD1 3.25Å; F914-I920 HydrophobicContact CD2-CD1 3.81Å; F914-I920 HydrophobicContact CE1-CD1 3.08Å; F914-I920 HydrophobicContact CE1-CG1 4.33Å; F914-I920 HydrophobicContact CE2-CD1 3.72Å; F914-I920 HydrophobicContact CE2-CG1 4.49Å; F914-I920 HydrophobicContact CG-CD1 3.63Å; F914-I920 HydrophobicContact CZ-CD1 3.35Å; F914-I920 HydrophobicContact CZ-CG1 4.24Å; F914-I920 WeakPolarHBondContact O-CD1 3.15Å; F914-I993 HydrophobicContact CD2-CG2 3.4Å; F914-I993 HydrophobicContact CE2-CG2 3.47Å; F914-I993 VanDerWaalsContact CE2-CG2 3.47Å; F914-I993 HydrophobicContact CG-CG2 4.26Å; F914-I993 HydrophobicContact CZ-CG2 4.47Å; F914-I996 HydrophobicContact CE1-CB 4.19Å; F914-I996 HydrophobicContact CE1-CG2 3.46Å; F914-I996 VanDerWaalsContact CE1-CG2 3.46Å; F914-I996 HydrophobicContact CZ-CB 4.06Å; F914-I996 HydrophobicContact CZ-CG2 3.71Å; F914-K997 HydrophobicContact CD2-CG 4.36Å; F914-K997 HydrophobicContact CE2-CB 4.42Å; F914-K997 HydrophobicContact CE2-CD 3.83Å; F914-K997 HydrophobicContact CE2-CG 3.14Å; F914-K997 HydrophobicContact CZ-CB 4.34Å; F914-K997 HydrophobicContact CZ-CG 3.44Å; F914-K997 VanDerWaalsContact CZ-CG 3.44Å
915	N	51.2	Low	60.6	Low	89 Å²	89	64.1 Å²	64.1	48%	0.476	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-22.5	-179.3	-76.6	-16.9	0	0	0	113.2	N911 I912	N911-N915 PolarHBondContact O-N 2.93Å; I912-N915 PolarHBondContact O-N 2.96Å
916	H	57	Low	63	Low	109 Å²	109	57.7 Å²	57.7	51%	0.505	30%	0.295	S	S	.	.	H	α-helix	trans	-94.2	-7.3	177.8	-71.5	-104.9	0	0	0	113.4	K823 I912 E913 F914 Q921	K823-H916 PolarHBondContact NZ-CE1 3.43Å; K823-H916 PolarHBondContact NZ-ND1 3.13Å; K823-H916 VanDerWaalsContact NZ-ND1 3.16Å; I912-H916 PolarHBondContact O-CD2 3.34Å; I912-H916 PolarHBondContact O-N 3.39Å; E913-H916 CarbonylContact O-C 3.58Å; E913-H916 PolarHBondContact O-N 2.93Å; F914-H916 PolarHBondContact O-N 2.96Å; F914-H916 VanDerWaalsContact O-N 3.09Å; H916-Q921 PolarHBondContact O-NE2 3.27Å; H916-Q921 VanDerWaalsContact O-NE2 3.09Å
917	S	70.1	Confident	65.2	Low	15 Å²	15	54.9 Å²	54.9	11%	0.105	27%	0.273	C	S	.	.			trans	-61.2	142.5	-177.4	68.8	0	0	0	0	112.6	E913 F914 E919 I920 Q921	E913-S917 PolarHBondContact O-N 3.49Å; F914-S917 WeakPolarHBondContact O-CB 3.26Å; F914-S917 PolarHBondContact O-N 3.21Å; F914-S917 PolarHBondContact O-OG 3.02Å; S917-E919 PolarHBondContact O-N 3.18Å; S917-I920 PolarHBondContact O-N 3.05Å; S917-I920 WeakPolarHBondContact OG-CG1 3.38Å; S917-I920 PolarHBondContact OG-N 3.11Å; S917-Q921 PolarHBondContact O-N 2.97Å
918	A	75.2	Confident	67.5	Low	24 Å²	24	48.8 Å²	48.8	20%	0.198	24%	0.241	C	C	.	.	H	α-helix	trans	-58	-31.3	175.5	0	0	0	0	0	112.3	F897 T901 Q921 R922	F897-A918 HydrophobicContact CE1-CB 3.84Å; F897-A918 HydrophobicContact CZ-CB 3.66Å; T901-A918 HydrophobicContact CG2-CB 3.89Å; A918-Q921 PolarHBondContact O-N 3.04Å; A918-R922 WeakPolarHBondContact O-CG 3.46Å; A918-R922 PolarHBondContact O-N 2.94Å; A918-R922 VanDerWaalsContact O-N 3.12Å; A918-R922 PolarHBondContact O-NE 3.38Å
919	E	78.1	Confident	69.5	Low	52 Å²	52	47.3 Å²	47.3	24%	0.243	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-49.8	175.2	-71	177.4	-179.1	0	0	112.7	S917 Q921 R922 I923 K997	S917-E919 PolarHBondContact O-N 3.18Å; E919-Q921 VanDerWaalsContact C-N 3.29Å; E919-Q921 PolarHBondContact O-N 3.38Å; E919-R922 WeakPolarHBondContact O-CB 3.32Å; E919-R922 PolarHBondContact O-N 3.48Å; E919-R922 VanDerWaalsContact O-N 3.14Å; E919-I923 WeakPolarHBondContact O-CG1 3.49Å; E919-I923 PolarHBondContact O-N 3.31Å; E919-K997 IonicContact OE2-NZ 2.85Å; E919-K997 PolarHBondContact OE2-NZ 3.23Å
920	I	78.7	Confident	71.8	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-66.2	-35.5	179.8	-67.4	-178.2	0	0	0	111.4	F914 S917 R922 I923 N924	F914-I920 HydrophobicContact CD1-CD1 3.25Å; F914-I920 HydrophobicContact CD2-CD1 3.81Å; F914-I920 HydrophobicContact CE1-CD1 3.08Å; F914-I920 HydrophobicContact CE1-CG1 4.33Å; F914-I920 HydrophobicContact CE2-CD1 3.72Å; F914-I920 HydrophobicContact CE2-CG1 4.49Å; F914-I920 HydrophobicContact CG-CD1 3.63Å; F914-I920 HydrophobicContact CZ-CD1 3.35Å; F914-I920 HydrophobicContact CZ-CG1 4.24Å; F914-I920 WeakPolarHBondContact O-CD1 3.15Å; S917-I920 PolarHBondContact O-N 3.05Å; S917-I920 WeakPolarHBondContact OG-CG1 3.38Å; S917-I920 PolarHBondContact OG-N 3.11Å; I920-R922 VanDerWaalsContact C-N 3.3Å; I920-R922 PolarHBondContact O-N 3.46Å; I920-I923 PolarHBondContact O-N 3.3Å; I920-N924 WeakPolarHBondContact CG2-ND2 3.38Å; I920-N924 WeakPolarHBondContact O-CB 3.34Å; I920-N924 PolarHBondContact O-N 3.43Å; I920-N924 PolarHBondContact O-ND2 3.15Å
921	Q	83.8	Confident	73.6	Confident	15 Å²	15	34.7 Å²	34.7	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-60	-41.3	174.2	-68.3	-176.6	57.2	0	0	111.3	T821 L822 K823 I826 H916 S917 A918 E919 N924 L925	T821-Q921 PolarHBondContact OG1-OE1 2.93Å; L822-Q921 HydrophobicContact CB-CB 4.25Å; L822-Q921 HydrophobicContact CD1-CB 4.3Å; K823-Q921 HydrophobicContact CG-CG 4.42Å; I826-Q921 HydrophobicContact CD1-CB 4.43Å; I826-Q921 WeakPolarHBondContact CD1-O 3.23Å; H916-Q921 PolarHBondContact O-NE2 3.27Å; H916-Q921 VanDerWaalsContact O-NE2 3.09Å; S917-Q921 PolarHBondContact O-N 2.97Å; A918-Q921 PolarHBondContact O-N 3.04Å; E919-Q921 VanDerWaalsContact C-N 3.29Å; E919-Q921 PolarHBondContact O-N 3.38Å; Q921-N924 PolarHBondContact O-N 2.92Å; Q921-L925 WeakPolarHBondContact O-CB 3.42Å; Q921-L925 PolarHBondContact O-N 2.79Å
922	R	84.1	Confident	75.7	Confident	24 Å²	24	30.6 Å²	30.6	9%	0.091	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-42.7	174.3	-70.1	179.9	-71.8	-167.5	1	112.6	L822 L894 F897 N898 A918 E919 I920 L925 L926	L822-R922 HydrophobicContact CD1-CG 4.24Å; L894-R922 HydrophobicContact CD1-CG 4.08Å; F897-R922 HydrophobicContact CD1-CG 4.49Å; F897-R922 HydrophobicContact CE1-CG 4.27Å; N898-R922 WeakPolarHBondContact OD1-CD 3.37Å; N898-R922 PolarHBondContact OD1-NH1 3.03Å; A918-R922 WeakPolarHBondContact O-CG 3.46Å; A918-R922 PolarHBondContact O-N 2.94Å; A918-R922 VanDerWaalsContact O-N 3.12Å; A918-R922 PolarHBondContact O-NE 3.38Å; E919-R922 WeakPolarHBondContact O-CB 3.32Å; E919-R922 PolarHBondContact O-N 3.48Å; E919-R922 VanDerWaalsContact O-N 3.14Å; I920-R922 VanDerWaalsContact C-N 3.3Å; I920-R922 PolarHBondContact O-N 3.46Å; R922-L925 PolarHBondContact O-N 3.45Å; R922-L926 PolarHBondContact O-N 2.92Å; R922-L926 VanDerWaalsContact O-N 3.12Å
923	I	83.3	Confident	77.7	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-65.2	-44	178.2	-63.1	160.4	0	0	0	111.2	E919 I920 L925 L926 N927 P965 T968 Y1000 C1001 A1004	E919-I923 WeakPolarHBondContact O-CG1 3.49Å; E919-I923 PolarHBondContact O-N 3.31Å; I920-I923 PolarHBondContact O-N 3.3Å; I923-L925 VanDerWaalsContact C-N 3.34Å; I923-L925 PolarHBondContact O-N 3.45Å; I923-L926 PolarHBondContact O-N 3.43Å; I923-N927 PolarHBondContact O-N 2.89Å; I923-P965 HydrophobicContact CG1-CB 4.13Å; I923-P965 HydrophobicContact CG1-CG 4.18Å; I923-T968 HydrophobicContact CD1-CG2 4.46Å; I923-Y1000 WeakPolarHBondContact CG2-O 3.45Å; I923-C1001 WeakPolarHBondContact CD1-SG 3.43Å; I923-A1004 HydrophobicContact CG2-CB 3.76Å
924	N	84.4	Confident	79.2	Confident	44 Å²	44	20.5 Å²	20.5	24%	0.235	11%	0.107	C	C	.	.	H	α-helix	trans	-67	-34.8	177.6	-75.5	-22.1	0	0	0	112.2	I826 I920 Q921 N927 E928	I826-N924 HydrophobicContact CD1-CB 3.97Å; I826-N924 HydrophobicContact CG2-CB 4.36Å; I920-N924 WeakPolarHBondContact CG2-ND2 3.38Å; I920-N924 WeakPolarHBondContact O-CB 3.34Å; I920-N924 PolarHBondContact O-N 3.43Å; I920-N924 PolarHBondContact O-ND2 3.15Å; Q921-N924 PolarHBondContact O-N 2.92Å; N924-N927 PolarHBondContact O-N 2.87Å; N924-E928 WeakPolarHBondContact O-CG 3.35Å; N924-E928 PolarHBondContact O-N 2.9Å
925	L	88.4	Confident	80.6	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-60.8	-47.4	173	-178.8	65.2	0	0	0	111	L822 L825 I826 L829 V890 L894 Q921 R922 I923 N927 E928 F929 L961	L822-L925 HydrophobicContact CD1-CD2 4.13Å; L825-L925 HydrophobicContact CD2-CD1 3.89Å; L825-L925 HydrophobicContact CG-CD1 4.15Å; I826-L925 HydrophobicContact CD1-CB 4.49Å; I826-L925 HydrophobicContact CG1-CB 4.16Å; I826-L925 HydrophobicContact CG1-CD1 4.23Å; L829-L925 HydrophobicContact CD1-CD1 3.53Å; V890-L925 HydrophobicContact CG1-CD1 4.4Å; V890-L925 HydrophobicContact CG1-CD2 4.39Å; L894-L925 HydrophobicContact CB-CD2 4.33Å; L894-L925 HydrophobicContact CD1-CD2 4.22Å; Q921-L925 WeakPolarHBondContact O-CB 3.42Å; Q921-L925 PolarHBondContact O-N 2.79Å; R922-L925 PolarHBondContact O-N 3.45Å; I923-L925 VanDerWaalsContact C-N 3.34Å; I923-L925 PolarHBondContact O-N 3.45Å; L925-N927 VanDerWaalsContact C-N 3.33Å; L925-N927 PolarHBondContact O-N 3.34Å; L925-E928 PolarHBondContact O-N 3.49Å; L925-F929 VanDerWaalsContact O-CB 3.23Å; L925-F929 WeakPolarHBondContact O-CB 3.38Å; L925-F929 PolarHBondContact O-N 3.13Å; L925-L961 HydrophobicContact CD2-CD2 3.8Å; L925-L961 HydrophobicContact CG-CD2 4.18Å
926	L	89.5	Confident	82.1	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.3	-45.8	174.1	175.8	65.6	0	0	0	111.2	R922 I923 S930 L961 T962 P965 A1004 F1005 L1008	R922-L926 PolarHBondContact O-N 2.92Å; R922-L926 VanDerWaalsContact O-N 3.12Å; I923-L926 PolarHBondContact O-N 3.43Å; L926-S930 WeakPolarHBondContact CD1-OG 3.48Å; L926-S930 WeakPolarHBondContact O-CB 3.25Å; L926-S930 PolarHBondContact O-N 3.43Å; L926-S930 PolarHBondContact O-OG 3.35Å; L926-L961 HydrophobicContact CB-CB 4.47Å; L926-L961 HydrophobicContact CD1-CB 3.77Å; L926-T962 HydrophobicContact CD1-CG2 3.78Å; L926-T962 HydrophobicContact CD2-CG2 3.96Å; L926-P965 HydrophobicContact CB-CG 4.36Å; L926-P965 HydrophobicContact CD2-CB 4Å; L926-P965 HydrophobicContact CD2-CG 3.92Å; L926-A1004 HydrophobicContact CB-CB 4.42Å; L926-A1004 HydrophobicContact CD2-CB 3.98Å; L926-A1004 HydrophobicContact CG-CB 4.2Å; L926-F1005 HydrophobicContact CD2-CD1 4.5Å; L926-F1005 HydrophobicContact CD2-CE1 4.32Å; L926-L1008 HydrophobicContact CD1-CD1 4.29Å
927	N	86.1	Confident	83.2	Confident	34 Å²	34	12.8 Å²	12.8	18%	0.182	7%	0.071	C	C	.	.	H	α-helix	trans	-61.1	-49.3	-179.3	-176.8	63.6	0	0	0	112.7	I923 N924 L925 G931 A1004 Q1007	I923-N927 PolarHBondContact O-N 2.89Å; N924-N927 PolarHBondContact O-N 2.87Å; L925-N927 VanDerWaalsContact C-N 3.33Å; L925-N927 PolarHBondContact O-N 3.34Å; N927-G931 PolarHBondContact O-N 3.49Å; N927-A1004 HydrophobicContact CB-CB 3.94Å; N927-Q1007 WeakPolarHBondContact OD1-CG 3.27Å
928	E	87	Confident	83.7	Confident	11 Å²	11	17.1 Å²	17.1	5%	0.051	9%	0.089	C	C	.	.	H	α-helix	trans	-71.2	-42.3	-178.6	-66.6	-63.1	169.1	0	0	112.1	I826 L829 R830 R833 N924 L925 G931 M932	I826-E928 HydrophobicContact CG2-CB 4.47Å; I826-E928 HydrophobicContact CG2-CG 3.69Å; L829-E928 HydrophobicContact CB-CB 4.3Å; R830-E928 IonicContact CZ-OE1 2.74Å; R830-E928 VanDerWaalsContact CZ-OE1 3.31Å; R830-E928 IonicContact NE-OE1 3.15Å; R830-E928 PolarHBondContact NE-OE1 3.12Å; R830-E928 IonicContact NE-OE2 2.68Å; R830-E928 IonicContact NH2-OE1 3.37Å; R830-E928 PolarHBondContact NH2-OE1 3.02Å; R833-E928 IonicContact CZ-OE2 3.51Å; R833-E928 IonicContact NH1-OE2 2.67Å; R833-E928 PolarHBondContact NH1-OE2 3.33Å; R833-E928 IonicContact NH2-OE1 2.71Å; R833-E928 IonicContact NH2-OE2 3.49Å; R833-E928 PolarHBondContact NH2-OE2 3.31Å; N924-E928 WeakPolarHBondContact O-CG 3.35Å; N924-E928 PolarHBondContact O-N 2.9Å; L925-E928 PolarHBondContact O-N 3.49Å; E928-G931 PolarHBondContact O-N 2.96Å; E928-M932 PolarHBondContact O-N 2.96Å
929	F	89.6	Confident	83.7	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.6	-45.3	177.3	-173.5	-95.4	0	0	0	111.5	L829 V890 L925 G931 M932 I933 T957 L958 L961	L829-F929 HydrophobicContact CD1-CB 4.13Å; L829-F929 HydrophobicContact CD1-CD2 4.24Å; L829-F929 HydrophobicContact CD2-CD2 4.15Å; V890-F929 HydrophobicContact CG1-CD2 4.39Å; V890-F929 HydrophobicContact CG2-CD2 4.27Å; V890-F929 HydrophobicContact CG2-CE2 4.32Å; L925-F929 VanDerWaalsContact O-CB 3.23Å; L925-F929 WeakPolarHBondContact O-CB 3.38Å; L925-F929 PolarHBondContact O-N 3.13Å; F929-G931 VanDerWaalsContact C-N 3.34Å; F929-G931 PolarHBondContact O-N 3.17Å; F929-M932 HydrophobicContact CD2-CE 3.74Å; F929-M932 HydrophobicContact CE2-CE 3.56Å; F929-M932 HydrophobicContact CZ-CE 4.23Å; F929-M932 WeakPolarHBondContact O-CB 3.37Å; F929-M932 PolarHBondContact O-N 2.96Å; F929-M932 VanDerWaalsContact O-N 3.17Å; F929-I933 HydrophobicContact CD1-CG1 4.25Å; F929-I933 HydrophobicContact CE1-CD1 4.27Å; F929-I933 HydrophobicContact CE1-CG1 3.88Å; F929-I933 HydrophobicContact CZ-CD1 4.14Å; F929-I933 HydrophobicContact CZ-CG1 4.24Å; F929-I933 WeakPolarHBondContact O-CG1 2.91Å; F929-I933 PolarHBondContact O-N 3.27Å; F929-T957 HydrophobicContact CD1-CG2 4.4Å; F929-T957 HydrophobicContact CE1-CG2 3.68Å; F929-T957 HydrophobicContact CE2-CG2 4.28Å; F929-T957 HydrophobicContact CZ-CG2 3.61Å; F929-L958 HydrophobicContact CD1-CD2 3.65Å; F929-L958 HydrophobicContact CD1-CG 4.4Å; F929-L958 HydrophobicContact CE1-CD2 3.79Å; F929-L958 HydrophobicContact CE1-CG 4.04Å; F929-L961 HydrophobicContact CB-CD1 3.73Å; F929-L961 HydrophobicContact CD1-CD1 3.4Å; F929-L961 HydrophobicContact CD2-CD1 4.49Å; F929-L961 HydrophobicContact CE1-CD1 4.13Å; F929-L961 HydrophobicContact CG-CD1 3.62Å
930	S	86.4	Confident	83.3	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.4	-42.8	175.7	-57.5	0	0	0	0	111.5	L926 M932 I933 A934 A1011	L926-S930 WeakPolarHBondContact CD1-OG 3.48Å; L926-S930 WeakPolarHBondContact O-CB 3.25Å; L926-S930 PolarHBondContact O-N 3.43Å; L926-S930 PolarHBondContact O-OG 3.35Å; S930-M932 VanDerWaalsContact C-N 3.28Å; S930-M932 PolarHBondContact O-N 2.92Å; S930-I933 PolarHBondContact O-N 3.37Å; S930-A934 WeakPolarHBondContact O-CB 3.45Å; S930-A934 PolarHBondContact O-N 2.88Å; S930-A1011 WeakPolarHBondContact O-CB 3.45Å
931	G	84.9	Confident	82.8	Confident	3 Å²	3	27.2 Å²	27.2	3%	0.031	13%	0.134	C	C	.	.	H	α-helix	trans	-60.4	-36.8	174.7	0	0	0	0	0	112.8	R833 N927 E928 F929 A934 V935	R833-G931 WeakPolarHBondContact CD-O 3.42Å; N927-G931 PolarHBondContact O-N 3.49Å; E928-G931 PolarHBondContact O-N 2.96Å; F929-G931 VanDerWaalsContact C-N 3.34Å; F929-G931 PolarHBondContact O-N 3.17Å; G931-A934 PolarHBondContact O-N 2.81Å; G931-V935 WeakPolarHBondContact O-CG2 3.43Å; G931-V935 PolarHBondContact O-N 3.28Å; G931-V935 VanDerWaalsContact O-N 3.1Å
932	M	86.8	Confident	82.1	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.1	-46.7	174.5	-178	-165.9	73	0	0	111.8	L829 W832 R833 I836 L883 L886 E928 F929 S930 A934 V935 L936	L829-M932 HydrophobicContact CD2-CE 4.42Å; L829-M932 HydrophobicContact CD2-SD 3.89Å; W832-M932 HydrophobicContact CG-SD 4.23Å; R833-M932 HydrophobicContact CB-CB 4.13Å; R833-M932 HydrophobicContact CB-CG 4.34Å; R833-M932 HydrophobicContact CG-CB 4.47Å; I836-M932 HydrophobicContact CD1-CG 3.84Å; L883-M932 HydrophobicContact CD1-CE 4.41Å; L886-M932 HydrophobicContact CD2-CE 3.72Å; L886-M932 HydrophobicContact CD2-SD 3.73Å; E928-M932 PolarHBondContact O-N 2.96Å; F929-M932 HydrophobicContact CD2-CE 3.74Å; F929-M932 HydrophobicContact CE2-CE 3.56Å; F929-M932 HydrophobicContact CZ-CE 4.23Å; F929-M932 WeakPolarHBondContact O-CB 3.37Å; F929-M932 PolarHBondContact O-N 2.96Å; F929-M932 VanDerWaalsContact O-N 3.17Å; S930-M932 VanDerWaalsContact C-N 3.28Å; S930-M932 PolarHBondContact O-N 2.92Å; M932-A934 VanDerWaalsContact C-N 3.33Å; M932-A934 PolarHBondContact O-N 3.2Å; M932-V935 PolarHBondContact O-N 2.83Å; M932-L936 HydrophobicContact CG-CD1 4.45Å; M932-L936 PolarHBondContact O-N 2.67Å
933	I	84.7	Confident	81.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.6	-38.2	176.5	-59.4	-58	0	0	0	111.3	L883 F929 S930 V935 L936 T937 V954 L958 A1011 L1015	L883-I933 HydrophobicContact CD1-CD1 4.24Å; F929-I933 HydrophobicContact CD1-CG1 4.25Å; F929-I933 HydrophobicContact CE1-CD1 4.27Å; F929-I933 HydrophobicContact CE1-CG1 3.88Å; F929-I933 HydrophobicContact CZ-CD1 4.14Å; F929-I933 HydrophobicContact CZ-CG1 4.24Å; F929-I933 WeakPolarHBondContact O-CG1 2.91Å; F929-I933 PolarHBondContact O-N 3.27Å; S930-I933 PolarHBondContact O-N 3.37Å; I933-V935 VanDerWaalsContact C-N 3.29Å; I933-V935 PolarHBondContact O-N 3.39Å; I933-L936 HydrophobicContact CD1-CD1 4.07Å; I933-L936 PolarHBondContact O-N 3.31Å; I933-T937 HydrophobicContact CG2-CG2 4.29Å; I933-T937 WeakPolarHBondContact O-CG2 3.34Å; I933-T937 PolarHBondContact O-N 3.18Å; I933-T937 PolarHBondContact O-OG1 2.84Å; I933-V954 HydrophobicContact CD1-CG1 3.87Å; I933-V954 HydrophobicContact CD1-CG2 4.27Å; I933-V954 HydrophobicContact CG1-CG1 4.14Å; I933-V954 HydrophobicContact CG2-CG1 4.03Å; I933-L958 HydrophobicContact CG1-CD2 4.35Å; I933-L958 HydrophobicContact CG2-CD1 4.31Å; I933-A1011 HydrophobicContact CB-CB 4.14Å; I933-A1011 HydrophobicContact CG2-CB 4.13Å; I933-L1015 HydrophobicContact CG2-CD1 4.03Å; I933-L1015 HydrophobicContact CG2-CD2 4.23Å; I933-L1015 HydrophobicContact CG2-CG 4.12Å
934	A	83.1	Confident	80.7	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-36.5	175.6	0	0	0	0	0	112.3	S930 G931 M932 T937 Q938 R1010 A1011	S930-A934 WeakPolarHBondContact O-CB 3.45Å; S930-A934 PolarHBondContact O-N 2.88Å; G931-A934 PolarHBondContact O-N 2.81Å; M932-A934 VanDerWaalsContact C-N 3.33Å; M932-A934 PolarHBondContact O-N 3.2Å; A934-T937 WeakPolarHBondContact CA-OG1 3.35Å; A934-T937 PolarHBondContact O-OG1 3.26Å; A934-Q938 VanDerWaalsContact O-CG 3.22Å; A934-Q938 WeakPolarHBondContact O-CG 3.2Å; A934-Q938 PolarHBondContact O-N 2.97Å; A934-R1010 HydrophobicContact CB-CB 4.47Å; A934-R1010 HydrophobicContact CB-CG 3.94Å; A934-A1011 HydrophobicContact CB-CB 4.26Å
935	V	81.1	Confident	79.9	Confident	22 Å²	22	32.2 Å²	32.2	13%	0.133	16%	0.16	C	C	.	.	H	α-helix	trans	-71.4	-44.1	173.8	170.7	0	0	0	0	111.2	R833 I836 V837 G931 M932 I933 T937 Q938 R939	R833-V935 HydrophobicContact CG-CB 4.31Å; R833-V935 HydrophobicContact CG-CG2 3.83Å; I836-V935 HydrophobicContact CB-CG1 4.27Å; I836-V935 HydrophobicContact CG2-CG1 3.75Å; V837-V935 HydrophobicContact CB-CG1 4.22Å; V837-V935 HydrophobicContact CG2-CB 4.18Å; V837-V935 HydrophobicContact CG2-CG1 3.41Å; V837-V935 VanDerWaalsContact CG2-CG1 3.41Å; V837-V935 HydrophobicContact CG2-CG2 3.68Å; G931-V935 WeakPolarHBondContact O-CG2 3.43Å; G931-V935 PolarHBondContact O-N 3.28Å; G931-V935 VanDerWaalsContact O-N 3.1Å; M932-V935 PolarHBondContact O-N 2.83Å; I933-V935 VanDerWaalsContact C-N 3.29Å; I933-V935 PolarHBondContact O-N 3.39Å; V935-T937 VanDerWaalsContact C-N 3.26Å; V935-T937 PolarHBondContact O-N 2.92Å; V935-Q938 PolarHBondContact O-N 2.87Å; V935-Q938 VanDerWaalsContact O-N 3.11Å; V935-R939 PolarHBondContact O-N 3.29Å
936	L	82.3	Confident	79	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-56.8	-43.1	177.3	-77.1	166.8	0	0	0	111.5	I836 L883 M932 I933 Q938 R939 I942 R1018	I836-L936 HydrophobicContact CD1-CD1 4.11Å; I836-L936 HydrophobicContact CD1-CD2 3.68Å; I836-L936 HydrophobicContact CD1-CG 3.8Å; I836-L936 HydrophobicContact CG1-CD2 4.1Å; I836-L936 HydrophobicContact CG2-CD2 3.59Å; I836-L936 HydrophobicContact CG2-CG 4.08Å; L883-L936 HydrophobicContact CD1-CD1 4.12Å; M932-L936 HydrophobicContact CG-CD1 4.45Å; M932-L936 PolarHBondContact O-N 2.67Å; I933-L936 HydrophobicContact CD1-CD1 4.07Å; I933-L936 PolarHBondContact O-N 3.31Å; L936-Q938 VanDerWaalsContact C-N 3.29Å; L936-Q938 PolarHBondContact O-N 3.32Å; L936-R939 PolarHBondContact O-N 2.6Å; L936-I942 HydrophobicContact CD2-CD1 3.76Å; L936-R1018 PolarHBondContact O-NH1 3.39Å
937	T	80.2	Confident	78	Confident	15 Å²	15	43.7 Å²	43.7	9%	0.092	22%	0.221	C	C	.	.	H	α-helix	trans	-68.8	-24.9	179.6	50.1	0	0	0	0	113.6	I933 A934 V935 W944 L1015 R1018	I933-T937 HydrophobicContact CG2-CG2 4.29Å; I933-T937 WeakPolarHBondContact O-CG2 3.34Å; I933-T937 PolarHBondContact O-N 3.18Å; I933-T937 PolarHBondContact O-OG1 2.84Å; A934-T937 WeakPolarHBondContact CA-OG1 3.35Å; A934-T937 PolarHBondContact O-OG1 3.26Å; V935-T937 VanDerWaalsContact C-N 3.26Å; V935-T937 PolarHBondContact O-N 2.92Å; T937-W944 HydrophobicContact CG2-CH2 4.5Å; T937-W944 HydrophobicContact CG2-CZ3 3.95Å; T937-L1015 HydrophobicContact CG2-CD2 3.84Å; T937-L1015 HydrophobicContact CG2-CG 3.93Å; T937-R1018 PolarHBondContact O-NH1 3.38Å
938	Q	80	Confident	77.4	Confident	107 Å²	107	42.3 Å²	42.3	50%	0.5	21%	0.214	S	C	.	.	H	α-helix	trans	-79.8	-19	176.5	-74.2	176.8	-9.3	0	0	113.7	A934 V935 L936 E940 R1010	A934-Q938 VanDerWaalsContact O-CG 3.22Å; A934-Q938 WeakPolarHBondContact O-CG 3.2Å; A934-Q938 PolarHBondContact O-N 2.97Å; V935-Q938 PolarHBondContact O-N 2.87Å; V935-Q938 VanDerWaalsContact O-N 3.11Å; L936-Q938 VanDerWaalsContact C-N 3.29Å; L936-Q938 PolarHBondContact O-N 3.32Å; Q938-E940 PolarHBondContact O-N 2.88Å; Q938-R1010 VanDerWaalsContact CD-NH2 3.33Å; Q938-R1010 VanDerWaalsContact NE2-CZ 3.3Å
939	R	75.5	Confident	76.9	Confident	25 Å²	25	50.7 Å²	50.7	9%	0.094	25%	0.247	C	C	.	.			trans	-83.1	100.1	177.9	-83.3	-167.6	66.4	-174.9	2.8	112	I836 W841 V935 L936 D941 I942 R1018	I836-R939 VanDerWaalsContact O-CD 3.25Å; I836-R939 WeakPolarHBondContact O-CD 3.35Å; I836-R939 PolarHBondContact O-NH1 3.21Å; W841-R939 PolarHBondContact O-NH1 3.12Å; V935-R939 PolarHBondContact O-N 3.29Å; L936-R939 PolarHBondContact O-N 2.6Å; R939-D941 VanDerWaalsContact CB-OD1 3.32Å; R939-D941 WeakPolarHBondContact CB-OD1 3.33Å; R939-D941 IonicContact CZ-OD1 3.22Å; R939-D941 IonicContact CZ-OD2 3.25Å; R939-D941 IonicContact NE-OD1 3.81Å; R939-D941 PolarHBondContact NE-OD1 3.12Å; R939-D941 IonicContact NE-OD2 3.98Å; R939-D941 PolarHBondContact NE-OD2 3.04Å; R939-D941 IonicContact NH2-OD1 2.82Å; R939-D941 IonicContact NH2-OD2 3.03Å; R939-D941 PolarHBondContact NH2-OD2 3.32Å; R939-D941 PolarHBondContact O-N 3.22Å; R939-I942 HydrophobicContact CB-CD1 3.77Å; R939-I942 HydrophobicContact CB-CG1 4.09Å; R939-I942 HydrophobicContact CG-CD1 4.45Å; R939-I942 PolarHBondContact O-N 2.86Å; R939-R1018 VanDerWaalsContact O-CZ 3.31Å; R939-R1018 PolarHBondContact O-NH1 3.23Å; R939-R1018 PolarHBondContact O-NH2 2.85Å
940	E	69	Low	76.3	Confident	192 Å²	192	50.7 Å²	50.7	90%	0.897	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.5	179.3	-62	-175.4	172.7	0	0	113.2	Q938 I942	Q938-E940 PolarHBondContact O-N 2.88Å; E940-I942 VanDerWaalsContact C-N 3.34Å
941	D	68.6	Low	76	Confident	75 Å²	75	50.7 Å²	50.7	40%	0.401	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-18.1	-177.3	62.5	-55.5	0	0	0	114.1	R939 I943	R939-D941 VanDerWaalsContact CB-OD1 3.32Å; R939-D941 WeakPolarHBondContact CB-OD1 3.33Å; R939-D941 IonicContact CZ-OD1 3.22Å; R939-D941 IonicContact CZ-OD2 3.25Å; R939-D941 IonicContact NE-OD1 3.81Å; R939-D941 PolarHBondContact NE-OD1 3.12Å; R939-D941 IonicContact NE-OD2 3.98Å; R939-D941 PolarHBondContact NE-OD2 3.04Å; R939-D941 IonicContact NH2-OD1 2.82Å; R939-D941 IonicContact NH2-OD2 3.03Å; R939-D941 PolarHBondContact NH2-OD2 3.32Å; R939-D941 PolarHBondContact O-N 3.22Å; D941-I943 PolarHBondContact O-N 3.43Å
942	I	68.4	Low	75.7	Confident	13 Å²	13	57.2 Å²	57.2	7%	0.067	27%	0.271	C	S	.	.	S	Bend	trans	-83.5	116.8	178.8	-63.6	173	0	0	0	109	I836 P842 H845 L936 R939 E940 R1018	I836-I942 HydrophobicContact CG2-CD1 4.42Å; P842-I942 WeakPolarHBondContact O-CD1 3.28Å; P842-I942 WeakPolarHBondContact O-CG1 3.24Å; H845-I942 WeakPolarHBondContact CD2-CG2 3.43Å; L936-I942 HydrophobicContact CD2-CD1 3.76Å; R939-I942 HydrophobicContact CB-CD1 3.77Å; R939-I942 HydrophobicContact CB-CG1 4.09Å; R939-I942 HydrophobicContact CG-CD1 4.45Å; R939-I942 PolarHBondContact O-N 2.86Å; E940-I942 VanDerWaalsContact C-N 3.34Å; I942-R1018 VanDerWaalsContact CB-NH2 3.34Å; I942-R1018 PolarHBondContact O-NH2 3.07Å
943	I	67	Low	75.5	Confident	136 Å²	136	59.9 Å²	59.9	70%	0.697	28%	0.283	S	S	*	.			trans	-84.3	124.2	177.7	-58.1	173.6	0	0	0	109.1	D941 P945	D941-I943 PolarHBondContact O-N 3.43Å; I943-P945 VanDerWaalsContact O-CD 3.29Å; I943-P945 WeakPolarHBondContact O-CD 3.44Å
944	W	72.6	Confident	75.6	Confident	23 Å²	23	59.9 Å²	59.9	9%	0.087	28%	0.283	C	S	.	.			trans	-106.5	97	174.7	-124.8	-2.6	0	0	0	110.3	H845 L883 T937 V954 L1015 R1018 H1019	H845-W944 AromaticContact CD2-CD1 3.19Å; H845-W944 AromaticContact CD2-NE1 3.26Å; H845-W944 PolarHBondContact CD2-NE1 3.04Å; H845-W944 VanDerWaalsContact CD2-NE1 3.26Å; H845-W944 AromaticContact CE1-CE2 3.98Å; H845-W944 AromaticContact CE1-NE1 3.3Å; H845-W944 PolarHBondContact CE1-NE1 3.42Å; H845-W944 VanDerWaalsContact CE1-NE1 3.3Å; H845-W944 AromaticContact CG-CD1 3.46Å; H845-W944 VanDerWaalsContact CG-CD1 3.46Å; H845-W944 AromaticContact CG-NE1 3.44Å; H845-W944 AromaticContact ND1-CD1 3.95Å; H845-W944 AromaticContact ND1-NE1 3.42Å; H845-W944 PolarHBondContact ND1-NE1 3.09Å; H845-W944 AromaticContact NE2-CD1 3.59Å; H845-W944 AromaticContact NE2-CE2 3.7Å; H845-W944 AromaticContact NE2-NE1 3.15Å; H845-W944 PolarHBondContact NE2-NE1 3.35Å; H845-W944 VanDerWaalsContact NE2-NE1 3.15Å; L883-W944 HydrophobicContact CD2-CZ2 3.44Å; L883-W944 VanDerWaalsContact CD2-CZ2 3.44Å; T937-W944 HydrophobicContact CG2-CH2 4.5Å; T937-W944 HydrophobicContact CG2-CZ3 3.95Å; W944-V954 HydrophobicContact CH2-CG1 4.47Å; W944-V954 HydrophobicContact CH2-CG2 4.45Å; W944-V954 HydrophobicContact CZ2-CG2 4.02Å; W944-L1015 HydrophobicContact CE3-CD2 4.46Å; W944-L1015 HydrophobicContact CH2-CD2 3.45Å; W944-L1015 VanDerWaalsContact CH2-CD2 3.45Å; W944-L1015 HydrophobicContact CZ3-CD2 3.29Å; W944-R1018 HydrophobicContact CE3-CG 4.43Å; W944-H1019 AromaticContact CD2-NE2 3.6Å; W944-H1019 AromaticContact CE3-CD2 3.97Å; W944-H1019 AromaticContact CE3-CE1 3.52Å; W944-H1019 AromaticContact CE3-NE2 2.88Å; W944-H1019 AromaticContact CZ3-CE1 3.51Å; W944-H1019 AromaticContact CZ3-NE2 3.37Å; W944-H1019 WeakPolarHBondContact CZ3-NE2 3.34Å
945	P	67.8	Low	75.7	Confident	16 Å²	16	59.9 Å²	59.9	10%	0.104	28%	0.283	C	S	.	.			trans	-70.4	137.6	-178.8	26.1	-32	0	0	0	111.2	Y847 I943 N947 C948	Y847-P945 HydrophobicContact CD2-CG 3.97Å; Y847-P945 HydrophobicContact CE2-CB 3.66Å; Y847-P945 HydrophobicContact CE2-CG 3.54Å; I943-P945 VanDerWaalsContact O-CD 3.29Å; I943-P945 WeakPolarHBondContact O-CD 3.44Å; P945-N947 PolarHBondContact O-N 2.87Å; P945-N947 VanDerWaalsContact O-N 3.11Å; P945-C948 HydrophobicContact CG-CB 4.07Å; P945-C948 WeakPolarHBondContact O-CB 3.49Å; P945-C948 PolarHBondContact O-N 3.33Å
946	D	67.6	Low	75.9	Confident	99 Å²	99	60.8 Å²	60.8	53%	0.529	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.1	178.8	-68	-40.5	0	0	0	113.3	C948 K951	D946-C948 VanDerWaalsContact C-N 3.29Å; D946-C948 PolarHBondContact O-N 3.48Å; D946-K951 IonicContact OD1-NZ 3.85Å; D946-K951 PolarHBondContact OD1-NZ 3.02Å
947	N	69.8	Low	76.1	Confident	143 Å²	143	60.7 Å²	60.7	77%	0.765	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-7.3	179.1	-62.9	-18.1	0	0	0	113.6	P945 Y949	P945-N947 PolarHBondContact O-N 2.87Å; P945-N947 VanDerWaalsContact O-N 3.11Å; N947-Y949 PolarHBondContact O-N 3Å
948	C	73.4	Confident	76.4	Confident	5 Å²	5	60 Å²	60	3%	0.034	29%	0.286	C	S	.	.			trans	-77.5	121.4	-179.7	-173.8	0	0	0	0	111.7	C846 C881 P945 D946 C950 K951	C846-C948 HydrophobicContact CB-CB 3.98Å; C881-C948 VanDerWaalsContact SG-SG 3.66Å; P945-C948 HydrophobicContact CG-CB 4.07Å; P945-C948 WeakPolarHBondContact O-CB 3.49Å; P945-C948 PolarHBondContact O-N 3.33Å; D946-C948 VanDerWaalsContact C-N 3.29Å; D946-C948 PolarHBondContact O-N 3.48Å; C948-C950 HydrophobicContact CB-CB 4.45Å; C948-C950 WeakPolarHBondContact CB-SG 3.31Å; C948-C950 PolarHBondContact O-N 3.47Å; C948-C950 VanDerWaalsContact O-N 3.08Å; C948-C950 WeakPolarHBondContact SG-CB 3.39Å; C948-C950 PolarHBondContact SG-N 3.47Å; C948-C950 CovalentContact SG-SG 2.05Å; C948-C950 PolarHBondContact SG-SG 3.21Å; C948-K951 WeakPolarHBondContact O-CB 3.2Å; C948-K951 PolarHBondContact O-N 3.44Å
949	Y	75.7	Confident	76.7	Confident	187 Å²	187	55.2 Å²	55.2	73%	0.733	26%	0.264	S	S	*	.	H	α-helix	trans	-57.9	-22.6	171.4	-67.5	-76.4	0	0	0	113.6	N947 K951 R952 Q953	N947-Y949 PolarHBondContact O-N 3Å; Y949-K951 PolarHBondContact O-N 3.4Å; Y949-R952 PolarHBondContact O-N 3.39Å; Y949-Q953 PolarHBondContact O-N 3.22Å; Y949-Q953 VanDerWaalsContact O-N 3.08Å
950	C	77.6	Confident	77.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-55.3	-35.7	172.9	59.7	0	0	0	0	112.9	C881 L883 L884 C948 R952 Q953 V954	C881-C950 HydrophobicContact CB-CB 4.43Å; C881-C950 WeakPolarHBondContact SG-CB 3.35Å; L883-C950 HydrophobicContact CB-CB 4.45Å; L883-C950 HydrophobicContact CD2-CB 4.21Å; L884-C950 HydrophobicContact CB-CB 4.03Å; C948-C950 HydrophobicContact CB-CB 4.45Å; C948-C950 WeakPolarHBondContact CB-SG 3.31Å; C948-C950 PolarHBondContact O-N 3.47Å; C948-C950 VanDerWaalsContact O-N 3.08Å; C948-C950 WeakPolarHBondContact SG-CB 3.39Å; C948-C950 PolarHBondContact SG-N 3.47Å; C948-C950 CovalentContact SG-SG 2.05Å; C948-C950 PolarHBondContact SG-SG 3.21Å; C950-R952 PolarHBondContact O-N 3.25Å; C950-Q953 PolarHBondContact O-N 3.03Å; C950-V954 VanDerWaalsContact O-CG2 3.24Å; C950-V954 WeakPolarHBondContact O-CG2 3.43Å; C950-V954 PolarHBondContact O-N 2.86Å
951	K	79.5	Confident	78	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.7	-53.9	-180	-170.8	175.4	-177.7	-171.8	0	110.6	D946 C948 Y949 Q953 V954 Y955 H1019 S1023 Y1027	D946-K951 IonicContact OD1-NZ 3.85Å; D946-K951 PolarHBondContact OD1-NZ 3.02Å; C948-K951 WeakPolarHBondContact O-CB 3.2Å; C948-K951 PolarHBondContact O-N 3.44Å; Y949-K951 PolarHBondContact O-N 3.4Å; K951-Q953 VanDerWaalsContact C-N 3.34Å; K951-Q953 PolarHBondContact O-N 3.38Å; K951-V954 PolarHBondContact O-N 3Å; K951-Y955 HydrophobicContact CG-CE2 4.29Å; K951-Y955 WeakPolarHBondContact O-CD2 3.43Å; K951-H1019 WeakPolarHBondContact CE-CD2 3.34Å; K951-H1019 VanDerWaalsContact CE-CE1 3.47Å; K951-H1019 WeakPolarHBondContact CE-CE1 3.32Å; K951-H1019 VanDerWaalsContact CE-ND1 3.26Å; K951-H1019 WeakPolarHBondContact CE-ND1 3.48Å; K951-H1019 WeakPolarHBondContact CE-NE2 3.36Å; K951-S1023 PolarHBondContact NZ-OG 3.21Å; K951-Y1027 HydrophobicContact CD-CD2 4.46Å; K951-Y1027 HydrophobicContact CD-CE2 3.59Å; K951-Y1027 HydrophobicContact CG-CD2 4.44Å; K951-Y1027 HydrophobicContact CG-CE2 3.95Å
952	R	79.3	Confident	78.8	Confident	141 Å²	141	44.5 Å²	44.5	53%	0.532	21%	0.212	S	C	.	.	H	α-helix	trans	-61.9	-41.3	176.3	-174.6	178.4	-179.8	-176.7	0.9	111.9	Y949 C950 V954 Y955 S956 Y1027	Y949-R952 PolarHBondContact O-N 3.39Å; C950-R952 PolarHBondContact O-N 3.25Å; R952-V954 VanDerWaalsContact C-N 3.33Å; R952-V954 PolarHBondContact O-N 2.97Å; R952-Y955 PolarHBondContact O-N 2.88Å; R952-S956 PolarHBondContact O-N 2.94Å; R952-S956 VanDerWaalsContact O-N 3.07Å; R952-Y1027 HydrophobicContact CB-CD1 4.03Å; R952-Y1027 HydrophobicContact CB-CE1 4.02Å; R952-Y1027 HydrophobicContact CG-CD1 4.22Å
953	Q	83	Confident	79.6	Confident	55 Å²	55	47.1 Å²	47.1	26%	0.257	23%	0.229	S	C	.	.	H	α-helix	trans	-65.6	-35.5	-178.9	-165.4	65.5	28	0	0	112.1	L884 C887 Y949 C950 K951 S956 T957	L884-Q953 HydrophobicContact CD1-CB 3.56Å; L884-Q953 HydrophobicContact CD1-CG 3.81Å; C887-Q953 HydrophobicContact CB-CB 4.37Å; C887-Q953 HydrophobicContact CB-CG 3.59Å; Y949-Q953 PolarHBondContact O-N 3.22Å; Y949-Q953 VanDerWaalsContact O-N 3.08Å; C950-Q953 PolarHBondContact O-N 3.03Å; K951-Q953 VanDerWaalsContact C-N 3.34Å; K951-Q953 PolarHBondContact O-N 3.38Å; Q953-S956 PolarHBondContact O-N 3.44Å; Q953-T957 WeakPolarHBondContact O-CB 3.48Å; Q953-T957 PolarHBondContact O-N 3.48Å; Q953-T957 PolarHBondContact O-OG1 3.45Å
954	V	85.7	Confident	80.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-48.9	175.8	170.5	0	0	0	0	111.6	L883 I933 W944 C950 K951 R952 S956 T957 L958 L1015	L883-V954 HydrophobicContact CD1-CG2 4.46Å; L883-V954 HydrophobicContact CD2-CG2 3.55Å; L883-V954 HydrophobicContact CG-CG2 4.09Å; I933-V954 HydrophobicContact CD1-CG1 3.87Å; I933-V954 HydrophobicContact CD1-CG2 4.27Å; I933-V954 HydrophobicContact CG1-CG1 4.14Å; I933-V954 HydrophobicContact CG2-CG1 4.03Å; W944-V954 HydrophobicContact CH2-CG1 4.47Å; W944-V954 HydrophobicContact CH2-CG2 4.45Å; W944-V954 HydrophobicContact CZ2-CG2 4.02Å; C950-V954 VanDerWaalsContact O-CG2 3.24Å; C950-V954 WeakPolarHBondContact O-CG2 3.43Å; C950-V954 PolarHBondContact O-N 2.86Å; K951-V954 PolarHBondContact O-N 3Å; R952-V954 VanDerWaalsContact C-N 3.33Å; R952-V954 PolarHBondContact O-N 2.97Å; V954-S956 VanDerWaalsContact C-N 3.33Å; V954-S956 PolarHBondContact O-N 3.41Å; V954-T957 PolarHBondContact O-N 2.74Å; V954-L958 HydrophobicContact CG1-CD1 3.94Å; V954-L958 HydrophobicContact CG1-CG 4.38Å; V954-L958 WeakPolarHBondContact O-CB 3.47Å; V954-L958 WeakPolarHBondContact O-CG 3.47Å; V954-L958 PolarHBondContact O-N 2.84Å; V954-L1015 HydrophobicContact CG1-CD1 4.14Å; V954-L1015 HydrophobicContact CG1-CD2 4.39Å
955	Y	85.2	Confident	80.7	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-60.5	-45.8	177.1	-71.6	-80.5	0	0	0	110.9	K951 R952 T957 L958 V959 L1012 L1015 H1019 F1024 Y1027 T1028	K951-Y955 HydrophobicContact CG-CE2 4.29Å; K951-Y955 WeakPolarHBondContact O-CD2 3.43Å; R952-Y955 PolarHBondContact O-N 2.88Å; Y955-T957 PolarHBondContact O-N 3.45Å; Y955-L958 PolarHBondContact O-N 3.16Å; Y955-V959 WeakPolarHBondContact O-CG2 3.43Å; Y955-V959 PolarHBondContact O-N 3.12Å; Y955-L1012 HydrophobicContact CD1-CD2 4.42Å; Y955-L1015 HydrophobicContact CD1-CD1 4.18Å; Y955-L1015 HydrophobicContact CE1-CB 4.01Å; Y955-L1015 HydrophobicContact CE1-CD1 3.86Å; Y955-L1015 HydrophobicContact CE1-CG 4.44Å; Y955-H1019 AromaticContact CE2-ND1 3.68Å; Y955-H1019 AromaticContact CZ-ND1 3.65Å; Y955-H1019 PolarHBondContact OH-ND1 2.91Å; Y955-F1024 AromaticContact CE1-CD2 3.69Å; Y955-F1024 HydrophobicContact CE1-CD2 3.69Å; Y955-F1024 AromaticContact CE1-CE2 3.78Å; Y955-F1024 HydrophobicContact CE1-CE2 3.78Å; Y955-F1024 WeakPolarHBondContact OH-CD2 3.36Å; Y955-Y1027 HydrophobicContact CD2-CD2 4.32Å; Y955-Y1027 HydrophobicContact CD2-CG 4.06Å; Y955-Y1027 AromaticContact CE2-CD2 3.88Å; Y955-Y1027 HydrophobicContact CE2-CD2 3.88Å; Y955-Y1027 HydrophobicContact CE2-CG 4.08Å; Y955-T1028 HydrophobicContact CD1-CG2 4.42Å
956	S	85.8	Confident	81.4	Confident	41 Å²	41	42 Å²	42	29%	0.287	20%	0.2	S	C	.	.	H	α-helix	trans	-61.2	-45.2	178	-179.3	0	0	0	0	112.1	R952 Q953 V954 V959 H960	R952-S956 PolarHBondContact O-N 2.94Å; R952-S956 VanDerWaalsContact O-N 3.07Å; Q953-S956 PolarHBondContact O-N 3.44Å; V954-S956 VanDerWaalsContact C-N 3.33Å; V954-S956 PolarHBondContact O-N 3.41Å; S956-V959 PolarHBondContact O-N 3.29Å; S956-H960 VanDerWaalsContact O-CB 3.24Å; S956-H960 WeakPolarHBondContact O-CB 3.24Å; S956-H960 PolarHBondContact O-N 2.89Å
957	T	86	Confident	82.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.1	-45.8	177.8	-64.2	0	0	0	0	111	V890 C891 F929 Q953 V954 Y955 V959 H960 L961	V890-T957 HydrophobicContact CG1-CG2 4.46Å; C891-T957 PolarHBondContact SG-OG1 3.35Å; F929-T957 HydrophobicContact CD1-CG2 4.4Å; F929-T957 HydrophobicContact CE1-CG2 3.68Å; F929-T957 HydrophobicContact CE2-CG2 4.28Å; F929-T957 HydrophobicContact CZ-CG2 3.61Å; Q953-T957 WeakPolarHBondContact O-CB 3.48Å; Q953-T957 PolarHBondContact O-N 3.48Å; Q953-T957 PolarHBondContact O-OG1 3.45Å; V954-T957 PolarHBondContact O-N 2.74Å; Y955-T957 PolarHBondContact O-N 3.45Å; T957-V959 VanDerWaalsContact C-N 3.34Å; T957-V959 PolarHBondContact O-N 3.3Å; T957-H960 PolarHBondContact O-N 2.9Å; T957-L961 HydrophobicContact CG2-CD1 4.13Å; T957-L961 HydrophobicContact CG2-CG 4.22Å; T957-L961 VanDerWaalsContact O-CG 3.23Å; T957-L961 WeakPolarHBondContact O-CG 3.42Å; T957-L961 PolarHBondContact O-N 2.72Å
958	L	87.6	Confident	82.4	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-57.2	-48	177.4	-77.5	172.5	0	0	0	111.4	F929 I933 V954 Y955 L961 T962 L1008 L1012 L1015	F929-L958 HydrophobicContact CD1-CD2 3.65Å; F929-L958 HydrophobicContact CD1-CG 4.4Å; F929-L958 HydrophobicContact CE1-CD2 3.79Å; F929-L958 HydrophobicContact CE1-CG 4.04Å; I933-L958 HydrophobicContact CG1-CD2 4.35Å; I933-L958 HydrophobicContact CG2-CD1 4.31Å; V954-L958 HydrophobicContact CG1-CD1 3.94Å; V954-L958 HydrophobicContact CG1-CG 4.38Å; V954-L958 WeakPolarHBondContact O-CB 3.47Å; V954-L958 WeakPolarHBondContact O-CG 3.47Å; V954-L958 PolarHBondContact O-N 2.84Å; Y955-L958 PolarHBondContact O-N 3.16Å; L958-L961 PolarHBondContact O-N 3.29Å; L958-T962 VanDerWaalsContact O-CG2 3.3Å; L958-T962 WeakPolarHBondContact O-CG2 3.39Å; L958-T962 PolarHBondContact O-N 2.91Å; L958-L1008 HydrophobicContact CB-CD1 3.99Å; L958-L1008 HydrophobicContact CD2-CD1 3.9Å; L958-L1008 HydrophobicContact CG-CD1 4.37Å; L958-L1012 HydrophobicContact CD1-CD2 4.42Å; L958-L1015 HydrophobicContact CD1-CD1 3.58Å
959	V	85.8	Confident	82.7	Confident	6 Å²	6	36.1 Å²	36.1	4%	0.036	17%	0.165	C	C	.	.	H	α-helix	trans	-65.1	-44	178	176.7	0	0	0	0	110.8	Y955 S956 T957 L961 T962 L1031 D1033 Y1034	Y955-V959 WeakPolarHBondContact O-CG2 3.43Å; Y955-V959 PolarHBondContact O-N 3.12Å; S956-V959 PolarHBondContact O-N 3.29Å; T957-V959 VanDerWaalsContact C-N 3.34Å; T957-V959 PolarHBondContact O-N 3.3Å; V959-L961 VanDerWaalsContact C-N 3.32Å; V959-L961 PolarHBondContact O-N 2.89Å; V959-T962 WeakPolarHBondContact O-CB 3.49Å; V959-T962 PolarHBondContact O-N 3.01Å; V959-T962 PolarHBondContact O-OG1 3.32Å; V959-L1031 HydrophobicContact CG2-CD1 4.32Å; V959-D1033 HydrophobicContact CG1-CB 3.45Å; V959-D1033 VanDerWaalsContact CG1-CB 3.45Å; V959-Y1034 HydrophobicContact CG2-CD2 4.01Å
960	H	84.9	Confident	82.8	Confident	58 Å²	58	31 Å²	31	27%	0.269	15%	0.15	S	C	.	.	H	α-helix	trans	-60.1	-39.1	178.3	-172.6	67.6	0	0	0	113.2	N895 S956 T957 T962 T963	N895-H960 PolarHBondContact OD1-NE2 3.06Å; S956-H960 VanDerWaalsContact O-CB 3.24Å; S956-H960 WeakPolarHBondContact O-CB 3.24Å; S956-H960 PolarHBondContact O-N 2.89Å; T957-H960 PolarHBondContact O-N 2.9Å; H960-T962 PolarHBondContact O-N 3.16Å; H960-T963 PolarHBondContact O-N 3.32Å; H960-T963 PolarHBondContact O-OG1 3.05Å
961	L	87.2	Confident	82.6	Confident	6 Å²	6	35.7 Å²	35.7	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-21	176.3	-68.9	179.5	0	0	0	112.7	V890 L894 L925 L926 F929 T957 L958 V959 P965	V890-L961 HydrophobicContact CG1-CD1 4.41Å; V890-L961 HydrophobicContact CG1-CD2 4.04Å; L894-L961 HydrophobicContact CD2-CD2 3.4Å; L894-L961 VanDerWaalsContact CD2-CD2 3.4Å; L925-L961 HydrophobicContact CD2-CD2 3.8Å; L925-L961 HydrophobicContact CG-CD2 4.18Å; L926-L961 HydrophobicContact CB-CB 4.47Å; L926-L961 HydrophobicContact CD1-CB 3.77Å; F929-L961 HydrophobicContact CB-CD1 3.73Å; F929-L961 HydrophobicContact CD1-CD1 3.4Å; F929-L961 HydrophobicContact CD2-CD1 4.49Å; F929-L961 HydrophobicContact CE1-CD1 4.13Å; F929-L961 HydrophobicContact CG-CD1 3.62Å; T957-L961 HydrophobicContact CG2-CD1 4.13Å; T957-L961 HydrophobicContact CG2-CG 4.22Å; T957-L961 VanDerWaalsContact O-CG 3.23Å; T957-L961 WeakPolarHBondContact O-CG 3.42Å; T957-L961 PolarHBondContact O-N 2.72Å; L958-L961 PolarHBondContact O-N 3.29Å; V959-L961 VanDerWaalsContact C-N 3.32Å; V959-L961 PolarHBondContact O-N 2.89Å; L961-P965 WeakPolarHBondContact O-CD 3.43Å; L961-P965 WeakPolarHBondContact O-CG 3.25Å
962	T	85.5	Confident	82.1	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-83.6	-20.1	-177.1	65.2	0	0	0	0	114.7	L926 L958 V959 H960 Y964 P965 L966 F1005 L1008 L1037	L926-T962 HydrophobicContact CD1-CG2 3.78Å; L926-T962 HydrophobicContact CD2-CG2 3.96Å; L958-T962 VanDerWaalsContact O-CG2 3.3Å; L958-T962 WeakPolarHBondContact O-CG2 3.39Å; L958-T962 PolarHBondContact O-N 2.91Å; V959-T962 WeakPolarHBondContact O-CB 3.49Å; V959-T962 PolarHBondContact O-N 3.01Å; V959-T962 PolarHBondContact O-OG1 3.32Å; H960-T962 PolarHBondContact O-N 3.16Å; T962-Y964 VanDerWaalsContact C-N 3.33Å; T962-Y964 PolarHBondContact O-N 3.07Å; T962-P965 WeakPolarHBondContact O-CD 3.41Å; T962-L966 WeakPolarHBondContact O-CB 3.01Å; T962-L966 PolarHBondContact O-N 3.05Å; T962-F1005 HydrophobicContact CG2-CE1 4.1Å; T962-L1008 HydrophobicContact CG2-CD1 4.2Å; T962-L1008 HydrophobicContact CG2-CD2 3.36Å; T962-L1008 HydrophobicContact CG2-CG 4.36Å; T962-L1037 HydrophobicContact CG2-CD1 4.2Å; T962-L1037 HydrophobicContact CG2-CD2 4.02Å
963	T	84.2	Confident	81.4	Confident	67 Å²	67	32.3 Å²	32.3	41%	0.411	17%	0.174	S	C	.	.	H	α-helix	trans	-52.1	-49	-173	-53.3	0	0	0	0	112.4	H960 Q967	H960-T963 PolarHBondContact O-N 3.32Å; H960-T963 PolarHBondContact O-OG1 3.05Å; T963-Q967 WeakPolarHBondContact O-CB 3.39Å; T963-Q967 PolarHBondContact O-N 3.36Å; T963-Q967 VanDerWaalsContact O-N 3.1Å
964	Y	81.3	Confident	80.3	Confident	54 Å²	54	31.4 Å²	31.4	21%	0.212	17%	0.173	C	C	.	.	H	α-helix	trans	-76.8	-49.1	-179.9	-72.4	-79.6	0	0	0	113.9	N898 T962 L966 Q967 T968	N898-Y964 HydrophobicContact CB-CE2 4.23Å; N898-Y964 WeakPolarHBondContact ND2-CE2 3.08Å; N898-Y964 WeakPolarHBondContact OD1-CE2 3.49Å; T962-Y964 VanDerWaalsContact C-N 3.33Å; T962-Y964 PolarHBondContact O-N 3.07Å; Y964-L966 PolarHBondContact O-N 2.91Å; Y964-Q967 WeakPolarHBondContact O-CB 3.42Å; Y964-Q967 PolarHBondContact O-N 3.46Å; Y964-Q967 VanDerWaalsContact O-N 3.12Å; Y964-T968 PolarHBondContact O-N 2.89Å; Y964-T968 PolarHBondContact O-OG1 3.46Å; Y964-T968 VanDerWaalsContact O-OG1 3.12Å
965	P	83	Confident	78.7	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-53.7	-35.8	173.2	-29.9	37.1	0	0	0	113.6	I923 L926 L961 T962 T968 L969 F1005	I923-P965 HydrophobicContact CG1-CB 4.13Å; I923-P965 HydrophobicContact CG1-CG 4.18Å; L926-P965 HydrophobicContact CB-CG 4.36Å; L926-P965 HydrophobicContact CD2-CB 4Å; L926-P965 HydrophobicContact CD2-CG 3.92Å; L961-P965 WeakPolarHBondContact O-CD 3.43Å; L961-P965 WeakPolarHBondContact O-CG 3.25Å; T962-P965 WeakPolarHBondContact O-CD 3.41Å; P965-T968 PolarHBondContact O-N 3.27Å; P965-L969 WeakPolarHBondContact O-CB 3.27Å; P965-L969 PolarHBondContact O-N 3.46Å; P965-F1005 HydrophobicContact CB-CE2 4.29Å; P965-F1005 HydrophobicContact CB-CZ 4.05Å
966	L	82	Confident	77.1	Confident	13 Å²	13	35.8 Å²	35.8	7%	0.068	20%	0.202	C	C	.	.	H	α-helix	trans	-68.8	-47.3	176.1	-177.6	65.2	0	0	0	111.1	T962 Y964 T968 L969 L970 F1005 L1037 N1040 L1041	T962-L966 WeakPolarHBondContact O-CB 3.01Å; T962-L966 PolarHBondContact O-N 3.05Å; Y964-L966 PolarHBondContact O-N 2.91Å; L966-T968 VanDerWaalsContact C-N 3.28Å; L966-T968 PolarHBondContact O-N 3.32Å; L966-L969 PolarHBondContact O-N 3.13Å; L966-L969 VanDerWaalsContact O-N 3.13Å; L966-L970 HydrophobicContact CD1-CD1 4.44Å; L966-L970 HydrophobicContact CD1-CG 4.45Å; L966-L970 HydrophobicContact CG-CD1 4.14Å; L966-L970 VanDerWaalsContact O-CG 3.31Å; L966-L970 WeakPolarHBondContact O-CG 3.42Å; L966-L970 PolarHBondContact O-N 3.42Å; L966-F1005 HydrophobicContact CB-CZ 3.93Å; L966-F1005 HydrophobicContact CD1-CZ 4.22Å; L966-L1037 HydrophobicContact CD1-CD1 4.3Å; L966-L1037 HydrophobicContact CD2-CD1 3.92Å; L966-L1037 HydrophobicContact CG-CD1 4.5Å; L966-N1040 HydrophobicContact CD1-CB 4.07Å; L966-N1040 HydrophobicContact CD2-CB 3.97Å; L966-N1040 HydrophobicContact CG-CB 4.37Å; L966-L1041 HydrophobicContact CD1-CD2 3.8Å; L966-L1041 HydrophobicContact CD1-CG 3.97Å
967	Q	80.7	Confident	75.3	Confident	112 Å²	112	35 Å²	35	52%	0.523	20%	0.195	S	C	.	.	H	α-helix	trans	-56.4	-45.3	173.8	-172	-178.4	8.5	0	0	110.9	T963 Y964 L969 L970 T971	T963-Q967 WeakPolarHBondContact O-CB 3.39Å; T963-Q967 PolarHBondContact O-N 3.36Å; T963-Q967 VanDerWaalsContact O-N 3.1Å; Y964-Q967 WeakPolarHBondContact O-CB 3.42Å; Y964-Q967 PolarHBondContact O-N 3.46Å; Y964-Q967 VanDerWaalsContact O-N 3.12Å; Q967-L969 VanDerWaalsContact C-N 3.34Å; Q967-L969 PolarHBondContact O-N 3.48Å; Q967-L970 PolarHBondContact O-N 3.49Å; Q967-T971 WeakPolarHBondContact O-CG2 3.27Å; Q967-T971 PolarHBondContact O-N 3.05Å; Q967-T971 PolarHBondContact O-OG1 3Å
968	T	77.6	Confident	73.1	Confident	11 Å²	11	38.1 Å²	38.1	7%	0.067	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-39.9	175.9	-57.1	0	0	0	0	112.2	I923 Y964 P965 L966 L970 T971 I972	I923-T968 HydrophobicContact CD1-CG2 4.46Å; Y964-T968 PolarHBondContact O-N 2.89Å; Y964-T968 PolarHBondContact O-OG1 3.46Å; Y964-T968 VanDerWaalsContact O-OG1 3.12Å; P965-T968 PolarHBondContact O-N 3.27Å; L966-T968 VanDerWaalsContact C-N 3.28Å; L966-T968 PolarHBondContact O-N 3.32Å; T968-L970 VanDerWaalsContact C-N 3.35Å; T968-T971 PolarHBondContact O-N 3.14Å; T968-T971 PolarHBondContact O-OG1 3.09Å; T968-T971 VanDerWaalsContact O-OG1 3.05Å; T968-I972 HydrophobicContact CG2-CD1 4.47Å; T968-I972 WeakPolarHBondContact O-CD1 3.46Å; T968-I972 VanDerWaalsContact O-CG1 3.27Å; T968-I972 WeakPolarHBondContact O-CG1 3.44Å; T968-I972 PolarHBondContact O-N 2.89Å
969	L	79.4	Confident	70.7	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-65.5	-39.4	177.1	-175.2	66.6	0	0	0	111.9	P965 L966 Q967 Q998 C1001 F1005 L1041 W1044	P965-L969 WeakPolarHBondContact O-CB 3.27Å; P965-L969 PolarHBondContact O-N 3.46Å; L966-L969 PolarHBondContact O-N 3.13Å; L966-L969 VanDerWaalsContact O-N 3.13Å; Q967-L969 VanDerWaalsContact C-N 3.34Å; Q967-L969 PolarHBondContact O-N 3.48Å; L969-Q998 HydrophobicContact CD1-CG 4.25Å; L969-C1001 HydrophobicContact CB-CB 4.41Å; L969-C1001 HydrophobicContact CD1-CB 4.03Å; L969-F1005 HydrophobicContact CB-CE2 4.29Å; L969-F1005 HydrophobicContact CD2-CD2 4.03Å; L969-F1005 HydrophobicContact CD2-CE2 3.81Å; L969-L1041 HydrophobicContact CD2-CD2 3.88Å; L969-W1044 HydrophobicContact CD1-CD2 4.39Å; L969-W1044 HydrophobicContact CD1-CH2 4.33Å; L969-W1044 HydrophobicContact CD1-CZ2 3.66Å; L969-W1044 HydrophobicContact CD2-CD2 3.92Å; L969-W1044 HydrophobicContact CD2-CE3 4.24Å; L969-W1044 HydrophobicContact CD2-CG 4.19Å; L969-W1044 HydrophobicContact CG-CD2 4.09Å; L969-W1044 HydrophobicContact CG-CG 4.25Å; L969-W1044 HydrophobicContact CG-CZ2 4.25Å; L969-W1044 PolarHBondContact O-NE1 3.37Å
970	L	77.5	Confident	68.5	Low	80 Å²	80	43.4 Å²	43.4	42%	0.419	25%	0.254	S	S	.	.	H	α-helix	trans	-74.9	-25.9	179.9	-66.8	174.3	0	0	0	113.3	L966 Q967 T968 N1040 W1044	L966-L970 HydrophobicContact CD1-CD1 4.44Å; L966-L970 HydrophobicContact CD1-CG 4.45Å; L966-L970 HydrophobicContact CG-CD1 4.14Å; L966-L970 VanDerWaalsContact O-CG 3.31Å; L966-L970 WeakPolarHBondContact O-CG 3.42Å; L966-L970 PolarHBondContact O-N 3.42Å; Q967-L970 PolarHBondContact O-N 3.49Å; T968-L970 VanDerWaalsContact C-N 3.35Å; L970-N1040 HydrophobicContact CD1-CB 4.19Å; L970-W1044 HydrophobicContact CD2-CB 4.12Å
971	T	73.2	Confident	66.3	Low	97 Å²	97	45 Å²	45	60%	0.595	27%	0.271	S	S	*	.	H	α-helix	trans	-79.9	-18	175.7	55.4	0	0	0	0	113.5	Q967 T968 P973	Q967-T971 WeakPolarHBondContact O-CG2 3.27Å; Q967-T971 PolarHBondContact O-N 3.05Å; Q967-T971 PolarHBondContact O-OG1 3Å; T968-T971 PolarHBondContact O-N 3.14Å; T968-T971 PolarHBondContact O-OG1 3.09Å; T968-T971 VanDerWaalsContact O-OG1 3.05Å; T971-P973 WeakPolarHBondContact O-CD 3.3Å
972	I	70.1	Confident	63.7	Low	9 Å²	9	49.7 Å²	49.7	5%	0.046	30%	0.3	C	S	.	.	S	Bend	trans	-73.2	120.6	176.9	-66.1	162.4	0	0	0	109	T968 T974 L976 L994 K997 Q998	T968-I972 HydrophobicContact CG2-CD1 4.47Å; T968-I972 WeakPolarHBondContact O-CD1 3.46Å; T968-I972 VanDerWaalsContact O-CG1 3.27Å; T968-I972 WeakPolarHBondContact O-CG1 3.44Å; T968-I972 PolarHBondContact O-N 2.89Å; I972-T974 PolarHBondContact O-N 3.38Å; I972-T974 VanDerWaalsContact O-N 3.15Å; I972-L976 HydrophobicContact CG2-CD1 3.88Å; I972-L994 HydrophobicContact CG1-CD2 4.36Å; I972-L994 HydrophobicContact CG2-CB 4.46Å; I972-K997 HydrophobicContact CD1-CB 3.81Å; I972-Q998 HydrophobicContact CD1-CB 4.15Å
973	P	62.8	Low	61.4	Low	61 Å²	61	59.5 Å²	59.5	40%	0.396	34%	0.338	S	S	.	.			trans	-57.5	120	178.2	-21.6	29.6	0	0	0	111.4	T971 S975 L976	T971-P973 WeakPolarHBondContact O-CD 3.3Å; P973-S975 PolarHBondContact O-N 2.87Å; P973-L976 HydrophobicContact CB-CD1 4.06Å; P973-L976 HydrophobicContact CB-CG 4.35Å; P973-L976 HydrophobicContact CG-CD1 4.06Å; P973-L976 WeakPolarHBondContact O-CB 3.14Å; P973-L976 WeakPolarHBondContact O-CD1 3.37Å; P973-L976 PolarHBondContact O-N 3.48Å; P973-L976 VanDerWaalsContact O-N 3.14Å
974	T	60.3	Low	59.1	Low	36 Å²	36	67.9 Å²	67.9	22%	0.221	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-64.2	-20.1	175.5	45.2	0	0	0	0	112.7	I972 L976 L977 I1051	I972-T974 PolarHBondContact O-N 3.38Å; I972-T974 VanDerWaalsContact O-N 3.15Å; T974-L976 PolarHBondContact O-N 3.38Å; T974-L977 WeakPolarHBondContact O-CB 3.47Å; T974-L977 WeakPolarHBondContact O-CG 3.18Å; T974-L977 PolarHBondContact O-N 3.1Å; T974-I1051 VanDerWaalsContact CB-CD1 3.47Å; T974-I1051 WeakPolarHBondContact OG1-CD1 3.28Å
975	S	53	Low	56.9	Low	73 Å²	73	71.5 Å²	71.5	51%	0.51	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-66.8	-15.5	174.1	58.2	0	0	0	0	114.5	P973 L977 S978	P973-S975 PolarHBondContact O-N 2.87Å; S975-L977 PolarHBondContact O-N 3.02Å; S975-L977 VanDerWaalsContact O-N 3.16Å; S975-S978 PolarHBondContact O-N 3.44Å
976	L	50.8	Low	55.2	Low	21 Å²	21	77 Å²	77	11%	0.11	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-58.6	-24.8	173.9	-82.3	154.3	0	0	0	112.6	I972 P973 T974 S978 S979 N991 L994	I972-L976 HydrophobicContact CG2-CD1 3.88Å; P973-L976 HydrophobicContact CB-CD1 4.06Å; P973-L976 HydrophobicContact CB-CG 4.35Å; P973-L976 HydrophobicContact CG-CD1 4.06Å; P973-L976 WeakPolarHBondContact O-CB 3.14Å; P973-L976 WeakPolarHBondContact O-CD1 3.37Å; P973-L976 PolarHBondContact O-N 3.48Å; P973-L976 VanDerWaalsContact O-N 3.14Å; T974-L976 PolarHBondContact O-N 3.38Å; L976-S978 PolarHBondContact O-N 2.82Å; L976-S979 PolarHBondContact O-OG 3.29Å; L976-N991 HydrophobicContact CD2-CB 3.56Å; L976-N991 VanDerWaalsContact CD2-OD1 3.25Å; L976-N991 WeakPolarHBondContact CD2-OD1 3.32Å; L976-L994 HydrophobicContact CD1-CB 3.85Å; L976-L994 HydrophobicContact CD1-CD1 3.51Å; L976-L994 HydrophobicContact CD1-CG 4.35Å
977	L	48.5	Very low	53.7	Low	26 Å²	26	80.1 Å²	80.1	14%	0.136	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-65.5	-20.4	175	-65	168.5	0	0	0	113.1	T974 S975 L1068	T974-L977 WeakPolarHBondContact O-CB 3.47Å; T974-L977 WeakPolarHBondContact O-CG 3.18Å; T974-L977 PolarHBondContact O-N 3.1Å; S975-L977 PolarHBondContact O-N 3.02Å; S975-L977 VanDerWaalsContact O-N 3.16Å; L977-L1068 HydrophobicContact CD2-CD2 3.78Å
978	S	40.2	Very low	52.4	Low	64 Å²	64	80.6 Å²	80.6	45%	0.448	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-18.4	-173	-50.6	0	0	0	0	113.7	S975 L976 S980	S975-S978 PolarHBondContact O-N 3.44Å; L976-S978 PolarHBondContact O-N 2.82Å; S978-S980 PolarHBondContact O-N 3.17Å
979	S	37.7	Very low	51.5	Low	69 Å²	69	83.6 Å²	83.6	48%	0.483	46%	0.457	S	S	.	.			trans	-77.4	96.1	-176.4	60.1	0	0	0	0	110.9	L976	L976-S979 PolarHBondContact O-OG 3.29Å
980	S	39.3	Very low	50.8	Low	50 Å²	50	89.8 Å²	89.8	35%	0.35	48%	0.481	S	S	.	.			trans	-58.1	147.9	171.2	51.1	0	0	0	0	111.9	S978 T982	S978-S980 PolarHBondContact O-N 3.17Å; S980-T982 PolarHBondContact O-N 3.03Å; S980-T982 PolarHBondContact O-OG1 3.31Å
981	S	37.4	Very low	50.2	Low	90 Å²	90	88.4 Å²	88.4	63%	0.629	47%	0.474	S	S	*	.	S	Bend	trans	-61.1	45.3	179.9	56.2	0	0	0	0	115.9
982	T	33.2	Very low	49.7	Very low	105 Å²	105	88 Å²	88	64%	0.644	47%	0.465	S	S	*	.			trans	-106.3	119.7	179.8	32.3	0	0	0	0	111.2	S980	S980-T982 PolarHBondContact O-N 3.03Å; S980-T982 PolarHBondContact O-OG1 3.31Å
983	Y	37.6	Very low	49.6	Very low	210 Å²	210	87.8 Å²	87.8	82%	0.824	46%	0.464	S	S	*	.	S	Bend	trans	83.9	117.5	171.1	-79.4	-92.2	0	0	0	118.4	Q985	Y983-Q985 PolarHBondContact O-N 2.9Å
984	Y	35.5	Very low	50	Low	242 Å²	242	85.4 Å²	85.4	95%	0.949	45%	0.448	S	S	*	.			trans	-45.1	91.7	166.9	-76.7	-95.2	0	0	0	111.9
985	Q	36	Very low	50.4	Low	131 Å²	131	86.7 Å²	86.7	61%	0.612	45%	0.454	S	S	*	.			trans	-140.3	153.5	162.9	-81.6	-150.5	-12.9	0	0	110.3	Y983 T987 F988	Y983-Q985 PolarHBondContact O-N 2.9Å; Q985-T987 PolarHBondContact O-N 3.25Å; Q985-F988 PolarHBondContact O-N 3.19Å
986	P	46.5	Very low	51.2	Low	116 Å²	116	85.4 Å²	85.4	75%	0.753	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-11.7	179.3	19.1	-31.6	0	0	0	114.8	F988	P986-F988 PolarHBondContact O-N 3.41Å
987	T	51	Low	52.3	Low	78 Å²	78	85.4 Å²	85.4	48%	0.479	44%	0.44	S	S	.	.	H	α-helix	trans	-58.2	-28.3	169.2	42.9	0	0	0	0	113.5	Q985 Y990 N991	Q985-T987 PolarHBondContact O-N 3.25Å; T987-Y990 PolarHBondContact O-N 3.35Å; T987-N991 WeakPolarHBondContact O-CB 2.95Å; T987-N991 VanDerWaalsContact O-CG 3.23Å; T987-N991 PolarHBondContact O-N 2.98Å; T987-N991 PolarHBondContact O-OD1 3.39Å
988	F	52.1	Low	53.6	Low	123 Å²	123	84.6 Å²	84.6	54%	0.539	44%	0.435	S	S	.	.	H	α-helix	trans	-65.9	-42.6	-178.4	-166.1	-93.9	0	0	0	113	Q985 P986 Y990 N991 H992	Q985-F988 PolarHBondContact O-N 3.19Å; P986-F988 PolarHBondContact O-N 3.41Å; F988-Y990 VanDerWaalsContact C-N 3.33Å; F988-Y990 PolarHBondContact O-N 3.28Å; F988-N991 PolarHBondContact O-N 3.4Å; F988-H992 VanDerWaalsContact O-CB 3.31Å; F988-H992 WeakPolarHBondContact O-CB 3.24Å; F988-H992 PolarHBondContact O-N 3.15Å
989	T	59.7	Low	55.2	Low	73 Å²	73	87.2 Å²	87.2	45%	0.448	44%	0.438	S	S	.	.	H	α-helix	trans	-62.8	-42.9	178.9	-50.8	0	0	0	0	110.8	H992 I993	T989-H992 PolarHBondContact O-N 2.99Å; T989-I993 HydrophobicContact CG2-CD1 3.99Å; T989-I993 WeakPolarHBondContact O-CB 3.48Å; T989-I993 WeakPolarHBondContact O-CG1 3.48Å; T989-I993 PolarHBondContact O-N 2.95Å
990	Y	63.7	Low	57	Low	132 Å²	132	88 Å²	88	52%	0.518	43%	0.431	S	S	.	.	H	α-helix	trans	-64.2	-45.8	177.8	-175.4	-103.1	0	0	0	111.9	T987 F988 H992 I993 L994	T987-Y990 PolarHBondContact O-N 3.35Å; F988-Y990 VanDerWaalsContact C-N 3.33Å; F988-Y990 PolarHBondContact O-N 3.28Å; Y990-H992 PolarHBondContact O-N 3.37Å; Y990-I993 WeakPolarHBondContact O-CB 3.13Å; Y990-I993 PolarHBondContact O-N 3.27Å; Y990-L994 HydrophobicContact CD1-CD1 3.86Å; Y990-L994 HydrophobicContact CD1-CG 4.38Å; Y990-L994 HydrophobicContact CE1-CD1 3.35Å; Y990-L994 HydrophobicContact CE1-CG 4.07Å; Y990-L994 WeakPolarHBondContact O-CG 3.45Å; Y990-L994 PolarHBondContact O-N 3.05Å
991	N	65.1	Low	59	Low	50 Å²	50	85.6 Å²	85.6	27%	0.267	41%	0.414	S	S	.	.	H	α-helix	trans	-62.6	-42	177.3	-70	-5.4	0	0	0	111.9	L976 T987 F988 L994 L995	L976-N991 HydrophobicContact CD2-CB 3.56Å; L976-N991 VanDerWaalsContact CD2-OD1 3.25Å; L976-N991 WeakPolarHBondContact CD2-OD1 3.32Å; T987-N991 WeakPolarHBondContact O-CB 2.95Å; T987-N991 VanDerWaalsContact O-CG 3.23Å; T987-N991 PolarHBondContact O-N 2.98Å; T987-N991 PolarHBondContact O-OD1 3.39Å; F988-N991 PolarHBondContact O-N 3.4Å; N991-L994 PolarHBondContact O-N 3.09Å; N991-L995 PolarHBondContact O-N 3.23Å
992	H	63.8	Low	61	Low	89 Å²	89	81.4 Å²	81.4	41%	0.412	39%	0.385	S	S	.	.	H	α-helix	trans	-63.4	-42.2	176.3	-174	-89.7	0	0	0	111.8	F988 T989 Y990 L994 L995 I996	F988-H992 VanDerWaalsContact O-CB 3.31Å; F988-H992 WeakPolarHBondContact O-CB 3.24Å; F988-H992 PolarHBondContact O-N 3.15Å; T989-H992 PolarHBondContact O-N 2.99Å; Y990-H992 PolarHBondContact O-N 3.37Å; H992-L994 VanDerWaalsContact C-N 3.34Å; H992-L994 PolarHBondContact O-N 3.22Å; H992-L995 PolarHBondContact O-N 3.43Å; H992-I996 WeakPolarHBondContact CE1-CD1 3.25Å; H992-I996 WeakPolarHBondContact ND1-CD1 3.12Å; H992-I996 WeakPolarHBondContact O-CG1 3.22Å; H992-I996 PolarHBondContact O-N 3.45Å
993	I	68.1	Low	63	Low	4 Å²	4	79.9 Å²	79.9	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-59	-45.4	173.9	-75.5	169.8	0	0	0	110.8	N911 F914 T989 Y990 I996 K997	N911-I993 WeakPolarHBondContact OD1-CG1 3.47Å; F914-I993 HydrophobicContact CD2-CG2 3.4Å; F914-I993 HydrophobicContact CE2-CG2 3.47Å; F914-I993 VanDerWaalsContact CE2-CG2 3.47Å; F914-I993 HydrophobicContact CG-CG2 4.26Å; F914-I993 HydrophobicContact CZ-CG2 4.47Å; T989-I993 HydrophobicContact CG2-CD1 3.99Å; T989-I993 WeakPolarHBondContact O-CB 3.48Å; T989-I993 WeakPolarHBondContact O-CG1 3.48Å; T989-I993 PolarHBondContact O-N 2.95Å; Y990-I993 WeakPolarHBondContact O-CB 3.13Å; Y990-I993 PolarHBondContact O-N 3.27Å; I993-I996 PolarHBondContact O-N 2.96Å; I993-K997 WeakPolarHBondContact O-CG 3.47Å; I993-K997 PolarHBondContact O-N 3.48Å
994	L	70	Confident	65.2	Low	11 Å²	11	69.9 Å²	69.9	6%	0.058	33%	0.333	C	S	.	.	H	α-helix	trans	-64.4	-40.2	177.2	-69.9	-179.2	0	0	0	112.6	I972 L976 Y990 N991 H992 I996 K997 Q998	I972-L994 HydrophobicContact CG1-CD2 4.36Å; I972-L994 HydrophobicContact CG2-CB 4.46Å; L976-L994 HydrophobicContact CD1-CB 3.85Å; L976-L994 HydrophobicContact CD1-CD1 3.51Å; L976-L994 HydrophobicContact CD1-CG 4.35Å; Y990-L994 HydrophobicContact CD1-CD1 3.86Å; Y990-L994 HydrophobicContact CD1-CG 4.38Å; Y990-L994 HydrophobicContact CE1-CD1 3.35Å; Y990-L994 HydrophobicContact CE1-CG 4.07Å; Y990-L994 WeakPolarHBondContact O-CG 3.45Å; Y990-L994 PolarHBondContact O-N 3.05Å; N991-L994 PolarHBondContact O-N 3.09Å; H992-L994 VanDerWaalsContact C-N 3.34Å; H992-L994 PolarHBondContact O-N 3.22Å; L994-I996 VanDerWaalsContact C-N 3.31Å; L994-I996 PolarHBondContact O-N 3.38Å; L994-K997 HydrophobicContact CD2-CD 4.35Å; L994-K997 WeakPolarHBondContact O-CB 3.29Å; L994-K997 PolarHBondContact O-N 2.96Å; L994-K997 VanDerWaalsContact O-N 3.17Å; L994-Q998 PolarHBondContact O-N 3.06Å
995	L	69.4	Low	67.4	Low	64 Å²	64	58.4 Å²	58.4	34%	0.335	29%	0.288	S	S	.	.	H	α-helix	trans	-61.8	-41	175.1	-164.6	89.8	0	0	0	111.3	N991 H992 Q998 K999 L1068	N991-L995 PolarHBondContact O-N 3.23Å; H992-L995 PolarHBondContact O-N 3.43Å; L995-Q998 WeakPolarHBondContact O-CB 3.22Å; L995-Q998 PolarHBondContact O-N 3.43Å; L995-K999 PolarHBondContact O-N 3.04Å; L995-L1068 HydrophobicContact CD1-CD2 4.44Å
996	I	70.3	Confident	69.4	Low	46 Å²	46	52.6 Å²	52.6	24%	0.236	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-46	173.4	-67	167.2	0	0	0	110.2	F914 H992 I993 L994 Q998 K999 Y1000	F914-I996 HydrophobicContact CE1-CB 4.19Å; F914-I996 HydrophobicContact CE1-CG2 3.46Å; F914-I996 VanDerWaalsContact CE1-CG2 3.46Å; F914-I996 HydrophobicContact CZ-CB 4.06Å; F914-I996 HydrophobicContact CZ-CG2 3.71Å; H992-I996 WeakPolarHBondContact CE1-CD1 3.25Å; H992-I996 WeakPolarHBondContact ND1-CD1 3.12Å; H992-I996 WeakPolarHBondContact O-CG1 3.22Å; H992-I996 PolarHBondContact O-N 3.45Å; I993-I996 PolarHBondContact O-N 2.96Å; L994-I996 VanDerWaalsContact C-N 3.31Å; L994-I996 PolarHBondContact O-N 3.38Å; I996-Q998 VanDerWaalsContact C-N 3.3Å; I996-Q998 PolarHBondContact O-N 2.73Å; I996-K999 WeakPolarHBondContact O-CB 3.46Å; I996-K999 PolarHBondContact O-N 2.74Å; I996-K999 VanDerWaalsContact O-N 3.13Å; I996-Y1000 HydrophobicContact CG2-CD2 3.57Å; I996-Y1000 HydrophobicContact CG2-CE2 3.4Å; I996-Y1000 VanDerWaalsContact O-CD2 3.28Å; I996-Y1000 WeakPolarHBondContact O-CD2 3.47Å; I996-Y1000 PolarHBondContact O-N 3.34Å
997	K	72.9	Confident	71	Confident	21 Å²	21	50.3 Å²	50.3	9%	0.091	24%	0.243	C	C	.	.	H	α-helix	trans	-55	-48.6	176	-66.8	-166.5	178.3	-174.8	0	111.4	F914 E919 I972 I993 L994 K999 Y1000 C1001	F914-K997 HydrophobicContact CD2-CG 4.36Å; F914-K997 HydrophobicContact CE2-CB 4.42Å; F914-K997 HydrophobicContact CE2-CD 3.83Å; F914-K997 HydrophobicContact CE2-CG 3.14Å; F914-K997 HydrophobicContact CZ-CB 4.34Å; F914-K997 HydrophobicContact CZ-CG 3.44Å; F914-K997 VanDerWaalsContact CZ-CG 3.44Å; E919-K997 IonicContact OE2-NZ 2.85Å; E919-K997 PolarHBondContact OE2-NZ 3.23Å; I972-K997 HydrophobicContact CD1-CB 3.81Å; I993-K997 WeakPolarHBondContact O-CG 3.47Å; I993-K997 PolarHBondContact O-N 3.48Å; L994-K997 HydrophobicContact CD2-CD 4.35Å; L994-K997 WeakPolarHBondContact O-CB 3.29Å; L994-K997 PolarHBondContact O-N 2.96Å; L994-K997 VanDerWaalsContact O-N 3.17Å; K997-K999 VanDerWaalsContact C-N 3.26Å; K997-K999 PolarHBondContact O-N 3.42Å; K997-Y1000 PolarHBondContact O-N 3.42Å; K997-Y1000 VanDerWaalsContact O-N 3.12Å; K997-C1001 PolarHBondContact O-N 3.39Å; K997-C1001 PolarHBondContact O-SG 3.23Å
998	Q	75.9	Confident	72.6	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.037	22%	0.221	C	C	.	.	H	α-helix	trans	-55.7	-45.4	179.6	-173.3	-177	2.5	0	0	110.5	L969 I972 L994 L995 I996 Y1000 C1001 L1002 W1044	L969-Q998 HydrophobicContact CD1-CG 4.25Å; I972-Q998 HydrophobicContact CD1-CB 4.15Å; L994-Q998 PolarHBondContact O-N 3.06Å; L995-Q998 WeakPolarHBondContact O-CB 3.22Å; L995-Q998 PolarHBondContact O-N 3.43Å; I996-Q998 VanDerWaalsContact C-N 3.3Å; I996-Q998 PolarHBondContact O-N 2.73Å; Q998-Y1000 PolarHBondContact O-N 3.22Å; Q998-C1001 PolarHBondContact O-N 3.47Å; Q998-L1002 HydrophobicContact CG-CD1 4.1Å; Q998-L1002 WeakPolarHBondContact O-CB 3.43Å; Q998-L1002 VanDerWaalsContact O-CG 3.24Å; Q998-L1002 WeakPolarHBondContact O-CG 3.41Å; Q998-L1002 PolarHBondContact O-N 3.21Å; Q998-W1044 HydrophobicContact CG-CZ2 4.26Å
999	K	74.5	Confident	73.8	Confident	120 Å²	120	41 Å²	41	52%	0.522	20%	0.196	S	C	.	.	H	α-helix	trans	-61	-44.1	176.4	-172.9	-178.2	177.4	-175.4	0	112.8	L995 I996 K997 L1002 L1003	L995-K999 PolarHBondContact O-N 3.04Å; I996-K999 WeakPolarHBondContact O-CB 3.46Å; I996-K999 PolarHBondContact O-N 2.74Å; I996-K999 VanDerWaalsContact O-N 3.13Å; K997-K999 VanDerWaalsContact C-N 3.26Å; K997-K999 PolarHBondContact O-N 3.42Å; K999-L1002 PolarHBondContact O-N 2.97Å; K999-L1003 HydrophobicContact CG-CD1 4.23Å; K999-L1003 VanDerWaalsContact O-CG 3.32Å; K999-L1003 WeakPolarHBondContact O-CG 3.35Å; K999-L1003 PolarHBondContact O-N 2.78Å
1000	Y	75.2	Confident	74.7	Confident	84 Å²	84	41.3 Å²	41.3	33%	0.329	19%	0.189	S	C	.	.	H	α-helix	trans	-63.8	-43.2	176.7	-83.1	-82	0	0	0	112	I923 I996 K997 Q998 L1002 L1003 A1004	I923-Y1000 WeakPolarHBondContact CG2-O 3.45Å; I996-Y1000 HydrophobicContact CG2-CD2 3.57Å; I996-Y1000 HydrophobicContact CG2-CE2 3.4Å; I996-Y1000 VanDerWaalsContact O-CD2 3.28Å; I996-Y1000 WeakPolarHBondContact O-CD2 3.47Å; I996-Y1000 PolarHBondContact O-N 3.34Å; K997-Y1000 PolarHBondContact O-N 3.42Å; K997-Y1000 VanDerWaalsContact O-N 3.12Å; Q998-Y1000 PolarHBondContact O-N 3.22Å; Y1000-L1002 VanDerWaalsContact C-N 3.34Å; Y1000-L1002 PolarHBondContact O-N 3.26Å; Y1000-L1003 PolarHBondContact O-N 2.94Å; Y1000-A1004 WeakPolarHBondContact O-CB 3.25Å; Y1000-A1004 PolarHBondContact O-N 2.8Å
1001	C	81	Confident	75.7	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.6	-47.6	173.9	-70.8	0	0	0	0	110.9	I923 L969 K997 Q998 L1003 A1004 F1005	I923-C1001 WeakPolarHBondContact CD1-SG 3.43Å; L969-C1001 HydrophobicContact CB-CB 4.41Å; L969-C1001 HydrophobicContact CD1-CB 4.03Å; K997-C1001 PolarHBondContact O-N 3.39Å; K997-C1001 PolarHBondContact O-SG 3.23Å; Q998-C1001 PolarHBondContact O-N 3.47Å; C1001-L1003 PolarHBondContact O-N 3.03Å; C1001-A1004 PolarHBondContact O-N 3.45Å; C1001-F1005 HydrophobicContact CB-CD2 4.39Å; C1001-F1005 HydrophobicContact CB-CE2 4.35Å; C1001-F1005 WeakPolarHBondContact O-CD2 3.41Å; C1001-F1005 PolarHBondContact O-N 3.07Å
1002	L	78.6	Confident	76.6	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-41	179.6	-72.2	173	0	0	0	112.5	Q998 K999 Y1000 F1005 G1006 W1044 N1072 I1075 L1076	Q998-L1002 HydrophobicContact CG-CD1 4.1Å; Q998-L1002 WeakPolarHBondContact O-CB 3.43Å; Q998-L1002 VanDerWaalsContact O-CG 3.24Å; Q998-L1002 WeakPolarHBondContact O-CG 3.41Å; Q998-L1002 PolarHBondContact O-N 3.21Å; K999-L1002 PolarHBondContact O-N 2.97Å; Y1000-L1002 VanDerWaalsContact C-N 3.34Å; Y1000-L1002 PolarHBondContact O-N 3.26Å; L1002-F1005 PolarHBondContact O-N 3.37Å; L1002-G1006 PolarHBondContact O-N 3.46Å; L1002-W1044 HydrophobicContact CD1-CH2 4.23Å; L1002-W1044 HydrophobicContact CD2-CH2 3.69Å; L1002-W1044 HydrophobicContact CD2-CZ3 3.77Å; L1002-W1044 HydrophobicContact CG-CH2 4.35Å; L1002-N1072 HydrophobicContact CD1-CB 4.21Å; L1002-N1072 WeakPolarHBondContact CD1-OD1 3.19Å; L1002-I1075 HydrophobicContact CB-CG2 3.84Å; L1002-I1075 WeakPolarHBondContact O-CG2 3.48Å; L1002-L1076 HydrophobicContact CD2-CD1 3.84Å; L1002-L1076 HydrophobicContact CD2-CD2 4.49Å; L1002-L1076 HydrophobicContact CD2-CG 4.13Å
1003	L	76.9	Confident	77.3	Confident	73 Å²	73	29.6 Å²	29.6	38%	0.382	14%	0.139	S	C	.	.	H	α-helix	trans	-62.5	-43.6	174.5	-73.5	168.3	0	0	0	111.6	K999 Y1000 C1001 G1006 Q1007 I1075	K999-L1003 HydrophobicContact CG-CD1 4.23Å; K999-L1003 VanDerWaalsContact O-CG 3.32Å; K999-L1003 WeakPolarHBondContact O-CG 3.35Å; K999-L1003 PolarHBondContact O-N 2.78Å; Y1000-L1003 PolarHBondContact O-N 2.94Å; C1001-L1003 PolarHBondContact O-N 3.03Å; L1003-G1006 PolarHBondContact O-N 3.47Å; L1003-Q1007 PolarHBondContact O-N 3.3Å; L1003-I1075 HydrophobicContact CD2-CG1 4.45Å; L1003-I1075 HydrophobicContact CD2-CG2 3.96Å; L1003-I1075 HydrophobicContact CG-CG2 4.26Å
1004	A	82.1	Confident	77.9	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.2	-42.7	177.5	0	0	0	0	0	111.9	I923 L926 N927 Y1000 C1001 G1006 Q1007 L1008	I923-A1004 HydrophobicContact CG2-CB 3.76Å; L926-A1004 HydrophobicContact CB-CB 4.42Å; L926-A1004 HydrophobicContact CD2-CB 3.98Å; L926-A1004 HydrophobicContact CG-CB 4.2Å; N927-A1004 HydrophobicContact CB-CB 3.94Å; Y1000-A1004 WeakPolarHBondContact O-CB 3.25Å; Y1000-A1004 PolarHBondContact O-N 2.8Å; C1001-A1004 PolarHBondContact O-N 3.45Å; A1004-G1006 VanDerWaalsContact C-N 3.35Å; A1004-Q1007 PolarHBondContact O-N 3.04Å; A1004-L1008 WeakPolarHBondContact O-CB 3.41Å; A1004-L1008 PolarHBondContact O-N 3.38Å
1005	F	83.5	Confident	78.5	Confident	1 Å²	1	29.4 Å²	29.4	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-66.7	-34.4	173.2	-74.2	-60.1	0	0	0	112.3	L926 T962 P965 L966 L969 C1001 L1002 Q1007 L1008 T1009 L1037 L1041 L1076	L926-F1005 HydrophobicContact CD2-CD1 4.5Å; L926-F1005 HydrophobicContact CD2-CE1 4.32Å; T962-F1005 HydrophobicContact CG2-CE1 4.1Å; P965-F1005 HydrophobicContact CB-CE2 4.29Å; P965-F1005 HydrophobicContact CB-CZ 4.05Å; L966-F1005 HydrophobicContact CB-CZ 3.93Å; L966-F1005 HydrophobicContact CD1-CZ 4.22Å; L969-F1005 HydrophobicContact CB-CE2 4.29Å; L969-F1005 HydrophobicContact CD2-CD2 4.03Å; L969-F1005 HydrophobicContact CD2-CE2 3.81Å; C1001-F1005 HydrophobicContact CB-CD2 4.39Å; C1001-F1005 HydrophobicContact CB-CE2 4.35Å; C1001-F1005 WeakPolarHBondContact O-CD2 3.41Å; C1001-F1005 PolarHBondContact O-N 3.07Å; L1002-F1005 PolarHBondContact O-N 3.37Å; F1005-Q1007 PolarHBondContact O-N 2.7Å; F1005-L1008 HydrophobicContact CD1-CD2 3.86Å; F1005-L1008 HydrophobicContact CE1-CD2 4.28Å; F1005-L1008 PolarHBondContact O-N 3.3Å; F1005-T1009 WeakPolarHBondContact O-CB 3.26Å; F1005-T1009 WeakPolarHBondContact O-CG2 3.42Å; F1005-T1009 PolarHBondContact O-N 3.14Å; F1005-T1009 PolarHBondContact O-OG1 3.5Å; F1005-L1037 HydrophobicContact CE1-CD1 3.85Å; F1005-L1041 HydrophobicContact CD1-CD1 3.96Å; F1005-L1041 HydrophobicContact CD1-CD2 4.15Å; F1005-L1041 HydrophobicContact CD2-CD2 4.15Å; F1005-L1041 HydrophobicContact CE1-CD1 4.2Å; F1005-L1041 HydrophobicContact CE1-CD2 4.17Å; F1005-L1041 HydrophobicContact CE2-CD2 4.18Å; F1005-L1041 HydrophobicContact CG-CD2 4.16Å; F1005-L1041 HydrophobicContact CZ-CD2 4.2Å; F1005-L1076 HydrophobicContact CB-CD2 4.14Å
1006	G	76.5	Confident	79.1	Confident	10 Å²	10	27.7 Å²	27.7	10%	0.103	13%	0.131	C	C	.	.	H	α-helix	trans	-61.4	-40	171.2	0	0	0	0	0	112.9	L1002 L1003 A1004 T1009 R1010	L1002-G1006 PolarHBondContact O-N 3.46Å; L1003-G1006 PolarHBondContact O-N 3.47Å; A1004-G1006 VanDerWaalsContact C-N 3.35Å; G1006-T1009 WeakPolarHBondContact CA-OG1 3.39Å; G1006-T1009 PolarHBondContact O-OG1 3.28Å; G1006-R1010 PolarHBondContact O-N 2.97Å; G1006-R1010 VanDerWaalsContact O-N 3.15Å
1007	Q	80.2	Confident	79.5	Confident	67 Å²	67	34.5 Å²	34.5	31%	0.313	15%	0.154	S	C	.	.	H	α-helix	trans	-72.8	-39	173.6	-69.7	-60	-23.4	0	0	112.8	N927 L1003 A1004 F1005 T1009 R1010 A1011	N927-Q1007 WeakPolarHBondContact OD1-CG 3.27Å; L1003-Q1007 PolarHBondContact O-N 3.3Å; A1004-Q1007 PolarHBondContact O-N 3.04Å; F1005-Q1007 PolarHBondContact O-N 2.7Å; Q1007-T1009 VanDerWaalsContact C-N 3.28Å; Q1007-T1009 PolarHBondContact O-N 3.38Å; Q1007-R1010 WeakPolarHBondContact O-CB 3.38Å; Q1007-R1010 PolarHBondContact O-N 3.16Å; Q1007-A1011 PolarHBondContact O-N 2.94Å
1008	L	85	Confident	79.7	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-56.6	-46	174.1	174.1	70.1	0	0	0	111	L926 L958 T962 A1004 F1005 A1011 L1012 L1037	L926-L1008 HydrophobicContact CD1-CD1 4.29Å; L958-L1008 HydrophobicContact CB-CD1 3.99Å; L958-L1008 HydrophobicContact CD2-CD1 3.9Å; L958-L1008 HydrophobicContact CG-CD1 4.37Å; T962-L1008 HydrophobicContact CG2-CD1 4.2Å; T962-L1008 HydrophobicContact CG2-CD2 3.36Å; T962-L1008 HydrophobicContact CG2-CG 4.36Å; A1004-L1008 WeakPolarHBondContact O-CB 3.41Å; A1004-L1008 PolarHBondContact O-N 3.38Å; F1005-L1008 HydrophobicContact CD1-CD2 3.86Å; F1005-L1008 HydrophobicContact CE1-CD2 4.28Å; F1005-L1008 PolarHBondContact O-N 3.3Å; L1008-A1011 CarbonylContact O-C 3.59Å; L1008-A1011 WeakPolarHBondContact O-CA 3.36Å; L1008-A1011 WeakPolarHBondContact O-CB 3.49Å; L1008-A1011 PolarHBondContact O-N 3.23Å; L1008-A1011 VanDerWaalsContact O-N 3.09Å; L1008-L1012 HydrophobicContact CD1-CD1 4.26Å; L1008-L1012 HydrophobicContact CD1-CG 4.31Å; L1008-L1012 HydrophobicContact CD2-CD1 4.45Å; L1008-L1012 HydrophobicContact CG-CD1 4Å; L1008-L1012 HydrophobicContact CG-CG 4.39Å; L1008-L1012 WeakPolarHBondContact O-CG 3.4Å; L1008-L1012 PolarHBondContact O-N 3.43Å; L1008-L1037 HydrophobicContact CD2-CD2 4.04Å
1009	T	78.3	Confident	80	Confident	3 Å²	3	37 Å²	37	2%	0.018	16%	0.163	C	C	.	.	H	α-helix	trans	-69.5	-39.2	-176.7	54.6	0	0	0	0	110.6	F1005 G1006 Q1007 A1011 L1012 I1013 L1080	F1005-T1009 WeakPolarHBondContact O-CB 3.26Å; F1005-T1009 WeakPolarHBondContact O-CG2 3.42Å; F1005-T1009 PolarHBondContact O-N 3.14Å; F1005-T1009 PolarHBondContact O-OG1 3.5Å; G1006-T1009 WeakPolarHBondContact CA-OG1 3.39Å; G1006-T1009 PolarHBondContact O-OG1 3.28Å; Q1007-T1009 VanDerWaalsContact C-N 3.28Å; Q1007-T1009 PolarHBondContact O-N 3.38Å; T1009-A1011 VanDerWaalsContact C-N 3.28Å; T1009-A1011 PolarHBondContact O-N 3.41Å; T1009-L1012 PolarHBondContact O-N 3.02Å; T1009-I1013 WeakPolarHBondContact O-CB 3.16Å; T1009-I1013 VanDerWaalsContact O-CG1 3.25Å; T1009-I1013 WeakPolarHBondContact O-CG1 3.25Å; T1009-I1013 PolarHBondContact O-N 2.91Å; T1009-L1080 HydrophobicContact CG2-CD1 3.59Å; T1009-L1080 HydrophobicContact CG2-CD2 3.24Å; T1009-L1080 HydrophobicContact CG2-CG 3.94Å
1010	R	77.7	Confident	80.2	Confident	79 Å²	79	32.8 Å²	32.8	30%	0.298	15%	0.154	S	C	.	.	H	α-helix	trans	-55.6	-43	167.3	-174.3	-172.2	175.7	117.5	-9.8	112	A934 Q938 G1006 Q1007 G1014	A934-R1010 HydrophobicContact CB-CB 4.47Å; A934-R1010 HydrophobicContact CB-CG 3.94Å; Q938-R1010 VanDerWaalsContact CD-NH2 3.33Å; Q938-R1010 VanDerWaalsContact NE2-CZ 3.3Å; G1006-R1010 PolarHBondContact O-N 2.97Å; G1006-R1010 VanDerWaalsContact O-N 3.15Å; Q1007-R1010 WeakPolarHBondContact O-CB 3.38Å; Q1007-R1010 PolarHBondContact O-N 3.16Å; R1010-G1014 PolarHBondContact O-N 3.47Å
1011	A	84.2	Confident	80.3	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.8	-44.4	178.3	0	0	0	0	0	112	S930 I933 A934 Q1007 L1008 T1009 G1014 L1015	S930-A1011 WeakPolarHBondContact O-CB 3.45Å; I933-A1011 HydrophobicContact CB-CB 4.14Å; I933-A1011 HydrophobicContact CG2-CB 4.13Å; A934-A1011 HydrophobicContact CB-CB 4.26Å; Q1007-A1011 PolarHBondContact O-N 2.94Å; L1008-A1011 CarbonylContact O-C 3.59Å; L1008-A1011 WeakPolarHBondContact O-CA 3.36Å; L1008-A1011 WeakPolarHBondContact O-CB 3.49Å; L1008-A1011 PolarHBondContact O-N 3.23Å; L1008-A1011 VanDerWaalsContact O-N 3.09Å; T1009-A1011 VanDerWaalsContact C-N 3.28Å; T1009-A1011 PolarHBondContact O-N 3.41Å; A1011-G1014 PolarHBondContact O-N 3.15Å; A1011-L1015 WeakPolarHBondContact O-CB 3.31Å; A1011-L1015 WeakPolarHBondContact O-CG 3.39Å; A1011-L1015 PolarHBondContact O-N 2.78Å
1012	L	84.7	Confident	80	Confident	12 Å²	12	41.6 Å²	41.6	6%	0.063	20%	0.201	C	C	.	.	H	α-helix	trans	-64.9	-43.2	178.4	-71.4	173	0	0	0	112.3	Y955 L958 L1008 T1009 G1014 L1015 L1016 F1024 Y1034	Y955-L1012 HydrophobicContact CD1-CD2 4.42Å; L958-L1012 HydrophobicContact CD1-CD2 4.42Å; L1008-L1012 HydrophobicContact CD1-CD1 4.26Å; L1008-L1012 HydrophobicContact CD1-CG 4.31Å; L1008-L1012 HydrophobicContact CD2-CD1 4.45Å; L1008-L1012 HydrophobicContact CG-CD1 4Å; L1008-L1012 HydrophobicContact CG-CG 4.39Å; L1008-L1012 WeakPolarHBondContact O-CG 3.4Å; L1008-L1012 PolarHBondContact O-N 3.43Å; T1009-L1012 PolarHBondContact O-N 3.02Å; L1012-G1014 VanDerWaalsContact C-N 3.34Å; L1012-L1015 HydrophobicContact CD2-CD1 4.38Å; L1012-L1015 WeakPolarHBondContact O-CB 3.32Å; L1012-L1015 PolarHBondContact O-N 3.4Å; L1012-L1016 WeakPolarHBondContact O-CB 3.39Å; L1012-L1016 PolarHBondContact O-N 3.15Å; L1012-F1024 HydrophobicContact CB-CE2 4.49Å; L1012-F1024 HydrophobicContact CD2-CE2 4.39Å; L1012-F1024 WeakPolarHBondContact O-CE2 3.47Å; L1012-Y1034 HydrophobicContact CD1-CE2 4.14Å; L1012-Y1034 HydrophobicContact CD2-CE2 4.47Å
1013	I	79.3	Confident	80	Confident	14 Å²	14	43 Å²	43	7%	0.072	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-43.1	174.2	-66.7	165.3	0	0	0	110.1	T1009 L1015 L1016 W1017	T1009-I1013 WeakPolarHBondContact O-CB 3.16Å; T1009-I1013 VanDerWaalsContact O-CG1 3.25Å; T1009-I1013 WeakPolarHBondContact O-CG1 3.25Å; T1009-I1013 PolarHBondContact O-N 2.91Å; I1013-L1015 VanDerWaalsContact C-N 3.28Å; I1013-L1015 PolarHBondContact O-N 2.89Å; I1013-L1016 WeakPolarHBondContact O-CB 3.47Å; I1013-L1016 PolarHBondContact O-N 3.37Å; I1013-W1017 HydrophobicContact CG2-CD2 3.94Å; I1013-W1017 HydrophobicContact CG2-CE3 4.34Å; I1013-W1017 HydrophobicContact CG2-CH2 4.02Å; I1013-W1017 HydrophobicContact CG2-CZ2 3.57Å; I1013-W1017 HydrophobicContact CG2-CZ3 4.38Å; I1013-W1017 PolarHBondContact O-N 3.18Å
1014	G	79.9	Confident	80.1	Confident	11 Å²	11	40.7 Å²	40.7	11%	0.113	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-39.8	173.9	0	0	0	0	0	112.4	R1010 A1011 L1012 R1018	R1010-G1014 PolarHBondContact O-N 3.47Å; A1011-G1014 PolarHBondContact O-N 3.15Å; L1012-G1014 VanDerWaalsContact C-N 3.34Å; G1014-R1018 VanDerWaalsContact O-CB 3.22Å; G1014-R1018 WeakPolarHBondContact O-CB 3.47Å; G1014-R1018 PolarHBondContact O-N 3.05Å; G1014-R1018 VanDerWaalsContact O-N 3.07Å
1015	L	82.8	Confident	80	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68	-42.6	175.6	-74.8	167.5	0	0	0	112.4	I933 T937 W944 V954 Y955 L958 A1011 L1012 I1013 R1018 H1019	I933-L1015 HydrophobicContact CG2-CD1 4.03Å; I933-L1015 HydrophobicContact CG2-CD2 4.23Å; I933-L1015 HydrophobicContact CG2-CG 4.12Å; T937-L1015 HydrophobicContact CG2-CD2 3.84Å; T937-L1015 HydrophobicContact CG2-CG 3.93Å; W944-L1015 HydrophobicContact CE3-CD2 4.46Å; W944-L1015 HydrophobicContact CH2-CD2 3.45Å; W944-L1015 VanDerWaalsContact CH2-CD2 3.45Å; W944-L1015 HydrophobicContact CZ3-CD2 3.29Å; V954-L1015 HydrophobicContact CG1-CD1 4.14Å; V954-L1015 HydrophobicContact CG1-CD2 4.39Å; Y955-L1015 HydrophobicContact CD1-CD1 4.18Å; Y955-L1015 HydrophobicContact CE1-CB 4.01Å; Y955-L1015 HydrophobicContact CE1-CD1 3.86Å; Y955-L1015 HydrophobicContact CE1-CG 4.44Å; L958-L1015 HydrophobicContact CD1-CD1 3.58Å; A1011-L1015 WeakPolarHBondContact O-CB 3.31Å; A1011-L1015 WeakPolarHBondContact O-CG 3.39Å; A1011-L1015 PolarHBondContact O-N 2.78Å; L1012-L1015 HydrophobicContact CD2-CD1 4.38Å; L1012-L1015 WeakPolarHBondContact O-CB 3.32Å; L1012-L1015 PolarHBondContact O-N 3.4Å; I1013-L1015 VanDerWaalsContact C-N 3.28Å; I1013-L1015 PolarHBondContact O-N 2.89Å; L1015-R1018 PolarHBondContact O-N 2.87Å; L1015-H1019 WeakPolarHBondContact O-CB 3.46Å; L1015-H1019 PolarHBondContact O-N 2.92Å
1016	L	81.4	Confident	79.8	Confident	27 Å²	27	51 Å²	51	14%	0.141	25%	0.249	C	C	.	.	H	α-helix	trans	-57.3	-51.7	175.7	176.2	67.3	0	0	0	110.3	L1012 I1013 R1018 G1020 D1021 F1024	L1012-L1016 WeakPolarHBondContact O-CB 3.39Å; L1012-L1016 PolarHBondContact O-N 3.15Å; I1013-L1016 WeakPolarHBondContact O-CB 3.47Å; I1013-L1016 PolarHBondContact O-N 3.37Å; L1016-R1018 VanDerWaalsContact C-N 3.31Å; L1016-R1018 PolarHBondContact O-N 3.43Å; L1016-G1020 CarbonylContact O-C 3.59Å; L1016-G1020 VanDerWaalsContact O-CA 3.27Å; L1016-G1020 WeakPolarHBondContact O-CA 3.36Å; L1016-G1020 PolarHBondContact O-N 3.27Å; L1016-D1021 WeakPolarHBondContact CD1-OD1 3.49Å; L1016-F1024 HydrophobicContact CB-CD2 3.71Å; L1016-F1024 HydrophobicContact CB-CE2 3.98Å; L1016-F1024 HydrophobicContact CB-CG 4.12Å; L1016-F1024 HydrophobicContact CD1-CB 3.55Å; L1016-F1024 HydrophobicContact CD1-CD1 3.65Å; L1016-F1024 HydrophobicContact CD1-CD2 3.97Å; L1016-F1024 HydrophobicContact CD1-CE1 4.31Å; L1016-F1024 HydrophobicContact CD1-CG 3.45Å; L1016-F1024 VanDerWaalsContact CD1-CG 3.45Å; L1016-F1024 HydrophobicContact CG-CD2 4.47Å; L1016-F1024 HydrophobicContact CG-CG 4.4Å
1017	W	79.1	Confident	79.9	Confident	189 Å²	189	52.3 Å²	52.3	72%	0.716	25%	0.251	S	S	*	.	H	α-helix	trans	-65.7	-34.7	-179.3	-66.8	-7.9	0	0	0	113.1	I1013	I1013-W1017 HydrophobicContact CG2-CD2 3.94Å; I1013-W1017 HydrophobicContact CG2-CE3 4.34Å; I1013-W1017 HydrophobicContact CG2-CH2 4.02Å; I1013-W1017 HydrophobicContact CG2-CZ2 3.57Å; I1013-W1017 HydrophobicContact CG2-CZ3 4.38Å; I1013-W1017 PolarHBondContact O-N 3.18Å
1018	R	77.5	Confident	79.9	Confident	60 Å²	60	49.3 Å²	49.3	23%	0.226	24%	0.238	C	C	.	.	H	α-helix	trans	-76.8	-37.8	-178.3	-170	169.7	-173.6	119.8	-10	113.3	L936 T937 R939 I942 W944 G1014 L1015 L1016	L936-R1018 PolarHBondContact O-NH1 3.39Å; T937-R1018 PolarHBondContact O-NH1 3.38Å; R939-R1018 VanDerWaalsContact O-CZ 3.31Å; R939-R1018 PolarHBondContact O-NH1 3.23Å; R939-R1018 PolarHBondContact O-NH2 2.85Å; I942-R1018 VanDerWaalsContact CB-NH2 3.34Å; I942-R1018 PolarHBondContact O-NH2 3.07Å; W944-R1018 HydrophobicContact CE3-CG 4.43Å; G1014-R1018 VanDerWaalsContact O-CB 3.22Å; G1014-R1018 WeakPolarHBondContact O-CB 3.47Å; G1014-R1018 PolarHBondContact O-N 3.05Å; G1014-R1018 VanDerWaalsContact O-N 3.07Å; L1015-R1018 PolarHBondContact O-N 2.87Å; L1016-R1018 VanDerWaalsContact C-N 3.31Å; L1016-R1018 PolarHBondContact O-N 3.43Å
1019	H	81	Confident	79.6	Confident	22 Å²	22	52.9 Å²	52.9	10%	0.102	26%	0.257	C	S	.	.	H	α-helix	trans	-95.9	-16.5	-177	-60.4	158.8	0	0	0	113.7	W944 K951 Y955 L1015 S1023	W944-H1019 AromaticContact CD2-NE2 3.6Å; W944-H1019 AromaticContact CE3-CD2 3.97Å; W944-H1019 AromaticContact CE3-CE1 3.52Å; W944-H1019 AromaticContact CE3-NE2 2.88Å; W944-H1019 AromaticContact CZ3-CE1 3.51Å; W944-H1019 AromaticContact CZ3-NE2 3.37Å; W944-H1019 WeakPolarHBondContact CZ3-NE2 3.34Å; K951-H1019 WeakPolarHBondContact CE-CD2 3.34Å; K951-H1019 VanDerWaalsContact CE-CE1 3.47Å; K951-H1019 WeakPolarHBondContact CE-CE1 3.32Å; K951-H1019 VanDerWaalsContact CE-ND1 3.26Å; K951-H1019 WeakPolarHBondContact CE-ND1 3.48Å; K951-H1019 WeakPolarHBondContact CE-NE2 3.36Å; Y955-H1019 AromaticContact CE2-ND1 3.68Å; Y955-H1019 AromaticContact CZ-ND1 3.65Å; Y955-H1019 PolarHBondContact OH-ND1 2.91Å; L1015-H1019 WeakPolarHBondContact O-CB 3.46Å; L1015-H1019 PolarHBondContact O-N 2.92Å; H1019-S1023 VanDerWaalsContact O-CB 3.27Å; H1019-S1023 WeakPolarHBondContact O-CB 3.45Å; H1019-S1023 PolarHBondContact O-OG 3.44Å
1020	G	79.2	Confident	79.6	Confident	31 Å²	31	56 Å²	56	32%	0.32	28%	0.278	S	S	.	.			trans	76.6	158.9	-171.7	0	0	0	0	0	113	L1016 Q1022 S1023 F1024	L1016-G1020 CarbonylContact O-C 3.59Å; L1016-G1020 VanDerWaalsContact O-CA 3.27Å; L1016-G1020 WeakPolarHBondContact O-CA 3.36Å; L1016-G1020 PolarHBondContact O-N 3.27Å; G1020-Q1022 PolarHBondContact O-N 2.93Å; G1020-S1023 PolarHBondContact O-N 2.98Å; G1020-F1024 WeakPolarHBondContact O-CB 3.36Å; G1020-F1024 PolarHBondContact O-N 3.37Å
1021	D	76.5	Confident	79.7	Confident	96 Å²	96	53.3 Å²	53.3	51%	0.513	27%	0.269	S	S	.	.	H	α-helix	trans	-57.3	-43.8	-171.8	-56.8	-18.1	0	0	0	113	L1016 S1023 F1024 Q1025	L1016-D1021 WeakPolarHBondContact CD1-OD1 3.49Å; D1021-S1023 PolarHBondContact O-N 2.96Å; D1021-F1024 PolarHBondContact O-N 2.93Å; D1021-Q1025 VanDerWaalsContact O-CB 3.26Å; D1021-Q1025 WeakPolarHBondContact O-CB 3.03Å; D1021-Q1025 PolarHBondContact O-N 2.96Å
1022	Q	76.1	Confident	79.2	Confident	174 Å²	174	57.8 Å²	57.8	81%	0.813	30%	0.298	S	S	*	.	H	α-helix	trans	-63.1	-45.2	-178.1	-68.4	-177.5	-5.9	0	0	112.3	G1020 L1026	G1020-Q1022 PolarHBondContact O-N 2.93Å; Q1022-L1026 WeakPolarHBondContact O-CB 3.49Å; Q1022-L1026 PolarHBondContact O-N 3.49Å
1023	S	77.7	Confident	79	Confident	32 Å²	32	61.7 Å²	61.7	22%	0.224	32%	0.319	C	S	.	.	H	α-helix	trans	-67.4	-47.2	177.5	-71.9	0	0	0	0	110.5	K951 H1019 G1020 D1021 Q1025 L1026 Y1027	K951-S1023 PolarHBondContact NZ-OG 3.21Å; H1019-S1023 VanDerWaalsContact O-CB 3.27Å; H1019-S1023 WeakPolarHBondContact O-CB 3.45Å; H1019-S1023 PolarHBondContact O-OG 3.44Å; G1020-S1023 PolarHBondContact O-N 2.98Å; D1021-S1023 PolarHBondContact O-N 2.96Å; S1023-Q1025 VanDerWaalsContact C-N 3.33Å; S1023-Q1025 PolarHBondContact O-N 2.9Å; S1023-L1026 PolarHBondContact O-N 3.2Å; S1023-Y1027 WeakPolarHBondContact O-CD2 3.22Å; S1023-Y1027 PolarHBondContact O-N 3.03Å
1024	F	80.1	Confident	79.2	Confident	23 Å²	23	62.2 Å²	62.2	10%	0.101	32%	0.321	C	S	.	.	H	α-helix	trans	-54.9	-51.8	179.6	-179.4	-88.2	0	0	0	110.5	Y955 L1012 L1016 G1020 D1021 L1026 Y1027 T1028	Y955-F1024 AromaticContact CE1-CD2 3.69Å; Y955-F1024 HydrophobicContact CE1-CD2 3.69Å; Y955-F1024 AromaticContact CE1-CE2 3.78Å; Y955-F1024 HydrophobicContact CE1-CE2 3.78Å; Y955-F1024 WeakPolarHBondContact OH-CD2 3.36Å; L1012-F1024 HydrophobicContact CB-CE2 4.49Å; L1012-F1024 HydrophobicContact CD2-CE2 4.39Å; L1012-F1024 WeakPolarHBondContact O-CE2 3.47Å; L1016-F1024 HydrophobicContact CB-CD2 3.71Å; L1016-F1024 HydrophobicContact CB-CE2 3.98Å; L1016-F1024 HydrophobicContact CB-CG 4.12Å; L1016-F1024 HydrophobicContact CD1-CB 3.55Å; L1016-F1024 HydrophobicContact CD1-CD1 3.65Å; L1016-F1024 HydrophobicContact CD1-CD2 3.97Å; L1016-F1024 HydrophobicContact CD1-CE1 4.31Å; L1016-F1024 HydrophobicContact CD1-CG 3.45Å; L1016-F1024 VanDerWaalsContact CD1-CG 3.45Å; L1016-F1024 HydrophobicContact CG-CD2 4.47Å; L1016-F1024 HydrophobicContact CG-CG 4.4Å; G1020-F1024 WeakPolarHBondContact O-CB 3.36Å; G1020-F1024 PolarHBondContact O-N 3.37Å; D1021-F1024 PolarHBondContact O-N 2.93Å; F1024-L1026 PolarHBondContact O-N 3.35Å; F1024-Y1027 PolarHBondContact O-N 2.69Å; F1024-T1028 HydrophobicContact CD1-CG2 4Å; F1024-T1028 HydrophobicContact CE1-CG2 3.65Å; F1024-T1028 HydrophobicContact CE2-CG2 4.24Å; F1024-T1028 HydrophobicContact CG-CG2 4.45Å; F1024-T1028 HydrophobicContact CZ-CG2 3.77Å; F1024-T1028 WeakPolarHBondContact O-CG2 3.46Å; F1024-T1028 PolarHBondContact O-N 3.45Å; F1024-T1028 PolarHBondContact O-OG1 2.81Å
1025	Q	79.1	Confident	79.1	Confident	112 Å²	112	65.2 Å²	65.2	52%	0.523	33%	0.33	S	S	.	.	H	α-helix	trans	-58	-47.2	177.5	-176	171.3	10.7	0	0	111.7	D1021 S1023 Y1027 T1028 D1029	D1021-Q1025 VanDerWaalsContact O-CB 3.26Å; D1021-Q1025 WeakPolarHBondContact O-CB 3.03Å; D1021-Q1025 PolarHBondContact O-N 2.96Å; S1023-Q1025 VanDerWaalsContact C-N 3.33Å; S1023-Q1025 PolarHBondContact O-N 2.9Å; Q1025-Y1027 VanDerWaalsContact C-N 3.26Å; Q1025-Y1027 PolarHBondContact O-N 3.27Å; Q1025-T1028 WeakPolarHBondContact CA-OG1 3.27Å; Q1025-T1028 PolarHBondContact O-N 2.99Å; Q1025-T1028 PolarHBondContact O-OG1 2.97Å; Q1025-D1029 VanDerWaalsContact CG-OD2 3.24Å; Q1025-D1029 WeakPolarHBondContact CG-OD2 3.34Å; Q1025-D1029 PolarHBondContact NE2-OD2 3.42Å; Q1025-D1029 WeakPolarHBondContact O-CB 3.45Å; Q1025-D1029 PolarHBondContact O-N 3.27Å
1026	L	79.9	Confident	79	Confident	105 Å²	105	68.3 Å²	68.3	55%	0.55	35%	0.352	S	S	.	.	H	α-helix	trans	-58.5	-37.6	179.2	-175.4	132.2	0	0	0	112.7	Q1022 S1023 F1024 C1030	Q1022-L1026 WeakPolarHBondContact O-CB 3.49Å; Q1022-L1026 PolarHBondContact O-N 3.49Å; S1023-L1026 PolarHBondContact O-N 3.2Å; F1024-L1026 PolarHBondContact O-N 3.35Å; L1026-C1030 PolarHBondContact O-SG 3.41Å
1027	Y	79	Confident	79	Confident	38 Å²	38	67.2 Å²	67.2	15%	0.149	35%	0.346	C	S	.	.	H	α-helix	trans	-78.8	-41	177.5	-67.4	-63.9	0	0	0	113.2	K951 R952 Y955 S1023 F1024 Q1025 C1030 L1031	K951-Y1027 HydrophobicContact CD-CD2 4.46Å; K951-Y1027 HydrophobicContact CD-CE2 3.59Å; K951-Y1027 HydrophobicContact CG-CD2 4.44Å; K951-Y1027 HydrophobicContact CG-CE2 3.95Å; R952-Y1027 HydrophobicContact CB-CD1 4.03Å; R952-Y1027 HydrophobicContact CB-CE1 4.02Å; R952-Y1027 HydrophobicContact CG-CD1 4.22Å; Y955-Y1027 HydrophobicContact CD2-CD2 4.32Å; Y955-Y1027 HydrophobicContact CD2-CG 4.06Å; Y955-Y1027 AromaticContact CE2-CD2 3.88Å; Y955-Y1027 HydrophobicContact CE2-CD2 3.88Å; Y955-Y1027 HydrophobicContact CE2-CG 4.08Å; S1023-Y1027 WeakPolarHBondContact O-CD2 3.22Å; S1023-Y1027 PolarHBondContact O-N 3.03Å; F1024-Y1027 PolarHBondContact O-N 2.69Å; Q1025-Y1027 VanDerWaalsContact C-N 3.26Å; Q1025-Y1027 PolarHBondContact O-N 3.27Å; Y1027-C1030 PolarHBondContact O-N 2.96Å; Y1027-L1031 WeakPolarHBondContact O-CG 3.37Å
1028	T	79.1	Confident	79	Confident	5 Å²	5	58.9 Å²	58.9	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-68.5	-36.2	178.5	52.6	0	0	0	0	112	Y955 F1024 Q1025 C1030 L1031 Y1034	Y955-T1028 HydrophobicContact CD1-CG2 4.42Å; F1024-T1028 HydrophobicContact CD1-CG2 4Å; F1024-T1028 HydrophobicContact CE1-CG2 3.65Å; F1024-T1028 HydrophobicContact CE2-CG2 4.24Å; F1024-T1028 HydrophobicContact CG-CG2 4.45Å; F1024-T1028 HydrophobicContact CZ-CG2 3.77Å; F1024-T1028 WeakPolarHBondContact O-CG2 3.46Å; F1024-T1028 PolarHBondContact O-N 3.45Å; F1024-T1028 PolarHBondContact O-OG1 2.81Å; Q1025-T1028 WeakPolarHBondContact CA-OG1 3.27Å; Q1025-T1028 PolarHBondContact O-N 2.99Å; Q1025-T1028 PolarHBondContact O-OG1 2.97Å; T1028-C1030 PolarHBondContact O-N 3.26Å; T1028-L1031 PolarHBondContact O-N 3.47Å; T1028-Y1034 HydrophobicContact CG2-CD1 4.02Å; T1028-Y1034 HydrophobicContact CG2-CD2 4.09Å; T1028-Y1034 HydrophobicContact CG2-CE1 3.88Å; T1028-Y1034 HydrophobicContact CG2-CE2 3.95Å; T1028-Y1034 HydrophobicContact CG2-CG 4.12Å
1029	D	78.6	Confident	79	Confident	78 Å²	78	57.2 Å²	57.2	42%	0.417	31%	0.312	S	S	.	.	H	α-helix	trans	-67.4	-28.7	178.6	-69.2	3.3	0	0	0	111.6	Q1025 L1031 F1035	Q1025-D1029 VanDerWaalsContact CG-OD2 3.24Å; Q1025-D1029 WeakPolarHBondContact CG-OD2 3.34Å; Q1025-D1029 PolarHBondContact NE2-OD2 3.42Å; Q1025-D1029 WeakPolarHBondContact O-CB 3.45Å; Q1025-D1029 PolarHBondContact O-N 3.27Å; D1029-L1031 PolarHBondContact O-N 2.96Å; D1029-F1035 WeakPolarHBondContact OD1-CZ 3.42Å
1030	C	78.8	Confident	78.9	Confident	69 Å²	69	57.9 Å²	57.9	47%	0.466	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-6.6	173	-69.4	0	0	0	0	113.6	L1026 Y1027 T1028	L1026-C1030 PolarHBondContact O-SG 3.41Å; Y1027-C1030 PolarHBondContact O-N 2.96Å; T1028-C1030 PolarHBondContact O-N 3.26Å
1031	L	80	Confident	78.9	Confident	21 Å²	21	57 Å²	57	11%	0.11	30%	0.304	C	S	.	.			trans	-114.7	94.5	-176.9	-66.4	173.4	0	0	0	109.8	V959 Y1027 T1028 D1029 D1033 Y1034	V959-L1031 HydrophobicContact CG2-CD1 4.32Å; Y1027-L1031 WeakPolarHBondContact O-CG 3.37Å; T1028-L1031 PolarHBondContact O-N 3.47Å; D1029-L1031 PolarHBondContact O-N 2.96Å; L1031-D1033 PolarHBondContact O-N 3.34Å; L1031-D1033 VanDerWaalsContact O-N 3.15Å; L1031-Y1034 VanDerWaalsContact O-CB 3.25Å; L1031-Y1034 WeakPolarHBondContact O-CB 3.34Å; L1031-Y1034 PolarHBondContact O-N 3.44Å
1032	P	74.2	Confident	78.9	Confident	95 Å²	95	52.5 Å²	52.5	62%	0.617	28%	0.28	S	S	*	.	H	α-helix	trans	-58.6	-32.9	-178.1	21.7	-31.9	0	0	0	112.9	Y1034 F1035 C1036	P1032-Y1034 PolarHBondContact O-N 3.25Å; P1032-F1035 PolarHBondContact O-N 2.94Å; P1032-C1036 PolarHBondContact O-N 3.17Å
1033	D	80.8	Confident	78.8	Confident	94 Å²	94	50 Å²	50	50%	0.503	26%	0.263	S	S	.	.	H	α-helix	trans	-66.9	-21.9	178.9	-61.8	-32.4	0	0	0	113	V959 L1031 C1036 L1037	V959-D1033 HydrophobicContact CG1-CB 3.45Å; V959-D1033 VanDerWaalsContact CG1-CB 3.45Å; L1031-D1033 PolarHBondContact O-N 3.34Å; L1031-D1033 VanDerWaalsContact O-N 3.15Å; D1033-C1036 WeakPolarHBondContact O-CB 3.39Å; D1033-C1036 PolarHBondContact O-N 2.93Å; D1033-L1037 WeakPolarHBondContact O-CB 3.25Å; D1033-L1037 PolarHBondContact O-N 3.23Å
1034	Y	81.4	Confident	78.7	Confident	25 Å²	25	49.1 Å²	49.1	10%	0.098	26%	0.255	C	S	.	.	H	α-helix	trans	-65.1	-46.6	176.1	178	-100	0	0	0	111.3	V959 L1012 T1028 L1031 P1032 C1036 L1037 I1038	V959-Y1034 HydrophobicContact CG2-CD2 4.01Å; L1012-Y1034 HydrophobicContact CD1-CE2 4.14Å; L1012-Y1034 HydrophobicContact CD2-CE2 4.47Å; T1028-Y1034 HydrophobicContact CG2-CD1 4.02Å; T1028-Y1034 HydrophobicContact CG2-CD2 4.09Å; T1028-Y1034 HydrophobicContact CG2-CE1 3.88Å; T1028-Y1034 HydrophobicContact CG2-CE2 3.95Å; T1028-Y1034 HydrophobicContact CG2-CG 4.12Å; L1031-Y1034 VanDerWaalsContact O-CB 3.25Å; L1031-Y1034 WeakPolarHBondContact O-CB 3.34Å; L1031-Y1034 PolarHBondContact O-N 3.44Å; P1032-Y1034 PolarHBondContact O-N 3.25Å; Y1034-C1036 VanDerWaalsContact C-N 3.29Å; Y1034-C1036 PolarHBondContact O-N 3.15Å; Y1034-L1037 WeakPolarHBondContact O-CB 3.21Å; Y1034-L1037 PolarHBondContact O-N 3.4Å; Y1034-I1038 HydrophobicContact CD1-CG1 4.28Å; Y1034-I1038 HydrophobicContact CD2-CG1 4.45Å; Y1034-I1038 HydrophobicContact CE1-CG1 3.82Å; Y1034-I1038 HydrophobicContact CE2-CD1 4.14Å; Y1034-I1038 HydrophobicContact CE2-CG1 4.02Å; Y1034-I1038 WeakPolarHBondContact O-CG1 3.35Å; Y1034-I1038 PolarHBondContact O-N 3.22Å
1035	F	78.9	Confident	78.4	Confident	73 Å²	73	48.3 Å²	48.3	32%	0.32	25%	0.252	S	S	.	.	H	α-helix	trans	-64.5	-37.2	177.1	-65.9	-68.1	0	0	0	112	D1029 P1032 T1039 F1087	D1029-F1035 WeakPolarHBondContact OD1-CZ 3.42Å; P1032-F1035 PolarHBondContact O-N 2.94Å; F1035-T1039 WeakPolarHBondContact O-CB 3.42Å; F1035-T1039 PolarHBondContact O-N 3.45Å; F1035-T1039 PolarHBondContact O-OG1 3.04Å; F1035-F1087 HydrophobicContact CD1-CE1 4.47Å; F1035-F1087 AromaticContact CD1-CZ 3.7Å; F1035-F1087 HydrophobicContact CD1-CZ 3.7Å; F1035-F1087 HydrophobicContact CE1-CZ 4.01Å
1036	C	80	Confident	77.9	Confident	66 Å²	66	44.7 Å²	44.7	45%	0.446	24%	0.235	S	C	.	.	H	α-helix	trans	-61	-46.1	173.6	-170.9	0	0	0	0	111	P1032 D1033 Y1034 N1040	P1032-C1036 PolarHBondContact O-N 3.17Å; D1033-C1036 WeakPolarHBondContact O-CB 3.39Å; D1033-C1036 PolarHBondContact O-N 2.93Å; Y1034-C1036 VanDerWaalsContact C-N 3.29Å; Y1034-C1036 PolarHBondContact O-N 3.15Å; C1036-N1040 VanDerWaalsContact O-CB 3.25Å; C1036-N1040 WeakPolarHBondContact O-CB 3.28Å; C1036-N1040 PolarHBondContact O-N 3.09Å; C1036-N1040 PolarHBondContact O-ND2 3.33Å; C1036-N1040 PolarHBondContact SG-ND2 2.74Å
1037	L	81.4	Confident	77.4	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-57.8	-54.7	176.1	171.6	67.6	0	0	0	111.9	T962 L966 F1005 L1008 D1033 Y1034 N1040 L1041	T962-L1037 HydrophobicContact CG2-CD1 4.2Å; T962-L1037 HydrophobicContact CG2-CD2 4.02Å; L966-L1037 HydrophobicContact CD1-CD1 4.3Å; L966-L1037 HydrophobicContact CD2-CD1 3.92Å; L966-L1037 HydrophobicContact CG-CD1 4.5Å; F1005-L1037 HydrophobicContact CE1-CD1 3.85Å; L1008-L1037 HydrophobicContact CD2-CD2 4.04Å; D1033-L1037 WeakPolarHBondContact O-CB 3.25Å; D1033-L1037 PolarHBondContact O-N 3.23Å; Y1034-L1037 WeakPolarHBondContact O-CB 3.21Å; Y1034-L1037 PolarHBondContact O-N 3.4Å; L1037-N1040 PolarHBondContact O-N 3.06Å; L1037-L1041 HydrophobicContact CD1-CD1 3.68Å; L1037-L1041 HydrophobicContact CD1-CG 4.09Å; L1037-L1041 HydrophobicContact CG-CD1 4.02Å; L1037-L1041 WeakPolarHBondContact O-CB 3.47Å; L1037-L1041 WeakPolarHBondContact O-CG 3.34Å; L1037-L1041 PolarHBondContact O-N 3.13Å
1038	I	79.6	Confident	76.8	Confident	14 Å²	14	44.9 Å²	44.9	7%	0.072	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-45.3	-177.6	-63.9	-57.7	0	0	0	111.1	Y1034 N1040 L1041 S1042 L1084 F1087	Y1034-I1038 HydrophobicContact CD1-CG1 4.28Å; Y1034-I1038 HydrophobicContact CD2-CG1 4.45Å; Y1034-I1038 HydrophobicContact CE1-CG1 3.82Å; Y1034-I1038 HydrophobicContact CE2-CD1 4.14Å; Y1034-I1038 HydrophobicContact CE2-CG1 4.02Å; Y1034-I1038 WeakPolarHBondContact O-CG1 3.35Å; Y1034-I1038 PolarHBondContact O-N 3.22Å; I1038-N1040 PolarHBondContact O-N 3.47Å; I1038-L1041 PolarHBondContact O-N 2.84Å; I1038-S1042 WeakPolarHBondContact O-CB 3.24Å; I1038-S1042 PolarHBondContact O-N 3.45Å; I1038-L1084 HydrophobicContact CG2-CD2 3.95Å; I1038-F1087 HydrophobicContact CG2-CB 4.4Å; I1038-F1087 HydrophobicContact CG2-CD1 4.09Å; I1038-F1087 HydrophobicContact CG2-CD2 4.2Å; I1038-F1087 HydrophobicContact CG2-CE1 4.48Å; I1038-F1087 HydrophobicContact CG2-CG 3.96Å
1039	T	77.2	Confident	76.1	Confident	26 Å²	26	45.8 Å²	45.8	16%	0.16	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-44.7	178.6	-56.1	0	0	0	0	111.3	F1035 S1042 R1043	F1035-T1039 WeakPolarHBondContact O-CB 3.42Å; F1035-T1039 PolarHBondContact O-N 3.45Å; F1035-T1039 PolarHBondContact O-OG1 3.04Å; T1039-S1042 PolarHBondContact O-N 3.23Å; T1039-R1043 WeakPolarHBondContact O-CB 3.4Å; T1039-R1043 VanDerWaalsContact O-CG 3.28Å; T1039-R1043 WeakPolarHBondContact O-CG 3.42Å; T1039-R1043 PolarHBondContact O-N 3.02Å
1040	N	78.5	Confident	75.2	Confident	35 Å²	35	48.8 Å²	48.8	19%	0.187	24%	0.24	C	C	.	.	H	α-helix	trans	-70.2	-37.3	-179.4	-74.4	-32.1	0	0	0	112.7	L966 L970 C1036 L1037 I1038 W1044	L966-N1040 HydrophobicContact CD1-CB 4.07Å; L966-N1040 HydrophobicContact CD2-CB 3.97Å; L966-N1040 HydrophobicContact CG-CB 4.37Å; L970-N1040 HydrophobicContact CD1-CB 4.19Å; C1036-N1040 VanDerWaalsContact O-CB 3.25Å; C1036-N1040 WeakPolarHBondContact O-CB 3.28Å; C1036-N1040 PolarHBondContact O-N 3.09Å; C1036-N1040 PolarHBondContact O-ND2 3.33Å; C1036-N1040 PolarHBondContact SG-ND2 2.74Å; L1037-N1040 PolarHBondContact O-N 3.06Å; I1038-N1040 PolarHBondContact O-N 3.47Å; N1040-W1044 VanDerWaalsContact O-CB 3.28Å; N1040-W1044 WeakPolarHBondContact O-CB 3.47Å; N1040-W1044 PolarHBondContact O-N 2.92Å
1041	L	79.7	Confident	74	Confident	13 Å²	13	47.7 Å²	47.7	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-65.5	-42.8	173.3	-74.5	175.5	0	0	0	111.5	L966 L969 F1005 L1037 I1038 W1044 F1045 L1084	L966-L1041 HydrophobicContact CD1-CD2 3.8Å; L966-L1041 HydrophobicContact CD1-CG 3.97Å; L969-L1041 HydrophobicContact CD2-CD2 3.88Å; F1005-L1041 HydrophobicContact CD1-CD1 3.96Å; F1005-L1041 HydrophobicContact CD1-CD2 4.15Å; F1005-L1041 HydrophobicContact CD2-CD2 4.15Å; F1005-L1041 HydrophobicContact CE1-CD1 4.2Å; F1005-L1041 HydrophobicContact CE1-CD2 4.17Å; F1005-L1041 HydrophobicContact CE2-CD2 4.18Å; F1005-L1041 HydrophobicContact CG-CD2 4.16Å; F1005-L1041 HydrophobicContact CZ-CD2 4.2Å; L1037-L1041 HydrophobicContact CD1-CD1 3.68Å; L1037-L1041 HydrophobicContact CD1-CG 4.09Å; L1037-L1041 HydrophobicContact CG-CD1 4.02Å; L1037-L1041 WeakPolarHBondContact O-CB 3.47Å; L1037-L1041 WeakPolarHBondContact O-CG 3.34Å; L1037-L1041 PolarHBondContact O-N 3.13Å; I1038-L1041 PolarHBondContact O-N 2.84Å; L1041-W1044 PolarHBondContact O-N 3.37Å; L1041-F1045 WeakPolarHBondContact O-CB 3.43Å; L1041-F1045 PolarHBondContact O-N 3.21Å; L1041-L1084 HydrophobicContact CB-CD2 4.26Å
1042	S	75.7	Confident	72.6	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.014	23%	0.23	C	C	.	.	H	α-helix	trans	-58.4	-52	174.4	174.4	0	0	0	0	110.9	I1038 T1039 W1044 F1045 Q1046 L1084 E1088	I1038-S1042 WeakPolarHBondContact O-CB 3.24Å; I1038-S1042 PolarHBondContact O-N 3.45Å; T1039-S1042 PolarHBondContact O-N 3.23Å; S1042-W1044 VanDerWaalsContact C-N 3.34Å; S1042-W1044 PolarHBondContact O-N 3.27Å; S1042-F1045 WeakPolarHBondContact O-CB 3.49Å; S1042-F1045 PolarHBondContact O-N 3.47Å; S1042-F1045 VanDerWaalsContact O-N 3.15Å; S1042-Q1046 WeakPolarHBondContact O-CG 3.43Å; S1042-Q1046 PolarHBondContact O-N 3.49Å; S1042-Q1046 PolarHBondContact OG-NE2 3.3Å; S1042-L1084 PolarHBondContact OG-O 3.34Å; S1042-E1088 PolarHBondContact OG-OE2 3Å
1043	R	75.4	Confident	71.3	Confident	120 Å²	120	48.7 Å²	48.7	45%	0.453	23%	0.232	S	C	.	.	H	α-helix	trans	-57.3	-48.4	178.1	-75.2	175.6	-179.2	178.1	-0.4	111.5	T1039 F1045 Q1046 Y1047 E1088	T1039-R1043 WeakPolarHBondContact O-CB 3.4Å; T1039-R1043 VanDerWaalsContact O-CG 3.28Å; T1039-R1043 WeakPolarHBondContact O-CG 3.42Å; T1039-R1043 PolarHBondContact O-N 3.02Å; R1043-F1045 VanDerWaalsContact C-N 3.3Å; R1043-F1045 PolarHBondContact O-N 3.26Å; R1043-Q1046 PolarHBondContact O-N 2.85Å; R1043-Y1047 HydrophobicContact CB-CD2 4.33Å; R1043-Y1047 HydrophobicContact CB-CE2 4.32Å; R1043-Y1047 WeakPolarHBondContact O-CB 3.44Å; R1043-Y1047 WeakPolarHBondContact O-CD2 3.41Å; R1043-Y1047 PolarHBondContact O-N 3Å; R1043-E1088 VanDerWaalsContact CG-OE1 3.31Å; R1043-E1088 WeakPolarHBondContact CG-OE1 3.49Å; R1043-E1088 IonicContact NE-OE1 3.36Å; R1043-E1088 PolarHBondContact NE-OE1 3.17Å
1044	W	75.6	Confident	69.6	Low	14 Å²	14	50.8 Å²	50.8	5%	0.053	24%	0.242	C	C	.	.	H	α-helix	trans	-58	-45.1	178.1	-179.5	88.9	0	0	0	111.5	L969 L970 Q998 L1002 N1040 L1041 S1042 Y1047 S1048	L969-W1044 HydrophobicContact CD1-CD2 4.39Å; L969-W1044 HydrophobicContact CD1-CH2 4.33Å; L969-W1044 HydrophobicContact CD1-CZ2 3.66Å; L969-W1044 HydrophobicContact CD2-CD2 3.92Å; L969-W1044 HydrophobicContact CD2-CE3 4.24Å; L969-W1044 HydrophobicContact CD2-CG 4.19Å; L969-W1044 HydrophobicContact CG-CD2 4.09Å; L969-W1044 HydrophobicContact CG-CG 4.25Å; L969-W1044 HydrophobicContact CG-CZ2 4.25Å; L969-W1044 PolarHBondContact O-NE1 3.37Å; L970-W1044 HydrophobicContact CD2-CB 4.12Å; Q998-W1044 HydrophobicContact CG-CZ2 4.26Å; L1002-W1044 HydrophobicContact CD1-CH2 4.23Å; L1002-W1044 HydrophobicContact CD2-CH2 3.69Å; L1002-W1044 HydrophobicContact CD2-CZ3 3.77Å; L1002-W1044 HydrophobicContact CG-CH2 4.35Å; N1040-W1044 VanDerWaalsContact O-CB 3.28Å; N1040-W1044 WeakPolarHBondContact O-CB 3.47Å; N1040-W1044 PolarHBondContact O-N 2.92Å; L1041-W1044 PolarHBondContact O-N 3.37Å; S1042-W1044 VanDerWaalsContact C-N 3.34Å; S1042-W1044 PolarHBondContact O-N 3.27Å; W1044-Y1047 PolarHBondContact O-N 3.4Å; W1044-S1048 WeakPolarHBondContact O-CB 3.02Å; W1044-S1048 PolarHBondContact O-N 3.3Å
1045	F	72.7	Confident	67.8	Low	7 Å²	7	51.3 Å²	51.3	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-47.4	178	-172.5	-99.8	0	0	0	111.6	L1041 S1042 R1043 Y1047 S1048 N1049 N1073 L1076 I1081 Y1085	L1041-F1045 WeakPolarHBondContact O-CB 3.43Å; L1041-F1045 PolarHBondContact O-N 3.21Å; S1042-F1045 WeakPolarHBondContact O-CB 3.49Å; S1042-F1045 PolarHBondContact O-N 3.47Å; S1042-F1045 VanDerWaalsContact O-N 3.15Å; R1043-F1045 VanDerWaalsContact C-N 3.3Å; R1043-F1045 PolarHBondContact O-N 3.26Å; F1045-Y1047 PolarHBondContact O-N 3.44Å; F1045-S1048 PolarHBondContact O-N 2.77Å; F1045-S1048 PolarHBondContact O-OG 3.33Å; F1045-N1049 WeakPolarHBondContact CE1-ND2 3.07Å; F1045-N1049 WeakPolarHBondContact CZ-ND2 3.42Å; F1045-N1049 PolarHBondContact O-N 3.23Å; F1045-N1073 WeakPolarHBondContact CE2-OD1 3.28Å; F1045-L1076 HydrophobicContact CD2-CD1 4.27Å; F1045-I1081 HydrophobicContact CE1-CG2 3.7Å; F1045-I1081 HydrophobicContact CE2-CD1 4.26Å; F1045-I1081 HydrophobicContact CE2-CG1 4.17Å; F1045-I1081 HydrophobicContact CZ-CB 4.37Å; F1045-I1081 HydrophobicContact CZ-CD1 4.05Å; F1045-I1081 HydrophobicContact CZ-CG1 3.95Å; F1045-I1081 HydrophobicContact CZ-CG2 3.61Å; F1045-Y1085 HydrophobicContact CD1-CE2 4.26Å; F1045-Y1085 HydrophobicContact CE1-CD2 4.35Å; F1045-Y1085 AromaticContact CE1-CE2 3.5Å; F1045-Y1085 HydrophobicContact CE1-CE2 3.5Å; F1045-Y1085 AromaticContact CE1-CZ 3.69Å; F1045-Y1085 HydrophobicContact CZ-CE2 4.45Å
1046	Q	69.6	Low	65.8	Low	36 Å²	36	50.5 Å²	50.5	17%	0.168	26%	0.258	C	S	.	.	H	α-helix	trans	-62.2	-43.9	176.1	-70.2	179.9	16	0	0	112.8	S1042 R1043 S1048 N1049 R1050 E1088	S1042-Q1046 WeakPolarHBondContact O-CG 3.43Å; S1042-Q1046 PolarHBondContact O-N 3.49Å; S1042-Q1046 PolarHBondContact OG-NE2 3.3Å; R1043-Q1046 PolarHBondContact O-N 2.85Å; Q1046-S1048 VanDerWaalsContact C-N 3.32Å; Q1046-S1048 PolarHBondContact O-N 3.23Å; Q1046-N1049 PolarHBondContact O-N 2.76Å; Q1046-R1050 WeakPolarHBondContact O-CB 3.31Å; Q1046-R1050 WeakPolarHBondContact O-CG 3.47Å; Q1046-R1050 PolarHBondContact O-N 2.93Å; Q1046-E1088 VanDerWaalsContact CD-OE2 3.27Å; Q1046-E1088 PolarHBondContact NE2-OE2 3.05Å; Q1046-E1088 PolarHBondContact OE1-OE2 2.87Å
1047	Y	68.8	Low	64.2	Low	139 Å²	139	53.9 Å²	53.9	55%	0.545	27%	0.272	S	S	.	.	H	α-helix	trans	-61.1	-42.6	175.7	-82	-63	0	0	0	111.4	R1043 W1044 F1045 N1049 R1050 I1051	R1043-Y1047 HydrophobicContact CB-CD2 4.33Å; R1043-Y1047 HydrophobicContact CB-CE2 4.32Å; R1043-Y1047 WeakPolarHBondContact O-CB 3.44Å; R1043-Y1047 WeakPolarHBondContact O-CD2 3.41Å; R1043-Y1047 PolarHBondContact O-N 3Å; W1044-Y1047 PolarHBondContact O-N 3.4Å; F1045-Y1047 PolarHBondContact O-N 3.44Å; Y1047-N1049 VanDerWaalsContact C-N 3.29Å; Y1047-N1049 PolarHBondContact O-N 2.92Å; Y1047-R1050 PolarHBondContact O-N 3.39Å; Y1047-I1051 WeakPolarHBondContact O-CG1 3.05Å; Y1047-I1051 PolarHBondContact O-N 3.09Å; Y1047-I1051 VanDerWaalsContact O-N 3.16Å
1048	S	67.4	Low	62.3	Low	7 Å²	7	58.6 Å²	58.6	5%	0.049	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-36.2	177.8	78.8	0	0	0	0	112.4	W1044 F1045 Q1046 Q1052	W1044-S1048 WeakPolarHBondContact O-CB 3.02Å; W1044-S1048 PolarHBondContact O-N 3.3Å; F1045-S1048 PolarHBondContact O-N 2.77Å; F1045-S1048 PolarHBondContact O-OG 3.33Å; Q1046-S1048 VanDerWaalsContact C-N 3.32Å; Q1046-S1048 PolarHBondContact O-N 3.23Å; S1048-Q1052 WeakPolarHBondContact O-CG 3.44Å; S1048-Q1052 PolarHBondContact O-NE2 2.95Å
1049	N	64.7	Low	60.6	Low	25 Å²	25	64.2 Å²	64.2	13%	0.134	33%	0.327	C	S	.	.	H	α-helix	trans	-75.9	-41.2	175.6	-77.4	-29.7	0	0	0	112.8	F1045 Q1046 Y1047 I1051 Q1052 V1053 N1069 Y1085	F1045-N1049 WeakPolarHBondContact CE1-ND2 3.07Å; F1045-N1049 WeakPolarHBondContact CZ-ND2 3.42Å; F1045-N1049 PolarHBondContact O-N 3.23Å; Q1046-N1049 PolarHBondContact O-N 2.76Å; Y1047-N1049 VanDerWaalsContact C-N 3.29Å; Y1047-N1049 PolarHBondContact O-N 2.92Å; N1049-I1051 PolarHBondContact O-N 3.33Å; N1049-Q1052 PolarHBondContact O-N 3.44Å; N1049-V1053 PolarHBondContact O-N 3.36Å; N1049-N1069 PolarHBondContact OD1-ND2 3.22Å; N1049-Y1085 PolarHBondContact ND2-OH 3.03Å; N1049-Y1085 VanDerWaalsContact ND2-OH 3.13Å
1050	R	57.8	Low	59	Low	140 Å²	140	67.9 Å²	67.9	53%	0.528	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-40.6	179.9	-77.8	-175.8	-176.9	-174.9	3.8	112.7	Q1046 Y1047 Q1052 V1053 I1054	Q1046-R1050 WeakPolarHBondContact O-CB 3.31Å; Q1046-R1050 WeakPolarHBondContact O-CG 3.47Å; Q1046-R1050 PolarHBondContact O-N 2.93Å; Y1047-R1050 PolarHBondContact O-N 3.39Å; R1050-Q1052 PolarHBondContact O-N 2.85Å; R1050-V1053 PolarHBondContact O-N 3.36Å; R1050-I1054 PolarHBondContact O-N 2.82Å
1051	I	55	Low	57.1	Low	46 Å²	46	71.5 Å²	71.5	24%	0.236	37%	0.366	C	S	.	.	H	α-helix	trans	-61.5	-33.3	178.7	-70.8	166.7	0	0	0	111.2	T974 Y1047 N1049 G1055	T974-I1051 VanDerWaalsContact CB-CD1 3.47Å; T974-I1051 WeakPolarHBondContact OG1-CD1 3.28Å; Y1047-I1051 WeakPolarHBondContact O-CG1 3.05Å; Y1047-I1051 PolarHBondContact O-N 3.09Å; Y1047-I1051 VanDerWaalsContact O-N 3.16Å; N1049-I1051 PolarHBondContact O-N 3.33Å; I1051-G1055 PolarHBondContact O-N 3.4Å
1052	Q	49.4	Very low	55.2	Low	30 Å²	30	75.1 Å²	75.1	14%	0.14	38%	0.382	C	S	.	.	H	α-helix	trans	-74	-37.4	177.6	-65.5	176.8	25.2	0	0	112.6	S1048 N1049 R1050 I1054 G1055 S1056 N1069	S1048-Q1052 WeakPolarHBondContact O-CG 3.44Å; S1048-Q1052 PolarHBondContact O-NE2 2.95Å; N1049-Q1052 PolarHBondContact O-N 3.44Å; R1050-Q1052 PolarHBondContact O-N 2.85Å; Q1052-I1054 VanDerWaalsContact C-N 3.31Å; Q1052-I1054 PolarHBondContact O-N 2.97Å; Q1052-G1055 PolarHBondContact O-N 3.47Å; Q1052-S1056 PolarHBondContact O-N 3.09Å; Q1052-S1056 VanDerWaalsContact O-N 3.13Å; Q1052-N1069 VanDerWaalsContact OE1-CG 3.23Å; Q1052-N1069 PolarHBondContact OE1-ND2 3.38Å
1053	V	48	Very low	53.5	Low	108 Å²	108	83 Å²	83	66%	0.655	42%	0.419	S	S	*	.	H	α-helix	trans	-62.6	-39.6	176.3	177.8	0	0	0	0	111.1	N1049 R1050 S1056	N1049-V1053 PolarHBondContact O-N 3.36Å; R1050-V1053 PolarHBondContact O-N 3.36Å; V1053-S1056 WeakPolarHBondContact O-CB 3.27Å; V1053-S1056 PolarHBondContact O-N 3.38Å
1054	I	45.3	Very low	51.7	Low	137 Å²	137	84.1 Å²	84.1	70%	0.703	43%	0.429	S	S	*	.	H	α-helix	trans	-69.8	-35.4	178.1	-61.2	168.9	0	0	0	111.2	R1050 Q1052 S1056	R1050-I1054 PolarHBondContact O-N 2.82Å; Q1052-I1054 VanDerWaalsContact C-N 3.31Å; Q1052-I1054 PolarHBondContact O-N 2.97Å; I1054-S1056 PolarHBondContact O-N 3.25Å
1055	G	43.1	Very low	49.9	Very low	36 Å²	36	85.1 Å²	85.1	37%	0.371	44%	0.438	S	S	.	.	H	α-helix	trans	-70.1	-17	174.8	0	0	0	0	0	114.6	I1051 Q1052 N1057 N1058	I1051-G1055 PolarHBondContact O-N 3.4Å; Q1052-G1055 PolarHBondContact O-N 3.47Å; G1055-N1057 PolarHBondContact O-N 2.87Å; G1055-N1057 VanDerWaalsContact O-N 3.14Å; G1055-N1058 PolarHBondContact O-N 3.2Å
1056	S	37.7	Very low	48.3	Very low	56 Å²	56	88.7 Å²	88.7	39%	0.392	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-8.3	-173.4	-168.6	0	0	0	0	115	Q1052 V1053 I1054 N1058	Q1052-S1056 PolarHBondContact O-N 3.09Å; Q1052-S1056 VanDerWaalsContact O-N 3.13Å; V1053-S1056 WeakPolarHBondContact O-CB 3.27Å; V1053-S1056 PolarHBondContact O-N 3.38Å; I1054-S1056 PolarHBondContact O-N 3.25Å; S1056-N1058 VanDerWaalsContact C-N 3.31Å
1057	N	46.2	Very low	47.1	Very low	138 Å²	138	94.4 Å²	94.4	74%	0.738	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-11.5	177.5	-76.9	-6.4	0	0	0	113.8	G1055	G1055-N1057 PolarHBondContact O-N 2.87Å; G1055-N1057 VanDerWaalsContact O-N 3.14Å
1058	N	41.4	Very low	45.9	Very low	101 Å²	101	90.4 Å²	90.4	54%	0.54	47%	0.469	S	S	.	.	S	Bend	trans	-104.8	103.3	175.6	-73.7	-16.5	0	0	0	109.9	G1055 S1056 S1060 Y1061	G1055-N1058 PolarHBondContact O-N 3.2Å; S1056-N1058 VanDerWaalsContact C-N 3.31Å; N1058-S1060 PolarHBondContact O-N 2.95Å; N1058-Y1061 HydrophobicContact CB-CD2 3.45Å; N1058-Y1061 VanDerWaalsContact CB-CD2 3.45Å; N1058-Y1061 HydrophobicContact CB-CE2 3.69Å; N1058-Y1061 PolarHBondContact O-N 3.48Å
1059	N	43.7	Very low	44.8	Very low	133 Å²	133	91.4 Å²	91.4	71%	0.711	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-13.3	-170.8	-71.2	-20	0	0	0	116
1060	S	43.4	Very low	44	Very low	103 Å²	103	97.7 Å²	97.7	72%	0.72	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-15.8	176.8	58.4	0	0	0	0	114.2	N1058	N1058-S1060 PolarHBondContact O-N 2.95Å
1061	Y	39.3	Very low	43.5	Very low	111 Å²	111	93.4 Å²	93.4	44%	0.435	49%	0.489	S	S	.	.	S	Bend	trans	-93.7	-1.9	-174.2	-63.7	-85.1	0	0	0	114.2	N1058 H1063 S1065	N1058-Y1061 HydrophobicContact CB-CD2 3.45Å; N1058-Y1061 VanDerWaalsContact CB-CD2 3.45Å; N1058-Y1061 HydrophobicContact CB-CE2 3.69Å; N1058-Y1061 PolarHBondContact O-N 3.48Å; Y1061-H1063 PolarHBondContact O-N 3.4Å; Y1061-S1065 PolarHBondContact O-OG 2.94Å
1062	Q	38.6	Very low	43.3	Very low	88 Å²	88	92.1 Å²	92.1	41%	0.411	48%	0.482	S	S	.	.	H	α-helix	trans	-68.7	-30.2	-170.9	-77	-172.5	-15.9	0	0	114.5	N1066	Q1062-N1066 VanDerWaalsContact O-CB 3.32Å; Q1062-N1066 WeakPolarHBondContact O-CB 3.41Å; Q1062-N1066 VanDerWaalsContact O-CG 3.27Å; Q1062-N1066 PolarHBondContact O-ND2 3.44Å
1063	H	40.1	Very low	43.3	Very low	168 Å²	168	93 Å²	93	78%	0.778	49%	0.488	S	S	*	.	H	α-helix	trans	-83.9	-31.7	-166.3	-136.8	-56.9	0	0	0	114.2	Y1061	Y1061-H1063 PolarHBondContact O-N 3.4Å
1064	E	37.4	Very low	43.4	Very low	143 Å²	143	95.5 Å²	95.5	67%	0.668	49%	0.49	S	S	*	.	H	α-helix	trans	-88.1	-42.4	179.2	-71.2	-157.2	146.2	0	0	113.1	N1066 K1067 L1068	E1064-N1066 PolarHBondContact O-N 2.9Å; E1064-K1067 PolarHBondContact O-N 2.86Å; E1064-L1068 PolarHBondContact O-N 2.97Å
1065	S	37.4	Very low	43.7	Very low	35 Å²	35	90.7 Å²	90.7	25%	0.245	47%	0.466	C	S	.	.	H	α-helix	trans	-62.4	-43.2	-179.8	55.1	0	0	0	0	112.3	Y1061 K1067 L1068 N1069	Y1061-S1065 PolarHBondContact O-OG 2.94Å; S1065-K1067 VanDerWaalsContact C-N 3.34Å; S1065-K1067 PolarHBondContact O-N 3.11Å; S1065-L1068 PolarHBondContact O-N 3.01Å; S1065-N1069 PolarHBondContact O-N 3.37Å
1066	N	40.1	Very low	44.2	Very low	82 Å²	82	89.5 Å²	89.5	44%	0.439	45%	0.451	S	S	.	.	H	α-helix	trans	-62.8	-38.7	175.7	-75.7	-24.8	0	0	0	112.3	Q1062 E1064 L1068 N1069 Y1070	Q1062-N1066 VanDerWaalsContact O-CB 3.32Å; Q1062-N1066 WeakPolarHBondContact O-CB 3.41Å; Q1062-N1066 VanDerWaalsContact O-CG 3.27Å; Q1062-N1066 PolarHBondContact O-ND2 3.44Å; E1064-N1066 PolarHBondContact O-N 2.9Å; N1066-L1068 VanDerWaalsContact C-N 3.28Å; N1066-L1068 PolarHBondContact O-N 2.64Å; N1066-N1069 PolarHBondContact O-N 3.42Å; N1066-Y1070 VanDerWaalsContact O-CD2 3.25Å; N1066-Y1070 WeakPolarHBondContact O-CD2 3.5Å; N1066-Y1070 PolarHBondContact O-N 3.38Å
1067	K	44.1	Very low	44.9	Very low	157 Å²	157	91.1 Å²	91.1	68%	0.683	45%	0.448	S	S	*	.	H	α-helix	trans	-64.5	-35.6	179.8	-161.4	176.4	-174.8	178.2	0	111.6	E1064 S1065 S1071	E1064-K1067 PolarHBondContact O-N 2.86Å; S1065-K1067 VanDerWaalsContact C-N 3.34Å; S1065-K1067 PolarHBondContact O-N 3.11Å; K1067-S1071 PolarHBondContact O-N 2.78Å; K1067-S1071 VanDerWaalsContact O-N 3.12Å
1068	L	43.4	Very low	45.1	Very low	54 Å²	54	88.3 Å²	88.3	28%	0.283	44%	0.437	S	S	.	.	H	α-helix	trans	-72.6	-38.5	176.5	-127.5	141.2	0	0	0	111.6	L977 L995 E1064 S1065 N1066 S1071 N1072	L977-L1068 HydrophobicContact CD2-CD2 3.78Å; L995-L1068 HydrophobicContact CD1-CD2 4.44Å; E1064-L1068 PolarHBondContact O-N 2.97Å; S1065-L1068 PolarHBondContact O-N 3.01Å; N1066-L1068 VanDerWaalsContact C-N 3.28Å; N1066-L1068 PolarHBondContact O-N 2.64Å; L1068-S1071 WeakPolarHBondContact CA-OG 3.39Å; L1068-S1071 PolarHBondContact O-N 3.22Å; L1068-S1071 VanDerWaalsContact O-N 3.16Å; L1068-S1071 PolarHBondContact O-OG 3.4Å; L1068-N1072 PolarHBondContact O-N 3.13Å
1069	N	44.9	Very low	45.5	Very low	28 Å²	28	87.5 Å²	87.5	15%	0.15	43%	0.43	C	S	.	.	H	α-helix	trans	-64.8	-43.8	174.5	-154.3	3.7	0	0	0	112	N1049 Q1052 S1065 N1066 S1071 N1072 N1073	N1049-N1069 PolarHBondContact OD1-ND2 3.22Å; Q1052-N1069 VanDerWaalsContact OE1-CG 3.23Å; Q1052-N1069 PolarHBondContact OE1-ND2 3.38Å; S1065-N1069 PolarHBondContact O-N 3.37Å; N1066-N1069 PolarHBondContact O-N 3.42Å; N1069-S1071 VanDerWaalsContact C-N 3.28Å; N1069-S1071 PolarHBondContact O-N 3.43Å; N1069-N1072 PolarHBondContact O-N 3.25Å; N1069-N1073 VanDerWaalsContact O-CB 3.29Å; N1069-N1073 WeakPolarHBondContact O-CB 3.18Å; N1069-N1073 PolarHBondContact O-N 3.14Å; N1069-N1073 PolarHBondContact O-ND2 3.24Å; N1069-N1073 PolarHBondContact OD1-ND2 2.82Å; N1069-N1073 PolarHBondContact OD1-OD1 3.29Å
1070	Y	47.9	Very low	45.8	Very low	157 Å²	157	81.7 Å²	81.7	62%	0.616	40%	0.399	S	S	*	.	H	α-helix	trans	-53.7	-48.4	169.6	-87.4	-73.7	0	0	0	110.4	N1066 N1072 N1073 F1074	N1066-Y1070 VanDerWaalsContact O-CD2 3.25Å; N1066-Y1070 WeakPolarHBondContact O-CD2 3.5Å; N1066-Y1070 PolarHBondContact O-N 3.38Å; Y1070-N1072 PolarHBondContact O-N 3.13Å; Y1070-N1073 PolarHBondContact O-N 3.25Å; Y1070-F1074 AromaticContact CD1-CE2 3.77Å; Y1070-F1074 HydrophobicContact CD1-CE2 3.77Å; Y1070-F1074 HydrophobicContact CD1-CZ 4.46Å; Y1070-F1074 HydrophobicContact CG-CE2 4.48Å; Y1070-F1074 WeakPolarHBondContact O-CB 3.36Å; Y1070-F1074 WeakPolarHBondContact O-CD2 3.34Å; Y1070-F1074 WeakPolarHBondContact O-CG 3.39Å; Y1070-F1074 PolarHBondContact O-N 3.04Å
1071	S	48	Very low	46.3	Very low	50 Å²	50	78 Å²	78	35%	0.35	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-41	-178.9	73.1	0	0	0	0	114	K1067 L1068 N1069 F1074 I1075	K1067-S1071 PolarHBondContact O-N 2.78Å; K1067-S1071 VanDerWaalsContact O-N 3.12Å; L1068-S1071 WeakPolarHBondContact CA-OG 3.39Å; L1068-S1071 PolarHBondContact O-N 3.22Å; L1068-S1071 VanDerWaalsContact O-N 3.16Å; L1068-S1071 PolarHBondContact O-OG 3.4Å; N1069-S1071 VanDerWaalsContact C-N 3.28Å; N1069-S1071 PolarHBondContact O-N 3.43Å; S1071-F1074 PolarHBondContact O-N 3.21Å; S1071-I1075 WeakPolarHBondContact O-CD1 3.38Å; S1071-I1075 WeakPolarHBondContact O-CG1 3.47Å; S1071-I1075 PolarHBondContact O-N 3.16Å
1072	N	50.3	Low	46.8	Very low	19 Å²	19	79.1 Å²	79.1	10%	0.102	38%	0.38	C	S	.	.	H	α-helix	trans	-72.1	-39.2	-179.8	-71	-12.5	0	0	0	111.8	L1002 L1068 N1069 Y1070 F1074 I1075 L1076	L1002-N1072 HydrophobicContact CD1-CB 4.21Å; L1002-N1072 WeakPolarHBondContact CD1-OD1 3.19Å; L1068-N1072 PolarHBondContact O-N 3.13Å; N1069-N1072 PolarHBondContact O-N 3.25Å; Y1070-N1072 PolarHBondContact O-N 3.13Å; N1072-F1074 VanDerWaalsContact C-N 3.27Å; N1072-F1074 PolarHBondContact O-N 2.69Å; N1072-I1075 PolarHBondContact O-N 2.96Å; N1072-I1075 VanDerWaalsContact O-N 3.11Å; N1072-L1076 PolarHBondContact O-N 3.42Å
1073	N	49.7	Very low	47.7	Very low	48 Å²	48	79.3 Å²	79.3	26%	0.257	38%	0.381	S	S	.	.	H	α-helix	trans	-70.6	-21.3	174.6	-66	-19.7	0	0	0	112.9	F1045 N1069 Y1070 L1076 I1081	F1045-N1073 WeakPolarHBondContact CE2-OD1 3.28Å; N1069-N1073 VanDerWaalsContact O-CB 3.29Å; N1069-N1073 WeakPolarHBondContact O-CB 3.18Å; N1069-N1073 PolarHBondContact O-N 3.14Å; N1069-N1073 PolarHBondContact O-ND2 3.24Å; N1069-N1073 PolarHBondContact OD1-ND2 2.82Å; N1069-N1073 PolarHBondContact OD1-OD1 3.29Å; Y1070-N1073 PolarHBondContact O-N 3.25Å; N1073-L1076 CarbonylContact C-O 3.52Å; N1073-I1081 HydrophobicContact CB-CD1 4.01Å
1074	F	50	Low	48.4	Very low	161 Å²	161	71.5 Å²	71.5	71%	0.706	35%	0.345	S	S	*	.	H	α-helix	trans	-80	-24.1	169.2	-81.6	-62.3	0	0	0	112.4	Y1070 S1071 N1072	Y1070-F1074 AromaticContact CD1-CE2 3.77Å; Y1070-F1074 HydrophobicContact CD1-CE2 3.77Å; Y1070-F1074 HydrophobicContact CD1-CZ 4.46Å; Y1070-F1074 HydrophobicContact CG-CE2 4.48Å; Y1070-F1074 WeakPolarHBondContact O-CB 3.36Å; Y1070-F1074 WeakPolarHBondContact O-CD2 3.34Å; Y1070-F1074 WeakPolarHBondContact O-CG 3.39Å; Y1070-F1074 PolarHBondContact O-N 3.04Å; S1071-F1074 PolarHBondContact O-N 3.21Å; N1072-F1074 VanDerWaalsContact C-N 3.27Å; N1072-F1074 PolarHBondContact O-N 2.69Å
1075	I	51.7	Low	49.3	Very low	37 Å²	37	69.8 Å²	69.8	19%	0.19	33%	0.334	C	S	.	.	H	α-helix	trans	-80.8	-44.2	179.7	-68	161.4	0	0	0	111.1	L1002 L1003 S1071 N1072	L1002-I1075 HydrophobicContact CB-CG2 3.84Å; L1002-I1075 WeakPolarHBondContact O-CG2 3.48Å; L1003-I1075 HydrophobicContact CD2-CG1 4.45Å; L1003-I1075 HydrophobicContact CD2-CG2 3.96Å; L1003-I1075 HydrophobicContact CG-CG2 4.26Å; S1071-I1075 WeakPolarHBondContact O-CD1 3.38Å; S1071-I1075 WeakPolarHBondContact O-CG1 3.47Å; S1071-I1075 PolarHBondContact O-N 3.16Å; N1072-I1075 PolarHBondContact O-N 2.96Å; N1072-I1075 VanDerWaalsContact O-N 3.11Å
1076	L	53.4	Low	50.2	Low	10 Å²	10	73.4 Å²	73.4	5%	0.052	35%	0.35	C	S	.	.	S	Bend	trans	-83.3	121.3	169.2	-67.9	171.3	0	0	0	108.2	L1002 F1005 F1045 N1072 N1073 L1080	L1002-L1076 HydrophobicContact CD2-CD1 3.84Å; L1002-L1076 HydrophobicContact CD2-CD2 4.49Å; L1002-L1076 HydrophobicContact CD2-CG 4.13Å; F1005-L1076 HydrophobicContact CB-CD2 4.14Å; F1045-L1076 HydrophobicContact CD2-CD1 4.27Å; N1072-L1076 PolarHBondContact O-N 3.42Å; N1073-L1076 CarbonylContact C-O 3.52Å; L1076-L1080 HydrophobicContact CD2-CD2 4.32Å
1077	R	52.3	Low	50.7	Low	91 Å²	91	73.4 Å²	73.4	34%	0.343	35%	0.346	S	S	.	.			trans	-57.1	140.3	-176.6	-96.5	-161.3	-176.9	-157.2	0.5	111.9	E1079 L1080 I1081	R1077-E1079 WeakPolarHBondContact CB-OE2 3.49Å; R1077-E1079 PolarHBondContact O-N 3.15Å; R1077-E1079 VanDerWaalsContact O-N 3.16Å; R1077-L1080 WeakPolarHBondContact O-CB 3.46Å; R1077-L1080 PolarHBondContact O-N 3.41Å; R1077-I1081 PolarHBondContact O-N 2.91Å
1078	P	49.7	Very low	50.9	Low	78 Å²	78	67.1 Å²	67.1	51%	0.506	32%	0.319	S	S	.	.	H	α-helix	trans	-54.7	-35.9	-178.4	-23.5	31.3	0	0	0	113.5	L1080 I1081 E1082	P1078-L1080 PolarHBondContact O-N 3.38Å; P1078-I1081 WeakPolarHBondContact O-CB 3.38Å; P1078-I1081 PolarHBondContact O-N 2.97Å; P1078-E1082 PolarHBondContact O-N 2.85Å; P1078-E1082 VanDerWaalsContact O-N 3.07Å
1079	E	49.5	Very low	51.3	Low	84 Å²	84	68.3 Å²	68.3	39%	0.393	33%	0.332	S	S	.	.	H	α-helix	trans	-62	-34.7	-178.9	-57.2	90.4	159.7	0	0	111.7	R1077 E1083	R1077-E1079 WeakPolarHBondContact CB-OE2 3.49Å; R1077-E1079 PolarHBondContact O-N 3.15Å; R1077-E1079 VanDerWaalsContact O-N 3.16Å; E1079-E1083 WeakPolarHBondContact O-CG 3.48Å; E1079-E1083 PolarHBondContact O-N 3.17Å; E1079-E1083 VanDerWaalsContact O-N 3.09Å
1080	L	51.8	Low	51.4	Low	11 Å²	11	70.4 Å²	70.4	6%	0.058	36%	0.36	C	S	.	.	H	α-helix	trans	-75.7	-34.1	174.7	-169.8	86.5	0	0	0	111.9	T1009 L1076 R1077 P1078 E1082 E1083 L1084	T1009-L1080 HydrophobicContact CG2-CD1 3.59Å; T1009-L1080 HydrophobicContact CG2-CD2 3.24Å; T1009-L1080 HydrophobicContact CG2-CG 3.94Å; L1076-L1080 HydrophobicContact CD2-CD2 4.32Å; R1077-L1080 WeakPolarHBondContact O-CB 3.46Å; R1077-L1080 PolarHBondContact O-N 3.41Å; P1078-L1080 PolarHBondContact O-N 3.38Å; L1080-E1082 PolarHBondContact O-N 2.89Å; L1080-E1083 PolarHBondContact O-N 3.04Å; L1080-L1084 HydrophobicContact CD2-CD1 3.63Å; L1080-L1084 HydrophobicContact CD2-CG 4.34Å; L1080-L1084 HydrophobicContact CG-CD1 3.81Å; L1080-L1084 HydrophobicContact CG-CG 4Å; L1080-L1084 VanDerWaalsContact O-CB 3.27Å; L1080-L1084 WeakPolarHBondContact O-CB 3.46Å; L1080-L1084 VanDerWaalsContact O-CG 3.22Å; L1080-L1084 WeakPolarHBondContact O-CG 3.45Å; L1080-L1084 PolarHBondContact O-N 3.49Å
1081	I	52.1	Low	51.3	Low	25 Å²	25	68 Å²	68	13%	0.128	36%	0.358	C	S	.	.	H	α-helix	trans	-60.2	-43.5	176.2	-64.5	173.2	0	0	0	108.7	F1045 N1073 R1077 P1078 Y1085	F1045-I1081 HydrophobicContact CE1-CG2 3.7Å; F1045-I1081 HydrophobicContact CE2-CD1 4.26Å; F1045-I1081 HydrophobicContact CE2-CG1 4.17Å; F1045-I1081 HydrophobicContact CZ-CB 4.37Å; F1045-I1081 HydrophobicContact CZ-CD1 4.05Å; F1045-I1081 HydrophobicContact CZ-CG1 3.95Å; F1045-I1081 HydrophobicContact CZ-CG2 3.61Å; N1073-I1081 HydrophobicContact CB-CD1 4.01Å; R1077-I1081 PolarHBondContact O-N 2.91Å; P1078-I1081 WeakPolarHBondContact O-CB 3.38Å; P1078-I1081 PolarHBondContact O-N 2.97Å; I1081-Y1085 HydrophobicContact CG2-CD2 3.67Å; I1081-Y1085 HydrophobicContact CG2-CE2 3.56Å; I1081-Y1085 WeakPolarHBondContact O-CB 3.47Å; I1081-Y1085 WeakPolarHBondContact O-CD2 3.49Å; I1081-Y1085 PolarHBondContact O-N 3.04Å
1082	E	51.7	Low	50.6	Low	135 Å²	135	71.9 Å²	71.9	63%	0.631	37%	0.37	S	S	*	.	H	α-helix	trans	-61.6	-50	173.2	-66.4	-176.6	173.1	0	0	112	P1078 L1080 L1084 Y1085 D1086	P1078-E1082 PolarHBondContact O-N 2.85Å; P1078-E1082 VanDerWaalsContact O-N 3.07Å; L1080-E1082 PolarHBondContact O-N 2.89Å; E1082-L1084 PolarHBondContact O-N 3.27Å; E1082-Y1085 PolarHBondContact O-N 3.1Å; E1082-D1086 PolarHBondContact O-N 3.04Å
1083	E	55.9	Low	49.7	Very low	92 Å²	92	77.5 Å²	77.5	43%	0.43	41%	0.405	S	S	.	.	H	α-helix	trans	-62.1	-39.1	178.7	-74.4	178.6	-177.2	0	0	113.5	E1079 L1080 D1086 F1087	E1079-E1083 WeakPolarHBondContact O-CG 3.48Å; E1079-E1083 PolarHBondContact O-N 3.17Å; E1079-E1083 VanDerWaalsContact O-N 3.09Å; L1080-E1083 PolarHBondContact O-N 3.04Å; E1083-D1086 PolarHBondContact O-N 3.36Å; E1083-F1087 PolarHBondContact O-N 2.94Å
1084	L	56.2	Low	48.9	Very low	5 Å²	5	80.4 Å²	80.4	3%	0.026	43%	0.427	C	S	.	.	H	α-helix	trans	-68.5	-37.5	176.9	-72.8	170.5	0	0	0	111.5	I1038 L1041 S1042 L1080 E1082	I1038-L1084 HydrophobicContact CG2-CD2 3.95Å; L1041-L1084 HydrophobicContact CB-CD2 4.26Å; S1042-L1084 PolarHBondContact OG-O 3.34Å; L1080-L1084 HydrophobicContact CD2-CD1 3.63Å; L1080-L1084 HydrophobicContact CD2-CG 4.34Å; L1080-L1084 HydrophobicContact CG-CD1 3.81Å; L1080-L1084 HydrophobicContact CG-CG 4Å; L1080-L1084 VanDerWaalsContact O-CB 3.27Å; L1080-L1084 WeakPolarHBondContact O-CB 3.46Å; L1080-L1084 VanDerWaalsContact O-CG 3.22Å; L1080-L1084 WeakPolarHBondContact O-CG 3.45Å; L1080-L1084 PolarHBondContact O-N 3.49Å; E1082-L1084 PolarHBondContact O-N 3.27Å
1085	Y	56.2	Low	48.1	Very low	107 Å²	107	77.8 Å²	77.8	42%	0.42	43%	0.428	S	S	.	.	H	α-helix	trans	-64.7	-42.1	172.4	-88.9	-62.4	0	0	0	111.7	F1045 N1049 I1081 E1082 S1089	F1045-Y1085 HydrophobicContact CD1-CE2 4.26Å; F1045-Y1085 HydrophobicContact CE1-CD2 4.35Å; F1045-Y1085 AromaticContact CE1-CE2 3.5Å; F1045-Y1085 HydrophobicContact CE1-CE2 3.5Å; F1045-Y1085 AromaticContact CE1-CZ 3.69Å; F1045-Y1085 HydrophobicContact CZ-CE2 4.45Å; N1049-Y1085 PolarHBondContact ND2-OH 3.03Å; N1049-Y1085 VanDerWaalsContact ND2-OH 3.13Å; I1081-Y1085 HydrophobicContact CG2-CD2 3.67Å; I1081-Y1085 HydrophobicContact CG2-CE2 3.56Å; I1081-Y1085 WeakPolarHBondContact O-CB 3.47Å; I1081-Y1085 WeakPolarHBondContact O-CD2 3.49Å; I1081-Y1085 PolarHBondContact O-N 3.04Å; E1082-Y1085 PolarHBondContact O-N 3.1Å; Y1085-S1089 WeakPolarHBondContact O-CB 3.4Å; Y1085-S1089 PolarHBondContact O-N 3.22Å
1086	D	55.7	Low	47	Very low	111 Å²	111	83.5 Å²	83.5	59%	0.594	46%	0.46	S	S	*	.	H	α-helix	trans	-65.5	-40.2	-179.2	-79.4	-9.2	0	0	0	112	E1082 E1083 E1088 S1089 G1090	E1082-D1086 PolarHBondContact O-N 3.04Å; E1083-D1086 PolarHBondContact O-N 3.36Å; D1086-E1088 PolarHBondContact O-N 2.81Å; D1086-S1089 PolarHBondContact O-N 3.18Å; D1086-S1089 PolarHBondContact O-OG 3.25Å; D1086-G1090 PolarHBondContact O-N 3.3Å
1087	F	49.9	Very low	45.9	Very low	82 Å²	82	88.1 Å²	88.1	36%	0.36	49%	0.492	S	S	.	.	H	α-helix	trans	-60	-39.3	-174.8	-154	-90.8	0	0	0	113.8	F1035 I1038 E1083	F1035-F1087 HydrophobicContact CD1-CE1 4.47Å; F1035-F1087 AromaticContact CD1-CZ 3.7Å; F1035-F1087 HydrophobicContact CD1-CZ 3.7Å; F1035-F1087 HydrophobicContact CE1-CZ 4.01Å; I1038-F1087 HydrophobicContact CG2-CB 4.4Å; I1038-F1087 HydrophobicContact CG2-CD1 4.09Å; I1038-F1087 HydrophobicContact CG2-CD2 4.2Å; I1038-F1087 HydrophobicContact CG2-CE1 4.48Å; I1038-F1087 HydrophobicContact CG2-CG 3.96Å; E1083-F1087 PolarHBondContact O-N 2.94Å
1088	E	49.4	Very low	44.8	Very low	24 Å²	24	91.3 Å²	91.3	11%	0.112	52%	0.516	C	S	.	.	H	α-helix	trans	-91.2	-21	176.1	-96.4	-178.1	158.5	0	0	113.8	S1042 R1043 Q1046 D1086 G1090 L1091 E1092	S1042-E1088 PolarHBondContact OG-OE2 3Å; R1043-E1088 VanDerWaalsContact CG-OE1 3.31Å; R1043-E1088 WeakPolarHBondContact CG-OE1 3.49Å; R1043-E1088 IonicContact NE-OE1 3.36Å; R1043-E1088 PolarHBondContact NE-OE1 3.17Å; Q1046-E1088 VanDerWaalsContact CD-OE2 3.27Å; Q1046-E1088 PolarHBondContact NE2-OE2 3.05Å; Q1046-E1088 PolarHBondContact OE1-OE2 2.87Å; D1086-E1088 PolarHBondContact O-N 2.81Å; E1088-G1090 PolarHBondContact O-N 3.01Å; E1088-G1090 VanDerWaalsContact O-N 3.13Å; E1088-L1091 HydrophobicContact CG-CD1 4.23Å; E1088-L1091 WeakPolarHBondContact O-CA 3.42Å; E1088-L1091 PolarHBondContact O-N 3.16Å; E1088-E1092 PolarHBondContact O-N 3.29Å
1089	S	50.2	Low	43.8	Very low	79 Å²	79	93.7 Å²	93.7	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-59.2	-25.5	171.9	75.9	0	0	0	0	112.4	Y1085 D1086	Y1085-S1089 WeakPolarHBondContact O-CB 3.4Å; Y1085-S1089 PolarHBondContact O-N 3.22Å; D1086-S1089 PolarHBondContact O-N 3.18Å; D1086-S1089 PolarHBondContact O-OG 3.25Å
1090	G	48	Very low	42.6	Very low	72 Å²	72	102.8 Å²	102.8	74%	0.742	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-14.3	170.5	0	0	0	0	0	115.5	D1086 E1088	D1086-G1090 PolarHBondContact O-N 3.3Å; E1088-G1090 PolarHBondContact O-N 3.01Å; E1088-G1090 VanDerWaalsContact O-N 3.13Å
1091	L	45.5	Very low	42.2	Very low	107 Å²	107	107.4 Å²	107.4	56%	0.56	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	-9.4	-178.5	-80.6	156.8	0	0	0	113.4	E1088 T1093	E1088-L1091 HydrophobicContact CG-CD1 4.23Å; E1088-L1091 WeakPolarHBondContact O-CA 3.42Å; E1088-L1091 PolarHBondContact O-N 3.16Å; L1091-T1093 VanDerWaalsContact C-N 3.33Å; L1091-T1093 PolarHBondContact O-N 3.39Å
1092	E	34.3	Very low	41.6	Very low	132 Å²	132	111.7 Å²	111.7	62%	0.617	62%	0.618	S	S	*	*			trans	-77.7	76.3	176.5	-71.6	-160.7	162.3	0	0	113	E1088	E1088-E1092 PolarHBondContact O-N 3.29Å
1093	T	30.6	Very low	41.1	Very low	136 Å²	136	110.4 Å²	110.4	83%	0.834	62%	0.617	S	S	*	*			trans	-147	74.3	130.4	53.7	0	0	0	0	111.3	L1091	L1091-T1093 VanDerWaalsContact C-N 3.33Å; L1091-T1093 PolarHBondContact O-N 3.39Å
1094	P	32.8	Very low	40.2	Very low	109 Å²	109	111.5 Å²	111.5	71%	0.708	63%	0.628	S	S	*	*			trans	-91.5	100.4	152.7	25.7	-11.7	0	0	0	107.1	N1096	P1094-N1096 PolarHBondContact O-N 3.2Å
1095	S	33.4	Very low	39.2	Very low	106 Å²	106	118.1 Å²	118.1	74%	0.741	67%	0.666	S	S	*	*			trans	-43.4	120	165.9	47.8	0	0	0	0	110.7	S1097	S1095-S1097 PolarHBondContact O-N 3.1Å
1096	N	29.7	Very low	38.1	Very low	158 Å²	158	118.9 Å²	118.9	85%	0.845	68%	0.682	S	S	*	*			trans	-4.7	92.9	161.2	-71	-18.3	0	0	0	114.7	P1094	P1094-N1096 PolarHBondContact O-N 3.2Å
1097	S	30.1	Very low	36.8	Very low	106 Å²	106	119.4 Å²	119.4	74%	0.741	69%	0.689	S	S	*	*			trans	-116.3	86	156.4	63.8	0	0	0	0	107.9	S1095 V1099	S1095-S1097 PolarHBondContact O-N 3.1Å; S1097-V1099 PolarHBondContact O-N 3.3Å
1098	N	27.8	Very low	35.8	Very low	158 Å²	158	122.3 Å²	122.3	85%	0.845	71%	0.714	S	S	*	*			trans	-57.9	100.6	158.5	-75.1	-25.4	0	0	0	108.2
1099	V	29.7	Very low	34.7	Very low	128 Å²	128	130.5 Å²	130.5	78%	0.776	76%	0.764	S	S	*	*			trans	-139.2	125.6	152.6	-174.8	0	0	0	0	107.4	S1097	S1097-V1099 PolarHBondContact O-N 3.3Å
1100	F	24.3	Very low	33.3	Very low	275 Å²	275	135.2 Å²	135.2	100%	1.206	78%	0.783	S	S	*	*			trans	-47.3	0	-175.2	-79.6	-96.5	0	0	0	116.2

Retrieved 1,100 of 1,100 residues in 289.8 ms (Link to these results)

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