A0A3Q0KLU4_SCHMA Loading...

Putative metazoan probable membrane protein

AlphaFold DB , UniProt , Accession A0A3Q0KLU4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,021 aa.

						>A0A3Q0KLU4_SCHMA|A0A3Q0KLU4
MSSTPICDRVNTYANKSRVIPGYEGIPYNLCVNVIGWVVLMSGFTLLRKLAWDYGRMATFQPRKNRWTLFSEINDENVSTDSVSIDSVEQNPSTNDPGYFSWIVNYFKLTSADLRSKAGNDAVQYLRFHFYLIIYTAITTVFCLVVILPVNIHGTLKSPDLQKFGVTTISNISANSSSLWVHTIFGIGFFLLAFFLMQHFSRQFRRESTRTPNFSEKTLMISGISRRNCSRALILRHFAELYPECPVEDVQICYDTRKLIKLENQRDTVRAALRYSVESYERKHKRPFIIPCCCGWMYKKCYENYCCRSCCWNTNHQINSSQNYISNNNDNHKDNIIDTIPRSETVNNQLSSSSSSSSSPPSPTPQINYKKCKLCLCCSCPPPTDAINYYTNKKIYLQEEIVKHYETTIKKPIGIAFVTFSTKYAAAHVCKEYRNICRRLIISIMSSTSSVLKSHMWSVDFAPVPSNIIWANLAATRTVWWCRAIFINLCVFFVVFFLTTPTYVLNLVNTLHLTERLQINNPLLIQFIPSIILWSVSALLPYIVFNSDRLVGHWTKSVLHLTVMIKTYTLLILMILVLPSLGLTSIPALLQWLFPEMHIIPLVPANNVSKITNISSIANTTSNNDNYNATTYNNTNNSSTFTSSSSKFDEEPSPFIPIGPQSFQWECVFMPDNGAFFVNYVITAAFIGTSLELVRFSELFNYACRLMCVKSQAEKAGVRKASQFEFQFGLFYAWSLCVFAVICAYSIVCPLITPFGLIYLIFKYFVERYNLYYAYLPSRIDSHIHWLAISCMLASVFLLQLNIFMFIVLRANTVSHALVICSLLGLIFSAILMIFTIITGWIMAGSSSARKLLFRNAHLVSATDDSSVDQHSQYNSPISVQHRGSHLNDITNAVGDRKSVVDATFPMHRNNSDPNQFTQQSIIDISQAKNLTTSVPPSPLLSPPSPLLTPPTCSLQVFNRNDINRHSHPVRINNKEQFVAPVLLNFQKRHSIANFMSTQSMISSLSENNSDNHSQLEDHND
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	37.6	Very low	252 Å²	252	97.1 Å²	97.1	100%	1.241	54%	0.544	S	S	*	.				0	120.8	0	-71.3	167.4	166.4	0	0	107.6
2	S	34.2	Very low	37.2	Very low	93 Å²	93	96.3 Å²	96.3	65%	0.65	54%	0.544	S	S	*	.			trans	-85.2	140.7	-180	42.6	0	0	0	0	111.6	T4	S2-T4 VanDerWaalsContact C-N 3.28Å; S2-T4 PolarHBondContact O-N 3.11Å
3	S	40.2	Very low	36.9	Very low	128 Å²	128	102.8 Å²	102.8	90%	0.895	56%	0.556	S	S	*	*			trans	-89.6	40.5	-175.5	59.9	0	0	0	0	113.3
4	T	38.9	Very low	36.7	Very low	67 Å²	67	100.4 Å²	100.4	41%	0.411	56%	0.558	S	S	.	*			trans	-88.4	136.5	173.9	47.5	0	0	0	0	110.9	S2	S2-T4 VanDerWaalsContact C-N 3.28Å; S2-T4 PolarHBondContact O-N 3.11Å
5	P	42.2	Very low	36.5	Very low	74 Å²	74	104.5 Å²	104.5	48%	0.481	58%	0.578	S	S	.	*			trans	-61.1	148.7	178.6	26.5	-33.9	0	0	0	110.9	C7 D8	P5-C7 PolarHBondContact O-N 2.69Å; P5-D8 WeakPolarHBondContact CD-OD2 3.26Å; P5-D8 WeakPolarHBondContact CG-OD2 3.38Å; P5-D8 PolarHBondContact O-N 3.01Å; P5-D8 VanDerWaalsContact O-N 3.16Å
6	I	38.9	Very low	36.3	Very low	76 Å²	76	110.8 Å²	110.8	39%	0.39	60%	0.598	S	S	.	*	H	α-helix	trans	-67.5	-25.3	-167.6	-67.5	172.3	0	0	0	112	D8 R9 V10	I6-D8 VanDerWaalsContact C-N 3.26Å; I6-D8 PolarHBondContact O-N 3.08Å; I6-R9 WeakPolarHBondContact O-CA 3.33Å; I6-R9 WeakPolarHBondContact O-CB 3.36Å; I6-R9 PolarHBondContact O-N 3.4Å; I6-V10 PolarHBondContact O-N 2.93Å
7	C	44.1	Very low	36.2	Very low	27 Å²	27	110.2 Å²	110.2	18%	0.182	60%	0.604	C	S	.	*	H	α-helix	trans	-52.8	-40.2	172.9	-53.6	0	0	0	0	113	P5 R9 V10 N11 C667	P5-C7 PolarHBondContact O-N 2.69Å; C7-R9 PolarHBondContact O-N 3.33Å; C7-V10 PolarHBondContact O-N 3.25Å; C7-N11 PolarHBondContact O-N 2.87Å; C7-C667 VanDerWaalsContact SG-SG 3.69Å
8	D	38.3	Very low	36.3	Very low	63 Å²	63	113.4 Å²	113.4	34%	0.337	61%	0.606	S	S	.	*	H	α-helix	trans	-65.8	-27.7	179.5	-56.3	-16.7	0	0	0	111.7	P5 I6 T12	P5-D8 WeakPolarHBondContact CD-OD2 3.26Å; P5-D8 WeakPolarHBondContact CG-OD2 3.38Å; P5-D8 PolarHBondContact O-N 3.01Å; P5-D8 VanDerWaalsContact O-N 3.16Å; I6-D8 VanDerWaalsContact C-N 3.26Å; I6-D8 PolarHBondContact O-N 3.08Å; D8-T12 WeakPolarHBondContact O-CG2 3.11Å; D8-T12 PolarHBondContact O-N 3.15Å; D8-T12 PolarHBondContact O-OG1 2.92Å
9	R	30.7	Very low	36.8	Very low	127 Å²	127	111 Å²	111	48%	0.479	60%	0.596	S	S	.	*	H	α-helix	trans	-78.8	-17.7	174.2	-92	-178.2	-77.2	165.4	-6.1	113.9	I6 C7 T12 Y13	I6-R9 WeakPolarHBondContact O-CA 3.33Å; I6-R9 WeakPolarHBondContact O-CB 3.36Å; I6-R9 PolarHBondContact O-N 3.4Å; C7-R9 PolarHBondContact O-N 3.33Å; R9-T12 WeakPolarHBondContact CA-OG1 3.26Å; R9-Y13 VanDerWaalsContact O-CD2 3.3Å; R9-Y13 WeakPolarHBondContact O-CD2 3.45Å
10	V	35.2	Very low	37.2	Very low	80 Å²	80	106.9 Å²	106.9	49%	0.485	57%	0.573	S	S	.	*	H	α-helix	trans	-77.4	-44.6	173	-176.7	0	0	0	0	110	I6 C7 T12	I6-V10 PolarHBondContact O-N 2.93Å; C7-V10 PolarHBondContact O-N 3.25Å; V10-T12 VanDerWaalsContact C-N 3.3Å; V10-T12 PolarHBondContact O-N 3.44Å
11	N	35.4	Very low	37.8	Very low	81 Å²	81	107.3 Å²	107.3	43%	0.433	58%	0.582	S	S	.	*	H	α-helix	trans	-71	-21.2	-177.9	-74.4	4.8	0	0	0	114.1	C7	C7-N11 PolarHBondContact O-N 2.87Å
12	T	33.7	Very low	38.9	Very low	88 Å²	88	96.1 Å²	96.1	54%	0.54	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-15.7	-178	39.9	0	0	0	0	114.9	D8 R9 V10	D8-T12 WeakPolarHBondContact O-CG2 3.11Å; D8-T12 PolarHBondContact O-N 3.15Å; D8-T12 PolarHBondContact O-OG1 2.92Å; R9-T12 WeakPolarHBondContact CA-OG1 3.26Å; V10-T12 VanDerWaalsContact C-N 3.3Å; V10-T12 PolarHBondContact O-N 3.44Å
13	Y	32.9	Very low	40.8	Very low	180 Å²	180	94.6 Å²	94.6	71%	0.706	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-5.3	-178.4	-79.1	-102	0	0	0	114.3	R9 N15	R9-Y13 VanDerWaalsContact O-CD2 3.3Å; R9-Y13 WeakPolarHBondContact O-CD2 3.45Å; Y13-N15 PolarHBondContact O-N 3.33Å
14	A	34.3	Very low	42.2	Very low	70 Å²	70	90.1 Å²	90.1	58%	0.579	48%	0.476	S	S	*	.	S	Bend	trans	-77.2	97.7	168.5	0	0	0	0	0	110.4	K16	A14-K16 PolarHBondContact O-N 3.24Å
15	N	33.1	Very low	43.9	Very low	162 Å²	162	87 Å²	87	87%	0.866	46%	0.458	S	S	*	.			trans	-54.6	122.2	-176.7	-154.8	-7.7	0	0	0	111.3	Y13 S17	Y13-N15 PolarHBondContact O-N 3.33Å; N15-S17 PolarHBondContact O-N 3.36Å
16	K	33.3	Very low	45.8	Very low	204 Å²	204	83.8 Å²	83.8	89%	0.887	44%	0.436	S	S	*	.			trans	-54.6	99.1	-158.5	-83.2	175.8	174.4	167.5	0	114.1	A14 R18	A14-K16 PolarHBondContact O-N 3.24Å; K16-R18 PolarHBondContact O-N 3.01Å
17	S	35.6	Very low	48.1	Very low	101 Å²	101	83.6 Å²	83.6	71%	0.706	44%	0.44	S	S	*	.			trans	-77.3	53.7	-178.1	51.9	0	0	0	0	114.2	N15 V19	N15-S17 PolarHBondContact O-N 3.36Å; S17-V19 PolarHBondContact O-N 3.12Å
18	R	37.6	Very low	49.9	Very low	168 Å²	168	87.5 Å²	87.5	63%	0.634	45%	0.452	S	S	*	.			trans	55.1	24.8	166.8	-128	-178.5	-158.4	-166.6	9.3	116.6	K16 I20 N520 P522	K16-R18 PolarHBondContact O-N 3.01Å; R18-I20 PolarHBondContact O-N 3.01Å; R18-N520 PolarHBondContact NH1-O 3.4Å; R18-P522 WeakPolarHBondContact O-CB 3.37Å
19	V	45.9	Very low	52.1	Low	68 Å²	68	84.7 Å²	84.7	41%	0.412	44%	0.437	S	S	.	.			trans	-56.3	124.6	173.4	-179.4	0	0	0	0	109.8	S17	S17-V19 PolarHBondContact O-N 3.12Å
20	I	44.1	Very low	54.9	Low	29 Å²	29	81.1 Å²	81.1	15%	0.149	43%	0.426	C	S	.	.			trans	-65.5	130.5	177.9	-57	172.4	0	0	0	108.5	R18 G22 Y28 P522 L523	R18-I20 PolarHBondContact O-N 3.01Å; I20-G22 VanDerWaalsContact C-N 3.25Å; I20-G22 PolarHBondContact O-N 3.11Å; I20-Y28 HydrophobicContact CG2-CE2 3.99Å; I20-P522 HydrophobicContact CD1-CB 4.28Å; I20-P522 HydrophobicContact CD1-CG 4.01Å; I20-P522 HydrophobicContact CG1-CB 3.97Å; I20-P522 HydrophobicContact CG1-CG 3.87Å; I20-L523 HydrophobicContact CD1-CD2 3.47Å; I20-L523 VanDerWaalsContact CD1-CD2 3.47Å; I20-L523 HydrophobicContact CD1-CG 3.77Å
21	P	49.7	Very low	57.5	Low	116 Å²	116	80.6 Å²	80.6	75%	0.753	43%	0.426	S	S	*	.	S	Bend	trans	-73.9	68.2	-172.8	29.9	-36.8	0	0	0	113.8
22	G	59.3	Low	60	Low	17 Å²	17	80 Å²	80	18%	0.175	43%	0.425	C	S	.	.	S	Bend	trans	-167.6	96.7	-178.1	0	0	0	0	0	114.4	I20 E24 G25	I20-G22 VanDerWaalsContact C-N 3.25Å; I20-G22 PolarHBondContact O-N 3.11Å; G22-E24 PolarHBondContact O-N 3.03Å; G22-G25 PolarHBondContact O-N 3.32Å; G22-G25 VanDerWaalsContact O-N 3.15Å
23	Y	72.7	Confident	62.7	Low	60 Å²	60	76.2 Å²	76.2	24%	0.235	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	51	49.1	156.6	-152.6	-95.2	0	0	0	114.1	G25 I26 K163 F164 T167 L751	Y23-G25 PolarHBondContact O-N 3.32Å; Y23-G25 VanDerWaalsContact O-N 3.09Å; Y23-I26 HydrophobicContact CD1-CB 4.26Å; Y23-I26 HydrophobicContact CD1-CD1 4.05Å; Y23-I26 HydrophobicContact CE1-CD1 4.09Å; Y23-I26 PolarHBondContact O-N 3.31Å; Y23-I26 VanDerWaalsContact O-N 3.13Å; Y23-K163 HydrophobicContact CD2-CB 4.08Å; Y23-K163 VanDerWaalsContact CD2-O 3.27Å; Y23-K163 WeakPolarHBondContact CD2-O 3.38Å; Y23-K163 WeakPolarHBondContact CE2-O 3.4Å; Y23-F164 HydrophobicContact CD1-CD2 4.13Å; Y23-F164 HydrophobicContact CD2-CB 4.23Å; Y23-F164 AromaticContact CE1-CD2 3.66Å; Y23-F164 HydrophobicContact CE1-CD2 3.66Å; Y23-F164 HydrophobicContact CE1-CE2 4.36Å; Y23-F164 HydrophobicContact CE2-CB 4.29Å; Y23-F164 HydrophobicContact CE2-CD2 4.35Å; Y23-F164 HydrophobicContact CG-CB 4.4Å; Y23-F164 AromaticContact CZ-CD2 3.76Å; Y23-T167 HydrophobicContact CE2-CG2 4.27Å; Y23-T167 WeakPolarHBondContact OH-CG2 3.48Å; Y23-T167 PolarHBondContact OH-OG1 3.47Å; Y23-L751 HydrophobicContact CE1-CD2 3.63Å
24	E	70.8	Confident	65.6	Low	35 Å²	35	70.3 Å²	70.3	16%	0.164	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	51.1	33.1	177.9	-55.7	-62.1	168.6	0	0	115.3	G22 I26 Q162 F164 A675 N679	G22-E24 PolarHBondContact O-N 3.03Å; E24-I26 HydrophobicContact CB-CD1 4.35Å; E24-I26 HydrophobicContact CB-CG1 4.44Å; E24-I26 PolarHBondContact O-N 2.99Å; E24-Q162 PolarHBondContact OE1-NE2 3.35Å; E24-Q162 PolarHBondContact OE1-OE1 2.76Å; E24-F164 HydrophobicContact CB-CB 4.48Å; E24-F164 HydrophobicContact CG-CB 3.66Å; E24-F164 HydrophobicContact CG-CD1 4.18Å; E24-F164 HydrophobicContact CG-CG 3.96Å; E24-A675 HydrophobicContact CB-CB 3.43Å; E24-A675 VanDerWaalsContact CB-CB 3.43Å; E24-A675 HydrophobicContact CG-CB 3.56Å; E24-N679 PolarHBondContact O-ND2 3.45Å; E24-N679 VanDerWaalsContact O-ND2 3.14Å
25	G	74.7	Confident	68.4	Low	2 Å²	2	71.8 Å²	71.8	2%	0.021	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	69.4	-2.2	178.8	0	0	0	0	0	114.9	G22 Y23 Y28 N29	G22-G25 PolarHBondContact O-N 3.32Å; G22-G25 VanDerWaalsContact O-N 3.15Å; Y23-G25 PolarHBondContact O-N 3.32Å; Y23-G25 VanDerWaalsContact O-N 3.09Å; G25-Y28 WeakPolarHBondContact O-CB 3.33Å; G25-Y28 PolarHBondContact O-N 3.32Å; G25-N29 PolarHBondContact O-N 3.32Å
26	I	81.6	Confident	71.2	Confident	6 Å²	6	65.1 Å²	65.1	3%	0.031	35%	0.35	C	S	.	.	H	α-helix	trans	-54.4	-43.8	-171.1	-64.4	163.3	0	0	0	112.9	Y23 E24 Y28 N29 L30 F164 A675 V678 N679 I682 L751	Y23-I26 HydrophobicContact CD1-CB 4.26Å; Y23-I26 HydrophobicContact CD1-CD1 4.05Å; Y23-I26 HydrophobicContact CE1-CD1 4.09Å; Y23-I26 PolarHBondContact O-N 3.31Å; Y23-I26 VanDerWaalsContact O-N 3.13Å; E24-I26 HydrophobicContact CB-CD1 4.35Å; E24-I26 HydrophobicContact CB-CG1 4.44Å; E24-I26 PolarHBondContact O-N 2.99Å; I26-Y28 PolarHBondContact O-N 2.99Å; I26-N29 PolarHBondContact O-N 3.46Å; I26-L30 WeakPolarHBondContact O-CB 3.47Å; I26-L30 PolarHBondContact O-N 3.19Å; I26-F164 HydrophobicContact CD1-CD2 3.49Å; I26-F164 VanDerWaalsContact CD1-CD2 3.49Å; I26-F164 HydrophobicContact CD1-CE2 3.39Å; I26-F164 HydrophobicContact CD1-CG 4.48Å; I26-F164 HydrophobicContact CD1-CZ 4.33Å; I26-A675 HydrophobicContact CD1-CB 4.21Å; I26-V678 HydrophobicContact CD1-CB 4.31Å; I26-V678 HydrophobicContact CD1-CG1 3.99Å; I26-V678 HydrophobicContact CG1-CG1 4.22Å; I26-V678 HydrophobicContact CG2-CG1 3.92Å; I26-N679 WeakPolarHBondContact CA-OD1 3.42Å; I26-N679 WeakPolarHBondContact CG1-OD1 3.36Å; I26-I682 HydrophobicContact CG2-CD1 3.8Å; I26-L751 HydrophobicContact CD1-CD2 4.46Å
27	P	86.5	Confident	74.1	Confident	71 Å²	71	58.9 Å²	58.9	46%	0.461	32%	0.321	S	S	.	.	H	α-helix	trans	-64.7	-37.3	177.3	-21.8	34.7	0	0	0	113.3	C31	P27-C31 WeakPolarHBondContact O-CB 3.27Å; P27-C31 PolarHBondContact O-N 3.49Å
28	Y	82.8	Confident	76.9	Confident	110 Å²	110	57.5 Å²	57.5	43%	0.431	31%	0.308	S	S	.	.	H	α-helix	trans	-70.4	-41.7	176.7	-61.2	-81.3	0	0	0	111.2	I20 G25 I26 L30 C31 V32 L523	I20-Y28 HydrophobicContact CG2-CE2 3.99Å; G25-Y28 WeakPolarHBondContact O-CB 3.33Å; G25-Y28 PolarHBondContact O-N 3.32Å; I26-Y28 PolarHBondContact O-N 2.99Å; Y28-L30 VanDerWaalsContact C-N 3.35Å; Y28-L30 PolarHBondContact O-N 3.35Å; Y28-C31 PolarHBondContact O-N 2.8Å; Y28-V32 WeakPolarHBondContact O-CG2 3.44Å; Y28-V32 PolarHBondContact O-N 3.1Å; Y28-L523 HydrophobicContact CD1-CD2 3.83Å; Y28-L523 HydrophobicContact CD2-CD2 4.5Å; Y28-L523 HydrophobicContact CG-CD2 3.77Å
29	N	83.9	Confident	79.5	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-43.6	175.2	-169.4	34.4	0	0	0	111.3	G25 I26 V32 N33 F527 N679	G25-N29 PolarHBondContact O-N 3.32Å; I26-N29 PolarHBondContact O-N 3.46Å; N29-V32 PolarHBondContact O-N 3.33Å; N29-N33 VanDerWaalsContact O-CB 3.29Å; N29-N33 WeakPolarHBondContact O-CB 3.21Å; N29-N33 PolarHBondContact O-N 3.18Å; N29-N33 PolarHBondContact O-ND2 3.03Å; N29-N33 PolarHBondContact OD1-ND2 3.04Å; N29-F527 VanDerWaalsContact CA-CE1 3.48Å; N29-F527 HydrophobicContact CB-CD1 4.23Å; N29-F527 HydrophobicContact CB-CE1 3.67Å; N29-N679 WeakPolarHBondContact CB-OD1 3.47Å; N29-N679 VanDerWaalsContact ND2-CA 3.33Å; N29-N679 WeakPolarHBondContact ND2-CA 3.48Å; N29-N679 VanDerWaalsContact ND2-CB 3.35Å; N29-N679 WeakPolarHBondContact ND2-CB 3.26Å; N29-N679 PolarHBondContact ND2-O 3.28Å; N29-N679 PolarHBondContact ND2-OD1 2.96Å
30	L	89.2	Confident	81.7	Confident	51 Å²	51	53 Å²	53	27%	0.267	30%	0.298	S	S	.	.	H	α-helix	trans	-60.2	-46.2	174.6	-177.6	62.1	0	0	0	111.5	I26 Y28 N33 V34 I682 F686 F755	I26-L30 WeakPolarHBondContact O-CB 3.47Å; I26-L30 PolarHBondContact O-N 3.19Å; Y28-L30 VanDerWaalsContact C-N 3.35Å; Y28-L30 PolarHBondContact O-N 3.35Å; L30-N33 PolarHBondContact O-N 3.04Å; L30-V34 HydrophobicContact CD1-CG2 4.19Å; L30-V34 HydrophobicContact CG-CG2 4.49Å; L30-V34 WeakPolarHBondContact O-CB 3.34Å; L30-V34 VanDerWaalsContact O-CG2 3.25Å; L30-V34 WeakPolarHBondContact O-CG2 3.47Å; L30-V34 PolarHBondContact O-N 3.11Å; L30-I682 HydrophobicContact CB-CD1 4.49Å; L30-I682 HydrophobicContact CB-CG2 4.44Å; L30-I682 HydrophobicContact CD1-CG2 3.99Å; L30-F686 HydrophobicContact CD1-CD2 4.33Å; L30-F686 HydrophobicContact CD1-CE2 3.54Å; L30-F686 HydrophobicContact CD1-CZ 4.11Å; L30-F755 HydrophobicContact CD1-CD1 4.46Å; L30-F755 HydrophobicContact CD1-CE1 3.86Å; L30-F755 HydrophobicContact CD2-CE1 3.91Å; L30-F755 HydrophobicContact CD2-CZ 4.15Å; L30-F755 HydrophobicContact CG-CE1 4.5Å
31	C	90.4	Very high	83.9	Confident	69 Å²	69	53 Å²	53	47%	0.466	30%	0.297	S	S	.	.	H	α-helix	trans	-59.2	-50.1	177.8	-173.7	0	0	0	0	112.2	P27 Y28 N33 V34 I35	P27-C31 WeakPolarHBondContact O-CB 3.27Å; P27-C31 PolarHBondContact O-N 3.49Å; Y28-C31 PolarHBondContact O-N 2.8Å; C31-N33 PolarHBondContact O-N 3.04Å; C31-V34 PolarHBondContact O-N 3.26Å; C31-I35 WeakPolarHBondContact O-CG1 3.25Å; C31-I35 PolarHBondContact O-N 2.95Å
32	V	87.5	Confident	85.8	Confident	70 Å²	70	50.4 Å²	50.4	42%	0.424	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-41.6	179.4	171.7	0	0	0	0	111.7	Y28 N29 I35 G36 F527	Y28-V32 WeakPolarHBondContact O-CG2 3.44Å; Y28-V32 PolarHBondContact O-N 3.1Å; N29-V32 PolarHBondContact O-N 3.33Å; V32-I35 PolarHBondContact O-N 3.29Å; V32-G36 PolarHBondContact O-N 3.24Å; V32-F527 HydrophobicContact CB-CE2 4.32Å; V32-F527 HydrophobicContact CB-CZ 4.43Å; V32-F527 HydrophobicContact CG1-CE2 4.42Å; V32-F527 HydrophobicContact CG2-CE2 3.78Å; V32-F527 HydrophobicContact CG2-CZ 3.99Å
33	N	90.6	Very high	87.2	Confident	7 Å²	7	50.9 Å²	50.9	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-66.4	-38.7	176.6	-84.7	-68.9	0	0	0	113	N29 L30 C31 G36 W37 I682 T683 F686 I687	N29-N33 VanDerWaalsContact O-CB 3.29Å; N29-N33 WeakPolarHBondContact O-CB 3.21Å; N29-N33 PolarHBondContact O-N 3.18Å; N29-N33 PolarHBondContact O-ND2 3.03Å; N29-N33 PolarHBondContact OD1-ND2 3.04Å; L30-N33 PolarHBondContact O-N 3.04Å; C31-N33 PolarHBondContact O-N 3.04Å; N33-G36 PolarHBondContact O-N 2.92Å; N33-W37 WeakPolarHBondContact O-CB 3.39Å; N33-W37 PolarHBondContact O-N 3.1Å; N33-I682 HydrophobicContact CB-CG2 3.95Å; N33-T683 PolarHBondContact ND2-OG1 3.08Å; N33-T683 WeakPolarHBondContact OD1-CA 3.19Å; N33-F686 HydrophobicContact CB-CB 3.89Å; N33-F686 HydrophobicContact CB-CD2 4.17Å; N33-F686 HydrophobicContact CB-CG 4.24Å; N33-I687 WeakPolarHBondContact OD1-CG1 3.3Å
34	V	93.7	Very high	87.9	Confident	56 Å²	56	48.9 Å²	48.9	34%	0.339	28%	0.28	S	S	.	.	H	α-helix	trans	-65.8	-43.2	174.7	168	0	0	0	0	111.1	L30 C31 W37 V38 F686	L30-V34 HydrophobicContact CD1-CG2 4.19Å; L30-V34 HydrophobicContact CG-CG2 4.49Å; L30-V34 WeakPolarHBondContact O-CB 3.34Å; L30-V34 VanDerWaalsContact O-CG2 3.25Å; L30-V34 WeakPolarHBondContact O-CG2 3.47Å; L30-V34 PolarHBondContact O-N 3.11Å; C31-V34 PolarHBondContact O-N 3.26Å; V34-W37 WeakPolarHBondContact O-CB 3.31Å; V34-W37 PolarHBondContact O-N 3.04Å; V34-V38 WeakPolarHBondContact O-CG2 3.36Å; V34-V38 PolarHBondContact O-N 3.35Å; V34-F686 HydrophobicContact CG2-CD1 4.14Å; V34-F686 HydrophobicContact CG2-CE1 3.7Å; V34-F686 HydrophobicContact CG2-CE2 4.21Å; V34-F686 HydrophobicContact CG2-CZ 3.73Å
35	I	93.4	Very high	88.6	Confident	102 Å²	102	48 Å²	48	52%	0.523	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-46.5	174.8	-67.6	165.2	0	0	0	110.3	C31 V32 W37 V38 V39	C31-I35 WeakPolarHBondContact O-CG1 3.25Å; C31-I35 PolarHBondContact O-N 2.95Å; V32-I35 PolarHBondContact O-N 3.29Å; I35-W37 VanDerWaalsContact C-N 3.33Å; I35-W37 PolarHBondContact O-N 3.01Å; I35-V38 PolarHBondContact O-N 2.84Å; I35-V39 WeakPolarHBondContact O-CG2 3.44Å; I35-V39 PolarHBondContact O-N 3.16Å
36	G	91	Very high	89.1	Confident	21 Å²	21	52 Å²	52	22%	0.216	30%	0.297	C	S	.	.	H	α-helix	trans	-61.3	-38.1	175.8	0	0	0	0	0	113.3	V32 N33 V39 L40	V32-G36 PolarHBondContact O-N 3.24Å; N33-G36 PolarHBondContact O-N 2.92Å; G36-V39 PolarHBondContact O-N 2.91Å; G36-L40 WeakPolarHBondContact O-CB 3.5Å; G36-L40 VanDerWaalsContact O-CG 3.27Å; G36-L40 WeakPolarHBondContact O-CG 3.34Å; G36-L40 PolarHBondContact O-N 2.91Å
37	W	94.2	Very high	89	Confident	73 Å²	73	55.7 Å²	55.7	28%	0.277	32%	0.316	S	S	.	.	H	α-helix	trans	-63.3	-45.1	173.6	179	94.1	0	0	0	112.1	N33 V34 I35 V39 L40 M41 F686 F762	N33-W37 WeakPolarHBondContact O-CB 3.39Å; N33-W37 PolarHBondContact O-N 3.1Å; V34-W37 WeakPolarHBondContact O-CB 3.31Å; V34-W37 PolarHBondContact O-N 3.04Å; I35-W37 VanDerWaalsContact C-N 3.33Å; I35-W37 PolarHBondContact O-N 3.01Å; W37-V39 VanDerWaalsContact C-N 3.34Å; W37-V39 PolarHBondContact O-N 3.3Å; W37-L40 PolarHBondContact O-N 3.03Å; W37-M41 HydrophobicContact CD2-CG 4.05Å; W37-M41 HydrophobicContact CE3-CG 4.49Å; W37-M41 HydrophobicContact CG-CG 4.43Å; W37-M41 HydrophobicContact CZ2-CG 4.21Å; W37-M41 VanDerWaalsContact O-CB 3.31Å; W37-M41 WeakPolarHBondContact O-CB 3.4Å; W37-M41 VanDerWaalsContact O-CG 3.25Å; W37-M41 WeakPolarHBondContact O-CG 3.45Å; W37-M41 PolarHBondContact O-N 3.22Å; W37-F686 HydrophobicContact CB-CB 4.07Å; W37-F686 HydrophobicContact CB-CD1 3.8Å; W37-F686 HydrophobicContact CB-CG 4.4Å; W37-F686 AromaticContact CD1-CD1 3.8Å; W37-F686 HydrophobicContact CD2-CD1 4.32Å; W37-F686 AromaticContact CG-CD1 3.73Å; W37-F686 HydrophobicContact CG-CD1 3.73Å; W37-F762 AromaticContact CE2-CE2 3.92Å; W37-F762 HydrophobicContact CZ2-CE2 4.2Å; W37-F762 HydrophobicContact CZ2-CZ 4.11Å; W37-F762 AromaticContact NE1-CD2 3.87Å; W37-F762 AromaticContact NE1-CE2 3.49Å
38	V	94.2	Very high	88.5	Confident	72 Å²	72	53.4 Å²	53.4	44%	0.436	30%	0.299	S	S	.	.	H	α-helix	trans	-60.2	-44.3	174.8	173.3	0	0	0	0	110.8	V34 I35 M41 S42	V34-V38 WeakPolarHBondContact O-CG2 3.36Å; V34-V38 PolarHBondContact O-N 3.35Å; I35-V38 PolarHBondContact O-N 2.84Å; V38-M41 PolarHBondContact O-N 3.09Å; V38-S42 WeakPolarHBondContact O-CB 3.21Å; V38-S42 PolarHBondContact O-N 2.87Å; V38-S42 PolarHBondContact O-OG 3.08Å
39	V	94	Very high	88.1	Confident	97 Å²	97	53.9 Å²	53.9	59%	0.588	30%	0.303	S	S	*	.	H	α-helix	trans	-63.1	-45.1	177.1	172.1	0	0	0	0	111.7	I35 G36 W37 S42 G43	I35-V39 WeakPolarHBondContact O-CG2 3.44Å; I35-V39 PolarHBondContact O-N 3.16Å; G36-V39 PolarHBondContact O-N 2.91Å; W37-V39 VanDerWaalsContact C-N 3.34Å; W37-V39 PolarHBondContact O-N 3.3Å; V39-S42 PolarHBondContact O-N 3.15Å; V39-G43 PolarHBondContact O-N 3.09Å
40	L	92.2	Very high	87.6	Confident	45 Å²	45	60.8 Å²	60.8	24%	0.236	34%	0.339	C	S	.	.	H	α-helix	trans	-67.5	-39	178.8	-72.2	170.9	0	0	0	112.4	G36 W37 G43 F44 I687 L691	G36-L40 WeakPolarHBondContact O-CB 3.5Å; G36-L40 VanDerWaalsContact O-CG 3.27Å; G36-L40 WeakPolarHBondContact O-CG 3.34Å; G36-L40 PolarHBondContact O-N 2.91Å; W37-L40 PolarHBondContact O-N 3.03Å; L40-G43 PolarHBondContact O-N 2.76Å; L40-F44 WeakPolarHBondContact O-CB 3.13Å; L40-F44 PolarHBondContact O-N 2.87Å; L40-I687 HydrophobicContact CD1-CD1 3.8Å; L40-I687 HydrophobicContact CD1-CG2 4.22Å; L40-L691 HydrophobicContact CD1-CD2 4.36Å; L40-L691 HydrophobicContact CD1-CG 4.23Å; L40-L691 HydrophobicContact CD2-CD2 3.94Å
41	M	90.2	Very high	86.5	Confident	29 Å²	29	60.7 Å²	60.7	14%	0.143	35%	0.345	C	S	.	.	H	α-helix	trans	-67.3	-41.3	175.3	-72.6	-68.4	153.4	0	0	111.8	W37 V38 F44 T45 W102 S690 L693	W37-M41 HydrophobicContact CD2-CG 4.05Å; W37-M41 HydrophobicContact CE3-CG 4.49Å; W37-M41 HydrophobicContact CG-CG 4.43Å; W37-M41 HydrophobicContact CZ2-CG 4.21Å; W37-M41 VanDerWaalsContact O-CB 3.31Å; W37-M41 WeakPolarHBondContact O-CB 3.4Å; W37-M41 VanDerWaalsContact O-CG 3.25Å; W37-M41 WeakPolarHBondContact O-CG 3.45Å; W37-M41 PolarHBondContact O-N 3.22Å; V38-M41 PolarHBondContact O-N 3.09Å; M41-F44 WeakPolarHBondContact O-CB 3.38Å; M41-F44 PolarHBondContact O-N 2.9Å; M41-T45 WeakPolarHBondContact O-CG2 3.22Å; M41-T45 PolarHBondContact O-N 2.94Å; M41-W102 HydrophobicContact SD-CH2 4.49Å; M41-S690 WeakPolarHBondContact CE-OG 3.46Å; M41-L693 HydrophobicContact CE-CD2 3.74Å; M41-L693 HydrophobicContact SD-CD2 3.76Å
42	S	89.4	Confident	84.8	Confident	61 Å²	61	60 Å²	60	43%	0.427	33%	0.333	S	S	.	.	H	α-helix	trans	-63.7	-43.7	172.3	-71.4	0	0	0	0	111.7	V38 V39 F44 T45 L46	V38-S42 WeakPolarHBondContact O-CB 3.21Å; V38-S42 PolarHBondContact O-N 2.87Å; V38-S42 PolarHBondContact O-OG 3.08Å; V39-S42 PolarHBondContact O-N 3.15Å; S42-F44 VanDerWaalsContact C-N 3.3Å; S42-F44 PolarHBondContact O-N 3.5Å; S42-T45 PolarHBondContact O-N 3.11Å; S42-T45 PolarHBondContact O-OG1 3.02Å; S42-T45 VanDerWaalsContact O-OG1 3.11Å; S42-L46 WeakPolarHBondContact O-CG 3.47Å; S42-L46 PolarHBondContact O-N 3.32Å
43	G	88.2	Confident	83.2	Confident	28 Å²	28	62.1 Å²	62.1	29%	0.289	34%	0.342	S	S	.	.	H	α-helix	trans	-57.6	-41.9	171.8	0	0	0	0	0	112.5	V39 L40 L47	V39-G43 PolarHBondContact O-N 3.09Å; L40-G43 PolarHBondContact O-N 2.76Å; G43-L47 VanDerWaalsContact O-CB 3.31Å; G43-L47 WeakPolarHBondContact O-CB 3.32Å; G43-L47 VanDerWaalsContact O-CG 3.25Å; G43-L47 WeakPolarHBondContact O-CG 3.3Å; G43-L47 PolarHBondContact O-N 2.71Å
44	F	87.9	Confident	81.2	Confident	18 Å²	18	64.9 Å²	64.9	8%	0.079	35%	0.352	C	S	.	.	H	α-helix	trans	-63.5	-45.9	174.6	176.2	-105.7	0	0	0	112.5	L40 M41 S42 L46 L47 R48 W102 L693 V694 Y769	L40-F44 WeakPolarHBondContact O-CB 3.13Å; L40-F44 PolarHBondContact O-N 2.87Å; M41-F44 WeakPolarHBondContact O-CB 3.38Å; M41-F44 PolarHBondContact O-N 2.9Å; S42-F44 VanDerWaalsContact C-N 3.3Å; S42-F44 PolarHBondContact O-N 3.5Å; F44-L46 VanDerWaalsContact C-N 3.34Å; F44-L46 PolarHBondContact O-N 2.96Å; F44-L47 PolarHBondContact O-N 2.89Å; F44-R48 WeakPolarHBondContact O-CB 3.44Å; F44-R48 PolarHBondContact O-N 2.97Å; F44-W102 HydrophobicContact CD1-CH2 4.37Å; F44-W102 HydrophobicContact CD1-CZ2 4.09Å; F44-W102 HydrophobicContact CE1-CD2 4.13Å; F44-W102 HydrophobicContact CE1-CE3 4.17Å; F44-W102 HydrophobicContact CE1-CH2 4.1Å; F44-W102 HydrophobicContact CE1-CZ2 4.06Å; F44-W102 HydrophobicContact CE1-CZ3 4.16Å; F44-L693 HydrophobicContact CD1-CD2 3.77Å; F44-L693 HydrophobicContact CD1-CG 4.18Å; F44-L693 HydrophobicContact CD2-CG 4.15Å; F44-L693 HydrophobicContact CE1-CD1 4.3Å; F44-L693 HydrophobicContact CE1-CD2 3.74Å; F44-L693 HydrophobicContact CE1-CG 3.92Å; F44-L693 HydrophobicContact CE2-CD1 4.39Å; F44-L693 HydrophobicContact CE2-CG 3.88Å; F44-L693 WeakPolarHBondContact CE2-O 3.47Å; F44-L693 HydrophobicContact CG-CD2 4.19Å; F44-L693 HydrophobicContact CG-CG 4.29Å; F44-L693 HydrophobicContact CZ-CD1 3.96Å; F44-L693 HydrophobicContact CZ-CD2 4.13Å; F44-L693 HydrophobicContact CZ-CG 3.76Å; F44-V694 HydrophobicContact CB-CG2 3.95Å; F44-V694 HydrophobicContact CD2-CG2 4.01Å; F44-V694 HydrophobicContact CG-CG2 4.4Å; F44-Y769 AromaticContact CZ-CE1 3.83Å; F44-Y769 HydrophobicContact CZ-CE1 3.83Å
45	T	85.4	Confident	79.1	Confident	15 Å²	15	63 Å²	63	9%	0.092	35%	0.345	C	S	.	.	H	α-helix	trans	-66	-36.4	179.2	67.5	0	0	0	0	112.6	M41 S42 K49 W102	M41-T45 WeakPolarHBondContact O-CG2 3.22Å; M41-T45 PolarHBondContact O-N 2.94Å; S42-T45 PolarHBondContact O-N 3.11Å; S42-T45 PolarHBondContact O-OG1 3.02Å; S42-T45 VanDerWaalsContact O-OG1 3.11Å; T45-K49 PolarHBondContact O-N 2.91Å; T45-K49 VanDerWaalsContact O-N 3.11Å; T45-W102 HydrophobicContact CG2-CZ2 4.39Å; T45-W102 VanDerWaalsContact CG2-NE1 3.29Å
46	L	84.3	Confident	77	Confident	87 Å²	87	62.2 Å²	62.2	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-64.7	-51.7	172.7	-69.6	170.9	0	0	0	111.5	S42 F44 R48 K49 L50 Y99	S42-L46 WeakPolarHBondContact O-CG 3.47Å; S42-L46 PolarHBondContact O-N 3.32Å; F44-L46 VanDerWaalsContact C-N 3.34Å; F44-L46 PolarHBondContact O-N 2.96Å; L46-R48 VanDerWaalsContact C-N 3.32Å; L46-R48 PolarHBondContact O-N 2.86Å; L46-K49 PolarHBondContact O-N 3.48Å; L46-L50 WeakPolarHBondContact O-CB 3.27Å; L46-L50 WeakPolarHBondContact O-CG 3.24Å; L46-L50 PolarHBondContact O-N 3.32Å; L46-Y99 HydrophobicContact CD2-CE1 4.04Å
47	L	79.6	Confident	74.9	Confident	83 Å²	83	63.3 Å²	63.3	44%	0.435	34%	0.335	S	S	.	.	H	α-helix	trans	-59.5	-41.7	176.6	-75.1	171.1	0	0	0	111.9	G43 F44 K49 L50 A51 L699	G43-L47 VanDerWaalsContact O-CB 3.31Å; G43-L47 WeakPolarHBondContact O-CB 3.32Å; G43-L47 VanDerWaalsContact O-CG 3.25Å; G43-L47 WeakPolarHBondContact O-CG 3.3Å; G43-L47 PolarHBondContact O-N 2.71Å; F44-L47 PolarHBondContact O-N 2.89Å; L47-K49 VanDerWaalsContact C-N 3.29Å; L47-K49 PolarHBondContact O-N 3.29Å; L47-L50 PolarHBondContact O-N 3.15Å; L47-A51 WeakPolarHBondContact O-CB 3.27Å; L47-A51 PolarHBondContact O-N 2.85Å; L47-L699 HydrophobicContact CD1-CD2 4.37Å
48	R	77.3	Confident	72.5	Confident	24 Å²	24	60.5 Å²	60.5	9%	0.091	33%	0.327	C	S	.	.	H	α-helix	trans	-61.5	-37	177.6	-165.1	-162.7	115.1	113.1	4.2	111.7	F44 L46 W52 D96 S101 Y769	F44-R48 WeakPolarHBondContact O-CB 3.44Å; F44-R48 PolarHBondContact O-N 2.97Å; L46-R48 VanDerWaalsContact C-N 3.32Å; L46-R48 PolarHBondContact O-N 2.86Å; R48-W52 HydrophobicContact CG-CE3 3.66Å; R48-W52 HydrophobicContact CG-CZ3 3.77Å; R48-W52 VanDerWaalsContact O-CA 3.28Å; R48-W52 WeakPolarHBondContact O-CA 3.44Å; R48-W52 VanDerWaalsContact O-CB 3.29Å; R48-W52 WeakPolarHBondContact O-CB 3.17Å; R48-W52 PolarHBondContact O-N 2.73Å; R48-D96 IonicContact CZ-OD2 2.7Å; R48-D96 IonicContact NH2-OD2 3.71Å; R48-D96 PolarHBondContact NH2-OD2 3.29Å; R48-S101 PolarHBondContact NH2-OG 3.48Å; R48-Y769 PolarHBondContact NH1-OH 3Å
49	K	74	Confident	69.9	Low	119 Å²	119	59.7 Å²	59.7	52%	0.517	32%	0.323	S	S	.	.	H	α-helix	trans	-74.8	-46.3	175.5	-171.7	179	179.3	-180	0	112.1	T45 L46 L47 A51 Y99	T45-K49 PolarHBondContact O-N 2.91Å; T45-K49 VanDerWaalsContact O-N 3.11Å; L46-K49 PolarHBondContact O-N 3.48Å; L47-K49 VanDerWaalsContact C-N 3.29Å; L47-K49 PolarHBondContact O-N 3.29Å; K49-A51 VanDerWaalsContact C-N 3.31Å; K49-A51 PolarHBondContact O-N 2.83Å; K49-Y99 HydrophobicContact CB-CE1 4.42Å; K49-Y99 HydrophobicContact CD-CD1 3.81Å; K49-Y99 HydrophobicContact CD-CE1 3.25Å; K49-Y99 HydrophobicContact CG-CE1 4.45Å; K49-Y99 VanDerWaalsContact NZ-CZ 3.26Å; K49-Y99 PolarHBondContact NZ-OH 3.49Å
50	L	72.5	Confident	67.2	Low	150 Å²	150	61.6 Å²	61.6	79%	0.785	32%	0.323	S	S	*	.	H	α-helix	trans	-67.8	-29.2	-178.6	-70.2	170.3	0	0	0	113.3	L46 L47	L46-L50 WeakPolarHBondContact O-CB 3.27Å; L46-L50 WeakPolarHBondContact O-CG 3.24Å; L46-L50 PolarHBondContact O-N 3.32Å; L47-L50 PolarHBondContact O-N 3.15Å
51	A	65.9	Low	64.8	Low	48 Å²	48	63.8 Å²	63.8	40%	0.397	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.8	35.3	-177.1	0	0	0	0	0	112.4	L47 K49 D53 Y54	L47-A51 WeakPolarHBondContact O-CB 3.27Å; L47-A51 PolarHBondContact O-N 2.85Å; K49-A51 VanDerWaalsContact C-N 3.31Å; K49-A51 PolarHBondContact O-N 2.83Å; A51-D53 PolarHBondContact O-N 2.86Å; A51-Y54 WeakPolarHBondContact O-CA 3.28Å; A51-Y54 WeakPolarHBondContact O-CB 3.45Å; A51-Y54 PolarHBondContact O-N 3.12Å
52	W	56	Low	62.3	Low	55 Å²	55	67.7 Å²	67.7	21%	0.208	36%	0.36	C	S	.	.	H	α-helix	trans	-60.6	-29	-177.7	-165	-138.3	0	0	0	113.3	R48 Y54 G55 R56	R48-W52 HydrophobicContact CG-CE3 3.66Å; R48-W52 HydrophobicContact CG-CZ3 3.77Å; R48-W52 VanDerWaalsContact O-CA 3.28Å; R48-W52 WeakPolarHBondContact O-CA 3.44Å; R48-W52 VanDerWaalsContact O-CB 3.29Å; R48-W52 WeakPolarHBondContact O-CB 3.17Å; R48-W52 PolarHBondContact O-N 2.73Å; W52-Y54 PolarHBondContact O-N 3.15Å; W52-Y54 VanDerWaalsContact O-N 3.17Å; W52-G55 PolarHBondContact O-N 3.15Å; W52-R56 PolarHBondContact O-N 3.46Å
53	D	53.1	Low	59.7	Low	115 Å²	115	75.2 Å²	75.2	62%	0.615	38%	0.379	S	S	*	.	H	α-helix	trans	-57.6	-23.5	169.8	-70.5	-18.2	0	0	0	114	A51	A51-D53 PolarHBondContact O-N 2.86Å
54	Y	49.6	Very low	57	Low	64 Å²	64	80.9 Å²	80.9	25%	0.251	40%	0.395	S	S	.	.	H	α-helix	trans	-70.1	-36.2	173.4	-168.9	-114.4	0	0	0	111.5	A51 W52 M57 L699 Y702	A51-Y54 WeakPolarHBondContact O-CA 3.28Å; A51-Y54 WeakPolarHBondContact O-CB 3.45Å; A51-Y54 PolarHBondContact O-N 3.12Å; W52-Y54 PolarHBondContact O-N 3.15Å; W52-Y54 VanDerWaalsContact O-N 3.17Å; Y54-M57 HydrophobicContact CD2-CE 4.12Å; Y54-M57 WeakPolarHBondContact O-CE 3.37Å; Y54-L699 HydrophobicContact CE1-CD1 4.36Å; Y54-Y702 HydrophobicContact CD2-CD1 4.15Å; Y54-Y702 AromaticContact CD2-CE1 3.66Å; Y54-Y702 HydrophobicContact CD2-CE1 3.66Å; Y54-Y702 HydrophobicContact CD2-CE2 4.39Å; Y54-Y702 AromaticContact CD2-CZ 3.79Å; Y54-Y702 AromaticContact CE2-CD1 3.49Å; Y54-Y702 HydrophobicContact CE2-CD1 3.49Å; Y54-Y702 VanDerWaalsContact CE2-CD1 3.49Å; Y54-Y702 AromaticContact CE2-CD2 3.91Å; Y54-Y702 HydrophobicContact CE2-CD2 3.91Å; Y54-Y702 AromaticContact CE2-CE1 3.46Å; Y54-Y702 HydrophobicContact CE2-CE1 3.46Å; Y54-Y702 VanDerWaalsContact CE2-CE1 3.46Å; Y54-Y702 AromaticContact CE2-CE2 3.87Å; Y54-Y702 HydrophobicContact CE2-CE2 3.87Å; Y54-Y702 AromaticContact CE2-CG 3.72Å; Y54-Y702 HydrophobicContact CE2-CG 3.72Å; Y54-Y702 AromaticContact CE2-CZ 3.65Å; Y54-Y702 AromaticContact CZ-CD1 3.93Å
55	G	49.6	Very low	54.3	Low	17 Å²	17	83.7 Å²	83.7	18%	0.175	41%	0.411	C	S	.	.	H	α-helix	trans	-75.7	-39.6	-179.3	0	0	0	0	0	114	W52 M57 A58	W52-G55 PolarHBondContact O-N 3.15Å; G55-M57 PolarHBondContact O-N 3.11Å; G55-A58 PolarHBondContact O-N 3.24Å
56	R	48.9	Very low	51.8	Low	86 Å²	86	90 Å²	90	33%	0.325	43%	0.433	S	S	.	.	H	α-helix	trans	-54.1	-30.5	-176.7	-78.2	-172.7	170.9	-173.8	-0.9	114	W52 A58 T59 F60 T94	W52-R56 PolarHBondContact O-N 3.46Å; R56-A58 VanDerWaalsContact C-N 3.3Å; R56-A58 PolarHBondContact O-N 3.02Å; R56-T59 WeakPolarHBondContact O-CB 3.3Å; R56-T59 PolarHBondContact O-N 2.92Å; R56-T59 VanDerWaalsContact O-N 3.07Å; R56-F60 HydrophobicContact CB-CD2 4.37Å; R56-F60 WeakPolarHBondContact O-CD2 3.46Å; R56-F60 PolarHBondContact O-N 3.21Å; R56-F60 VanDerWaalsContact O-N 3.16Å; R56-T94 PolarHBondContact NH2-O 2.92Å
57	M	47.1	Very low	49.3	Very low	44 Å²	44	92.3 Å²	92.3	22%	0.217	44%	0.436	C	S	.	.	H	α-helix	trans	-70	-19.6	-173.8	-66.2	175.8	-64	0	0	114.9	Y54 G55 R719 Q723	Y54-M57 HydrophobicContact CD2-CE 4.12Å; Y54-M57 WeakPolarHBondContact O-CE 3.37Å; G55-M57 PolarHBondContact O-N 3.11Å; M57-R719 HydrophobicContact CE-CB 3.79Å; M57-R719 HydrophobicContact CE-CG 3.89Å; M57-R719 HydrophobicContact SD-CB 3.6Å; M57-R719 VanDerWaalsContact SD-CB 3.6Å; M57-R719 HydrophobicContact SD-CG 4.08Å; M57-Q723 PolarHBondContact O-NE2 2.66Å
58	A	42.9	Very low	46.9	Very low	13 Å²	13	89.4 Å²	89.4	11%	0.107	42%	0.422	C	S	.	.	H	α-helix	trans	-73.8	-39.9	169.2	0	0	0	0	0	110.7	G55 R56 K117 Y773	G55-A58 PolarHBondContact O-N 3.24Å; R56-A58 VanDerWaalsContact C-N 3.3Å; R56-A58 PolarHBondContact O-N 3.02Å; A58-K117 VanDerWaalsContact O-CE 3.26Å; A58-K117 WeakPolarHBondContact O-CE 3.46Å; A58-K117 PolarHBondContact O-NZ 2.9Å; A58-Y773 WeakPolarHBondContact CB-O 3.47Å
59	T	39.9	Very low	44.6	Very low	56 Å²	56	93.6 Å²	93.6	34%	0.344	45%	0.445	S	S	.	.	H	α-helix	trans	-65.2	-50.8	-177.1	-40.1	0	0	0	0	111.7	R56 Q61 K117	R56-T59 WeakPolarHBondContact O-CB 3.3Å; R56-T59 PolarHBondContact O-N 2.92Å; R56-T59 VanDerWaalsContact O-N 3.07Å; T59-Q61 PolarHBondContact O-N 2.94Å; T59-K117 PolarHBondContact O-NZ 2.83Å
60	F	37.9	Very low	42.4	Very low	137 Å²	137	92.8 Å²	92.8	60%	0.601	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	51.2	-170.6	-63.4	-83.8	0	0	0	114.6	R56	R56-F60 HydrophobicContact CB-CD2 4.37Å; R56-F60 WeakPolarHBondContact O-CD2 3.46Å; R56-F60 PolarHBondContact O-N 3.21Å; R56-F60 VanDerWaalsContact O-N 3.16Å
61	Q	41.9	Very low	40.4	Very low	90 Å²	90	88.6 Å²	88.6	42%	0.421	43%	0.425	S	S	.	.			trans	-91.2	120.4	156.6	-74.8	-157.7	7.8	0	0	109.2	T59	T59-Q61 PolarHBondContact O-N 2.94Å
62	P	36.2	Very low	38.6	Very low	112 Å²	112	91 Å²	91	73%	0.727	43%	0.428	S	S	*	.			trans	-64.3	143.8	176.9	26.7	-34	0	0	0	110.5	K64	P62-K64 PolarHBondContact O-N 3.28Å
63	R	35.2	Very low	37.5	Very low	218 Å²	218	92.9 Å²	92.9	82%	0.823	44%	0.441	S	S	*	.	S	Bend	trans	-71.3	9.8	-171	-151.2	178.7	-176.5	104.7	-0.5	114.4	N65	R63-N65 PolarHBondContact O-N 3.15Å
64	K	32.1	Very low	36.4	Very low	147 Å²	147	94.4 Å²	94.4	64%	0.639	45%	0.45	S	S	*	.			trans	-75.2	114.4	179.2	-78.5	-152.1	169.7	-157.6	0	110.7	P62 R66 E72	P62-K64 PolarHBondContact O-N 3.28Å; K64-R66 PolarHBondContact O-N 2.82Å; K64-E72 IonicContact NZ-OE1 3.87Å; K64-E72 PolarHBondContact NZ-OE1 3.08Å
65	N	31.5	Very low	35.4	Very low	77 Å²	77	97.8 Å²	97.8	41%	0.412	47%	0.472	S	S	.	.			trans	-55.1	114.7	176.6	-71.1	-36.7	0	0	0	110.8	R63 W67 T68 F978	R63-N65 PolarHBondContact O-N 3.15Å; N65-W67 PolarHBondContact O-N 3.04Å; N65-T68 HydrophobicContact CB-CG2 3.85Å; N65-T68 PolarHBondContact O-N 3.3Å; N65-T68 PolarHBondContact O-OG1 2.99Å; N65-F978 VanDerWaalsContact ND2-CE2 3.29Å; N65-F978 WeakPolarHBondContact ND2-CE2 3.32Å; N65-F978 WeakPolarHBondContact ND2-CZ 3.25Å
66	R	32.9	Very low	34.4	Very low	148 Å²	148	105.1 Å²	105.1	56%	0.558	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	13.1	-179.4	-169.1	166	166.6	-127.4	1.4	115	K64 D267	K64-R66 PolarHBondContact O-N 2.82Å; R66-D267 IonicContact CZ-OD2 3.37Å; R66-D267 IonicContact NH2-OD2 3.72Å; R66-D267 PolarHBondContact NH2-OD2 3.02Å
67	W	30.3	Very low	33.4	Very low	136 Å²	136	108.9 Å²	108.9	52%	0.515	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-13.3	169.6	-67.9	97.6	0	0	0	113.3	N65	N65-W67 PolarHBondContact O-N 3.04Å
68	T	30.1	Very low	32.7	Very low	21 Å²	21	112.6 Å²	112.6	13%	0.129	55%	0.553	C	S	.	*	G	3₁₀ helix	trans	-79	-27.8	174.1	66.2	0	0	0	0	112.5	N65 F70 S71 E72 F978	N65-T68 HydrophobicContact CB-CG2 3.85Å; N65-T68 PolarHBondContact O-N 3.3Å; N65-T68 PolarHBondContact O-OG1 2.99Å; T68-F70 PolarHBondContact O-N 2.99Å; T68-S71 WeakPolarHBondContact O-CA 3.32Å; T68-S71 WeakPolarHBondContact O-CB 3.32Å; T68-S71 PolarHBondContact O-N 3.01Å; T68-E72 WeakPolarHBondContact O-CB 3.22Å; T68-E72 PolarHBondContact O-N 3.09Å; T68-E72 VanDerWaalsContact O-N 3.11Å; T68-E72 PolarHBondContact OG1-OE2 2.89Å; T68-F978 HydrophobicContact CG2-CD1 3.51Å; T68-F978 HydrophobicContact CG2-CE1 3.28Å; T68-F978 HydrophobicContact CG2-CG 4.48Å; T68-F978 HydrophobicContact CG2-CZ 4.08Å
69	L	29.1	Very low	32	Very low	112 Å²	112	116.6 Å²	116.6	59%	0.586	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-62.2	-7.3	179.5	-159.1	70.6	0	0	0	114.1	I73	L69-I73 WeakPolarHBondContact O-CD1 3.49Å
70	F	28.6	Very low	31.4	Very low	103 Å²	103	120.3 Å²	120.3	45%	0.452	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-104.8	6	170.7	-76	-77.7	0	0	0	113.6	T68 P981	T68-F70 PolarHBondContact O-N 2.99Å; F70-P981 VanDerWaalsContact CB-CD 3.43Å; F70-P981 HydrophobicContact CB-CG 3.96Å; F70-P981 WeakPolarHBondContact O-CD 3.31Å; F70-P981 WeakPolarHBondContact O-CG 3.23Å
71	S	29.2	Very low	30.9	Very low	62 Å²	62	120.8 Å²	120.8	43%	0.434	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.1	-13.3	169.6	-161	0	0	0	0	112.5	T68	T68-S71 WeakPolarHBondContact O-CA 3.32Å; T68-S71 WeakPolarHBondContact O-CB 3.32Å; T68-S71 PolarHBondContact O-N 3.01Å
72	E	28.1	Very low	30.2	Very low	97 Å²	97	121.4 Å²	121.4	45%	0.453	63%	0.627	S	S	.	*	S	Bend	trans	-109.2	43.9	-165.9	-155.4	173.6	165.8	0	0	109.1	K64 T68	K64-E72 IonicContact NZ-OE1 3.87Å; K64-E72 PolarHBondContact NZ-OE1 3.08Å; T68-E72 WeakPolarHBondContact O-CB 3.22Å; T68-E72 PolarHBondContact O-N 3.09Å; T68-E72 VanDerWaalsContact O-N 3.11Å; T68-E72 PolarHBondContact OG1-OE2 2.89Å
73	I	32.9	Very low	29.7	Very low	95 Å²	95	121.5 Å²	121.5	49%	0.487	63%	0.625	S	S	.	*	S	Bend	trans	-125.3	7.3	-179.4	-54.2	179.8	0	0	0	110.8	L69	L69-I73 WeakPolarHBondContact O-CD1 3.49Å
74	N	29.8	Very low	29.2	Very low	147 Å²	147	113.7 Å²	113.7	79%	0.786	60%	0.603	S	S	*	*	S	Bend	trans	-107	-1.5	-173.4	-85.7	33.2	0	0	0	115.1
75	D	29.8	Very low	29.2	Very low	135 Å²	135	113.9 Å²	113.9	72%	0.722	61%	0.61	S	S	*	*			trans	-118.5	75	-176.6	-67.5	-61.7	0	0	0	111.2	N77	D75-N77 PolarHBondContact O-N 3.39Å
76	E	29.1	Very low	29	Very low	171 Å²	171	115.4 Å²	115.4	80%	0.799	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-2	175.4	-67.6	-166.8	128.6	0	0	113.7
77	N	27.8	Very low	28.7	Very low	165 Å²	165	111.1 Å²	111.1	88%	0.882	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	26.7	-170.4	-77.8	-23.1	0	0	0	115.1	D75	D75-N77 PolarHBondContact O-N 3.39Å
78	V	32	Very low	28.7	Very low	122 Å²	122	109.6 Å²	109.6	74%	0.739	62%	0.616	S	S	*	*			trans	-107.6	112.1	170	-177.8	0	0	0	0	110.3
79	S	27.6	Very low	28.6	Very low	98 Å²	98	116.7 Å²	116.7	69%	0.685	65%	0.648	S	S	*	*			trans	-63.4	135.2	-176.7	53.2	0	0	0	0	113.8	D81	S79-D81 PolarHBondContact O-N 2.7Å
80	T	26.8	Very low	28.5	Very low	134 Å²	134	118.9 Å²	118.9	82%	0.822	66%	0.655	S	S	*	*			trans	41.1	66.3	131.6	-37.8	0	0	0	0	117.1
81	D	26.9	Very low	28.4	Very low	146 Å²	146	120.2 Å²	120.2	78%	0.781	67%	0.667	S	S	*	*			trans	-133.8	79.3	144.5	-146.6	-10.5	0	0	0	109.4	S79 V83	S79-D81 PolarHBondContact O-N 2.7Å; D81-V83 PolarHBondContact O-N 2.83Å
82	S	27.4	Very low	28.4	Very low	104 Å²	104	122 Å²	122	73%	0.727	68%	0.678	S	S	*	*			trans	-77.1	68.8	-175.1	59.8	0	0	0	0	111	S84	S82-S84 VanDerWaalsContact C-N 3.29Å; S82-S84 PolarHBondContact O-N 3.49Å
83	V	25.8	Very low	28.5	Very low	113 Å²	113	122 Å²	122	69%	0.685	69%	0.688	S	S	*	*			trans	-59.7	96.6	166.4	-179.9	0	0	0	0	107.4	D81 I85	D81-V83 PolarHBondContact O-N 2.83Å; V83-I85 PolarHBondContact O-N 3.21Å
84	S	24.8	Very low	28.8	Very low	54 Å²	54	121.7 Å²	121.7	38%	0.378	69%	0.691	S	S	.	*			trans	-64.5	121.3	-162	46.6	0	0	0	0	111	S82 D86 S87	S82-S84 VanDerWaalsContact C-N 3.29Å; S82-S84 PolarHBondContact O-N 3.49Å; S84-D86 PolarHBondContact O-N 3.3Å; S84-D86 VanDerWaalsContact O-N 3.07Å; S84-S87 PolarHBondContact O-N 2.88Å; S84-S87 PolarHBondContact O-OG 2.71Å; S84-S87 WeakPolarHBondContact OG-CB 3.36Å; S84-S87 PolarHBondContact OG-OG 3.18Å
85	I	31.9	Very low	29.6	Very low	152 Å²	152	121 Å²	121	78%	0.779	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-26.3	176.6	-66.7	174.8	0	0	0	110.4	V83	V83-I85 PolarHBondContact O-N 3.21Å
86	D	28.1	Very low	30.7	Very low	109 Å²	109	116.4 Å²	116.4	58%	0.583	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-20.8	178.8	-43.8	-66.3	0	0	0	114.3	S84 E89	S84-D86 PolarHBondContact O-N 3.3Å; S84-D86 VanDerWaalsContact O-N 3.07Å; D86-E89 PolarHBondContact O-N 3.2Å
87	S	26.2	Very low	32.1	Very low	57 Å²	57	114.3 Å²	114.3	40%	0.399	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.7	-32.1	178.8	62.9	0	0	0	0	113	S84 E89 Q90	S84-S87 PolarHBondContact O-N 2.88Å; S84-S87 PolarHBondContact O-OG 2.71Å; S84-S87 WeakPolarHBondContact OG-CB 3.36Å; S84-S87 PolarHBondContact OG-OG 3.18Å; S87-E89 PolarHBondContact O-N 3.45Å; S87-Q90 PolarHBondContact O-N 2.92Å; S87-Q90 VanDerWaalsContact O-N 3.07Å
88	V	29.7	Very low	34	Very low	104 Å²	104	108.1 Å²	108.1	63%	0.63	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-19.6	173.6	-175.5	0	0	0	0	111.3	Q90	V88-Q90 VanDerWaalsContact C-N 3.32Å
89	E	29.5	Very low	35.8	Very low	171 Å²	171	107.5 Å²	107.5	80%	0.799	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-4.2	173.5	-143.1	166.4	-145.6	0	0	112.9	D86 S87	D86-E89 PolarHBondContact O-N 3.2Å; S87-E89 PolarHBondContact O-N 3.45Å
90	Q	26	Very low	38.3	Very low	157 Å²	157	109.6 Å²	109.6	73%	0.734	62%	0.621	S	S	*	*			trans	-122.1	29.1	-172.9	-68.4	-165	4.2	0	0	116.1	S87 V88 P92	S87-Q90 PolarHBondContact O-N 2.92Å; S87-Q90 VanDerWaalsContact O-N 3.07Å; V88-Q90 VanDerWaalsContact C-N 3.32Å; Q90-P92 WeakPolarHBondContact O-CD 3.07Å
91	N	26.6	Very low	40.7	Very low	131 Å²	131	104 Å²	104	70%	0.701	59%	0.588	S	S	*	*			trans	-102.5	92.1	164.6	-117.8	-44.8	0	0	0	110.6	S93	N91-S93 PolarHBondContact O-N 3.38Å
92	P	29.7	Very low	43.1	Very low	101 Å²	101	98.6 Å²	98.6	66%	0.656	56%	0.556	S	S	*	*			trans	-79.5	41	-172.7	34.2	-38.7	0	0	0	114.4	Q90	Q90-P92 WeakPolarHBondContact O-CD 3.07Å
93	S	29.1	Very low	45.7	Very low	96 Å²	96	96.7 Å²	96.7	67%	0.671	54%	0.537	S	S	*	.			trans	-104.2	103.8	174.3	45.1	0	0	0	0	109.9	N91	N91-S93 PolarHBondContact O-N 3.38Å
94	T	40.9	Very low	48.4	Very low	89 Å²	89	95 Å²	95	55%	0.546	53%	0.527	S	S	.	.			cis	-124.5	154.2	15.1	54.7	0	0	0	0	113.8	R56	R56-T94 PolarHBondContact NH2-O 2.92Å
95	N	45.9	Very low	50.9	Low	132 Å²	132	94.5 Å²	94.5	71%	0.706	52%	0.52	S	S	*	.			trans	-77	111.5	144.9	-79.4	-21.2	0	0	0	107.4	P97	N95-P97 VanDerWaalsContact O-CD 3.24Å; N95-P97 WeakPolarHBondContact O-CD 3.3Å; N95-P97 VanDerWaalsContact O-N 3.16Å
96	D	53.6	Low	53.3	Low	38 Å²	38	87.7 Å²	87.7	20%	0.203	48%	0.484	C	S	.	.			trans	-63.8	109.8	176.5	-102.3	-18.5	0	0	0	109.1	R48 G98 N105	R48-D96 IonicContact CZ-OD2 2.7Å; R48-D96 IonicContact NH2-OD2 3.71Å; R48-D96 PolarHBondContact NH2-OD2 3.29Å; D96-G98 PolarHBondContact O-N 3.32Å; D96-N105 PolarHBondContact OD1-ND2 3.17Å; D96-N105 PolarHBondContact OD2-ND2 3.34Å
97	P	56.8	Low	56	Low	127 Å²	127	88.9 Å²	88.9	83%	0.825	49%	0.485	S	S	*	.			trans	-81.9	-15.7	-156.6	30.2	-36	0	0	0	114.9	N95	N95-P97 VanDerWaalsContact O-CD 3.24Å; N95-P97 WeakPolarHBondContact O-CD 3.3Å; N95-P97 VanDerWaalsContact O-N 3.16Å
98	G	68.2	Low	58.7	Low	35 Å²	35	93.3 Å²	93.3	36%	0.361	50%	0.497	S	S	.	.	S	Bend	trans	-133.4	152.9	-173.4	0	0	0	0	0	113.8	D96 F100 S101	D96-G98 PolarHBondContact O-N 3.32Å; G98-F100 PolarHBondContact O-N 3.41Å; G98-F100 VanDerWaalsContact O-N 3.11Å; G98-S101 VanDerWaalsContact O-CB 3.24Å; G98-S101 WeakPolarHBondContact O-CB 3.35Å; G98-S101 PolarHBondContact O-N 3.17Å; G98-S101 PolarHBondContact O-OG 2.91Å
99	Y	70.6	Confident	61.1	Low	109 Å²	109	88.8 Å²	88.8	43%	0.427	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-25.8	179.9	-67.8	-81	0	0	0	114.1	L46 K49	L46-Y99 HydrophobicContact CD2-CE1 4.04Å; K49-Y99 HydrophobicContact CB-CE1 4.42Å; K49-Y99 HydrophobicContact CD-CD1 3.81Å; K49-Y99 HydrophobicContact CD-CE1 3.25Å; K49-Y99 HydrophobicContact CG-CE1 4.45Å; K49-Y99 VanDerWaalsContact NZ-CZ 3.26Å; K49-Y99 PolarHBondContact NZ-OH 3.49Å
100	F	78.7	Confident	63.8	Low	142 Å²	142	84.4 Å²	84.4	62%	0.623	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	4	179.9	-58.5	-72.5	0	0	0	114.4	G98 W102 I103	G98-F100 PolarHBondContact O-N 3.41Å; G98-F100 VanDerWaalsContact O-N 3.11Å; F100-W102 PolarHBondContact O-N 3.48Å; F100-W102 VanDerWaalsContact O-N 3.08Å; F100-I103 HydrophobicContact CD1-CD1 3.93Å; F100-I103 PolarHBondContact O-N 2.86Å
101	S	77.3	Confident	66.6	Low	18 Å²	18	80.2 Å²	80.2	13%	0.126	44%	0.442	C	S	.	.	H	α-helix	trans	-48.7	-36.6	175.5	50.7	0	0	0	0	113	R48 G98 I103 V104 N105	R48-S101 PolarHBondContact NH2-OG 3.48Å; G98-S101 VanDerWaalsContact O-CB 3.24Å; G98-S101 WeakPolarHBondContact O-CB 3.35Å; G98-S101 PolarHBondContact O-N 3.17Å; G98-S101 PolarHBondContact O-OG 2.91Å; S101-I103 VanDerWaalsContact C-N 3.31Å; S101-I103 PolarHBondContact O-N 3.24Å; S101-V104 PolarHBondContact O-N 3.19Å; S101-N105 WeakPolarHBondContact O-CB 3.21Å; S101-N105 VanDerWaalsContact O-CG 3.24Å; S101-N105 PolarHBondContact O-N 2.77Å
102	W	77.8	Confident	69.5	Low	31 Å²	31	76.8 Å²	76.8	12%	0.117	43%	0.432	C	S	.	.	H	α-helix	trans	-61.5	-33.4	180	75.6	-89	0	0	0	114.4	M41 F44 T45 F100 Y106 L693 Y769	M41-W102 HydrophobicContact SD-CH2 4.49Å; F44-W102 HydrophobicContact CD1-CH2 4.37Å; F44-W102 HydrophobicContact CD1-CZ2 4.09Å; F44-W102 HydrophobicContact CE1-CD2 4.13Å; F44-W102 HydrophobicContact CE1-CE3 4.17Å; F44-W102 HydrophobicContact CE1-CH2 4.1Å; F44-W102 HydrophobicContact CE1-CZ2 4.06Å; F44-W102 HydrophobicContact CE1-CZ3 4.16Å; T45-W102 HydrophobicContact CG2-CZ2 4.39Å; T45-W102 VanDerWaalsContact CG2-NE1 3.29Å; F100-W102 PolarHBondContact O-N 3.48Å; F100-W102 VanDerWaalsContact O-N 3.08Å; W102-Y106 VanDerWaalsContact O-CB 3.22Å; W102-Y106 WeakPolarHBondContact O-CB 3.43Å; W102-Y106 PolarHBondContact O-N 3.34Å; W102-L693 HydrophobicContact CH2-CD2 3.87Å; W102-L693 HydrophobicContact CZ3-CD2 4.23Å; W102-Y769 HydrophobicContact CB-CE2 4.41Å; W102-Y769 HydrophobicContact CE3-CD2 4.06Å; W102-Y769 AromaticContact CE3-CE2 3.85Å; W102-Y769 HydrophobicContact CE3-CE2 3.85Å; W102-Y769 HydrophobicContact CZ3-CD2 4.45Å
103	I	82.9	Confident	72.1	Confident	65 Å²	65	74.8 Å²	74.8	33%	0.333	42%	0.416	S	S	.	.	H	α-helix	trans	-71.5	-45.8	179	-55	-177.7	0	0	0	108.8	F100 S101 Y106 F107	F100-I103 HydrophobicContact CD1-CD1 3.93Å; F100-I103 PolarHBondContact O-N 2.86Å; S101-I103 VanDerWaalsContact C-N 3.31Å; S101-I103 PolarHBondContact O-N 3.24Å; I103-Y106 WeakPolarHBondContact O-CB 3.44Å; I103-Y106 PolarHBondContact O-N 3.15Å; I103-F107 HydrophobicContact CG2-CD2 3.92Å; I103-F107 HydrophobicContact CG2-CE2 3.7Å; I103-F107 WeakPolarHBondContact O-CD2 3.48Å; I103-F107 PolarHBondContact O-N 2.94Å
104	V	81.5	Confident	74.8	Confident	78 Å²	78	70.5 Å²	70.5	47%	0.473	39%	0.385	S	S	.	.	H	α-helix	trans	-62.6	-45.7	176	-177.6	0	0	0	0	111	S101 Y106 F107 K108	S101-V104 PolarHBondContact O-N 3.19Å; V104-Y106 VanDerWaalsContact C-N 3.32Å; V104-Y106 PolarHBondContact O-N 3.44Å; V104-F107 PolarHBondContact O-N 2.68Å; V104-K108 HydrophobicContact CG1-CD 4.37Å; V104-K108 WeakPolarHBondContact O-CG 3.39Å; V104-K108 PolarHBondContact O-N 3.24Å
105	N	77	Confident	76.8	Confident	42 Å²	42	71.3 Å²	71.3	23%	0.225	38%	0.378	C	S	.	.	H	α-helix	trans	-67	-32.3	178.5	-68.4	-12.3	0	0	0	112.1	D96 S101 L109	D96-N105 PolarHBondContact OD1-ND2 3.17Å; D96-N105 PolarHBondContact OD2-ND2 3.34Å; S101-N105 WeakPolarHBondContact O-CB 3.21Å; S101-N105 VanDerWaalsContact O-CG 3.24Å; S101-N105 PolarHBondContact O-N 2.77Å; N105-L109 PolarHBondContact O-N 2.93Å
106	Y	82.8	Confident	78.4	Confident	9 Å²	9	68.5 Å²	68.5	4%	0.035	37%	0.369	C	S	.	.	H	α-helix	trans	-64.4	-46.3	170.3	166	-86.3	0	0	0	112.1	W102 I103 V104 K108 L109 F765 R768 Y769	W102-Y106 VanDerWaalsContact O-CB 3.22Å; W102-Y106 WeakPolarHBondContact O-CB 3.43Å; W102-Y106 PolarHBondContact O-N 3.34Å; I103-Y106 WeakPolarHBondContact O-CB 3.44Å; I103-Y106 PolarHBondContact O-N 3.15Å; V104-Y106 VanDerWaalsContact C-N 3.32Å; V104-Y106 PolarHBondContact O-N 3.44Å; Y106-K108 VanDerWaalsContact C-N 3.26Å; Y106-K108 PolarHBondContact O-N 2.81Å; Y106-L109 VanDerWaalsContact O-CB 3.28Å; Y106-L109 WeakPolarHBondContact O-CB 3.39Å; Y106-L109 PolarHBondContact O-N 3.25Å; Y106-L109 VanDerWaalsContact O-N 3.09Å; Y106-F765 HydrophobicContact CD1-CD1 4.39Å; Y106-F765 AromaticContact CE1-CD1 3.43Å; Y106-F765 HydrophobicContact CE1-CD1 3.43Å; Y106-F765 VanDerWaalsContact CE1-CD1 3.43Å; Y106-F765 AromaticContact CE1-CE1 3.56Å; Y106-F765 HydrophobicContact CE1-CE1 3.56Å; Y106-F765 HydrophobicContact CE2-CD1 4.39Å; Y106-F765 AromaticContact CZ-CD1 3.42Å; Y106-F765 VanDerWaalsContact CZ-CD1 3.42Å; Y106-F765 AromaticContact CZ-CE1 3.89Å; Y106-F765 WeakPolarHBondContact OH-CD1 3.47Å; Y106-R768 HydrophobicContact CE2-CB 4.01Å; Y106-R768 HydrophobicContact CE2-CG 3.81Å; Y106-R768 WeakPolarHBondContact OH-CD 3.4Å; Y106-R768 PolarHBondContact OH-NH1 3.04Å; Y106-R768 VanDerWaalsContact OH-NH1 3.11Å; Y106-Y769 HydrophobicContact CD2-CD2 4.46Å
107	F	84.9	Confident	79.6	Confident	134 Å²	134	69.4 Å²	69.4	59%	0.588	37%	0.371	S	S	*	.	H	α-helix	trans	-68.6	-25.4	-179.9	-78.7	-67.7	0	0	0	113	I103 V104 L109 F765	I103-F107 HydrophobicContact CG2-CD2 3.92Å; I103-F107 HydrophobicContact CG2-CE2 3.7Å; I103-F107 WeakPolarHBondContact O-CD2 3.48Å; I103-F107 PolarHBondContact O-N 2.94Å; V104-F107 PolarHBondContact O-N 2.68Å; F107-L109 VanDerWaalsContact C-N 3.32Å; F107-F765 AromaticContact CE1-CE1 3.88Å; F107-F765 HydrophobicContact CE1-CE1 3.88Å; F107-F765 HydrophobicContact CE1-CZ 4.45Å; F107-F765 AromaticContact CZ-CE1 3.95Å; F107-F765 HydrophobicContact CZ-CE1 3.95Å; F107-F765 HydrophobicContact CZ-CZ 4.47Å
108	K	83.3	Confident	80.7	Confident	150 Å²	150	63.8 Å²	63.8	65%	0.652	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-14.4	170.8	-72.3	175.6	176.9	-179.4	0	114.5	V104 Y106 T110	V104-K108 HydrophobicContact CG1-CD 4.37Å; V104-K108 WeakPolarHBondContact O-CG 3.39Å; V104-K108 PolarHBondContact O-N 3.24Å; Y106-K108 VanDerWaalsContact C-N 3.26Å; Y106-K108 PolarHBondContact O-N 2.81Å; K108-T110 PolarHBondContact O-N 3.41Å
109	L	80.1	Confident	81.4	Confident	9 Å²	9	63.3 Å²	63.3	5%	0.047	33%	0.33	C	S	.	.			trans	-75.3	115	-172.9	177.5	64.9	0	0	0	112.3	N105 Y106 F107 D113 R768 Y772	N105-L109 PolarHBondContact O-N 2.93Å; Y106-L109 VanDerWaalsContact O-CB 3.28Å; Y106-L109 WeakPolarHBondContact O-CB 3.39Å; Y106-L109 PolarHBondContact O-N 3.25Å; Y106-L109 VanDerWaalsContact O-N 3.09Å; F107-L109 VanDerWaalsContact C-N 3.32Å; L109-D113 HydrophobicContact CD1-CB 3.7Å; L109-R768 PolarHBondContact O-NH2 3.4Å; L109-Y772 HydrophobicContact CD1-CD1 3.88Å; L109-Y772 HydrophobicContact CD1-CD2 3.63Å; L109-Y772 HydrophobicContact CD1-CE1 3.7Å; L109-Y772 HydrophobicContact CD1-CE2 3.45Å; L109-Y772 VanDerWaalsContact CD1-CE2 3.45Å; L109-Y772 HydrophobicContact CD1-CG 3.83Å; L109-Y772 VanDerWaalsContact CD1-CZ 3.48Å; L109-Y772 HydrophobicContact CD2-CD1 3.85Å; L109-Y772 HydrophobicContact CD2-CD2 3.99Å; L109-Y772 HydrophobicContact CD2-CE1 4.5Å; L109-Y772 HydrophobicContact CD2-CG 3.54Å; L109-Y772 HydrophobicContact CG-CD2 4.44Å; L109-Y772 HydrophobicContact CG-CG 4.36Å
110	T	86.4	Confident	82	Confident	79 Å²	79	59.4 Å²	59.4	49%	0.485	32%	0.317	S	S	.	.			trans	-82	151.1	-179.4	-41.1	0	0	0	0	111.8	K108 A112 D113 L114	K108-T110 PolarHBondContact O-N 3.41Å; T110-A112 HydrophobicContact CG2-CB 4.19Å; T110-A112 PolarHBondContact O-N 3.25Å; T110-A112 VanDerWaalsContact O-N 3.16Å; T110-D113 WeakPolarHBondContact CA-OD2 3.39Å; T110-D113 WeakPolarHBondContact CB-OD2 3.4Å; T110-D113 PolarHBondContact N-OD2 3.11Å; T110-D113 WeakPolarHBondContact O-CB 3.36Å; T110-D113 PolarHBondContact O-N 3.48Å; T110-D113 VanDerWaalsContact O-N 3.08Å; T110-D113 PolarHBondContact OG1-OD2 2.84Å; T110-D113 VanDerWaalsContact OG1-OD2 3.06Å; T110-L114 PolarHBondContact O-N 3.46Å; T110-L114 VanDerWaalsContact O-N 3.1Å
111	S	85	Confident	82.3	Confident	70 Å²	70	53.6 Å²	53.6	49%	0.49	29%	0.292	S	S	.	.	H	α-helix	trans	-60	-21.5	171.3	-58.6	0	0	0	0	113.5	R115	S111-R115 WeakPolarHBondContact O-CB 3.35Å; S111-R115 PolarHBondContact O-N 3.23Å
112	A	86.1	Confident	82.8	Confident	59 Å²	59	52.8 Å²	52.8	49%	0.488	29%	0.287	S	S	.	.	H	α-helix	trans	-71.1	-43.5	172.5	0	0	0	0	0	111.9	T110 R115 S116	T110-A112 HydrophobicContact CG2-CB 4.19Å; T110-A112 PolarHBondContact O-N 3.25Å; T110-A112 VanDerWaalsContact O-N 3.16Å; A112-R115 WeakPolarHBondContact O-CB 3.5Å; A112-R115 PolarHBondContact O-N 2.99Å; A112-S116 PolarHBondContact O-N 3.12Å
113	D	85.3	Confident	83.4	Confident	59 Å²	59	52.1 Å²	52.1	32%	0.316	29%	0.286	S	S	.	.	H	α-helix	trans	-64.7	-42.7	177.4	-45.4	-36.7	0	0	0	110.5	L109 T110 S116 K117 Y772	L109-D113 HydrophobicContact CD1-CB 3.7Å; T110-D113 WeakPolarHBondContact CA-OD2 3.39Å; T110-D113 WeakPolarHBondContact CB-OD2 3.4Å; T110-D113 PolarHBondContact N-OD2 3.11Å; T110-D113 WeakPolarHBondContact O-CB 3.36Å; T110-D113 PolarHBondContact O-N 3.48Å; T110-D113 VanDerWaalsContact O-N 3.08Å; T110-D113 PolarHBondContact OG1-OD2 2.84Å; T110-D113 VanDerWaalsContact OG1-OD2 3.06Å; D113-S116 PolarHBondContact O-N 3.32Å; D113-S116 PolarHBondContact O-OG 3.1Å; D113-K117 VanDerWaalsContact O-CB 3.28Å; D113-K117 WeakPolarHBondContact O-CB 3.36Å; D113-K117 PolarHBondContact O-N 3.14Å; D113-Y772 HydrophobicContact CB-CE2 4.28Å
114	L	84.8	Confident	83.7	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-42	173.2	-176.6	66.7	0	0	0	111.9	T110 S116 K117 A118 V123 L126 L771 Y772	T110-L114 PolarHBondContact O-N 3.46Å; T110-L114 VanDerWaalsContact O-N 3.1Å; L114-S116 VanDerWaalsContact C-N 3.33Å; L114-S116 PolarHBondContact O-N 3.11Å; L114-K117 PolarHBondContact O-N 2.8Å; L114-A118 HydrophobicContact CD1-CB 3.76Å; L114-A118 HydrophobicContact CG-CB 4.4Å; L114-A118 WeakPolarHBondContact O-CB 3.36Å; L114-A118 PolarHBondContact O-N 2.75Å; L114-V123 HydrophobicContact CD2-CG2 4.28Å; L114-V123 HydrophobicContact CG-CG2 4.28Å; L114-L126 HydrophobicContact CD2-CD1 3.35Å; L114-L771 HydrophobicContact CD1-CB 4.18Å; L114-Y772 HydrophobicContact CD1-CD2 4.2Å
115	R	84.6	Confident	84.2	Confident	107 Å²	107	45.8 Å²	45.8	40%	0.404	25%	0.25	S	C	.	.	H	α-helix	trans	-61.2	-42	175.2	-177.5	-175.6	-106.7	145.8	-16.6	111.5	S111 A112 K117 G119 N120 V123 E207	S111-R115 WeakPolarHBondContact O-CB 3.35Å; S111-R115 PolarHBondContact O-N 3.23Å; A112-R115 WeakPolarHBondContact O-CB 3.5Å; A112-R115 PolarHBondContact O-N 2.99Å; R115-K117 VanDerWaalsContact C-N 3.33Å; R115-G119 VanDerWaalsContact O-CA 3.26Å; R115-G119 WeakPolarHBondContact O-CA 3.44Å; R115-G119 PolarHBondContact O-N 3.26Å; R115-G119 VanDerWaalsContact O-N 3.11Å; R115-N120 PolarHBondContact NE-OD1 2.78Å; R115-V123 HydrophobicContact CB-CG2 3.99Å; R115-E207 IonicContact CZ-OE1 2.88Å; R115-E207 IonicContact NH2-OE1 3.74Å; R115-E207 PolarHBondContact NH2-OE1 2.84Å
116	S	79.5	Confident	85	Confident	72 Å²	72	44.1 Å²	44.1	50%	0.503	24%	0.241	S	C	.	.	H	α-helix	trans	-73.1	-25.6	-177.6	80.3	0	0	0	0	113	A112 D113 L114	A112-S116 PolarHBondContact O-N 3.12Å; D113-S116 PolarHBondContact O-N 3.32Å; D113-S116 PolarHBondContact O-OG 3.1Å; L114-S116 VanDerWaalsContact C-N 3.33Å; L114-S116 PolarHBondContact O-N 3.11Å
117	K	78.3	Confident	85.5	Confident	57 Å²	57	47.2 Å²	47.2	25%	0.248	25%	0.253	C	S	.	.	H	α-helix	trans	-93.9	-50.3	-179.8	-173.1	61.7	179.8	174.4	0	114.6	A58 T59 D113 L114 R115 Y772	A58-K117 VanDerWaalsContact O-CE 3.26Å; A58-K117 WeakPolarHBondContact O-CE 3.46Å; A58-K117 PolarHBondContact O-NZ 2.9Å; T59-K117 PolarHBondContact O-NZ 2.83Å; D113-K117 VanDerWaalsContact O-CB 3.28Å; D113-K117 WeakPolarHBondContact O-CB 3.36Å; D113-K117 PolarHBondContact O-N 3.14Å; L114-K117 PolarHBondContact O-N 2.8Å; R115-K117 VanDerWaalsContact C-N 3.33Å; K117-Y772 HydrophobicContact CB-CD2 4.01Å; K117-Y772 HydrophobicContact CB-CE2 3.81Å; K117-Y772 HydrophobicContact CG-CD2 4.03Å; K117-Y772 HydrophobicContact CG-CE2 3.97Å
118	A	79.9	Confident	86	Confident	10 Å²	10	40.9 Å²	40.9	8%	0.083	23%	0.225	C	C	.	.	H	α-helix	trans	-102.7	-14.6	-172.8	0	0	0	0	0	113.9	L114 A122 P777	L114-A118 HydrophobicContact CD1-CB 3.76Å; L114-A118 HydrophobicContact CG-CB 4.4Å; L114-A118 WeakPolarHBondContact O-CB 3.36Å; L114-A118 PolarHBondContact O-N 2.75Å; A118-A122 HydrophobicContact CB-CB 3.68Å; A118-P777 WeakPolarHBondContact O-CB 3.35Å
119	G	82.1	Confident	86.6	Confident	24 Å²	24	33.8 Å²	33.8	25%	0.247	19%	0.194	C	C	.	.			trans	91.8	176.5	178.6	0	0	0	0	0	114.8	R115	R115-G119 VanDerWaalsContact O-CA 3.26Å; R115-G119 WeakPolarHBondContact O-CA 3.44Å; R115-G119 PolarHBondContact O-N 3.26Å; R115-G119 VanDerWaalsContact O-N 3.11Å
120	N	83.5	Confident	87.3	Confident	27 Å²	27	38.2 Å²	38.2	14%	0.144	21%	0.213	C	C	.	.	H	α-helix	trans	-63	-42.1	-177.6	-99.2	4.9	0	0	0	112.7	R115 A122 V123 Q124 E207 T211	R115-N120 PolarHBondContact NE-OD1 2.78Å; N120-A122 VanDerWaalsContact C-N 3.31Å; N120-A122 PolarHBondContact O-N 2.79Å; N120-V123 WeakPolarHBondContact O-CB 3.22Å; N120-V123 PolarHBondContact O-N 2.91Å; N120-Q124 WeakPolarHBondContact O-CG 3.33Å; N120-Q124 PolarHBondContact O-N 3.14Å; N120-E207 PolarHBondContact ND2-OE1 3.33Å; N120-T211 WeakPolarHBondContact ND2-CG2 3.33Å; N120-T211 PolarHBondContact ND2-OG1 3.43Å; N120-T211 VanDerWaalsContact ND2-OG1 3.13Å
121	D	85	Confident	87.8	Confident	21 Å²	21	35.2 Å²	35.2	11%	0.112	19%	0.193	C	C	.	.	H	α-helix	trans	-60.7	-41.2	-173.2	-49	4.6	0	0	0	111	V123 Q124 Y125 F728 R779 I780	D121-V123 PolarHBondContact O-N 2.77Å; D121-Q124 PolarHBondContact O-N 3.31Å; D121-Y125 WeakPolarHBondContact O-CB 3.4Å; D121-Y125 PolarHBondContact O-N 3.11Å; D121-F728 HydrophobicContact CB-CE1 4.11Å; D121-F728 HydrophobicContact CB-CZ 3.97Å; D121-F728 WeakPolarHBondContact O-CE1 3.37Å; D121-R779 WeakPolarHBondContact OD2-CA 3.24Å; D121-I780 PolarHBondContact OD2-N 2.98Å
122	A	88	Confident	88.4	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-63.3	-38.8	175.1	0	0	0	0	0	112.7	A118 N120 Y125 L126 F728 L771	A118-A122 HydrophobicContact CB-CB 3.68Å; N120-A122 VanDerWaalsContact C-N 3.31Å; N120-A122 PolarHBondContact O-N 2.79Å; A122-Y125 PolarHBondContact O-N 3.27Å; A122-L126 PolarHBondContact O-N 3.02Å; A122-F728 HydrophobicContact CB-CZ 4.33Å; A122-L771 HydrophobicContact CB-CD1 4.42Å; A122-L771 HydrophobicContact CB-CD2 4.11Å
123	V	89.5	Confident	88.9	Confident	16 Å²	16	30.1 Å²	30.1	10%	0.097	15%	0.152	C	C	.	.	H	α-helix	trans	-70.1	-35	175.3	178.2	0	0	0	0	111.2	L114 R115 N120 D121 R127	L114-V123 HydrophobicContact CD2-CG2 4.28Å; L114-V123 HydrophobicContact CG-CG2 4.28Å; R115-V123 HydrophobicContact CB-CG2 3.99Å; N120-V123 WeakPolarHBondContact O-CB 3.22Å; N120-V123 PolarHBondContact O-N 2.91Å; D121-V123 PolarHBondContact O-N 2.77Å; V123-R127 WeakPolarHBondContact O-CB 3.41Å; V123-R127 PolarHBondContact O-N 3.28Å
124	Q	89.3	Confident	89.5	Confident	10 Å²	10	29.9 Å²	29.9	5%	0.047	15%	0.15	C	C	.	.	H	α-helix	trans	-68.6	-37	174.2	-67.8	167.3	8.3	0	0	111.6	N120 D121 F128 F204	N120-Q124 WeakPolarHBondContact O-CG 3.33Å; N120-Q124 PolarHBondContact O-N 3.14Å; D121-Q124 PolarHBondContact O-N 3.31Å; Q124-F128 PolarHBondContact O-N 2.96Å; Q124-F204 HydrophobicContact CG-CD2 4.47Å; Q124-F204 VanDerWaalsContact OE1-CE2 3.29Å
125	Y	92.9	Very high	90.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.4	-49.2	174.2	174.2	-84.3	0	0	0	113.2	D121 A122 R127 F128 H129 F726 F728 F731 Y732 E767 L771	D121-Y125 WeakPolarHBondContact O-CB 3.4Å; D121-Y125 PolarHBondContact O-N 3.11Å; A122-Y125 PolarHBondContact O-N 3.27Å; Y125-R127 VanDerWaalsContact C-N 3.34Å; Y125-F128 WeakPolarHBondContact O-CB 3.41Å; Y125-F128 PolarHBondContact O-N 3.45Å; Y125-H129 AromaticContact CD1-ND1 3.97Å; Y125-H129 AromaticContact CE1-CE1 3.63Å; Y125-H129 AromaticContact CE1-ND1 3.59Å; Y125-H129 AromaticContact CE2-CE1 3.51Å; Y125-H129 AromaticContact CZ-CE1 3.15Å; Y125-H129 AromaticContact CZ-ND1 3.62Å; Y125-H129 AromaticContact CZ-NE2 3.98Å; Y125-H129 PolarHBondContact O-N 2.94Å; Y125-H129 VanDerWaalsContact O-N 3.16Å; Y125-H129 PolarHBondContact O-ND1 3.05Å; Y125-H129 PolarHBondContact OH-CE1 3.42Å; Y125-H129 PolarHBondContact OH-NE2 2.95Å; Y125-F726 HydrophobicContact CD1-CE1 4Å; Y125-F726 HydrophobicContact CD1-CZ 4.4Å; Y125-F726 HydrophobicContact CD2-CE1 4.02Å; Y125-F726 AromaticContact CE1-CE1 3.81Å; Y125-F726 HydrophobicContact CE1-CE1 3.81Å; Y125-F726 AromaticContact CE1-CZ 3.79Å; Y125-F726 HydrophobicContact CE1-CZ 3.79Å; Y125-F726 AromaticContact CE2-CE1 3.81Å; Y125-F726 HydrophobicContact CE2-CE1 3.81Å; Y125-F726 HydrophobicContact CE2-CZ 4.2Å; Y125-F726 HydrophobicContact CG-CE1 4.14Å; Y125-F726 AromaticContact CZ-CE1 3.72Å; Y125-F726 AromaticContact CZ-CZ 3.69Å; Y125-F728 AromaticContact CD2-CD1 3.76Å; Y125-F728 HydrophobicContact CD2-CD1 3.76Å; Y125-F728 HydrophobicContact CD2-CE1 4.27Å; Y125-F728 HydrophobicContact CG-CD1 4.09Å; Y125-F728 HydrophobicContact CG-CE1 4.13Å; Y125-F731 HydrophobicContact CE2-CB 4.4Å; Y125-F731 WeakPolarHBondContact OH-CB 3.37Å; Y125-Y732 HydrophobicContact CD2-CD1 4.1Å; Y125-Y732 AromaticContact CD2-CD2 3.97Å; Y125-Y732 HydrophobicContact CD2-CD2 3.97Å; Y125-Y732 AromaticContact CD2-CE1 3.71Å; Y125-Y732 HydrophobicContact CD2-CE1 3.71Å; Y125-Y732 AromaticContact CD2-CE2 3.6Å; Y125-Y732 HydrophobicContact CD2-CE2 3.6Å; Y125-Y732 HydrophobicContact CD2-CG 4.2Å; Y125-Y732 AromaticContact CD2-CZ 3.45Å; Y125-Y732 VanDerWaalsContact CD2-CZ 3.45Å; Y125-Y732 AromaticContact CE2-CD1 3.82Å; Y125-Y732 HydrophobicContact CE2-CD1 3.82Å; Y125-Y732 HydrophobicContact CE2-CD2 4.05Å; Y125-Y732 AromaticContact CE2-CE1 3.88Å; Y125-Y732 HydrophobicContact CE2-CE1 3.88Å; Y125-Y732 HydrophobicContact CE2-CE2 4.14Å; Y125-Y732 AromaticContact CE2-CG 3.89Å; Y125-Y732 HydrophobicContact CE2-CG 3.89Å; Y125-E767 HydrophobicContact CE1-CB 4.45Å; Y125-E767 WeakPolarHBondContact CE1-OE2 3.38Å; Y125-E767 PolarHBondContact OH-OE1 3.25Å; Y125-E767 PolarHBondContact OH-OE2 2.87Å; Y125-L771 HydrophobicContact CD1-CD1 4.05Å; Y125-L771 HydrophobicContact CE1-CD1 4.48Å
126	L	93.7	Very high	90.8	Very high	7 Å²	7	24.7 Å²	24.7	4%	0.037	13%	0.13	C	C	.	.	H	α-helix	trans	-66.5	-37.2	175.7	-73.4	-177.2	0	0	0	112	L114 A122 F128 H129 F130 Y764 E767 R768 L771	L114-L126 HydrophobicContact CD2-CD1 3.35Å; A122-L126 PolarHBondContact O-N 3.02Å; L126-F128 VanDerWaalsContact C-N 3.32Å; L126-F128 PolarHBondContact O-N 3.2Å; L126-H129 PolarHBondContact O-N 3.48Å; L126-F130 PolarHBondContact O-N 3.05Å; L126-Y764 HydrophobicContact CB-CE2 4.01Å; L126-Y764 HydrophobicContact CD2-CD2 4.11Å; L126-Y764 HydrophobicContact CD2-CE2 4.24Å; L126-Y764 WeakPolarHBondContact O-CE2 3.28Å; L126-E767 HydrophobicContact CD2-CB 4.21Å; L126-R768 HydrophobicContact CD1-CB 3.64Å; L126-R768 HydrophobicContact CD1-CG 3.71Å; L126-R768 HydrophobicContact CD2-CB 4.09Å; L126-L771 HydrophobicContact CD1-CD1 4.13Å; L126-L771 HydrophobicContact CD2-CD1 3.91Å; L126-L771 HydrophobicContact CG-CD1 3.78Å
127	R	93.4	Very high	91.6	Very high	75 Å²	75	22.9 Å²	22.9	28%	0.283	12%	0.12	S	C	.	.	H	α-helix	trans	-58.3	-45.9	173.2	-178.2	177.6	-68.7	162	1.3	110.8	V123 Y125 H129 F130 Y131 F200	V123-R127 WeakPolarHBondContact O-CB 3.41Å; V123-R127 PolarHBondContact O-N 3.28Å; Y125-R127 VanDerWaalsContact C-N 3.34Å; R127-H129 VanDerWaalsContact C-N 3.34Å; R127-H129 PolarHBondContact O-N 3.45Å; R127-F130 WeakPolarHBondContact O-CB 3.26Å; R127-F130 PolarHBondContact O-N 3.1Å; R127-F130 VanDerWaalsContact O-N 3.11Å; R127-Y131 HydrophobicContact CG-CD2 4.18Å; R127-Y131 HydrophobicContact CG-CE2 3.85Å; R127-Y131 WeakPolarHBondContact O-CD2 3.49Å; R127-Y131 PolarHBondContact O-N 2.93Å; R127-Y131 VanDerWaalsContact O-N 3.16Å; R127-F200 HydrophobicContact CB-CE2 4.34Å; R127-F200 HydrophobicContact CG-CD2 4.16Å; R127-F200 HydrophobicContact CG-CE2 3.96Å
128	F	95	Very high	92.6	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57	-45.7	175.7	-178.9	-91.4	0	0	0	112.2	Q124 Y125 L126 F130 Y131 L132 M197 F200 Y732 L736 A788 I789 M792	Q124-F128 PolarHBondContact O-N 2.96Å; Y125-F128 WeakPolarHBondContact O-CB 3.41Å; Y125-F128 PolarHBondContact O-N 3.45Å; L126-F128 VanDerWaalsContact C-N 3.32Å; L126-F128 PolarHBondContact O-N 3.2Å; F128-F130 VanDerWaalsContact C-N 3.27Å; F128-F130 PolarHBondContact O-N 2.68Å; F128-Y131 WeakPolarHBondContact O-CB 3.22Å; F128-Y131 PolarHBondContact O-N 2.61Å; F128-L132 HydrophobicContact CD1-CD1 4.23Å; F128-L132 HydrophobicContact CD1-CG 4.25Å; F128-L132 HydrophobicContact CE1-CD1 3.89Å; F128-L132 HydrophobicContact CE1-CD2 3.96Å; F128-L132 HydrophobicContact CE1-CG 4Å; F128-L132 HydrophobicContact CZ-CD2 4.18Å; F128-L132 PolarHBondContact O-N 2.78Å; F128-L132 VanDerWaalsContact O-N 3.13Å; F128-M197 HydrophobicContact CE2-CE 4.47Å; F128-M197 HydrophobicContact CE2-SD 3.92Å; F128-F200 HydrophobicContact CB-CE2 4.2Å; F128-F200 HydrophobicContact CB-CZ 3.91Å; F128-F200 HydrophobicContact CD2-CD1 4.18Å; F128-F200 AromaticContact CD2-CE1 3.73Å; F128-F200 HydrophobicContact CD2-CE1 3.73Å; F128-F200 HydrophobicContact CD2-CZ 4Å; F128-F200 HydrophobicContact CG-CZ 4.47Å; F128-Y732 HydrophobicContact CB-CE1 4.33Å; F128-Y732 HydrophobicContact CD1-CD1 4.24Å; F128-Y732 AromaticContact CD1-CE1 3.52Å; F128-Y732 HydrophobicContact CD1-CE1 3.52Å; F128-Y732 HydrophobicContact CE1-CD1 4.28Å; F128-Y732 AromaticContact CE1-CE1 3.94Å; F128-Y732 HydrophobicContact CE1-CE1 3.94Å; F128-Y732 AromaticContact CG-CE1 3.99Å; F128-Y732 HydrophobicContact CG-CE1 3.99Å; F128-L736 HydrophobicContact CE1-CD1 4.39Å; F128-L736 HydrophobicContact CE1-CD2 4Å; F128-L736 HydrophobicContact CE1-CG 4.37Å; F128-L736 HydrophobicContact CZ-CD2 4.02Å; F128-A788 HydrophobicContact CD2-CB 4.38Å; F128-A788 HydrophobicContact CE1-CB 4.12Å; F128-A788 HydrophobicContact CE2-CB 3.87Å; F128-A788 HydrophobicContact CZ-CB 3.71Å; F128-A788 WeakPolarHBondContact CZ-O 3.47Å; F128-I789 HydrophobicContact CE2-CG1 4.23Å; F128-M792 HydrophobicContact CZ-CB 4.18Å
129	H	95.5	Very high	93.4	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.009	12%	0.119	C	C	.	.	H	α-helix	trans	-60.9	-34.6	175.9	-77.1	77.4	0	0	0	112.8	Y125 L126 R127 Y131 L132 I133 S735 Y764 E767	Y125-H129 AromaticContact CD1-ND1 3.97Å; Y125-H129 AromaticContact CE1-CE1 3.63Å; Y125-H129 AromaticContact CE1-ND1 3.59Å; Y125-H129 AromaticContact CE2-CE1 3.51Å; Y125-H129 AromaticContact CZ-CE1 3.15Å; Y125-H129 AromaticContact CZ-ND1 3.62Å; Y125-H129 AromaticContact CZ-NE2 3.98Å; Y125-H129 PolarHBondContact O-N 2.94Å; Y125-H129 VanDerWaalsContact O-N 3.16Å; Y125-H129 PolarHBondContact O-ND1 3.05Å; Y125-H129 PolarHBondContact OH-CE1 3.42Å; Y125-H129 PolarHBondContact OH-NE2 2.95Å; L126-H129 PolarHBondContact O-N 3.48Å; R127-H129 VanDerWaalsContact C-N 3.34Å; R127-H129 PolarHBondContact O-N 3.45Å; H129-Y131 VanDerWaalsContact C-N 3.35Å; H129-Y131 PolarHBondContact O-N 3.05Å; H129-L132 WeakPolarHBondContact O-CB 3.16Å; H129-L132 PolarHBondContact O-N 3.41Å; H129-I133 WeakPolarHBondContact O-CG1 3.42Å; H129-I133 PolarHBondContact O-N 2.83Å; H129-S735 WeakPolarHBondContact NE2-CB 3.31Å; H129-S735 PolarHBondContact NE2-OG 3.19Å; H129-Y764 HydrophobicContact CB-CD2 4.15Å; H129-E767 IonicContact CD2-OE2 2.81Å; H129-E767 IonicContact CE1-OE2 2.66Å; H129-E767 IonicContact NE2-OE2 3.86Å
130	F	95.6	Very high	94.1	Very high	101 Å²	101	22 Å²	22	44%	0.443	11%	0.111	S	C	.	.	H	α-helix	trans	-65.1	-34.3	172.8	-168.1	-111.8	0	0	0	112.9	L126 R127 F128 I133 I134 Y764	L126-F130 PolarHBondContact O-N 3.05Å; R127-F130 WeakPolarHBondContact O-CB 3.26Å; R127-F130 PolarHBondContact O-N 3.1Å; R127-F130 VanDerWaalsContact O-N 3.11Å; F128-F130 VanDerWaalsContact C-N 3.27Å; F128-F130 PolarHBondContact O-N 2.68Å; F130-I133 PolarHBondContact O-N 3.44Å; F130-I134 HydrophobicContact CD1-CD1 3.71Å; F130-I134 HydrophobicContact CD1-CG1 4.39Å; F130-I134 HydrophobicContact CE1-CD1 3.64Å; F130-I134 HydrophobicContact CE1-CG1 4.22Å; F130-I134 HydrophobicContact CZ-CD1 4.41Å; F130-I134 WeakPolarHBondContact O-CG1 3.37Å; F130-I134 PolarHBondContact O-N 3.37Å; F130-Y764 HydrophobicContact CB-CE2 4.33Å
131	Y	96.6	Very high	94.8	Very high	17 Å²	17	24.9 Å²	24.9	7%	0.067	13%	0.129	C	C	.	.	H	α-helix	trans	-68.3	-33.3	170.9	-79.3	-97.6	0	0	0	112.5	R127 F128 H129 I133 I134 Y135 L196 M197 H199 F200 Q203	R127-Y131 HydrophobicContact CG-CD2 4.18Å; R127-Y131 HydrophobicContact CG-CE2 3.85Å; R127-Y131 WeakPolarHBondContact O-CD2 3.49Å; R127-Y131 PolarHBondContact O-N 2.93Å; R127-Y131 VanDerWaalsContact O-N 3.16Å; F128-Y131 WeakPolarHBondContact O-CB 3.22Å; F128-Y131 PolarHBondContact O-N 2.61Å; H129-Y131 VanDerWaalsContact C-N 3.35Å; H129-Y131 PolarHBondContact O-N 3.05Å; Y131-I133 VanDerWaalsContact C-N 3.35Å; Y131-I134 PolarHBondContact O-N 3.15Å; Y131-Y135 WeakPolarHBondContact O-CB 3.36Å; Y131-Y135 PolarHBondContact O-N 2.98Å; Y131-L196 HydrophobicContact CD1-CB 4.27Å; Y131-L196 HydrophobicContact CD1-CD2 4.38Å; Y131-M197 HydrophobicContact CD1-CE 4.33Å; Y131-M197 HydrophobicContact CG-CE 4.23Å; Y131-H199 HydrophobicContact CE1-CB 4.49Å; Y131-H199 AromaticContact CE1-ND1 3.88Å; Y131-H199 AromaticContact CZ-ND1 3.78Å; Y131-H199 PolarHBondContact OH-CE1 3.44Å; Y131-H199 PolarHBondContact OH-ND1 3.47Å; Y131-F200 HydrophobicContact CD1-CB 4.15Å; Y131-F200 HydrophobicContact CD2-CB 4.14Å; Y131-F200 AromaticContact CD2-CD2 3.73Å; Y131-F200 HydrophobicContact CD2-CD2 3.73Å; Y131-F200 HydrophobicContact CD2-CG 4.25Å; Y131-F200 HydrophobicContact CE1-CB 3.93Å; Y131-F200 HydrophobicContact CE2-CB 3.96Å; Y131-F200 AromaticContact CE2-CD2 3.6Å; Y131-F200 HydrophobicContact CE2-CD2 3.6Å; Y131-F200 HydrophobicContact CE2-CG 4.22Å; Y131-F200 HydrophobicContact CG-CB 4.25Å; Y131-Q203 PolarHBondContact OH-OE1 3.43Å
132	L	97.3	Very high	95.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.4	-40.9	171.4	-58	-177.9	0	0	0	111.3	F128 H129 T136 L736 F739 L760 M792	F128-L132 HydrophobicContact CD1-CD1 4.23Å; F128-L132 HydrophobicContact CD1-CG 4.25Å; F128-L132 HydrophobicContact CE1-CD1 3.89Å; F128-L132 HydrophobicContact CE1-CD2 3.96Å; F128-L132 HydrophobicContact CE1-CG 4Å; F128-L132 HydrophobicContact CZ-CD2 4.18Å; F128-L132 PolarHBondContact O-N 2.78Å; F128-L132 VanDerWaalsContact O-N 3.13Å; H129-L132 WeakPolarHBondContact O-CB 3.16Å; H129-L132 PolarHBondContact O-N 3.41Å; L132-T136 VanDerWaalsContact O-CB 3.3Å; L132-T136 WeakPolarHBondContact O-CB 3.23Å; L132-T136 PolarHBondContact O-N 2.86Å; L132-T136 PolarHBondContact O-OG1 3.39Å; L132-L736 HydrophobicContact CD2-CD2 4.5Å; L132-F739 HydrophobicContact CB-CD2 4.23Å; L132-F739 HydrophobicContact CB-CE2 4.26Å; L132-F739 HydrophobicContact CD1-CD2 4.48Å; L132-F739 HydrophobicContact CD2-CD1 4.4Å; L132-F739 HydrophobicContact CD2-CD2 3.96Å; L132-F739 HydrophobicContact CD2-CE1 4.31Å; L132-F739 HydrophobicContact CD2-CE2 3.84Å; L132-F739 HydrophobicContact CD2-CG 4.24Å; L132-F739 HydrophobicContact CD2-CZ 4.03Å; L132-F739 HydrophobicContact CG-CD2 4.45Å; L132-L760 HydrophobicContact CB-CD1 4.26Å; L132-L760 HydrophobicContact CB-CD2 4.33Å; L132-L760 HydrophobicContact CD1-CD2 4.35Å; L132-M792 HydrophobicContact CD2-CE 4.27Å; L132-M792 HydrophobicContact CD2-CG 3.82Å; L132-M792 HydrophobicContact CD2-SD 3.59Å; L132-M792 VanDerWaalsContact CD2-SD 3.59Å
133	I	97.7	Very high	95.7	Very high	22 Å²	22	27.9 Å²	27.9	11%	0.113	14%	0.141	C	C	.	.	H	α-helix	trans	-63.8	-48.2	174.9	-66.2	167.5	0	0	0	110.7	H129 F130 Y131 Y135 T136 A137 L757 L760 I761 Y764	H129-I133 WeakPolarHBondContact O-CG1 3.42Å; H129-I133 PolarHBondContact O-N 2.83Å; F130-I133 PolarHBondContact O-N 3.44Å; Y131-I133 VanDerWaalsContact C-N 3.35Å; I133-Y135 PolarHBondContact O-N 3.4Å; I133-T136 PolarHBondContact O-N 3.22Å; I133-A137 VanDerWaalsContact O-CB 3.27Å; I133-A137 WeakPolarHBondContact O-CB 3.08Å; I133-A137 PolarHBondContact O-N 2.94Å; I133-L757 HydrophobicContact CG2-CD1 4.14Å; I133-L760 HydrophobicContact CG1-CB 3.82Å; I133-I761 HydrophobicContact CD1-CG1 4.31Å; I133-I761 HydrophobicContact CG1-CG1 4.41Å; I133-I761 HydrophobicContact CG2-CG1 4.07Å; I133-Y764 HydrophobicContact CD1-CD1 4.42Å; I133-Y764 HydrophobicContact CD1-CD2 4.49Å; I133-Y764 HydrophobicContact CD1-CG 3.97Å
134	I	97.6	Very high	96	Very high	53 Å²	53	30.1 Å²	30.1	27%	0.272	15%	0.152	S	C	.	.	H	α-helix	trans	-56.7	-51.2	177.8	-70.3	163.9	0	0	0	110.8	F130 Y131 T136 A137 I138 L196	F130-I134 HydrophobicContact CD1-CD1 3.71Å; F130-I134 HydrophobicContact CD1-CG1 4.39Å; F130-I134 HydrophobicContact CE1-CD1 3.64Å; F130-I134 HydrophobicContact CE1-CG1 4.22Å; F130-I134 HydrophobicContact CZ-CD1 4.41Å; F130-I134 WeakPolarHBondContact O-CG1 3.37Å; F130-I134 PolarHBondContact O-N 3.37Å; Y131-I134 PolarHBondContact O-N 3.15Å; I134-T136 PolarHBondContact O-N 3.42Å; I134-A137 PolarHBondContact O-N 2.94Å; I134-I138 HydrophobicContact CG2-CD1 3.82Å; I134-I138 VanDerWaalsContact O-CG1 3.3Å; I134-I138 WeakPolarHBondContact O-CG1 3.32Å; I134-I138 PolarHBondContact O-N 3.48Å; I134-I138 VanDerWaalsContact O-N 3.13Å; I134-L196 HydrophobicContact CG2-CD1 4.2Å; I134-L196 HydrophobicContact CG2-CD2 4.1Å
135	Y	98.1	Very high	96.3	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-56.5	-52.3	177.9	172.8	-92.7	0	0	0	110.9	Y131 I133 A137 I138 T139 F189 L192 A193 L196 F739 M792 V796	Y131-Y135 WeakPolarHBondContact O-CB 3.36Å; Y131-Y135 PolarHBondContact O-N 2.98Å; I133-Y135 PolarHBondContact O-N 3.4Å; Y135-A137 VanDerWaalsContact C-N 3.34Å; Y135-A137 PolarHBondContact O-N 2.93Å; Y135-I138 PolarHBondContact O-N 3.43Å; Y135-T139 HydrophobicContact CD1-CG2 4.3Å; Y135-T139 HydrophobicContact CD2-CG2 4.39Å; Y135-T139 HydrophobicContact CE1-CG2 3.83Å; Y135-T139 HydrophobicContact CE2-CG2 3.9Å; Y135-T139 PolarHBondContact O-N 3.22Å; Y135-T139 PolarHBondContact O-OG1 2.94Å; Y135-F189 WeakPolarHBondContact CE2-O 3.26Å; Y135-L192 HydrophobicContact CD2-CD2 4.03Å; Y135-L192 HydrophobicContact CD2-CG 4.08Å; Y135-L192 HydrophobicContact CE2-CD2 4.2Å; Y135-L192 HydrophobicContact CE2-CG 4.35Å; Y135-A193 HydrophobicContact CD2-CB 4.08Å; Y135-A193 HydrophobicContact CE2-CB 3.67Å; Y135-L196 HydrophobicContact CD2-CD1 4.2Å; Y135-F739 AromaticContact CD1-CE2 3.64Å; Y135-F739 HydrophobicContact CD1-CE2 3.64Å; Y135-F739 AromaticContact CD1-CZ 3.55Å; Y135-F739 HydrophobicContact CD1-CZ 3.55Å; Y135-F739 HydrophobicContact CE1-CE2 4.08Å; Y135-F739 AromaticContact CE1-CZ 3.7Å; Y135-F739 HydrophobicContact CE1-CZ 3.7Å; Y135-F739 HydrophobicContact CG-CZ 4.39Å; Y135-M792 HydrophobicContact CD1-CE 4.43Å; Y135-M792 HydrophobicContact CD2-CE 4.22Å; Y135-M792 HydrophobicContact CG-CE 4.01Å; Y135-V796 HydrophobicContact CE1-CG2 4.29Å; Y135-V796 HydrophobicContact CE2-CG2 4.46Å; Y135-V796 WeakPolarHBondContact OH-CG1 3.18Å; Y135-V796 WeakPolarHBondContact OH-CG2 3.33Å
136	T	97.5	Very high	96.4	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-66.7	-35.1	-174.8	-51.4	0	0	0	0	111.9	L132 I133 I134 T139 T140 I742 L757 L760	L132-T136 VanDerWaalsContact O-CB 3.3Å; L132-T136 WeakPolarHBondContact O-CB 3.23Å; L132-T136 PolarHBondContact O-N 2.86Å; L132-T136 PolarHBondContact O-OG1 3.39Å; I133-T136 PolarHBondContact O-N 3.22Å; I134-T136 PolarHBondContact O-N 3.42Å; T136-T139 WeakPolarHBondContact CA-OG1 3.47Å; T136-T139 PolarHBondContact O-OG1 3.19Å; T136-T139 VanDerWaalsContact O-OG1 3.09Å; T136-T140 VanDerWaalsContact O-CB 3.24Å; T136-T140 WeakPolarHBondContact O-CB 3.43Å; T136-T140 PolarHBondContact O-N 3.03Å; T136-T140 PolarHBondContact O-OG1 2.85Å; T136-I742 HydrophobicContact CG2-CG2 4.18Å; T136-L757 HydrophobicContact CG2-CB 4.2Å; T136-L757 HydrophobicContact CG2-CD1 4.5Å; T136-L760 HydrophobicContact CG2-CD1 3.98Å; T136-L760 WeakPolarHBondContact OG1-CD1 3.39Å
137	A	98	Very high	96.5	Very high	35 Å²	35	36.4 Å²	36.4	29%	0.289	19%	0.191	S	C	.	.	H	α-helix	trans	-63.3	-46.3	174.7	0	0	0	0	0	111.4	I133 I134 Y135 T140 V141 L757	I133-A137 VanDerWaalsContact O-CB 3.27Å; I133-A137 WeakPolarHBondContact O-CB 3.08Å; I133-A137 PolarHBondContact O-N 2.94Å; I134-A137 PolarHBondContact O-N 2.94Å; Y135-A137 VanDerWaalsContact C-N 3.34Å; Y135-A137 PolarHBondContact O-N 2.93Å; A137-T140 PolarHBondContact O-N 2.94Å; A137-V141 PolarHBondContact O-N 3.4Å; A137-V141 VanDerWaalsContact O-N 3.15Å; A137-L757 HydrophobicContact CB-CD1 3.96Å; A137-L757 HydrophobicContact CB-CD2 4.25Å
138	I	97.8	Very high	96.5	Very high	60 Å²	60	34.3 Å²	34.3	31%	0.308	19%	0.185	S	C	.	.	H	α-helix	trans	-63.5	-46.6	177.6	-64	165.2	0	0	0	110.6	I134 Y135 T140 V141 F142 L192	I134-I138 HydrophobicContact CG2-CD1 3.82Å; I134-I138 VanDerWaalsContact O-CG1 3.3Å; I134-I138 WeakPolarHBondContact O-CG1 3.32Å; I134-I138 PolarHBondContact O-N 3.48Å; I134-I138 VanDerWaalsContact O-N 3.13Å; Y135-I138 PolarHBondContact O-N 3.43Å; I138-T140 VanDerWaalsContact C-N 3.33Å; I138-T140 PolarHBondContact O-N 2.83Å; I138-V141 PolarHBondContact O-N 3.05Å; I138-F142 HydrophobicContact CG2-CD2 4.04Å; I138-F142 HydrophobicContact CG2-CE2 3.71Å; I138-F142 VanDerWaalsContact O-CD2 3.26Å; I138-F142 WeakPolarHBondContact O-CD2 3.36Å; I138-F142 PolarHBondContact O-N 3.49Å; I138-L192 HydrophobicContact CB-CD2 4Å; I138-L192 HydrophobicContact CD1-CD1 4.25Å; I138-L192 HydrophobicContact CG2-CD2 3.54Å
139	T	96.7	Very high	96.4	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-36.9	177.3	58.6	0	0	0	0	112	Y135 T136 V141 F142 C143 F189 L192	Y135-T139 HydrophobicContact CD1-CG2 4.3Å; Y135-T139 HydrophobicContact CD2-CG2 4.39Å; Y135-T139 HydrophobicContact CE1-CG2 3.83Å; Y135-T139 HydrophobicContact CE2-CG2 3.9Å; Y135-T139 PolarHBondContact O-N 3.22Å; Y135-T139 PolarHBondContact O-OG1 2.94Å; T136-T139 WeakPolarHBondContact CA-OG1 3.47Å; T136-T139 PolarHBondContact O-OG1 3.19Å; T136-T139 VanDerWaalsContact O-OG1 3.09Å; T139-V141 VanDerWaalsContact C-N 3.32Å; T139-V141 PolarHBondContact O-N 3.01Å; T139-F142 PolarHBondContact O-N 2.71Å; T139-C143 VanDerWaalsContact O-CB 3.26Å; T139-C143 WeakPolarHBondContact O-CB 3.3Å; T139-C143 PolarHBondContact O-N 2.91Å; T139-C143 PolarHBondContact O-SG 3.02Å; T139-F189 HydrophobicContact CG2-CD1 3.85Å; T139-F189 HydrophobicContact CG2-CD2 3.74Å; T139-F189 HydrophobicContact CG2-CE1 3.88Å; T139-F189 HydrophobicContact CG2-CE2 3.79Å; T139-F189 HydrophobicContact CG2-CG 3.78Å; T139-F189 HydrophobicContact CG2-CZ 3.85Å; T139-L192 HydrophobicContact CG2-CD2 4.31Å
140	T	97.3	Very high	96.3	Very high	10 Å²	10	38.1 Å²	38.1	6%	0.061	21%	0.209	C	C	.	.	H	α-helix	trans	-58.9	-42.7	176.7	-60.6	0	0	0	0	111.4	T136 A137 I138 C143 L144 T753 P754	T136-T140 VanDerWaalsContact O-CB 3.24Å; T136-T140 WeakPolarHBondContact O-CB 3.43Å; T136-T140 PolarHBondContact O-N 3.03Å; T136-T140 PolarHBondContact O-OG1 2.85Å; A137-T140 PolarHBondContact O-N 2.94Å; I138-T140 VanDerWaalsContact C-N 3.33Å; I138-T140 PolarHBondContact O-N 2.83Å; T140-C143 PolarHBondContact O-N 3.46Å; T140-L144 HydrophobicContact CG2-CD1 3.74Å; T140-L144 HydrophobicContact CG2-CG 4.22Å; T140-L144 WeakPolarHBondContact O-CB 3.5Å; T140-L144 WeakPolarHBondContact O-CG 3.41Å; T140-L144 PolarHBondContact O-N 3.07Å; T140-T753 WeakPolarHBondContact OG1-CB 3.48Å; T140-T753 PolarHBondContact OG1-O 3.33Å; T140-P754 HydrophobicContact CG2-CB 4.31Å
141	V	97.4	Very high	96	Very high	87 Å²	87	33.3 Å²	33.3	53%	0.527	19%	0.188	S	C	.	.	H	α-helix	trans	-59.9	-50.6	176.1	173.6	0	0	0	0	110.8	A137 I138 T139 C143 L144 V145	A137-V141 PolarHBondContact O-N 3.4Å; A137-V141 VanDerWaalsContact O-N 3.15Å; I138-V141 PolarHBondContact O-N 3.05Å; T139-V141 VanDerWaalsContact C-N 3.32Å; T139-V141 PolarHBondContact O-N 3.01Å; V141-C143 PolarHBondContact O-N 3.37Å; V141-L144 PolarHBondContact O-N 3.23Å; V141-V145 HydrophobicContact CG1-CG2 4.2Å; V141-V145 VanDerWaalsContact O-CB 3.23Å; V141-V145 WeakPolarHBondContact O-CB 3.49Å; V141-V145 VanDerWaalsContact O-CG2 3.25Å; V141-V145 WeakPolarHBondContact O-CG2 3.22Å; V141-V145 PolarHBondContact O-N 2.85Å
142	F	96.8	Very high	95.6	Very high	84 Å²	84	36 Å²	36	37%	0.368	20%	0.203	S	C	.	.	H	α-helix	trans	-66.2	-37.7	178.9	-69.5	-63.2	0	0	0	113.4	I138 T139 V146 I147 F185 F189	I138-F142 HydrophobicContact CG2-CD2 4.04Å; I138-F142 HydrophobicContact CG2-CE2 3.71Å; I138-F142 VanDerWaalsContact O-CD2 3.26Å; I138-F142 WeakPolarHBondContact O-CD2 3.36Å; I138-F142 PolarHBondContact O-N 3.49Å; T139-F142 PolarHBondContact O-N 2.71Å; F142-V146 WeakPolarHBondContact O-CB 3.45Å; F142-V146 PolarHBondContact O-N 2.89Å; F142-I147 PolarHBondContact O-N 3.18Å; F142-F185 HydrophobicContact CB-CD1 4.17Å; F142-F185 HydrophobicContact CB-CE1 3.74Å; F142-F185 AromaticContact CD1-CE1 3.6Å; F142-F185 HydrophobicContact CD1-CE1 3.6Å; F142-F185 HydrophobicContact CD1-CZ 4.06Å; F142-F185 HydrophobicContact CD2-CE1 4.46Å; F142-F185 HydrophobicContact CE1-CE1 4.3Å; F142-F185 HydrophobicContact CG-CD1 4.42Å; F142-F185 AromaticContact CG-CE1 3.69Å; F142-F185 HydrophobicContact CG-CE1 3.69Å; F142-F189 HydrophobicContact CB-CE1 3.96Å; F142-F189 HydrophobicContact CB-CZ 4.02Å; F142-F189 HydrophobicContact CD2-CE1 4.19Å; F142-F189 HydrophobicContact CG-CE1 4.42Å
143	C	96.2	Very high	95.1	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.235	C	C	.	.	I	π-helix	trans	-62.9	-42.3	176.2	-75.4	0	0	0	0	112	T139 T140 V141 I147 L148 S746 P750 T753	T139-C143 VanDerWaalsContact O-CB 3.26Å; T139-C143 WeakPolarHBondContact O-CB 3.3Å; T139-C143 PolarHBondContact O-N 2.91Å; T139-C143 PolarHBondContact O-SG 3.02Å; T140-C143 PolarHBondContact O-N 3.46Å; V141-C143 PolarHBondContact O-N 3.37Å; C143-I147 PolarHBondContact O-N 3.4Å; C143-L148 VanDerWaalsContact O-CB 3.27Å; C143-L148 WeakPolarHBondContact O-CB 3.04Å; C143-L148 PolarHBondContact O-N 3.33Å; C143-S746 PolarHBondContact SG-O 3.34Å; C143-P750 HydrophobicContact CB-CB 4.07Å; C143-P750 WeakPolarHBondContact O-CB 3.3Å; C143-T753 HydrophobicContact CB-CG2 3.98Å
144	L	95.5	Very high	94.3	Very high	63 Å²	63	42.2 Å²	42.2	33%	0.33	23%	0.233	S	C	.	.	I	π-helix	trans	-82.4	-34	-179.6	-63.9	179.3	0	0	0	113.7	T140 V141 L148 P149 P754	T140-L144 HydrophobicContact CG2-CD1 3.74Å; T140-L144 HydrophobicContact CG2-CG 4.22Å; T140-L144 WeakPolarHBondContact O-CB 3.5Å; T140-L144 WeakPolarHBondContact O-CG 3.41Å; T140-L144 PolarHBondContact O-N 3.07Å; V141-L144 PolarHBondContact O-N 3.23Å; L144-L148 HydrophobicContact CD2-CD2 3.82Å; L144-P149 WeakPolarHBondContact O-CD 3.28Å; L144-P754 HydrophobicContact CD1-CB 4.46Å; L144-P754 HydrophobicContact CD1-CG 4.37Å; L144-P754 HydrophobicContact CD2-CG 4.41Å
145	V	96.1	Very high	93.1	Very high	101 Å²	101	44.5 Å²	44.5	61%	0.612	25%	0.25	S	C	*	.	I	π-helix	trans	-86.2	-29	-176.9	176.5	0	0	0	0	112.8	V141	V141-V145 HydrophobicContact CG1-CG2 4.2Å; V141-V145 VanDerWaalsContact O-CB 3.23Å; V141-V145 WeakPolarHBondContact O-CB 3.49Å; V141-V145 VanDerWaalsContact O-CG2 3.25Å; V141-V145 WeakPolarHBondContact O-CG2 3.22Å; V141-V145 PolarHBondContact O-N 2.85Å
146	V	95.4	Very high	91.8	Very high	48 Å²	48	48 Å²	48	29%	0.291	27%	0.268	S	S	.	.	I	π-helix	trans	-119.7	-58.4	-175.1	-170.5	0	0	0	0	112.4	F142 P149 V150 V181 F185	F142-V146 WeakPolarHBondContact O-CB 3.45Å; F142-V146 PolarHBondContact O-N 2.89Å; V146-P149 WeakPolarHBondContact O-CD 3.31Å; V146-V150 VanDerWaalsContact O-CG2 3.26Å; V146-V150 WeakPolarHBondContact O-CG2 3.45Å; V146-V150 PolarHBondContact O-N 3.04Å; V146-V181 HydrophobicContact CG1-CG1 4.05Å; V146-F185 HydrophobicContact CB-CE2 4.32Å; V146-F185 HydrophobicContact CB-CZ 4.29Å; V146-F185 HydrophobicContact CG1-CE2 3.81Å; V146-F185 HydrophobicContact CG1-CZ 4.19Å; V146-F185 HydrophobicContact CG2-CZ 4.25Å
147	I	94.7	Very high	90	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.295	C	S	.	.	I	π-helix	trans	-66.8	-44.8	-171.8	-48.3	-58.2	0	0	0	111.6	F142 C143 V150 N151 V181 F185 I747 P750	F142-I147 PolarHBondContact O-N 3.18Å; C143-I147 PolarHBondContact O-N 3.4Å; I147-V150 PolarHBondContact O-N 2.93Å; I147-N151 PolarHBondContact O-N 3.35Å; I147-V181 HydrophobicContact CD1-CG1 3.83Å; I147-F185 HydrophobicContact CD1-CB 4.02Å; I147-F185 HydrophobicContact CD1-CD2 3.63Å; I147-F185 HydrophobicContact CD1-CE2 4.28Å; I147-F185 HydrophobicContact CD1-CG 3.85Å; I147-I747 HydrophobicContact CG2-CG2 4.43Å; I147-P750 HydrophobicContact CB-CG 3.9Å; I147-P750 HydrophobicContact CG2-CG 3.6Å
148	L	93	Very high	88	Confident	32 Å²	32	54.8 Å²	54.8	17%	0.168	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-47.7	-178.4	177.6	62.5	0	0	0	112.8	C143 L144 V150 N151 I152 T167 P750	C143-L148 VanDerWaalsContact O-CB 3.27Å; C143-L148 WeakPolarHBondContact O-CB 3.04Å; C143-L148 PolarHBondContact O-N 3.33Å; L144-L148 HydrophobicContact CD2-CD2 3.82Å; L148-V150 VanDerWaalsContact C-N 3.35Å; L148-V150 PolarHBondContact O-N 3Å; L148-N151 PolarHBondContact O-N 2.72Å; L148-I152 HydrophobicContact CD1-CD1 3.82Å; L148-I152 HydrophobicContact CD1-CG1 4.3Å; L148-I152 HydrophobicContact CG-CD1 3.94Å; L148-I152 WeakPolarHBondContact O-CG1 3.49Å; L148-I152 PolarHBondContact O-N 3.36Å; L148-I152 VanDerWaalsContact O-N 3.08Å; L148-T167 HydrophobicContact CD1-CG2 4.16Å; L148-P750 HydrophobicContact CB-CB 3.9Å; L148-P750 HydrophobicContact CB-CG 4.21Å; L148-P750 HydrophobicContact CD1-CB 4.5Å
149	P	93.9	Very high	85.9	Confident	48 Å²	48	57.9 Å²	57.9	31%	0.312	32%	0.32	S	S	.	.	H	α-helix	trans	-56.7	-43.2	169.6	-30.1	37.2	0	0	0	113.7	L144 V146 N151 I152 H153	L144-P149 WeakPolarHBondContact O-CD 3.28Å; V146-P149 WeakPolarHBondContact O-CD 3.31Å; P149-N151 VanDerWaalsContact C-N 3.34Å; P149-N151 PolarHBondContact O-N 3.37Å; P149-I152 PolarHBondContact O-N 3.2Å; P149-H153 PolarHBondContact O-N 3.13Å; P149-H153 PolarHBondContact O-ND1 3.01Å
150	V	92.7	Very high	83.8	Confident	33 Å²	33	61.8 Å²	61.8	20%	0.2	34%	0.341	C	S	.	.	H	α-helix	trans	-63.3	-39.1	179.6	173.2	0	0	0	0	111.6	V146 I147 L148 G154 I172 H182	V146-V150 VanDerWaalsContact O-CG2 3.26Å; V146-V150 WeakPolarHBondContact O-CG2 3.45Å; V146-V150 PolarHBondContact O-N 3.04Å; I147-V150 PolarHBondContact O-N 2.93Å; L148-V150 VanDerWaalsContact C-N 3.35Å; L148-V150 PolarHBondContact O-N 3Å; V150-G154 PolarHBondContact O-N 3.37Å; V150-I172 HydrophobicContact CG1-CD1 4.08Å; V150-H182 WeakPolarHBondContact CG1-NE2 3.34Å
151	N	89.2	Confident	81.8	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-46	173.1	-72.8	-10.9	0	0	0	112.3	I147 L148 P149 H153 G154 V166 T167 I169 N171 I172 P750	I147-N151 PolarHBondContact O-N 3.35Å; L148-N151 PolarHBondContact O-N 2.72Å; P149-N151 VanDerWaalsContact C-N 3.34Å; P149-N151 PolarHBondContact O-N 3.37Å; N151-H153 VanDerWaalsContact C-N 3.28Å; N151-H153 PolarHBondContact O-N 3.17Å; N151-G154 PolarHBondContact O-N 3.18Å; N151-V166 CarbonylContact C-O 3.52Å; N151-T167 WeakPolarHBondContact CB-O 2.99Å; N151-T167 PolarHBondContact ND2-O 3.08Å; N151-I169 PolarHBondContact ND2-N 3.09Å; N151-N171 PolarHBondContact O-ND2 3.11Å; N151-I172 WeakPolarHBondContact OD1-CD1 3.45Å; N151-P750 WeakPolarHBondContact ND2-CD 3.22Å
152	I	88	Confident	80	Confident	73 Å²	73	62.7 Å²	62.7	37%	0.374	34%	0.34	S	S	.	.	H	α-helix	trans	-66.4	-29.8	-177.6	-68.4	166.3	0	0	0	112.4	L148 P149 G154 K157 V166 T167	L148-I152 HydrophobicContact CD1-CD1 3.82Å; L148-I152 HydrophobicContact CD1-CG1 4.3Å; L148-I152 HydrophobicContact CG-CD1 3.94Å; L148-I152 WeakPolarHBondContact O-CG1 3.49Å; L148-I152 PolarHBondContact O-N 3.36Å; L148-I152 VanDerWaalsContact O-N 3.08Å; P149-I152 PolarHBondContact O-N 3.2Å; I152-G154 VanDerWaalsContact C-N 3.25Å; I152-G154 PolarHBondContact O-N 3.42Å; I152-K157 WeakPolarHBondContact O-CE 3.41Å; I152-K157 PolarHBondContact O-NZ 2.84Å; I152-V166 WeakPolarHBondContact CA-O 3.34Å; I152-T167 HydrophobicContact CD1-CG2 4.37Å; I152-T167 HydrophobicContact CG1-CG2 4.19Å
153	H	87.1	Confident	78.7	Confident	148 Å²	148	65.8 Å²	65.8	69%	0.685	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-1	173	-69.6	84.9	0	0	0	113.7	P149 N151	P149-H153 PolarHBondContact O-N 3.13Å; P149-H153 PolarHBondContact O-ND1 3.01Å; N151-H153 VanDerWaalsContact C-N 3.28Å; N151-H153 PolarHBondContact O-N 3.17Å
154	G	81.2	Confident	77.9	Confident	6 Å²	6	65.8 Å²	65.8	6%	0.062	35%	0.353	C	S	.	.			trans	-56.3	147.2	171.3	0	0	0	0	0	112.9	V150 N151 I152 K157 N171	V150-G154 PolarHBondContact O-N 3.37Å; N151-G154 PolarHBondContact O-N 3.18Å; I152-G154 VanDerWaalsContact C-N 3.25Å; I152-G154 PolarHBondContact O-N 3.42Å; G154-K157 WeakPolarHBondContact O-CE 3.17Å; G154-K157 WeakPolarHBondContact O-CG 3.38Å; G154-N171 CarbonylContact C-O 3.27Å; G154-N171 VanDerWaalsContact C-O 3.27Å; G154-N171 WeakPolarHBondContact CA-ND2 3.37Å; G154-N171 VanDerWaalsContact CA-O 3.3Å; G154-N171 WeakPolarHBondContact CA-O 3.43Å; G154-N171 PolarHBondContact O-ND2 3.12Å; G154-N171 VanDerWaalsContact O-ND2 3.16Å
155	T	72.8	Confident	76.9	Confident	101 Å²	101	63 Å²	63	62%	0.62	34%	0.339	S	S	*	.	S	Bend	trans	-92.2	-12.5	-170.2	50	0	0	0	0	114.6	K157 N171 S173	T155-K157 PolarHBondContact O-N 2.71Å; T155-N171 PolarHBondContact N-O 3.02Å; T155-N171 VanDerWaalsContact N-O 3.15Å; T155-S173 PolarHBondContact OG1-OG 3.02Å
156	L	69.7	Low	76.2	Confident	74 Å²	74	60 Å²	60	39%	0.387	32%	0.321	S	S	.	.			trans	-81.7	46.2	-178.5	-61.2	177	0	0	0	112.5	S158 S170 N171	L156-S158 PolarHBondContact O-N 3.14Å; L156-S170 WeakPolarHBondContact CD1-O 3.36Å; L156-N171 WeakPolarHBondContact CB-O 3.36Å; L156-N171 PolarHBondContact N-O 2.89Å; L156-N171 PolarHBondContact N-OD1 2.76Å; L156-N171 PolarHBondContact O-OD1 2.94Å
157	K	61.2	Low	75.8	Confident	135 Å²	135	58.2 Å²	58.2	59%	0.587	31%	0.31	S	S	*	.			trans	-76.2	54.5	-179	-58.9	-176.6	-177.7	-177.4	0	111.9	I152 G154 T155 N171	I152-K157 WeakPolarHBondContact O-CE 3.41Å; I152-K157 PolarHBondContact O-NZ 2.84Å; G154-K157 WeakPolarHBondContact O-CE 3.17Å; G154-K157 WeakPolarHBondContact O-CG 3.38Å; T155-K157 PolarHBondContact O-N 2.71Å; K157-N171 PolarHBondContact N-OD1 3.1Å
158	S	55.3	Low	75.4	Confident	44 Å²	44	58.4 Å²	58.4	31%	0.308	31%	0.312	S	S	.	.			trans	-65.1	154.4	174.1	66.7	0	0	0	0	110.7	L156 D160 L161	L156-S158 PolarHBondContact O-N 3.14Å; S158-D160 PolarHBondContact O-N 2.84Å; S158-L161 PolarHBondContact O-N 3.46Å; S158-L161 WeakPolarHBondContact OG-CD1 3.45Å; S158-L161 PolarHBondContact OG-N 2.7Å; S158-L161 VanDerWaalsContact OG-N 3.17Å
159	P	54.4	Low	74.9	Confident	126 Å²	126	57.1 Å²	57.1	82%	0.818	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.7	172	27.4	-34.7	0	0	0	112.6
160	D	51.8	Low	74.1	Confident	84 Å²	84	55.7 Å²	55.7	45%	0.449	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-22.6	-180	-43.2	-80.7	0	0	0	112.7	S158 Q162	S158-D160 PolarHBondContact O-N 2.84Å; D160-Q162 PolarHBondContact O-N 2.95Å
161	L	55.7	Low	73.6	Confident	38 Å²	38	54.1 Å²	54.1	20%	0.199	29%	0.286	C	S	.	.	S	Bend	trans	-69.6	88.5	162	-99.7	76.5	0	0	0	108.5	S158 V166 N171	S158-L161 PolarHBondContact O-N 3.46Å; S158-L161 WeakPolarHBondContact OG-CD1 3.45Å; S158-L161 PolarHBondContact OG-N 2.7Å; S158-L161 VanDerWaalsContact OG-N 3.17Å; L161-V166 HydrophobicContact CB-CG1 4.27Å; L161-V166 HydrophobicContact CD2-CG1 4.3Å; L161-N171 HydrophobicContact CD2-CB 3.81Å
162	Q	58.7	Low	73.3	Confident	79 Å²	79	54.1 Å²	54.1	37%	0.369	29%	0.286	S	S	.	.			trans	-43.8	152.1	168.2	-64.7	-158.6	64.9	0	0	110.8	E24 D160 F164 G165	E24-Q162 PolarHBondContact OE1-NE2 3.35Å; E24-Q162 PolarHBondContact OE1-OE1 2.76Å; D160-Q162 PolarHBondContact O-N 2.95Å; Q162-F164 CarbonylContact O-C 3.6Å; Q162-F164 PolarHBondContact O-N 2.98Å; Q162-G165 PolarHBondContact O-N 3.06Å
163	K	69.9	Low	72.8	Confident	149 Å²	149	52.1 Å²	52.1	65%	0.648	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	-20.9	-171.8	-65.5	178.5	179.2	171.4	0	115.9	Y23 V166	Y23-K163 HydrophobicContact CD2-CB 4.08Å; Y23-K163 VanDerWaalsContact CD2-O 3.27Å; Y23-K163 WeakPolarHBondContact CD2-O 3.38Å; Y23-K163 WeakPolarHBondContact CE2-O 3.4Å; K163-V166 WeakPolarHBondContact O-CG2 3.49Å
164	F	78.8	Confident	72.2	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-46	171.8	178.2	-99	0	0	0	114.4	Y23 E24 I26 Q162 V166 T167 T168 P671 A675 C749 L751	Y23-F164 HydrophobicContact CD1-CD2 4.13Å; Y23-F164 HydrophobicContact CD2-CB 4.23Å; Y23-F164 AromaticContact CE1-CD2 3.66Å; Y23-F164 HydrophobicContact CE1-CD2 3.66Å; Y23-F164 HydrophobicContact CE1-CE2 4.36Å; Y23-F164 HydrophobicContact CE2-CB 4.29Å; Y23-F164 HydrophobicContact CE2-CD2 4.35Å; Y23-F164 HydrophobicContact CG-CB 4.4Å; Y23-F164 AromaticContact CZ-CD2 3.76Å; E24-F164 HydrophobicContact CB-CB 4.48Å; E24-F164 HydrophobicContact CG-CB 3.66Å; E24-F164 HydrophobicContact CG-CD1 4.18Å; E24-F164 HydrophobicContact CG-CG 3.96Å; I26-F164 HydrophobicContact CD1-CD2 3.49Å; I26-F164 VanDerWaalsContact CD1-CD2 3.49Å; I26-F164 HydrophobicContact CD1-CE2 3.39Å; I26-F164 HydrophobicContact CD1-CG 4.48Å; I26-F164 HydrophobicContact CD1-CZ 4.33Å; Q162-F164 CarbonylContact O-C 3.6Å; Q162-F164 PolarHBondContact O-N 2.98Å; F164-V166 VanDerWaalsContact C-N 3.26Å; F164-V166 PolarHBondContact O-N 3.24Å; F164-V166 VanDerWaalsContact O-N 3.15Å; F164-T167 WeakPolarHBondContact O-CB 3.44Å; F164-T167 PolarHBondContact O-N 2.92Å; F164-T167 PolarHBondContact O-OG1 2.69Å; F164-T168 HydrophobicContact CD1-CG2 4.2Å; F164-T168 HydrophobicContact CE1-CG2 3.7Å; F164-T168 HydrophobicContact CZ-CG2 4.21Å; F164-P671 WeakPolarHBondContact CE1-O 3.46Å; F164-A675 HydrophobicContact CD1-CB 3.86Å; F164-A675 HydrophobicContact CD2-CB 4.42Å; F164-A675 HydrophobicContact CE1-CB 3.61Å; F164-A675 VanDerWaalsContact CE1-N 3.32Å; F164-A675 HydrophobicContact CE2-CB 4.19Å; F164-A675 HydrophobicContact CG-CB 4.25Å; F164-A675 VanDerWaalsContact CZ-CA 3.48Å; F164-A675 HydrophobicContact CZ-CB 3.76Å; F164-A675 VanDerWaalsContact CZ-N 3.34Å; F164-C749 WeakPolarHBondContact CZ-SG 3.32Å; F164-L751 HydrophobicContact CE2-CD2 4.21Å
165	G	75.1	Confident	72	Confident	3 Å²	3	52.9 Å²	52.9	3%	0.031	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-57.4	-33.9	-169.5	0	0	0	0	0	114.1	Q162 T167 T168	Q162-G165 PolarHBondContact O-N 3.06Å; G165-T167 PolarHBondContact O-N 3.07Å; G165-T168 PolarHBondContact O-N 3.42Å; G165-T168 PolarHBondContact O-OG1 2.87Å
166	V	81	Confident	72.5	Confident	39 Å²	39	49.6 Å²	49.6	24%	0.236	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-60.3	-15.6	175.4	-60	0	0	0	0	114.4	N151 I152 L161 K163 F164 N171	N151-V166 CarbonylContact C-O 3.52Å; I152-V166 WeakPolarHBondContact CA-O 3.34Å; L161-V166 HydrophobicContact CB-CG1 4.27Å; L161-V166 HydrophobicContact CD2-CG1 4.3Å; K163-V166 WeakPolarHBondContact O-CG2 3.49Å; F164-V166 VanDerWaalsContact C-N 3.26Å; F164-V166 PolarHBondContact O-N 3.24Å; F164-V166 VanDerWaalsContact O-N 3.15Å; V166-N171 PolarHBondContact O-ND2 2.91Å
167	T	86.8	Confident	73.2	Confident	11 Å²	11	50.7 Å²	50.7	7%	0.067	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-92.8	-2.6	175.4	68.3	0	0	0	0	113.8	Y23 L148 N151 I152 F164 G165	Y23-T167 HydrophobicContact CE2-CG2 4.27Å; Y23-T167 WeakPolarHBondContact OH-CG2 3.48Å; Y23-T167 PolarHBondContact OH-OG1 3.47Å; L148-T167 HydrophobicContact CD1-CG2 4.16Å; N151-T167 WeakPolarHBondContact CB-O 2.99Å; N151-T167 PolarHBondContact ND2-O 3.08Å; I152-T167 HydrophobicContact CD1-CG2 4.37Å; I152-T167 HydrophobicContact CG1-CG2 4.19Å; F164-T167 WeakPolarHBondContact O-CB 3.44Å; F164-T167 PolarHBondContact O-N 2.92Å; F164-T167 PolarHBondContact O-OG1 2.69Å; G165-T167 PolarHBondContact O-N 3.07Å
168	T	86	Confident	74.4	Confident	4 Å²	4	46.1 Å²	46.1	3%	0.025	27%	0.27	C	S	.	.	S	Bend	trans	-106.7	163.7	-178.5	75.2	0	0	0	0	111.7	F164 G165 S170 N171 V748 C749	F164-T168 HydrophobicContact CD1-CG2 4.2Å; F164-T168 HydrophobicContact CE1-CG2 3.7Å; F164-T168 HydrophobicContact CZ-CG2 4.21Å; G165-T168 PolarHBondContact O-N 3.42Å; G165-T168 PolarHBondContact O-OG1 2.87Å; T168-S170 PolarHBondContact O-N 3.48Å; T168-S170 VanDerWaalsContact O-N 3.07Å; T168-S170 PolarHBondContact OG1-OG 2.95Å; T168-N171 PolarHBondContact O-N 3.32Å; T168-V748 VanDerWaalsContact CA-O 3.26Å; T168-V748 WeakPolarHBondContact CA-O 3.43Å; T168-V748 VanDerWaalsContact CB-O 3.31Å; T168-V748 WeakPolarHBondContact CB-O 3.43Å; T168-C749 HydrophobicContact CG2-CB 4.18Å
169	I	84	Confident	76	Confident	5 Å²	5	44.3 Å²	44.3	3%	0.026	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-59.5	-18.1	178.6	-164.2	175.2	0	0	0	113.5	N151 N171 I172 L179 H182 V748 F806	N151-I169 PolarHBondContact ND2-N 3.09Å; I169-N171 PolarHBondContact O-N 2.95Å; I169-I172 PolarHBondContact O-N 3Å; I169-L179 HydrophobicContact CD1-CD2 4.34Å; I169-L179 HydrophobicContact CG1-CD2 4.24Å; I169-H182 HydrophobicContact CD1-CB 4.12Å; I169-H182 VanDerWaalsContact CD1-CD2 3.48Å; I169-H182 WeakPolarHBondContact CD1-CD2 3.27Å; I169-V748 HydrophobicContact CG2-CB 4.25Å; I169-V748 HydrophobicContact CG2-CG1 3.84Å; I169-V748 HydrophobicContact CG2-CG2 4.48Å; I169-V748 PolarHBondContact N-O 3.21Å; I169-F806 HydrophobicContact CB-CZ 4.4Å; I169-F806 HydrophobicContact CD1-CD1 3.86Å; I169-F806 HydrophobicContact CD1-CE1 3.67Å; I169-F806 HydrophobicContact CD1-CZ 4.34Å; I169-F806 HydrophobicContact CG1-CD1 4.42Å; I169-F806 HydrophobicContact CG1-CE1 3.74Å; I169-F806 HydrophobicContact CG1-CZ 4.02Å; I169-F806 HydrophobicContact CG2-CD2 4.43Å; I169-F806 HydrophobicContact CG2-CE1 4.17Å; I169-F806 HydrophobicContact CG2-CE2 3.94Å; I169-F806 HydrophobicContact CG2-CZ 3.78Å
170	S	77.6	Confident	77.8	Confident	17 Å²	17	42.9 Å²	42.9	12%	0.119	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-63.5	-28.7	179.8	70.4	0	0	0	0	113.3	L156 T168 I172	L156-S170 WeakPolarHBondContact CD1-O 3.36Å; T168-S170 PolarHBondContact O-N 3.48Å; T168-S170 VanDerWaalsContact O-N 3.07Å; T168-S170 PolarHBondContact OG1-OG 2.95Å; S170-I172 PolarHBondContact O-N 3.46Å
171	N	81.3	Confident	79.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-69	-12	178.4	-171.4	39.2	0	0	0	113.7	N151 G154 T155 L156 K157 L161 V166 T168 I169	N151-N171 PolarHBondContact O-ND2 3.11Å; G154-N171 CarbonylContact C-O 3.27Å; G154-N171 VanDerWaalsContact C-O 3.27Å; G154-N171 WeakPolarHBondContact CA-ND2 3.37Å; G154-N171 VanDerWaalsContact CA-O 3.3Å; G154-N171 WeakPolarHBondContact CA-O 3.43Å; G154-N171 PolarHBondContact O-ND2 3.12Å; G154-N171 VanDerWaalsContact O-ND2 3.16Å; T155-N171 PolarHBondContact N-O 3.02Å; T155-N171 VanDerWaalsContact N-O 3.15Å; L156-N171 WeakPolarHBondContact CB-O 3.36Å; L156-N171 PolarHBondContact N-O 2.89Å; L156-N171 PolarHBondContact N-OD1 2.76Å; L156-N171 PolarHBondContact O-OD1 2.94Å; K157-N171 PolarHBondContact N-OD1 3.1Å; L161-N171 HydrophobicContact CD2-CB 3.81Å; V166-N171 PolarHBondContact O-ND2 2.91Å; T168-N171 PolarHBondContact O-N 3.32Å; I169-N171 PolarHBondContact O-N 2.95Å
172	I	82.2	Confident	81.6	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	-89.9	126.3	179.8	-58.5	178.1	0	0	0	109.3	V150 N151 I169 S170 L179 H182 R810	V150-I172 HydrophobicContact CG1-CD1 4.08Å; N151-I172 WeakPolarHBondContact OD1-CD1 3.45Å; I169-I172 PolarHBondContact O-N 3Å; S170-I172 PolarHBondContact O-N 3.46Å; I172-L179 HydrophobicContact CB-CD2 4.22Å; I172-L179 HydrophobicContact CG2-CD2 3.75Å; I172-L179 HydrophobicContact CG2-CG 3.89Å; I172-H182 WeakPolarHBondContact CD1-NE2 3.35Å; I172-R810 PolarHBondContact O-NH1 3.46Å
173	S	78.1	Confident	83.2	Confident	32 Å²	32	35.2 Å²	35.2	22%	0.224	20%	0.198	C	C	.	.			trans	-69.5	147.1	175.5	67.2	0	0	0	0	111.6	T155 N175 S176	T155-S173 PolarHBondContact OG1-OG 3.02Å; S173-N175 VanDerWaalsContact C-N 3.27Å; S173-N175 PolarHBondContact O-N 3.25Å; S173-S176 WeakPolarHBondContact O-CB 3.28Å; S173-S176 PolarHBondContact O-N 2.9Å
174	A	75.6	Confident	84.4	Confident	19 Å²	19	32.9 Å²	32.9	16%	0.157	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-30.7	-174	0	0	0	0	0	114.1	S176 R810 T813 V814	A174-S176 PolarHBondContact O-N 3.28Å; A174-R810 HydrophobicContact CB-CB 4.3Å; A174-T813 CarbonylContact C-O 3.58Å; A174-T813 WeakPolarHBondContact CB-OG1 3.32Å; A174-V814 HydrophobicContact CB-CG2 3.89Å
175	N	75.1	Confident	85.2	Confident	150 Å²	150	35 Å²	35	80%	0.802	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	5	175.4	-163.2	27.9	0	0	0	113.4	S173	S173-N175 VanDerWaalsContact C-N 3.27Å; S173-N175 PolarHBondContact O-N 3.25Å
176	S	83.6	Confident	86.1	Confident	33 Å²	33	34.9 Å²	34.9	23%	0.231	20%	0.2	C	C	.	.			trans	-83.6	130	-179.4	-172.2	0	0	0	0	112.1	S173 A174 S178 L179	S173-S176 WeakPolarHBondContact O-CB 3.28Å; S173-S176 PolarHBondContact O-N 2.9Å; A174-S176 PolarHBondContact O-N 3.28Å; S176-S178 PolarHBondContact O-N 3.42Å; S176-S178 VanDerWaalsContact O-N 3.11Å; S176-S178 WeakPolarHBondContact OG-CB 3.46Å; S176-S178 PolarHBondContact OG-N 3.22Å; S176-S178 PolarHBondContact OG-OG 2.99Å; S176-L179 PolarHBondContact O-N 2.76Å
177	S	85.8	Confident	86.8	Confident	97 Å²	97	35 Å²	35	68%	0.678	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.1	172.2	52.3	0	0	0	0	113.5	L179 W180	S177-L179 PolarHBondContact O-N 3.27Å; S177-W180 WeakPolarHBondContact O-CB 3.43Å; S177-W180 PolarHBondContact O-N 2.85Å
178	S	86.6	Confident	87.3	Confident	39 Å²	39	36 Å²	36	27%	0.273	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-21.8	175.9	-62.8	0	0	0	0	114.7	S176 W180 V181 H182	S176-S178 PolarHBondContact O-N 3.42Å; S176-S178 VanDerWaalsContact O-N 3.11Å; S176-S178 WeakPolarHBondContact OG-CB 3.46Å; S176-S178 PolarHBondContact OG-N 3.22Å; S176-S178 PolarHBondContact OG-OG 2.99Å; S178-W180 PolarHBondContact O-N 3.06Å; S178-V181 WeakPolarHBondContact O-CB 3.4Å; S178-V181 PolarHBondContact O-N 2.77Å; S178-H182 PolarHBondContact O-CE1 3.37Å; S178-H182 PolarHBondContact O-ND1 3.08Å; S178-H182 PolarHBondContact O-NE2 3.35Å
179	L	87.3	Confident	87.8	Confident	5 Å²	5	36 Å²	36	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-20.4	175.6	-65.5	176	0	0	0	113.4	I169 I172 S176 S177 V181 H182 T183 F806 V814 L818	I169-L179 HydrophobicContact CD1-CD2 4.34Å; I169-L179 HydrophobicContact CG1-CD2 4.24Å; I172-L179 HydrophobicContact CB-CD2 4.22Å; I172-L179 HydrophobicContact CG2-CD2 3.75Å; I172-L179 HydrophobicContact CG2-CG 3.89Å; S176-L179 PolarHBondContact O-N 2.76Å; S177-L179 PolarHBondContact O-N 3.27Å; L179-V181 VanDerWaalsContact C-N 3.31Å; L179-V181 PolarHBondContact O-N 2.8Å; L179-H182 VanDerWaalsContact C-CE1 3.4Å; L179-H182 WeakPolarHBondContact CA-CE1 3.28Å; L179-H182 PolarHBondContact N-CE1 3Å; L179-H182 PolarHBondContact O-CE1 2.87Å; L179-H182 PolarHBondContact O-N 3.29Å; L179-T183 PolarHBondContact O-N 2.9Å; L179-T183 PolarHBondContact O-OG1 3.24Å; L179-F806 HydrophobicContact CD2-CE1 4.35Å; L179-V814 HydrophobicContact CD1-CG2 4.3Å; L179-L818 HydrophobicContact CB-CD2 3.72Å
180	W	92.4	Very high	88.5	Confident	96 Å²	96	35.8 Å²	35.8	36%	0.364	21%	0.21	S	C	.	.	H	α-helix	trans	-61.6	-37.8	171.9	-81.3	87.9	0	0	0	112.6	S177 S178 H182 T183 I184 A817 L818 C821	S177-W180 WeakPolarHBondContact O-CB 3.43Å; S177-W180 PolarHBondContact O-N 2.85Å; S178-W180 PolarHBondContact O-N 3.06Å; W180-H182 VanDerWaalsContact C-N 3.32Å; W180-H182 PolarHBondContact O-N 2.86Å; W180-T183 PolarHBondContact O-N 2.85Å; W180-I184 HydrophobicContact CB-CD1 4.44Å; W180-I184 HydrophobicContact CE3-CD1 4.47Å; W180-I184 WeakPolarHBondContact O-CB 3.27Å; W180-I184 VanDerWaalsContact O-CG1 3.28Å; W180-I184 WeakPolarHBondContact O-CG1 3.38Å; W180-I184 PolarHBondContact O-N 2.85Å; W180-A817 HydrophobicContact CH2-CB 4.43Å; W180-A817 HydrophobicContact CZ2-CB 4.04Å; W180-L818 HydrophobicContact CB-CD1 4.26Å; W180-L818 HydrophobicContact CD2-CD1 3.56Å; W180-L818 HydrophobicContact CE3-CD1 4.08Å; W180-L818 HydrophobicContact CG-CD1 3.65Å; W180-L818 HydrophobicContact CZ2-CB 4.48Å; W180-L818 HydrophobicContact CZ2-CD1 4.34Å; W180-C821 HydrophobicContact CH2-CB 4.18Å; W180-C821 HydrophobicContact CZ3-CB 4.12Å
181	V	93.9	Very high	89.4	Confident	37 Å²	37	37.6 Å²	37.6	22%	0.224	22%	0.218	C	C	.	.	H	α-helix	trans	-56.5	-48.7	179	-176.4	0	0	0	0	110.3	V146 I147 S178 L179 T183 I184 F185	V146-V181 HydrophobicContact CG1-CG1 4.05Å; I147-V181 HydrophobicContact CD1-CG1 3.83Å; S178-V181 WeakPolarHBondContact O-CB 3.4Å; S178-V181 PolarHBondContact O-N 2.77Å; L179-V181 VanDerWaalsContact C-N 3.31Å; L179-V181 PolarHBondContact O-N 2.8Å; V181-T183 VanDerWaalsContact C-N 3.33Å; V181-T183 PolarHBondContact O-N 3.12Å; V181-I184 PolarHBondContact O-N 3.38Å; V181-F185 HydrophobicContact CG1-CD2 3.71Å; V181-F185 HydrophobicContact CG1-CE2 3.91Å; V181-F185 WeakPolarHBondContact O-CD2 3.26Å; V181-F185 PolarHBondContact O-N 2.87Å
182	H	92.8	Very high	90.1	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-40.5	-178.8	-59.9	75.5	0	0	0	112.2	V150 I169 I172 S178 L179 W180 G186 I747	V150-H182 WeakPolarHBondContact CG1-NE2 3.34Å; I169-H182 HydrophobicContact CD1-CB 4.12Å; I169-H182 VanDerWaalsContact CD1-CD2 3.48Å; I169-H182 WeakPolarHBondContact CD1-CD2 3.27Å; I172-H182 WeakPolarHBondContact CD1-NE2 3.35Å; S178-H182 PolarHBondContact O-CE1 3.37Å; S178-H182 PolarHBondContact O-ND1 3.08Å; S178-H182 PolarHBondContact O-NE2 3.35Å; L179-H182 VanDerWaalsContact C-CE1 3.4Å; L179-H182 WeakPolarHBondContact CA-CE1 3.28Å; L179-H182 PolarHBondContact N-CE1 3Å; L179-H182 PolarHBondContact O-CE1 2.87Å; L179-H182 PolarHBondContact O-N 3.29Å; W180-H182 VanDerWaalsContact C-N 3.32Å; W180-H182 PolarHBondContact O-N 2.86Å; H182-G186 PolarHBondContact O-N 3.45Å; H182-I747 HydrophobicContact CB-CG2 3.87Å
183	T	92.8	Very high	90.8	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-69.6	-45.5	178.3	-55.3	0	0	0	0	111.5	L179 W180 V181 G186 I187 I807	L179-T183 PolarHBondContact O-N 2.9Å; L179-T183 PolarHBondContact O-OG1 3.24Å; W180-T183 PolarHBondContact O-N 2.85Å; V181-T183 VanDerWaalsContact C-N 3.33Å; V181-T183 PolarHBondContact O-N 3.12Å; T183-G186 PolarHBondContact O-N 2.83Å; T183-I187 HydrophobicContact CG2-CD1 4.48Å; T183-I187 WeakPolarHBondContact O-CG1 3.37Å; T183-I187 PolarHBondContact O-N 3.01Å; T183-I187 VanDerWaalsContact O-N 3.11Å; T183-I807 WeakPolarHBondContact OG1-CD1 3.07Å
184	I	94.9	Very high	91.7	Very high	99 Å²	99	39.1 Å²	39.1	51%	0.508	22%	0.222	S	C	.	.	H	α-helix	trans	-62.3	-46.4	178.4	-68.3	165	0	0	0	110.8	W180 V181 I187 G188	W180-I184 HydrophobicContact CB-CD1 4.44Å; W180-I184 HydrophobicContact CE3-CD1 4.47Å; W180-I184 WeakPolarHBondContact O-CB 3.27Å; W180-I184 VanDerWaalsContact O-CG1 3.28Å; W180-I184 WeakPolarHBondContact O-CG1 3.38Å; W180-I184 PolarHBondContact O-N 2.85Å; V181-I184 PolarHBondContact O-N 3.38Å; I184-I187 PolarHBondContact O-N 2.84Å; I184-G188 PolarHBondContact O-N 2.76Å
185	F	95.9	Very high	92.6	Very high	44 Å²	44	44.5 Å²	44.5	19%	0.193	24%	0.242	C	C	.	.	H	α-helix	trans	-68.1	-32.9	176.8	-84.3	-79.4	0	0	0	112.8	F142 V146 I147 V181 I187 G188 F189 I747	F142-F185 HydrophobicContact CB-CD1 4.17Å; F142-F185 HydrophobicContact CB-CE1 3.74Å; F142-F185 AromaticContact CD1-CE1 3.6Å; F142-F185 HydrophobicContact CD1-CE1 3.6Å; F142-F185 HydrophobicContact CD1-CZ 4.06Å; F142-F185 HydrophobicContact CD2-CE1 4.46Å; F142-F185 HydrophobicContact CE1-CE1 4.3Å; F142-F185 HydrophobicContact CG-CD1 4.42Å; F142-F185 AromaticContact CG-CE1 3.69Å; F142-F185 HydrophobicContact CG-CE1 3.69Å; V146-F185 HydrophobicContact CB-CE2 4.32Å; V146-F185 HydrophobicContact CB-CZ 4.29Å; V146-F185 HydrophobicContact CG1-CE2 3.81Å; V146-F185 HydrophobicContact CG1-CZ 4.19Å; V146-F185 HydrophobicContact CG2-CZ 4.25Å; I147-F185 HydrophobicContact CD1-CB 4.02Å; I147-F185 HydrophobicContact CD1-CD2 3.63Å; I147-F185 HydrophobicContact CD1-CE2 4.28Å; I147-F185 HydrophobicContact CD1-CG 3.85Å; V181-F185 HydrophobicContact CG1-CD2 3.71Å; V181-F185 HydrophobicContact CG1-CE2 3.91Å; V181-F185 WeakPolarHBondContact O-CD2 3.26Å; V181-F185 PolarHBondContact O-N 2.87Å; F185-I187 VanDerWaalsContact C-N 3.33Å; F185-I187 PolarHBondContact O-N 3.42Å; F185-G188 PolarHBondContact O-N 2.85Å; F185-F189 HydrophobicContact CD1-CD1 4.32Å; F185-F189 AromaticContact CD1-CE1 3.71Å; F185-F189 HydrophobicContact CD1-CE1 3.71Å; F185-F189 HydrophobicContact CD1-CZ 4.25Å; F185-F189 HydrophobicContact CE1-CE1 4.48Å; F185-F189 VanDerWaalsContact O-CB 3.3Å; F185-F189 WeakPolarHBondContact O-CB 3.49Å; F185-F189 WeakPolarHBondContact O-CD1 3.37Å; F185-F189 VanDerWaalsContact O-CG 3.28Å; F185-F189 WeakPolarHBondContact O-CG 3.4Å; F185-F189 PolarHBondContact O-N 2.94Å; F185-I747 HydrophobicContact CB-CD1 4.01Å
186	G	94.8	Very high	93.6	Very high	2 Å²	2	38.7 Å²	38.7	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-38.1	172	0	0	0	0	0	113.3	H182 T183 F190 Q800	H182-G186 PolarHBondContact O-N 3.45Å; T183-G186 PolarHBondContact O-N 2.83Å; G186-F190 PolarHBondContact O-N 2.78Å; G186-Q800 WeakPolarHBondContact O-CG 3.43Å; G186-Q800 PolarHBondContact O-NE2 2.94Å
187	I	95.9	Very high	94.1	Very high	42 Å²	42	37.3 Å²	37.3	22%	0.215	20%	0.201	C	C	.	.	H	α-helix	trans	-72	-46.6	173.5	-63.5	169.7	0	0	0	110.5	T183 I184 F185 F189 F190 L191	T183-I187 HydrophobicContact CG2-CD1 4.48Å; T183-I187 WeakPolarHBondContact O-CG1 3.37Å; T183-I187 PolarHBondContact O-N 3.01Å; T183-I187 VanDerWaalsContact O-N 3.11Å; I184-I187 PolarHBondContact O-N 2.84Å; F185-I187 VanDerWaalsContact C-N 3.33Å; F185-I187 PolarHBondContact O-N 3.42Å; I187-F189 PolarHBondContact O-N 2.76Å; I187-F190 PolarHBondContact O-N 3.26Å; I187-L191 HydrophobicContact CG2-CD1 4.28Å; I187-L191 PolarHBondContact O-N 3.48Å
188	G	96.6	Very high	94.4	Very high	32 Å²	32	34 Å²	34	33%	0.33	18%	0.175	S	C	.	.	H	α-helix	trans	-61.2	-39.5	179.8	0	0	0	0	0	114	I184 F185 L191 L192	I184-G188 PolarHBondContact O-N 2.76Å; F185-G188 PolarHBondContact O-N 2.85Å; G188-L191 PolarHBondContact O-N 3.25Å; G188-L192 WeakPolarHBondContact O-CB 3.5Å; G188-L192 PolarHBondContact O-N 3.43Å
189	F	97.5	Very high	94.7	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.018	19%	0.187	C	C	.	.	H	α-helix	trans	-66.5	-39.1	176.6	-75.7	5.9	0	0	0	111.9	Y135 T139 F142 F185 I187 L192 A193 I747 L799	Y135-F189 WeakPolarHBondContact CE2-O 3.26Å; T139-F189 HydrophobicContact CG2-CD1 3.85Å; T139-F189 HydrophobicContact CG2-CD2 3.74Å; T139-F189 HydrophobicContact CG2-CE1 3.88Å; T139-F189 HydrophobicContact CG2-CE2 3.79Å; T139-F189 HydrophobicContact CG2-CG 3.78Å; T139-F189 HydrophobicContact CG2-CZ 3.85Å; F142-F189 HydrophobicContact CB-CE1 3.96Å; F142-F189 HydrophobicContact CB-CZ 4.02Å; F142-F189 HydrophobicContact CD2-CE1 4.19Å; F142-F189 HydrophobicContact CG-CE1 4.42Å; F185-F189 HydrophobicContact CD1-CD1 4.32Å; F185-F189 AromaticContact CD1-CE1 3.71Å; F185-F189 HydrophobicContact CD1-CE1 3.71Å; F185-F189 HydrophobicContact CD1-CZ 4.25Å; F185-F189 HydrophobicContact CE1-CE1 4.48Å; F185-F189 VanDerWaalsContact O-CB 3.3Å; F185-F189 WeakPolarHBondContact O-CB 3.49Å; F185-F189 WeakPolarHBondContact O-CD1 3.37Å; F185-F189 VanDerWaalsContact O-CG 3.28Å; F185-F189 WeakPolarHBondContact O-CG 3.4Å; F185-F189 PolarHBondContact O-N 2.94Å; I187-F189 PolarHBondContact O-N 2.76Å; F189-L192 PolarHBondContact O-N 2.82Å; F189-A193 WeakPolarHBondContact O-CB 3.33Å; F189-A193 PolarHBondContact O-N 3.28Å; F189-I747 HydrophobicContact CD2-CD1 3.85Å; F189-I747 HydrophobicContact CD2-CG1 4.21Å; F189-I747 HydrophobicContact CE2-CD1 3.94Å; F189-I747 HydrophobicContact CE2-CG1 3.87Å; F189-L799 HydrophobicContact CD2-CD2 4.03Å
190	F	97.2	Very high	94.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.1	-40.9	173.7	-173.8	-84.6	0	0	0	112.3	G186 I187 L192 A193 F194 V796 F797 S829 L832 M833	G186-F190 PolarHBondContact O-N 2.78Å; I187-F190 PolarHBondContact O-N 3.26Å; F190-L192 PolarHBondContact O-N 3.27Å; F190-A193 PolarHBondContact O-N 3.24Å; F190-F194 HydrophobicContact CE1-CB 4.42Å; F190-F194 WeakPolarHBondContact O-CB 3.24Å; F190-F194 PolarHBondContact O-N 3.29Å; F190-V796 HydrophobicContact CB-CG1 4.07Å; F190-V796 HydrophobicContact CD2-CB 4.28Å; F190-V796 HydrophobicContact CD2-CG1 4.12Å; F190-F797 HydrophobicContact CE2-CB 4.31Å; F190-S829 WeakPolarHBondContact CD1-OG 3.47Å; F190-S829 WeakPolarHBondContact CZ-O 3.48Å; F190-L832 HydrophobicContact CE1-CB 3.89Å; F190-L832 HydrophobicContact CE1-CD1 4.09Å; F190-L832 HydrophobicContact CZ-CB 4.42Å; F190-M833 HydrophobicContact CZ-CB 4.21Å
191	L	96.9	Very high	94.7	Very high	54 Å²	54	33 Å²	33	28%	0.283	17%	0.17	S	C	.	.	H	α-helix	trans	-59.6	-45.5	173.3	-78.4	170.4	0	0	0	111.8	I187 G188 A193 F194 F195 F828 L832	I187-L191 HydrophobicContact CG2-CD1 4.28Å; I187-L191 PolarHBondContact O-N 3.48Å; G188-L191 PolarHBondContact O-N 3.25Å; L191-A193 PolarHBondContact O-N 3.39Å; L191-F194 PolarHBondContact O-N 3.01Å; L191-F195 HydrophobicContact CB-CE2 4.33Å; L191-F195 HydrophobicContact CD2-CE2 4.15Å; L191-F195 WeakPolarHBondContact O-CD2 3.3Å; L191-F195 PolarHBondContact O-N 2.89Å; L191-F828 HydrophobicContact CD2-CE1 3.94Å; L191-F828 HydrophobicContact CD2-CZ 4.44Å; L191-L832 HydrophobicContact CD2-CD1 4.38Å
192	L	97.2	Very high	94.4	Very high	42 Å²	42	39.1 Å²	39.1	22%	0.22	19%	0.189	C	C	.	.	H	α-helix	trans	-58.2	-47.9	174.6	177	66	0	0	0	111.7	Y135 I138 T139 G188 F189 F190 F194 F195 L196	Y135-L192 HydrophobicContact CD2-CD2 4.03Å; Y135-L192 HydrophobicContact CD2-CG 4.08Å; Y135-L192 HydrophobicContact CE2-CD2 4.2Å; Y135-L192 HydrophobicContact CE2-CG 4.35Å; I138-L192 HydrophobicContact CB-CD2 4Å; I138-L192 HydrophobicContact CD1-CD1 4.25Å; I138-L192 HydrophobicContact CG2-CD2 3.54Å; T139-L192 HydrophobicContact CG2-CD2 4.31Å; G188-L192 WeakPolarHBondContact O-CB 3.5Å; G188-L192 PolarHBondContact O-N 3.43Å; F189-L192 PolarHBondContact O-N 2.82Å; F190-L192 PolarHBondContact O-N 3.27Å; L192-F194 VanDerWaalsContact C-N 3.35Å; L192-F194 PolarHBondContact O-N 3.38Å; L192-F195 PolarHBondContact O-N 3.45Å; L192-L196 HydrophobicContact CD1-CD1 3.95Å; L192-L196 HydrophobicContact CD1-CG 4.21Å; L192-L196 HydrophobicContact CG-CD1 4.02Å; L192-L196 WeakPolarHBondContact O-CB 3.4Å; L192-L196 WeakPolarHBondContact O-CG 3.43Å; L192-L196 PolarHBondContact O-N 3.23Å
193	A	96.9	Very high	94	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.9	-45.6	176.3	0	0	0	0	0	111.7	Y135 F189 F190 L191 M197 M792 L793 V796	Y135-A193 HydrophobicContact CD2-CB 4.08Å; Y135-A193 HydrophobicContact CE2-CB 3.67Å; F189-A193 WeakPolarHBondContact O-CB 3.33Å; F189-A193 PolarHBondContact O-N 3.28Å; F190-A193 PolarHBondContact O-N 3.24Å; L191-A193 PolarHBondContact O-N 3.39Å; A193-M197 VanDerWaalsContact O-CB 3.3Å; A193-M197 WeakPolarHBondContact O-CB 3.36Å; A193-M197 WeakPolarHBondContact O-CG 3.29Å; A193-M197 PolarHBondContact O-N 3.08Å; A193-M792 HydrophobicContact CB-CE 4.17Å; A193-L793 HydrophobicContact CB-CD2 4.05Å; A193-V796 HydrophobicContact CB-CB 4.29Å; A193-V796 HydrophobicContact CB-CG1 4.23Å; A193-V796 HydrophobicContact CB-CG2 3.93Å
194	F	96.1	Very high	93.6	Very high	22 Å²	22	42.4 Å²	42.4	10%	0.096	20%	0.204	C	C	.	.	H	α-helix	trans	-60.4	-50.3	177.3	179.3	-91.4	0	0	0	111.7	F190 L191 L192 M197 Q198 L832 T836	F190-F194 HydrophobicContact CE1-CB 4.42Å; F190-F194 WeakPolarHBondContact O-CB 3.24Å; F190-F194 PolarHBondContact O-N 3.29Å; L191-F194 PolarHBondContact O-N 3.01Å; L192-F194 VanDerWaalsContact C-N 3.35Å; L192-F194 PolarHBondContact O-N 3.38Å; F194-M197 PolarHBondContact O-N 3.39Å; F194-Q198 HydrophobicContact CD1-CG 4.02Å; F194-Q198 HydrophobicContact CE1-CG 3.72Å; F194-Q198 HydrophobicContact CE2-CG 4.3Å; F194-Q198 HydrophobicContact CG-CG 4.43Å; F194-Q198 HydrophobicContact CZ-CG 3.88Å; F194-Q198 WeakPolarHBondContact O-CB 3.18Å; F194-Q198 VanDerWaalsContact O-CG 3.26Å; F194-Q198 WeakPolarHBondContact O-CG 3.41Å; F194-Q198 PolarHBondContact O-N 2.88Å; F194-L832 HydrophobicContact CD2-CB 3.98Å; F194-L832 HydrophobicContact CD2-CD1 4.29Å; F194-L832 HydrophobicContact CE1-CD2 4.48Å; F194-L832 HydrophobicContact CE2-CB 3.89Å; F194-L832 HydrophobicContact CE2-CD1 4.44Å; F194-L832 HydrophobicContact CE2-CD2 3.95Å; F194-L832 HydrophobicContact CE2-CG 4.32Å; F194-L832 HydrophobicContact CG-CD1 4.37Å; F194-L832 HydrophobicContact CZ-CD2 3.89Å; F194-T836 HydrophobicContact CD2-CG2 3.72Å; F194-T836 HydrophobicContact CE2-CG2 3.43Å; F194-T836 VanDerWaalsContact CE2-CG2 3.43Å
195	F	95.5	Very high	92.8	Very high	132 Å²	132	43 Å²	43	58%	0.579	20%	0.2	S	C	*	.	H	α-helix	trans	-65.1	-41.7	-179.5	-71.6	-59.2	0	0	0	112.8	L191 L192 Q198 H199	L191-F195 HydrophobicContact CB-CE2 4.33Å; L191-F195 HydrophobicContact CD2-CE2 4.15Å; L191-F195 WeakPolarHBondContact O-CD2 3.3Å; L191-F195 PolarHBondContact O-N 2.89Å; L192-F195 PolarHBondContact O-N 3.45Å; F195-Q198 PolarHBondContact O-N 3.37Å; F195-H199 PolarHBondContact O-N 3.15Å
196	L	95.9	Very high	91.8	Very high	29 Å²	29	50 Å²	50	15%	0.152	23%	0.225	C	C	.	.	H	α-helix	trans	-61.8	-43.5	174.6	-73.2	175	0	0	0	111.7	Y131 I134 Y135 L192 H199 F200	Y131-L196 HydrophobicContact CD1-CB 4.27Å; Y131-L196 HydrophobicContact CD1-CD2 4.38Å; I134-L196 HydrophobicContact CG2-CD1 4.2Å; I134-L196 HydrophobicContact CG2-CD2 4.1Å; Y135-L196 HydrophobicContact CD2-CD1 4.2Å; L192-L196 HydrophobicContact CD1-CD1 3.95Å; L192-L196 HydrophobicContact CD1-CG 4.21Å; L192-L196 HydrophobicContact CG-CD1 4.02Å; L192-L196 WeakPolarHBondContact O-CB 3.4Å; L192-L196 WeakPolarHBondContact O-CG 3.43Å; L192-L196 PolarHBondContact O-N 3.23Å; L196-H199 PolarHBondContact O-N 3.3Å; L196-F200 PolarHBondContact O-N 3.01Å
197	M	94	Very high	90.7	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.015	23%	0.23	C	C	.	.	H	α-helix	trans	-68.9	-35	176.1	-74.5	-58.2	99.7	0	0	113.3	F128 Y131 A193 F194 H199 F200 S201 I789 M792 L793	F128-M197 HydrophobicContact CE2-CE 4.47Å; F128-M197 HydrophobicContact CE2-SD 3.92Å; Y131-M197 HydrophobicContact CD1-CE 4.33Å; Y131-M197 HydrophobicContact CG-CE 4.23Å; A193-M197 VanDerWaalsContact O-CB 3.3Å; A193-M197 WeakPolarHBondContact O-CB 3.36Å; A193-M197 WeakPolarHBondContact O-CG 3.29Å; A193-M197 PolarHBondContact O-N 3.08Å; F194-M197 PolarHBondContact O-N 3.39Å; M197-H199 VanDerWaalsContact C-N 3.33Å; M197-F200 HydrophobicContact CE-CB 4.32Å; M197-F200 PolarHBondContact O-N 2.77Å; M197-S201 WeakPolarHBondContact O-CB 3.39Å; M197-S201 PolarHBondContact O-N 3.09Å; M197-I789 HydrophobicContact CB-CG2 3.93Å; M197-I789 HydrophobicContact CG-CG2 4.09Å; M197-I789 HydrophobicContact SD-CB 4.26Å; M197-I789 HydrophobicContact SD-CG1 3.85Å; M197-I789 HydrophobicContact SD-CG2 4.12Å; M197-M792 HydrophobicContact CE-CE 4.19Å; M197-M792 HydrophobicContact CE-SD 3.45Å; M197-M792 WeakPolarHBondContact CE-SD 3.41Å; M197-M792 HydrophobicContact CG-CE 4.32Å; M197-M792 HydrophobicContact CG-SD 3.66Å; M197-M792 HydrophobicContact SD-SD 3.44Å; M197-L793 HydrophobicContact CG-CD2 4.29Å; M197-L793 HydrophobicContact CG-CG 4.37Å
198	Q	91.5	Very high	89.4	Confident	28 Å²	28	50.3 Å²	50.3	13%	0.131	23%	0.228	C	C	.	.	H	α-helix	trans	-66	-35.9	171.7	-71.2	-64.3	-11.6	0	0	111.9	F194 F195 S201 R202	F194-Q198 HydrophobicContact CD1-CG 4.02Å; F194-Q198 HydrophobicContact CE1-CG 3.72Å; F194-Q198 HydrophobicContact CE2-CG 4.3Å; F194-Q198 HydrophobicContact CG-CG 4.43Å; F194-Q198 HydrophobicContact CZ-CG 3.88Å; F194-Q198 WeakPolarHBondContact O-CB 3.18Å; F194-Q198 VanDerWaalsContact O-CG 3.26Å; F194-Q198 WeakPolarHBondContact O-CG 3.41Å; F194-Q198 PolarHBondContact O-N 2.88Å; F195-Q198 PolarHBondContact O-N 3.37Å; Q198-S201 PolarHBondContact O-OG 2.66Å; Q198-R202 WeakPolarHBondContact O-CB 3.48Å; Q198-R202 WeakPolarHBondContact O-CD 3.4Å; Q198-R202 WeakPolarHBondContact O-CG 3.42Å; Q198-R202 PolarHBondContact O-N 3.43Å
199	H	92.9	Very high	87.7	Confident	113 Å²	113	51.2 Å²	51.2	52%	0.523	23%	0.227	S	C	.	.	H	α-helix	trans	-66.6	-49.3	174	-172.9	-101.1	0	0	0	111.7	Y131 F195 L196 M197 S201 R202 Q203	Y131-H199 HydrophobicContact CE1-CB 4.49Å; Y131-H199 AromaticContact CE1-ND1 3.88Å; Y131-H199 AromaticContact CZ-ND1 3.78Å; Y131-H199 PolarHBondContact OH-CE1 3.44Å; Y131-H199 PolarHBondContact OH-ND1 3.47Å; F195-H199 PolarHBondContact O-N 3.15Å; L196-H199 PolarHBondContact O-N 3.3Å; M197-H199 VanDerWaalsContact C-N 3.33Å; H199-S201 VanDerWaalsContact C-N 3.32Å; H199-S201 PolarHBondContact O-N 2.98Å; H199-R202 PolarHBondContact O-N 2.86Å; H199-Q203 PolarHBondContact O-N 2.95Å
200	F	92.1	Very high	86	Confident	2 Å²	2	58 Å²	58	1%	0.009	25%	0.252	C	S	.	.	H	α-helix	trans	-56.9	-43.9	173.8	175.8	-105.5	0	0	0	111.8	R127 F128 Y131 L196 M197 Q203 F204 I789	R127-F200 HydrophobicContact CB-CE2 4.34Å; R127-F200 HydrophobicContact CG-CD2 4.16Å; R127-F200 HydrophobicContact CG-CE2 3.96Å; F128-F200 HydrophobicContact CB-CE2 4.2Å; F128-F200 HydrophobicContact CB-CZ 3.91Å; F128-F200 HydrophobicContact CD2-CD1 4.18Å; F128-F200 AromaticContact CD2-CE1 3.73Å; F128-F200 HydrophobicContact CD2-CE1 3.73Å; F128-F200 HydrophobicContact CD2-CZ 4Å; F128-F200 HydrophobicContact CG-CZ 4.47Å; Y131-F200 HydrophobicContact CD1-CB 4.15Å; Y131-F200 HydrophobicContact CD2-CB 4.14Å; Y131-F200 AromaticContact CD2-CD2 3.73Å; Y131-F200 HydrophobicContact CD2-CD2 3.73Å; Y131-F200 HydrophobicContact CD2-CG 4.25Å; Y131-F200 HydrophobicContact CE1-CB 3.93Å; Y131-F200 HydrophobicContact CE2-CB 3.96Å; Y131-F200 AromaticContact CE2-CD2 3.6Å; Y131-F200 HydrophobicContact CE2-CD2 3.6Å; Y131-F200 HydrophobicContact CE2-CG 4.22Å; Y131-F200 HydrophobicContact CG-CB 4.25Å; L196-F200 PolarHBondContact O-N 3.01Å; M197-F200 HydrophobicContact CE-CB 4.32Å; M197-F200 PolarHBondContact O-N 2.77Å; F200-Q203 PolarHBondContact O-N 2.93Å; F200-F204 VanDerWaalsContact O-CB 3.26Å; F200-F204 WeakPolarHBondContact O-CB 3.31Å; F200-F204 PolarHBondContact O-N 3.11Å; F200-I789 HydrophobicContact CD1-CD1 3.75Å; F200-I789 HydrophobicContact CD1-CG1 3.87Å; F200-I789 HydrophobicContact CE1-CD1 3.92Å; F200-I789 HydrophobicContact CE1-CG1 4.02Å
201	S	88.6	Confident	84.4	Confident	4 Å²	4	60.2 Å²	60.2	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-67.1	-38	-178.6	90.2	0	0	0	0	113	M197 Q198 H199 F204 R205	M197-S201 WeakPolarHBondContact O-CB 3.39Å; M197-S201 PolarHBondContact O-N 3.09Å; Q198-S201 PolarHBondContact O-OG 2.66Å; H199-S201 VanDerWaalsContact C-N 3.32Å; H199-S201 PolarHBondContact O-N 2.98Å; S201-F204 PolarHBondContact O-N 3Å; S201-R205 WeakPolarHBondContact O-CB 3.36Å; S201-R205 PolarHBondContact O-N 3.05Å
202	R	86.9	Confident	82.7	Confident	166 Å²	166	58.5 Å²	58.5	63%	0.626	26%	0.258	S	S	*	.	H	α-helix	trans	-63.9	-42.4	172.4	-73.5	168.3	-179.1	-163.2	-0	111.5	Q198 H199	Q198-R202 WeakPolarHBondContact O-CB 3.48Å; Q198-R202 WeakPolarHBondContact O-CD 3.4Å; Q198-R202 WeakPolarHBondContact O-CG 3.42Å; Q198-R202 PolarHBondContact O-N 3.43Å; H199-R202 PolarHBondContact O-N 2.86Å
203	Q	84.8	Confident	81.2	Confident	69 Å²	69	57.1 Å²	57.1	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-67.2	-42.7	176.9	-166.1	-179.2	28.1	0	0	111.7	Y131 H199 F200	Y131-Q203 PolarHBondContact OH-OE1 3.43Å; H199-Q203 PolarHBondContact O-N 2.95Å; F200-Q203 PolarHBondContact O-N 2.93Å
204	F	83.6	Confident	80	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.018	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-46.3	176.4	178.9	-96	0	0	0	112.1	Q124 F200 S201 R206 E207 S208 H785 W786	Q124-F204 HydrophobicContact CG-CD2 4.47Å; Q124-F204 VanDerWaalsContact OE1-CE2 3.29Å; F200-F204 VanDerWaalsContact O-CB 3.26Å; F200-F204 WeakPolarHBondContact O-CB 3.31Å; F200-F204 PolarHBondContact O-N 3.11Å; S201-F204 PolarHBondContact O-N 3Å; F204-R206 VanDerWaalsContact C-N 3.26Å; F204-R206 PolarHBondContact O-N 3.26Å; F204-E207 PolarHBondContact O-N 3.42Å; F204-S208 WeakPolarHBondContact O-CB 3.39Å; F204-S208 PolarHBondContact O-N 2.9Å; F204-H785 HydrophobicContact CD2-CB 4.26Å; F204-H785 HydrophobicContact CE2-CB 3.67Å; F204-H785 AromaticContact CE2-CD2 3.38Å; F204-H785 WeakPolarHBondContact CE2-CD2 3.3Å; F204-H785 AromaticContact CE2-CG 3.62Å; F204-H785 HydrophobicContact CZ-CB 3.81Å; F204-H785 AromaticContact CZ-CD2 3.67Å; F204-W786 HydrophobicContact CD1-CZ2 4.19Å; F204-W786 AromaticContact CD1-NE1 3.95Å; F204-W786 AromaticContact CE1-NE1 3.52Å
205	R	77.3	Confident	79.3	Confident	112 Å²	112	57.8 Å²	57.8	42%	0.423	26%	0.258	S	S	.	.	H	α-helix	trans	-52.1	-44	179.5	-168.8	-168.1	-56.8	-170	1.3	112.1	S201 E207 T209 M843	S201-R205 WeakPolarHBondContact O-CB 3.36Å; S201-R205 PolarHBondContact O-N 3.05Å; R205-E207 VanDerWaalsContact C-N 3.27Å; R205-E207 PolarHBondContact O-N 3.45Å; R205-T209 WeakPolarHBondContact O-CG2 3.32Å; R205-T209 PolarHBondContact O-N 3.5Å; R205-T209 PolarHBondContact O-OG1 3.03Å; R205-T209 VanDerWaalsContact O-OG1 3.04Å; R205-M843 HydrophobicContact CG-SD 4.5Å; R205-M843 PolarHBondContact NE-SD 2.1Å; R205-M843 PolarHBondContact NH2-SD 3.05Å
206	R	74.7	Confident	78.6	Confident	189 Å²	189	51.9 Å²	51.9	71%	0.713	23%	0.232	S	C	*	.	H	α-helix	trans	-64.1	-25.7	-179.6	-70	176	173.1	175.4	-2.8	114	F204 T209	F204-R206 VanDerWaalsContact C-N 3.26Å; F204-R206 PolarHBondContact O-N 3.26Å; R206-T209 PolarHBondContact O-OG1 3.32Å
207	E	73.5	Confident	78.2	Confident	27 Å²	27	53.8 Å²	53.8	13%	0.126	24%	0.239	C	C	.	.	H	α-helix	trans	-99.3	-37.3	-178.3	-166.1	78.4	154	0	0	112.1	R115 N120 F204 R205 T209 R210 T211	R115-E207 IonicContact CZ-OE1 2.88Å; R115-E207 IonicContact NH2-OE1 3.74Å; R115-E207 PolarHBondContact NH2-OE1 2.84Å; N120-E207 PolarHBondContact ND2-OE1 3.33Å; F204-E207 PolarHBondContact O-N 3.42Å; R205-E207 VanDerWaalsContact C-N 3.27Å; R205-E207 PolarHBondContact O-N 3.45Å; E207-T209 PolarHBondContact O-N 3.01Å; E207-R210 WeakPolarHBondContact O-CA 3.34Å; E207-R210 WeakPolarHBondContact O-CB 3.49Å; E207-R210 PolarHBondContact O-N 2.93Å; E207-R210 IonicContact OE2-CZ 3.84Å; E207-R210 IonicContact OE2-NH1 3.96Å; E207-R210 PolarHBondContact OE2-NH1 3.34Å; E207-T211 PolarHBondContact O-N 3.49Å
208	S	67.8	Low	78.1	Confident	25 Å²	25	54.3 Å²	54.3	18%	0.175	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-31.8	174.3	179.7	0	0	0	0	112.1	F204 R210 S782	F204-S208 WeakPolarHBondContact O-CB 3.39Å; F204-S208 PolarHBondContact O-N 2.9Å; S208-R210 PolarHBondContact O-N 2.87Å; S208-S782 WeakPolarHBondContact OG-CB 3.34Å; S208-S782 PolarHBondContact OG-OG 3.35Å
209	T	60.5	Low	78.1	Confident	50 Å²	50	53 Å²	53	31%	0.307	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	1.6	170.7	53.6	0	0	0	0	114.8	R205 R206 E207 I972	R205-T209 WeakPolarHBondContact O-CG2 3.32Å; R205-T209 PolarHBondContact O-N 3.5Å; R205-T209 PolarHBondContact O-OG1 3.03Å; R205-T209 VanDerWaalsContact O-OG1 3.04Å; R206-T209 PolarHBondContact O-OG1 3.32Å; E207-T209 PolarHBondContact O-N 3.01Å; T209-I972 CarbonylContact C-O 3.47Å; T209-I972 VanDerWaalsContact C-O 3.3Å; T209-I972 VanDerWaalsContact O-O 3.08Å
210	R	61.2	Low	78	Confident	147 Å²	147	48.2 Å²	48.2	56%	0.555	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-37.6	175.2	-65.7	-179.2	178.4	134.3	-4.8	114	E207 S208 I972 N973	E207-R210 WeakPolarHBondContact O-CA 3.34Å; E207-R210 WeakPolarHBondContact O-CB 3.49Å; E207-R210 PolarHBondContact O-N 2.93Å; E207-R210 IonicContact OE2-CZ 3.84Å; E207-R210 IonicContact OE2-NH1 3.96Å; E207-R210 PolarHBondContact OE2-NH1 3.34Å; S208-R210 PolarHBondContact O-N 2.87Å; R210-I972 CarbonylContact C-O 3.5Å; R210-I972 WeakPolarHBondContact CA-O 3.34Å; R210-I972 PolarHBondContact N-O 3.08Å; R210-I972 CarbonylContact O-C 3.27Å; R210-I972 VanDerWaalsContact O-O 3.13Å; R210-N973 PolarHBondContact O-N 3.45Å
211	T	63.7	Low	78	Confident	46 Å²	46	48.1 Å²	48.1	28%	0.282	22%	0.215	S	C	.	.	S	Bend	trans	-123.9	130	-169.6	55.4	0	0	0	0	114.1	N120 E207	N120-T211 WeakPolarHBondContact ND2-CG2 3.33Å; N120-T211 PolarHBondContact ND2-OG1 3.43Å; N120-T211 VanDerWaalsContact ND2-OG1 3.13Å; E207-T211 PolarHBondContact O-N 3.49Å
212	P	62.3	Low	78	Confident	19 Å²	19	49.7 Å²	49.7	12%	0.123	23%	0.226	C	C	.	.			trans	-147	144.6	-134.7	42	-19.5	0	0	0	118.4	R971 I972 N973	P212-R971 HydrophobicContact CB-CB 3.62Å; P212-R971 VanDerWaalsContact CB-CD 3.45Å; P212-R971 HydrophobicContact CB-CG 3.52Å; P212-R971 HydrophobicContact CG-CG 4.25Å; P212-R971 PolarHBondContact O-NE 3.24Å; P212-I972 VanDerWaalsContact CB-C 3.46Å; P212-N973 WeakPolarHBondContact CG-O 3.46Å
213	N	65.6	Low	77.8	Confident	13 Å²	13	43.7 Å²	43.7	7%	0.07	22%	0.215	C	C	.	.	S	Bend	trans	-103.8	10	-158.7	-57.3	-29.7	0	0	0	121.9	P463 V464 I780 D781	N213-P463 WeakPolarHBondContact O-CA 3.15Å; N213-V464 PolarHBondContact O-N 2.81Å; N213-I780 PolarHBondContact ND2-O 2.83Å; N213-D781 PolarHBondContact ND2-OD1 2.71Å
214	F	72.4	Confident	78	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	155.1	176.5	81.9	-93	0	0	0	114.5	E216 F461 A462 L853 V970 R971	F214-E216 VanDerWaalsContact CE2-CA 3.43Å; F214-E216 HydrophobicContact CE2-CB 4.36Å; F214-E216 HydrophobicContact CE2-CG 4.07Å; F214-E216 HydrophobicContact CZ-CG 3.99Å; F214-E216 PolarHBondContact O-N 3.37Å; F214-E216 VanDerWaalsContact O-N 3.09Å; F214-F461 HydrophobicContact CB-CB 4.15Å; F214-F461 HydrophobicContact CD1-CB 4.35Å; F214-F461 HydrophobicContact CD2-CB 3.32Å; F214-F461 AromaticContact CD2-CD1 3.45Å; F214-F461 HydrophobicContact CD2-CD1 3.45Å; F214-F461 VanDerWaalsContact CD2-CD1 3.45Å; F214-F461 HydrophobicContact CD2-CD2 4.46Å; F214-F461 HydrophobicContact CD2-CE1 4.29Å; F214-F461 AromaticContact CD2-CG 3.52Å; F214-F461 HydrophobicContact CD2-CG 3.52Å; F214-F461 HydrophobicContact CE2-CB 3.67Å; F214-F461 AromaticContact CE2-CD1 3.02Å; F214-F461 HydrophobicContact CE2-CD1 3.02Å; F214-F461 AromaticContact CE2-CD2 3.94Å; F214-F461 HydrophobicContact CE2-CD2 3.94Å; F214-F461 AromaticContact CE2-CE1 3.42Å; F214-F461 HydrophobicContact CE2-CE1 3.42Å; F214-F461 VanDerWaalsContact CE2-CE1 3.42Å; F214-F461 HydrophobicContact CE2-CE2 4.26Å; F214-F461 AromaticContact CE2-CG 3.28Å; F214-F461 HydrophobicContact CE2-CG 3.28Å; F214-F461 HydrophobicContact CE2-CZ 4.01Å; F214-F461 HydrophobicContact CG-CB 3.7Å; F214-F461 HydrophobicContact CG-CG 4.25Å; F214-F461 HydrophobicContact CZ-CB 4.34Å; F214-F461 AromaticContact CZ-CD1 3.88Å; F214-F461 HydrophobicContact CZ-CD1 3.88Å; F214-F461 HydrophobicContact CZ-CD2 4.04Å; F214-F461 HydrophobicContact CZ-CE1 4.03Å; F214-F461 HydrophobicContact CZ-CE2 4.19Å; F214-F461 AromaticContact CZ-CG 3.85Å; F214-F461 HydrophobicContact CZ-CG 3.85Å; F214-F461 HydrophobicContact CZ-CZ 4.15Å; F214-A462 CarbonylContact C-O 3.53Å; F214-A462 VanDerWaalsContact C-O 3.27Å; F214-A462 WeakPolarHBondContact CA-O 3.28Å; F214-A462 WeakPolarHBondContact CB-O 3.37Å; F214-L853 HydrophobicContact CZ-CD1 3.92Å; F214-V970 HydrophobicContact CB-CB 4.47Å; F214-V970 HydrophobicContact CB-CG2 4.06Å; F214-V970 HydrophobicContact CD1-CB 3.41Å; F214-V970 VanDerWaalsContact CD1-CB 3.41Å; F214-V970 HydrophobicContact CD1-CG1 3.07Å; F214-V970 HydrophobicContact CD1-CG2 3.9Å; F214-V970 HydrophobicContact CD2-CG1 4.32Å; F214-V970 HydrophobicContact CE1-CB 3.76Å; F214-V970 HydrophobicContact CE1-CG1 2.95Å; F214-V970 HydrophobicContact CE2-CG1 4.24Å; F214-V970 HydrophobicContact CG-CB 4.14Å; F214-V970 HydrophobicContact CG-CG1 3.78Å; F214-V970 HydrophobicContact CG-CG2 4.13Å; F214-V970 HydrophobicContact CZ-CG1 3.61Å; F214-R971 HydrophobicContact CB-CG 4.22Å; F214-R971 HydrophobicContact CD1-CB 3.24Å; F214-R971 HydrophobicContact CD1-CG 3.21Å; F214-R971 HydrophobicContact CD2-CG 4.42Å; F214-R971 VanDerWaalsContact CE1-CA 3.49Å; F214-R971 HydrophobicContact CE1-CB 3.08Å; F214-R971 HydrophobicContact CE1-CG 3.61Å; F214-R971 HydrophobicContact CG-CB 4.17Å; F214-R971 HydrophobicContact CG-CG 3.71Å; F214-R971 HydrophobicContact CZ-CB 3.91Å; F214-R971 HydrophobicContact CZ-CG 4.38Å; F214-R971 WeakPolarHBondContact O-CD 2.97Å; F214-R971 WeakPolarHBondContact O-CG 3.4Å; F214-R971 PolarHBondContact O-NE 3.2Å; F214-R971 PolarHBondContact O-NH1 3.45Å; F214-R971 VanDerWaalsContact O-NH1 3.11Å; F214-R971 PolarHBondContact O-NH2 3.15Å
215	S	79.7	Confident	78.2	Confident	35 Å²	35	41.4 Å²	41.4	25%	0.245	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	109.9	172.9	179.7	0	0	0	0	112.2	K217 T218 A462	S215-K217 PolarHBondContact O-N 3.25Å; S215-T218 WeakPolarHBondContact CB-OG1 3.47Å; S215-T218 PolarHBondContact O-N 3.35Å; S215-T218 WeakPolarHBondContact OG-CB 3.46Å; S215-T218 PolarHBondContact OG-N 3.24Å; S215-T218 PolarHBondContact OG-OG1 3.47Å; S215-A462 PolarHBondContact N-O 2.94Å
216	E	81.2	Confident	78.6	Confident	8 Å²	8	42.5 Å²	42.5	4%	0.037	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	-18.1	-178.4	-86.2	160.1	-115.1	0	0	115.7	F214 K423 R971 I972	F214-E216 VanDerWaalsContact CE2-CA 3.43Å; F214-E216 HydrophobicContact CE2-CB 4.36Å; F214-E216 HydrophobicContact CE2-CG 4.07Å; F214-E216 HydrophobicContact CZ-CG 3.99Å; F214-E216 PolarHBondContact O-N 3.37Å; F214-E216 VanDerWaalsContact O-N 3.09Å; E216-K423 HydrophobicContact CB-CD 3.97Å; E216-K423 HydrophobicContact CB-CG 4.07Å; E216-K423 HydrophobicContact CG-CD 4.49Å; E216-K423 WeakPolarHBondContact OE2-CD 3.04Å; E216-K423 WeakPolarHBondContact OE2-CE 3.29Å; E216-K423 IonicContact OE2-NZ 2.71Å; E216-K423 PolarHBondContact OE2-NZ 2.83Å; E216-R971 HydrophobicContact CG-CB 4.04Å; E216-R971 HydrophobicContact CG-CG 4.22Å; E216-R971 WeakPolarHBondContact OE1-CD 3.48Å; E216-R971 IonicContact OE1-NE 3.83Å; E216-R971 IonicContact OE1-NH1 2.69Å; E216-I972 HydrophobicContact CG-CG1 4.02Å
217	K	88.8	Confident	79.1	Confident	69 Å²	69	44.5 Å²	44.5	30%	0.3	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-16.4	173.4	-75.2	-175.2	161.7	-157.5	0	114.2	S215 E248 T419 F420 S421 K423	S215-K217 PolarHBondContact O-N 3.25Å; K217-E248 IonicContact NZ-OE1 2.65Å; K217-E248 PolarHBondContact NZ-OE1 2.6Å; K217-E248 IonicContact NZ-OE2 3.8Å; K217-E248 PolarHBondContact NZ-OE2 2.95Å; K217-T419 HydrophobicContact CB-CG2 3.81Å; K217-T419 HydrophobicContact CD-CG2 4.43Å; K217-T419 WeakPolarHBondContact O-CA 3.46Å; K217-F420 WeakPolarHBondContact CB-O 3.34Å; K217-F420 WeakPolarHBondContact CD-O 3.49Å; K217-F420 WeakPolarHBondContact CG-O 3.48Å; K217-F420 PolarHBondContact O-N 3.22Å; K217-S421 WeakPolarHBondContact CE-O 3.38Å; K217-S421 PolarHBondContact NZ-O 2.99Å; K217-K423 HydrophobicContact CG-CG 4.43Å
218	T	91.8	Very high	79.6	Confident	15 Å²	15	45.8 Å²	45.8	9%	0.092	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.9	-167.9	-40.7	0	0	0	0	112.5	S215 F417 V418 T419 A462	S215-T218 WeakPolarHBondContact CB-OG1 3.47Å; S215-T218 PolarHBondContact O-N 3.35Å; S215-T218 WeakPolarHBondContact OG-CB 3.46Å; S215-T218 PolarHBondContact OG-N 3.24Å; S215-T218 PolarHBondContact OG-OG1 3.47Å; T218-F417 HydrophobicContact CG2-CB 3.84Å; T218-V418 CarbonylContact C-O 3.54Å; T218-V418 VanDerWaalsContact CA-O 3.27Å; T218-V418 WeakPolarHBondContact CA-O 3.19Å; T218-V418 WeakPolarHBondContact CG2-O 3.35Å; T218-T419 VanDerWaalsContact CG2-OG1 3.3Å; T218-T419 WeakPolarHBondContact CG2-OG1 3.36Å; T218-T419 PolarHBondContact OG1-OG1 3.04Å; T218-A462 HydrophobicContact CG2-CB 4.15Å; T218-A462 VanDerWaalsContact O-CB 3.32Å; T218-A462 WeakPolarHBondContact O-CB 3.22Å; T218-A462 PolarHBondContact O-N 3.08Å
219	L	91.3	Very high	80.4	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	138.8	170.4	-55.3	-174.5	0	0	0	110.3	F417 V418 F420 A426 V429 C430 V459 D460 F461	L219-F417 CarbonylContact O-C 3.58Å; L219-F417 VanDerWaalsContact O-CA 3.32Å; L219-F417 WeakPolarHBondContact O-CA 3.44Å; L219-V418 PolarHBondContact N-O 2.9Å; L219-V418 PolarHBondContact O-N 3.28Å; L219-F420 HydrophobicContact CB-CE2 4.32Å; L219-F420 HydrophobicContact CD1-CD2 4.41Å; L219-F420 HydrophobicContact CD1-CE2 3.62Å; L219-F420 HydrophobicContact CD1-CZ 4.23Å; L219-F420 HydrophobicContact CG-CD2 4.25Å; L219-F420 HydrophobicContact CG-CE2 3.77Å; L219-A426 HydrophobicContact CD2-CB 4.22Å; L219-A426 HydrophobicContact CG-CB 4.36Å; L219-V429 HydrophobicContact CD1-CB 4.02Å; L219-V429 HydrophobicContact CD1-CG1 3.8Å; L219-C430 HydrophobicContact CD1-CB 4.01Å; L219-C430 HydrophobicContact CD2-CB 3.78Å; L219-V459 HydrophobicContact CB-CG1 4.18Å; L219-V459 HydrophobicContact CD1-CG1 3.68Å; L219-V459 HydrophobicContact CG-CG1 4.42Å; L219-D460 CarbonylContact C-O 3.54Å; L219-F461 HydrophobicContact CD2-CD1 3.27Å; L219-F461 HydrophobicContact CD2-CE1 3.59Å; L219-F461 HydrophobicContact CD2-CG 3.92Å; L219-F461 HydrophobicContact CD2-CZ 4.42Å
220	M	90.9	Very high	81.8	Confident	13 Å²	13	45 Å²	45	6%	0.064	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	113.3	166.4	-179.6	178	173.3	0	0	108	I415 F417 D460 A462 L473 W554	M220-I415 HydrophobicContact CE-CD1 4.31Å; M220-I415 HydrophobicContact CE-CG2 3.84Å; M220-I415 HydrophobicContact CG-CG2 4.24Å; M220-F417 HydrophobicContact CB-CD1 3.88Å; M220-F417 HydrophobicContact CB-CE1 3.7Å; M220-F417 HydrophobicContact CG-CD1 4.13Å; M220-F417 HydrophobicContact CG-CE1 3.61Å; M220-F417 HydrophobicContact CG-CZ 4.3Å; M220-F417 HydrophobicContact SD-CE1 3.9Å; M220-F417 HydrophobicContact SD-CZ 4.3Å; M220-D460 PolarHBondContact N-O 2.88Å; M220-D460 PolarHBondContact O-N 3Å; M220-D460 VanDerWaalsContact O-N 3.12Å; M220-D460 VanDerWaalsContact O-O 3.13Å; M220-A462 HydrophobicContact CB-CB 3.94Å; M220-L473 HydrophobicContact CE-CD1 3.91Å; M220-W554 HydrophobicContact CE-CE3 4.21Å; M220-W554 HydrophobicContact CE-CH2 3.83Å; M220-W554 HydrophobicContact CE-CZ3 3.61Å; M220-W554 HydrophobicContact SD-CH2 3.75Å; M220-W554 HydrophobicContact SD-CZ3 3.65Å
221	I	91.1	Very high	83.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126.8	176.7	-53.8	-178.8	0	0	0	107.6	I224 F238 I415 A416 V418 W457 V459	I221-I224 HydrophobicContact CB-CD1 4.2Å; I221-I224 HydrophobicContact CG2-CD1 3.9Å; I221-I224 HydrophobicContact CG2-CG1 3.84Å; I221-F238 HydrophobicContact CD1-CE2 3.48Å; I221-F238 VanDerWaalsContact CD1-CE2 3.48Å; I221-F238 HydrophobicContact CD1-CZ 3.45Å; I221-F238 VanDerWaalsContact CD1-CZ 3.45Å; I221-I415 CarbonylContact O-C 3.58Å; I221-I415 VanDerWaalsContact O-CA 3.27Å; I221-I415 WeakPolarHBondContact O-CA 3.06Å; I221-A416 PolarHBondContact N-O 3.24Å; I221-A416 PolarHBondContact O-N 3.29Å; I221-V418 HydrophobicContact CD1-CB 4.31Å; I221-V418 HydrophobicContact CD1-CG2 3.53Å; I221-V418 HydrophobicContact CG1-CG2 4.22Å; I221-W457 HydrophobicContact CD1-CE3 4.38Å; I221-W457 HydrophobicContact CD1-CZ3 4.06Å; I221-W457 HydrophobicContact CG2-CB 4.2Å; I221-W457 HydrophobicContact CG2-CD2 3.55Å; I221-W457 HydrophobicContact CG2-CE3 3.52Å; I221-W457 HydrophobicContact CG2-CG 3.91Å; I221-W457 HydrophobicContact CG2-CH2 4.48Å; I221-W457 HydrophobicContact CG2-CZ3 4.02Å; I221-V459 HydrophobicContact CG1-CG2 4.32Å; I221-V459 HydrophobicContact CG2-CG2 4.4Å
222	S	87.8	Confident	84.5	Confident	37 Å²	37	44.8 Å²	44.8	26%	0.259	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.8	178.6	63.4	0	0	0	0	111.3	W457 S458	S222-W457 CarbonylContact O-C 3.3Å; S222-W457 VanDerWaalsContact O-CA 3.28Å; S222-W457 WeakPolarHBondContact O-CA 3.46Å; S222-S458 PolarHBondContact N-O 2.95Å; S222-S458 PolarHBondContact O-N 3.42Å; S222-S458 PolarHBondContact OG-O 2.8Å
223	G	83.9	Confident	85.8	Confident	39 Å²	39	46.2 Å²	46.2	40%	0.402	24%	0.238	S	C	.	.			trans	100.2	11.5	-174.4	0	0	0	0	0	114.4	G414	G223-G414 PolarHBondContact N-O 3.11Å
224	I	88.4	Confident	87	Confident	5 Å²	5	45.6 Å²	45.6	3%	0.026	24%	0.235	C	C	.	.			trans	-66.8	138.7	177.5	-48.8	178.4	0	0	0	109.9	I221 R226 C229 I234 G414 A416 L452 W457	I221-I224 HydrophobicContact CB-CD1 4.2Å; I221-I224 HydrophobicContact CG2-CD1 3.9Å; I221-I224 HydrophobicContact CG2-CG1 3.84Å; I224-R226 PolarHBondContact O-N 3.02Å; I224-C229 HydrophobicContact CG2-CB 3.97Å; I224-I234 HydrophobicContact CD1-CD1 3.88Å; I224-G414 PolarHBondContact N-O 3.15Å; I224-G414 VanDerWaalsContact O-CA 3.24Å; I224-G414 WeakPolarHBondContact O-CA 3.25Å; I224-A416 HydrophobicContact CD1-CB 3.63Å; I224-L452 HydrophobicContact CG2-CD2 4.05Å; I224-W457 HydrophobicContact CG1-CZ2 4.06Å; I224-W457 HydrophobicContact CG2-CZ2 4.27Å
225	S	88.3	Confident	88	Confident	20 Å²	20	48 Å²	48	14%	0.14	25%	0.247	C	C	.	.			trans	-53.6	110.5	175.5	-179.1	0	0	0	0	111.9	R227 N228 C229 V451 L452	S225-R227 PolarHBondContact O-N 2.74Å; S225-R227 VanDerWaalsContact O-N 3.1Å; S225-N228 CarbonylContact O-C 3.46Å; S225-N228 PolarHBondContact O-N 2.88Å; S225-C229 WeakPolarHBondContact O-CB 3.47Å; S225-C229 PolarHBondContact O-N 2.9Å; S225-V451 WeakPolarHBondContact CB-O 3.36Å; S225-L452 PolarHBondContact N-O 3.32Å
226	R	86	Confident	88.5	Confident	135 Å²	135	53 Å²	53	51%	0.509	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-28.8	-176.7	-73.1	-177.3	173.1	-173.9	-10	115	I224 P412 I413	I224-R226 PolarHBondContact O-N 3.02Å; R226-P412 WeakPolarHBondContact O-CG 3.43Å; R226-I413 PolarHBondContact NE-O 3.27Å; R226-I413 PolarHBondContact NH2-O 2.91Å
227	R	84.8	Confident	88.9	Confident	231 Å²	231	52.6 Å²	52.6	87%	0.872	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-27.6	177.1	-74.7	-173.9	-85.6	159.6	-9.6	112.7	S225	S225-R227 PolarHBondContact O-N 2.74Å; S225-R227 VanDerWaalsContact O-N 3.1Å
228	N	84.3	Confident	89	Confident	55 Å²	55	49.3 Å²	49.3	29%	0.294	25%	0.245	S	C	.	.	S	Bend	trans	-120.6	18.3	-167.8	-49.4	-18.5	0	0	0	111.8	S225 S230 L233 V451 L452	S225-N228 CarbonylContact O-C 3.46Å; S225-N228 PolarHBondContact O-N 2.88Å; N228-S230 VanDerWaalsContact C-N 3.35Å; N228-S230 PolarHBondContact O-N 3.11Å; N228-L233 HydrophobicContact CB-CD1 4.28Å; N228-L233 WeakPolarHBondContact O-CD1 3.5Å; N228-V451 HydrophobicContact CB-CG1 3.81Å; N228-V451 WeakPolarHBondContact ND2-CG1 3.36Å; N228-V451 PolarHBondContact ND2-O 3.48Å; N228-L452 WeakPolarHBondContact O-CD2 3.12Å
229	C	85.4	Confident	88.9	Confident	12 Å²	12	51.7 Å²	51.7	8%	0.081	27%	0.266	C	S	.	.			trans	-82.4	76.4	-176.2	-174.9	0	0	0	0	110.2	I224 S225 I252 P412	I224-C229 HydrophobicContact CG2-CB 3.97Å; S225-C229 WeakPolarHBondContact O-CB 3.47Å; S225-C229 PolarHBondContact O-N 2.9Å; C229-I252 WeakPolarHBondContact O-CD1 3.49Å; C229-P412 HydrophobicContact CB-CB 4.2Å; C229-P412 HydrophobicContact CB-CG 4.01Å
230	S	87.9	Confident	88.8	Confident	45 Å²	45	55.2 Å²	55.2	32%	0.315	28%	0.282	S	S	.	.			trans	-115	152.6	179.3	81.3	0	0	0	0	112.8	N228 A232 L233 I234	N228-S230 VanDerWaalsContact C-N 3.35Å; N228-S230 PolarHBondContact O-N 3.11Å; S230-A232 VanDerWaalsContact C-N 3.32Å; S230-A232 PolarHBondContact O-N 2.95Å; S230-L233 PolarHBondContact O-N 3.07Å; S230-L233 WeakPolarHBondContact OG-CG 3.48Å; S230-L233 PolarHBondContact OG-N 3.42Å; S230-I234 WeakPolarHBondContact O-CG1 3.37Å; S230-I234 PolarHBondContact O-N 3.18Å
231	R	91.2	Very high	88.6	Confident	118 Å²	118	56.5 Å²	56.5	45%	0.445	29%	0.289	S	S	.	.	H	α-helix	trans	-60.7	-43.1	-177.8	-163.5	-178.1	-175.2	-108.5	5	111.1	I234 L235 D249 V250 I252	R231-I234 PolarHBondContact O-N 3Å; R231-L235 HydrophobicContact CG-CD1 4.01Å; R231-L235 WeakPolarHBondContact O-CB 3.41Å; R231-L235 WeakPolarHBondContact O-CG 3.44Å; R231-L235 PolarHBondContact O-N 3.22Å; R231-D249 IonicContact CZ-OD1 3.2Å; R231-D249 IonicContact NE-OD1 2.81Å; R231-D249 PolarHBondContact NE-OD1 2.83Å; R231-D249 IonicContact NH2-OD1 3.78Å; R231-D249 PolarHBondContact NH2-OD1 3.45Å; R231-V250 HydrophobicContact CG-CB 3.96Å; R231-V250 HydrophobicContact CG-CG1 4.31Å; R231-V250 PolarHBondContact NE-O 3.28Å; R231-I252 HydrophobicContact CB-CD1 4.39Å
232	A	90.8	Very high	88.4	Confident	72 Å²	72	57.5 Å²	57.5	60%	0.595	29%	0.293	S	S	*	.	H	α-helix	trans	-64.1	-43.4	179.8	0	0	0	0	0	113.1	S230 L235 R236	S230-A232 VanDerWaalsContact C-N 3.32Å; S230-A232 PolarHBondContact O-N 2.95Å; A232-L235 PolarHBondContact O-N 2.83Å; A232-R236 VanDerWaalsContact O-CB 3.22Å; A232-R236 WeakPolarHBondContact O-CB 3.48Å; A232-R236 PolarHBondContact O-N 3.18Å
233	L	90.6	Very high	88.4	Confident	48 Å²	48	60.2 Å²	60.2	25%	0.251	31%	0.31	S	S	.	.	H	α-helix	trans	-66.1	-40.3	178.5	-72	171.3	0	0	0	111.7	N228 S230 H237 T448 V451 L452	N228-L233 HydrophobicContact CB-CD1 4.28Å; N228-L233 WeakPolarHBondContact O-CD1 3.5Å; S230-L233 PolarHBondContact O-N 3.07Å; S230-L233 WeakPolarHBondContact OG-CG 3.48Å; S230-L233 PolarHBondContact OG-N 3.42Å; L233-H237 WeakPolarHBondContact O-CB 3.24Å; L233-H237 PolarHBondContact O-N 2.93Å; L233-T448 HydrophobicContact CD2-CG2 3.64Å; L233-V451 HydrophobicContact CD1-CG1 4.26Å; L233-L452 HydrophobicContact CB-CD1 4.32Å; L233-L452 HydrophobicContact CB-CD2 3.96Å; L233-L452 HydrophobicContact CB-CG 4.34Å
234	I	90.7	Very high	88.5	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-69.7	-41.7	178.3	-62.1	165.7	0	0	0	111.1	I224 S230 R231 H237 F238 V250 I252 A416 V418 L452	I224-I234 HydrophobicContact CD1-CD1 3.88Å; S230-I234 WeakPolarHBondContact O-CG1 3.37Å; S230-I234 PolarHBondContact O-N 3.18Å; R231-I234 PolarHBondContact O-N 3Å; I234-H237 WeakPolarHBondContact O-CB 3.27Å; I234-H237 PolarHBondContact O-N 3.1Å; I234-F238 HydrophobicContact CG2-CD2 4.05Å; I234-F238 HydrophobicContact CG2-CE2 3.95Å; I234-F238 VanDerWaalsContact O-CD2 3.28Å; I234-F238 WeakPolarHBondContact O-CD2 3.48Å; I234-F238 PolarHBondContact O-N 3.41Å; I234-V250 HydrophobicContact CB-CG1 4.04Å; I234-V250 HydrophobicContact CD1-CG1 4.09Å; I234-V250 HydrophobicContact CG2-CG1 3.78Å; I234-V250 HydrophobicContact CG2-CG2 4.16Å; I234-I252 HydrophobicContact CD1-CG1 4.49Å; I234-A416 HydrophobicContact CD1-CB 3.92Å; I234-V418 HydrophobicContact CG2-CG2 4.01Å; I234-L452 HydrophobicContact CG1-CD2 4.32Å
235	L	92.2	Very high	88.5	Confident	50 Å²	50	66 Å²	66	26%	0.262	33%	0.327	S	S	.	.	H	α-helix	trans	-61.3	-47.4	174.1	-76.5	169.2	0	0	0	111.4	R231 A232 H237 F238 A239 V247 V250	R231-L235 HydrophobicContact CG-CD1 4.01Å; R231-L235 WeakPolarHBondContact O-CB 3.41Å; R231-L235 WeakPolarHBondContact O-CG 3.44Å; R231-L235 PolarHBondContact O-N 3.22Å; A232-L235 PolarHBondContact O-N 2.83Å; L235-H237 VanDerWaalsContact C-N 3.32Å; L235-H237 PolarHBondContact O-N 3.03Å; L235-F238 PolarHBondContact O-N 3.45Å; L235-A239 WeakPolarHBondContact O-CB 3.49Å; L235-A239 PolarHBondContact O-N 2.93Å; L235-V247 HydrophobicContact CD2-CB 3.98Å; L235-V247 HydrophobicContact CD2-CG1 3.7Å; L235-V250 HydrophobicContact CD2-CG2 3.64Å; L235-V250 HydrophobicContact CG-CG2 3.88Å
236	R	90.3	Very high	88.5	Confident	140 Å²	140	68.6 Å²	68.6	53%	0.528	34%	0.343	S	S	.	.	H	α-helix	trans	-60.5	-40.5	177	-176.8	171.2	175.6	151.3	9.7	112.1	A232 F238 A239 E240 S447 T448	A232-R236 VanDerWaalsContact O-CB 3.22Å; A232-R236 WeakPolarHBondContact O-CB 3.48Å; A232-R236 PolarHBondContact O-N 3.18Å; R236-F238 PolarHBondContact O-N 3.48Å; R236-A239 PolarHBondContact O-N 3.47Å; R236-E240 HydrophobicContact CG-CG 4.25Å; R236-E240 IonicContact CZ-OE1 3.98Å; R236-E240 VanDerWaalsContact CZ-OE1 3.25Å; R236-E240 IonicContact NE-OE1 2.69Å; R236-E240 PolarHBondContact NE-OE1 3.47Å; R236-E240 IonicContact NH2-OE1 2.69Å; R236-E240 PolarHBondContact NH2-OE1 3.19Å; R236-E240 WeakPolarHBondContact O-CB 3.32Å; R236-E240 WeakPolarHBondContact O-CG 3.46Å; R236-E240 PolarHBondContact O-N 2.66Å; R236-S447 PolarHBondContact NE-OG 2.78Å; R236-S447 PolarHBondContact NH2-OG 2.69Å; R236-T448 HydrophobicContact CB-CG2 4.33Å; R236-T448 HydrophobicContact CG-CG2 4.09Å
237	H	90.4	Very high	88.8	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-56.9	-44.6	174.8	-179.8	73.3	0	0	0	113.1	L233 I234 L235 L241 Y433 S446 T448 S449 L452 W457	L233-H237 WeakPolarHBondContact O-CB 3.24Å; L233-H237 PolarHBondContact O-N 2.93Å; I234-H237 WeakPolarHBondContact O-CB 3.27Å; I234-H237 PolarHBondContact O-N 3.1Å; L235-H237 VanDerWaalsContact C-N 3.32Å; L235-H237 PolarHBondContact O-N 3.03Å; H237-L241 WeakPolarHBondContact CE1-CD1 3.1Å; H237-L241 WeakPolarHBondContact O-CG 3.44Å; H237-L241 PolarHBondContact O-N 2.87Å; H237-Y433 PolarHBondContact NE2-OH 3.31Å; H237-S446 PolarHBondContact ND1-OG 3.26Å; H237-T448 WeakPolarHBondContact CA-OG1 3.24Å; H237-T448 WeakPolarHBondContact CB-OG1 3.39Å; H237-S449 PolarHBondContact CE1-OG 3.32Å; H237-L452 HydrophobicContact CB-CD1 3.75Å; H237-W457 AromaticContact CD2-CH2 3.67Å; H237-W457 AromaticContact CD2-CZ3 3.56Å; H237-W457 AromaticContact NE2-CH2 3.96Å; H237-W457 AromaticContact NE2-CZ3 3.55Å
238	F	91	Very high	89.1	Confident	1 Å²	1	57.6 Å²	57.6	0%	0.004	31%	0.309	C	S	.	.	H	α-helix	trans	-76.8	-36.8	179	-75.7	-66	0	0	0	112.8	I221 I234 L235 R236 E240 L241 Y242 V247 V418 F420 V429 Y433 W457	I221-F238 HydrophobicContact CD1-CE2 3.48Å; I221-F238 VanDerWaalsContact CD1-CE2 3.48Å; I221-F238 HydrophobicContact CD1-CZ 3.45Å; I221-F238 VanDerWaalsContact CD1-CZ 3.45Å; I234-F238 HydrophobicContact CG2-CD2 4.05Å; I234-F238 HydrophobicContact CG2-CE2 3.95Å; I234-F238 VanDerWaalsContact O-CD2 3.28Å; I234-F238 WeakPolarHBondContact O-CD2 3.48Å; I234-F238 PolarHBondContact O-N 3.41Å; L235-F238 PolarHBondContact O-N 3.45Å; R236-F238 PolarHBondContact O-N 3.48Å; F238-E240 PolarHBondContact O-N 2.73Å; F238-L241 PolarHBondContact O-N 2.71Å; F238-Y242 AromaticContact CD1-CD2 3.91Å; F238-Y242 HydrophobicContact CD1-CD2 3.91Å; F238-Y242 HydrophobicContact CD1-CE2 4.33Å; F238-Y242 HydrophobicContact CE1-CD2 4.41Å; F238-Y242 HydrophobicContact CE1-CE2 4.4Å; F238-Y242 CarbonylContact O-C 3.07Å; F238-Y242 WeakPolarHBondContact O-CA 3.48Å; F238-Y242 PolarHBondContact O-N 2.92Å; F238-V247 HydrophobicContact CB-CG2 3.95Å; F238-V247 HydrophobicContact CG-CG2 4.39Å; F238-V418 HydrophobicContact CD2-CG1 4.2Å; F238-V418 HydrophobicContact CE2-CG1 4.24Å; F238-V418 HydrophobicContact CE2-CG2 4.17Å; F238-F420 HydrophobicContact CD1-CE1 4.37Å; F238-F420 HydrophobicContact CD1-CZ 4.17Å; F238-F420 HydrophobicContact CE1-CZ 4.28Å; F238-F420 HydrophobicContact CG-CZ 4.49Å; F238-V429 HydrophobicContact CD1-CG1 4.27Å; F238-V429 HydrophobicContact CE1-CG1 3.56Å; F238-V429 HydrophobicContact CZ-CG1 4.38Å; F238-Y433 HydrophobicContact CE1-CE2 4.35Å; F238-W457 HydrophobicContact CE2-CZ3 4.23Å; F238-W457 AromaticContact CZ-CZ3 3.98Å; F238-W457 HydrophobicContact CZ-CZ3 3.98Å
239	A	90.3	Very high	89.4	Confident	65 Å²	65	56.9 Å²	56.9	54%	0.537	31%	0.306	S	S	.	.	H	α-helix	trans	-63.8	-37.3	174.8	0	0	0	0	0	112.9	L235 R236	L235-A239 WeakPolarHBondContact O-CB 3.49Å; L235-A239 PolarHBondContact O-N 2.93Å; R236-A239 PolarHBondContact O-N 3.47Å
240	E	89.6	Confident	89.8	Confident	73 Å²	73	56.5 Å²	56.5	34%	0.341	30%	0.303	S	S	.	.	H	α-helix	trans	-75.8	-20.5	178.5	-74.5	179.7	176.7	0	0	114.1	R236 F238 S446 S447	R236-E240 HydrophobicContact CG-CG 4.25Å; R236-E240 IonicContact CZ-OE1 3.98Å; R236-E240 VanDerWaalsContact CZ-OE1 3.25Å; R236-E240 IonicContact NE-OE1 2.69Å; R236-E240 PolarHBondContact NE-OE1 3.47Å; R236-E240 IonicContact NH2-OE1 2.69Å; R236-E240 PolarHBondContact NH2-OE1 3.19Å; R236-E240 WeakPolarHBondContact O-CB 3.32Å; R236-E240 WeakPolarHBondContact O-CG 3.46Å; R236-E240 PolarHBondContact O-N 2.66Å; F238-E240 PolarHBondContact O-N 2.73Å; E240-S446 WeakPolarHBondContact OE2-CB 3.48Å; E240-S447 PolarHBondContact OE1-OG 3.3Å; E240-S447 WeakPolarHBondContact OE2-CB 3.46Å; E240-S447 PolarHBondContact OE2-N 3.14Å; E240-S447 PolarHBondContact OE2-OG 2.65Å
241	L	85.8	Confident	90	Very high	40 Å²	40	57.5 Å²	57.5	21%	0.209	30%	0.302	C	S	.	.	H	α-helix	trans	-111.9	-26.5	-175.7	-66.5	-179.6	0	0	0	114.7	H237 F238 I444	H237-L241 WeakPolarHBondContact CE1-CD1 3.1Å; H237-L241 WeakPolarHBondContact O-CG 3.44Å; H237-L241 PolarHBondContact O-N 2.87Å; F238-L241 PolarHBondContact O-N 2.71Å; L241-I444 HydrophobicContact CD1-CG2 3.87Å; L241-I444 HydrophobicContact CD2-CG2 3.63Å; L241-I444 HydrophobicContact CG-CG2 4.27Å
242	Y	87.5	Confident	90	Very high	22 Å²	22	52.9 Å²	52.9	9%	0.086	29%	0.286	C	S	.	.			trans	-142.7	65.1	-175	-53.1	-87.4	0	0	0	110.1	F238 E244 C245 H428 V429 E432 Y433	F238-Y242 AromaticContact CD1-CD2 3.91Å; F238-Y242 HydrophobicContact CD1-CD2 3.91Å; F238-Y242 HydrophobicContact CD1-CE2 4.33Å; F238-Y242 HydrophobicContact CE1-CD2 4.41Å; F238-Y242 HydrophobicContact CE1-CE2 4.4Å; F238-Y242 CarbonylContact O-C 3.07Å; F238-Y242 WeakPolarHBondContact O-CA 3.48Å; F238-Y242 PolarHBondContact O-N 2.92Å; Y242-E244 PolarHBondContact O-N 3.38Å; Y242-C245 WeakPolarHBondContact O-CA 3.36Å; Y242-C245 WeakPolarHBondContact O-CB 3.21Å; Y242-C245 PolarHBondContact O-N 2.88Å; Y242-H428 AromaticContact CD1-ND1 4Å; Y242-V429 HydrophobicContact CD1-CG2 3.99Å; Y242-V429 HydrophobicContact CD2-CG2 4.05Å; Y242-V429 HydrophobicContact CE1-CG2 4.23Å; Y242-V429 HydrophobicContact CE2-CG1 4.47Å; Y242-V429 HydrophobicContact CE2-CG2 4.31Å; Y242-V429 HydrophobicContact CG-CG2 3.89Å; Y242-E432 HydrophobicContact CE1-CG 4.43Å; Y242-Y433 HydrophobicContact CE2-CE2 4.41Å
243	P	86.8	Confident	90	Very high	93 Å²	93	49.8 Å²	49.8	60%	0.604	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.1	177.7	23.1	-33.6	0	0	0	112.2	C245	P243-C245 PolarHBondContact O-N 2.76Å
244	E	86.4	Confident	89.9	Confident	163 Å²	163	49.5 Å²	49.5	76%	0.762	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-13.9	172.2	-53	-49.7	138.1	0	0	115.1	Y242 P246	Y242-E244 PolarHBondContact O-N 3.38Å; E244-P246 VanDerWaalsContact O-CD 3.24Å; E244-P246 WeakPolarHBondContact O-CD 3.49Å
245	C	88.2	Confident	89.8	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.02	27%	0.269	C	S	.	.	S	Bend	trans	-119.6	64.5	-171.5	-66.9	0	0	0	0	111.7	Y242 P243 V247 F420 A425 V429	Y242-C245 WeakPolarHBondContact O-CA 3.36Å; Y242-C245 WeakPolarHBondContact O-CB 3.21Å; Y242-C245 PolarHBondContact O-N 2.88Å; P243-C245 PolarHBondContact O-N 2.76Å; C245-V247 PolarHBondContact O-N 2.87Å; C245-F420 HydrophobicContact CB-CD1 4.14Å; C245-F420 HydrophobicContact CB-CE1 4.27Å; C245-F420 WeakPolarHBondContact O-CD1 3.35Å; C245-A425 HydrophobicContact CB-CB 3.7Å; C245-V429 HydrophobicContact CB-CG2 4.3Å
246	P	89.1	Confident	89.4	Confident	74 Å²	74	50.6 Å²	50.6	48%	0.481	26%	0.263	S	S	.	.			trans	-61.7	136.9	-175.3	20.8	-29.3	0	0	0	112.6	E244 S421	E244-P246 VanDerWaalsContact O-CD 3.24Å; E244-P246 WeakPolarHBondContact O-CD 3.49Å; P246-S421 PolarHBondContact O-N 3.4Å; P246-S421 PolarHBondContact O-OG 3.07Å
247	V	91.2	Very high	89.1	Confident	33 Å²	33	49.5 Å²	49.5	20%	0.2	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.4	-175.8	175.9	0	0	0	0	109.6	L235 F238 C245 D249 V250 V418 T419 F420	L235-V247 HydrophobicContact CD2-CB 3.98Å; L235-V247 HydrophobicContact CD2-CG1 3.7Å; F238-V247 HydrophobicContact CB-CG2 3.95Å; F238-V247 HydrophobicContact CG-CG2 4.39Å; C245-V247 PolarHBondContact O-N 2.87Å; V247-D249 WeakPolarHBondContact CG1-O 3.49Å; V247-V250 HydrophobicContact CG1-CG2 3.66Å; V247-V418 HydrophobicContact CG1-CG1 3.69Å; V247-V418 HydrophobicContact CG2-CG1 3.96Å; V247-T419 CarbonylContact C-O 3.52Å; V247-T419 WeakPolarHBondContact CA-O 3.43Å; V247-T419 WeakPolarHBondContact CG1-O 3.29Å; V247-F420 HydrophobicContact CG2-CD1 3.92Å; V247-F420 HydrophobicContact CG2-CE1 3.68Å; V247-F420 HydrophobicContact CG2-CZ 4.27Å
248	E	90.7	Very high	89	Confident	103 Å²	103	55.6 Å²	55.6	48%	0.481	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	-45	175.1	-65.9	178.5	160.8	0	0	111.4	K217 T419 S421	K217-E248 IonicContact NZ-OE1 2.65Å; K217-E248 PolarHBondContact NZ-OE1 2.6Å; K217-E248 IonicContact NZ-OE2 3.8Å; K217-E248 PolarHBondContact NZ-OE2 2.95Å; E248-T419 HydrophobicContact CB-CG2 4.31Å; E248-T419 PolarHBondContact N-O 3.27Å; E248-T419 VanDerWaalsContact OE2-CG2 3.27Å; E248-T419 WeakPolarHBondContact OE2-CG2 3.49Å; E248-S421 WeakPolarHBondContact OE1-CA 3.34Å
249	D	92.5	Very high	88.8	Confident	40 Å²	40	56 Å²	56	21%	0.214	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	155.4	-177.9	-170.4	27	0	0	0	113.3	R231 V247 Q251 V418 T419	R231-D249 IonicContact CZ-OD1 3.2Å; R231-D249 IonicContact NE-OD1 2.81Å; R231-D249 PolarHBondContact NE-OD1 2.83Å; R231-D249 IonicContact NH2-OD1 3.78Å; R231-D249 PolarHBondContact NH2-OD1 3.45Å; V247-D249 WeakPolarHBondContact CG1-O 3.49Å; D249-Q251 WeakPolarHBondContact OD2-CG 3.31Å; D249-Q251 PolarHBondContact OD2-NE2 2.66Å; D249-V418 WeakPolarHBondContact O-CA 3.48Å; D249-T419 PolarHBondContact N-O 3.3Å; D249-T419 PolarHBondContact O-N 2.83Å
250	V	92.8	Very high	88.5	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.024	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	113.9	174	176.5	0	0	0	0	109.4	R231 I234 L235 V247 A416 F417 V418	R231-V250 HydrophobicContact CG-CB 3.96Å; R231-V250 HydrophobicContact CG-CG1 4.31Å; R231-V250 PolarHBondContact NE-O 3.28Å; I234-V250 HydrophobicContact CB-CG1 4.04Å; I234-V250 HydrophobicContact CD1-CG1 4.09Å; I234-V250 HydrophobicContact CG2-CG1 3.78Å; I234-V250 HydrophobicContact CG2-CG2 4.16Å; L235-V250 HydrophobicContact CD2-CG2 3.64Å; L235-V250 HydrophobicContact CG-CG2 3.88Å; V247-V250 HydrophobicContact CG1-CG2 3.66Å; V250-A416 HydrophobicContact CG1-CB 4.49Å; V250-F417 CarbonylContact C-O 3.05Å; V250-F417 WeakPolarHBondContact CA-O 3.45Å; V250-V418 HydrophobicContact CG1-CG2 4.34Å; V250-V418 HydrophobicContact CG2-CG1 4.19Å; V250-V418 HydrophobicContact CG2-CG2 4.14Å
251	Q	92.4	Very high	88.3	Confident	65 Å²	65	58.9 Å²	58.9	30%	0.304	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121.5	-179.4	-57.5	-175.4	9.6	0	0	110.9	D249 A416 F417	D249-Q251 WeakPolarHBondContact OD2-CG 3.31Å; D249-Q251 PolarHBondContact OD2-NE2 2.66Å; Q251-A416 CarbonylContact O-C 3.58Å; Q251-A416 VanDerWaalsContact O-CA 3.26Å; Q251-A416 WeakPolarHBondContact O-CA 3.24Å; Q251-F417 HydrophobicContact CB-CB 4.48Å; Q251-F417 PolarHBondContact N-O 3.19Å; Q251-F417 PolarHBondContact O-N 3.07Å
252	I	91.4	Very high	88.4	Confident	21 Å²	21	58.1 Å²	58.1	11%	0.108	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	140.7	-177.9	-66.9	158.3	0	0	0	110.5	C229 R231 I234 Y254 P412 A416	C229-I252 WeakPolarHBondContact O-CD1 3.49Å; R231-I252 HydrophobicContact CB-CD1 4.39Å; I234-I252 HydrophobicContact CD1-CG1 4.49Å; I252-Y254 HydrophobicContact CB-CE1 4.48Å; I252-Y254 HydrophobicContact CB-CE2 4.26Å; I252-Y254 HydrophobicContact CG2-CD1 4.41Å; I252-Y254 HydrophobicContact CG2-CE1 3.82Å; I252-Y254 HydrophobicContact CG2-CE2 4.32Å; I252-Y254 WeakPolarHBondContact O-CD2 3.41Å; I252-Y254 WeakPolarHBondContact O-CE2 3.45Å; I252-P412 HydrophobicContact CG2-CB 3.63Å; I252-A416 HydrophobicContact CG1-CB 4.5Å
253	C	89.8	Confident	88.3	Confident	8 Å²	8	59 Å²	59	5%	0.054	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	129.5	178.4	-63.8	0	0	0	0	112.3	I413 I415 F417 L473	C253-I413 HydrophobicContact CB-CD1 4.21Å; C253-I413 PolarHBondContact O-N 3.49Å; C253-I415 HydrophobicContact CB-CB 3.98Å; C253-I415 HydrophobicContact CB-CG2 4.3Å; C253-I415 WeakPolarHBondContact CB-O 3.13Å; C253-I415 PolarHBondContact N-O 2.91Å; C253-F417 WeakPolarHBondContact SG-CE2 3.47Å; C253-L473 HydrophobicContact CB-CD2 4.33Å
254	Y	89.6	Confident	88	Confident	42 Å²	42	58.4 Å²	58.4	17%	0.165	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	163.6	177.8	-47.5	-84.3	0	0	0	111.6	I252 T256 I409 P412 I413 L984	I252-Y254 HydrophobicContact CB-CE1 4.48Å; I252-Y254 HydrophobicContact CB-CE2 4.26Å; I252-Y254 HydrophobicContact CG2-CD1 4.41Å; I252-Y254 HydrophobicContact CG2-CE1 3.82Å; I252-Y254 HydrophobicContact CG2-CE2 4.32Å; I252-Y254 WeakPolarHBondContact O-CD2 3.41Å; I252-Y254 WeakPolarHBondContact O-CE2 3.45Å; Y254-T256 PolarHBondContact O-N 3.25Å; Y254-I409 HydrophobicContact CE1-CG1 3.97Å; Y254-I409 VanDerWaalsContact CE1-O 3.25Å; Y254-I409 WeakPolarHBondContact CE1-O 3.32Å; Y254-P412 HydrophobicContact CD1-CB 4.08Å; Y254-P412 HydrophobicContact CE1-CB 4.08Å; Y254-I413 VanDerWaalsContact O-CD1 3.26Å; Y254-I413 WeakPolarHBondContact O-CD1 3.37Å; Y254-L984 HydrophobicContact CE2-CD1 4.37Å
255	D	87.5	Confident	87.9	Confident	48 Å²	48	54.8 Å²	54.8	26%	0.257	27%	0.265	S	S	.	.			trans	-74.6	87.7	178.9	-171.6	1	0	0	0	112.4	R257 T408 A474	D255-R257 VanDerWaalsContact C-N 3.29Å; D255-R257 PolarHBondContact O-N 3.17Å; D255-R257 WeakPolarHBondContact OD1-CB 3.15Å; D255-R257 VanDerWaalsContact OD1-CG 3.23Å; D255-R257 WeakPolarHBondContact OD1-CG 3.49Å; D255-R257 IonicContact OD1-CZ 3.67Å; D255-R257 PolarHBondContact OD1-N 2.87Å; D255-R257 IonicContact OD1-NE 3.67Å; D255-R257 PolarHBondContact OD1-NE 3.48Å; D255-R257 IonicContact OD1-NH2 3.59Å; D255-R257 IonicContact OD2-CZ 3.83Å; D255-R257 IonicContact OD2-NE 2.73Å; D255-R257 PolarHBondContact OD2-NE 3.47Å; D255-R257 IonicContact OD2-NH2 3.81Å; D255-R257 PolarHBondContact OD2-NH2 2.89Å; D255-T408 VanDerWaalsContact O-CG2 3.31Å; D255-T408 WeakPolarHBondContact O-CG2 3.38Å; D255-T408 PolarHBondContact O-OG1 2.75Å; D255-A474 HydrophobicContact CB-CB 4.1Å; D255-A474 WeakPolarHBondContact OD1-CB 3.28Å
256	T	84.9	Confident	87.9	Confident	24 Å²	24	56.2 Å²	56.2	15%	0.147	27%	0.27	C	S	.	.			trans	-81.3	2.4	-178.5	53.4	0	0	0	0	114.2	Y254 K258 L259 I260	Y254-T256 PolarHBondContact O-N 3.25Å; T256-K258 PolarHBondContact O-N 2.97Å; T256-L259 PolarHBondContact O-N 3.02Å; T256-L259 VanDerWaalsContact O-N 3.11Å; T256-I260 WeakPolarHBondContact O-CG1 3.15Å; T256-I260 PolarHBondContact O-N 3.38Å; T256-I260 WeakPolarHBondContact OG1-CD1 3.33Å
257	R	84.2	Confident	87.5	Confident	117 Å²	117	54.7 Å²	54.7	44%	0.442	26%	0.258	S	S	.	.	H	α-helix	trans	-55.1	-44.4	-172.9	-73.9	-179.7	-66.8	174	-0.5	114.1	D255 K261 A471	D255-R257 VanDerWaalsContact C-N 3.29Å; D255-R257 PolarHBondContact O-N 3.17Å; D255-R257 WeakPolarHBondContact OD1-CB 3.15Å; D255-R257 VanDerWaalsContact OD1-CG 3.23Å; D255-R257 WeakPolarHBondContact OD1-CG 3.49Å; D255-R257 IonicContact OD1-CZ 3.67Å; D255-R257 PolarHBondContact OD1-N 2.87Å; D255-R257 IonicContact OD1-NE 3.67Å; D255-R257 PolarHBondContact OD1-NE 3.48Å; D255-R257 IonicContact OD1-NH2 3.59Å; D255-R257 IonicContact OD2-CZ 3.83Å; D255-R257 IonicContact OD2-NE 2.73Å; D255-R257 PolarHBondContact OD2-NE 3.47Å; D255-R257 IonicContact OD2-NH2 3.81Å; D255-R257 PolarHBondContact OD2-NH2 2.89Å; R257-K261 PolarHBondContact O-N 3Å; R257-A471 WeakPolarHBondContact CD-O 3.36Å; R257-A471 HydrophobicContact CG-CB 4.39Å; R257-A471 WeakPolarHBondContact CG-O 3.3Å
258	K	86.6	Confident	86.9	Confident	128 Å²	128	56.2 Å²	56.2	56%	0.557	27%	0.267	S	S	*	.	H	α-helix	trans	-71.8	-44.1	176.2	-72.1	-169.1	173.6	-169.6	0	111.8	T256 I260 K261 L262	T256-K258 PolarHBondContact O-N 2.97Å; K258-I260 PolarHBondContact O-N 2.8Å; K258-K261 WeakPolarHBondContact O-CB 3.27Å; K258-K261 PolarHBondContact O-N 3.46Å; K258-K261 VanDerWaalsContact O-N 3.1Å; K258-L262 WeakPolarHBondContact O-CG 3.43Å; K258-L262 PolarHBondContact O-N 3.49Å
259	L	87.5	Confident	86.6	Confident	10 Å²	10	51.6 Å²	51.6	5%	0.052	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-46.3	179.6	-65.4	172.6	0	0	0	111.8	T256 K261 L262 E263 I401 H404 T408	T256-L259 PolarHBondContact O-N 3.02Å; T256-L259 VanDerWaalsContact O-N 3.11Å; L259-K261 VanDerWaalsContact C-N 3.28Å; L259-K261 PolarHBondContact O-N 2.78Å; L259-L262 PolarHBondContact O-N 2.67Å; L259-E263 VanDerWaalsContact O-CB 3.3Å; L259-E263 WeakPolarHBondContact O-CB 3.37Å; L259-E263 PolarHBondContact O-N 2.95Å; L259-I401 HydrophobicContact CD2-CG2 4.41Å; L259-H404 HydrophobicContact CD2-CB 3.9Å; L259-T408 HydrophobicContact CD1-CG2 3.95Å
260	I	83.4	Confident	86.4	Confident	59 Å²	59	54.4 Å²	54.4	30%	0.303	25%	0.254	S	S	.	.	H	α-helix	trans	-60.2	-37.5	176.1	-68	166.9	0	0	0	111.2	T256 K258 N264 W470 A471	T256-I260 WeakPolarHBondContact O-CG1 3.15Å; T256-I260 PolarHBondContact O-N 3.38Å; T256-I260 WeakPolarHBondContact OG1-CD1 3.33Å; K258-I260 PolarHBondContact O-N 2.8Å; I260-N264 WeakPolarHBondContact O-CB 3.42Å; I260-N264 PolarHBondContact O-N 2.94Å; I260-N264 VanDerWaalsContact O-N 3.14Å; I260-N264 PolarHBondContact O-ND2 2.95Å; I260-W470 HydrophobicContact CD1-CB 3.98Å; I260-A471 HydrophobicContact CD1-CB 4.43Å
261	K	85.2	Confident	85.7	Confident	140 Å²	140	56.3 Å²	56.3	61%	0.609	27%	0.27	S	S	*	.	H	α-helix	trans	-66.8	-46.7	176.6	-174.1	-177.4	176.9	-174.6	0	111.5	R257 K258 L259 Q265	R257-K261 PolarHBondContact O-N 3Å; K258-K261 WeakPolarHBondContact O-CB 3.27Å; K258-K261 PolarHBondContact O-N 3.46Å; K258-K261 VanDerWaalsContact O-N 3.1Å; L259-K261 VanDerWaalsContact C-N 3.28Å; L259-K261 PolarHBondContact O-N 2.78Å; K261-Q265 WeakPolarHBondContact O-CG 3.43Å; K261-Q265 PolarHBondContact O-N 3.02Å; K261-Q265 VanDerWaalsContact O-N 3.12Å
262	L	89.1	Confident	85.3	Confident	23 Å²	23	53.3 Å²	53.3	12%	0.12	26%	0.256	C	S	.	.	H	α-helix	trans	-67.7	-40.3	-180	-67.8	163.4	0	0	0	111.8	K258 L259 Q265 R266 L397 E400 I401 H404	K258-L262 WeakPolarHBondContact O-CG 3.43Å; K258-L262 PolarHBondContact O-N 3.49Å; L259-L262 PolarHBondContact O-N 2.67Å; L262-Q265 CarbonylContact O-C 3.53Å; L262-Q265 WeakPolarHBondContact O-CA 3.32Å; L262-Q265 WeakPolarHBondContact O-CB 3.26Å; L262-Q265 PolarHBondContact O-N 3.06Å; L262-Q265 VanDerWaalsContact O-N 3.14Å; L262-R266 PolarHBondContact O-N 3.07Å; L262-L397 HydrophobicContact CD2-CD2 3.98Å; L262-E400 HydrophobicContact CD1-CG 4.29Å; L262-E400 HydrophobicContact CD2-CG 4.34Å; L262-I401 HydrophobicContact CB-CD1 4.03Å; L262-I401 HydrophobicContact CB-CG1 3.55Å; L262-I401 HydrophobicContact CD1-CG1 4.31Å; L262-H404 HydrophobicContact CD1-CB 4.48Å
263	E	85.1	Confident	85.1	Confident	41 Å²	41	53.7 Å²	53.7	19%	0.192	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-45.6	176.3	-175.5	57.7	-126.2	0	0	111.6	L259 Q265 R266 D267 R270	L259-E263 VanDerWaalsContact O-CB 3.3Å; L259-E263 WeakPolarHBondContact O-CB 3.37Å; L259-E263 PolarHBondContact O-N 2.95Å; E263-Q265 VanDerWaalsContact C-N 3.25Å; E263-Q265 PolarHBondContact O-N 2.69Å; E263-R266 WeakPolarHBondContact O-CB 3.16Å; E263-R266 PolarHBondContact O-N 2.77Å; E263-R266 VanDerWaalsContact O-N 3.11Å; E263-R266 IonicContact OE1-CZ 2.88Å; E263-R266 VanDerWaalsContact OE1-CZ 3.23Å; E263-R266 IonicContact OE1-NE 3.25Å; E263-R266 PolarHBondContact OE1-NE 3.48Å; E263-R266 IonicContact OE1-NH2 2.71Å; E263-R266 PolarHBondContact OE1-NH2 3.28Å; E263-R266 IonicContact OE2-CZ 2.85Å; E263-R266 IonicContact OE2-NE 3.84Å; E263-R266 PolarHBondContact OE2-NE 2.89Å; E263-R266 VanDerWaalsContact OE2-NE 3.14Å; E263-R266 IonicContact OE2-NH2 3.65Å; E263-R266 PolarHBondContact OE2-NH2 3.45Å; E263-D267 PolarHBondContact O-N 3.27Å; E263-R270 IonicContact OE1-NH1 2.74Å
264	N	80	Confident	84.8	Confident	80 Å²	80	61.5 Å²	61.5	43%	0.428	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-31.3	175	-77.4	-63.6	0	0	0	112.3	I260 T268	I260-N264 WeakPolarHBondContact O-CB 3.42Å; I260-N264 PolarHBondContact O-N 2.94Å; I260-N264 VanDerWaalsContact O-N 3.14Å; I260-N264 PolarHBondContact O-ND2 2.95Å; N264-T268 WeakPolarHBondContact O-CB 3.33Å; N264-T268 PolarHBondContact O-N 3.37Å; N264-T268 VanDerWaalsContact O-N 3.1Å; N264-T268 PolarHBondContact O-OG1 3.47Å
265	Q	85.8	Confident	84.5	Confident	87 Å²	87	62.1 Å²	62.1	41%	0.407	29%	0.289	S	S	.	.	H	α-helix	trans	-69.6	-42.5	170.4	-72.1	176.9	-34.5	0	0	111.8	K261 L262 E263 T268 V269 L397	K261-Q265 WeakPolarHBondContact O-CG 3.43Å; K261-Q265 PolarHBondContact O-N 3.02Å; K261-Q265 VanDerWaalsContact O-N 3.12Å; L262-Q265 CarbonylContact O-C 3.53Å; L262-Q265 WeakPolarHBondContact O-CA 3.32Å; L262-Q265 WeakPolarHBondContact O-CB 3.26Å; L262-Q265 PolarHBondContact O-N 3.06Å; L262-Q265 VanDerWaalsContact O-N 3.14Å; E263-Q265 VanDerWaalsContact C-N 3.25Å; E263-Q265 PolarHBondContact O-N 2.69Å; Q265-T268 PolarHBondContact O-N 2.69Å; Q265-V269 WeakPolarHBondContact O-CB 3.46Å; Q265-V269 WeakPolarHBondContact O-CG2 3.47Å; Q265-V269 PolarHBondContact O-N 2.9Å; Q265-L397 HydrophobicContact CB-CD1 4.09Å; Q265-L397 HydrophobicContact CB-CD2 4.25Å
266	R	87.2	Confident	84.3	Confident	33 Å²	33	59.9 Å²	59.9	13%	0.125	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-46.1	175.5	-172.8	179.8	71.9	153.2	3.3	111.1	L262 E263 V269 R270 L397 I401	L262-R266 PolarHBondContact O-N 3.07Å; E263-R266 WeakPolarHBondContact O-CB 3.16Å; E263-R266 PolarHBondContact O-N 2.77Å; E263-R266 VanDerWaalsContact O-N 3.11Å; E263-R266 IonicContact OE1-CZ 2.88Å; E263-R266 VanDerWaalsContact OE1-CZ 3.23Å; E263-R266 IonicContact OE1-NE 3.25Å; E263-R266 PolarHBondContact OE1-NE 3.48Å; E263-R266 IonicContact OE1-NH2 2.71Å; E263-R266 PolarHBondContact OE1-NH2 3.28Å; E263-R266 IonicContact OE2-CZ 2.85Å; E263-R266 IonicContact OE2-NE 3.84Å; E263-R266 PolarHBondContact OE2-NE 2.89Å; E263-R266 VanDerWaalsContact OE2-NE 3.14Å; E263-R266 IonicContact OE2-NH2 3.65Å; E263-R266 PolarHBondContact OE2-NH2 3.45Å; R266-V269 PolarHBondContact O-N 3.14Å; R266-R270 VanDerWaalsContact O-CB 3.22Å; R266-R270 WeakPolarHBondContact O-CB 3.28Å; R266-R270 PolarHBondContact O-N 3.02Å; R266-L397 HydrophobicContact CB-CB 4.48Å; R266-I401 HydrophobicContact CB-CD1 4.12Å
267	D	80.6	Confident	84.5	Confident	42 Å²	42	61 Å²	61	23%	0.225	28%	0.284	C	S	.	.	H	α-helix	trans	-65.3	-37.5	176.5	-104.5	-4.8	0	0	0	112.6	R66 E263 R270 A271	R66-D267 IonicContact CZ-OD2 3.37Å; R66-D267 IonicContact NH2-OD2 3.72Å; R66-D267 PolarHBondContact NH2-OD2 3.02Å; E263-D267 PolarHBondContact O-N 3.27Å; D267-R270 PolarHBondContact O-N 3.39Å; D267-R270 IonicContact OD1-CZ 3.92Å; D267-R270 IonicContact OD1-NH1 3.61Å; D267-R270 PolarHBondContact OD1-NH1 3.49Å; D267-A271 WeakPolarHBondContact O-CB 3.35Å; D267-A271 PolarHBondContact O-N 3.09Å
268	T	78.1	Confident	84.5	Confident	65 Å²	65	58.4 Å²	58.4	40%	0.399	28%	0.277	S	S	.	.	H	α-helix	trans	-65.1	-42.5	174.6	-55.7	0	0	0	0	111.1	N264 Q265 A272	N264-T268 WeakPolarHBondContact O-CB 3.33Å; N264-T268 PolarHBondContact O-N 3.37Å; N264-T268 VanDerWaalsContact O-N 3.1Å; N264-T268 PolarHBondContact O-OG1 3.47Å; Q265-T268 PolarHBondContact O-N 2.69Å; T268-A272 VanDerWaalsContact O-CB 3.31Å; T268-A272 WeakPolarHBondContact O-CB 3.46Å; T268-A272 PolarHBondContact O-N 3.49Å
269	V	86	Confident	84.3	Confident	7 Å²	7	52.9 Å²	52.9	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-69.2	-39.1	176.3	169.5	0	0	0	0	111.6	Q265 R266 A272 L273 Y390 K393 K394 L397	Q265-V269 WeakPolarHBondContact O-CB 3.46Å; Q265-V269 WeakPolarHBondContact O-CG2 3.47Å; Q265-V269 PolarHBondContact O-N 2.9Å; R266-V269 PolarHBondContact O-N 3.14Å; V269-A272 PolarHBondContact O-N 2.74Å; V269-L273 VanDerWaalsContact O-CB 3.31Å; V269-L273 WeakPolarHBondContact O-CB 3.46Å; V269-L273 PolarHBondContact O-N 2.83Å; V269-Y390 HydrophobicContact CG1-CD1 4.17Å; V269-Y390 VanDerWaalsContact CG1-O 3.27Å; V269-Y390 WeakPolarHBondContact CG1-O 3.38Å; V269-K393 HydrophobicContact CG1-CB 4.24Å; V269-K393 HydrophobicContact CG1-CG 4.37Å; V269-K393 HydrophobicContact CG2-CD 3.8Å; V269-K393 HydrophobicContact CG2-CG 4.03Å; V269-K394 HydrophobicContact CG1-CB 4.16Å; V269-L397 HydrophobicContact CB-CD1 4.34Å; V269-L397 HydrophobicContact CG2-CD1 3.89Å
270	R	86.6	Confident	84.3	Confident	99 Å²	99	56.8 Å²	56.8	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-60.8	-46	174.8	177.9	-172.9	-82	136	-9.2	111.4	E263 R266 D267 R274	E263-R270 IonicContact OE1-NH1 2.74Å; R266-R270 VanDerWaalsContact O-CB 3.22Å; R266-R270 WeakPolarHBondContact O-CB 3.28Å; R266-R270 PolarHBondContact O-N 3.02Å; D267-R270 PolarHBondContact O-N 3.39Å; D267-R270 IonicContact OD1-CZ 3.92Å; D267-R270 IonicContact OD1-NH1 3.61Å; D267-R270 PolarHBondContact OD1-NH1 3.49Å; R270-R274 PolarHBondContact O-N 3.02Å
271	A	79.7	Confident	84.5	Confident	44 Å²	44	59.5 Å²	59.5	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-65.1	-40.2	174.6	0	0	0	0	0	112.1	D267 R274 Y275	D267-A271 WeakPolarHBondContact O-CB 3.35Å; D267-A271 PolarHBondContact O-N 3.09Å; A271-R274 PolarHBondContact O-N 3.13Å; A271-Y275 PolarHBondContact O-N 3.19Å; A271-Y275 VanDerWaalsContact O-N 3.08Å
272	A	83	Confident	84.4	Confident	2 Å²	2	60.3 Å²	60.3	2%	0.017	28%	0.279	C	S	.	.	H	α-helix	trans	-71.2	-34.2	179.4	0	0	0	0	0	113.2	T268 V269 S276 Y390 A713	T268-A272 VanDerWaalsContact O-CB 3.31Å; T268-A272 WeakPolarHBondContact O-CB 3.46Å; T268-A272 PolarHBondContact O-N 3.49Å; V269-A272 PolarHBondContact O-N 2.74Å; A272-S276 WeakPolarHBondContact O-CB 3.23Å; A272-S276 PolarHBondContact O-N 2.85Å; A272-S276 VanDerWaalsContact O-N 3.07Å; A272-S276 PolarHBondContact O-OG 3.46Å; A272-Y390 HydrophobicContact CB-CD1 4.11Å; A272-Y390 HydrophobicContact CB-CD2 4.09Å; A272-Y390 HydrophobicContact CB-CE1 3.72Å; A272-Y390 HydrophobicContact CB-CE2 3.71Å; A272-Y390 HydrophobicContact CB-CG 4.3Å; A272-A713 HydrophobicContact CB-CB 3.81Å; A272-A713 WeakPolarHBondContact O-CB 3.3Å
273	L	87.5	Confident	84.3	Confident	28 Å²	28	65.8 Å²	65.8	15%	0.147	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-51.3	170.9	179.2	57.5	0	0	0	110.5	V269 Y275 S276 V277 I387 T391 K394	V269-L273 VanDerWaalsContact O-CB 3.31Å; V269-L273 WeakPolarHBondContact O-CB 3.46Å; V269-L273 PolarHBondContact O-N 2.83Å; L273-Y275 PolarHBondContact O-N 3.4Å; L273-S276 WeakPolarHBondContact O-CA 3.32Å; L273-S276 WeakPolarHBondContact O-CB 3.38Å; L273-S276 PolarHBondContact O-N 3.4Å; L273-V277 HydrophobicContact CD1-CG2 4.31Å; L273-V277 PolarHBondContact O-N 2.92Å; L273-I387 HydrophobicContact CD1-CB 4.5Å; L273-I387 HydrophobicContact CD1-CG2 3.93Å; L273-T391 WeakPolarHBondContact CD1-OG1 3.38Å; L273-K394 HydrophobicContact CD2-CD 4.22Å
274	R	84.4	Confident	84.2	Confident	173 Å²	173	71.6 Å²	71.6	65%	0.653	33%	0.329	S	S	*	.	H	α-helix	trans	-55.5	-51.4	178.8	-169.3	-169.7	-76.9	170.8	-8.5	111.3	R270 A271 S276 V277 E278	R270-R274 PolarHBondContact O-N 3.02Å; A271-R274 PolarHBondContact O-N 3.13Å; R274-S276 PolarHBondContact O-N 3.4Å; R274-V277 PolarHBondContact O-N 3.21Å; R274-V277 VanDerWaalsContact O-N 3.09Å; R274-E278 WeakPolarHBondContact CD-OE1 3.44Å; R274-E278 HydrophobicContact CG-CG 4.31Å; R274-E278 VanDerWaalsContact CG-OE1 3.32Å; R274-E278 WeakPolarHBondContact CG-OE1 3.16Å; R274-E278 WeakPolarHBondContact O-CG 3.38Å; R274-E278 PolarHBondContact O-N 2.67Å
275	Y	82.4	Confident	84.3	Confident	55 Å²	55	75 Å²	75	22%	0.216	34%	0.34	C	S	.	.	H	α-helix	trans	-57.1	-36.4	175.7	-178.8	-88.3	0	0	0	113	A271 L273 S279 Q712 A713	A271-Y275 PolarHBondContact O-N 3.19Å; A271-Y275 VanDerWaalsContact O-N 3.08Å; L273-Y275 PolarHBondContact O-N 3.4Å; Y275-S279 WeakPolarHBondContact O-CB 3.24Å; Y275-S279 PolarHBondContact O-N 3.11Å; Y275-Q712 HydrophobicContact CE1-CB 4Å; Y275-Q712 HydrophobicContact CE1-CG 3.77Å; Y275-Q712 VanDerWaalsContact OH-CG 3.23Å; Y275-Q712 WeakPolarHBondContact OH-CG 3.28Å; Y275-A713 HydrophobicContact CD1-CB 3.53Å; Y275-A713 HydrophobicContact CE1-CB 4.43Å; Y275-A713 HydrophobicContact CG-CB 4.08Å
276	S	84.2	Confident	84.1	Confident	1 Å²	1	76 Å²	76	1%	0.007	34%	0.34	C	S	.	.	H	α-helix	trans	-70.2	-35	179.4	-57.9	0	0	0	0	112.1	A272 L273 R274 Y280 P287 Y390	A272-S276 WeakPolarHBondContact O-CB 3.23Å; A272-S276 PolarHBondContact O-N 2.85Å; A272-S276 VanDerWaalsContact O-N 3.07Å; A272-S276 PolarHBondContact O-OG 3.46Å; L273-S276 WeakPolarHBondContact O-CA 3.32Å; L273-S276 WeakPolarHBondContact O-CB 3.38Å; L273-S276 PolarHBondContact O-N 3.4Å; R274-S276 PolarHBondContact O-N 3.4Å; S276-Y280 PolarHBondContact O-N 3.41Å; S276-Y280 VanDerWaalsContact O-N 3.12Å; S276-P287 WeakPolarHBondContact O-CG 3.16Å; S276-Y390 WeakPolarHBondContact OG-CE2 3.24Å
277	V	87.7	Confident	83.8	Confident	47 Å²	47	75.7 Å²	75.7	29%	0.285	34%	0.342	S	S	.	.	H	α-helix	trans	-70	-52.7	172.5	173.9	0	0	0	0	110.5	L273 R274 S279 Y280 E281 I387	L273-V277 HydrophobicContact CD1-CG2 4.31Å; L273-V277 PolarHBondContact O-N 2.92Å; R274-V277 PolarHBondContact O-N 3.21Å; R274-V277 VanDerWaalsContact O-N 3.09Å; V277-S279 PolarHBondContact O-N 3.39Å; V277-S279 VanDerWaalsContact O-N 3.11Å; V277-Y280 WeakPolarHBondContact O-CA 3.18Å; V277-Y280 WeakPolarHBondContact O-CB 3.43Å; V277-Y280 PolarHBondContact O-N 2.9Å; V277-E281 HydrophobicContact CG1-CG 4.5Å; V277-E281 VanDerWaalsContact CG1-OE1 3.25Å; V277-E281 WeakPolarHBondContact CG1-OE1 3.46Å; V277-E281 WeakPolarHBondContact O-CG 3.47Å; V277-E281 PolarHBondContact O-N 3.14Å; V277-I387 HydrophobicContact CG2-CD1 4.32Å; V277-I387 HydrophobicContact CG2-CG1 4.37Å; V277-I387 HydrophobicContact CG2-CG2 4.16Å
278	E	85.4	Confident	83.6	Confident	63 Å²	63	79.5 Å²	79.5	29%	0.294	36%	0.357	S	S	.	.	H	α-helix	trans	-56.7	-32.6	175.9	-60.8	162.7	-147.4	0	0	112.7	R274 E281 R282	R274-E278 WeakPolarHBondContact CD-OE1 3.44Å; R274-E278 HydrophobicContact CG-CG 4.31Å; R274-E278 VanDerWaalsContact CG-OE1 3.32Å; R274-E278 WeakPolarHBondContact CG-OE1 3.16Å; R274-E278 WeakPolarHBondContact O-CG 3.38Å; R274-E278 PolarHBondContact O-N 2.67Å; E278-E281 WeakPolarHBondContact CA-OE2 3.03Å; E278-R282 WeakPolarHBondContact O-CB 3.47Å; E278-R282 VanDerWaalsContact O-CG 3.3Å; E278-R282 WeakPolarHBondContact O-CG 3.36Å; E278-R282 PolarHBondContact O-N 3.36Å; E278-R282 VanDerWaalsContact O-N 3.11Å; E278-R282 PolarHBondContact O-NE 2.83Å; E278-R282 IonicContact OE2-CZ 2.68Å; E278-R282 IonicContact OE2-NH2 3.78Å; E278-R282 PolarHBondContact OE2-NH2 3.22Å
279	S	81.8	Confident	83.4	Confident	12 Å²	12	76.4 Å²	76.4	8%	0.084	34%	0.338	C	S	.	.	H	α-helix	trans	-81.7	-18.3	178.7	-178.3	0	0	0	0	112.6	Y275 V277 K283	Y275-S279 WeakPolarHBondContact O-CB 3.24Å; Y275-S279 PolarHBondContact O-N 3.11Å; V277-S279 PolarHBondContact O-N 3.39Å; V277-S279 VanDerWaalsContact O-N 3.11Å; S279-K283 WeakPolarHBondContact O-CB 3.47Å
280	Y	87.9	Confident	82.6	Confident	92 Å²	92	77.6 Å²	77.6	36%	0.361	34%	0.344	S	S	.	.	H	α-helix	trans	-79.1	-48.3	167.4	171.1	-113.4	0	0	0	110.2	S276 V277 R282 K283 H284 R286 I387	S276-Y280 PolarHBondContact O-N 3.41Å; S276-Y280 VanDerWaalsContact O-N 3.12Å; V277-Y280 WeakPolarHBondContact O-CA 3.18Å; V277-Y280 WeakPolarHBondContact O-CB 3.43Å; V277-Y280 PolarHBondContact O-N 2.9Å; Y280-R282 PolarHBondContact O-N 3.1Å; Y280-K283 PolarHBondContact O-N 3.41Å; Y280-H284 VanDerWaalsContact O-CA 3.24Å; Y280-H284 WeakPolarHBondContact O-CA 3.33Å; Y280-H284 PolarHBondContact O-N 2.89Å; Y280-R286 HydrophobicContact CD2-CB 4.45Å; Y280-R286 HydrophobicContact CD2-CG 3.76Å; Y280-R286 HydrophobicContact CE2-CG 3.75Å; Y280-I387 HydrophobicContact CG-CD1 4.27Å
281	E	87.9	Confident	81.7	Confident	115 Å²	115	74.2 Å²	74.2	54%	0.537	34%	0.335	S	S	.	.	H	α-helix	trans	-55.1	-50	176.8	-69.1	161.1	173.7	0	0	111.8	V277 E278 K283 H284	V277-E281 HydrophobicContact CG1-CG 4.5Å; V277-E281 VanDerWaalsContact CG1-OE1 3.25Å; V277-E281 WeakPolarHBondContact CG1-OE1 3.46Å; V277-E281 WeakPolarHBondContact O-CG 3.47Å; V277-E281 PolarHBondContact O-N 3.14Å; E278-E281 WeakPolarHBondContact CA-OE2 3.03Å; E281-K283 VanDerWaalsContact C-N 3.28Å; E281-K283 PolarHBondContact O-N 3.16Å; E281-H284 PolarHBondContact O-CE1 3.39Å; E281-H284 VanDerWaalsContact O-CE1 3.28Å
282	R	82.5	Confident	80.9	Confident	157 Å²	157	73.2 Å²	73.2	59%	0.592	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-5	-178.1	-71	178.1	-71	-170.3	-9.4	115.9	E278 Y280	E278-R282 WeakPolarHBondContact O-CB 3.47Å; E278-R282 VanDerWaalsContact O-CG 3.3Å; E278-R282 WeakPolarHBondContact O-CG 3.36Å; E278-R282 PolarHBondContact O-N 3.36Å; E278-R282 VanDerWaalsContact O-N 3.11Å; E278-R282 PolarHBondContact O-NE 2.83Å; E278-R282 IonicContact OE2-CZ 2.68Å; E278-R282 IonicContact OE2-NH2 3.78Å; E278-R282 PolarHBondContact OE2-NH2 3.22Å; Y280-R282 PolarHBondContact O-N 3.1Å
283	K	86	Confident	79.7	Confident	138 Å²	138	78 Å²	78	60%	0.6	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141	-4.4	-173	-58.7	-176.8	178.5	175.9	0	115	S279 Y280 E281 K285	S279-K283 WeakPolarHBondContact O-CB 3.47Å; Y280-K283 PolarHBondContact O-N 3.41Å; E281-K283 VanDerWaalsContact C-N 3.28Å; E281-K283 PolarHBondContact O-N 3.16Å; K283-K285 PolarHBondContact O-N 3.38Å
284	H	84.5	Confident	78.1	Confident	164 Å²	164	79.7 Å²	79.7	76%	0.759	37%	0.371	S	S	*	.	S	Bend	trans	46.8	24.4	-171.7	-51	-60.2	0	0	0	115.1	Y280 E281	Y280-H284 VanDerWaalsContact O-CA 3.24Å; Y280-H284 WeakPolarHBondContact O-CA 3.33Å; Y280-H284 PolarHBondContact O-N 2.89Å; E281-H284 PolarHBondContact O-CE1 3.39Å; E281-H284 VanDerWaalsContact O-CE1 3.28Å
285	K	81.1	Confident	76.8	Confident	151 Å²	151	71.8 Å²	71.8	66%	0.657	34%	0.343	S	S	*	.	S	Bend	trans	-129.5	116.8	-176.7	-175.5	165.4	-174.9	164.9	0	110.5	K283	K283-K285 PolarHBondContact O-N 3.38Å
286	R	82.6	Confident	75.7	Confident	109 Å²	109	74.6 Å²	74.6	41%	0.411	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-57.7	123.7	179.9	-83.1	170.1	168	-93.2	2.9	110.2	Y280 D385 N388	Y280-R286 HydrophobicContact CD2-CB 4.45Å; Y280-R286 HydrophobicContact CD2-CG 3.76Å; Y280-R286 HydrophobicContact CE2-CG 3.75Å; R286-D385 WeakPolarHBondContact CB-OD2 3.22Å; R286-D385 WeakPolarHBondContact CD-OD2 3.15Å; R286-D385 WeakPolarHBondContact CG-OD2 3.33Å; R286-D385 IonicContact CZ-OD2 3.65Å; R286-D385 IonicContact NE-OD2 2.66Å; R286-D385 IonicContact NH1-OD1 3.4Å; R286-D385 IonicContact NH1-OD2 2.6Å; R286-D385 PolarHBondContact NH1-OD2 3.01Å; R286-N388 PolarHBondContact NH1-OD1 3.06Å
287	P	79.9	Confident	74.3	Confident	26 Å²	26	80.7 Å²	80.7	17%	0.169	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-75.3	135.6	179.7	27.9	-31.9	0	0	0	110.8	S276 A386 I387	S276-P287 WeakPolarHBondContact O-CG 3.16Å; P287-A386 HydrophobicContact CB-CB 4.47Å; P287-A386 HydrophobicContact CG-CB 4.3Å; P287-A386 WeakPolarHBondContact O-CB 3.16Å; P287-A386 PolarHBondContact O-N 3.03Å; P287-I387 HydrophobicContact CG-CG1 4.47Å
288	F	76.6	Confident	72.8	Confident	121 Å²	121	83.1 Å²	83.1	53%	0.531	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	148.3	175.5	-65.7	-86.3	0	0	0	111.8	P383 T384	F288-P383 HydrophobicContact CB-CB 4.44Å; F288-P383 HydrophobicContact CD1-CB 4.41Å; F288-T384 CarbonylContact C-O 3.46Å; F288-T384 WeakPolarHBondContact CA-O 3.2Å
289	I	74.4	Confident	71.3	Confident	1 Å²	1	83.5 Å²	83.5	1%	0.005	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	139	168.7	-171.1	172.3	0	0	0	110.4	P291 P383 T384 A386 Y389 Y390	I289-P291 WeakPolarHBondContact O-CD 3.08Å; I289-P383 WeakPolarHBondContact O-CA 3.17Å; I289-T384 PolarHBondContact N-O 3.42Å; I289-T384 PolarHBondContact O-N 2.86Å; I289-A386 HydrophobicContact CB-CB 4.02Å; I289-A386 HydrophobicContact CG2-CB 4.12Å; I289-Y389 HydrophobicContact CD1-CD1 3.78Å; I289-Y389 HydrophobicContact CD1-CE1 3.7Å; I289-Y389 HydrophobicContact CG2-CD1 4.01Å; I289-Y389 HydrophobicContact CG2-CD2 4.47Å; I289-Y389 HydrophobicContact CG2-CG 3.86Å; I289-Y390 HydrophobicContact CD1-CE1 4.15Å
290	I	69.4	Low	70	Confident	31 Å²	31	91 Å²	91	16%	0.159	42%	0.42	C	S	.	.			trans	-100.6	108.9	172.2	-60.5	175.8	0	0	0	107.1	C292 Y302 P383	I290-C292 HydrophobicContact CG2-CB 4.02Å; I290-C292 PolarHBondContact O-N 3.39Å; I290-C292 VanDerWaalsContact O-N 3.15Å; I290-Y302 HydrophobicContact CD1-CG 4.29Å; I290-P383 HydrophobicContact CG1-CB 4.43Å; I290-P383 HydrophobicContact CG1-CG 4.42Å
291	P	65.7	Low	68.3	Low	29 Å²	29	88.7 Å²	88.7	19%	0.188	42%	0.416	C	S	.	.			trans	-71.6	-8.7	-170.7	-19	32	0	0	0	115.3	I289 P381 K710	I289-P291 WeakPolarHBondContact O-CD 3.08Å; P291-P381 HydrophobicContact CB-CG 3.74Å; P291-P381 HydrophobicContact CG-CB 4.45Å; P291-P381 HydrophobicContact CG-CG 3.84Å; P291-K710 PolarHBondContact O-NZ 3.48Å
292	C	63.8	Low	66.7	Low	23 Å²	23	86.5 Å²	86.5	16%	0.155	40%	0.404	C	S	.	.	S	Bend	trans	-54.6	160	-173.2	-58.2	0	0	0	0	114.9	I290 C294 K710	I290-C292 HydrophobicContact CG2-CB 4.02Å; I290-C292 PolarHBondContact O-N 3.39Å; I290-C292 VanDerWaalsContact O-N 3.15Å; C292-C294 PolarHBondContact O-N 3.31Å; C292-K710 WeakPolarHBondContact O-CD 3.31Å; C292-K710 WeakPolarHBondContact O-CE 3.34Å; C292-K710 PolarHBondContact O-NZ 2.96Å
293	C	56.9	Low	65.4	Low	102 Å²	102	84 Å²	84	69%	0.689	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-24.6	177.8	-55	0	0	0	0	113.4
294	C	55.6	Low	63.8	Low	64 Å²	64	82.2 Å²	82.2	43%	0.432	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-1.3	-161.9	-39.1	0	0	0	0	115.3	C292 Y298	C292-C294 PolarHBondContact O-N 3.31Å; C294-Y298 HydrophobicContact CB-CD2 3.4Å; C294-Y298 VanDerWaalsContact CB-CD2 3.4Å; C294-Y298 HydrophobicContact CB-CE2 3.6Å; C294-Y298 HydrophobicContact CB-CG 4.34Å
295	G	57.1	Low	62.3	Low	7 Å²	7	82 Å²	82	7%	0.072	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	62.6	-165.4	178.9	0	0	0	0	0	115	M297 V709	G295-M297 PolarHBondContact O-N 3.05Å; G295-V709 WeakPolarHBondContact CA-O 3.32Å
296	W	58	Low	60.7	Low	113 Å²	113	76.8 Å²	76.8	43%	0.428	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-69.3	-11.6	-179.8	-95	50.3	0	0	0	115	Y298 K299 V709 K710	W296-Y298 PolarHBondContact O-N 3.11Å; W296-K299 HydrophobicContact CD2-CD 4.34Å; W296-K299 HydrophobicContact CE3-CD 3.75Å; W296-K299 HydrophobicContact CH2-CD 4.12Å; W296-K299 HydrophobicContact CZ3-CD 3.63Å; W296-K299 WeakPolarHBondContact O-CB 3.3Å; W296-K299 PolarHBondContact O-N 2.78Å; W296-V709 PolarHBondContact N-O 2.97Å; W296-K710 VanDerWaalsContact CD1-C 3.46Å; W296-K710 PolarHBondContact NE1-O 2.85Å
297	M	54.8	Low	59.2	Low	129 Å²	129	73.8 Å²	73.8	64%	0.635	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-57.4	-23.7	-178	-169.4	169.1	70.1	0	0	113.3	G295	G295-M297 PolarHBondContact O-N 3.05Å
298	Y	56.1	Low	57.5	Low	98 Å²	98	80.8 Å²	80.8	38%	0.384	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-103.9	13.5	-179.6	-64.5	-91.5	0	0	0	114.3	C294 W296 K300 C301 Y302	C294-Y298 HydrophobicContact CB-CD2 3.4Å; C294-Y298 VanDerWaalsContact CB-CD2 3.4Å; C294-Y298 HydrophobicContact CB-CE2 3.6Å; C294-Y298 HydrophobicContact CB-CG 4.34Å; W296-Y298 PolarHBondContact O-N 3.11Å; Y298-K300 VanDerWaalsContact C-N 3.28Å; Y298-K300 PolarHBondContact O-N 2.99Å; Y298-C301 WeakPolarHBondContact O-CB 3.36Å; Y298-C301 PolarHBondContact O-N 3.36Å; Y298-Y302 PolarHBondContact O-N 3.34Å; Y298-Y302 VanDerWaalsContact O-N 3.12Å
299	K	55.3	Low	56.1	Low	71 Å²	71	79.2 Å²	79.2	31%	0.309	39%	0.394	S	S	.	.	H	α-helix	trans	-51.5	-43.5	-178.8	-177.3	176.5	177.4	-78.4	0	112.8	W296 C301 Y302 E303	W296-K299 HydrophobicContact CD2-CD 4.34Å; W296-K299 HydrophobicContact CE3-CD 3.75Å; W296-K299 HydrophobicContact CH2-CD 4.12Å; W296-K299 HydrophobicContact CZ3-CD 3.63Å; W296-K299 WeakPolarHBondContact O-CB 3.3Å; W296-K299 PolarHBondContact O-N 2.78Å; K299-C301 PolarHBondContact O-N 3.33Å; K299-Y302 WeakPolarHBondContact O-CB 3.41Å; K299-Y302 PolarHBondContact O-N 3.32Å; K299-Y302 VanDerWaalsContact O-N 3.15Å; K299-E303 WeakPolarHBondContact CE-OE1 3.46Å; K299-E303 HydrophobicContact CG-CG 4.34Å; K299-E303 WeakPolarHBondContact CG-OE2 3.28Å; K299-E303 IonicContact NZ-OE1 2.75Å; K299-E303 PolarHBondContact NZ-OE1 2.75Å; K299-E303 IonicContact NZ-OE2 3.86Å; K299-E303 PolarHBondContact NZ-OE2 3.4Å; K299-E303 WeakPolarHBondContact O-CG 3.27Å; K299-E303 PolarHBondContact O-N 2.96Å
300	K	53.7	Low	54.4	Low	171 Å²	171	82.2 Å²	82.2	74%	0.743	41%	0.414	S	S	*	.	H	α-helix	trans	-65.2	-32.1	176.4	-76.9	-169.4	171.5	-171.7	0	114.3	Y298 Y302 N304	Y298-K300 VanDerWaalsContact C-N 3.28Å; Y298-K300 PolarHBondContact O-N 2.99Å; K300-Y302 VanDerWaalsContact C-N 3.32Å; K300-N304 WeakPolarHBondContact O-CB 3.44Å; K300-N304 PolarHBondContact O-N 3.11Å; K300-N304 PolarHBondContact O-OD1 3.06Å
301	C	52.1	Low	53.1	Low	42 Å²	42	83.7 Å²	83.7	28%	0.284	43%	0.427	S	S	.	.	H	α-helix	trans	-69.1	-35.4	172.7	-68.8	0	0	0	0	111.2	Y298 K299 Y305 C306	Y298-C301 WeakPolarHBondContact O-CB 3.36Å; Y298-C301 PolarHBondContact O-N 3.36Å; K299-C301 PolarHBondContact O-N 3.33Å; C301-Y305 PolarHBondContact O-N 3.38Å; C301-C306 WeakPolarHBondContact CB-O 3.48Å; C301-C306 PolarHBondContact O-N 2.99Å; C301-C306 VanDerWaalsContact O-N 3.15Å
302	Y	53.9	Low	51.6	Low	70 Å²	70	93 Å²	93	28%	0.275	46%	0.458	S	S	.	.	H	α-helix	trans	-70.1	-49.7	176.9	-171.6	-84.5	0	0	0	112	I290 Y298 K299 K300 N304 Y305 Y369 P383	I290-Y302 HydrophobicContact CD1-CG 4.29Å; Y298-Y302 PolarHBondContact O-N 3.34Å; Y298-Y302 VanDerWaalsContact O-N 3.12Å; K299-Y302 WeakPolarHBondContact O-CB 3.41Å; K299-Y302 PolarHBondContact O-N 3.32Å; K299-Y302 VanDerWaalsContact O-N 3.15Å; K300-Y302 VanDerWaalsContact C-N 3.32Å; Y302-N304 PolarHBondContact O-N 2.85Å; Y302-Y305 PolarHBondContact O-N 3.15Å; Y302-Y305 VanDerWaalsContact O-N 3.11Å; Y302-Y369 HydrophobicContact CE2-CE1 4.28Å; Y302-Y369 WeakPolarHBondContact OH-CE1 3.45Å; Y302-Y369 PolarHBondContact OH-OH 3.09Å; Y302-P383 HydrophobicContact CD1-CG 4.28Å; Y302-P383 HydrophobicContact CE1-CG 3.48Å; Y302-P383 VanDerWaalsContact CE1-CG 3.48Å; Y302-P383 HydrophobicContact CE2-CG 3.83Å; Y302-P383 VanDerWaalsContact CZ-CD 3.44Å; Y302-P383 WeakPolarHBondContact OH-CD 3.24Å; Y302-P383 VanDerWaalsContact OH-CG 3.3Å; Y302-P383 WeakPolarHBondContact OH-CG 3.43Å
303	E	56.5	Low	50.5	Low	104 Å²	104	98.9 Å²	98.9	49%	0.486	49%	0.488	S	S	.	.	H	α-helix	trans	-62.8	-27.7	-178.5	-71.5	178.5	134.9	0	0	113.2	K299	K299-E303 WeakPolarHBondContact CE-OE1 3.46Å; K299-E303 HydrophobicContact CG-CG 4.34Å; K299-E303 WeakPolarHBondContact CG-OE2 3.28Å; K299-E303 IonicContact NZ-OE1 2.75Å; K299-E303 PolarHBondContact NZ-OE1 2.75Å; K299-E303 IonicContact NZ-OE2 3.86Å; K299-E303 PolarHBondContact NZ-OE2 3.4Å; K299-E303 WeakPolarHBondContact O-CG 3.27Å; K299-E303 PolarHBondContact O-N 2.96Å
304	N	51.3	Low	49.6	Very low	100 Å²	100	99.1 Å²	99.1	54%	0.535	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	7.1	178.5	-64.9	15.5	0	0	0	113.7	K300 Y302 C306	K300-N304 WeakPolarHBondContact O-CB 3.44Å; K300-N304 PolarHBondContact O-N 3.11Å; K300-N304 PolarHBondContact O-OD1 3.06Å; Y302-N304 PolarHBondContact O-N 2.85Å; N304-C306 HydrophobicContact CB-CB 4.46Å; N304-C306 PolarHBondContact O-N 2.78Å; N304-C306 PolarHBondContact O-SG 2.97Å
305	Y	52.7	Low	48.7	Very low	161 Å²	161	103.2 Å²	103.2	63%	0.631	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	17.5	-174.1	-66.1	-84.9	0	0	0	115.6	C301 Y302	C301-Y305 PolarHBondContact O-N 3.38Å; Y302-Y305 PolarHBondContact O-N 3.15Å; Y302-Y305 VanDerWaalsContact O-N 3.11Å
306	C	48	Very low	47.6	Very low	41 Å²	41	111.2 Å²	111.2	28%	0.277	54%	0.539	S	S	.	.			trans	-114.8	128.7	-167.8	-79.4	0	0	0	0	112.7	C301 N304 C310 C311	C301-C306 WeakPolarHBondContact CB-O 3.48Å; C301-C306 PolarHBondContact O-N 2.99Å; C301-C306 VanDerWaalsContact O-N 3.15Å; N304-C306 HydrophobicContact CB-CB 4.46Å; N304-C306 PolarHBondContact O-N 2.78Å; N304-C306 PolarHBondContact O-SG 2.97Å; C306-C310 HydrophobicContact CB-CB 4.36Å; C306-C311 WeakPolarHBondContact CB-SG 3.42Å
307	C	52.1	Low	46.3	Very low	46 Å²	46	114.4 Å²	114.4	31%	0.311	56%	0.559	S	S	.	*			trans	-66.7	153.5	161.6	83.1	0	0	0	0	110	S309 C310	C307-S309 PolarHBondContact O-N 3.35Å; C307-C310 PolarHBondContact O-N 3.38Å
308	R	43.9	Very low	45.3	Very low	172 Å²	172	114.8 Å²	114.8	65%	0.649	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-15	-171.5	-162.6	173.6	-177.4	177	1.6	114.5	L374	R308-L374 HydrophobicContact CB-CD2 4.21Å
309	S	46.3	Very low	43.9	Very low	89 Å²	89	118.3 Å²	118.3	62%	0.622	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-19.5	177.3	-160	0	0	0	0	114.5	C307	C307-S309 PolarHBondContact O-N 3.35Å
310	C	39.6	Very low	42.7	Very low	64 Å²	64	119.1 Å²	119.1	43%	0.432	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.6	-44.5	-178.6	-61.6	0	0	0	0	111.9	C306 C307 W312 N313	C306-C310 HydrophobicContact CB-CB 4.36Å; C307-C310 PolarHBondContact O-N 3.38Å; C310-W312 PolarHBondContact O-N 2.87Å; C310-N313 PolarHBondContact O-N 3.13Å; C310-N313 VanDerWaalsContact O-N 3.15Å
311	C	41.4	Very low	41.7	Very low	62 Å²	62	116.1 Å²	116.1	42%	0.419	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.5	3.1	-173.4	-57	0	0	0	0	115.7	C306	C306-C311 WeakPolarHBondContact CB-SG 3.42Å
312	W	34.9	Very low	40.6	Very low	225 Å²	225	122.3 Å²	122.3	85%	0.852	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-9.4	173.8	-89.7	51.4	0	0	0	113.1	C310	C310-W312 PolarHBondContact O-N 2.87Å
313	N	40.3	Very low	39.4	Very low	146 Å²	146	125.1 Å²	125.1	78%	0.781	65%	0.647	S	S	*	*	S	Bend	trans	-116.3	13.1	-167.4	-141.5	58.5	0	0	0	114.5	C310	C310-N313 PolarHBondContact O-N 3.13Å; C310-N313 VanDerWaalsContact O-N 3.15Å
314	T	37.5	Very low	38.1	Very low	106 Å²	106	129.9 Å²	129.9	65%	0.65	66%	0.662	S	S	*	*			trans	-129.7	35.6	-173.9	62.9	0	0	0	0	112.9
315	N	37.2	Very low	37	Very low	151 Å²	151	132.4 Å²	132.4	81%	0.807	67%	0.674	S	S	*	*	S	Bend	trans	-102.3	12.1	175.4	-90	7.7	0	0	0	113.4
316	H	34.7	Very low	35.9	Very low	174 Å²	174	130.2 Å²	130.2	81%	0.806	68%	0.682	S	S	*	*	S	Bend	trans	-131.7	148.4	170.8	-89.8	-104.4	0	0	0	109.1
317	Q	30.5	Very low	35	Very low	181 Å²	181	135 Å²	135	85%	0.846	71%	0.705	S	S	*	*			trans	61.5	102	177.4	-64.1	-179.3	-36	0	0	113.3
318	I	32.7	Very low	33.9	Very low	136 Å²	136	139.7 Å²	139.7	70%	0.697	73%	0.727	S	S	*	*				-169.5	132.1	57	-91.6	137.2	0	0	0	110.2	S320	I318-S320 WeakPolarHBondContact CG2-OG 3.38Å
319	N	27.4	Very low	33.2	Very low	173 Å²	173	137.9 Å²	137.9	93%	0.925	73%	0.73	S	S	*	*			trans	-101.1	105.4	153.4	-89.5	-16	0	0	0	107.1
320	S	30.2	Very low	32.7	Very low	88 Å²	88	140.6 Å²	140.6	62%	0.615	74%	0.738	S	S	*	*			trans	-167.1	133.2	165.1	58.6	0	0	0	0	113.9	I318	I318-S320 WeakPolarHBondContact CG2-OG 3.38Å
321	S	31.6	Very low	32.2	Very low	108 Å²	108	144 Å²	144	76%	0.755	75%	0.752	S	S	*	*			trans	53.7	123.1	144.9	58.9	0	0	0	0	121.1
322	Q	30.2	Very low	31.8	Very low	171 Å²	171	149.3 Å²	149.3	80%	0.799	77%	0.77	S	S	*	*			trans	-58	158.2	150.4	-54.9	132.5	-67	0	0	111.2
323	N	28.5	Very low	31.6	Very low	129 Å²	129	146.5 Å²	146.5	69%	0.69	76%	0.764	S	S	*	*				160.7	157.5	124.5	-79.9	-22.8	0	0	0	113.5
324	Y	29.2	Very low	31.4	Very low	204 Å²	204	146 Å²	146	80%	0.8	76%	0.761	S	S	*	*			trans	62.3	133.9	170.7	-58.9	-68.8	0	0	0	116.6
325	I	28.9	Very low	31.1	Very low	153 Å²	153	147.4 Å²	147.4	79%	0.785	77%	0.765	S	S	*	*			cis	67.4	91.6	17.8	-42.3	177.3	0	0	0	115.3
326	S	29.9	Very low	31	Very low	115 Å²	115	148.4 Å²	148.4	80%	0.804	77%	0.768	S	S	*	*				-174.6	165.3	118.3	54.9	0	0	0	0	111.8
327	N	28.1	Very low	30.9	Very low	141 Å²	141	146.8 Å²	146.8	75%	0.754	76%	0.764	S	S	*	*			trans	-84.8	155.3	174.1	-53.2	-32.4	0	0	0	110.4
328	N	29.9	Very low	31.1	Very low	145 Å²	145	145.1 Å²	145.1	78%	0.775	76%	0.761	S	S	*	*				-178.5	169.6	103	-94.3	-21.7	0	0	0	113.6
329	N	29.2	Very low	31.2	Very low	134 Å²	134	144.1 Å²	144.1	72%	0.717	76%	0.762	S	S	*	*			trans	-60.7	158.6	171.1	-37.6	-55.9	0	0	0	110.7
330	D	34.5	Very low	31.5	Very low	146 Å²	146	143.2 Å²	143.2	78%	0.781	76%	0.755	S	S	*	*				-168.3	174.2	92.4	-117.5	-50.2	0	0	0	114.7
331	N	29	Very low	31.8	Very low	137 Å²	137	144.7 Å²	144.7	73%	0.733	76%	0.762	S	S	*	*			trans	-89.6	140.3	-169.8	-58.6	-96	0	0	0	112.8
332	H	33.7	Very low	31.7	Very low	173 Å²	173	149.1 Å²	149.1	80%	0.801	76%	0.762	S	S	*	*			trans	-155.4	160.4	132.9	-134.5	-96	0	0	0	114.8
333	K	30.5	Very low	31.9	Very low	166 Å²	166	146.5 Å²	146.5	72%	0.722	76%	0.763	S	S	*	*			trans	-86.6	161.5	177.6	-52.8	165.1	-178.5	168.1	0	110.6
334	D	35.9	Very low	32	Very low	136 Å²	136	146.6 Å²	146.6	73%	0.727	76%	0.76	S	S	*	*				-176.5	166	96.6	-92.1	-40.8	0	0	0	114.1
335	N	31.2	Very low	32.3	Very low	135 Å²	135	143.3 Å²	143.3	72%	0.722	76%	0.761	S	S	*	*			trans	-101.2	146.9	-168.3	-46.4	-82.6	0	0	0	112.7
336	I	35.8	Very low	32.7	Very low	172 Å²	172	142.4 Å²	142.4	88%	0.882	76%	0.762	S	S	*	*			trans	-133.9	142.1	143.6	-62.8	-173.9	0	0	0	108.2
337	I	32.4	Very low	32.7	Very low	139 Å²	139	143.5 Å²	143.5	71%	0.713	76%	0.759	S	S	*	*			trans	-112.3	146.5	-172.9	-65.2	161.1	0	0	0	108.1
338	D	35	Very low	33.1	Very low	146 Å²	146	144.8 Å²	144.8	78%	0.781	77%	0.766	S	S	*	*			trans	-162.6	132.9	133.8	-116.8	-36.2	0	0	0	118.9
339	T	34.9	Very low	33.1	Very low	116 Å²	116	146.8 Å²	146.8	71%	0.712	77%	0.771	S	S	*	*			trans	54	130.4	151.3	-47.9	0	0	0	0	123.2
340	I	33.3	Very low	33.3	Very low	153 Å²	153	148.8 Å²	148.8	79%	0.785	78%	0.781	S	S	*	*			trans	-135.4	154.9	164.3	-30.2	169.8	0	0	0	108
341	P	35.4	Very low	33	Very low	119 Å²	119	146.9 Å²	146.9	77%	0.773	78%	0.779	S	S	*	*				-142.6	153.9	103.9	36.1	-21.9	0	0	0	112.8
342	R	29.9	Very low	33.3	Very low	201 Å²	201	145.9 Å²	145.9	76%	0.758	78%	0.782	S	S	*	*			cis	94.4	109.7	24.9	-170	-178.3	175.4	147.5	3.5	115.1	E344	R342-E344 IonicContact CZ-OE1 3.65Å; R342-E344 IonicContact NE-OE1 3.58Å; R342-E344 PolarHBondContact NE-OE1 3.18Å; R342-E344 IonicContact NH2-OE1 2.66Å; R342-E344 PolarHBondContact NH2-OE1 2.96Å; R342-E344 VanDerWaalsContact NH2-OE1 3.11Å
343	S	34.3	Very low	33.2	Very low	117 Å²	117	143.2 Å²	143.2	82%	0.818	78%	0.783	S	S	*	*			trans	-169.9	162.1	154.5	58.1	0	0	0	0	109.5
344	E	32.4	Very low	33.5	Very low	131 Å²	131	141.5 Å²	141.5	61%	0.612	79%	0.792	S	S	*	*				-158.8	-179.6	-71.8	-118	178	-169	0	0	109.3	R342	R342-E344 IonicContact CZ-OE1 3.65Å; R342-E344 IonicContact NE-OE1 3.58Å; R342-E344 PolarHBondContact NE-OE1 3.18Å; R342-E344 IonicContact NH2-OE1 2.66Å; R342-E344 PolarHBondContact NH2-OE1 2.96Å; R342-E344 VanDerWaalsContact NH2-OE1 3.11Å
345	T	35.2	Very low	33.3	Very low	135 Å²	135	140.8 Å²	140.8	83%	0.828	80%	0.797	S	S	*	*			trans	70.6	144	177.9	74.8	0	0	0	0	116.5
346	V	36	Very low	33.5	Very low	134 Å²	134	140.4 Å²	140.4	81%	0.812	81%	0.805	S	S	*	*			cis	-148.1	155.4	-13.5	116	0	0	0	0	109.5
347	N	31.4	Very low	33.2	Very low	138 Å²	138	138 Å²	138	74%	0.738	80%	0.804	S	S	*	*			trans	-85.7	161	-178.6	-57.7	-37.2	0	0	0	112.6
348	N	35.3	Very low	33.4	Very low	168 Å²	168	137 Å²	137	90%	0.898	81%	0.81	S	S	*	*				-166.2	154.6	109.7	-94.8	-14.6	0	0	0	112.5
349	Q	29.4	Very low	33.4	Very low	187 Å²	187	135.6 Å²	135.6	87%	0.874	81%	0.811	S	S	*	*			trans	-114	149.7	-178.2	-57.5	164.8	-66.9	0	0	109.7
350	L	33.3	Very low	33.7	Very low	176 Å²	176	135.6 Å²	135.6	92%	0.921	81%	0.813	S	S	*	*			trans	-151.6	160.8	133.6	-148.9	60.5	0	0	0	110.7
351	S	30	Very low	33.9	Very low	106 Å²	106	134.3 Å²	134.3	74%	0.741	82%	0.815	S	S	*	*			trans	-133.4	139	-161.6	54.7	0	0	0	0	112.7
352	S	35	Very low	33.9	Very low	115 Å²	115	133.7 Å²	133.7	80%	0.804	81%	0.813	S	S	*	*			trans	-162.3	120.3	145.6	56.4	0	0	0	0	112.7
353	S	31.7	Very low	34.3	Very low	118 Å²	118	130.1 Å²	130.1	83%	0.825	82%	0.816	S	S	*	*			trans	-26.3	138.5	162.1	51.2	0	0	0	0	119.3
354	S	35.8	Very low	34.2	Very low	130 Å²	130	130.6 Å²	130.6	91%	0.909	81%	0.814	S	S	*	*				-156.8	161.1	113.4	62.9	0	0	0	0	110.4
355	S	31.6	Very low	34.3	Very low	120 Å²	120	129.7 Å²	129.7	84%	0.839	82%	0.82	S	S	*	*			trans	-124.1	136.1	-162.9	57.2	0	0	0	0	114.2
356	S	34.9	Very low	34.2	Very low	127 Å²	127	132.7 Å²	132.7	89%	0.888	82%	0.824	S	S	*	*			trans	-146.6	154.3	152.8	64	0	0	0	0	110.2
357	S	30.8	Very low	34.4	Very low	123 Å²	123	130.6 Å²	130.6	86%	0.86	81%	0.808	S	S	*	*			trans	-107.6	131.4	-159.1	44.7	0	0	0	0	114.2
358	S	35.1	Very low	34.8	Very low	118 Å²	118	130.7 Å²	130.7	83%	0.825	81%	0.808	S	S	*	*			trans	-145.1	141.4	153.5	57.2	0	0	0	0	109.1
359	S	36.6	Very low	35.3	Very low	115 Å²	115	127.6 Å²	127.6	80%	0.804	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-84	133.2	-169.3	39.2	0	0	0	0	112.4
360	P	39.6	Very low	36	Very low	117 Å²	117	127.9 Å²	127.9	76%	0.76	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-73.7	142.4	172.3	30.7	-33.6	0	0	0	110.6
361	P	38.3	Very low	36.6	Very low	126 Å²	126	128.9 Å²	128.9	82%	0.818	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-66.5	148.4	170.5	29.3	-34.3	0	0	0	110.7
362	S	36	Very low	37.3	Very low	105 Å²	105	126.4 Å²	126.4	73%	0.734	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-63.4	146.8	-174.7	47	0	0	0	0	113.3	T364	S362-T364 PolarHBondContact O-N 3.43Å
363	P	37.8	Very low	37.8	Very low	126 Å²	126	130.8 Å²	130.8	82%	0.818	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-67.2	125.3	178.9	27.7	-34	0	0	0	110.4
364	T	31.7	Very low	38.6	Very low	128 Å²	128	130.9 Å²	130.9	79%	0.785	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-74.2	142.9	172.5	29.9	0	0	0	0	110.6	S362 Q366	S362-T364 PolarHBondContact O-N 3.43Å; T364-Q366 PolarHBondContact O-N 2.99Å
365	P	33.9	Very low	39.1	Very low	112 Å²	112	127.1 Å²	127.1	73%	0.727	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-63.1	132.4	-173.8	-22.9	33.6	0	0	0	112.6	I367	P365-I367 PolarHBondContact O-N 2.87Å
366	Q	33.1	Very low	39.9	Very low	198 Å²	198	129.7 Å²	129.7	93%	0.925	73%	0.733	S	S	*	*			trans	-73.1	89.3	172	-69.7	-161.1	14	0	0	110.7	T364 N368	T364-Q366 PolarHBondContact O-N 2.99Å; Q366-N368 PolarHBondContact O-N 3.43Å; Q366-N368 VanDerWaalsContact O-N 3.08Å
367	I	41.7	Very low	40.6	Very low	90 Å²	90	129 Å²	129	46%	0.462	73%	0.728	S	S	.	*			trans	-64.5	109.3	171.4	-63.1	173.6	0	0	0	108.5	P365 Y369	P365-I367 PolarHBondContact O-N 2.87Å; I367-Y369 WeakPolarHBondContact O-CD2 3.42Å; I367-Y369 VanDerWaalsContact O-CE2 3.26Å; I367-Y369 WeakPolarHBondContact O-CE2 3.15Å; I367-Y369 PolarHBondContact O-N 2.87Å; I367-Y369 VanDerWaalsContact O-N 3.15Å
368	N	38.1	Very low	41.7	Very low	140 Å²	140	126.3 Å²	126.3	75%	0.749	71%	0.708	S	S	*	*			trans	-78.2	99	-177.2	-169.6	-15.5	0	0	0	110.7	Q366 K370	Q366-N368 PolarHBondContact O-N 3.43Å; Q366-N368 VanDerWaalsContact O-N 3.08Å; N368-K370 PolarHBondContact O-N 3.34Å
369	Y	47.1	Very low	42.7	Very low	102 Å²	102	125.9 Å²	125.9	40%	0.4	71%	0.705	S	S	.	*			trans	-67.1	85.8	-176.7	-63	-88.1	0	0	0	112.4	Y302 I367 P382	Y302-Y369 HydrophobicContact CE2-CE1 4.28Å; Y302-Y369 WeakPolarHBondContact OH-CE1 3.45Å; Y302-Y369 PolarHBondContact OH-OH 3.09Å; I367-Y369 WeakPolarHBondContact O-CD2 3.42Å; I367-Y369 VanDerWaalsContact O-CE2 3.26Å; I367-Y369 WeakPolarHBondContact O-CE2 3.15Å; I367-Y369 PolarHBondContact O-N 2.87Å; I367-Y369 VanDerWaalsContact O-N 3.15Å; Y369-P382 HydrophobicContact CE2-CB 3.89Å
370	K	43.9	Very low	43.7	Very low	194 Å²	194	123.4 Å²	123.4	84%	0.843	69%	0.687	S	S	*	*			trans	-54.7	138.6	176.7	-69	-175.5	178.5	179.3	0	111.7	N368 C372	N368-K370 PolarHBondContact O-N 3.34Å; K370-C372 PolarHBondContact O-N 2.97Å
371	K	46.2	Very low	44.8	Very low	196 Å²	196	120.8 Å²	120.8	85%	0.852	67%	0.67	S	S	*	*			trans	-51.7	131	-173	-69	178.2	177.5	175.6	0	113	K373	K371-K373 PolarHBondContact O-N 2.87Å
372	C	43.6	Very low	46.1	Very low	55 Å²	55	117.6 Å²	117.6	37%	0.372	65%	0.649	S	S	.	*			trans	-73.4	114.2	172.2	-176.2	0	0	0	0	110.7	K370 L374	K370-C372 PolarHBondContact O-N 2.97Å; C372-L374 PolarHBondContact O-N 3.42Å; C372-L374 VanDerWaalsContact O-N 3.1Å
373	K	47.3	Very low	47.7	Very low	207 Å²	207	114.1 Å²	114.1	90%	0.9	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-6.8	-179.4	-114.7	-177.7	179	-176.8	0	115.1	K371	K371-K373 PolarHBondContact O-N 2.87Å
374	L	47.2	Very low	49.7	Very low	119 Å²	119	110.7 Å²	110.7	62%	0.623	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-0.5	-172.4	-153.6	69.5	0	0	0	114.3	R308 C372	R308-L374 HydrophobicContact CB-CD2 4.21Å; C372-L374 PolarHBondContact O-N 3.42Å; C372-L374 VanDerWaalsContact O-N 3.1Å
375	C	47.6	Very low	52.4	Low	52 Å²	52	105.8 Å²	105.8	35%	0.351	57%	0.57	S	S	.	*			trans	-139	109.4	171.2	51.3	0	0	0	0	110.7	C377	C375-C377 PolarHBondContact O-N 2.97Å
376	L	48.1	Very low	54.8	Low	173 Å²	173	100.5 Å²	100.5	91%	0.906	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	0.8	-177	-81.6	73.5	0	0	0	114.2
377	C	49.9	Very low	57.5	Low	113 Å²	113	92.2 Å²	92.2	76%	0.764	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-28.5	-157.6	-47	0	0	0	0	115.9	C375	C375-C377 PolarHBondContact O-N 2.97Å
378	C	53.6	Low	59.8	Low	66 Å²	66	92 Å²	92	45%	0.446	50%	0.497	S	S	.	.			trans	-146.8	134	-167.9	-61.1	0	0	0	0	113.7	C380	C378-C380 PolarHBondContact O-N 2.7Å
379	S	55.1	Low	62.2	Low	109 Å²	109	88.5 Å²	88.5	76%	0.762	47%	0.474	S	S	*	.			trans	-67.4	113.1	147.4	-63	0	0	0	0	108	P381	S379-P381 WeakPolarHBondContact O-CD 3.45Å
380	C	57.5	Low	64.3	Low	64 Å²	64	83.7 Å²	83.7	43%	0.432	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-71	117.9	177.1	-70.2	0	0	0	0	109.8	C378	C378-C380 PolarHBondContact O-N 2.7Å
381	P	63.7	Low	66.6	Low	62 Å²	62	76.7 Å²	76.7	40%	0.403	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-67.7	152.5	175	29.1	-34.9	0	0	0	110.8	P291 S379	P291-P381 HydrophobicContact CB-CG 3.74Å; P291-P381 HydrophobicContact CG-CB 4.45Å; P291-P381 HydrophobicContact CG-CG 3.84Å; S379-P381 WeakPolarHBondContact O-CD 3.45Å
382	P	65.4	Low	68.9	Low	59 Å²	59	72.6 Å²	72.6	38%	0.383	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-60.9	158.3	177.7	26.3	-35.2	0	0	0	111.9	Y369 T384	Y369-P382 HydrophobicContact CE2-CB 3.89Å; P382-T384 PolarHBondContact O-N 3.41Å
383	P	69.4	Low	71.2	Confident	32 Å²	32	73.2 Å²	73.2	21%	0.208	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-56.2	131	166	-18.3	30.2	0	0	0	109.5	F288 I289 I290 Y302	F288-P383 HydrophobicContact CB-CB 4.44Å; F288-P383 HydrophobicContact CD1-CB 4.41Å; I289-P383 WeakPolarHBondContact O-CA 3.17Å; I290-P383 HydrophobicContact CG1-CB 4.43Å; I290-P383 HydrophobicContact CG1-CG 4.42Å; Y302-P383 HydrophobicContact CD1-CG 4.28Å; Y302-P383 HydrophobicContact CE1-CG 3.48Å; Y302-P383 VanDerWaalsContact CE1-CG 3.48Å; Y302-P383 HydrophobicContact CE2-CG 3.83Å; Y302-P383 VanDerWaalsContact CZ-CD 3.44Å; Y302-P383 WeakPolarHBondContact OH-CD 3.24Å; Y302-P383 VanDerWaalsContact OH-CG 3.3Å; Y302-P383 WeakPolarHBondContact OH-CG 3.43Å
384	T	80.3	Confident	73.3	Confident	54 Å²	54	68 Å²	68	33%	0.331	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	156.1	-179.4	34.7	0	0	0	0	109.9	F288 I289 P382 A386	F288-T384 CarbonylContact C-O 3.46Å; F288-T384 WeakPolarHBondContact CA-O 3.2Å; I289-T384 PolarHBondContact N-O 3.42Å; I289-T384 PolarHBondContact O-N 2.86Å; P382-T384 PolarHBondContact O-N 3.41Å; T384-A386 PolarHBondContact O-N 2.88Å
385	D	87.1	Confident	75.6	Confident	25 Å²	25	66.2 Å²	66.2	13%	0.134	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	124.5	168.6	179.1	-66.9	0	0	0	109.2	R286 I387 N388 Y389	R286-D385 WeakPolarHBondContact CB-OD2 3.22Å; R286-D385 WeakPolarHBondContact CD-OD2 3.15Å; R286-D385 WeakPolarHBondContact CG-OD2 3.33Å; R286-D385 IonicContact CZ-OD2 3.65Å; R286-D385 IonicContact NE-OD2 2.66Å; R286-D385 IonicContact NH1-OD1 3.4Å; R286-D385 IonicContact NH1-OD2 2.6Å; R286-D385 PolarHBondContact NH1-OD2 3.01Å; D385-I387 WeakPolarHBondContact OD1-CA 3.42Å; D385-I387 WeakPolarHBondContact OD1-CB 3.4Å; D385-I387 PolarHBondContact OD1-N 3.33Å; D385-N388 HydrophobicContact CB-CB 4.12Å; D385-N388 PolarHBondContact OD1-N 3.08Å; D385-N388 PolarHBondContact OD1-OD1 3.48Å; D385-Y389 VanDerWaalsContact O-CB 3.3Å; D385-Y389 WeakPolarHBondContact O-CB 3.4Å; D385-Y389 PolarHBondContact O-N 2.9Å
386	A	85.7	Confident	77.8	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-72.4	-29.4	-174.1	0	0	0	0	0	112.8	P287 I289 T384 Y390	P287-A386 HydrophobicContact CB-CB 4.47Å; P287-A386 HydrophobicContact CG-CB 4.3Å; P287-A386 WeakPolarHBondContact O-CB 3.16Å; P287-A386 PolarHBondContact O-N 3.03Å; I289-A386 HydrophobicContact CB-CB 4.02Å; I289-A386 HydrophobicContact CG2-CB 4.12Å; T384-A386 PolarHBondContact O-N 2.88Å; A386-Y390 HydrophobicContact CB-CD2 4.25Å; A386-Y390 HydrophobicContact CB-CE2 4.08Å; A386-Y390 WeakPolarHBondContact O-CB 3.43Å; A386-Y390 WeakPolarHBondContact O-CD2 3.42Å; A386-Y390 PolarHBondContact O-N 2.89Å
387	I	88.4	Confident	79.9	Confident	24 Å²	24	62.6 Å²	62.6	12%	0.123	35%	0.348	C	S	.	.	H	α-helix	trans	-67.9	-48.3	176.9	-59.3	173.6	0	0	0	108.6	L273 V277 Y280 P287 D385 Y390 T391	L273-I387 HydrophobicContact CD1-CB 4.5Å; L273-I387 HydrophobicContact CD1-CG2 3.93Å; V277-I387 HydrophobicContact CG2-CD1 4.32Å; V277-I387 HydrophobicContact CG2-CG1 4.37Å; V277-I387 HydrophobicContact CG2-CG2 4.16Å; Y280-I387 HydrophobicContact CG-CD1 4.27Å; P287-I387 HydrophobicContact CG-CG1 4.47Å; D385-I387 WeakPolarHBondContact OD1-CA 3.42Å; D385-I387 WeakPolarHBondContact OD1-CB 3.4Å; D385-I387 PolarHBondContact OD1-N 3.33Å; I387-Y390 PolarHBondContact O-N 3.1Å; I387-T391 WeakPolarHBondContact O-CB 3.46Å; I387-T391 PolarHBondContact O-N 3.42Å; I387-T391 PolarHBondContact O-OG1 3.31Å
388	N	90.4	Very high	81.9	Confident	86 Å²	86	61 Å²	61	46%	0.46	33%	0.33	S	S	.	.	H	α-helix	trans	-62.4	-46.5	176.1	-63.6	4.9	0	0	0	110.8	R286 D385 T391 N392	R286-N388 PolarHBondContact NH1-OD1 3.06Å; D385-N388 HydrophobicContact CB-CB 4.12Å; D385-N388 PolarHBondContact OD1-N 3.08Å; D385-N388 PolarHBondContact OD1-OD1 3.48Å; N388-T391 PolarHBondContact O-N 3.5Å; N388-N392 VanDerWaalsContact O-CG 3.3Å; N388-N392 PolarHBondContact O-N 3.25Å; N388-N392 PolarHBondContact O-OD1 3.49Å
389	Y	89.6	Confident	83.8	Confident	66 Å²	66	63.3 Å²	63.3	26%	0.259	33%	0.334	S	S	.	.	H	α-helix	trans	-58.4	-50.2	177.4	174.3	-94.2	0	0	0	112.6	I289 D385 T391 K393	I289-Y389 HydrophobicContact CD1-CD1 3.78Å; I289-Y389 HydrophobicContact CD1-CE1 3.7Å; I289-Y389 HydrophobicContact CG2-CD1 4.01Å; I289-Y389 HydrophobicContact CG2-CD2 4.47Å; I289-Y389 HydrophobicContact CG2-CG 3.86Å; D385-Y389 VanDerWaalsContact O-CB 3.3Å; D385-Y389 WeakPolarHBondContact O-CB 3.4Å; D385-Y389 PolarHBondContact O-N 2.9Å; Y389-T391 VanDerWaalsContact C-N 3.35Å; Y389-K393 HydrophobicContact CE1-CD 3.73Å; Y389-K393 WeakPolarHBondContact O-CB 3.24Å; Y389-K393 PolarHBondContact O-N 3.33Å; Y389-K393 PolarHBondContact OH-NZ 2.87Å
390	Y	89.9	Confident	85.7	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-72.1	-28.4	-180	-67.2	-53.1	0	0	0	112.7	V269 A272 S276 I289 A386 I387 K394 S711 A713	V269-Y390 HydrophobicContact CG1-CD1 4.17Å; V269-Y390 VanDerWaalsContact CG1-O 3.27Å; V269-Y390 WeakPolarHBondContact CG1-O 3.38Å; A272-Y390 HydrophobicContact CB-CD1 4.11Å; A272-Y390 HydrophobicContact CB-CD2 4.09Å; A272-Y390 HydrophobicContact CB-CE1 3.72Å; A272-Y390 HydrophobicContact CB-CE2 3.71Å; A272-Y390 HydrophobicContact CB-CG 4.3Å; S276-Y390 WeakPolarHBondContact OG-CE2 3.24Å; I289-Y390 HydrophobicContact CD1-CE1 4.15Å; A386-Y390 HydrophobicContact CB-CD2 4.25Å; A386-Y390 HydrophobicContact CB-CE2 4.08Å; A386-Y390 WeakPolarHBondContact O-CB 3.43Å; A386-Y390 WeakPolarHBondContact O-CD2 3.42Å; A386-Y390 PolarHBondContact O-N 2.89Å; I387-Y390 PolarHBondContact O-N 3.1Å; Y390-K394 VanDerWaalsContact O-CB 3.28Å; Y390-K394 WeakPolarHBondContact O-CB 3.41Å; Y390-K394 PolarHBondContact O-N 3.01Å; Y390-S711 VanDerWaalsContact OH-CB 3.28Å; Y390-S711 WeakPolarHBondContact OH-CB 3.45Å; Y390-A713 HydrophobicContact CE2-CB 4.2Å
391	T	93	Very high	87.3	Confident	47 Å²	47	57.7 Å²	57.7	29%	0.288	29%	0.29	S	S	.	.	H	α-helix	trans	-66.4	-52.3	173.9	-62	0	0	0	0	111	L273 I387 N388 Y389 K393 K394 I395	L273-T391 WeakPolarHBondContact CD1-OG1 3.38Å; I387-T391 WeakPolarHBondContact O-CB 3.46Å; I387-T391 PolarHBondContact O-N 3.42Å; I387-T391 PolarHBondContact O-OG1 3.31Å; N388-T391 PolarHBondContact O-N 3.5Å; Y389-T391 VanDerWaalsContact C-N 3.35Å; T391-K393 VanDerWaalsContact C-N 3.26Å; T391-K393 PolarHBondContact O-N 3.29Å; T391-K394 WeakPolarHBondContact O-CB 3.22Å; T391-K394 PolarHBondContact O-N 3.32Å; T391-K394 VanDerWaalsContact O-N 3.11Å; T391-I395 HydrophobicContact CG2-CD1 4.27Å; T391-I395 WeakPolarHBondContact O-CG1 3.3Å; T391-I395 PolarHBondContact O-N 3.14Å; T391-I395 VanDerWaalsContact O-N 3.09Å
392	N	93.5	Very high	88.6	Confident	110 Å²	110	57.7 Å²	57.7	59%	0.588	29%	0.288	S	S	*	.	H	α-helix	trans	-61.6	-38.6	178	-64.4	5.7	0	0	0	110.9	N388 I395 Y396	N388-N392 VanDerWaalsContact O-CG 3.3Å; N388-N392 PolarHBondContact O-N 3.25Å; N388-N392 PolarHBondContact O-OD1 3.49Å; N392-I395 PolarHBondContact O-N 3.01Å; N392-Y396 PolarHBondContact O-N 3.26Å
393	K	91.6	Very high	89.9	Confident	67 Å²	67	60.6 Å²	60.6	29%	0.291	30%	0.295	S	S	.	.	H	α-helix	trans	-69.8	-30.7	176.5	-167.6	174.4	-176	176.5	0	113.7	V269 Y389 T391 L397	V269-K393 HydrophobicContact CG1-CB 4.24Å; V269-K393 HydrophobicContact CG1-CG 4.37Å; V269-K393 HydrophobicContact CG2-CD 3.8Å; V269-K393 HydrophobicContact CG2-CG 4.03Å; Y389-K393 HydrophobicContact CE1-CD 3.73Å; Y389-K393 WeakPolarHBondContact O-CB 3.24Å; Y389-K393 PolarHBondContact O-N 3.33Å; Y389-K393 PolarHBondContact OH-NZ 2.87Å; T391-K393 VanDerWaalsContact C-N 3.26Å; T391-K393 PolarHBondContact O-N 3.29Å; K393-L397 HydrophobicContact CG-CD1 4.25Å; K393-L397 WeakPolarHBondContact O-CB 3.38Å; K393-L397 WeakPolarHBondContact O-CD1 3.2Å; K393-L397 VanDerWaalsContact O-CG 3.24Å; K393-L397 WeakPolarHBondContact O-CG 3.36Å; K393-L397 PolarHBondContact O-N 2.82Å; K393-L397 VanDerWaalsContact O-N 3.09Å
394	K	92.7	Very high	90.9	Very high	98 Å²	98	60.8 Å²	60.8	43%	0.426	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-44	171.1	169.2	-160.9	166.5	-162.6	0	110.2	V269 L273 Y390 T391 Q398	V269-K394 HydrophobicContact CG1-CB 4.16Å; L273-K394 HydrophobicContact CD2-CD 4.22Å; Y390-K394 VanDerWaalsContact O-CB 3.28Å; Y390-K394 WeakPolarHBondContact O-CB 3.41Å; Y390-K394 PolarHBondContact O-N 3.01Å; T391-K394 WeakPolarHBondContact O-CB 3.22Å; T391-K394 PolarHBondContact O-N 3.32Å; T391-K394 VanDerWaalsContact O-N 3.11Å; K394-Q398 WeakPolarHBondContact O-CB 3.21Å; K394-Q398 PolarHBondContact O-N 3.32Å
395	I	94	Very high	91.4	Very high	82 Å²	82	61.2 Å²	61.2	42%	0.421	29%	0.289	S	S	.	.	H	α-helix	trans	-64.5	-54.8	179.6	-65.3	165.4	0	0	0	110.1	T391 N392 L397 Q398 E399	T391-I395 HydrophobicContact CG2-CD1 4.27Å; T391-I395 WeakPolarHBondContact O-CG1 3.3Å; T391-I395 PolarHBondContact O-N 3.14Å; T391-I395 VanDerWaalsContact O-N 3.09Å; N392-I395 PolarHBondContact O-N 3.01Å; I395-L397 VanDerWaalsContact C-N 3.3Å; I395-L397 PolarHBondContact O-N 3.09Å; I395-Q398 WeakPolarHBondContact O-CA 3.39Å; I395-Q398 VanDerWaalsContact O-CB 3.3Å; I395-Q398 WeakPolarHBondContact O-CB 3.27Å; I395-Q398 PolarHBondContact O-N 3Å; I395-E399 VanDerWaalsContact CG2-OE1 3.27Å; I395-E399 WeakPolarHBondContact CG2-OE1 3.39Å; I395-E399 PolarHBondContact O-N 3.06Å
396	Y	94.1	Very high	91.6	Very high	140 Å²	140	64.2 Å²	64.2	55%	0.549	30%	0.302	S	S	.	.	H	α-helix	trans	-53	-42.8	175.6	172.2	-91.7	0	0	0	113.4	N392 Q398 E400	N392-Y396 PolarHBondContact O-N 3.26Å; Y396-Q398 VanDerWaalsContact C-N 3.33Å; Y396-E400 WeakPolarHBondContact O-CB 3.16Å; Y396-E400 PolarHBondContact O-N 3.34Å; Y396-E400 VanDerWaalsContact O-N 3.11Å
397	L	92	Very high	91.7	Very high	8 Å²	8	67.5 Å²	67.5	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-69.7	-29.3	176.8	-75.6	170.8	0	0	0	112.9	L262 Q265 R266 V269 K393 I395 I401	L262-L397 HydrophobicContact CD2-CD2 3.98Å; Q265-L397 HydrophobicContact CB-CD1 4.09Å; Q265-L397 HydrophobicContact CB-CD2 4.25Å; R266-L397 HydrophobicContact CB-CB 4.48Å; V269-L397 HydrophobicContact CB-CD1 4.34Å; V269-L397 HydrophobicContact CG2-CD1 3.89Å; K393-L397 HydrophobicContact CG-CD1 4.25Å; K393-L397 WeakPolarHBondContact O-CB 3.38Å; K393-L397 WeakPolarHBondContact O-CD1 3.2Å; K393-L397 VanDerWaalsContact O-CG 3.24Å; K393-L397 WeakPolarHBondContact O-CG 3.36Å; K393-L397 PolarHBondContact O-N 2.82Å; K393-L397 VanDerWaalsContact O-N 3.09Å; I395-L397 VanDerWaalsContact C-N 3.3Å; I395-L397 PolarHBondContact O-N 3.09Å; L397-I401 WeakPolarHBondContact O-CB 3.45Å; L397-I401 VanDerWaalsContact O-CD1 3.27Å; L397-I401 WeakPolarHBondContact O-CD1 3.29Å; L397-I401 WeakPolarHBondContact O-CG1 3.41Å; L397-I401 PolarHBondContact O-N 2.94Å; L397-I401 VanDerWaalsContact O-N 3.15Å
398	Q	92.8	Very high	91.6	Very high	79 Å²	79	67.3 Å²	67.3	37%	0.369	32%	0.323	S	S	.	.	H	α-helix	trans	-69.3	-46.2	175.3	-178.6	62.5	28.1	0	0	111.1	K394 I395 Y396 I401 V402	K394-Q398 WeakPolarHBondContact O-CB 3.21Å; K394-Q398 PolarHBondContact O-N 3.32Å; I395-Q398 WeakPolarHBondContact O-CA 3.39Å; I395-Q398 VanDerWaalsContact O-CB 3.3Å; I395-Q398 WeakPolarHBondContact O-CB 3.27Å; I395-Q398 PolarHBondContact O-N 3Å; Y396-Q398 VanDerWaalsContact C-N 3.33Å; Q398-I401 PolarHBondContact O-N 3.46Å; Q398-V402 WeakPolarHBondContact O-CG2 3.48Å; Q398-V402 PolarHBondContact O-N 2.81Å; Q398-V402 VanDerWaalsContact O-N 3.08Å
399	E	94.3	Very high	91.4	Very high	115 Å²	115	65.8 Å²	65.8	54%	0.537	31%	0.314	S	S	.	.	H	α-helix	trans	-59.1	-50.7	176.8	-66.8	161.6	179.7	0	0	111.6	I395 I401 V402 K403	I395-E399 VanDerWaalsContact CG2-OE1 3.27Å; I395-E399 WeakPolarHBondContact CG2-OE1 3.39Å; I395-E399 PolarHBondContact O-N 3.06Å; E399-I401 VanDerWaalsContact C-N 3.26Å; E399-I401 PolarHBondContact O-N 3.42Å; E399-V402 PolarHBondContact O-N 2.85Å; E399-V402 VanDerWaalsContact O-N 3.16Å; E399-K403 WeakPolarHBondContact O-CB 3.45Å; E399-K403 PolarHBondContact O-N 2.76Å
400	E	93.2	Very high	91.3	Very high	38 Å²	38	70 Å²	70	18%	0.178	33%	0.334	C	S	.	.	H	α-helix	trans	-67.3	-25.7	-179.5	-169.5	68.1	177.9	0	0	112.2	L262 Y396 K403 H404	L262-E400 HydrophobicContact CD1-CG 4.29Å; L262-E400 HydrophobicContact CD2-CG 4.34Å; Y396-E400 WeakPolarHBondContact O-CB 3.16Å; Y396-E400 PolarHBondContact O-N 3.34Å; Y396-E400 VanDerWaalsContact O-N 3.11Å; E400-K403 IonicContact OE1-NZ 3.11Å; E400-K403 WeakPolarHBondContact OE2-CD 3.39Å; E400-K403 WeakPolarHBondContact OE2-CE 3.01Å; E400-K403 IonicContact OE2-NZ 3.48Å; E400-K403 PolarHBondContact OE2-NZ 3.44Å; E400-H404 WeakPolarHBondContact O-CB 3.41Å; E400-H404 PolarHBondContact O-N 3.34Å; E400-H404 VanDerWaalsContact O-N 3.12Å; E400-H404 IonicContact OE1-CD2 2.69Å; E400-H404 IonicContact OE1-NE2 3.01Å
401	I	91	Very high	91.1	Very high	18 Å²	18	77 Å²	77	9%	0.092	36%	0.364	C	S	.	.	H	α-helix	trans	-68.6	-48.2	169.8	-77.2	166.3	0	0	0	111.3	L259 L262 R266 L397 Q398 E399 H404 Y405	L259-I401 HydrophobicContact CD2-CG2 4.41Å; L262-I401 HydrophobicContact CB-CD1 4.03Å; L262-I401 HydrophobicContact CB-CG1 3.55Å; L262-I401 HydrophobicContact CD1-CG1 4.31Å; R266-I401 HydrophobicContact CB-CD1 4.12Å; L397-I401 WeakPolarHBondContact O-CB 3.45Å; L397-I401 VanDerWaalsContact O-CD1 3.27Å; L397-I401 WeakPolarHBondContact O-CD1 3.29Å; L397-I401 WeakPolarHBondContact O-CG1 3.41Å; L397-I401 PolarHBondContact O-N 2.94Å; L397-I401 VanDerWaalsContact O-N 3.15Å; Q398-I401 PolarHBondContact O-N 3.46Å; E399-I401 VanDerWaalsContact C-N 3.26Å; E399-I401 PolarHBondContact O-N 3.42Å; I401-H404 PolarHBondContact O-N 2.92Å; I401-Y405 WeakPolarHBondContact O-CB 2.97Å; I401-Y405 PolarHBondContact O-N 3.18Å
402	V	93.1	Very high	90.9	Very high	61 Å²	61	75.9 Å²	75.9	37%	0.37	36%	0.358	S	S	.	.	H	α-helix	trans	-60.8	-51.3	-179.7	172.5	0	0	0	0	110.5	Q398 E399 H404 Y405 E406	Q398-V402 WeakPolarHBondContact O-CG2 3.48Å; Q398-V402 PolarHBondContact O-N 2.81Å; Q398-V402 VanDerWaalsContact O-N 3.08Å; E399-V402 PolarHBondContact O-N 2.85Å; E399-V402 VanDerWaalsContact O-N 3.16Å; V402-H404 VanDerWaalsContact C-N 3.34Å; V402-H404 PolarHBondContact O-N 3.48Å; V402-Y405 WeakPolarHBondContact O-CA 2.82Å; V402-Y405 WeakPolarHBondContact O-CB 3.3Å; V402-Y405 PolarHBondContact O-N 3.1Å; V402-E406 PolarHBondContact O-N 3.35Å
403	K	92.4	Very high	90.6	Very high	121 Å²	121	71.5 Å²	71.5	53%	0.526	33%	0.334	S	S	.	.	H	α-helix	trans	-56.3	-41.3	176.4	174	177.7	158.1	-153.7	0	113.2	E399 E400 T407	E399-K403 WeakPolarHBondContact O-CB 3.45Å; E399-K403 PolarHBondContact O-N 2.76Å; E400-K403 IonicContact OE1-NZ 3.11Å; E400-K403 WeakPolarHBondContact OE2-CD 3.39Å; E400-K403 WeakPolarHBondContact OE2-CE 3.01Å; E400-K403 IonicContact OE2-NZ 3.48Å; E400-K403 PolarHBondContact OE2-NZ 3.44Å; K403-T407 PolarHBondContact O-N 3.37Å; K403-T407 PolarHBondContact O-OG1 2.81Å
404	H	90.7	Very high	90.4	Very high	36 Å²	36	68.6 Å²	68.6	17%	0.167	32%	0.323	C	S	.	.	H	α-helix	trans	-73.7	-32.2	173.6	-93.2	-41	0	0	0	113.6	L259 L262 E400 I401 V402 T407 T408	L259-H404 HydrophobicContact CD2-CB 3.9Å; L262-H404 HydrophobicContact CD1-CB 4.48Å; E400-H404 WeakPolarHBondContact O-CB 3.41Å; E400-H404 PolarHBondContact O-N 3.34Å; E400-H404 VanDerWaalsContact O-N 3.12Å; E400-H404 IonicContact OE1-CD2 2.69Å; E400-H404 IonicContact OE1-NE2 3.01Å; I401-H404 PolarHBondContact O-N 2.92Å; V402-H404 VanDerWaalsContact C-N 3.34Å; V402-H404 PolarHBondContact O-N 3.48Å; H404-T407 WeakPolarHBondContact O-CB 3.43Å; H404-T407 PolarHBondContact O-N 2.75Å; H404-T408 WeakPolarHBondContact O-CB 3.44Å; H404-T408 PolarHBondContact O-N 2.94Å; H404-T408 PolarHBondContact O-OG1 3.37Å
405	Y	90.3	Very high	90.3	Very high	62 Å²	62	64.9 Å²	64.9	24%	0.243	31%	0.307	C	S	.	.	H	α-helix	trans	-65.2	-47.2	178.7	163.7	-101.8	0	0	0	111.5	I401 V402 T407 T408 I409 L983 L984	I401-Y405 WeakPolarHBondContact O-CB 2.97Å; I401-Y405 PolarHBondContact O-N 3.18Å; V402-Y405 WeakPolarHBondContact O-CA 2.82Å; V402-Y405 WeakPolarHBondContact O-CB 3.3Å; V402-Y405 PolarHBondContact O-N 3.1Å; Y405-T407 PolarHBondContact O-N 3.32Å; Y405-T408 PolarHBondContact O-N 3.38Å; Y405-I409 PolarHBondContact O-N 3Å; Y405-L983 HydrophobicContact CD2-CB 4.47Å; Y405-L983 HydrophobicContact CE2-CB 4.13Å; Y405-L983 WeakPolarHBondContact CE2-O 3.22Å; Y405-L983 PolarHBondContact OH-O 3.01Å; Y405-L984 WeakPolarHBondContact OH-CG 3.49Å
406	E	90.6	Very high	90.2	Very high	88 Å²	88	61 Å²	61	41%	0.411	29%	0.287	S	S	.	.	H	α-helix	trans	-58.7	-31.5	172.5	-69	174.8	-158.6	0	0	113.2	V402 K410	V402-E406 PolarHBondContact O-N 3.35Å; E406-K410 VanDerWaalsContact O-CD 3.26Å; E406-K410 WeakPolarHBondContact O-CD 3.18Å; E406-K410 WeakPolarHBondContact O-CE 3.41Å; E406-K410 WeakPolarHBondContact O-CG 3.25Å
407	T	88.6	Confident	90.2	Very high	69 Å²	69	55.1 Å²	55.1	42%	0.423	27%	0.265	S	S	.	.	H	α-helix	trans	-75.9	-34.9	175.6	-57.3	0	0	0	0	111.9	K403 H404 Y405	K403-T407 PolarHBondContact O-N 3.37Å; K403-T407 PolarHBondContact O-OG1 2.81Å; H404-T407 WeakPolarHBondContact O-CB 3.43Å; H404-T407 PolarHBondContact O-N 2.75Å; Y405-T407 PolarHBondContact O-N 3.32Å
408	T	86.5	Confident	90.3	Very high	21 Å²	21	54.8 Å²	54.8	13%	0.129	26%	0.263	C	S	.	.	H	α-helix	trans	-78.1	-40.6	-176.8	-79.2	0	0	0	0	112.6	D255 L259 H404 Y405 K410 K411	D255-T408 VanDerWaalsContact O-CG2 3.31Å; D255-T408 WeakPolarHBondContact O-CG2 3.38Å; D255-T408 PolarHBondContact O-OG1 2.75Å; L259-T408 HydrophobicContact CD1-CG2 3.95Å; H404-T408 WeakPolarHBondContact O-CB 3.44Å; H404-T408 PolarHBondContact O-N 2.94Å; H404-T408 PolarHBondContact O-OG1 3.37Å; Y405-T408 PolarHBondContact O-N 3.38Å; T408-K410 PolarHBondContact O-N 2.86Å; T408-K411 PolarHBondContact O-N 3.44Å
409	I	86.3	Confident	90.4	Very high	53 Å²	53	52.2 Å²	52.2	27%	0.272	25%	0.253	S	S	.	.	H	α-helix	trans	-61.3	-31.7	179.4	-167.6	170.8	0	0	0	112.4	Y254 Y405 K411 L984	Y254-I409 HydrophobicContact CE1-CG1 3.97Å; Y254-I409 VanDerWaalsContact CE1-O 3.25Å; Y254-I409 WeakPolarHBondContact CE1-O 3.32Å; Y405-I409 PolarHBondContact O-N 3Å; I409-K411 PolarHBondContact O-N 3.38Å; I409-K411 VanDerWaalsContact O-N 3.11Å; I409-L984 HydrophobicContact CD1-CD1 4.06Å; I409-L984 HydrophobicContact CD1-CD2 3.95Å; I409-L984 HydrophobicContact CD1-CG 4.08Å
410	K	86	Confident	90.3	Very high	156 Å²	156	46.8 Å²	46.8	68%	0.678	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-3.4	175.9	-64.8	171.1	-172.5	172.6	0	114	E406 T408	E406-K410 VanDerWaalsContact O-CD 3.26Å; E406-K410 WeakPolarHBondContact O-CD 3.18Å; E406-K410 WeakPolarHBondContact O-CE 3.41Å; E406-K410 WeakPolarHBondContact O-CG 3.25Å; T408-K410 PolarHBondContact O-N 2.86Å
411	K	85.7	Confident	90.2	Very high	148 Å²	148	46.8 Å²	46.8	64%	0.643	23%	0.231	S	C	*	.	S	Bend	trans	-138.5	73.7	-172.5	-64.1	-176.9	-178.1	176.7	0	112.8	T408 I409	T408-K411 PolarHBondContact O-N 3.44Å; I409-K411 PolarHBondContact O-N 3.38Å; I409-K411 VanDerWaalsContact O-N 3.11Å
412	P	88.6	Confident	90.1	Very high	24 Å²	24	48.8 Å²	48.8	16%	0.156	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	148.4	177.4	29.7	-35.7	0	0	0	112.9	R226 C229 I252 Y254 G414	R226-P412 WeakPolarHBondContact O-CG 3.43Å; C229-P412 HydrophobicContact CB-CB 4.2Å; C229-P412 HydrophobicContact CB-CG 4.01Å; I252-P412 HydrophobicContact CG2-CB 3.63Å; Y254-P412 HydrophobicContact CD1-CB 4.08Å; Y254-P412 HydrophobicContact CE1-CB 4.08Å; P412-G414 PolarHBondContact O-N 3.49Å
413	I	87.8	Confident	89.9	Confident	18 Å²	18	49.8 Å²	49.8	9%	0.092	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	-21.2	-172.8	-64.9	164.1	0	0	0	112.7	R226 C253 Y254 I415 A474	R226-I413 PolarHBondContact NE-O 3.27Å; R226-I413 PolarHBondContact NH2-O 2.91Å; C253-I413 HydrophobicContact CB-CD1 4.21Å; C253-I413 PolarHBondContact O-N 3.49Å; Y254-I413 VanDerWaalsContact O-CD1 3.26Å; Y254-I413 WeakPolarHBondContact O-CD1 3.37Å; I413-I415 HydrophobicContact CG2-CD1 3.98Å; I413-I415 HydrophobicContact CG2-CG1 4.18Å; I413-A474 HydrophobicContact CD1-CB 3.78Å; I413-A474 HydrophobicContact CG1-CB 4.35Å
414	G	88	Confident	89.6	Confident	5 Å²	5	47.1 Å²	47.1	5%	0.052	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	90.3	30.1	-168.6	0	0	0	0	0	113.3	G223 I224 P412	G223-G414 PolarHBondContact N-O 3.11Å; I224-G414 PolarHBondContact N-O 3.15Å; I224-G414 VanDerWaalsContact O-CA 3.24Å; I224-G414 WeakPolarHBondContact O-CA 3.25Å; P412-G414 PolarHBondContact O-N 3.49Å
415	I	90.6	Very high	89.6	Confident	20 Å²	20	45.4 Å²	45.4	10%	0.103	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	138.6	176.3	-59.5	174.3	0	0	0	107.7	M220 I221 C253 I413 L473	M220-I415 HydrophobicContact CE-CD1 4.31Å; M220-I415 HydrophobicContact CE-CG2 3.84Å; M220-I415 HydrophobicContact CG-CG2 4.24Å; I221-I415 CarbonylContact O-C 3.58Å; I221-I415 VanDerWaalsContact O-CA 3.27Å; I221-I415 WeakPolarHBondContact O-CA 3.06Å; C253-I415 HydrophobicContact CB-CB 3.98Å; C253-I415 HydrophobicContact CB-CG2 4.3Å; C253-I415 WeakPolarHBondContact CB-O 3.13Å; C253-I415 PolarHBondContact N-O 2.91Å; I413-I415 HydrophobicContact CG2-CD1 3.98Å; I413-I415 HydrophobicContact CG2-CG1 4.18Å; I415-L473 HydrophobicContact CD1-CD1 3.96Å; I415-L473 HydrophobicContact CD1-CG 4.17Å
416	A	92.3	Very high	89.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.5	172.1	0	0	0	0	0	111.5	I221 I224 I234 V250 Q251 I252	I221-A416 PolarHBondContact N-O 3.24Å; I221-A416 PolarHBondContact O-N 3.29Å; I224-A416 HydrophobicContact CD1-CB 3.63Å; I234-A416 HydrophobicContact CD1-CB 3.92Å; V250-A416 HydrophobicContact CG1-CB 4.49Å; Q251-A416 CarbonylContact O-C 3.58Å; Q251-A416 VanDerWaalsContact O-CA 3.26Å; Q251-A416 WeakPolarHBondContact O-CA 3.24Å; I252-A416 HydrophobicContact CG1-CB 4.5Å
417	F	94.1	Very high	89.3	Confident	18 Å²	18	38.2 Å²	38.2	8%	0.079	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.5	168.8	-63.9	-72.3	0	0	0	109	T218 L219 M220 V250 Q251 C253 A462 I468 W470	T218-F417 HydrophobicContact CG2-CB 3.84Å; L219-F417 CarbonylContact O-C 3.58Å; L219-F417 VanDerWaalsContact O-CA 3.32Å; L219-F417 WeakPolarHBondContact O-CA 3.44Å; M220-F417 HydrophobicContact CB-CD1 3.88Å; M220-F417 HydrophobicContact CB-CE1 3.7Å; M220-F417 HydrophobicContact CG-CD1 4.13Å; M220-F417 HydrophobicContact CG-CE1 3.61Å; M220-F417 HydrophobicContact CG-CZ 4.3Å; M220-F417 HydrophobicContact SD-CE1 3.9Å; M220-F417 HydrophobicContact SD-CZ 4.3Å; V250-F417 CarbonylContact C-O 3.05Å; V250-F417 WeakPolarHBondContact CA-O 3.45Å; Q251-F417 HydrophobicContact CB-CB 4.48Å; Q251-F417 PolarHBondContact N-O 3.19Å; Q251-F417 PolarHBondContact O-N 3.07Å; C253-F417 WeakPolarHBondContact SG-CE2 3.47Å; F417-A462 HydrophobicContact CD1-CB 3.61Å; F417-A462 HydrophobicContact CE1-CB 3.81Å; F417-I468 HydrophobicContact CE1-CD1 4.29Å; F417-I468 HydrophobicContact CZ-CD1 3.83Å; F417-W470 AromaticContact CE2-CH2 3.74Å; F417-W470 HydrophobicContact CE2-CH2 3.74Å; F417-W470 AromaticContact CE2-CZ3 3.88Å; F417-W470 HydrophobicContact CE2-CZ3 3.88Å; F417-W470 HydrophobicContact CZ-CH2 4.24Å
418	V	93.7	Very high	89.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	113.4	-176.8	-179.5	0	0	0	0	108.6	T218 L219 I221 I234 F238 V247 D249 V250 F420	T218-V418 CarbonylContact C-O 3.54Å; T218-V418 VanDerWaalsContact CA-O 3.27Å; T218-V418 WeakPolarHBondContact CA-O 3.19Å; T218-V418 WeakPolarHBondContact CG2-O 3.35Å; L219-V418 PolarHBondContact N-O 2.9Å; L219-V418 PolarHBondContact O-N 3.28Å; I221-V418 HydrophobicContact CD1-CB 4.31Å; I221-V418 HydrophobicContact CD1-CG2 3.53Å; I221-V418 HydrophobicContact CG1-CG2 4.22Å; I234-V418 HydrophobicContact CG2-CG2 4.01Å; F238-V418 HydrophobicContact CD2-CG1 4.2Å; F238-V418 HydrophobicContact CE2-CG1 4.24Å; F238-V418 HydrophobicContact CE2-CG2 4.17Å; V247-V418 HydrophobicContact CG1-CG1 3.69Å; V247-V418 HydrophobicContact CG2-CG1 3.96Å; D249-V418 WeakPolarHBondContact O-CA 3.48Å; V250-V418 HydrophobicContact CG1-CG2 4.34Å; V250-V418 HydrophobicContact CG2-CG1 4.19Å; V250-V418 HydrophobicContact CG2-CG2 4.14Å; V418-F420 HydrophobicContact CB-CE2 4.16Å; V418-F420 HydrophobicContact CG1-CD2 4.29Å; V418-F420 HydrophobicContact CG1-CE1 4.44Å; V418-F420 HydrophobicContact CG1-CE2 3.59Å; V418-F420 HydrophobicContact CG1-CZ 3.68Å
419	T	94.3	Very high	89.2	Confident	26 Å²	26	36.2 Å²	36.2	16%	0.16	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126.4	-179.3	-57.6	0	0	0	0	109.9	K217 T218 V247 E248 D249	K217-T419 HydrophobicContact CB-CG2 3.81Å; K217-T419 HydrophobicContact CD-CG2 4.43Å; K217-T419 WeakPolarHBondContact O-CA 3.46Å; T218-T419 VanDerWaalsContact CG2-OG1 3.3Å; T218-T419 WeakPolarHBondContact CG2-OG1 3.36Å; T218-T419 PolarHBondContact OG1-OG1 3.04Å; V247-T419 CarbonylContact C-O 3.52Å; V247-T419 WeakPolarHBondContact CA-O 3.43Å; V247-T419 WeakPolarHBondContact CG1-O 3.29Å; E248-T419 HydrophobicContact CB-CG2 4.31Å; E248-T419 PolarHBondContact N-O 3.27Å; E248-T419 VanDerWaalsContact OE2-CG2 3.27Å; E248-T419 WeakPolarHBondContact OE2-CG2 3.49Å; D249-T419 PolarHBondContact N-O 3.3Å; D249-T419 PolarHBondContact O-N 2.83Å
420	F	93	Very high	89.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	151.9	-179.9	-64.9	-95	0	0	0	111.8	K217 L219 F238 C245 V247 V418 T422 A425 A426 V429	K217-F420 WeakPolarHBondContact CB-O 3.34Å; K217-F420 WeakPolarHBondContact CD-O 3.49Å; K217-F420 WeakPolarHBondContact CG-O 3.48Å; K217-F420 PolarHBondContact O-N 3.22Å; L219-F420 HydrophobicContact CB-CE2 4.32Å; L219-F420 HydrophobicContact CD1-CD2 4.41Å; L219-F420 HydrophobicContact CD1-CE2 3.62Å; L219-F420 HydrophobicContact CD1-CZ 4.23Å; L219-F420 HydrophobicContact CG-CD2 4.25Å; L219-F420 HydrophobicContact CG-CE2 3.77Å; F238-F420 HydrophobicContact CD1-CE1 4.37Å; F238-F420 HydrophobicContact CD1-CZ 4.17Å; F238-F420 HydrophobicContact CE1-CZ 4.28Å; F238-F420 HydrophobicContact CG-CZ 4.49Å; C245-F420 HydrophobicContact CB-CD1 4.14Å; C245-F420 HydrophobicContact CB-CE1 4.27Å; C245-F420 WeakPolarHBondContact O-CD1 3.35Å; V247-F420 HydrophobicContact CG2-CD1 3.92Å; V247-F420 HydrophobicContact CG2-CE1 3.68Å; V247-F420 HydrophobicContact CG2-CZ 4.27Å; V418-F420 HydrophobicContact CB-CE2 4.16Å; V418-F420 HydrophobicContact CG1-CD2 4.29Å; V418-F420 HydrophobicContact CG1-CE1 4.44Å; V418-F420 HydrophobicContact CG1-CE2 3.59Å; V418-F420 HydrophobicContact CG1-CZ 3.68Å; F420-T422 PolarHBondContact O-N 2.85Å; F420-A425 HydrophobicContact CB-CB 3.85Å; F420-A425 HydrophobicContact CD1-CB 4.04Å; F420-A425 HydrophobicContact CG-CB 4.22Å; F420-A426 HydrophobicContact CB-CB 4.21Å; F420-A426 HydrophobicContact CD2-CB 3.87Å; F420-A426 HydrophobicContact CG-CB 4.28Å; F420-V429 HydrophobicContact CE1-CG2 3.92Å; F420-V429 HydrophobicContact CZ-CB 4.19Å; F420-V429 HydrophobicContact CZ-CG1 4.06Å; F420-V429 HydrophobicContact CZ-CG2 4.06Å
421	S	90.2	Very high	89	Confident	38 Å²	38	27.1 Å²	27.1	27%	0.266	14%	0.135	S	C	.	.	S	Bend	trans	-53.5	-37.2	178.9	63.5	0	0	0	0	113.5	K217 P246 E248	K217-S421 WeakPolarHBondContact CE-O 3.38Å; K217-S421 PolarHBondContact NZ-O 2.99Å; P246-S421 PolarHBondContact O-N 3.4Å; P246-S421 PolarHBondContact O-OG 3.07Å; E248-S421 WeakPolarHBondContact OE1-CA 3.34Å
422	T	89.4	Confident	88.8	Confident	61 Å²	61	22.6 Å²	22.6	37%	0.374	12%	0.116	S	C	.	.	S	Bend	trans	-126.2	153.7	-178	69.5	0	0	0	0	112.3	F420 Y424 A425 A426	F420-T422 PolarHBondContact O-N 2.85Å; T422-Y424 PolarHBondContact O-N 2.93Å; T422-A425 PolarHBondContact O-N 3.17Å; T422-A425 WeakPolarHBondContact OG1-CB 3.31Å; T422-A425 PolarHBondContact OG1-N 2.85Å; T422-A426 PolarHBondContact O-N 3.32Å
423	K	88.7	Confident	88.5	Confident	81 Å²	81	23.2 Å²	23.2	35%	0.352	12%	0.115	S	C	.	.	H	α-helix	trans	-63.6	-26.7	170.3	-53.4	-178.1	-178.6	-174.2	0	111.7	E216 K217 A427 L853 N973	E216-K423 HydrophobicContact CB-CD 3.97Å; E216-K423 HydrophobicContact CB-CG 4.07Å; E216-K423 HydrophobicContact CG-CD 4.49Å; E216-K423 WeakPolarHBondContact OE2-CD 3.04Å; E216-K423 WeakPolarHBondContact OE2-CE 3.29Å; E216-K423 IonicContact OE2-NZ 2.71Å; E216-K423 PolarHBondContact OE2-NZ 2.83Å; K217-K423 HydrophobicContact CG-CG 4.43Å; K423-A427 VanDerWaalsContact O-CB 3.3Å; K423-A427 WeakPolarHBondContact O-CB 3.18Å; K423-A427 PolarHBondContact O-N 2.87Å; K423-A427 VanDerWaalsContact O-N 3.11Å; K423-L853 HydrophobicContact CB-CD2 4.1Å; K423-N973 PolarHBondContact NZ-OD1 2.74Å; K423-N973 VanDerWaalsContact NZ-OD1 3.16Å
424	Y	86.4	Confident	88	Confident	65 Å²	65	26.6 Å²	26.6	26%	0.255	13%	0.127	S	C	.	.	H	α-helix	trans	-65.3	-53.9	174.4	175	-88.8	0	0	0	111	T422 A426 A427 H428 A857 V860	T422-Y424 PolarHBondContact O-N 2.93Å; Y424-A426 PolarHBondContact O-N 3Å; Y424-A427 CarbonylContact O-C 3.35Å; Y424-A427 WeakPolarHBondContact O-CA 3.42Å; Y424-A427 WeakPolarHBondContact O-CB 3.27Å; Y424-A427 PolarHBondContact O-N 3.15Å; Y424-H428 WeakPolarHBondContact O-CB 3.35Å; Y424-H428 PolarHBondContact O-N 3.29Å; Y424-A857 HydrophobicContact CD2-CB 4.41Å; Y424-A857 HydrophobicContact CE2-CB 4.29Å; Y424-V860 HydrophobicContact CD2-CB 4.31Å; Y424-V860 HydrophobicContact CD2-CG2 4.06Å; Y424-V860 HydrophobicContact CE2-CB 3.66Å; Y424-V860 HydrophobicContact CE2-CG1 4.46Å; Y424-V860 HydrophobicContact CE2-CG2 3.86Å
425	A	89.8	Confident	87	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.4	-47	179.9	0	0	0	0	0	112.2	C245 F420 T422 A427 H428 V429	C245-A425 HydrophobicContact CB-CB 3.7Å; F420-A425 HydrophobicContact CB-CB 3.85Å; F420-A425 HydrophobicContact CD1-CB 4.04Å; F420-A425 HydrophobicContact CG-CB 4.22Å; T422-A425 PolarHBondContact O-N 3.17Å; T422-A425 WeakPolarHBondContact OG1-CB 3.31Å; T422-A425 PolarHBondContact OG1-N 2.85Å; A425-A427 VanDerWaalsContact C-N 3.33Å; A425-A427 PolarHBondContact O-N 3.07Å; A425-H428 PolarHBondContact O-N 3.34Å; A425-V429 WeakPolarHBondContact O-CG2 3Å; A425-V429 PolarHBondContact O-N 2.97Å
426	A	89.5	Confident	85.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.7	-40.1	174.2	0	0	0	0	0	112.5	L219 F420 T422 Y424 C430 F461	L219-A426 HydrophobicContact CD2-CB 4.22Å; L219-A426 HydrophobicContact CG-CB 4.36Å; F420-A426 HydrophobicContact CB-CB 4.21Å; F420-A426 HydrophobicContact CD2-CB 3.87Å; F420-A426 HydrophobicContact CG-CB 4.28Å; T422-A426 PolarHBondContact O-N 3.32Å; Y424-A426 PolarHBondContact O-N 3Å; A426-C430 WeakPolarHBondContact O-CB 3.23Å; A426-C430 PolarHBondContact O-N 3.49Å; A426-C430 VanDerWaalsContact O-N 3.1Å; A426-F461 HydrophobicContact CB-CE1 3.98Å
427	A	86.5	Confident	83.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-70.2	-37	176.9	0	0	0	0	0	113.3	K423 Y424 A425 K431 F461 L853 F854	K423-A427 VanDerWaalsContact O-CB 3.3Å; K423-A427 WeakPolarHBondContact O-CB 3.18Å; K423-A427 PolarHBondContact O-N 2.87Å; K423-A427 VanDerWaalsContact O-N 3.11Å; Y424-A427 CarbonylContact O-C 3.35Å; Y424-A427 WeakPolarHBondContact O-CA 3.42Å; Y424-A427 WeakPolarHBondContact O-CB 3.27Å; Y424-A427 PolarHBondContact O-N 3.15Å; A425-A427 VanDerWaalsContact C-N 3.33Å; A425-A427 PolarHBondContact O-N 3.07Å; A427-K431 WeakPolarHBondContact O-CB 3.5Å; A427-K431 PolarHBondContact O-N 2.88Å; A427-F461 HydrophobicContact CB-CZ 4.06Å; A427-L853 HydrophobicContact CB-CB 3.95Å; A427-L853 HydrophobicContact CB-CD2 4.43Å; A427-F854 HydrophobicContact CB-CD1 4.4Å; A427-F854 WeakPolarHBondContact O-CE1 3.33Å
428	H	84.8	Confident	81.9	Confident	48 Å²	48	42.7 Å²	42.7	22%	0.222	21%	0.207	C	C	.	.	H	α-helix	trans	-63.8	-57.2	177.2	-175.3	-105.5	0	0	0	110.7	Y242 Y424 A425 C430 K431 E432	Y242-H428 AromaticContact CD1-ND1 4Å; Y424-H428 WeakPolarHBondContact O-CB 3.35Å; Y424-H428 PolarHBondContact O-N 3.29Å; A425-H428 PolarHBondContact O-N 3.34Å; H428-C430 VanDerWaalsContact C-N 3.32Å; H428-C430 PolarHBondContact O-N 3.07Å; H428-K431 WeakPolarHBondContact O-CB 3.11Å; H428-K431 PolarHBondContact O-N 3.22Å; H428-E432 PolarHBondContact O-N 3.23Å
429	V	87.5	Confident	79.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.1	-41.3	178.3	173.5	0	0	0	0	112	L219 F238 Y242 C245 F420 A425 K431 Y433	L219-V429 HydrophobicContact CD1-CB 4.02Å; L219-V429 HydrophobicContact CD1-CG1 3.8Å; F238-V429 HydrophobicContact CD1-CG1 4.27Å; F238-V429 HydrophobicContact CE1-CG1 3.56Å; F238-V429 HydrophobicContact CZ-CG1 4.38Å; Y242-V429 HydrophobicContact CD1-CG2 3.99Å; Y242-V429 HydrophobicContact CD2-CG2 4.05Å; Y242-V429 HydrophobicContact CE1-CG2 4.23Å; Y242-V429 HydrophobicContact CE2-CG1 4.47Å; Y242-V429 HydrophobicContact CE2-CG2 4.31Å; Y242-V429 HydrophobicContact CG-CG2 3.89Å; C245-V429 HydrophobicContact CB-CG2 4.3Å; F420-V429 HydrophobicContact CE1-CG2 3.92Å; F420-V429 HydrophobicContact CZ-CB 4.19Å; F420-V429 HydrophobicContact CZ-CG1 4.06Å; F420-V429 HydrophobicContact CZ-CG2 4.06Å; A425-V429 WeakPolarHBondContact O-CG2 3Å; A425-V429 PolarHBondContact O-N 2.97Å; V429-K431 VanDerWaalsContact C-N 3.34Å; V429-K431 PolarHBondContact O-N 3.16Å; V429-Y433 HydrophobicContact CG1-CD2 4.1Å; V429-Y433 HydrophobicContact CG1-CE2 4.44Å; V429-Y433 PolarHBondContact O-N 3.11Å
430	C	86.4	Confident	77.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-36.1	176.6	-174.9	0	0	0	0	112.5	L219 A426 H428 R434 F461 F854	L219-C430 HydrophobicContact CD1-CB 4.01Å; L219-C430 HydrophobicContact CD2-CB 3.78Å; A426-C430 WeakPolarHBondContact O-CB 3.23Å; A426-C430 PolarHBondContact O-N 3.49Å; A426-C430 VanDerWaalsContact O-N 3.1Å; H428-C430 VanDerWaalsContact C-N 3.32Å; H428-C430 PolarHBondContact O-N 3.07Å; C430-R434 WeakPolarHBondContact O-CB 3.42Å; C430-R434 WeakPolarHBondContact O-CD 3.02Å; C430-R434 WeakPolarHBondContact O-CG 3.4Å; C430-R434 PolarHBondContact O-N 2.81Å; C430-F461 HydrophobicContact CB-CD2 4.5Å; C430-F461 HydrophobicContact CB-CE2 4.12Å; C430-F461 HydrophobicContact CB-CZ 4.21Å; C430-F461 VanDerWaalsContact SG-CD2 3.59Å; C430-F854 HydrophobicContact CB-CE1 4.42Å
431	K	82.6	Confident	75.9	Confident	18 Å²	18	56.3 Å²	56.3	8%	0.078	27%	0.265	C	S	.	.	H	α-helix	trans	-69.5	-47.3	178	177.8	-176.6	168.6	-164.8	0	111.4	A427 H428 V429 R434 N435 F854 H858	A427-K431 WeakPolarHBondContact O-CB 3.5Å; A427-K431 PolarHBondContact O-N 2.88Å; H428-K431 WeakPolarHBondContact O-CB 3.11Å; H428-K431 PolarHBondContact O-N 3.22Å; V429-K431 VanDerWaalsContact C-N 3.34Å; V429-K431 PolarHBondContact O-N 3.16Å; K431-R434 PolarHBondContact O-N 3.08Å; K431-R434 VanDerWaalsContact O-N 3.07Å; K431-N435 WeakPolarHBondContact O-CB 3.41Å; K431-N435 PolarHBondContact O-N 3.01Å; K431-F854 HydrophobicContact CB-CD1 3.79Å; K431-F854 HydrophobicContact CB-CE1 3.87Å; K431-F854 HydrophobicContact CD-CD1 4.36Å; K431-F854 HydrophobicContact CG-CD1 4.3Å; K431-H858 PolarHBondContact NZ-CD2 3.33Å; K431-H858 PolarHBondContact NZ-CE1 3.06Å; K431-H858 PolarHBondContact NZ-NE2 3.44Å
432	E	81.7	Confident	74.1	Confident	53 Å²	53	60.7 Å²	60.7	25%	0.248	28%	0.283	C	S	.	.	H	α-helix	trans	-60.1	-51.7	178.9	-70.1	-49.6	104.3	0	0	111.6	Y242 H428 R434 N435 I436	Y242-E432 HydrophobicContact CE1-CG 4.43Å; H428-E432 PolarHBondContact O-N 3.23Å; E432-R434 PolarHBondContact O-N 3.12Å; E432-N435 PolarHBondContact O-N 3.16Å; E432-I436 HydrophobicContact CB-CD1 4.16Å; E432-I436 WeakPolarHBondContact O-CB 3.37Å; E432-I436 WeakPolarHBondContact O-CD1 3.09Å; E432-I436 WeakPolarHBondContact O-CG1 3.15Å; E432-I436 PolarHBondContact O-N 3.33Å
433	Y	81.2	Confident	72.3	Confident	36 Å²	36	62.1 Å²	62.1	14%	0.141	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-10.9	175.9	-93.2	-82.7	0	0	0	115.3	H237 F238 Y242 V429 W457 V459	H237-Y433 PolarHBondContact NE2-OH 3.31Å; F238-Y433 HydrophobicContact CE1-CE2 4.35Å; Y242-Y433 HydrophobicContact CE2-CE2 4.41Å; V429-Y433 HydrophobicContact CG1-CD2 4.1Å; V429-Y433 HydrophobicContact CG1-CE2 4.44Å; V429-Y433 PolarHBondContact O-N 3.11Å; Y433-W457 HydrophobicContact CE1-CB 4.41Å; Y433-W457 HydrophobicContact CE1-CE3 4.04Å; Y433-W457 AromaticContact CZ-CE3 3.89Å; Y433-V459 HydrophobicContact CD1-CB 4.45Å; Y433-V459 HydrophobicContact CD1-CG2 3.6Å; Y433-V459 HydrophobicContact CD2-CG2 4.02Å; Y433-V459 HydrophobicContact CE1-CG2 4.12Å; Y433-V459 HydrophobicContact CE2-CG2 4.49Å; Y433-V459 HydrophobicContact CG-CB 4.06Å; Y433-V459 HydrophobicContact CG-CG2 3.54Å
434	R	77	Confident	71	Confident	89 Å²	89	61 Å²	61	34%	0.336	29%	0.293	S	S	.	.	H	α-helix	trans	-104.5	-34.2	176.1	-74.6	170.5	157.9	-129	-6.8	113.6	C430 K431 E432 D460 H968	C430-R434 WeakPolarHBondContact O-CB 3.42Å; C430-R434 WeakPolarHBondContact O-CD 3.02Å; C430-R434 WeakPolarHBondContact O-CG 3.4Å; C430-R434 PolarHBondContact O-N 2.81Å; K431-R434 PolarHBondContact O-N 3.08Å; K431-R434 VanDerWaalsContact O-N 3.07Å; E432-R434 PolarHBondContact O-N 3.12Å; R434-D460 IonicContact CZ-OD1 3.13Å; R434-D460 IonicContact NE-OD1 2.83Å; R434-D460 IonicContact NH2-OD1 3.62Å; R434-D460 PolarHBondContact NH2-OD1 3.14Å; R434-H968 PolarHBondContact NH2-CE1 3.47Å; R434-H968 VanDerWaalsContact NH2-CE1 3.32Å
435	N	67.6	Low	69.9	Low	106 Å²	106	63.2 Å²	63.2	57%	0.567	31%	0.307	S	S	*	.	H	α-helix	trans	-79	-34.2	179.3	-77.2	-3.3	0	0	0	111.9	K431 E432 C437	K431-N435 WeakPolarHBondContact O-CB 3.41Å; K431-N435 PolarHBondContact O-N 3.01Å; E432-N435 PolarHBondContact O-N 3.16Å; N435-C437 PolarHBondContact O-N 2.83Å
436	I	59.5	Low	69.4	Low	31 Å²	31	63.6 Å²	63.6	16%	0.159	31%	0.31	C	S	.	.	S	Bend	trans	-66.2	99.7	178.9	-63.9	164.8	0	0	0	109	E432 R438 L440 I441 I444	E432-I436 HydrophobicContact CB-CD1 4.16Å; E432-I436 WeakPolarHBondContact O-CB 3.37Å; E432-I436 WeakPolarHBondContact O-CD1 3.09Å; E432-I436 WeakPolarHBondContact O-CG1 3.15Å; E432-I436 PolarHBondContact O-N 3.33Å; I436-R438 PolarHBondContact O-N 3.04Å; I436-L440 HydrophobicContact CG2-CB 3.67Å; I436-I441 HydrophobicContact CB-CG1 4.45Å; I436-I441 HydrophobicContact CG2-CB 4.35Å; I436-I441 HydrophobicContact CG2-CG1 3.51Å; I436-I444 HydrophobicContact CD1-CD1 3.62Å
437	C	54.1	Low	69	Low	91 Å²	91	66.9 Å²	66.9	62%	0.615	33%	0.333	S	S	*	.			trans	-55.4	131.8	168.8	-167.4	0	0	0	0	108.4	N435 R439 L440	N435-C437 PolarHBondContact O-N 2.83Å; C437-R439 PolarHBondContact O-N 3.45Å; C437-L440 PolarHBondContact O-N 3.33Å
438	R	55.9	Low	68.7	Low	153 Å²	153	67.1 Å²	67.1	58%	0.577	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-50.6	-22.7	-163	-85.9	-176.6	165.9	172.6	-3.8	116.7	I436 L440 I441	I436-R438 PolarHBondContact O-N 3.04Å; R438-L440 VanDerWaalsContact C-N 3.32Å; R438-I441 HydrophobicContact CB-CD1 4.41Å; R438-I441 HydrophobicContact CG-CD1 3.95Å
439	R	51.4	Low	68.5	Low	186 Å²	186	64.9 Å²	64.9	70%	0.702	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-64	-32.3	173.4	-62.6	-177.9	179.8	-179.8	-0.4	113.1	C437	C437-R439 PolarHBondContact O-N 3.45Å
440	L	51.3	Low	68.1	Low	107 Å²	107	68.4 Å²	68.4	56%	0.56	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-84.7	-10	-179.7	-88.3	153.9	0	0	0	114.3	I436 C437 R438 I442 S443	I436-L440 HydrophobicContact CG2-CB 3.67Å; C437-L440 PolarHBondContact O-N 3.33Å; R438-L440 VanDerWaalsContact C-N 3.32Å; L440-I442 PolarHBondContact O-N 2.92Å; L440-S443 PolarHBondContact O-N 3.46Å; L440-S443 PolarHBondContact O-OG 3.31Å
441	I	53.1	Low	68	Low	20 Å²	20	71.3 Å²	71.3	10%	0.103	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-64.5	-15.3	174.7	-48.9	171.7	0	0	0	111.1	I436 R438 S443 I444 H455	I436-I441 HydrophobicContact CB-CG1 4.45Å; I436-I441 HydrophobicContact CG2-CB 4.35Å; I436-I441 HydrophobicContact CG2-CG1 3.51Å; R438-I441 HydrophobicContact CB-CD1 4.41Å; R438-I441 HydrophobicContact CG-CD1 3.95Å; I441-S443 VanDerWaalsContact C-N 3.29Å; I441-S443 PolarHBondContact O-N 2.9Å; I441-I444 PolarHBondContact O-N 2.79Å; I441-H455 HydrophobicContact CB-CB 4.23Å; I441-H455 HydrophobicContact CD1-CB 4.43Å; I441-H455 HydrophobicContact CG2-CB 3.96Å
442	I	51.6	Low	68.1	Low	129 Å²	129	70.4 Å²	70.4	66%	0.662	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-65.9	-27.9	174.3	-57.8	175.7	0	0	0	111.9	L440	L440-I442 PolarHBondContact O-N 2.92Å
443	S	52.3	Low	68.1	Low	92 Å²	92	72.7 Å²	72.7	64%	0.643	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-84.6	-14.2	178.8	64.6	0	0	0	0	114.2	L440 I441	L440-S443 PolarHBondContact O-N 3.46Å; L440-S443 PolarHBondContact O-OG 3.31Å; I441-S443 VanDerWaalsContact C-N 3.29Å; I441-S443 PolarHBondContact O-N 2.9Å
444	I	60.8	Low	68.1	Low	56 Å²	56	71.2 Å²	71.2	29%	0.287	37%	0.366	S	S	.	.			trans	-109.6	77.4	-179.1	-50.7	-166.7	0	0	0	109.8	L241 I436 I441	L241-I444 HydrophobicContact CD1-CG2 3.87Å; L241-I444 HydrophobicContact CD2-CG2 3.63Å; L241-I444 HydrophobicContact CG-CG2 4.27Å; I436-I444 HydrophobicContact CD1-CD1 3.62Å; I441-I444 PolarHBondContact O-N 2.79Å
445	M	64.3	Low	68.1	Low	112 Å²	112	71.4 Å²	71.4	55%	0.552	37%	0.371	S	S	*	.			trans	-115.6	100	-177.1	-71.1	-167.6	60.7	0	0	112.8
446	S	77.3	Confident	68.8	Low	8 Å²	8	71.2 Å²	71.2	6%	0.056	37%	0.368	C	S	.	.			trans	-60.6	161.8	158	70.3	0	0	0	0	111.1	H237 E240 T448 S449	H237-S446 PolarHBondContact ND1-OG 3.26Å; E240-S446 WeakPolarHBondContact OE2-CB 3.48Å; S446-T448 PolarHBondContact O-N 3.43Å; S446-T448 PolarHBondContact OG-N 3.16Å; S446-T448 PolarHBondContact OG-OG1 3.19Å; S446-T448 VanDerWaalsContact OG-OG1 3.08Å; S446-S449 PolarHBondContact N-OG 2.94Å; S446-S449 WeakPolarHBondContact O-CB 3.48Å; S446-S449 PolarHBondContact O-N 2.86Å; S446-S449 PolarHBondContact OG-N 3.05Å; S446-S449 PolarHBondContact OG-OG 2.8Å
447	S	81.4	Confident	70.1	Confident	69 Å²	69	70.4 Å²	70.4	48%	0.483	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-25.8	173.5	67.6	0	0	0	0	112.9	R236 E240	R236-S447 PolarHBondContact NE-OG 2.78Å; R236-S447 PolarHBondContact NH2-OG 2.69Å; E240-S447 PolarHBondContact OE1-OG 3.3Å; E240-S447 WeakPolarHBondContact OE2-CB 3.46Å; E240-S447 PolarHBondContact OE2-N 3.14Å; E240-S447 PolarHBondContact OE2-OG 2.65Å
448	T	80.9	Confident	71.6	Confident	5 Å²	5	68.8 Å²	68.8	3%	0.031	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-8.8	-178.5	63.5	0	0	0	0	114	L233 R236 H237 S446 S450 V451 L452	L233-T448 HydrophobicContact CD2-CG2 3.64Å; R236-T448 HydrophobicContact CB-CG2 4.33Å; R236-T448 HydrophobicContact CG-CG2 4.09Å; H237-T448 WeakPolarHBondContact CA-OG1 3.24Å; H237-T448 WeakPolarHBondContact CB-OG1 3.39Å; S446-T448 PolarHBondContact O-N 3.43Å; S446-T448 PolarHBondContact OG-N 3.16Å; S446-T448 PolarHBondContact OG-OG1 3.19Å; S446-T448 VanDerWaalsContact OG-OG1 3.08Å; T448-S450 PolarHBondContact O-N 3.38Å; T448-V451 PolarHBondContact O-N 3.07Å; T448-L452 WeakPolarHBondContact O-CB 3.48Å; T448-L452 WeakPolarHBondContact O-CG 3.37Å; T448-L452 PolarHBondContact O-N 3.08Å
449	S	81.1	Confident	73.1	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.014	33%	0.327	C	S	.	.	H	α-helix	trans	-60.9	-39.2	-170.2	-78.9	0	0	0	0	113.4	H237 S446 K453 S454	H237-S449 PolarHBondContact CE1-OG 3.32Å; S446-S449 PolarHBondContact N-OG 2.94Å; S446-S449 WeakPolarHBondContact O-CB 3.48Å; S446-S449 PolarHBondContact O-N 2.86Å; S446-S449 PolarHBondContact OG-N 3.05Å; S446-S449 PolarHBondContact OG-OG 2.8Å; S449-K453 WeakPolarHBondContact O-CA 3.5Å; S449-K453 PolarHBondContact O-N 2.87Å; S449-S454 WeakPolarHBondContact CB-OG 3.35Å; S449-S454 PolarHBondContact O-N 2.79Å; S449-S454 VanDerWaalsContact O-N 3.09Å; S449-S454 PolarHBondContact OG-OG 3.1Å
450	S	79	Confident	74.7	Confident	74 Å²	74	54.7 Å²	54.7	52%	0.517	30%	0.303	S	S	.	.	H	α-helix	trans	-67.8	-46.3	176.5	55.4	0	0	0	0	111.8	T448 L452 K453	T448-S450 PolarHBondContact O-N 3.38Å; S450-L452 PolarHBondContact O-N 2.81Å; S450-K453 PolarHBondContact O-N 2.79Å
451	V	83.8	Confident	76.5	Confident	60 Å²	60	49.9 Å²	49.9	36%	0.364	28%	0.278	S	S	.	.	H	α-helix	trans	-62.5	-41.1	179.5	179.3	0	0	0	0	111.5	S225 N228 L233 T448	S225-V451 WeakPolarHBondContact CB-O 3.36Å; N228-V451 HydrophobicContact CB-CG1 3.81Å; N228-V451 WeakPolarHBondContact ND2-CG1 3.36Å; N228-V451 PolarHBondContact ND2-O 3.48Å; L233-V451 HydrophobicContact CD1-CG1 4.26Å; T448-V451 PolarHBondContact O-N 3.07Å
452	L	84.7	Confident	78.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-83.7	-18.9	-180	-73.7	174.2	0	0	0	114.4	I224 S225 N228 L233 I234 H237 T448 S450 W457	I224-L452 HydrophobicContact CG2-CD2 4.05Å; S225-L452 PolarHBondContact N-O 3.32Å; N228-L452 WeakPolarHBondContact O-CD2 3.12Å; L233-L452 HydrophobicContact CB-CD1 4.32Å; L233-L452 HydrophobicContact CB-CD2 3.96Å; L233-L452 HydrophobicContact CB-CG 4.34Å; I234-L452 HydrophobicContact CG1-CD2 4.32Å; H237-L452 HydrophobicContact CB-CD1 3.75Å; T448-L452 WeakPolarHBondContact O-CB 3.48Å; T448-L452 WeakPolarHBondContact O-CG 3.37Å; T448-L452 PolarHBondContact O-N 3.08Å; S450-L452 PolarHBondContact O-N 2.81Å; L452-W457 HydrophobicContact CB-CZ2 3.82Å; L452-W457 HydrophobicContact CD1-CH2 4.13Å; L452-W457 HydrophobicContact CD1-CZ2 4.04Å; L452-W457 HydrophobicContact CD2-CZ2 4.47Å; L452-W457 HydrophobicContact CG-CZ2 4.35Å; L452-W457 PolarHBondContact O-NE1 3.38Å
453	K	82.7	Confident	79.6	Confident	101 Å²	101	44 Å²	44	44%	0.439	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	52.1	-169.7	-57.8	-165.4	174.1	-160.1	0	113.7	S449 S450 H455 M456 W457	S449-K453 WeakPolarHBondContact O-CA 3.5Å; S449-K453 PolarHBondContact O-N 2.87Å; S450-K453 PolarHBondContact O-N 2.79Å; K453-H455 PolarHBondContact O-N 2.94Å; K453-H455 VanDerWaalsContact O-N 3.15Å; K453-M456 HydrophobicContact CB-CB 4.47Å; K453-M456 HydrophobicContact CB-CG 4.14Å; K453-M456 HydrophobicContact CB-SD 4.35Å; K453-M456 HydrophobicContact CD-SD 3.86Å; K453-M456 WeakPolarHBondContact O-CB 3.18Å; K453-M456 PolarHBondContact O-N 3.39Å; K453-W457 VanDerWaalsContact O-CD1 3.26Å
454	S	81.1	Confident	81	Confident	4 Å²	4	39.8 Å²	39.8	3%	0.028	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-52.3	-36.6	-178.1	58	0	0	0	0	114	S449 M456 W457	S449-S454 WeakPolarHBondContact CB-OG 3.35Å; S449-S454 PolarHBondContact O-N 2.79Å; S449-S454 VanDerWaalsContact O-N 3.09Å; S449-S454 PolarHBondContact OG-OG 3.1Å; S454-M456 PolarHBondContact O-N 2.96Å; S454-M456 VanDerWaalsContact O-N 3.1Å; S454-W457 VanDerWaalsContact O-CB 3.27Å; S454-W457 WeakPolarHBondContact O-CB 3.35Å; S454-W457 PolarHBondContact O-N 3.4Å
455	H	77.3	Confident	82.1	Confident	94 Å²	94	40.6 Å²	40.6	44%	0.435	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-61.2	-17	176.1	69.3	-96.6	0	0	0	115.2	I441 K453	I441-H455 HydrophobicContact CB-CB 4.23Å; I441-H455 HydrophobicContact CD1-CB 4.43Å; I441-H455 HydrophobicContact CG2-CB 3.96Å; K453-H455 PolarHBondContact O-N 2.94Å; K453-H455 VanDerWaalsContact O-N 3.15Å
456	M	81.2	Confident	82.7	Confident	102 Å²	102	38.2 Å²	38.2	50%	0.502	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-90.9	-9.3	175.4	-58.9	-162.4	77.4	0	0	113.2	K453 S454	K453-M456 HydrophobicContact CB-CB 4.47Å; K453-M456 HydrophobicContact CB-CG 4.14Å; K453-M456 HydrophobicContact CB-SD 4.35Å; K453-M456 HydrophobicContact CD-SD 3.86Å; K453-M456 WeakPolarHBondContact O-CB 3.18Å; K453-M456 PolarHBondContact O-N 3.39Å; S454-M456 PolarHBondContact O-N 2.96Å; S454-M456 VanDerWaalsContact O-N 3.1Å
457	W	87.3	Confident	83	Confident	13 Å²	13	38 Å²	38	5%	0.049	22%	0.221	C	C	.	.			trans	-69.2	144.4	-171.4	-65.9	3.9	0	0	0	112.2	I221 S222 I224 H237 F238 Y433 L452 K453 S454 V459	I221-W457 HydrophobicContact CD1-CE3 4.38Å; I221-W457 HydrophobicContact CD1-CZ3 4.06Å; I221-W457 HydrophobicContact CG2-CB 4.2Å; I221-W457 HydrophobicContact CG2-CD2 3.55Å; I221-W457 HydrophobicContact CG2-CE3 3.52Å; I221-W457 HydrophobicContact CG2-CG 3.91Å; I221-W457 HydrophobicContact CG2-CH2 4.48Å; I221-W457 HydrophobicContact CG2-CZ3 4.02Å; S222-W457 CarbonylContact O-C 3.3Å; S222-W457 VanDerWaalsContact O-CA 3.28Å; S222-W457 WeakPolarHBondContact O-CA 3.46Å; I224-W457 HydrophobicContact CG1-CZ2 4.06Å; I224-W457 HydrophobicContact CG2-CZ2 4.27Å; H237-W457 AromaticContact CD2-CH2 3.67Å; H237-W457 AromaticContact CD2-CZ3 3.56Å; H237-W457 AromaticContact NE2-CH2 3.96Å; H237-W457 AromaticContact NE2-CZ3 3.55Å; F238-W457 HydrophobicContact CE2-CZ3 4.23Å; F238-W457 AromaticContact CZ-CZ3 3.98Å; F238-W457 HydrophobicContact CZ-CZ3 3.98Å; Y433-W457 HydrophobicContact CE1-CB 4.41Å; Y433-W457 HydrophobicContact CE1-CE3 4.04Å; Y433-W457 AromaticContact CZ-CE3 3.89Å; L452-W457 HydrophobicContact CB-CZ2 3.82Å; L452-W457 HydrophobicContact CD1-CH2 4.13Å; L452-W457 HydrophobicContact CD1-CZ2 4.04Å; L452-W457 HydrophobicContact CD2-CZ2 4.47Å; L452-W457 HydrophobicContact CG-CZ2 4.35Å; L452-W457 PolarHBondContact O-NE1 3.38Å; K453-W457 VanDerWaalsContact O-CD1 3.26Å; S454-W457 VanDerWaalsContact O-CB 3.27Å; S454-W457 WeakPolarHBondContact O-CB 3.35Å; S454-W457 PolarHBondContact O-N 3.4Å; W457-V459 HydrophobicContact CB-CG2 4.41Å
458	S	84.9	Confident	83.2	Confident	58 Å²	58	35.2 Å²	35.2	41%	0.406	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.3	157.7	-161.5	0	0	0	0	107.1	S222 D460	S222-S458 PolarHBondContact N-O 2.95Å; S222-S458 PolarHBondContact O-N 3.42Å; S222-S458 PolarHBondContact OG-O 2.8Å; S458-D460 PolarHBondContact OG-OD2 2.85Å; S458-D460 VanDerWaalsContact OG-OD2 3.08Å
459	V	87.7	Confident	83.4	Confident	5 Å²	5	36.9 Å²	36.9	3%	0.03	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	111.9	177.4	-177.9	0	0	0	0	108	L219 I221 Y433 W457	L219-V459 HydrophobicContact CB-CG1 4.18Å; L219-V459 HydrophobicContact CD1-CG1 3.68Å; L219-V459 HydrophobicContact CG-CG1 4.42Å; I221-V459 HydrophobicContact CG1-CG2 4.32Å; I221-V459 HydrophobicContact CG2-CG2 4.4Å; Y433-V459 HydrophobicContact CD1-CB 4.45Å; Y433-V459 HydrophobicContact CD1-CG2 3.6Å; Y433-V459 HydrophobicContact CD2-CG2 4.02Å; Y433-V459 HydrophobicContact CE1-CG2 4.12Å; Y433-V459 HydrophobicContact CE2-CG2 4.49Å; Y433-V459 HydrophobicContact CG-CB 4.06Å; Y433-V459 HydrophobicContact CG-CG2 3.54Å; W457-V459 HydrophobicContact CB-CG2 4.41Å
460	D	85.7	Confident	83.5	Confident	38 Å²	38	39.5 Å²	39.5	20%	0.203	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	154.1	177.4	-76.2	-78	0	0	0	108.8	L219 M220 R434 S458 A462 H968	L219-D460 CarbonylContact C-O 3.54Å; M220-D460 PolarHBondContact N-O 2.88Å; M220-D460 PolarHBondContact O-N 3Å; M220-D460 VanDerWaalsContact O-N 3.12Å; M220-D460 VanDerWaalsContact O-O 3.13Å; R434-D460 IonicContact CZ-OD1 3.13Å; R434-D460 IonicContact NE-OD1 2.83Å; R434-D460 IonicContact NH2-OD1 3.62Å; R434-D460 PolarHBondContact NH2-OD1 3.14Å; S458-D460 PolarHBondContact OG-OD2 2.85Å; S458-D460 VanDerWaalsContact OG-OD2 3.08Å; D460-A462 PolarHBondContact O-N 2.79Å; D460-H968 IonicContact OD1-CE1 3.96Å; D460-H968 IonicContact OD1-ND1 3.14Å
461	F	88	Confident	83.7	Confident	6 Å²	6	37.8 Å²	37.8	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	133.1	172.5	-83.5	-66.4	0	0	0	111.5	F214 L219 A426 A427 C430 L853 F854 V970	F214-F461 HydrophobicContact CB-CB 4.15Å; F214-F461 HydrophobicContact CD1-CB 4.35Å; F214-F461 HydrophobicContact CD2-CB 3.32Å; F214-F461 AromaticContact CD2-CD1 3.45Å; F214-F461 HydrophobicContact CD2-CD1 3.45Å; F214-F461 VanDerWaalsContact CD2-CD1 3.45Å; F214-F461 HydrophobicContact CD2-CD2 4.46Å; F214-F461 HydrophobicContact CD2-CE1 4.29Å; F214-F461 AromaticContact CD2-CG 3.52Å; F214-F461 HydrophobicContact CD2-CG 3.52Å; F214-F461 HydrophobicContact CE2-CB 3.67Å; F214-F461 AromaticContact CE2-CD1 3.02Å; F214-F461 HydrophobicContact CE2-CD1 3.02Å; F214-F461 AromaticContact CE2-CD2 3.94Å; F214-F461 HydrophobicContact CE2-CD2 3.94Å; F214-F461 AromaticContact CE2-CE1 3.42Å; F214-F461 HydrophobicContact CE2-CE1 3.42Å; F214-F461 VanDerWaalsContact CE2-CE1 3.42Å; F214-F461 HydrophobicContact CE2-CE2 4.26Å; F214-F461 AromaticContact CE2-CG 3.28Å; F214-F461 HydrophobicContact CE2-CG 3.28Å; F214-F461 HydrophobicContact CE2-CZ 4.01Å; F214-F461 HydrophobicContact CG-CB 3.7Å; F214-F461 HydrophobicContact CG-CG 4.25Å; F214-F461 HydrophobicContact CZ-CB 4.34Å; F214-F461 AromaticContact CZ-CD1 3.88Å; F214-F461 HydrophobicContact CZ-CD1 3.88Å; F214-F461 HydrophobicContact CZ-CD2 4.04Å; F214-F461 HydrophobicContact CZ-CE1 4.03Å; F214-F461 HydrophobicContact CZ-CE2 4.19Å; F214-F461 AromaticContact CZ-CG 3.85Å; F214-F461 HydrophobicContact CZ-CG 3.85Å; F214-F461 HydrophobicContact CZ-CZ 4.15Å; L219-F461 HydrophobicContact CD2-CD1 3.27Å; L219-F461 HydrophobicContact CD2-CE1 3.59Å; L219-F461 HydrophobicContact CD2-CG 3.92Å; L219-F461 HydrophobicContact CD2-CZ 4.42Å; A426-F461 HydrophobicContact CB-CE1 3.98Å; A427-F461 HydrophobicContact CB-CZ 4.06Å; C430-F461 HydrophobicContact CB-CD2 4.5Å; C430-F461 HydrophobicContact CB-CE2 4.12Å; C430-F461 HydrophobicContact CB-CZ 4.21Å; C430-F461 VanDerWaalsContact SG-CD2 3.59Å; F461-L853 HydrophobicContact CZ-CD1 4.28Å; F461-F854 HydrophobicContact CE2-CE1 4.09Å; F461-F854 AromaticContact CE2-CZ 3.89Å; F461-F854 HydrophobicContact CE2-CZ 3.89Å; F461-V970 HydrophobicContact CB-CG1 3.82Å; F461-V970 HydrophobicContact CB-CG2 3.93Å; F461-V970 HydrophobicContact CD2-CG1 3.6Å; F461-V970 HydrophobicContact CE2-CG1 4.41Å; F461-V970 HydrophobicContact CG-CG1 4Å
462	A	87.4	Confident	83.8	Confident	4 Å²	4	36.6 Å²	36.6	3%	0.033	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	124	-171.3	0	0	0	0	0	112.6	F214 S215 T218 M220 F417 D460	F214-A462 CarbonylContact C-O 3.53Å; F214-A462 VanDerWaalsContact C-O 3.27Å; F214-A462 WeakPolarHBondContact CA-O 3.28Å; F214-A462 WeakPolarHBondContact CB-O 3.37Å; S215-A462 PolarHBondContact N-O 2.94Å; T218-A462 HydrophobicContact CG2-CB 4.15Å; T218-A462 VanDerWaalsContact O-CB 3.32Å; T218-A462 WeakPolarHBondContact O-CB 3.22Å; T218-A462 PolarHBondContact O-N 3.08Å; M220-A462 HydrophobicContact CB-CB 3.94Å; F417-A462 HydrophobicContact CD1-CB 3.61Å; F417-A462 HydrophobicContact CE1-CB 3.81Å; D460-A462 PolarHBondContact O-N 2.79Å
463	P	83	Confident	83.9	Confident	20 Å²	20	37.2 Å²	37.2	13%	0.13	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	161.3	179.2	26.2	-34.4	0	0	0	112.6	N213 I468 W554 T555	N213-P463 WeakPolarHBondContact O-CA 3.15Å; P463-I468 HydrophobicContact CG-CD1 4.12Å; P463-I468 HydrophobicContact CG-CG1 3.81Å; P463-W554 HydrophobicContact CG-CZ3 4.1Å; P463-T555 HydrophobicContact CG-CG2 4.39Å
464	V	81.2	Confident	83.9	Confident	4 Å²	4	32.9 Å²	32.9	2%	0.024	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-54	136.3	174.7	-74.1	0	0	0	0	111.5	N213 S466 N467 I468 R971	N213-V464 PolarHBondContact O-N 2.81Å; V464-S466 PolarHBondContact O-N 3.43Å; V464-N467 HydrophobicContact CG2-CB 3.53Å; V464-N467 WeakPolarHBondContact O-CB 3.13Å; V464-N467 PolarHBondContact O-N 2.91Å; V464-I468 PolarHBondContact O-N 3.24Å; V464-R971 VanDerWaalsContact CG1-NH2 3.32Å
465	P	84.4	Confident	83.9	Confident	74 Å²	74	34 Å²	34	48%	0.481	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.4	-176.6	-30	36.4	0	0	0	115.2	N467 I468 W470	P465-N467 VanDerWaalsContact C-N 3.35Å; P465-I468 PolarHBondContact O-N 3.44Å; P465-W470 HydrophobicContact CB-CZ2 4.42Å; P465-W470 PolarHBondContact O-NE1 3.5Å
466	S	78	Confident	84.1	Confident	61 Å²	61	31.6 Å²	31.6	43%	0.427	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-14.2	176.5	53.1	0	0	0	0	114.9	V464 K556	V464-S466 PolarHBondContact O-N 3.43Å; S466-K556 WeakPolarHBondContact O-CD 3.36Å; S466-K556 WeakPolarHBondContact O-CE 3.37Å; S466-K556 PolarHBondContact O-NZ 2.97Å
467	N	83.1	Confident	84.1	Confident	5 Å²	5	36.5 Å²	36.5	3%	0.027	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-20.8	173.1	-175.2	12.7	0	0	0	111.5	V464 P465 I469 T555 K556 S557	V464-N467 HydrophobicContact CG2-CB 3.53Å; V464-N467 WeakPolarHBondContact O-CB 3.13Å; V464-N467 PolarHBondContact O-N 2.91Å; P465-N467 VanDerWaalsContact C-N 3.35Å; N467-I469 PolarHBondContact O-N 3.44Å; N467-T555 CarbonylContact O-C 3.49Å; N467-T555 VanDerWaalsContact O-CA 3.24Å; N467-T555 WeakPolarHBondContact O-CA 3.43Å; N467-K556 PolarHBondContact O-N 2.92Å; N467-K556 WeakPolarHBondContact OD1-CB 3.42Å; N467-K556 PolarHBondContact OD1-N 3.18Å; N467-S557 PolarHBondContact ND2-OG 3.1Å; N467-S557 PolarHBondContact OD1-N 3Å; N467-S557 PolarHBondContact OD1-OG 3.23Å
468	I	84.7	Confident	84	Confident	10 Å²	10	40.6 Å²	40.6	5%	0.051	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-73.6	124.4	177	-58.8	173.7	0	0	0	109.9	F417 P463 V464 P465 W470	F417-I468 HydrophobicContact CE1-CD1 4.29Å; F417-I468 HydrophobicContact CZ-CD1 3.83Å; P463-I468 HydrophobicContact CG-CD1 4.12Å; P463-I468 HydrophobicContact CG-CG1 3.81Å; V464-I468 PolarHBondContact O-N 3.24Å; P465-I468 PolarHBondContact O-N 3.44Å; I468-W470 HydrophobicContact CB-CD2 4.34Å; I468-W470 HydrophobicContact CB-CZ2 4.16Å; I468-W470 HydrophobicContact CD1-CH2 4.03Å; I468-W470 HydrophobicContact CD1-CZ2 3.76Å; I468-W470 HydrophobicContact CG2-CD2 3.67Å; I468-W470 HydrophobicContact CG2-CE3 4.07Å; I468-W470 HydrophobicContact CG2-CG 3.97Å; I468-W470 HydrophobicContact CG2-CZ2 4.12Å; I468-W470 HydrophobicContact CG2-CZ3 4.47Å; I468-W470 VanDerWaalsContact O-CD1 3.25Å; I468-W470 PolarHBondContact O-N 3.13Å
469	I	84.5	Confident	84.1	Confident	39 Å²	39	41.3 Å²	41.3	20%	0.2	23%	0.23	C	C	.	.			trans	-91	81.1	170.8	-54.9	173.8	0	0	0	107.2	N467 A471 N472 L473 H553 W554 K556 L559	N467-I469 PolarHBondContact O-N 3.44Å; I469-A471 VanDerWaalsContact C-N 3.25Å; I469-A471 PolarHBondContact O-N 3.39Å; I469-A471 VanDerWaalsContact O-N 3.13Å; I469-N472 HydrophobicContact CB-CB 4.47Å; I469-N472 HydrophobicContact CG2-CB 4.14Å; I469-N472 WeakPolarHBondContact CG2-ND2 3.46Å; I469-N472 PolarHBondContact O-N 2.84Å; I469-L473 PolarHBondContact O-N 3.49Å; I469-H553 WeakPolarHBondContact CD1-O 3.41Å; I469-W554 PolarHBondContact N-O 3.24Å; I469-K556 HydrophobicContact CD1-CG 3.93Å; I469-K556 HydrophobicContact CG1-CG 3.75Å; I469-L559 HydrophobicContact CD1-CD2 4.17Å
470	W	84.7	Confident	84.2	Confident	58 Å²	58	44.2 Å²	44.2	22%	0.22	24%	0.24	C	C	.	.	H	α-helix	trans	-50.2	-39.8	-171.9	-65.2	93.2	0	0	0	114.2	I260 F417 P465 I468 N472 L473	I260-W470 HydrophobicContact CD1-CB 3.98Å; F417-W470 AromaticContact CE2-CH2 3.74Å; F417-W470 HydrophobicContact CE2-CH2 3.74Å; F417-W470 AromaticContact CE2-CZ3 3.88Å; F417-W470 HydrophobicContact CE2-CZ3 3.88Å; F417-W470 HydrophobicContact CZ-CH2 4.24Å; P465-W470 HydrophobicContact CB-CZ2 4.42Å; P465-W470 PolarHBondContact O-NE1 3.5Å; I468-W470 HydrophobicContact CB-CD2 4.34Å; I468-W470 HydrophobicContact CB-CZ2 4.16Å; I468-W470 HydrophobicContact CD1-CH2 4.03Å; I468-W470 HydrophobicContact CD1-CZ2 3.76Å; I468-W470 HydrophobicContact CG2-CD2 3.67Å; I468-W470 HydrophobicContact CG2-CE3 4.07Å; I468-W470 HydrophobicContact CG2-CG 3.97Å; I468-W470 HydrophobicContact CG2-CZ2 4.12Å; I468-W470 HydrophobicContact CG2-CZ3 4.47Å; I468-W470 VanDerWaalsContact O-CD1 3.25Å; I468-W470 PolarHBondContact O-N 3.13Å; W470-N472 PolarHBondContact O-N 3.03Å; W470-L473 HydrophobicContact CE3-CD2 4.05Å; W470-L473 HydrophobicContact CZ3-CD2 4.14Å; W470-L473 WeakPolarHBondContact O-CB 3.38Å; W470-L473 PolarHBondContact O-N 3.2Å
471	A	82.6	Confident	84.4	Confident	38 Å²	38	47.8 Å²	47.8	31%	0.314	25%	0.251	S	S	.	.	H	α-helix	trans	-64.9	-18	177	0	0	0	0	0	114.6	R257 I260 I469	R257-A471 WeakPolarHBondContact CD-O 3.36Å; R257-A471 HydrophobicContact CG-CB 4.39Å; R257-A471 WeakPolarHBondContact CG-O 3.3Å; I260-A471 HydrophobicContact CD1-CB 4.43Å; I469-A471 VanDerWaalsContact C-N 3.25Å; I469-A471 PolarHBondContact O-N 3.39Å; I469-A471 VanDerWaalsContact O-N 3.13Å
472	N	86.5	Confident	84.6	Confident	35 Å²	35	51.7 Å²	51.7	19%	0.187	28%	0.278	C	S	.	.	H	α-helix	trans	-99.3	-14.4	175.9	-72.8	-24.8	0	0	0	113	I469 W470 A474 A475 G552 H553 W554	I469-N472 HydrophobicContact CB-CB 4.47Å; I469-N472 HydrophobicContact CG2-CB 4.14Å; I469-N472 WeakPolarHBondContact CG2-ND2 3.46Å; I469-N472 PolarHBondContact O-N 2.84Å; W470-N472 PolarHBondContact O-N 3.03Å; N472-A474 PolarHBondContact O-N 2.9Å; N472-A475 VanDerWaalsContact O-CB 3.3Å; N472-A475 WeakPolarHBondContact O-CB 3.49Å; N472-A475 PolarHBondContact O-N 3.1Å; N472-G552 WeakPolarHBondContact CB-O 3.43Å; N472-G552 VanDerWaalsContact ND2-CA 3.35Å; N472-G552 WeakPolarHBondContact ND2-CA 3.37Å; N472-H553 VanDerWaalsContact CB-O 3.31Å; N472-H553 WeakPolarHBondContact CB-O 3.22Å; N472-H553 PolarHBondContact ND2-O 3.46Å; N472-W554 HydrophobicContact CB-CB 4.42Å
473	L	85.5	Confident	84.8	Confident	12 Å²	12	55.1 Å²	55.1	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-61.7	-25.8	-178.9	-168.7	66.2	0	0	0	113.2	M220 C253 I415 I469 W470 A475 W554	M220-L473 HydrophobicContact CE-CD1 3.91Å; C253-L473 HydrophobicContact CB-CD2 4.33Å; I415-L473 HydrophobicContact CD1-CD1 3.96Å; I415-L473 HydrophobicContact CD1-CG 4.17Å; I469-L473 PolarHBondContact O-N 3.49Å; W470-L473 HydrophobicContact CE3-CD2 4.05Å; W470-L473 HydrophobicContact CZ3-CD2 4.14Å; W470-L473 WeakPolarHBondContact O-CB 3.38Å; W470-L473 PolarHBondContact O-N 3.2Å; L473-A475 VanDerWaalsContact C-N 3.33Å; L473-W554 HydrophobicContact CD1-CB 4.44Å; L473-W554 HydrophobicContact CD1-CD2 4.34Å; L473-W554 HydrophobicContact CD1-CE3 3.84Å
474	A	82.5	Confident	85.1	Confident	11 Å²	11	54.4 Å²	54.4	9%	0.091	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-6.6	176.4	0	0	0	0	0	114.8	D255 I413 N472 T476	D255-A474 HydrophobicContact CB-CB 4.1Å; D255-A474 WeakPolarHBondContact OD1-CB 3.28Å; I413-A474 HydrophobicContact CD1-CB 3.78Å; I413-A474 HydrophobicContact CG1-CB 4.35Å; N472-A474 PolarHBondContact O-N 2.9Å; A474-T476 PolarHBondContact O-N 3.3Å
475	A	80.9	Confident	85.6	Confident	27 Å²	27	58.6 Å²	58.6	22%	0.223	31%	0.307	C	S	.	.			trans	-70.1	127.2	-179.2	0	0	0	0	0	111.4	N472 L473	N472-A475 VanDerWaalsContact O-CB 3.3Å; N472-A475 WeakPolarHBondContact O-CB 3.49Å; N472-A475 PolarHBondContact O-N 3.1Å; L473-A475 VanDerWaalsContact C-N 3.33Å
476	T	82.4	Confident	86.1	Confident	44 Å²	44	61.8 Å²	61.8	27%	0.27	31%	0.314	S	S	.	.			trans	-71	150.1	172	60	0	0	0	0	110.4	A474 T478 V479 W480	A474-T476 PolarHBondContact O-N 3.3Å; T476-T478 PolarHBondContact O-N 2.83Å; T476-T478 PolarHBondContact OG1-OG1 3.42Å; T476-V479 PolarHBondContact O-N 3.23Å; T476-V479 VanDerWaalsContact O-N 3.15Å; T476-V479 WeakPolarHBondContact OG1-CB 3.35Å; T476-V479 VanDerWaalsContact OG1-CG2 3.28Å; T476-V479 WeakPolarHBondContact OG1-CG2 2.87Å; T476-V479 PolarHBondContact OG1-N 2.86Å; T476-W480 WeakPolarHBondContact O-CB 3.2Å; T476-W480 PolarHBondContact O-N 3.44Å
477	R	81.3	Confident	86.7	Confident	205 Å²	205	60 Å²	60	77%	0.774	30%	0.299	S	S	*	.	H	α-helix	trans	-54.8	-36.9	178.1	-174.8	177.5	-70.8	-159.2	-0.4	112.2	W481	R477-W481 VanDerWaalsContact O-CD1 3.31Å; R477-W481 PolarHBondContact O-N 3.44Å
478	T	85.1	Confident	87	Confident	99 Å²	99	62.9 Å²	62.9	61%	0.607	31%	0.314	S	S	*	.	H	α-helix	trans	-64.7	-52.1	175.4	47.6	0	0	0	0	112.3	T476 W480 W481 C482	T476-T478 PolarHBondContact O-N 2.83Å; T476-T478 PolarHBondContact OG1-OG1 3.42Å; T478-W480 VanDerWaalsContact C-N 3.27Å; T478-W480 PolarHBondContact O-N 3Å; T478-W481 PolarHBondContact O-N 2.81Å; T478-C482 PolarHBondContact O-N 3.26Å; T478-C482 PolarHBondContact O-SG 2.85Å
479	V	87.4	Confident	87.3	Confident	73 Å²	73	66.7 Å²	66.7	44%	0.442	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-34.9	178.3	170.5	0	0	0	0	111.6	T476 R483	T476-V479 PolarHBondContact O-N 3.23Å; T476-V479 VanDerWaalsContact O-N 3.15Å; T476-V479 WeakPolarHBondContact OG1-CB 3.35Å; T476-V479 VanDerWaalsContact OG1-CG2 3.28Å; T476-V479 WeakPolarHBondContact OG1-CG2 2.87Å; T476-V479 PolarHBondContact OG1-N 2.86Å; V479-R483 WeakPolarHBondContact O-CB 2.99Å; V479-R483 WeakPolarHBondContact O-CD 3.05Å; V479-R483 VanDerWaalsContact O-CG 3.26Å; V479-R483 WeakPolarHBondContact O-CG 3.27Å; V479-R483 PolarHBondContact O-N 2.76Å
480	W	89.3	Confident	87.6	Confident	66 Å²	66	67.6 Å²	67.6	25%	0.25	34%	0.343	C	S	.	.	H	α-helix	trans	-63.9	-47.2	173.5	-174.9	89.6	0	0	0	111.9	T476 T478 R483 A484 V551 H553	T476-W480 WeakPolarHBondContact O-CB 3.2Å; T476-W480 PolarHBondContact O-N 3.44Å; T478-W480 VanDerWaalsContact C-N 3.27Å; T478-W480 PolarHBondContact O-N 3Å; W480-R483 PolarHBondContact O-N 3.26Å; W480-A484 HydrophobicContact CE3-CB 4.49Å; W480-A484 HydrophobicContact CH2-CB 4.37Å; W480-A484 HydrophobicContact CZ3-CB 4.27Å; W480-A484 WeakPolarHBondContact O-CB 3.38Å; W480-A484 PolarHBondContact O-N 2.93Å; W480-V551 HydrophobicContact CZ2-CG1 3.8Å; W480-H553 AromaticContact CZ2-CE1 3.81Å
481	W	89.4	Confident	87.6	Confident	113 Å²	113	66 Å²	66	43%	0.428	34%	0.34	S	S	.	.	H	α-helix	trans	-64.6	-42.1	176.7	-89.9	102	0	0	0	112.8	R477 T478 R483 A484 I485	R477-W481 VanDerWaalsContact O-CD1 3.31Å; R477-W481 PolarHBondContact O-N 3.44Å; T478-W481 PolarHBondContact O-N 2.81Å; W481-R483 PolarHBondContact O-N 2.88Å; W481-A484 PolarHBondContact O-N 3.3Å; W481-I485 HydrophobicContact CE3-CD1 4.39Å; W481-I485 HydrophobicContact CE3-CG1 4.42Å; W481-I485 WeakPolarHBondContact O-CG1 3.22Å; W481-I485 PolarHBondContact O-N 3.48Å
482	C	92.5	Very high	87.7	Confident	87 Å²	87	69.9 Å²	69.9	59%	0.588	35%	0.35	S	S	*	.	H	α-helix	trans	-61.1	-43.2	175.7	-62.8	0	0	0	0	111.7	T478 F486	T478-C482 PolarHBondContact O-N 3.26Å; T478-C482 PolarHBondContact O-SG 2.85Å; C482-F486 WeakPolarHBondContact O-CB 3.41Å; C482-F486 PolarHBondContact O-N 2.96Å; C482-F486 VanDerWaalsContact O-N 3.07Å
483	R	91.2	Very high	87.5	Confident	76 Å²	76	73.7 Å²	73.7	29%	0.287	37%	0.365	S	S	.	.	H	α-helix	trans	-61.8	-46	172.9	-75.2	167.6	68.7	-179.5	3.3	111.5	V479 W480 W481 I487 L550 V551	V479-R483 WeakPolarHBondContact O-CB 2.99Å; V479-R483 WeakPolarHBondContact O-CD 3.05Å; V479-R483 VanDerWaalsContact O-CG 3.26Å; V479-R483 WeakPolarHBondContact O-CG 3.27Å; V479-R483 PolarHBondContact O-N 2.76Å; W480-R483 PolarHBondContact O-N 3.26Å; W481-R483 PolarHBondContact O-N 2.88Å; R483-I487 HydrophobicContact CB-CD1 4.25Å; R483-I487 VanDerWaalsContact O-CB 3.24Å; R483-I487 WeakPolarHBondContact O-CB 3.32Å; R483-I487 WeakPolarHBondContact O-CD1 3.39Å; R483-I487 WeakPolarHBondContact O-CG1 3.35Å; R483-I487 PolarHBondContact O-N 3.11Å; R483-L550 PolarHBondContact NE-O 2.73Å; R483-L550 PolarHBondContact NH2-O 2.91Å; R483-V551 PolarHBondContact NE-O 2.8Å
484	A	89.9	Confident	87.3	Confident	5 Å²	5	76.5 Å²	76.5	4%	0.041	38%	0.383	C	S	.	.	H	α-helix	trans	-58.8	-48.9	179.6	0	0	0	0	0	111.9	W480 W481 N488 V551	W480-A484 HydrophobicContact CE3-CB 4.49Å; W480-A484 HydrophobicContact CH2-CB 4.37Å; W480-A484 HydrophobicContact CZ3-CB 4.27Å; W480-A484 WeakPolarHBondContact O-CB 3.38Å; W480-A484 PolarHBondContact O-N 2.93Å; W481-A484 PolarHBondContact O-N 3.3Å; A484-N488 WeakPolarHBondContact O-CB 3.19Å; A484-N488 PolarHBondContact O-N 3.36Å; A484-N488 PolarHBondContact O-ND2 2.94Å; A484-V551 HydrophobicContact CB-CG1 3.86Å
485	I	92.3	Very high	86.9	Confident	93 Å²	93	76.7 Å²	76.7	48%	0.477	38%	0.382	S	S	.	.	H	α-helix	trans	-62	-54	179.1	-67.2	164.9	0	0	0	110.5	W481 I487 N488 L489	W481-I485 HydrophobicContact CE3-CD1 4.39Å; W481-I485 HydrophobicContact CE3-CG1 4.42Å; W481-I485 WeakPolarHBondContact O-CG1 3.22Å; W481-I485 PolarHBondContact O-N 3.48Å; I485-I487 PolarHBondContact O-N 3.01Å; I485-N488 PolarHBondContact O-N 3.4Å; I485-L489 HydrophobicContact CG2-CD1 3.91Å; I485-L489 WeakPolarHBondContact O-CG 3.4Å; I485-L489 PolarHBondContact O-N 3.36Å
486	F	94.1	Very high	86.5	Confident	141 Å²	141	78.9 Å²	78.9	62%	0.618	39%	0.387	S	S	*	.	H	α-helix	trans	-57.8	-47.8	-178.8	179.6	-98.3	0	0	0	112.2	C482 L489 C490	C482-F486 WeakPolarHBondContact O-CB 3.41Å; C482-F486 PolarHBondContact O-N 2.96Å; C482-F486 VanDerWaalsContact O-N 3.07Å; F486-L489 PolarHBondContact O-N 2.87Å; F486-C490 PolarHBondContact O-N 2.68Å; F486-C490 PolarHBondContact O-SG 3.08Å; F486-C490 VanDerWaalsContact O-SG 3.33Å
487	I	92.1	Very high	86	Confident	24 Å²	24	83.2 Å²	83.2	12%	0.123	40%	0.403	C	S	.	.	H	α-helix	trans	-68.9	-41.9	-177.7	-66.6	165.3	0	0	0	111.3	R483 I485 L489 C490 V491 L550 V551	R483-I487 HydrophobicContact CB-CD1 4.25Å; R483-I487 VanDerWaalsContact O-CB 3.24Å; R483-I487 WeakPolarHBondContact O-CB 3.32Å; R483-I487 WeakPolarHBondContact O-CD1 3.39Å; R483-I487 WeakPolarHBondContact O-CG1 3.35Å; R483-I487 PolarHBondContact O-N 3.11Å; I485-I487 PolarHBondContact O-N 3.01Å; I487-L489 VanDerWaalsContact C-N 3.3Å; I487-L489 PolarHBondContact O-N 3.07Å; I487-C490 PolarHBondContact O-N 2.96Å; I487-V491 HydrophobicContact CG2-CG2 4.4Å; I487-V491 VanDerWaalsContact O-CG2 3.3Å; I487-V491 WeakPolarHBondContact O-CG2 3.48Å; I487-V491 PolarHBondContact O-N 2.93Å; I487-L550 HydrophobicContact CD1-CB 3.69Å; I487-L550 VanDerWaalsContact CD1-O 3.29Å; I487-L550 WeakPolarHBondContact CD1-O 3.39Å; I487-V551 HydrophobicContact CB-CG2 4.18Å; I487-V551 HydrophobicContact CD1-CG2 4.09Å; I487-V551 HydrophobicContact CG2-CG2 4.08Å
488	N	88.5	Confident	85.3	Confident	65 Å²	65	75.6 Å²	75.6	35%	0.348	38%	0.377	S	S	.	.	H	α-helix	trans	-64	-35.2	176.9	-70.3	-29.2	0	0	0	111.8	A484 I485 F492 K566	A484-N488 WeakPolarHBondContact O-CB 3.19Å; A484-N488 PolarHBondContact O-N 3.36Å; A484-N488 PolarHBondContact O-ND2 2.94Å; I485-N488 PolarHBondContact O-N 3.4Å; N488-F492 WeakPolarHBondContact O-CB 3.39Å; N488-F492 PolarHBondContact O-N 3.07Å; N488-K566 PolarHBondContact OD1-NZ 3.16Å
489	L	90.7	Very high	84.4	Confident	90 Å²	90	72 Å²	72	47%	0.471	36%	0.355	S	S	.	.	H	α-helix	trans	-66.2	-46.9	173.1	-72.2	169.2	0	0	0	111.7	I485 F486 I487 V491 F492 F493	I485-L489 HydrophobicContact CG2-CD1 3.91Å; I485-L489 WeakPolarHBondContact O-CG 3.4Å; I485-L489 PolarHBondContact O-N 3.36Å; F486-L489 PolarHBondContact O-N 2.87Å; I487-L489 VanDerWaalsContact C-N 3.3Å; I487-L489 PolarHBondContact O-N 3.07Å; L489-V491 VanDerWaalsContact C-N 3.31Å; L489-V491 PolarHBondContact O-N 3.3Å; L489-F492 WeakPolarHBondContact O-CB 3.35Å; L489-F492 PolarHBondContact O-N 3.06Å; L489-F492 VanDerWaalsContact O-N 3.15Å; L489-F493 WeakPolarHBondContact O-CD2 3.16Å; L489-F493 PolarHBondContact O-N 3.36Å
490	C	90	Very high	83.2	Confident	57 Å²	57	69.2 Å²	69.2	39%	0.385	34%	0.338	S	S	.	.	H	α-helix	trans	-59.5	-41.2	175	-66.2	0	0	0	0	112.2	F486 I487 V494	F486-C490 PolarHBondContact O-N 2.68Å; F486-C490 PolarHBondContact O-SG 3.08Å; F486-C490 VanDerWaalsContact O-SG 3.33Å; I487-C490 PolarHBondContact O-N 2.96Å; C490-V494 WeakPolarHBondContact O-CB 3.22Å; C490-V494 WeakPolarHBondContact O-CG2 3.36Å; C490-V494 PolarHBondContact O-N 2.88Å; C490-V494 VanDerWaalsContact O-N 3.08Å
491	V	86.2	Confident	81.6	Confident	25 Å²	25	67.6 Å²	67.6	15%	0.152	34%	0.336	C	S	.	.	H	α-helix	trans	-62.8	-46.5	173.3	171.8	0	0	0	0	110.5	I487 L489 F493 V494 V495	I487-V491 HydrophobicContact CG2-CG2 4.4Å; I487-V491 VanDerWaalsContact O-CG2 3.3Å; I487-V491 WeakPolarHBondContact O-CG2 3.48Å; I487-V491 PolarHBondContact O-N 2.93Å; L489-V491 VanDerWaalsContact C-N 3.31Å; L489-V491 PolarHBondContact O-N 3.3Å; V491-F493 PolarHBondContact O-N 3.23Å; V491-V494 PolarHBondContact O-N 3.19Å; V491-V495 HydrophobicContact CG1-CG2 3.78Å; V491-V495 WeakPolarHBondContact O-CB 3.32Å; V491-V495 WeakPolarHBondContact O-CG2 3.21Å; V491-V495 PolarHBondContact O-N 3.18Å
492	F	84.3	Confident	79.8	Confident	119 Å²	119	64.7 Å²	64.7	52%	0.522	33%	0.331	S	S	.	.	H	α-helix	trans	-55.9	-46.6	178.7	174.5	-95.7	0	0	0	112.1	N488 L489 V495 F496	N488-F492 WeakPolarHBondContact O-CB 3.39Å; N488-F492 PolarHBondContact O-N 3.07Å; L489-F492 WeakPolarHBondContact O-CB 3.35Å; L489-F492 PolarHBondContact O-N 3.06Å; L489-F492 VanDerWaalsContact O-N 3.15Å; F492-V495 PolarHBondContact O-N 2.85Å; F492-F496 VanDerWaalsContact O-CB 3.22Å; F492-F496 WeakPolarHBondContact O-CB 3.21Å; F492-F496 PolarHBondContact O-N 3.39Å
493	F	83.1	Confident	78.1	Confident	116 Å²	116	66.5 Å²	66.5	51%	0.509	33%	0.326	S	S	.	.	H	α-helix	trans	-65	-47.6	176.8	-71.1	-65	0	0	0	112.8	L489 V491 V495 F496 F497	L489-F493 WeakPolarHBondContact O-CD2 3.16Å; L489-F493 PolarHBondContact O-N 3.36Å; V491-F493 PolarHBondContact O-N 3.23Å; F493-V495 VanDerWaalsContact C-N 3.28Å; F493-V495 PolarHBondContact O-N 2.79Å; F493-F496 PolarHBondContact O-N 3.41Å; F493-F497 WeakPolarHBondContact O-CD2 3.41Å; F493-F497 PolarHBondContact O-N 3.39Å
494	V	80.6	Confident	76.6	Confident	71 Å²	71	64.9 Å²	64.9	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-60.3	-41	177.8	168.4	0	0	0	0	111.2	C490 V491 L498 I543	C490-V494 WeakPolarHBondContact O-CB 3.22Å; C490-V494 WeakPolarHBondContact O-CG2 3.36Å; C490-V494 PolarHBondContact O-N 2.88Å; C490-V494 VanDerWaalsContact O-N 3.08Å; V491-V494 PolarHBondContact O-N 3.19Å; V494-L498 HydrophobicContact CG1-CD1 3.87Å; V494-L498 WeakPolarHBondContact O-CB 3.42Å; V494-L498 WeakPolarHBondContact O-CD1 3.47Å; V494-L498 VanDerWaalsContact O-CG 3.24Å; V494-L498 WeakPolarHBondContact O-CG 3.41Å; V494-L498 PolarHBondContact O-N 2.89Å; V494-I543 HydrophobicContact CG1-CD1 4.29Å
495	V	74.7	Confident	75.1	Confident	14 Å²	14	67.5 Å²	67.5	9%	0.085	34%	0.337	C	S	.	.	H	α-helix	trans	-65.2	-50	175.5	165.8	0	0	0	0	110.7	V491 F492 F493 F497 L498 T499 L540 L570	V491-V495 HydrophobicContact CG1-CG2 3.78Å; V491-V495 WeakPolarHBondContact O-CB 3.32Å; V491-V495 WeakPolarHBondContact O-CG2 3.21Å; V491-V495 PolarHBondContact O-N 3.18Å; F492-V495 PolarHBondContact O-N 2.85Å; F493-V495 VanDerWaalsContact C-N 3.28Å; F493-V495 PolarHBondContact O-N 2.79Å; V495-F497 VanDerWaalsContact C-N 3.31Å; V495-F497 PolarHBondContact O-N 2.8Å; V495-L498 CarbonylContact O-C 3.55Å; V495-L498 WeakPolarHBondContact O-CA 3.4Å; V495-L498 PolarHBondContact O-N 2.84Å; V495-T499 HydrophobicContact CG1-CG2 3.53Å; V495-T499 WeakPolarHBondContact O-CB 3.35Å; V495-T499 WeakPolarHBondContact O-CG2 3.42Å; V495-T499 PolarHBondContact O-N 3.44Å; V495-T499 PolarHBondContact O-OG1 3.41Å; V495-L540 HydrophobicContact CG2-CD2 4Å; V495-L570 HydrophobicContact CG1-CD1 3.48Å; V495-L570 VanDerWaalsContact CG1-CD1 3.48Å; V495-L570 HydrophobicContact CG1-CD2 4.32Å; V495-L570 HydrophobicContact CG2-CD2 3.85Å
496	F	72.4	Confident	73.2	Confident	74 Å²	74	67.4 Å²	67.4	33%	0.325	34%	0.338	S	S	.	.	H	α-helix	trans	-52.6	-46.9	-177.6	178.9	-98.4	0	0	0	112.2	F492 F493 L498 T499 T500 I586	F492-F496 VanDerWaalsContact O-CB 3.22Å; F492-F496 WeakPolarHBondContact O-CB 3.21Å; F492-F496 PolarHBondContact O-N 3.39Å; F493-F496 PolarHBondContact O-N 3.41Å; F496-L498 VanDerWaalsContact C-N 3.35Å; F496-L498 PolarHBondContact O-N 3.43Å; F496-T499 WeakPolarHBondContact CA-OG1 3.31Å; F496-T499 PolarHBondContact O-N 3.38Å; F496-T499 PolarHBondContact O-OG1 3.33Å; F496-T500 PolarHBondContact O-OG1 3.39Å; F496-I586 HydrophobicContact CE1-CD1 4.47Å
497	F	70.2	Confident	71.7	Confident	135 Å²	135	63.9 Å²	63.9	59%	0.592	33%	0.325	S	S	*	.	H	α-helix	trans	-73	-21.4	176.5	-65.1	-64	0	0	0	114.3	F493 V495	F493-F497 WeakPolarHBondContact O-CD2 3.41Å; F493-F497 PolarHBondContact O-N 3.39Å; V495-F497 VanDerWaalsContact C-N 3.31Å; V495-F497 PolarHBondContact O-N 2.8Å
498	L	67.7	Low	70.3	Confident	45 Å²	45	63.8 Å²	63.8	24%	0.236	33%	0.326	C	S	.	.	H	α-helix	trans	-87.3	-26.9	173.7	-73.7	171.2	0	0	0	113.4	V494 V495 F496 T500 V536 L540 I543	V494-L498 HydrophobicContact CG1-CD1 3.87Å; V494-L498 WeakPolarHBondContact O-CB 3.42Å; V494-L498 WeakPolarHBondContact O-CD1 3.47Å; V494-L498 VanDerWaalsContact O-CG 3.24Å; V494-L498 WeakPolarHBondContact O-CG 3.41Å; V494-L498 PolarHBondContact O-N 2.89Å; V495-L498 CarbonylContact O-C 3.55Å; V495-L498 WeakPolarHBondContact O-CA 3.4Å; V495-L498 PolarHBondContact O-N 2.84Å; F496-L498 VanDerWaalsContact C-N 3.35Å; F496-L498 PolarHBondContact O-N 3.43Å; L498-T500 PolarHBondContact O-N 2.82Å; L498-T500 VanDerWaalsContact O-N 3.09Å; L498-V536 HydrophobicContact CB-CG1 4.33Å; L498-L540 HydrophobicContact CD1-CD2 3.97Å; L498-I543 HydrophobicContact CD1-CD1 3.92Å
499	T	65.1	Low	68.8	Low	23 Å²	23	64.7 Å²	64.7	14%	0.141	33%	0.331	C	S	.	.	S	Bend	trans	-73.5	5.2	-176.4	43.6	0	0	0	0	114.3	V495 F496 P501 M574	V495-T499 HydrophobicContact CG1-CG2 3.53Å; V495-T499 WeakPolarHBondContact O-CB 3.35Å; V495-T499 WeakPolarHBondContact O-CG2 3.42Å; V495-T499 PolarHBondContact O-N 3.44Å; V495-T499 PolarHBondContact O-OG1 3.41Å; F496-T499 WeakPolarHBondContact CA-OG1 3.31Å; F496-T499 PolarHBondContact O-N 3.38Å; F496-T499 PolarHBondContact O-OG1 3.33Å; T499-P501 WeakPolarHBondContact O-CD 3.26Å; T499-M574 HydrophobicContact CG2-CB 4.12Å; T499-M574 HydrophobicContact CG2-CG 3.86Å; T499-M574 HydrophobicContact CG2-SD 4.1Å
500	T	62.5	Low	67.4	Low	14 Å²	14	64.8 Å²	64.8	9%	0.086	34%	0.335	C	S	.	.			trans	-114.3	73.2	178.3	-37.4	0	0	0	0	109.3	F496 L498 T502 Y503 V504 T584	F496-T500 PolarHBondContact O-OG1 3.39Å; L498-T500 PolarHBondContact O-N 2.82Å; L498-T500 VanDerWaalsContact O-N 3.09Å; T500-T502 PolarHBondContact O-N 3.11Å; T500-T502 VanDerWaalsContact O-N 3.14Å; T500-Y503 WeakPolarHBondContact O-CA 3.29Å; T500-Y503 VanDerWaalsContact O-CB 3.31Å; T500-Y503 WeakPolarHBondContact O-CB 3.32Å; T500-Y503 PolarHBondContact O-N 2.8Å; T500-V504 PolarHBondContact O-N 3.43Å; T500-T584 WeakPolarHBondContact CG2-O 3.33Å
501	P	56.2	Low	66.1	Low	33 Å²	33	66.7 Å²	66.7	21%	0.214	34%	0.341	C	S	.	.	H	α-helix	trans	-52.2	-34.5	173.3	-25.6	32.9	0	0	0	112.5	T499 Y503 V504 L505 L533	T499-P501 WeakPolarHBondContact O-CD 3.26Å; P501-Y503 VanDerWaalsContact C-N 3.3Å; P501-Y503 PolarHBondContact O-N 3.35Å; P501-V504 PolarHBondContact O-N 3.14Å; P501-V504 VanDerWaalsContact O-N 3.1Å; P501-L505 PolarHBondContact O-N 2.9Å; P501-L533 HydrophobicContact CG-CD1 3.82Å
502	T	51.6	Low	65	Low	52 Å²	52	70.1 Å²	70.1	32%	0.319	36%	0.355	S	S	.	.	H	α-helix	trans	-68.7	-24	175.2	-43.2	0	0	0	0	112.7	T500 N506 T584	T500-T502 PolarHBondContact O-N 3.11Å; T500-T502 VanDerWaalsContact O-N 3.14Å; T502-N506 WeakPolarHBondContact O-CA 3.33Å; T502-N506 WeakPolarHBondContact O-CB 3.27Å; T502-N506 PolarHBondContact O-N 2.88Å; T502-T584 VanDerWaalsContact CB-O 3.29Å; T502-T584 WeakPolarHBondContact CB-O 3.39Å; T502-T584 WeakPolarHBondContact OG1-CB 3.41Å; T502-T584 PolarHBondContact OG1-O 3.38Å; T502-T584 PolarHBondContact OG1-OG1 2.91Å
503	Y	57.4	Low	64	Low	125 Å²	125	67.9 Å²	67.9	49%	0.49	35%	0.348	S	S	.	.	H	α-helix	trans	-71.3	-40.5	166.9	177.1	-95.5	0	0	0	110.8	T500 P501 N506 L507	T500-Y503 WeakPolarHBondContact O-CA 3.29Å; T500-Y503 VanDerWaalsContact O-CB 3.31Å; T500-Y503 WeakPolarHBondContact O-CB 3.32Å; T500-Y503 PolarHBondContact O-N 2.8Å; P501-Y503 VanDerWaalsContact C-N 3.3Å; P501-Y503 PolarHBondContact O-N 3.35Å; Y503-N506 PolarHBondContact O-N 3.45Å; Y503-L507 HydrophobicContact CE1-CD2 4.24Å; Y503-L507 WeakPolarHBondContact O-CB 3.29Å; Y503-L507 PolarHBondContact O-N 3.42Å
504	V	58.4	Low	63	Low	42 Å²	42	64 Å²	64	26%	0.255	33%	0.334	S	S	.	.	H	α-helix	trans	-65.7	-41.8	175.8	-171.2	0	0	0	0	110.8	T500 P501 L507 V508 I532	T500-V504 PolarHBondContact O-N 3.43Å; P501-V504 PolarHBondContact O-N 3.14Å; P501-V504 VanDerWaalsContact O-N 3.1Å; V504-L507 PolarHBondContact O-N 3.29Å; V504-V508 WeakPolarHBondContact O-CG2 3.4Å; V504-V508 PolarHBondContact O-N 2.72Å; V504-I532 HydrophobicContact CB-CG2 4.25Å; V504-I532 HydrophobicContact CG1-CD1 4.1Å; V504-I532 HydrophobicContact CG1-CG2 3.94Å
505	L	58.6	Low	62.2	Low	59 Å²	59	66.8 Å²	66.8	31%	0.309	34%	0.342	S	S	.	.	H	α-helix	trans	-67.4	-43.6	175.6	-173.8	58.8	0	0	0	112	P501 L507 V508 N509 P529	P501-L505 PolarHBondContact O-N 2.9Å; L505-L507 VanDerWaalsContact C-N 3.3Å; L505-L507 PolarHBondContact O-N 2.84Å; L505-V508 WeakPolarHBondContact O-CB 3.2Å; L505-V508 PolarHBondContact O-N 3.45Å; L505-N509 PolarHBondContact O-N 3.47Å; L505-N509 PolarHBondContact O-OD1 3.48Å; L505-P529 HydrophobicContact CD1-CG 4.05Å; L505-P529 HydrophobicContact CD2-CG 4.3Å
506	N	53.7	Low	61.4	Low	91 Å²	91	76 Å²	76	49%	0.487	38%	0.376	S	S	.	.	H	α-helix	trans	-65.6	-33.3	174.5	-169	45.6	0	0	0	111.8	T502 Y503 N509 T510	T502-N506 WeakPolarHBondContact O-CA 3.33Å; T502-N506 WeakPolarHBondContact O-CB 3.27Å; T502-N506 PolarHBondContact O-N 2.88Å; Y503-N506 PolarHBondContact O-N 3.45Å; N506-N509 PolarHBondContact O-N 3.26Å; N506-T510 VanDerWaalsContact O-CB 3.22Å; N506-T510 WeakPolarHBondContact O-CB 3.42Å; N506-T510 PolarHBondContact O-N 3.06Å; N506-T510 PolarHBondContact O-OG1 3.44Å
507	L	61.3	Low	61.1	Low	67 Å²	67	77.6 Å²	77.6	35%	0.351	39%	0.387	S	S	.	.	H	α-helix	trans	-68.3	-41.3	173.5	-177.5	66.6	0	0	0	111.4	Y503 V504 L505 N509 T510 L511	Y503-L507 HydrophobicContact CE1-CD2 4.24Å; Y503-L507 WeakPolarHBondContact O-CB 3.29Å; Y503-L507 PolarHBondContact O-N 3.42Å; V504-L507 PolarHBondContact O-N 3.29Å; L505-L507 VanDerWaalsContact C-N 3.3Å; L505-L507 PolarHBondContact O-N 2.84Å; L507-N509 VanDerWaalsContact C-N 3.28Å; L507-N509 PolarHBondContact O-N 2.86Å; L507-T510 PolarHBondContact O-N 3.21Å; L507-L511 HydrophobicContact CD1-CD1 3.85Å; L507-L511 HydrophobicContact CD1-CD2 4.49Å; L507-L511 HydrophobicContact CD1-CG 3.94Å; L507-L511 HydrophobicContact CG-CD1 3.83Å; L507-L511 HydrophobicContact CG-CG 4.28Å; L507-L511 VanDerWaalsContact O-CB 3.27Å; L507-L511 WeakPolarHBondContact O-CB 3.35Å; L507-L511 WeakPolarHBondContact O-CG 3.44Å; L507-L511 PolarHBondContact O-N 3.44Å
508	V	63	Low	60.5	Low	23 Å²	23	78.9 Å²	78.9	14%	0.139	40%	0.395	C	S	.	.	H	α-helix	trans	-57.5	-42.3	171.6	163.2	0	0	0	0	111.1	V504 L505 L513 T514	V504-V508 WeakPolarHBondContact O-CG2 3.4Å; V504-V508 PolarHBondContact O-N 2.72Å; L505-V508 WeakPolarHBondContact O-CB 3.2Å; L505-V508 PolarHBondContact O-N 3.45Å; V508-L513 HydrophobicContact CG1-CB 4.29Å; V508-L513 WeakPolarHBondContact O-CB 3.33Å; V508-L513 PolarHBondContact O-N 3.5Å; V508-T514 HydrophobicContact CG1-CG2 4.27Å
509	N	58.2	Low	60.1	Low	84 Å²	84	78.6 Å²	78.6	45%	0.449	39%	0.393	S	S	.	.	H	α-helix	trans	-71.9	-46.1	177.1	-65.2	-7.8	0	0	0	112.3	L505 N506 L507 L511 H512	L505-N509 PolarHBondContact O-N 3.47Å; L505-N509 PolarHBondContact O-OD1 3.48Å; N506-N509 PolarHBondContact O-N 3.26Å; L507-N509 VanDerWaalsContact C-N 3.28Å; L507-N509 PolarHBondContact O-N 2.86Å; N509-L511 VanDerWaalsContact C-N 3.32Å; N509-L511 PolarHBondContact O-N 2.95Å; N509-H512 WeakPolarHBondContact O-CA 3.26Å; N509-H512 PolarHBondContact O-N 2.86Å
510	T	60.3	Low	59.7	Low	91 Å²	91	82.7 Å²	82.7	56%	0.558	41%	0.414	S	S	*	.	H	α-helix	trans	-67.1	-30.7	-177.9	-55	0	0	0	0	112.2	N506 L507 H512	N506-T510 VanDerWaalsContact O-CB 3.22Å; N506-T510 WeakPolarHBondContact O-CB 3.42Å; N506-T510 PolarHBondContact O-N 3.06Å; N506-T510 PolarHBondContact O-OG1 3.44Å; L507-T510 PolarHBondContact O-N 3.21Å; T510-H512 PolarHBondContact O-N 2.87Å
511	L	63.5	Low	59.8	Low	97 Å²	97	87 Å²	87	51%	0.508	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	1.1	170.9	-65.7	175.2	0	0	0	113	L507 N509 L513	L507-L511 HydrophobicContact CD1-CD1 3.85Å; L507-L511 HydrophobicContact CD1-CD2 4.49Å; L507-L511 HydrophobicContact CD1-CG 3.94Å; L507-L511 HydrophobicContact CG-CD1 3.83Å; L507-L511 HydrophobicContact CG-CG 4.28Å; L507-L511 VanDerWaalsContact O-CB 3.27Å; L507-L511 WeakPolarHBondContact O-CB 3.35Å; L507-L511 WeakPolarHBondContact O-CG 3.44Å; L507-L511 PolarHBondContact O-N 3.44Å; N509-L511 VanDerWaalsContact C-N 3.32Å; N509-L511 PolarHBondContact O-N 2.95Å; L511-L513 HydrophobicContact CB-CB 4.46Å; L511-L513 HydrophobicContact CB-CD1 4.26Å; L511-L513 PolarHBondContact O-N 3.47Å; L511-L513 VanDerWaalsContact O-N 3.16Å
512	H	61.7	Low	60	Low	97 Å²	97	87.2 Å²	87.2	45%	0.449	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	35.5	-171.7	-73.2	-109.7	0	0	0	112.2	N509 T510 T514 E515 R516	N509-H512 WeakPolarHBondContact O-CA 3.26Å; N509-H512 PolarHBondContact O-N 2.86Å; T510-H512 PolarHBondContact O-N 2.87Å; H512-T514 VanDerWaalsContact C-N 3.29Å; H512-T514 PolarHBondContact O-N 3.47Å; H512-E515 IonicContact CE1-OE2 3.23Å; H512-E515 IonicContact CG-OE2 2.61Å; H512-E515 IonicContact ND1-OE1 2.68Å; H512-E515 IonicContact ND1-OE2 2.75Å; H512-E515 PolarHBondContact ND1-OE2 3.48Å; H512-E515 PolarHBondContact O-N 3.14Å; H512-E515 VanDerWaalsContact O-N 3.15Å; H512-R516 HydrophobicContact CB-CG 4.49Å; H512-R516 WeakPolarHBondContact O-CB 3.27Å; H512-R516 WeakPolarHBondContact O-CG 3.37Å; H512-R516 PolarHBondContact O-N 3.42Å
513	L	64.4	Low	60.4	Low	72 Å²	72	87.8 Å²	87.8	38%	0.377	44%	0.439	S	S	.	.	H	α-helix	trans	-67.9	-31.8	-165.5	-149.9	80.7	0	0	0	112.2	V508 L511 L517	V508-L513 HydrophobicContact CG1-CB 4.29Å; V508-L513 WeakPolarHBondContact O-CB 3.33Å; V508-L513 PolarHBondContact O-N 3.5Å; L511-L513 HydrophobicContact CB-CB 4.46Å; L511-L513 HydrophobicContact CB-CD1 4.26Å; L511-L513 PolarHBondContact O-N 3.47Å; L511-L513 VanDerWaalsContact O-N 3.16Å; L513-L517 HydrophobicContact CD2-CD1 4.21Å; L513-L517 HydrophobicContact CG-CD1 4.01Å; L513-L517 VanDerWaalsContact O-CB 3.28Å; L513-L517 WeakPolarHBondContact O-CB 3.25Å; L513-L517 WeakPolarHBondContact O-CD1 3.16Å; L513-L517 WeakPolarHBondContact O-CG 3.27Å; L513-L517 PolarHBondContact O-N 3.4Å
514	T	62.4	Low	60.7	Low	34 Å²	34	85.6 Å²	85.6	21%	0.209	44%	0.435	C	S	.	.	H	α-helix	trans	-61.7	-44.5	173.2	40.7	0	0	0	0	112.5	V508 H512 Q518 I519	V508-T514 HydrophobicContact CG1-CG2 4.27Å; H512-T514 VanDerWaalsContact C-N 3.29Å; H512-T514 PolarHBondContact O-N 3.47Å; T514-Q518 PolarHBondContact O-N 2.84Å; T514-I519 PolarHBondContact O-N 3.1Å
515	E	62.7	Low	61	Low	131 Å²	131	87 Å²	87	61%	0.612	44%	0.44	S	S	*	.	H	α-helix	trans	-72.6	-45.8	177.4	-62.1	177.3	168.7	0	0	111.3	H512 L517 Q518	H512-E515 IonicContact CE1-OE2 3.23Å; H512-E515 IonicContact CG-OE2 2.61Å; H512-E515 IonicContact ND1-OE1 2.68Å; H512-E515 IonicContact ND1-OE2 2.75Å; H512-E515 PolarHBondContact ND1-OE2 3.48Å; H512-E515 PolarHBondContact O-N 3.14Å; H512-E515 VanDerWaalsContact O-N 3.15Å; E515-L517 PolarHBondContact O-N 3.01Å; E515-Q518 PolarHBondContact O-N 3.44Å
516	R	59.3	Low	61.1	Low	207 Å²	207	86.5 Å²	86.5	78%	0.781	44%	0.436	S	S	*	.	H	α-helix	trans	-58	-30.9	177.4	-71.7	-78.5	-177.6	141.4	0.6	113.3	H512	H512-R516 HydrophobicContact CB-CG 4.49Å; H512-R516 WeakPolarHBondContact O-CB 3.27Å; H512-R516 WeakPolarHBondContact O-CG 3.37Å; H512-R516 PolarHBondContact O-N 3.42Å
517	L	64.9	Low	61.8	Low	107 Å²	107	82.8 Å²	82.8	56%	0.56	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	4	177.7	-65.6	171.2	0	0	0	113.3	L513 E515 I519	L513-L517 HydrophobicContact CD2-CD1 4.21Å; L513-L517 HydrophobicContact CG-CD1 4.01Å; L513-L517 VanDerWaalsContact O-CB 3.28Å; L513-L517 WeakPolarHBondContact O-CB 3.25Å; L513-L517 WeakPolarHBondContact O-CD1 3.16Å; L513-L517 WeakPolarHBondContact O-CG 3.27Å; L513-L517 PolarHBondContact O-N 3.4Å; E515-L517 PolarHBondContact O-N 3.01Å; L517-I519 HydrophobicContact CB-CD1 3.74Å; L517-I519 HydrophobicContact CB-CG1 3.66Å; L517-I519 HydrophobicContact CD1-CD1 3.96Å; L517-I519 PolarHBondContact O-N 3.04Å; L517-I519 VanDerWaalsContact O-N 3.16Å
518	Q	57.1	Low	62.2	Low	163 Å²	163	81.8 Å²	81.8	76%	0.762	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	34.8	-175.4	-64.3	-170.7	-30.6	0	0	114.3	T514 E515 N520	T514-Q518 PolarHBondContact O-N 2.84Å; E515-Q518 PolarHBondContact O-N 3.44Å; Q518-N520 PolarHBondContact O-N 3.1Å
519	I	60.6	Low	62.3	Low	38 Å²	38	82.6 Å²	82.6	20%	0.195	42%	0.416	C	S	.	.			trans	-80.3	66.4	-177.8	-53.3	177.9	0	0	0	109.6	T514 L517 N521 L524	T514-I519 PolarHBondContact O-N 3.1Å; L517-I519 HydrophobicContact CB-CD1 3.74Å; L517-I519 HydrophobicContact CB-CG1 3.66Å; L517-I519 HydrophobicContact CD1-CD1 3.96Å; L517-I519 PolarHBondContact O-N 3.04Å; L517-I519 VanDerWaalsContact O-N 3.16Å; I519-N521 PolarHBondContact O-N 3.35Å; I519-L524 HydrophobicContact CG2-CB 3.57Å; I519-L524 HydrophobicContact CG2-CD1 3.74Å; I519-L524 HydrophobicContact CG2-CG 4.3Å
520	N	55.6	Low	62.7	Low	110 Å²	110	78.9 Å²	78.9	59%	0.588	40%	0.397	S	S	*	.			trans	-72.2	-4.9	177.8	-77.9	-25.4	0	0	0	113.6	R18 Q518 P522	R18-N520 PolarHBondContact NH1-O 3.4Å; Q518-N520 PolarHBondContact O-N 3.1Å; N520-P522 VanDerWaalsContact O-CD 3.25Å; N520-P522 WeakPolarHBondContact O-CD 3.43Å
521	N	65.3	Low	63.3	Low	105 Å²	105	78.4 Å²	78.4	56%	0.561	39%	0.39	S	S	*	.			trans	-76.3	106.3	178	-70.6	-24.5	0	0	0	110.4	I519 L523 L524	I519-N521 PolarHBondContact O-N 3.35Å; N521-L523 PolarHBondContact O-N 3.3Å; N521-L523 VanDerWaalsContact O-N 3.13Å; N521-L524 HydrophobicContact CB-CD1 4.32Å; N521-L524 PolarHBondContact O-N 3.42Å
522	P	60	Low	63.7	Low	36 Å²	36	75.8 Å²	75.8	23%	0.234	38%	0.376	C	S	.	.	H	α-helix	trans	-62.7	-26.4	-174.8	25.3	-34.1	0	0	0	113	R18 I20 N520 L524 I525 Q526	R18-P522 WeakPolarHBondContact O-CB 3.37Å; I20-P522 HydrophobicContact CD1-CB 4.28Å; I20-P522 HydrophobicContact CD1-CG 4.01Å; I20-P522 HydrophobicContact CG1-CB 3.97Å; I20-P522 HydrophobicContact CG1-CG 3.87Å; N520-P522 VanDerWaalsContact O-CD 3.25Å; N520-P522 WeakPolarHBondContact O-CD 3.43Å; P522-L524 PolarHBondContact O-N 3.28Å; P522-I525 PolarHBondContact O-N 2.87Å; P522-Q526 PolarHBondContact O-N 3.24Å
523	L	60.2	Low	64.1	Low	64 Å²	64	71.2 Å²	71.2	34%	0.335	36%	0.355	S	S	.	.	H	α-helix	trans	-53.9	-50.2	171.3	-69.9	170.7	0	0	0	112.4	I20 Y28 N521 I525 Q526 F527	I20-L523 HydrophobicContact CD1-CD2 3.47Å; I20-L523 VanDerWaalsContact CD1-CD2 3.47Å; I20-L523 HydrophobicContact CD1-CG 3.77Å; Y28-L523 HydrophobicContact CD1-CD2 3.83Å; Y28-L523 HydrophobicContact CD2-CD2 4.5Å; Y28-L523 HydrophobicContact CG-CD2 3.77Å; N521-L523 PolarHBondContact O-N 3.3Å; N521-L523 VanDerWaalsContact O-N 3.13Å; L523-I525 VanDerWaalsContact C-N 3.34Å; L523-I525 PolarHBondContact O-N 3.26Å; L523-Q526 PolarHBondContact O-N 3.27Å; L523-F527 HydrophobicContact CB-CE2 3.9Å; L523-F527 HydrophobicContact CB-CZ 4.37Å; L523-F527 HydrophobicContact CD2-CE2 4.45Å; L523-F527 HydrophobicContact CD2-CZ 4.14Å; L523-F527 WeakPolarHBondContact O-CD2 3.44Å; L523-F527 WeakPolarHBondContact O-CE2 3.43Å; L523-F527 VanDerWaalsContact O-CG 3.27Å; L523-F527 WeakPolarHBondContact O-CG 3.26Å; L523-F527 PolarHBondContact O-N 3.19Å
524	L	64.4	Low	64.6	Low	79 Å²	79	69.2 Å²	69.2	41%	0.414	34%	0.343	S	S	.	.	H	α-helix	trans	-66.3	-37.8	-177.4	-84.1	167.6	0	0	0	111.9	I519 N521 P522 Q526 F527 I528	I519-L524 HydrophobicContact CG2-CB 3.57Å; I519-L524 HydrophobicContact CG2-CD1 3.74Å; I519-L524 HydrophobicContact CG2-CG 4.3Å; N521-L524 HydrophobicContact CB-CD1 4.32Å; N521-L524 PolarHBondContact O-N 3.42Å; P522-L524 PolarHBondContact O-N 3.28Å; L524-Q526 VanDerWaalsContact C-N 3.31Å; L524-Q526 PolarHBondContact O-N 2.8Å; L524-F527 PolarHBondContact O-N 3.47Å; L524-I528 WeakPolarHBondContact O-CD1 3.31Å; L524-I528 VanDerWaalsContact O-CG1 3.26Å; L524-I528 WeakPolarHBondContact O-CG1 3.25Å; L524-I528 PolarHBondContact O-N 3.08Å
525	I	63.1	Low	65.4	Low	72 Å²	72	70.1 Å²	70.1	37%	0.369	35%	0.35	S	S	.	.	H	α-helix	trans	-61.6	-40.3	177.6	-60.3	175	0	0	0	110.7	P522 L523 P529	P522-I525 PolarHBondContact O-N 2.87Å; L523-I525 VanDerWaalsContact C-N 3.34Å; L523-I525 PolarHBondContact O-N 3.26Å; I525-P529 WeakPolarHBondContact O-CD 3.29Å
526	Q	61.5	Low	66.1	Low	48 Å²	48	64.9 Å²	64.9	22%	0.224	33%	0.327	C	S	.	.	H	α-helix	trans	-68.5	-32.4	176.1	-70	-178.7	-27.1	0	0	113.4	P522 L523 L524	P522-Q526 PolarHBondContact O-N 3.24Å; L523-Q526 PolarHBondContact O-N 3.27Å; L524-Q526 VanDerWaalsContact C-N 3.31Å; L524-Q526 PolarHBondContact O-N 2.8Å
527	F	68.6	Low	67	Low	14 Å²	14	55.1 Å²	55.1	6%	0.061	29%	0.29	C	S	.	.	H	α-helix	trans	-81.6	-30.4	-178.9	-55.2	-36.8	0	0	0	114	N29 V32 L523 L524 S530 I531	N29-F527 VanDerWaalsContact CA-CE1 3.48Å; N29-F527 HydrophobicContact CB-CD1 4.23Å; N29-F527 HydrophobicContact CB-CE1 3.67Å; V32-F527 HydrophobicContact CB-CE2 4.32Å; V32-F527 HydrophobicContact CB-CZ 4.43Å; V32-F527 HydrophobicContact CG1-CE2 4.42Å; V32-F527 HydrophobicContact CG2-CE2 3.78Å; V32-F527 HydrophobicContact CG2-CZ 3.99Å; L523-F527 HydrophobicContact CB-CE2 3.9Å; L523-F527 HydrophobicContact CB-CZ 4.37Å; L523-F527 HydrophobicContact CD2-CE2 4.45Å; L523-F527 HydrophobicContact CD2-CZ 4.14Å; L523-F527 WeakPolarHBondContact O-CD2 3.44Å; L523-F527 WeakPolarHBondContact O-CE2 3.43Å; L523-F527 VanDerWaalsContact O-CG 3.27Å; L523-F527 WeakPolarHBondContact O-CG 3.26Å; L523-F527 PolarHBondContact O-N 3.19Å; L524-F527 PolarHBondContact O-N 3.47Å; F527-S530 PolarHBondContact O-N 3.45Å; F527-S530 VanDerWaalsContact O-N 3.13Å; F527-I531 HydrophobicContact CB-CD1 3.93Å; F527-I531 WeakPolarHBondContact O-CG1 3.47Å; F527-I531 PolarHBondContact O-N 3.05Å
528	I	69.4	Low	67.8	Low	45 Å²	45	50.7 Å²	50.7	23%	0.231	27%	0.269	C	S	.	.	H	α-helix	trans	-53.6	-49.5	-176.2	-77.9	162.3	0	0	0	113.2	L524 S530 I531 I532	L524-I528 WeakPolarHBondContact O-CD1 3.31Å; L524-I528 VanDerWaalsContact O-CG1 3.26Å; L524-I528 WeakPolarHBondContact O-CG1 3.25Å; L524-I528 PolarHBondContact O-N 3.08Å; I528-S530 VanDerWaalsContact C-N 3.35Å; I528-S530 PolarHBondContact O-N 2.96Å; I528-I531 PolarHBondContact O-N 3.45Å; I528-I532 HydrophobicContact CG2-CD1 3.59Å; I528-I532 HydrophobicContact CG2-CG1 4.37Å; I528-I532 WeakPolarHBondContact O-CB 3.28Å; I528-I532 VanDerWaalsContact O-CG1 3.27Å; I528-I532 WeakPolarHBondContact O-CG1 3.15Å; I528-I532 PolarHBondContact O-N 2.82Å
529	P	65	Low	69	Low	40 Å²	40	47.2 Å²	47.2	26%	0.26	26%	0.256	S	S	.	.	H	α-helix	trans	-59.9	-41.8	177.1	-23.7	33.1	0	0	0	113.2	L505 I525 I532 L533 F676	L505-P529 HydrophobicContact CD1-CG 4.05Å; L505-P529 HydrophobicContact CD2-CG 4.3Å; I525-P529 WeakPolarHBondContact O-CD 3.29Å; P529-I532 PolarHBondContact O-N 3.13Å; P529-L533 PolarHBondContact O-N 3.08Å; P529-F676 HydrophobicContact CB-CE2 4.49Å
530	S	66.3	Low	70	Confident	6 Å²	6	45.5 Å²	45.5	4%	0.042	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-42.8	179.6	-61	0	0	0	0	111.7	F527 I528 W534	F527-S530 PolarHBondContact O-N 3.45Å; F527-S530 VanDerWaalsContact O-N 3.13Å; I528-S530 VanDerWaalsContact C-N 3.35Å; I528-S530 PolarHBondContact O-N 2.96Å; S530-W534 WeakPolarHBondContact O-CB 3.44Å; S530-W534 PolarHBondContact O-N 3.34Å
531	I	73.6	Confident	71.4	Confident	82 Å²	82	40.2 Å²	40.2	42%	0.421	22%	0.219	S	C	.	.	H	α-helix	trans	-70.5	-38.3	178.4	-67.4	170.2	0	0	0	111	F527 I528 S535	F527-I531 HydrophobicContact CB-CD1 3.93Å; F527-I531 WeakPolarHBondContact O-CG1 3.47Å; F527-I531 PolarHBondContact O-N 3.05Å; I528-I531 PolarHBondContact O-N 3.45Å; I531-S535 VanDerWaalsContact O-CB 3.25Å; I531-S535 WeakPolarHBondContact O-CB 3.45Å; I531-S535 PolarHBondContact O-N 3.27Å; I531-S535 PolarHBondContact O-OG 3.07Å
532	I	71.8	Confident	72.3	Confident	41 Å²	41	38 Å²	38	21%	0.21	20%	0.202	C	C	.	.	H	α-helix	trans	-64.3	-52	175.3	-73	171.9	0	0	0	110.5	V504 I528 P529 W534 S535 V536	V504-I532 HydrophobicContact CB-CG2 4.25Å; V504-I532 HydrophobicContact CG1-CD1 4.1Å; V504-I532 HydrophobicContact CG1-CG2 3.94Å; I528-I532 HydrophobicContact CG2-CD1 3.59Å; I528-I532 HydrophobicContact CG2-CG1 4.37Å; I528-I532 WeakPolarHBondContact O-CB 3.28Å; I528-I532 VanDerWaalsContact O-CG1 3.27Å; I528-I532 WeakPolarHBondContact O-CG1 3.15Å; I528-I532 PolarHBondContact O-N 2.82Å; P529-I532 PolarHBondContact O-N 3.13Å; I532-W534 VanDerWaalsContact C-N 3.34Å; I532-W534 PolarHBondContact O-N 3.06Å; I532-S535 PolarHBondContact O-N 3.12Å; I532-V536 WeakPolarHBondContact O-CG2 3.15Å; I532-V536 PolarHBondContact O-N 3.02Å
533	L	69.6	Low	73.5	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-61.3	-44.6	177.8	179.1	64.7	0	0	0	111.1	P501 P529 S535 V536 S537 M574 F676 Y680	P501-L533 HydrophobicContact CG-CD1 3.82Å; P529-L533 PolarHBondContact O-N 3.08Å; L533-S535 VanDerWaalsContact C-N 3.33Å; L533-S535 PolarHBondContact O-N 3.01Å; L533-V536 PolarHBondContact O-N 3.16Å; L533-S537 VanDerWaalsContact O-CB 3.27Å; L533-S537 WeakPolarHBondContact O-CB 3.2Å; L533-S537 PolarHBondContact O-N 2.94Å; L533-S537 PolarHBondContact O-OG 3.27Å; L533-M574 HydrophobicContact CD1-CE 3.97Å; L533-F676 HydrophobicContact CB-CZ 4.18Å; L533-F676 HydrophobicContact CD2-CE1 3.38Å; L533-F676 HydrophobicContact CD2-CZ 3.39Å; L533-F676 HydrophobicContact CG-CZ 4.4Å; L533-Y680 HydrophobicContact CD2-CD2 4.34Å
534	W	76.2	Confident	74.8	Confident	30 Å²	30	35.4 Å²	35.4	11%	0.114	19%	0.187	C	C	.	.	H	α-helix	trans	-57.8	-46.4	176.7	172.5	82.2	0	0	0	111.3	S530 I532 V536 S537 A538 Y680 T683 I687 L691	S530-W534 WeakPolarHBondContact O-CB 3.44Å; S530-W534 PolarHBondContact O-N 3.34Å; I532-W534 VanDerWaalsContact C-N 3.34Å; I532-W534 PolarHBondContact O-N 3.06Å; W534-V536 PolarHBondContact O-N 3.03Å; W534-S537 WeakPolarHBondContact CA-OG 3.33Å; W534-S537 PolarHBondContact O-N 3.24Å; W534-S537 PolarHBondContact O-OG 3.49Å; W534-A538 HydrophobicContact CZ2-CB 4.44Å; W534-A538 WeakPolarHBondContact O-CB 3.14Å; W534-A538 PolarHBondContact O-N 3.41Å; W534-Y680 HydrophobicContact CB-CD2 4.43Å; W534-Y680 HydrophobicContact CB-CE2 4.39Å; W534-T683 HydrophobicContact CB-CG2 4.24Å; W534-T683 HydrophobicContact CD2-CG2 4.16Å; W534-T683 HydrophobicContact CG-CG2 3.91Å; W534-I687 HydrophobicContact CH2-CG2 4.15Å; W534-I687 HydrophobicContact CZ2-CG2 4.3Å; W534-L691 HydrophobicContact CH2-CD1 3.55Å; W534-L691 HydrophobicContact CZ2-CD1 4.1Å
535	S	78.5	Confident	75.9	Confident	52 Å²	52	32.5 Å²	32.5	36%	0.364	17%	0.171	S	C	.	.	H	α-helix	trans	-63.2	-42.2	178.8	-58.8	0	0	0	0	112.9	I531 I532 L533 A538 L539	I531-S535 VanDerWaalsContact O-CB 3.25Å; I531-S535 WeakPolarHBondContact O-CB 3.45Å; I531-S535 PolarHBondContact O-N 3.27Å; I531-S535 PolarHBondContact O-OG 3.07Å; I532-S535 PolarHBondContact O-N 3.12Å; L533-S535 VanDerWaalsContact C-N 3.33Å; L533-S535 PolarHBondContact O-N 3.01Å; S535-A538 PolarHBondContact O-N 2.66Å; S535-L539 WeakPolarHBondContact O-CB 3.24Å; S535-L539 PolarHBondContact O-N 3.35Å
536	V	77.3	Confident	77.1	Confident	21 Å²	21	32 Å²	32	13%	0.127	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-43.4	175.2	172.6	0	0	0	0	110.6	L498 I532 L533 W534 A538 L539 L540 M574	L498-V536 HydrophobicContact CB-CG1 4.33Å; I532-V536 WeakPolarHBondContact O-CG2 3.15Å; I532-V536 PolarHBondContact O-N 3.02Å; L533-V536 PolarHBondContact O-N 3.16Å; W534-V536 PolarHBondContact O-N 3.03Å; V536-A538 VanDerWaalsContact C-N 3.26Å; V536-A538 PolarHBondContact O-N 3.04Å; V536-L539 PolarHBondContact O-N 2.86Å; V536-L540 HydrophobicContact CG1-CD1 3.69Å; V536-L540 HydrophobicContact CG1-CG 4.22Å; V536-L540 WeakPolarHBondContact O-CG 3.44Å; V536-L540 PolarHBondContact O-N 3.48Å; V536-M574 HydrophobicContact CG1-CE 4.27Å; V536-M574 HydrophobicContact CG1-SD 4.04Å
537	S	78.1	Confident	78.5	Confident	2 Å²	2	30 Å²	30	1%	0.014	16%	0.161	C	C	.	.	H	α-helix	trans	-64.2	-28.9	176.2	78.5	0	0	0	0	113.3	L533 W534 P541 Y680	L533-S537 VanDerWaalsContact O-CB 3.27Å; L533-S537 WeakPolarHBondContact O-CB 3.2Å; L533-S537 PolarHBondContact O-N 2.94Å; L533-S537 PolarHBondContact O-OG 3.27Å; W534-S537 WeakPolarHBondContact CA-OG 3.33Å; W534-S537 PolarHBondContact O-N 3.24Å; W534-S537 PolarHBondContact O-OG 3.49Å; S537-P541 WeakPolarHBondContact O-CD 3.32Å; S537-P541 WeakPolarHBondContact O-CG 3Å; S537-Y680 PolarHBondContact OG-OH 2.97Å
538	A	81.2	Confident	79.5	Confident	14 Å²	14	29.5 Å²	29.5	12%	0.116	16%	0.158	C	C	.	.	H	α-helix	trans	-78.8	-31.6	174.6	0	0	0	0	0	112.6	W534 S535 V536 Y542 W734	W534-A538 HydrophobicContact CZ2-CB 4.44Å; W534-A538 WeakPolarHBondContact O-CB 3.14Å; W534-A538 PolarHBondContact O-N 3.41Å; S535-A538 PolarHBondContact O-N 2.66Å; V536-A538 VanDerWaalsContact C-N 3.26Å; V536-A538 PolarHBondContact O-N 3.04Å; A538-Y542 WeakPolarHBondContact O-CD2 3.08Å; A538-Y542 WeakPolarHBondContact O-CE2 3.33Å; A538-W734 HydrophobicContact CB-CH2 3.51Å; A538-W734 HydrophobicContact CB-CZ2 3.99Å; A538-W734 HydrophobicContact CB-CZ3 4.36Å
539	L	82.7	Confident	80.4	Confident	91 Å²	91	34 Å²	34	48%	0.476	17%	0.172	S	C	.	.	H	α-helix	trans	-80.4	-42.3	-179	-179.7	61.8	0	0	0	113.2	S535 V536 P541 Y542 I543	S535-L539 WeakPolarHBondContact O-CB 3.24Å; S535-L539 PolarHBondContact O-N 3.35Å; V536-L539 PolarHBondContact O-N 2.86Å; L539-P541 VanDerWaalsContact C-CD 3.47Å; L539-Y542 PolarHBondContact O-N 3.23Å; L539-I543 HydrophobicContact CD1-CG1 4.49Å; L539-I543 HydrophobicContact CD2-CD1 4.2Å; L539-I543 HydrophobicContact CG-CD1 3.88Å; L539-I543 HydrophobicContact CG-CG1 4.22Å; L539-I543 PolarHBondContact O-N 3.06Å; L539-I543 VanDerWaalsContact O-N 3.13Å
540	L	82.2	Confident	81.5	Confident	1 Å²	1	37 Å²	37	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-54.6	-41.1	-176.3	-76.8	165.3	0	0	0	114.9	V495 L498 V536 Y542 I543 V544 L570 L571 M574	V495-L540 HydrophobicContact CG2-CD2 4Å; L498-L540 HydrophobicContact CD1-CD2 3.97Å; V536-L540 HydrophobicContact CG1-CD1 3.69Å; V536-L540 HydrophobicContact CG1-CG 4.22Å; V536-L540 WeakPolarHBondContact O-CG 3.44Å; V536-L540 PolarHBondContact O-N 3.48Å; L540-Y542 VanDerWaalsContact C-N 3.29Å; L540-Y542 PolarHBondContact O-N 2.9Å; L540-I543 HydrophobicContact CD2-CD1 4.32Å; L540-I543 WeakPolarHBondContact O-CB 3.07Å; L540-I543 PolarHBondContact O-N 3.11Å; L540-I543 VanDerWaalsContact O-N 3.09Å; L540-V544 WeakPolarHBondContact O-CG2 3.35Å; L540-V544 PolarHBondContact O-N 3.06Å; L540-L570 HydrophobicContact CD2-CD2 4.4Å; L540-L571 HydrophobicContact CB-CD2 4.48Å; L540-M574 HydrophobicContact CD1-CE 3.56Å; L540-M574 HydrophobicContact CD1-SD 3.27Å; L540-M574 WeakPolarHBondContact CD1-SD 3.32Å
541	P	83.3	Confident	82.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-55.7	-41.7	174.6	-27.2	36.3	0	0	0	112.7	S537 L539 V544 F545 T567 L571 L730 W734	S537-P541 WeakPolarHBondContact O-CD 3.32Å; S537-P541 WeakPolarHBondContact O-CG 3Å; L539-P541 VanDerWaalsContact C-CD 3.47Å; P541-V544 PolarHBondContact O-N 3.3Å; P541-F545 WeakPolarHBondContact O-CB 3.44Å; P541-F545 PolarHBondContact O-N 2.79Å; P541-T567 HydrophobicContact CB-CG2 3.88Å; P541-T567 HydrophobicContact CG-CG2 4.17Å; P541-L571 HydrophobicContact CG-CD1 4.14Å; P541-L571 HydrophobicContact CG-CD2 4.12Å; P541-L730 VanDerWaalsContact C-CD1 3.43Å; P541-L730 HydrophobicContact CB-CD1 3.36Å; P541-L730 HydrophobicContact CB-CG 4.43Å; P541-L730 VanDerWaalsContact O-CD1 3.23Å; P541-L730 WeakPolarHBondContact O-CD1 3.25Å; P541-W734 HydrophobicContact CB-CE3 4.36Å; P541-W734 HydrophobicContact CG-CE3 4.07Å
542	Y	84.8	Confident	83.2	Confident	57 Å²	57	33 Å²	33	22%	0.224	17%	0.165	C	C	.	.	H	α-helix	trans	-71.9	-31.7	176.8	-62.2	-76.6	0	0	0	112.8	A538 L539 L540 N546 L730 W734	A538-Y542 WeakPolarHBondContact O-CD2 3.08Å; A538-Y542 WeakPolarHBondContact O-CE2 3.33Å; L539-Y542 PolarHBondContact O-N 3.23Å; L540-Y542 VanDerWaalsContact C-N 3.29Å; L540-Y542 PolarHBondContact O-N 2.9Å; Y542-N546 WeakPolarHBondContact O-CB 3.3Å; Y542-N546 PolarHBondContact O-N 2.72Å; Y542-N546 PolarHBondContact O-ND2 3.19Å; Y542-L730 HydrophobicContact CD1-CD2 4Å; Y542-L730 HydrophobicContact CE1-CD2 3.81Å; Y542-W734 HydrophobicContact CE2-CZ3 4.12Å
543	I	86.7	Confident	84	Confident	42 Å²	42	31.8 Å²	31.8	22%	0.215	16%	0.158	C	C	.	.	H	α-helix	trans	-62.6	-51.1	172.1	-66	174.2	0	0	0	109.6	V494 L498 L539 L540 N546 S547	V494-I543 HydrophobicContact CG1-CD1 4.29Å; L498-I543 HydrophobicContact CD1-CD1 3.92Å; L539-I543 HydrophobicContact CD1-CG1 4.49Å; L539-I543 HydrophobicContact CD2-CD1 4.2Å; L539-I543 HydrophobicContact CG-CD1 3.88Å; L539-I543 HydrophobicContact CG-CG1 4.22Å; L539-I543 PolarHBondContact O-N 3.06Å; L539-I543 VanDerWaalsContact O-N 3.13Å; L540-I543 HydrophobicContact CD2-CD1 4.32Å; L540-I543 WeakPolarHBondContact O-CB 3.07Å; L540-I543 PolarHBondContact O-N 3.11Å; L540-I543 VanDerWaalsContact O-N 3.09Å; I543-N546 PolarHBondContact O-N 2.91Å; I543-S547 WeakPolarHBondContact O-CB 3.47Å; I543-S547 PolarHBondContact O-N 2.99Å
544	V	87.1	Confident	84.8	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.024	17%	0.174	C	C	.	.	H	α-helix	trans	-60.5	-50.1	178.7	177.9	0	0	0	0	111	L540 P541 N546 S547 D548 K566 T567 L570	L540-V544 WeakPolarHBondContact O-CG2 3.35Å; L540-V544 PolarHBondContact O-N 3.06Å; P541-V544 PolarHBondContact O-N 3.3Å; V544-N546 PolarHBondContact O-N 2.97Å; V544-S547 WeakPolarHBondContact O-CB 3.34Å; V544-S547 PolarHBondContact O-N 3.5Å; V544-S547 PolarHBondContact O-OG 2.99Å; V544-D548 PolarHBondContact O-N 3.03Å; V544-K566 HydrophobicContact CG1-CB 3.71Å; V544-K566 HydrophobicContact CG1-CD 4.41Å; V544-T567 WeakPolarHBondContact CG1-OG1 3.4Å; V544-L570 HydrophobicContact CG2-CD2 3.66Å
545	F	87.6	Confident	85.3	Confident	18 Å²	18	34.9 Å²	34.9	8%	0.079	17%	0.171	C	C	.	.	H	α-helix	trans	-57.8	-44.7	178.4	172.5	-96.2	0	0	0	113.2	P541 S547 D548 R549 V563 Q727 L730	P541-F545 WeakPolarHBondContact O-CB 3.44Å; P541-F545 PolarHBondContact O-N 2.79Å; F545-S547 VanDerWaalsContact C-N 3.3Å; F545-S547 PolarHBondContact O-N 2.81Å; F545-D548 PolarHBondContact O-N 3.3Å; F545-R549 WeakPolarHBondContact O-CB 3.5Å; F545-R549 PolarHBondContact O-N 2.84Å; F545-V563 HydrophobicContact CB-CG1 4.18Å; F545-V563 HydrophobicContact CD2-CG1 4.16Å; F545-V563 HydrophobicContact CD2-CG2 4.01Å; F545-Q727 VanDerWaalsContact CE1-OE1 3.27Å; F545-Q727 HydrophobicContact CE2-CG 4.21Å; F545-Q727 HydrophobicContact CZ-CG 4.16Å; F545-Q727 VanDerWaalsContact CZ-OE1 3.31Å; F545-L730 HydrophobicContact CB-CD1 4.14Å
546	N	87.5	Confident	85.6	Confident	62 Å²	62	34.3 Å²	34.3	33%	0.332	16%	0.162	S	C	.	.	H	α-helix	trans	-67	-33.7	177.2	-81	-77.2	0	0	0	111.9	Y542 I543 V544 R549 L550	Y542-N546 WeakPolarHBondContact O-CB 3.3Å; Y542-N546 PolarHBondContact O-N 2.72Å; Y542-N546 PolarHBondContact O-ND2 3.19Å; I543-N546 PolarHBondContact O-N 2.91Å; V544-N546 PolarHBondContact O-N 2.97Å; N546-R549 PolarHBondContact O-N 2.77Å; N546-R549 PolarHBondContact OD1-NH2 3.41Å; N546-L550 VanDerWaalsContact O-CG 3.27Å; N546-L550 WeakPolarHBondContact O-CG 3.4Å; N546-L550 PolarHBondContact O-N 2.72Å
547	S	91.2	Very high	86	Confident	7 Å²	7	33.8 Å²	33.8	5%	0.049	16%	0.159	C	C	.	.	H	α-helix	trans	-62.9	-49.7	175.1	84.7	0	0	0	0	112.3	I543 V544 F545 R549 L550 V551	I543-S547 WeakPolarHBondContact O-CB 3.47Å; I543-S547 PolarHBondContact O-N 2.99Å; V544-S547 WeakPolarHBondContact O-CB 3.34Å; V544-S547 PolarHBondContact O-N 3.5Å; V544-S547 PolarHBondContact O-OG 2.99Å; F545-S547 VanDerWaalsContact C-N 3.3Å; F545-S547 PolarHBondContact O-N 2.81Å; S547-R549 VanDerWaalsContact C-N 3.3Å; S547-R549 PolarHBondContact O-N 3.38Å; S547-L550 CarbonylContact O-C 3.57Å; S547-L550 WeakPolarHBondContact O-CA 3.5Å; S547-L550 WeakPolarHBondContact O-CB 3.46Å; S547-L550 PolarHBondContact O-N 3.47Å; S547-V551 WeakPolarHBondContact O-CG2 3.4Å; S547-V551 PolarHBondContact O-N 3.39Å
548	D	90.2	Very high	86.4	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.011	17%	0.168	C	C	.	.	H	α-helix	trans	-67.1	-32.5	179.3	-76	-54.3	0	0	0	112.1	V544 F545 L550 V551 G552 H553 L559 V563 K566	V544-D548 PolarHBondContact O-N 3.03Å; F545-D548 PolarHBondContact O-N 3.3Å; D548-L550 VanDerWaalsContact C-N 3.27Å; D548-L550 PolarHBondContact O-N 2.88Å; D548-V551 WeakPolarHBondContact O-CB 3.31Å; D548-V551 PolarHBondContact O-N 2.95Å; D548-G552 PolarHBondContact O-N 3.01Å; D548-H553 IonicContact OD1-NE2 3.78Å; D548-L559 HydrophobicContact CB-CD1 3.74Å; D548-V563 HydrophobicContact CB-CG2 3.58Å; D548-K566 WeakPolarHBondContact OD1-CD 3.44Å; D548-K566 WeakPolarHBondContact OD1-CE 3.31Å; D548-K566 IonicContact OD1-NZ 2.81Å; D548-K566 PolarHBondContact OD1-NZ 3.38Å; D548-K566 WeakPolarHBondContact OD2-CD 3.18Å; D548-K566 IonicContact OD2-NZ 3.24Å
549	R	87.7	Confident	86.8	Confident	140 Å²	140	35.3 Å²	35.3	53%	0.528	17%	0.167	S	C	.	.	H	α-helix	trans	-63.3	-34.6	170	-164.8	179.9	66.8	161.9	-3.9	111.8	F545 N546 S547	F545-R549 WeakPolarHBondContact O-CB 3.5Å; F545-R549 PolarHBondContact O-N 2.84Å; N546-R549 PolarHBondContact O-N 2.77Å; N546-R549 PolarHBondContact OD1-NH2 3.41Å; S547-R549 VanDerWaalsContact C-N 3.3Å; S547-R549 PolarHBondContact O-N 3.38Å
550	L	88.7	Confident	87.2	Confident	103 Å²	103	31.5 Å²	31.5	54%	0.539	15%	0.146	S	C	.	.	H	α-helix	trans	-77.2	-25.6	174.2	-70.8	169.3	0	0	0	113.4	R483 I487 N546 S547 D548 G552	R483-L550 PolarHBondContact NE-O 2.73Å; R483-L550 PolarHBondContact NH2-O 2.91Å; I487-L550 HydrophobicContact CD1-CB 3.69Å; I487-L550 VanDerWaalsContact CD1-O 3.29Å; I487-L550 WeakPolarHBondContact CD1-O 3.39Å; N546-L550 VanDerWaalsContact O-CG 3.27Å; N546-L550 WeakPolarHBondContact O-CG 3.4Å; N546-L550 PolarHBondContact O-N 2.72Å; S547-L550 CarbonylContact O-C 3.57Å; S547-L550 WeakPolarHBondContact O-CA 3.5Å; S547-L550 WeakPolarHBondContact O-CB 3.46Å; S547-L550 PolarHBondContact O-N 3.47Å; D548-L550 VanDerWaalsContact C-N 3.27Å; D548-L550 PolarHBondContact O-N 2.88Å; L550-G552 VanDerWaalsContact C-N 3.26Å; L550-G552 PolarHBondContact O-N 3.3Å
551	V	89.8	Confident	87.6	Confident	3 Å²	3	33 Å²	33	2%	0.018	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-39.8	169.2	175.9	0	0	0	0	110.1	W480 R483 A484 I487 S547 D548	W480-V551 HydrophobicContact CZ2-CG1 3.8Å; R483-V551 PolarHBondContact NE-O 2.8Å; A484-V551 HydrophobicContact CB-CG1 3.86Å; I487-V551 HydrophobicContact CB-CG2 4.18Å; I487-V551 HydrophobicContact CD1-CG2 4.09Å; I487-V551 HydrophobicContact CG2-CG2 4.08Å; S547-V551 WeakPolarHBondContact O-CG2 3.4Å; S547-V551 PolarHBondContact O-N 3.39Å; D548-V551 WeakPolarHBondContact O-CB 3.31Å; D548-V551 PolarHBondContact O-N 2.95Å
552	G	86	Confident	87.9	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.01	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	57.2	169.3	0	0	0	0	0	113.6	N472 D548 L550	N472-G552 WeakPolarHBondContact CB-O 3.43Å; N472-G552 VanDerWaalsContact ND2-CA 3.35Å; N472-G552 WeakPolarHBondContact ND2-CA 3.37Å; D548-G552 PolarHBondContact O-N 3.01Å; L550-G552 VanDerWaalsContact C-N 3.26Å; L550-G552 PolarHBondContact O-N 3.3Å
553	H	87.7	Confident	88.3	Confident	15 Å²	15	32 Å²	32	7%	0.069	15%	0.154	C	C	.	.			trans	-59.4	143.8	169.2	-64.8	-86.3	0	0	0	111.8	I469 N472 W480 D548 L559 T562	I469-H553 WeakPolarHBondContact CD1-O 3.41Å; N472-H553 VanDerWaalsContact CB-O 3.31Å; N472-H553 WeakPolarHBondContact CB-O 3.22Å; N472-H553 PolarHBondContact ND2-O 3.46Å; W480-H553 AromaticContact CZ2-CE1 3.81Å; D548-H553 IonicContact OD1-NE2 3.78Å; H553-L559 HydrophobicContact CB-CB 4.11Å; H553-T562 PolarHBondContact NE2-OG1 3.48Å
554	W	86.6	Confident	88.6	Confident	89 Å²	89	30 Å²	30	34%	0.337	14%	0.144	S	C	.	.	S	Bend	trans	-91.3	-6.6	-178.1	68.2	-88.4	0	0	0	114.1	M220 P463 I469 N472 L473	M220-W554 HydrophobicContact CE-CE3 4.21Å; M220-W554 HydrophobicContact CE-CH2 3.83Å; M220-W554 HydrophobicContact CE-CZ3 3.61Å; M220-W554 HydrophobicContact SD-CH2 3.75Å; M220-W554 HydrophobicContact SD-CZ3 3.65Å; P463-W554 HydrophobicContact CG-CZ3 4.1Å; I469-W554 PolarHBondContact N-O 3.24Å; N472-W554 HydrophobicContact CB-CB 4.42Å; L473-W554 HydrophobicContact CD1-CB 4.44Å; L473-W554 HydrophobicContact CD1-CD2 4.34Å; L473-W554 HydrophobicContact CD1-CE3 3.84Å
555	T	85.6	Confident	88.8	Confident	9 Å²	9	33.2 Å²	33.2	6%	0.055	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-126.6	148	166.8	60	0	0	0	0	111.7	P463 N467 V558 L559	P463-T555 HydrophobicContact CG-CG2 4.39Å; N467-T555 CarbonylContact O-C 3.49Å; N467-T555 VanDerWaalsContact O-CA 3.24Å; N467-T555 WeakPolarHBondContact O-CA 3.43Å; T555-V558 WeakPolarHBondContact OG1-CB 3.23Å; T555-V558 VanDerWaalsContact OG1-CG2 3.28Å; T555-V558 WeakPolarHBondContact OG1-CG2 3.42Å; T555-V558 PolarHBondContact OG1-N 3.47Å; T555-L559 PolarHBondContact O-N 3.16Å
556	K	85.4	Confident	89	Confident	39 Å²	39	35.4 Å²	35.4	17%	0.17	17%	0.169	C	C	.	.	H	α-helix	trans	-67.5	-40.1	174.5	-63	-179.7	-179.8	175.5	0	111.6	S466 N467 I469 V558 L559 H560 E725	S466-K556 WeakPolarHBondContact O-CD 3.36Å; S466-K556 WeakPolarHBondContact O-CE 3.37Å; S466-K556 PolarHBondContact O-NZ 2.97Å; N467-K556 PolarHBondContact O-N 2.92Å; N467-K556 WeakPolarHBondContact OD1-CB 3.42Å; N467-K556 PolarHBondContact OD1-N 3.18Å; I469-K556 HydrophobicContact CD1-CG 3.93Å; I469-K556 HydrophobicContact CG1-CG 3.75Å; K556-V558 VanDerWaalsContact C-N 3.34Å; K556-V558 PolarHBondContact O-N 3.24Å; K556-L559 WeakPolarHBondContact O-CB 3.47Å; K556-L559 PolarHBondContact O-N 3Å; K556-H560 PolarHBondContact O-CD2 2.91Å; K556-H560 PolarHBondContact O-N 3.25Å; K556-E725 WeakPolarHBondContact CE-OE2 3.43Å; K556-E725 IonicContact NZ-OE1 2.9Å; K556-E725 PolarHBondContact NZ-OE1 3.13Å; K556-E725 IonicContact NZ-OE2 3.14Å; K556-E725 PolarHBondContact NZ-OE2 2.88Å
557	S	86	Confident	89.2	Confident	10 Å²	10	32.5 Å²	32.5	7%	0.07	15%	0.154	C	C	.	.	H	α-helix	trans	-57.2	-45.1	178.7	-60.5	0	0	0	0	112.5	N467 L561 D781	N467-S557 PolarHBondContact ND2-OG 3.1Å; N467-S557 PolarHBondContact OD1-N 3Å; N467-S557 PolarHBondContact OD1-OG 3.23Å; S557-L561 WeakPolarHBondContact O-CB 3.43Å; S557-L561 PolarHBondContact O-N 3.47Å; S557-D781 WeakPolarHBondContact OG-CB 3.34Å; S557-D781 PolarHBondContact OG-N 3.12Å; S557-D781 VanDerWaalsContact OG-N 3.13Å
558	V	86.6	Confident	89.2	Confident	34 Å²	34	33 Å²	33	21%	0.206	16%	0.155	C	C	.	.	H	α-helix	trans	-69.7	-39.5	177.3	177.2	0	0	0	0	110.8	T555 K556 H560 L561 T562	T555-V558 WeakPolarHBondContact OG1-CB 3.23Å; T555-V558 VanDerWaalsContact OG1-CG2 3.28Å; T555-V558 WeakPolarHBondContact OG1-CG2 3.42Å; T555-V558 PolarHBondContact OG1-N 3.47Å; K556-V558 VanDerWaalsContact C-N 3.34Å; K556-V558 PolarHBondContact O-N 3.24Å; V558-H560 PolarHBondContact O-N 3.41Å; V558-L561 PolarHBondContact O-N 3.02Å; V558-T562 HydrophobicContact CG1-CG2 4.2Å; V558-T562 PolarHBondContact O-N 3.29Å; V558-T562 PolarHBondContact O-OG1 3.04Å; V558-T562 VanDerWaalsContact O-OG1 3.07Å
559	L	89.8	Confident	89.2	Confident	15 Å²	15	37 Å²	37	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-56.8	-48.5	174.7	175.7	63.1	0	0	0	112.1	I469 D548 H553 T555 K556 L561 T562 V563	I469-L559 HydrophobicContact CD1-CD2 4.17Å; D548-L559 HydrophobicContact CB-CD1 3.74Å; H553-L559 HydrophobicContact CB-CB 4.11Å; T555-L559 PolarHBondContact O-N 3.16Å; K556-L559 WeakPolarHBondContact O-CB 3.47Å; K556-L559 PolarHBondContact O-N 3Å; L559-L561 VanDerWaalsContact C-N 3.34Å; L559-L561 PolarHBondContact O-N 3.18Å; L559-T562 PolarHBondContact O-OG1 3.19Å; L559-V563 HydrophobicContact CD1-CG2 4.1Å; L559-V563 WeakPolarHBondContact O-CB 3.48Å; L559-V563 WeakPolarHBondContact O-CG2 3.26Å; L559-V563 PolarHBondContact O-N 3.19Å
560	H	90.6	Very high	89.2	Confident	10 Å²	10	31.5 Å²	31.5	5%	0.046	16%	0.16	C	C	.	.	H	α-helix	trans	-69.3	-32.7	179	-67.8	-64.9	0	0	0	112.4	K556 V558 M564 G729 I780 I784	K556-H560 PolarHBondContact O-CD2 2.91Å; K556-H560 PolarHBondContact O-N 3.25Å; V558-H560 PolarHBondContact O-N 3.41Å; H560-M564 VanDerWaalsContact O-CB 3.24Å; H560-M564 WeakPolarHBondContact O-CB 3.46Å; H560-M564 PolarHBondContact O-N 3.13Å; H560-G729 WeakPolarHBondContact O-CA 3.08Å; H560-I780 HydrophobicContact CB-CD1 4.49Å; H560-I780 WeakPolarHBondContact CD2-CD1 3.14Å; H560-I784 HydrophobicContact CB-CD1 3.86Å
561	L	90.3	Very high	89.2	Confident	33 Å²	33	26.8 Å²	26.8	17%	0.173	14%	0.136	C	C	.	.	H	α-helix	trans	-67.1	-46.3	174.9	-167.1	76.4	0	0	0	111.9	S557 V558 L559 M564 I565 H783 L787	S557-L561 WeakPolarHBondContact O-CB 3.43Å; S557-L561 PolarHBondContact O-N 3.47Å; V558-L561 PolarHBondContact O-N 3.02Å; L559-L561 VanDerWaalsContact C-N 3.34Å; L559-L561 PolarHBondContact O-N 3.18Å; L561-M564 PolarHBondContact O-N 3.05Å; L561-I565 HydrophobicContact CG-CD1 4.4Å; L561-I565 WeakPolarHBondContact O-CG1 3.09Å; L561-I565 PolarHBondContact O-N 3.43Å; L561-I565 VanDerWaalsContact O-N 3.08Å; L561-H783 HydrophobicContact CD1-CB 4.46Å; L561-L787 HydrophobicContact CD1-CB 4.13Å; L561-L787 HydrophobicContact CD1-CD2 3.63Å; L561-L787 HydrophobicContact CD1-CG 4.49Å; L561-L787 HydrophobicContact CG-CD2 4.36Å
562	T	90.6	Very high	89.1	Confident	36 Å²	36	27.4 Å²	27.4	22%	0.221	14%	0.139	C	C	.	.	H	α-helix	trans	-68.3	-42.6	179.9	51.7	0	0	0	0	112.1	H553 V558 L559 M564 I565 K566	H553-T562 PolarHBondContact NE2-OG1 3.48Å; V558-T562 HydrophobicContact CG1-CG2 4.2Å; V558-T562 PolarHBondContact O-N 3.29Å; V558-T562 PolarHBondContact O-OG1 3.04Å; V558-T562 VanDerWaalsContact O-OG1 3.07Å; L559-T562 PolarHBondContact O-OG1 3.19Å; T562-M564 VanDerWaalsContact C-N 3.3Å; T562-M564 PolarHBondContact O-N 3.37Å; T562-I565 PolarHBondContact O-N 3.44Å; T562-K566 WeakPolarHBondContact O-CB 3.07Å; T562-K566 WeakPolarHBondContact O-CG 3.23Å; T562-K566 PolarHBondContact O-N 2.87Å
563	V	92	Very high	88.9	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-57	-44.9	172.1	168.2	0	0	0	0	110.8	F545 D548 L559 T567	F545-V563 HydrophobicContact CB-CG1 4.18Å; F545-V563 HydrophobicContact CD2-CG1 4.16Å; F545-V563 HydrophobicContact CD2-CG2 4.01Å; D548-V563 HydrophobicContact CB-CG2 3.58Å; L559-V563 HydrophobicContact CD1-CG2 4.1Å; L559-V563 WeakPolarHBondContact O-CB 3.48Å; L559-V563 WeakPolarHBondContact O-CG2 3.26Å; L559-V563 PolarHBondContact O-N 3.19Å; V563-T567 WeakPolarHBondContact O-CB 3.2Å; V563-T567 PolarHBondContact O-N 3.4Å; V563-T567 PolarHBondContact O-OG1 3.23Å
564	M	93.3	Very high	88.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.8	-48.8	-178.8	-175.8	172	173.2	0	0	112	H560 L561 T562 Y568 G729 Y732 A733 L736 I784 L787 A788	H560-M564 VanDerWaalsContact O-CB 3.24Å; H560-M564 WeakPolarHBondContact O-CB 3.46Å; H560-M564 PolarHBondContact O-N 3.13Å; L561-M564 PolarHBondContact O-N 3.05Å; T562-M564 VanDerWaalsContact C-N 3.3Å; T562-M564 PolarHBondContact O-N 3.37Å; M564-Y568 WeakPolarHBondContact O-CB 3.32Å; M564-Y568 PolarHBondContact O-N 2.82Å; M564-G729 WeakPolarHBondContact CA-O 3.47Å; M564-G729 WeakPolarHBondContact CB-O 3.17Å; M564-Y732 HydrophobicContact CE-CG 4.15Å; M564-Y732 HydrophobicContact SD-CD2 4.16Å; M564-Y732 HydrophobicContact SD-CG 4.19Å; M564-A733 HydrophobicContact CG-CB 4.39Å; M564-L736 HydrophobicContact CE-CD1 3.56Å; M564-I784 HydrophobicContact SD-CG1 3.86Å; M564-L787 HydrophobicContact CB-CD2 3.97Å; M564-L787 HydrophobicContact CE-CD2 4.3Å; M564-L787 HydrophobicContact CE-CG 4.09Å; M564-L787 HydrophobicContact CG-CD2 3.77Å; M564-L787 HydrophobicContact SD-CB 4.45Å; M564-L787 HydrophobicContact SD-CD2 3.7Å; M564-L787 HydrophobicContact SD-CG 4.07Å; M564-A788 HydrophobicContact CE-CB 3.87Å
565	I	91.9	Very high	88.3	Confident	71 Å²	71	26.5 Å²	26.5	36%	0.364	14%	0.14	S	C	.	.	H	α-helix	trans	-59.8	-55.1	178.3	-64.1	171	0	0	0	110	L561 T562 T567 Y568 T569 L787	L561-I565 HydrophobicContact CG-CD1 4.4Å; L561-I565 WeakPolarHBondContact O-CG1 3.09Å; L561-I565 PolarHBondContact O-N 3.43Å; L561-I565 VanDerWaalsContact O-N 3.08Å; T562-I565 PolarHBondContact O-N 3.44Å; I565-T567 PolarHBondContact O-N 3.26Å; I565-Y568 PolarHBondContact O-N 3.41Å; I565-T569 WeakPolarHBondContact O-CB 3.4Å; I565-T569 PolarHBondContact O-N 2.93Å; I565-T569 PolarHBondContact O-OG1 3.48Å; I565-T569 VanDerWaalsContact O-OG1 3.1Å; I565-L787 HydrophobicContact CD1-CD2 4.21Å; I565-L787 HydrophobicContact CG1-CD1 4.09Å; I565-L787 HydrophobicContact CG1-CD2 3.49Å; I565-L787 VanDerWaalsContact CG1-CD2 3.49Å; I565-L787 HydrophobicContact CG1-CG 4.45Å
566	K	91.6	Very high	88	Confident	64 Å²	64	26.2 Å²	26.2	28%	0.278	14%	0.139	S	C	.	.	H	α-helix	trans	-59.5	-46.3	-177.4	-76.7	172.6	152.5	-164.3	0	112.5	N488 V544 D548 T562 L570	N488-K566 PolarHBondContact OD1-NZ 3.16Å; V544-K566 HydrophobicContact CG1-CB 3.71Å; V544-K566 HydrophobicContact CG1-CD 4.41Å; D548-K566 WeakPolarHBondContact OD1-CD 3.44Å; D548-K566 WeakPolarHBondContact OD1-CE 3.31Å; D548-K566 IonicContact OD1-NZ 2.81Å; D548-K566 PolarHBondContact OD1-NZ 3.38Å; D548-K566 WeakPolarHBondContact OD2-CD 3.18Å; D548-K566 IonicContact OD2-NZ 3.24Å; T562-K566 WeakPolarHBondContact O-CB 3.07Å; T562-K566 WeakPolarHBondContact O-CG 3.23Å; T562-K566 PolarHBondContact O-N 2.87Å; K566-L570 WeakPolarHBondContact O-CB 3.23Å; K566-L570 PolarHBondContact O-N 3.33Å
567	T	91.3	Very high	87.8	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-67.6	-46.2	-178.1	-54	0	0	0	0	110.5	P541 V544 V563 I565 L570 L571 A733	P541-T567 HydrophobicContact CB-CG2 3.88Å; P541-T567 HydrophobicContact CG-CG2 4.17Å; V544-T567 WeakPolarHBondContact CG1-OG1 3.4Å; V563-T567 WeakPolarHBondContact O-CB 3.2Å; V563-T567 PolarHBondContact O-N 3.4Å; V563-T567 PolarHBondContact O-OG1 3.23Å; I565-T567 PolarHBondContact O-N 3.26Å; T567-L570 PolarHBondContact O-N 2.84Å; T567-L571 HydrophobicContact CG2-CD1 3.76Å; T567-L571 HydrophobicContact CG2-CG 4.13Å; T567-L571 WeakPolarHBondContact O-CB 3.17Å; T567-L571 WeakPolarHBondContact O-CG 3.44Å; T567-L571 PolarHBondContact O-N 3.44Å; T567-A733 HydrophobicContact CG2-CB 3.68Å
568	Y	92.1	Very high	87.2	Confident	18 Å²	18	27.9 Å²	27.9	7%	0.071	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-49.9	178.4	177.7	-100.1	0	0	0	111.4	M564 I565 L570 L571 I572 L736 C791 S795	M564-Y568 WeakPolarHBondContact O-CB 3.32Å; M564-Y568 PolarHBondContact O-N 2.82Å; I565-Y568 PolarHBondContact O-N 3.41Å; Y568-L570 VanDerWaalsContact C-N 3.33Å; Y568-L570 PolarHBondContact O-N 3.46Å; Y568-L571 PolarHBondContact O-N 2.85Å; Y568-I572 HydrophobicContact CD1-CG1 4.29Å; Y568-I572 HydrophobicContact CD2-CG1 4.11Å; Y568-I572 HydrophobicContact CE1-CG1 3.98Å; Y568-I572 HydrophobicContact CE2-CD1 3.86Å; Y568-I572 HydrophobicContact CE2-CG1 3.78Å; Y568-I572 HydrophobicContact CG-CG1 4.35Å; Y568-I572 WeakPolarHBondContact O-CB 3.37Å; Y568-I572 WeakPolarHBondContact O-CG1 3.25Å; Y568-I572 PolarHBondContact O-N 3.11Å; Y568-L736 HydrophobicContact CD2-CB 3.93Å; Y568-L736 HydrophobicContact CE2-CB 3.9Å; Y568-C791 HydrophobicContact CD1-CB 4.32Å; Y568-C791 HydrophobicContact CD2-CB 4.4Å; Y568-C791 HydrophobicContact CE1-CB 4.08Å; Y568-C791 HydrophobicContact CE2-CB 4.16Å; Y568-C791 HydrophobicContact CG-CB 4.48Å; Y568-C791 PolarHBondContact OH-O 3.02Å; Y568-C791 VanDerWaalsContact OH-O 3.08Å; Y568-S795 PolarHBondContact OH-OG 3.26Å; Y568-S795 VanDerWaalsContact OH-OG 3.05Å
569	T	90.4	Very high	86.4	Confident	86 Å²	86	27.1 Å²	27.1	53%	0.528	15%	0.146	S	C	.	.	H	α-helix	trans	-59.5	-42.5	178	-61.4	0	0	0	0	112.1	I565 L573	I565-T569 WeakPolarHBondContact O-CB 3.4Å; I565-T569 PolarHBondContact O-N 2.93Å; I565-T569 PolarHBondContact O-OG1 3.48Å; I565-T569 VanDerWaalsContact O-OG1 3.1Å; T569-L573 WeakPolarHBondContact O-CB 3.47Å; T569-L573 PolarHBondContact O-N 3.11Å; T569-L573 VanDerWaalsContact O-N 3.07Å
570	L	87.3	Confident	85.5	Confident	24 Å²	24	26.8 Å²	26.8	13%	0.126	14%	0.144	C	C	.	.	H	α-helix	trans	-66.4	-47.4	178.7	175.4	58.7	0	0	0	112.6	V495 L540 V544 K566 T567 Y568 L573 M574	V495-L570 HydrophobicContact CG1-CD1 3.48Å; V495-L570 VanDerWaalsContact CG1-CD1 3.48Å; V495-L570 HydrophobicContact CG1-CD2 4.32Å; V495-L570 HydrophobicContact CG2-CD2 3.85Å; L540-L570 HydrophobicContact CD2-CD2 4.4Å; V544-L570 HydrophobicContact CG2-CD2 3.66Å; K566-L570 WeakPolarHBondContact O-CB 3.23Å; K566-L570 PolarHBondContact O-N 3.33Å; T567-L570 PolarHBondContact O-N 2.84Å; Y568-L570 VanDerWaalsContact C-N 3.33Å; Y568-L570 PolarHBondContact O-N 3.46Å; L570-L573 PolarHBondContact O-N 3.18Å; L570-M574 PolarHBondContact O-N 2.69Å
571	L	88.4	Confident	84.4	Confident	4 Å²	4	29 Å²	29	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-65.4	-40.8	-179.4	-66.2	174.4	0	0	0	111.2	L540 P541 T567 Y568 L573 M574 I575 C737	L540-L571 HydrophobicContact CB-CD2 4.48Å; P541-L571 HydrophobicContact CG-CD1 4.14Å; P541-L571 HydrophobicContact CG-CD2 4.12Å; T567-L571 HydrophobicContact CG2-CD1 3.76Å; T567-L571 HydrophobicContact CG2-CG 4.13Å; T567-L571 WeakPolarHBondContact O-CB 3.17Å; T567-L571 WeakPolarHBondContact O-CG 3.44Å; T567-L571 PolarHBondContact O-N 3.44Å; Y568-L571 PolarHBondContact O-N 2.85Å; L571-L573 PolarHBondContact O-N 3.44Å; L571-M574 PolarHBondContact O-N 3.19Å; L571-I575 HydrophobicContact CB-CD1 4.12Å; L571-I575 HydrophobicContact CD2-CD1 3.98Å; L571-I575 WeakPolarHBondContact O-CB 3.49Å; L571-I575 VanDerWaalsContact O-CG1 3.31Å; L571-I575 WeakPolarHBondContact O-CG1 3.44Å; L571-I575 PolarHBondContact O-N 3.38Å; L571-C737 HydrophobicContact CB-CB 3.84Å; L571-C737 WeakPolarHBondContact CB-SG 3.39Å; L571-C737 HydrophobicContact CD1-CB 3.91Å
572	I	88	Confident	83	Confident	16 Å²	16	29.3 Å²	29.3	8%	0.082	17%	0.168	C	C	.	.	I	π-helix	trans	-60.9	-44.5	174.9	-67.4	-71	0	0	0	110.9	Y568 L576 V577 A740 L798	Y568-I572 HydrophobicContact CD1-CG1 4.29Å; Y568-I572 HydrophobicContact CD2-CG1 4.11Å; Y568-I572 HydrophobicContact CE1-CG1 3.98Å; Y568-I572 HydrophobicContact CE2-CD1 3.86Å; Y568-I572 HydrophobicContact CE2-CG1 3.78Å; Y568-I572 HydrophobicContact CG-CG1 4.35Å; Y568-I572 WeakPolarHBondContact O-CB 3.37Å; Y568-I572 WeakPolarHBondContact O-CG1 3.25Å; Y568-I572 PolarHBondContact O-N 3.11Å; I572-L576 WeakPolarHBondContact O-CB 3.35Å; I572-L576 PolarHBondContact O-N 3.04Å; I572-V577 HydrophobicContact CG2-CG2 4.13Å; I572-V577 PolarHBondContact O-N 2.85Å; I572-A740 HydrophobicContact CD1-CB 3.32Å; I572-L798 HydrophobicContact CD1-CD1 4.47Å; I572-L798 HydrophobicContact CG2-CD1 4.06Å
573	L	82.5	Confident	81.5	Confident	83 Å²	83	28.1 Å²	28.1	44%	0.435	16%	0.16	S	C	.	.	I	π-helix	trans	-61.3	-49.2	178	-179.8	62.2	0	0	0	111.8	T569 L570 L571 V577 L578	T569-L573 WeakPolarHBondContact O-CB 3.47Å; T569-L573 PolarHBondContact O-N 3.11Å; T569-L573 VanDerWaalsContact O-N 3.07Å; L570-L573 PolarHBondContact O-N 3.18Å; L571-L573 PolarHBondContact O-N 3.44Å; L573-V577 HydrophobicContact CD1-CB 4.27Å; L573-V577 HydrophobicContact CD1-CG1 4.3Å; L573-L578 HydrophobicContact CD1-CD1 4.5Å; L573-L578 HydrophobicContact CD1-CG 4.15Å; L573-L578 HydrophobicContact CG-CD1 4.25Å; L573-L578 HydrophobicContact CG-CG 4.38Å; L573-L578 WeakPolarHBondContact O-CG 3.27Å; L573-L578 PolarHBondContact O-N 3.5Å
574	M	79.4	Confident	79.8	Confident	3 Å²	3	29.9 Å²	29.9	2%	0.015	17%	0.171	C	C	.	.	I	π-helix	trans	-75.1	-43	-176.1	-172.9	-167.2	72.6	0	0	113.6	T499 L533 V536 L540 L570 L571 P579	T499-M574 HydrophobicContact CG2-CB 4.12Å; T499-M574 HydrophobicContact CG2-CG 3.86Å; T499-M574 HydrophobicContact CG2-SD 4.1Å; L533-M574 HydrophobicContact CD1-CE 3.97Å; V536-M574 HydrophobicContact CG1-CE 4.27Å; V536-M574 HydrophobicContact CG1-SD 4.04Å; L540-M574 HydrophobicContact CD1-CE 3.56Å; L540-M574 HydrophobicContact CD1-SD 3.27Å; L540-M574 WeakPolarHBondContact CD1-SD 3.32Å; L570-M574 PolarHBondContact O-N 2.69Å; L571-M574 PolarHBondContact O-N 3.19Å; M574-P579 WeakPolarHBondContact O-CD 3.27Å; M574-P579 WeakPolarHBondContact O-CG 3.04Å
575	I	80.8	Confident	78	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.182	C	C	.	.	I	π-helix	trans	-88	-39.3	-169.9	-57.7	174.5	0	0	0	110.7	L571 P579 F677 Y680 V741	L571-I575 HydrophobicContact CB-CD1 4.12Å; L571-I575 HydrophobicContact CD2-CD1 3.98Å; L571-I575 WeakPolarHBondContact O-CB 3.49Å; L571-I575 VanDerWaalsContact O-CG1 3.31Å; L571-I575 WeakPolarHBondContact O-CG1 3.44Å; L571-I575 PolarHBondContact O-N 3.38Å; I575-P579 WeakPolarHBondContact O-CG 3.4Å; I575-F677 HydrophobicContact CG2-CE1 4.04Å; I575-F677 WeakPolarHBondContact O-CE1 3.37Å; I575-F677 WeakPolarHBondContact O-CZ 3.47Å; I575-Y680 HydrophobicContact CG2-CE1 4.4Å; I575-V741 HydrophobicContact CG2-CG2 3.79Å
576	L	80.5	Confident	76.2	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.016	18%	0.18	C	C	.	.	I	π-helix	trans	-102.8	-54.9	-174.8	-177.2	60.8	0	0	0	112.2	I572 S580 A744 Y745 L798	I572-L576 WeakPolarHBondContact O-CB 3.35Å; I572-L576 PolarHBondContact O-N 3.04Å; L576-S580 WeakPolarHBondContact O-CB 3.18Å; L576-S580 PolarHBondContact O-N 2.92Å; L576-S580 VanDerWaalsContact O-N 3.12Å; L576-S580 PolarHBondContact O-OG 3.3Å; L576-A744 HydrophobicContact CD1-CB 3.74Å; L576-A744 HydrophobicContact CD2-CB 3.72Å; L576-A744 HydrophobicContact CG-CB 4.39Å; L576-Y745 HydrophobicContact CD1-CD2 4.34Å; L576-Y745 HydrophobicContact CD1-CE2 3.63Å; L576-L798 HydrophobicContact CD2-CD1 4.19Å
577	V	79.5	Confident	74.6	Confident	50 Å²	50	32.3 Å²	32.3	30%	0.303	19%	0.194	S	C	.	.	I	π-helix	trans	-72.8	-56.3	-167.4	-180	0	0	0	0	112.4	I572 L573 S580 L581	I572-V577 HydrophobicContact CG2-CG2 4.13Å; I572-V577 PolarHBondContact O-N 2.85Å; L573-V577 HydrophobicContact CD1-CB 4.27Å; L573-V577 HydrophobicContact CD1-CG1 4.3Å; V577-S580 PolarHBondContact O-N 3.06Å; V577-L581 HydrophobicContact CG1-CD1 3.8Å; V577-L581 HydrophobicContact CG1-CG 4.47Å; V577-L581 WeakPolarHBondContact O-CG 3.48Å; V577-L581 PolarHBondContact O-N 2.9Å
578	L	74.1	Confident	73.1	Confident	33 Å²	33	33.5 Å²	33.5	17%	0.173	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-40.5	-177.4	-69.9	171.5	0	0	0	113.2	L573 G582 L583	L573-L578 HydrophobicContact CD1-CD1 4.5Å; L573-L578 HydrophobicContact CD1-CG 4.15Å; L573-L578 HydrophobicContact CG-CD1 4.25Å; L573-L578 HydrophobicContact CG-CG 4.38Å; L573-L578 WeakPolarHBondContact O-CG 3.27Å; L573-L578 PolarHBondContact O-N 3.5Å; L578-G582 PolarHBondContact O-N 3.35Å; L578-L583 HydrophobicContact CD2-CB 4.14Å; L578-L583 PolarHBondContact O-N 3.41Å; L578-L583 VanDerWaalsContact O-N 3.14Å
579	P	70	Confident	71.6	Confident	18 Å²	18	35 Å²	35	12%	0.117	21%	0.213	C	C	.	.	H	α-helix	trans	-69.5	-39.2	174.2	-23.7	37.8	0	0	0	113.6	M574 I575 L581 G582 T584 F677	M574-P579 WeakPolarHBondContact O-CD 3.27Å; M574-P579 WeakPolarHBondContact O-CG 3.04Å; I575-P579 WeakPolarHBondContact O-CG 3.4Å; P579-L581 VanDerWaalsContact C-N 3.26Å; P579-L581 PolarHBondContact O-N 3.34Å; P579-G582 PolarHBondContact O-N 3.27Å; P579-G582 VanDerWaalsContact O-N 3.08Å; P579-T584 HydrophobicContact CB-CG2 4.19Å; P579-T584 HydrophobicContact CG-CG2 4.33Å; P579-F677 HydrophobicContact CB-CZ 4.08Å
580	S	70.8	Confident	70.3	Confident	8 Å²	8	34.4 Å²	34.4	6%	0.056	21%	0.206	C	C	.	.	H	α-helix	trans	-61.5	-36.4	176.9	-62	0	0	0	0	112.2	L576 V577 G582 Y745	L576-S580 WeakPolarHBondContact O-CB 3.18Å; L576-S580 PolarHBondContact O-N 2.92Å; L576-S580 VanDerWaalsContact O-N 3.12Å; L576-S580 PolarHBondContact O-OG 3.3Å; V577-S580 PolarHBondContact O-N 3.06Å; S580-G582 VanDerWaalsContact C-N 3.32Å; S580-Y745 PolarHBondContact OG-OH 3.33Å; S580-Y745 VanDerWaalsContact OG-OH 3.14Å
581	L	67.5	Low	69.1	Low	57 Å²	57	37.4 Å²	37.4	30%	0.298	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.1	177	-64.6	174.8	0	0	0	113.9	V577 P579 L583 F663	V577-L581 HydrophobicContact CG1-CD1 3.8Å; V577-L581 HydrophobicContact CG1-CG 4.47Å; V577-L581 WeakPolarHBondContact O-CG 3.48Å; V577-L581 PolarHBondContact O-N 2.9Å; P579-L581 VanDerWaalsContact C-N 3.26Å; P579-L581 PolarHBondContact O-N 3.34Å; L581-L583 HydrophobicContact CB-CB 4.45Å; L581-L583 HydrophobicContact CB-CD1 4.12Å; L581-L583 HydrophobicContact CB-CG 3.94Å; L581-L583 HydrophobicContact CD1-CD1 4.18Å; L581-L583 PolarHBondContact O-N 2.71Å; L581-L583 VanDerWaalsContact O-N 3.08Å; L581-F663 WeakPolarHBondContact O-CE2 3.31Å; L581-F663 VanDerWaalsContact O-CZ 3.31Å; L581-F663 WeakPolarHBondContact O-CZ 3.27Å
582	G	60.5	Low	67.9	Low	40 Å²	40	42.9 Å²	42.9	41%	0.412	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	-2.7	-173.9	0	0	0	0	0	115.3	L578 P579 S580 T584	L578-G582 PolarHBondContact O-N 3.35Å; P579-G582 PolarHBondContact O-N 3.27Å; P579-G582 VanDerWaalsContact O-N 3.08Å; S580-G582 VanDerWaalsContact C-N 3.32Å; G582-T584 PolarHBondContact O-N 2.84Å
583	L	60.2	Low	67	Low	11 Å²	11	46.5 Å²	46.5	6%	0.058	26%	0.259	C	S	.	.			trans	-74.9	42.8	-178.7	-58.4	179.6	0	0	0	112.8	L578 L581 L589 W592 F663	L578-L583 HydrophobicContact CD2-CB 4.14Å; L578-L583 PolarHBondContact O-N 3.41Å; L578-L583 VanDerWaalsContact O-N 3.14Å; L581-L583 HydrophobicContact CB-CB 4.45Å; L581-L583 HydrophobicContact CB-CD1 4.12Å; L581-L583 HydrophobicContact CB-CG 3.94Å; L581-L583 HydrophobicContact CD1-CD1 4.18Å; L581-L583 PolarHBondContact O-N 2.71Å; L581-L583 VanDerWaalsContact O-N 3.08Å; L583-L589 HydrophobicContact CD1-CD1 4.38Å; L583-W592 HydrophobicContact CD1-CD2 4.01Å; L583-W592 HydrophobicContact CD1-CE3 4.25Å; L583-W592 HydrophobicContact CD1-CG 4.2Å; L583-W592 HydrophobicContact CD2-CB 3.73Å; L583-W592 HydrophobicContact CD2-CG 3.88Å; L583-F663 HydrophobicContact CD2-CE2 3.98Å
584	T	56	Low	66.5	Low	37 Å²	37	47.5 Å²	47.5	23%	0.227	26%	0.26	C	S	.	.			trans	-89.6	-0.9	-174.9	65.9	0	0	0	0	113.7	T500 T502 P579 G582	T500-T584 WeakPolarHBondContact CG2-O 3.33Å; T502-T584 VanDerWaalsContact CB-O 3.29Å; T502-T584 WeakPolarHBondContact CB-O 3.39Å; T502-T584 WeakPolarHBondContact OG1-CB 3.41Å; T502-T584 PolarHBondContact OG1-O 3.38Å; T502-T584 PolarHBondContact OG1-OG1 2.91Å; P579-T584 HydrophobicContact CB-CG2 4.19Å; P579-T584 HydrophobicContact CG-CG2 4.33Å; G582-T584 PolarHBondContact O-N 2.84Å
585	S	54.7	Low	65.6	Low	34 Å²	34	52 Å²	52	24%	0.238	29%	0.29	C	S	.	.	S	Bend	trans	-130.2	149.3	179.4	78	0	0	0	0	111.1	A588 L589	S585-A588 PolarHBondContact O-N 2.91Å; S585-A588 WeakPolarHBondContact OG-CB 3.19Å; S585-A588 PolarHBondContact OG-N 2.74Å; S585-L589 WeakPolarHBondContact O-CB 3.47Å; S585-L589 PolarHBondContact O-N 3.24Å
586	I	55.2	Low	64.7	Low	62 Å²	62	60.7 Å²	60.7	32%	0.318	33%	0.331	S	S	.	.	H	α-helix	trans	-60.4	-42.2	178	-65.6	173.3	0	0	0	111.9	F496 A588 L589 L590	F496-I586 HydrophobicContact CE1-CD1 4.47Å; I586-A588 PolarHBondContact O-N 2.87Å; I586-L589 PolarHBondContact O-N 3.04Å; I586-L590 HydrophobicContact CG2-CD1 3.71Å; I586-L590 HydrophobicContact CG2-CG 4.07Å; I586-L590 WeakPolarHBondContact O-CB 3.42Å; I586-L590 WeakPolarHBondContact O-CG 3.25Å; I586-L590 PolarHBondContact O-N 3.36Å
587	P	58	Low	63.2	Low	89 Å²	89	65.4 Å²	65.4	58%	0.578	35%	0.354	S	S	*	.	H	α-helix	trans	-58.3	-46.9	174.5	-27	36.5	0	0	0	113.3	L589 L590 Q591	P587-L589 VanDerWaalsContact C-N 3.33Å; P587-L589 PolarHBondContact O-N 3.5Å; P587-L590 PolarHBondContact O-N 3.27Å; P587-Q591 VanDerWaalsContact O-CB 3.25Å; P587-Q591 WeakPolarHBondContact O-CB 3.4Å; P587-Q591 PolarHBondContact O-N 3.32Å
588	A	58.3	Low	61.8	Low	26 Å²	26	69.8 Å²	69.8	22%	0.215	37%	0.371	C	S	.	.	H	α-helix	trans	-63.7	-39.2	178.4	0	0	0	0	0	112	S585 I586 W592	S585-A588 PolarHBondContact O-N 2.91Å; S585-A588 WeakPolarHBondContact OG-CB 3.19Å; S585-A588 PolarHBondContact OG-N 2.74Å; I586-A588 PolarHBondContact O-N 2.87Å; A588-W592 WeakPolarHBondContact O-CB 3.43Å; A588-W592 PolarHBondContact O-N 3.48Å
589	L	60.4	Low	60.3	Low	50 Å²	50	75.6 Å²	75.6	26%	0.262	40%	0.4	S	S	.	.	H	α-helix	trans	-67.2	-43	176.6	-178.2	62.4	0	0	0	112.5	L583 S585 I586 P587 W592 L593	L583-L589 HydrophobicContact CD1-CD1 4.38Å; S585-L589 WeakPolarHBondContact O-CB 3.47Å; S585-L589 PolarHBondContact O-N 3.24Å; I586-L589 PolarHBondContact O-N 3.04Å; P587-L589 VanDerWaalsContact C-N 3.33Å; P587-L589 PolarHBondContact O-N 3.5Å; L589-W592 HydrophobicContact CD1-CE3 4.45Å; L589-W592 PolarHBondContact O-N 2.96Å; L589-L593 HydrophobicContact CD1-CD1 3.9Å; L589-L593 HydrophobicContact CG-CD1 4.03Å; L589-L593 WeakPolarHBondContact O-CB 3.31Å; L589-L593 PolarHBondContact O-N 3.45Å
590	L	63.3	Low	59	Low	73 Å²	73	80.9 Å²	80.9	38%	0.382	43%	0.426	S	S	.	.	H	α-helix	trans	-67.7	-42.1	177.4	-73.5	175.8	0	0	0	111.8	I586 P587 W592 L593 F594	I586-L590 HydrophobicContact CG2-CD1 3.71Å; I586-L590 HydrophobicContact CG2-CG 4.07Å; I586-L590 WeakPolarHBondContact O-CB 3.42Å; I586-L590 WeakPolarHBondContact O-CG 3.25Å; I586-L590 PolarHBondContact O-N 3.36Å; P587-L590 PolarHBondContact O-N 3.27Å; L590-W592 VanDerWaalsContact C-N 3.28Å; L590-W592 PolarHBondContact O-N 3.34Å; L590-L593 PolarHBondContact O-N 3.49Å; L590-F594 HydrophobicContact CD2-CD2 4.19Å; L590-F594 HydrophobicContact CD2-CE2 4.25Å; L590-F594 WeakPolarHBondContact O-CA 3.34Å; L590-F594 WeakPolarHBondContact O-CB 3.34Å; L590-F594 PolarHBondContact O-N 3.31Å
591	Q	63.3	Low	57.3	Low	88 Å²	88	85.6 Å²	85.6	41%	0.411	46%	0.456	S	S	.	.	H	α-helix	trans	-67.1	-30	176.8	-165.4	-172.4	0.7	0	0	112.2	P587 P595 Q661	P587-Q591 VanDerWaalsContact O-CB 3.25Å; P587-Q591 WeakPolarHBondContact O-CB 3.4Å; P587-Q591 PolarHBondContact O-N 3.32Å; Q591-P595 VanDerWaalsContact O-CA 3.22Å; Q591-P595 WeakPolarHBondContact O-CA 3.37Å; Q591-Q661 PolarHBondContact NE2-O 3.33Å
592	W	62	Low	55.9	Low	119 Å²	119	90.6 Å²	90.6	45%	0.451	48%	0.483	S	S	.	.	H	α-helix	trans	-75.3	-39.2	173.6	-180	87.7	0	0	0	112.9	L583 A588 L589 L590	L583-W592 HydrophobicContact CD1-CD2 4.01Å; L583-W592 HydrophobicContact CD1-CE3 4.25Å; L583-W592 HydrophobicContact CD1-CG 4.2Å; L583-W592 HydrophobicContact CD2-CB 3.73Å; L583-W592 HydrophobicContact CD2-CG 3.88Å; A588-W592 WeakPolarHBondContact O-CB 3.43Å; A588-W592 PolarHBondContact O-N 3.48Å; L589-W592 HydrophobicContact CD1-CE3 4.45Å; L589-W592 PolarHBondContact O-N 2.96Å; L590-W592 VanDerWaalsContact C-N 3.28Å; L590-W592 PolarHBondContact O-N 3.34Å
593	L	70.2	Confident	54.9	Low	91 Å²	91	94.1 Å²	94.1	48%	0.476	50%	0.496	S	S	.	.	H	α-helix	trans	-75.1	-33.4	176.1	-95.1	147.6	0	0	0	113.5	L589 L590	L589-L593 HydrophobicContact CD1-CD1 3.9Å; L589-L593 HydrophobicContact CG-CD1 4.03Å; L589-L593 WeakPolarHBondContact O-CB 3.31Å; L589-L593 PolarHBondContact O-N 3.45Å; L590-L593 PolarHBondContact O-N 3.49Å
594	F	72.6	Confident	53.7	Low	104 Å²	104	98.8 Å²	98.8	46%	0.456	53%	0.527	S	S	.	.			trans	-139	70.1	-172.3	-51.2	-73.9	0	0	0	110.3	L590 E596 M597	L590-F594 HydrophobicContact CD2-CD2 4.19Å; L590-F594 HydrophobicContact CD2-CE2 4.25Å; L590-F594 WeakPolarHBondContact O-CA 3.34Å; L590-F594 WeakPolarHBondContact O-CB 3.34Å; L590-F594 PolarHBondContact O-N 3.31Å; F594-E596 PolarHBondContact O-N 2.95Å; F594-M597 HydrophobicContact CB-CB 3.84Å; F594-M597 HydrophobicContact CB-CE 3.74Å; F594-M597 HydrophobicContact CD1-CE 4.26Å; F594-M597 HydrophobicContact CD2-CE 3.6Å; F594-M597 HydrophobicContact CE2-CE 4.23Å; F594-M597 HydrophobicContact CG-CE 3.62Å; F594-M597 WeakPolarHBondContact O-CB 3.1Å; F594-M597 PolarHBondContact O-N 3.29Å
595	P	60.2	Low	52.6	Low	99 Å²	99	101.7 Å²	101.7	64%	0.643	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-19.1	-176.1	23.9	-34.7	0	0	0	114.3	Q591	Q591-P595 VanDerWaalsContact O-CA 3.22Å; Q591-P595 WeakPolarHBondContact O-CA 3.37Å
596	E	60.4	Low	51.8	Low	183 Å²	183	106.2 Å²	106.2	86%	0.855	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-5.8	175.8	-61	-175.2	173.5	0	0	113.8	F594 H598	F594-E596 PolarHBondContact O-N 2.95Å; E596-H598 PolarHBondContact O-N 2.88Å
597	M	50.8	Low	50.9	Low	101 Å²	101	110.2 Å²	110.2	50%	0.498	60%	0.598	S	S	.	*			trans	-79	65.8	-176.8	-161.7	-170.2	-59.9	0	0	112.6	F594	F594-M597 HydrophobicContact CB-CB 3.84Å; F594-M597 HydrophobicContact CB-CE 3.74Å; F594-M597 HydrophobicContact CD1-CE 4.26Å; F594-M597 HydrophobicContact CD2-CE 3.6Å; F594-M597 HydrophobicContact CE2-CE 4.23Å; F594-M597 HydrophobicContact CG-CE 3.62Å; F594-M597 WeakPolarHBondContact O-CB 3.1Å; F594-M597 PolarHBondContact O-N 3.29Å
598	H	50	Low	49.9	Very low	143 Å²	143	112 Å²	112	66%	0.662	61%	0.607	S	S	*	*			trans	-60.5	161.6	152.2	-73	-98.6	0	0	0	109.9	E596	E596-H598 PolarHBondContact O-N 2.88Å
599	I	42.6	Very low	48.9	Very low	155 Å²	155	116.3 Å²	116.3	80%	0.795	64%	0.636	S	S	*	*			trans	78.5	69.8	178.5	-39.5	160.1	0	0	0	115.5
600	I	41.5	Very low	47.7	Very low	128 Å²	128	123.1 Å²	123.1	66%	0.656	66%	0.663	S	S	*	*			trans	-138.6	100.3	132.7	-53.9	-178	0	0	0	109	L602	I600-L602 HydrophobicContact CG2-CD2 4.35Å; I600-L602 HydrophobicContact CG2-CG 4.35Å; I600-L602 PolarHBondContact O-N 3.48Å
601	P	35.7	Very low	46.4	Very low	107 Å²	107	126.8 Å²	126.8	70%	0.695	68%	0.682	S	S	*	*			trans	-78.2	111.1	171.5	-6.7	23.9	0	0	0	110.4	V603	P601-V603 PolarHBondContact O-N 3.41Å; P601-V603 VanDerWaalsContact O-N 3.09Å
602	L	38.7	Very low	45.1	Very low	163 Å²	163	128.4 Å²	128.4	85%	0.853	70%	0.698	S	S	*	*	S	Bend	trans	-84.2	52.1	176.9	-74	171.2	0	0	0	113	I600	I600-L602 HydrophobicContact CG2-CD2 4.35Å; I600-L602 HydrophobicContact CG2-CG 4.35Å; I600-L602 PolarHBondContact O-N 3.48Å
603	V	38.5	Very low	43.7	Very low	114 Å²	114	130.1 Å²	130.1	69%	0.691	72%	0.716	S	S	*	*	S	Bend	trans	-167.7	141.5	160.5	133.6	0	0	0	0	109.3	P601	P601-V603 PolarHBondContact O-N 3.41Å; P601-V603 VanDerWaalsContact O-N 3.09Å
604	P	35.3	Very low	42.1	Very low	109 Å²	109	133.6 Å²	133.6	71%	0.708	73%	0.733	S	S	*	*			trans	-72.5	126.5	171.6	-13.4	29.1	0	0	0	111.6	N606	P604-N606 VanDerWaalsContact C-N 3.3Å; P604-N606 PolarHBondContact O-N 3.03Å
605	A	33.9	Very low	40.3	Very low	98 Å²	98	134.1 Å²	134.1	81%	0.81	75%	0.75	S	S	*	*			trans	-80.9	62.6	-174.4	0	0	0	0	0	114.1
606	N	37.3	Very low	39.3	Very low	129 Å²	129	134.1 Å²	134.1	69%	0.69	75%	0.752	S	S	*	*			trans	-100.5	146	174.6	-70.1	-4.6	0	0	0	111.7	P604	P604-N606 VanDerWaalsContact C-N 3.3Å; P604-N606 PolarHBondContact O-N 3.03Å
607	N	35.2	Very low	38.2	Very low	146 Å²	146	133 Å²	133	78%	0.781	75%	0.75	S	S	*	*	S	Bend	trans	87.3	-3.6	172.8	-54.9	-11.4	0	0	0	119.8	S609	N607-S609 VanDerWaalsContact C-N 3.33Å; N607-S609 PolarHBondContact O-N 3.33Å
608	V	37.3	Very low	37.4	Very low	126 Å²	126	132 Å²	132	76%	0.764	76%	0.758	S	S	*	*			trans	-74.7	-19.9	179.9	-177.5	0	0	0	0	113.4	K610	V608-K610 PolarHBondContact O-N 2.91Å
609	S	37.3	Very low	36.6	Very low	116 Å²	116	132.2 Å²	132.2	81%	0.811	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	27.4	-172.1	54.5	0	0	0	0	116.4	N607	N607-S609 VanDerWaalsContact C-N 3.33Å; N607-S609 PolarHBondContact O-N 3.33Å
610	K	35.4	Very low	36.2	Very low	193 Å²	193	131 Å²	131	84%	0.839	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.6	9.3	-173.5	-128.6	-178.6	-175.5	-176	0	117.5	V608	V608-K610 PolarHBondContact O-N 2.91Å
611	I	35.9	Very low	36	Very low	150 Å²	150	131 Å²	131	77%	0.769	77%	0.77	S	S	*	*	S	Bend	trans	-114.3	-11.3	-174.3	-66.2	178.2	0	0	0	113.2	N613	I611-N613 PolarHBondContact O-N 2.9Å
612	T	35.4	Very low	36.1	Very low	122 Å²	122	129.9 Å²	129.9	75%	0.748	77%	0.765	S	S	*	*	S	Bend	trans	-92.3	17.1	-171.4	40.9	0	0	0	0	116.3
613	N	34.2	Very low	36	Very low	155 Å²	155	128.6 Å²	128.6	83%	0.829	76%	0.759	S	S	*	*			trans	-133.2	43.2	-173.4	-95.1	-5.8	0	0	0	114.5	I611	I611-N613 PolarHBondContact O-N 2.9Å
614	I	35.5	Very low	36	Very low	164 Å²	164	129.5 Å²	129.5	84%	0.841	76%	0.76	S	S	*	*			trans	-135.3	86.5	165.8	-50.8	179.9	0	0	0	109.7
615	S	35.3	Very low	36.1	Very low	115 Å²	115	130.1 Å²	130.1	80%	0.804	76%	0.757	S	S	*	*			trans	-144.4	42.3	178.1	52.3	0	0	0	0	112.8
616	S	38.8	Very low	36.4	Very low	99 Å²	99	131.3 Å²	131.3	69%	0.692	75%	0.75	S	S	*	*			trans	-164.9	168.5	165.6	53	0	0	0	0	112.1
617	I	37.1	Very low	36.3	Very low	159 Å²	159	135.5 Å²	135.5	82%	0.815	76%	0.758	S	S	*	*			trans	83.3	108.5	167.7	-53.7	169	0	0	0	117.2
618	A	35.2	Very low	36.4	Very low	80 Å²	80	135.7 Å²	135.7	66%	0.661	76%	0.759	S	S	*	*			trans	48.2	121.6	149.5	0	0	0	0	0	120.4
619	N	31.5	Very low	36.3	Very low	148 Å²	148	133.4 Å²	133.4	79%	0.791	75%	0.753	S	S	*	*				76.3	140.2	59.4	-75	-9.5	0	0	0	115.3
620	T	36.1	Very low	36.2	Very low	131 Å²	131	134.3 Å²	134.3	80%	0.804	75%	0.754	S	S	*	*			trans	63.4	140.8	172.3	58.5	0	0	0	0	115.8
621	T	36.8	Very low	36.1	Very low	126 Å²	126	131.1 Å²	131.1	77%	0.773	75%	0.751	S	S	*	*			cis	-170.3	161.4	-7.3	19.8	0	0	0	0	106.6
622	S	37.4	Very low	36	Very low	84 Å²	84	134.9 Å²	134.9	59%	0.587	76%	0.757	S	S	*	*			cis	-176	166.5	-9	47.6	0	0	0	0	109.1
623	N	36.9	Very low	36	Very low	137 Å²	137	135.8 Å²	135.8	73%	0.733	76%	0.757	S	S	*	*			trans	71.3	154.7	166.5	-51	-13.9	0	0	0	116
624	N	38.4	Very low	36.2	Very low	132 Å²	132	135 Å²	135	71%	0.706	75%	0.753	S	S	*	*			cis	-162	176.2	-24.3	-111.5	5.9	0	0	0	111.1
625	D	37.9	Very low	36.3	Very low	123 Å²	123	132.3 Å²	132.3	66%	0.658	74%	0.744	S	S	*	*			trans	95.8	102.8	151.9	-61.9	-38.5	0	0	0	121.7
626	N	38.9	Very low	36.4	Very low	122 Å²	122	133.4 Å²	133.4	65%	0.652	74%	0.741	S	S	*	*				54.9	129.8	126.1	-43.1	-44.3	0	0	0	119.5
627	Y	35.8	Very low	36.3	Very low	217 Å²	217	136.8 Å²	136.8	85%	0.851	75%	0.751	S	S	*	*				-157.6	162.7	58.9	-109.2	-89.4	0	0	0	116.2
628	N	38.1	Very low	36.1	Very low	151 Å²	151	134.6 Å²	134.6	81%	0.807	75%	0.75	S	S	*	*			trans	-80.2	172.1	178.9	-70.3	-36.6	0	0	0	114
629	A	34.2	Very low	36.2	Very low	78 Å²	78	135.8 Å²	135.8	65%	0.645	75%	0.754	S	S	*	*			cis	-177.6	-162.7	-22.6	0	0	0	0	0	109.7
630	T	36.1	Very low	36.2	Very low	134 Å²	134	134.8 Å²	134.8	82%	0.822	75%	0.753	S	S	*	*			trans	87	121.8	177.9	71	0	0	0	0	116
631	T	33	Very low	35.9	Very low	126 Å²	126	137 Å²	137	77%	0.773	75%	0.752	S	S	*	*			cis	94.2	105.6	16.5	-49.3	0	0	0	0	115.9
632	Y	33.6	Very low	35.7	Very low	229 Å²	229	136.5 Å²	136.5	90%	0.898	75%	0.749	S	S	*	*			trans	-156.1	154.9	134.8	-122.5	-82.5	0	0	0	110.6
633	N	34.5	Very low	35.4	Very low	142 Å²	142	136.9 Å²	136.9	76%	0.759	75%	0.752	S	S	*	*			trans	-146.5	179.3	-168	-130.2	-7.1	0	0	0	111.4
634	N	39.2	Very low	35.2	Very low	139 Å²	139	135.8 Å²	135.8	74%	0.743	76%	0.755	S	S	*	*			trans	92.5	143.7	169	-55.8	-13.3	0	0	0	117.3
635	T	38.1	Very low	35	Very low	106 Å²	106	134.5 Å²	134.5	65%	0.65	76%	0.756	S	S	*	*			cis	-160.2	144.1	-15.1	18.8	0	0	0	0	112.1
636	N	36.9	Very low	34.8	Very low	139 Å²	139	133.9 Å²	133.9	74%	0.743	76%	0.761	S	S	*	*			trans	40.5	126.7	137.7	-51	-7.1	0	0	0	122.5
637	N	37.5	Very low	34.4	Very low	169 Å²	169	136 Å²	136	90%	0.904	77%	0.765	S	S	*	*				-156.7	159.6	116.8	-104.2	-27.2	0	0	0	110.7
638	S	32	Very low	34.3	Very low	114 Å²	114	135.2 Å²	135.2	80%	0.797	77%	0.766	S	S	*	*			trans	-144.8	139.3	-148.8	56.3	0	0	0	0	118
639	S	37	Very low	33.9	Very low	104 Å²	104	134.3 Å²	134.3	73%	0.727	76%	0.761	S	S	*	*			trans	-159.7	115.3	156.2	33.3	0	0	0	0	108.2
640	T	31.7	Very low	34	Very low	128 Å²	128	139.4 Å²	139.4	79%	0.785	77%	0.772	S	S	*	*				53.9	129.5	96.4	52.3	0	0	0	0	114.3
641	F	31.1	Very low	33.9	Very low	177 Å²	177	141.7 Å²	141.7	78%	0.776	77%	0.773	S	S	*	*			cis	-158.5	157	22.6	-150.6	-119.2	0	0	0	111.7
642	T	31.3	Very low	34	Very low	116 Å²	116	141.5 Å²	141.5	71%	0.712	77%	0.774	S	S	*	*			trans	57.9	147.8	166.3	44.2	0	0	0	0	120.7
643	S	32.2	Very low	33.7	Very low	92 Å²	92	135.1 Å²	135.1	64%	0.643	76%	0.763	S	S	*	*			cis	-174.8	138.2	-26.7	47.5	0	0	0	0	111
644	S	32.5	Very low	33.7	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	76%	0.762	S	S	*	*			trans	64.8	151.5	170.9	78.1	0	0	0	0	117.6
645	S	32.7	Very low	33.3	Very low	105 Å²	105	136.1 Å²	136.1	73%	0.734	77%	0.766	S	S	*	*			cis	-161.5	161.4	-23	-101.6	0	0	0	0	110.3
646	S	33.5	Very low	32.9	Very low	109 Å²	109	137.8 Å²	137.8	76%	0.762	77%	0.769	S	S	*	*			trans	47.2	100.2	164.2	58	0	0	0	0	118.4
647	K	32.2	Very low	32.6	Very low	167 Å²	167	136.5 Å²	136.5	73%	0.726	77%	0.769	S	S	*	*			trans	-76.5	139.9	143.7	-105.1	-170.2	159.7	-132.5	0	109.2	D649	K647-D649 IonicContact NZ-OD1 3.87Å; K647-D649 PolarHBondContact NZ-OD1 3.01Å; K647-D649 IonicContact NZ-OD2 2.66Å
648	F	32.1	Very low	32.6	Very low	201 Å²	201	135.3 Å²	135.3	88%	0.882	76%	0.761	S	S	*	*			trans	-129.4	126	151.6	-114.2	-94.4	0	0	0	105.6
649	D	30.6	Very low	32.8	Very low	132 Å²	132	132 Å²	132	71%	0.706	75%	0.745	S	S	*	*			trans	-89.5	111.5	174.4	-59.8	-70.3	0	0	0	107	K647	K647-D649 IonicContact NZ-OD1 3.87Å; K647-D649 PolarHBondContact NZ-OD1 3.01Å; K647-D649 IonicContact NZ-OD2 2.66Å
650	E	35.8	Very low	33	Very low	185 Å²	185	132.5 Å²	132.5	86%	0.864	75%	0.745	S	S	*	*			trans	-115.2	126.4	-173.7	-163.1	170.3	-136.6	0	0	110.5
651	E	33.6	Very low	33.6	Very low	182 Å²	182	132.7 Å²	132.7	85%	0.85	74%	0.737	S	S	*	*			trans	-77.4	133.9	-172.8	-167.8	173.9	-154.7	0	0	111.1	S653	E651-S653 PolarHBondContact O-N 2.89Å
652	P	35.5	Very low	34.1	Very low	122 Å²	122	127.7 Å²	127.7	79%	0.792	72%	0.724	S	S	*	*			trans	-73	95.9	-169.8	28.2	-35.3	0	0	0	112.5
653	S	28	Very low	34.9	Very low	95 Å²	95	125.3 Å²	125.3	66%	0.664	70%	0.704	S	S	*	*			trans	-58.4	138.8	173.9	65.9	0	0	0	0	112.3	E651 F655	E651-S653 PolarHBondContact O-N 2.89Å; S653-F655 PolarHBondContact O-N 2.81Å
654	P	34.7	Very low	35.8	Very low	114 Å²	114	124.2 Å²	124.2	74%	0.74	69%	0.689	S	S	*	*	S	Bend	trans	-83.9	28.6	-164.2	34.1	-38.2	0	0	0	115.1
655	F	30.4	Very low	37	Very low	187 Å²	187	125.4 Å²	125.4	82%	0.82	68%	0.676	S	S	*	*			trans	-140.7	85.2	-177.8	-73	-76.1	0	0	0	113.2	S653	S653-F655 PolarHBondContact O-N 2.81Å
656	I	29.9	Very low	37.8	Very low	141 Å²	141	126.8 Å²	126.8	72%	0.723	67%	0.671	S	S	*	*			trans	-86.2	124.8	161.6	-60.4	178.7	0	0	0	108	I658	I656-I658 PolarHBondContact O-N 3.02Å
657	P	31.3	Very low	38.7	Very low	113 Å²	113	123.3 Å²	123.3	73%	0.734	65%	0.646	S	S	*	*			trans	-66.7	132.1	176.4	27.4	-33.7	0	0	0	110.4	G659	P657-G659 VanDerWaalsContact C-N 3.31Å; P657-G659 PolarHBondContact O-N 2.98Å
658	I	35.8	Very low	39.9	Very low	144 Å²	144	116.2 Å²	116.2	74%	0.738	62%	0.617	S	S	*	*			trans	-73.1	89.2	176.2	-55.6	175.1	0	0	0	108.2	I656 Q661	I656-I658 PolarHBondContact O-N 3.02Å; I658-Q661 HydrophobicContact CG2-CG 4.08Å
659	G	37.7	Very low	41.1	Very low	45 Å²	45	107.8 Å²	107.8	46%	0.464	58%	0.58	S	S	.	*			trans	-58.3	163.3	162.2	0	0	0	0	0	110.8	P657 Q661	P657-G659 VanDerWaalsContact C-N 3.31Å; P657-G659 PolarHBondContact O-N 2.98Å; G659-Q661 PolarHBondContact O-N 3.07Å
660	P	40.4	Very low	42.4	Very low	113 Å²	113	104 Å²	104	73%	0.734	56%	0.558	S	S	*	*			trans	-59.8	104.1	-171.9	24.8	-34.4	0	0	0	110.9	S662	P660-S662 PolarHBondContact O-N 3.22Å
661	Q	43.6	Very low	43.2	Very low	133 Å²	133	96.6 Å²	96.6	62%	0.621	53%	0.527	S	S	*	.			trans	-72.1	74.7	171.8	-70.6	-173.8	-8.5	0	0	108.4	Q591 I658 G659 F663	Q591-Q661 PolarHBondContact NE2-O 3.33Å; I658-Q661 HydrophobicContact CG2-CG 4.08Å; G659-Q661 PolarHBondContact O-N 3.07Å; Q661-F663 PolarHBondContact O-N 3.22Å
662	S	42	Very low	44.5	Very low	72 Å²	72	91.1 Å²	91.1	50%	0.503	50%	0.503	S	S	.	.			trans	-53.1	139.3	174.1	53.6	0	0	0	0	109.6	P660 Q664	P660-S662 PolarHBondContact O-N 3.22Å; S662-Q664 VanDerWaalsContact C-N 3.3Å; S662-Q664 PolarHBondContact O-N 3.48Å; S662-Q664 PolarHBondContact OG-NE2 3.13Å
663	F	49.1	Very low	46.1	Very low	66 Å²	66	87.4 Å²	87.4	29%	0.289	48%	0.477	S	S	.	.			trans	-65.5	92.6	176.7	-178.7	-92.8	0	0	0	108.9	L581 L583 Q661 W665 V668	L581-F663 WeakPolarHBondContact O-CE2 3.31Å; L581-F663 VanDerWaalsContact O-CZ 3.31Å; L581-F663 WeakPolarHBondContact O-CZ 3.27Å; L583-F663 HydrophobicContact CD2-CE2 3.98Å; Q661-F663 PolarHBondContact O-N 3.22Å; F663-W665 HydrophobicContact CD1-CD2 4.07Å; F663-W665 AromaticContact CD1-CE2 3.88Å; F663-W665 HydrophobicContact CD1-CG 4.36Å; F663-W665 HydrophobicContact CD1-CZ2 4.24Å; F663-W665 AromaticContact CE1-CD2 3.78Å; F663-W665 HydrophobicContact CE1-CD2 3.78Å; F663-W665 AromaticContact CE1-CE2 3.88Å; F663-W665 AromaticContact CE1-CE3 3.83Å; F663-W665 HydrophobicContact CE1-CE3 3.83Å; F663-W665 HydrophobicContact CE1-CG 4.37Å; F663-W665 HydrophobicContact CE1-CH2 4.11Å; F663-W665 HydrophobicContact CE1-CZ2 4.06Å; F663-W665 HydrophobicContact CE1-CZ3 4Å; F663-W665 PolarHBondContact O-N 2.95Å; F663-V668 HydrophobicContact CE1-CG2 4.38Å; F663-V668 HydrophobicContact CZ-CG2 4.24Å
664	Q	51.1	Low	48.4	Very low	68 Å²	68	83.1 Å²	83.1	32%	0.318	45%	0.447	S	S	.	.			trans	-81.2	101.6	-175.3	-78.8	166.1	26.8	0	0	109.2	S662 E666 C667	S662-Q664 VanDerWaalsContact C-N 3.3Å; S662-Q664 PolarHBondContact O-N 3.48Å; S662-Q664 PolarHBondContact OG-NE2 3.13Å; Q664-E666 PolarHBondContact O-N 2.98Å; Q664-C667 WeakPolarHBondContact O-CB 3.48Å; Q664-C667 PolarHBondContact O-N 2.93Å
665	W	57	Low	50.5	Low	139 Å²	139	77.8 Å²	77.8	53%	0.527	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-52.7	-23.7	178.9	-68.7	95.8	0	0	0	113.7	F663 C667 V668 L809	F663-W665 HydrophobicContact CD1-CD2 4.07Å; F663-W665 AromaticContact CD1-CE2 3.88Å; F663-W665 HydrophobicContact CD1-CG 4.36Å; F663-W665 HydrophobicContact CD1-CZ2 4.24Å; F663-W665 AromaticContact CE1-CD2 3.78Å; F663-W665 HydrophobicContact CE1-CD2 3.78Å; F663-W665 AromaticContact CE1-CE2 3.88Å; F663-W665 AromaticContact CE1-CE3 3.83Å; F663-W665 HydrophobicContact CE1-CE3 3.83Å; F663-W665 HydrophobicContact CE1-CG 4.37Å; F663-W665 HydrophobicContact CE1-CH2 4.11Å; F663-W665 HydrophobicContact CE1-CZ2 4.06Å; F663-W665 HydrophobicContact CE1-CZ3 4Å; F663-W665 PolarHBondContact O-N 2.95Å; W665-C667 PolarHBondContact O-N 2.89Å; W665-V668 HydrophobicContact CE3-CG2 4.26Å; W665-V668 WeakPolarHBondContact O-CB 3.44Å; W665-V668 WeakPolarHBondContact O-CG2 3.24Å; W665-V668 PolarHBondContact O-N 3.17Å; W665-V668 VanDerWaalsContact O-N 3.07Å; W665-L809 HydrophobicContact CB-CD2 3.64Å; W665-L809 HydrophobicContact CE3-CD2 4.49Å
666	E	50.2	Low	52.7	Low	135 Å²	135	71.6 Å²	71.6	63%	0.631	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-60.1	-21.5	174.3	-62.9	174	-164.1	0	0	113.9	Q664	Q664-E666 PolarHBondContact O-N 2.98Å
667	C	50.7	Low	55.3	Low	35 Å²	35	64.9 Å²	64.9	24%	0.236	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-86.4	-6.9	175.8	-64.5	0	0	0	0	114	C7 Q664 W665 M670	C7-C667 VanDerWaalsContact SG-SG 3.69Å; Q664-C667 WeakPolarHBondContact O-CB 3.48Å; Q664-C667 PolarHBondContact O-N 2.93Å; W665-C667 PolarHBondContact O-N 2.89Å; C667-M670 HydrophobicContact CB-CE 4Å; C667-M670 WeakPolarHBondContact O-CG 3.33Å; C667-M670 PolarHBondContact O-N 2.72Å
668	V	58.3	Low	58	Low	19 Å²	19	59.5 Å²	59.5	12%	0.115	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	130.7	-179.8	-179.4	0	0	0	0	109.2	F663 W665 L809	F663-V668 HydrophobicContact CE1-CG2 4.38Å; F663-V668 HydrophobicContact CZ-CG2 4.24Å; W665-V668 HydrophobicContact CE3-CG2 4.26Å; W665-V668 WeakPolarHBondContact O-CB 3.44Å; W665-V668 WeakPolarHBondContact O-CG2 3.24Å; W665-V668 PolarHBondContact O-N 3.17Å; W665-V668 VanDerWaalsContact O-N 3.07Å; V668-L809 HydrophobicContact CB-CD1 3.93Å; V668-L809 HydrophobicContact CG1-CD1 4.24Å
669	F	56.9	Low	60.3	Low	23 Å²	23	53.5 Å²	53.5	10%	0.101	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	38.3	-169.3	-46.7	-74.6	0	0	0	116.8	N802 M805 F806 L809	F669-N802 HydrophobicContact CE1-CB 4.16Å; F669-N802 HydrophobicContact CZ-CB 4.2Å; F669-M805 HydrophobicContact CE2-CB 3.85Å; F669-M805 HydrophobicContact CZ-CB 4.24Å; F669-F806 HydrophobicContact CB-CD2 4.42Å; F669-F806 HydrophobicContact CD2-CB 4.4Å; F669-L809 HydrophobicContact CD2-CD1 4.16Å; F669-L809 HydrophobicContact CE2-CD1 4.31Å
670	M	57.8	Low	62.6	Low	52 Å²	52	51.5 Å²	51.5	26%	0.256	26%	0.264	S	S	.	.			trans	-49.7	144.3	162.9	-84.2	174.2	168.9	0	0	112.8	C667 D672 N673	C667-M670 HydrophobicContact CB-CE 4Å; C667-M670 WeakPolarHBondContact O-CG 3.33Å; C667-M670 PolarHBondContact O-N 2.72Å; M670-D672 PolarHBondContact O-N 3.46Å; M670-N673 WeakPolarHBondContact O-CB 3.33Å; M670-N673 PolarHBondContact O-N 3.38Å
671	P	54.2	Low	65.1	Low	31 Å²	31	46.1 Å²	46.1	20%	0.201	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-30.4	-175.7	24.2	-32.1	0	0	0	113.2	F164 N673 G674 A675	F164-P671 WeakPolarHBondContact CE1-O 3.46Å; P671-N673 PolarHBondContact O-N 3.41Å; P671-G674 WeakPolarHBondContact O-CA 3.41Å; P671-G674 PolarHBondContact O-N 2.89Å; P671-A675 PolarHBondContact O-N 2.82Å
672	D	59.7	Low	67.4	Low	66 Å²	66	39.8 Å²	39.8	35%	0.353	20%	0.2	S	C	.	.	H	α-helix	trans	-53.8	-39	178.1	-54.2	28.4	0	0	0	111.9	M670 G674 A675 F676	M670-D672 PolarHBondContact O-N 3.46Å; D672-G674 VanDerWaalsContact C-N 3.27Å; D672-G674 PolarHBondContact O-N 3.38Å; D672-A675 PolarHBondContact O-N 3.14Å; D672-F676 PolarHBondContact O-N 2.81Å
673	N	68.4	Low	69.7	Low	45 Å²	45	36.5 Å²	36.5	24%	0.241	18%	0.176	C	C	.	.	H	α-helix	trans	-60.3	-37.4	173.9	-73.8	-23.3	0	0	0	111.6	M670 P671 F676 F677	M670-N673 WeakPolarHBondContact O-CB 3.33Å; M670-N673 PolarHBondContact O-N 3.38Å; P671-N673 PolarHBondContact O-N 3.41Å; N673-F676 WeakPolarHBondContact O-CB 3.45Å; N673-F676 PolarHBondContact O-N 2.98Å; N673-F677 WeakPolarHBondContact O-CD2 3.26Å; N673-F677 PolarHBondContact O-N 3.22Å
674	G	77.1	Confident	71.7	Confident	4 Å²	4	33.4 Å²	33.4	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-42.6	176.4	0	0	0	0	0	112.4	P671 D672 F677 V678	P671-G674 WeakPolarHBondContact O-CA 3.41Å; P671-G674 PolarHBondContact O-N 2.89Å; D672-G674 VanDerWaalsContact C-N 3.27Å; D672-G674 PolarHBondContact O-N 3.38Å; G674-F677 PolarHBondContact O-N 3.42Å; G674-V678 WeakPolarHBondContact O-CG2 3.33Å; G674-V678 PolarHBondContact O-N 3.2Å
675	A	78	Confident	73.8	Confident	3 Å²	3	30.2 Å²	30.2	3%	0.025	15%	0.148	C	C	.	.	H	α-helix	trans	-66.2	-39.9	176.7	0	0	0	0	0	112.1	E24 I26 F164 P671 D672 F677 V678 N679	E24-A675 HydrophobicContact CB-CB 3.43Å; E24-A675 VanDerWaalsContact CB-CB 3.43Å; E24-A675 HydrophobicContact CG-CB 3.56Å; I26-A675 HydrophobicContact CD1-CB 4.21Å; F164-A675 HydrophobicContact CD1-CB 3.86Å; F164-A675 HydrophobicContact CD2-CB 4.42Å; F164-A675 HydrophobicContact CE1-CB 3.61Å; F164-A675 VanDerWaalsContact CE1-N 3.32Å; F164-A675 HydrophobicContact CE2-CB 4.19Å; F164-A675 HydrophobicContact CG-CB 4.25Å; F164-A675 VanDerWaalsContact CZ-CA 3.48Å; F164-A675 HydrophobicContact CZ-CB 3.76Å; F164-A675 VanDerWaalsContact CZ-N 3.34Å; P671-A675 PolarHBondContact O-N 2.82Å; D672-A675 PolarHBondContact O-N 3.14Å; A675-F677 PolarHBondContact O-N 3.22Å; A675-V678 PolarHBondContact O-N 2.85Å; A675-N679 WeakPolarHBondContact O-CB 3.49Å; A675-N679 PolarHBondContact O-N 2.93Å; A675-N679 PolarHBondContact O-ND2 3.11Å
676	F	77.2	Confident	75.5	Confident	56 Å²	56	24.4 Å²	24.4	25%	0.246	13%	0.127	C	C	.	.	H	α-helix	trans	-57.9	-45	173.9	-179.2	-102.8	0	0	0	112.1	P529 L533 D672 N673 N679 Y680	P529-F676 HydrophobicContact CB-CE2 4.49Å; L533-F676 HydrophobicContact CB-CZ 4.18Å; L533-F676 HydrophobicContact CD2-CE1 3.38Å; L533-F676 HydrophobicContact CD2-CZ 3.39Å; L533-F676 HydrophobicContact CG-CZ 4.4Å; D672-F676 PolarHBondContact O-N 2.81Å; N673-F676 WeakPolarHBondContact O-CB 3.45Å; N673-F676 PolarHBondContact O-N 2.98Å; F676-N679 PolarHBondContact O-N 3Å; F676-Y680 WeakPolarHBondContact O-CB 3.38Å; F676-Y680 PolarHBondContact O-N 3.16Å
677	F	84.1	Confident	77.5	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-71.3	-33.3	177.3	-72.3	-63.3	0	0	0	114.1	I575 P579 N673 G674 A675 Y680 V681 V741 Y745 I752	I575-F677 HydrophobicContact CG2-CE1 4.04Å; I575-F677 WeakPolarHBondContact O-CE1 3.37Å; I575-F677 WeakPolarHBondContact O-CZ 3.47Å; P579-F677 HydrophobicContact CB-CZ 4.08Å; N673-F677 WeakPolarHBondContact O-CD2 3.26Å; N673-F677 PolarHBondContact O-N 3.22Å; G674-F677 PolarHBondContact O-N 3.42Å; A675-F677 PolarHBondContact O-N 3.22Å; F677-Y680 PolarHBondContact O-N 3.03Å; F677-V681 WeakPolarHBondContact O-CG2 3.33Å; F677-V681 PolarHBondContact O-N 3.26Å; F677-V741 HydrophobicContact CB-CG1 3.99Å; F677-V741 HydrophobicContact CD1-CG1 3.59Å; F677-V741 HydrophobicContact CE1-CG1 4.4Å; F677-V741 HydrophobicContact CG-CG1 3.98Å; F677-Y745 HydrophobicContact CB-CD2 4.21Å; F677-Y745 HydrophobicContact CB-CE2 4.39Å; F677-Y745 AromaticContact CD2-CD2 3.84Å; F677-Y745 HydrophobicContact CD2-CD2 3.84Å; F677-Y745 HydrophobicContact CD2-CE1 4.13Å; F677-Y745 AromaticContact CD2-CE2 3.17Å; F677-Y745 HydrophobicContact CD2-CE2 3.17Å; F677-Y745 AromaticContact CD2-CZ 3.37Å; F677-Y745 AromaticContact CE2-CE2 3.49Å; F677-Y745 HydrophobicContact CE2-CE2 3.49Å; F677-Y745 VanDerWaalsContact CE2-CE2 3.49Å; F677-Y745 AromaticContact CE2-CZ 3.55Å; F677-Y745 VanDerWaalsContact CE2-OH 3.22Å; F677-Y745 WeakPolarHBondContact CE2-OH 3.36Å; F677-Y745 HydrophobicContact CG-CD2 4.07Å; F677-Y745 AromaticContact CG-CE2 3.79Å; F677-Y745 HydrophobicContact CG-CE2 3.79Å; F677-Y745 HydrophobicContact CZ-CE2 4.29Å; F677-I752 HydrophobicContact CB-CD1 3.92Å
678	V	88.5	Confident	79.4	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.4	-47.3	169	171.2	0	0	0	0	110.3	I26 G674 A675 Y680 V681 I682 L751 I752 F755	I26-V678 HydrophobicContact CD1-CB 4.31Å; I26-V678 HydrophobicContact CD1-CG1 3.99Å; I26-V678 HydrophobicContact CG1-CG1 4.22Å; I26-V678 HydrophobicContact CG2-CG1 3.92Å; G674-V678 WeakPolarHBondContact O-CG2 3.33Å; G674-V678 PolarHBondContact O-N 3.2Å; A675-V678 PolarHBondContact O-N 2.85Å; V678-Y680 PolarHBondContact O-N 3.41Å; V678-V681 PolarHBondContact O-N 3.26Å; V678-I682 HydrophobicContact CG1-CD1 3.88Å; V678-I682 WeakPolarHBondContact O-CG1 3.39Å; V678-I682 PolarHBondContact O-N 3.07Å; V678-L751 HydrophobicContact CG1-CD2 4.42Å; V678-I752 HydrophobicContact CG2-CB 3.96Å; V678-I752 HydrophobicContact CG2-CG1 4.21Å; V678-F755 HydrophobicContact CG1-CD2 3.89Å; V678-F755 HydrophobicContact CG1-CE2 4.05Å
679	N	85.2	Confident	81	Confident	18 Å²	18	17.2 Å²	17.2	10%	0.096	9%	0.091	C	C	.	.	H	α-helix	trans	-63.2	-38.7	178.1	-80.2	-36.3	0	0	0	112.9	E24 I26 N29 A675 F676 T683	E24-N679 PolarHBondContact O-ND2 3.45Å; E24-N679 VanDerWaalsContact O-ND2 3.14Å; I26-N679 WeakPolarHBondContact CA-OD1 3.42Å; I26-N679 WeakPolarHBondContact CG1-OD1 3.36Å; N29-N679 WeakPolarHBondContact CB-OD1 3.47Å; N29-N679 VanDerWaalsContact ND2-CA 3.33Å; N29-N679 WeakPolarHBondContact ND2-CA 3.48Å; N29-N679 VanDerWaalsContact ND2-CB 3.35Å; N29-N679 WeakPolarHBondContact ND2-CB 3.26Å; N29-N679 PolarHBondContact ND2-O 3.28Å; N29-N679 PolarHBondContact ND2-OD1 2.96Å; A675-N679 WeakPolarHBondContact O-CB 3.49Å; A675-N679 PolarHBondContact O-N 2.93Å; A675-N679 PolarHBondContact O-ND2 3.11Å; F676-N679 PolarHBondContact O-N 3Å; N679-T683 PolarHBondContact O-N 2.99Å; N679-T683 PolarHBondContact O-OG1 3.35Å
680	Y	86	Confident	82.7	Confident	3 Å²	3	16.2 Å²	16.2	1%	0.012	9%	0.087	C	C	.	.	H	α-helix	trans	-62.3	-47.4	172.1	170.8	-97	0	0	0	112.5	L533 W534 S537 I575 F676 F677 V678 I682 T683 A684	L533-Y680 HydrophobicContact CD2-CD2 4.34Å; W534-Y680 HydrophobicContact CB-CD2 4.43Å; W534-Y680 HydrophobicContact CB-CE2 4.39Å; S537-Y680 PolarHBondContact OG-OH 2.97Å; I575-Y680 HydrophobicContact CG2-CE1 4.4Å; F676-Y680 WeakPolarHBondContact O-CB 3.38Å; F676-Y680 PolarHBondContact O-N 3.16Å; F677-Y680 PolarHBondContact O-N 3.03Å; V678-Y680 PolarHBondContact O-N 3.41Å; Y680-I682 VanDerWaalsContact C-N 3.35Å; Y680-I682 PolarHBondContact O-N 3.36Å; Y680-T683 PolarHBondContact O-N 3.33Å; Y680-A684 WeakPolarHBondContact O-CB 3.22Å; Y680-A684 PolarHBondContact O-N 3.04Å
681	V	91.9	Very high	84.2	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.3	-37	-179.9	170.1	0	0	0	0	111.4	F677 V678 A684 A685 V741 I742 I752 F755	F677-V681 WeakPolarHBondContact O-CG2 3.33Å; F677-V681 PolarHBondContact O-N 3.26Å; V678-V681 PolarHBondContact O-N 3.26Å; V681-A684 PolarHBondContact O-N 3.25Å; V681-A685 VanDerWaalsContact O-CB 3.26Å; V681-A685 WeakPolarHBondContact O-CB 3.09Å; V681-A685 PolarHBondContact O-N 3.35Å; V681-V741 HydrophobicContact CG2-CG1 4.22Å; V681-I742 HydrophobicContact CG1-CG1 4.39Å; V681-I742 HydrophobicContact CG2-CG1 4.18Å; V681-I752 HydrophobicContact CB-CG1 4.36Å; V681-I752 HydrophobicContact CG2-CD1 3.96Å; V681-I752 HydrophobicContact CG2-CG1 4.01Å; V681-F755 HydrophobicContact CG1-CB 4.02Å
682	I	92.2	Very high	85.9	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-60.2	-49.9	172.9	-70.4	166.4	0	0	0	110.7	I26 L30 N33 V678 Y680 A684 A685 F686 F755	I26-I682 HydrophobicContact CG2-CD1 3.8Å; L30-I682 HydrophobicContact CB-CD1 4.49Å; L30-I682 HydrophobicContact CB-CG2 4.44Å; L30-I682 HydrophobicContact CD1-CG2 3.99Å; N33-I682 HydrophobicContact CB-CG2 3.95Å; V678-I682 HydrophobicContact CG1-CD1 3.88Å; V678-I682 WeakPolarHBondContact O-CG1 3.39Å; V678-I682 PolarHBondContact O-N 3.07Å; Y680-I682 VanDerWaalsContact C-N 3.35Å; Y680-I682 PolarHBondContact O-N 3.36Å; I682-A684 VanDerWaalsContact C-N 3.33Å; I682-A684 PolarHBondContact O-N 3.2Å; I682-A685 PolarHBondContact O-N 2.87Å; I682-F686 HydrophobicContact CG2-CD2 4.08Å; I682-F686 HydrophobicContact CG2-CE2 4.45Å; I682-F686 WeakPolarHBondContact O-CD2 3.4Å; I682-F686 PolarHBondContact O-N 3.06Å; I682-F755 HydrophobicContact CD1-CD1 4.21Å; I682-F755 HydrophobicContact CD1-CD2 4.07Å; I682-F755 HydrophobicContact CD1-CE1 4.13Å; I682-F755 HydrophobicContact CD1-CE2 3.98Å; I682-F755 HydrophobicContact CD1-CG 4.18Å; I682-F755 HydrophobicContact CD1-CZ 4.01Å; I682-F755 HydrophobicContact CG1-CB 4.13Å; I682-F755 HydrophobicContact CG1-CD1 3.73Å; I682-F755 HydrophobicContact CG1-CD2 4.06Å; I682-F755 HydrophobicContact CG1-CE1 4.12Å; I682-F755 HydrophobicContact CG1-CE2 4.41Å; I682-F755 HydrophobicContact CG1-CG 3.7Å; I682-F755 HydrophobicContact CG1-CZ 4.44Å
683	T	90.3	Very high	87.3	Confident	3 Å²	3	12.2 Å²	12.2	2%	0.018	6%	0.064	C	C	.	.	H	α-helix	trans	-63.8	-37.8	178.5	-57.3	0	0	0	0	112.3	N33 W534 N679 Y680 I687 G688	N33-T683 PolarHBondContact ND2-OG1 3.08Å; N33-T683 WeakPolarHBondContact OD1-CA 3.19Å; W534-T683 HydrophobicContact CB-CG2 4.24Å; W534-T683 HydrophobicContact CD2-CG2 4.16Å; W534-T683 HydrophobicContact CG-CG2 3.91Å; N679-T683 PolarHBondContact O-N 2.99Å; N679-T683 PolarHBondContact O-OG1 3.35Å; Y680-T683 PolarHBondContact O-N 3.33Å; T683-I687 HydrophobicContact CG2-CB 4.38Å; T683-I687 WeakPolarHBondContact O-CB 3.46Å; T683-I687 PolarHBondContact O-N 3.21Å; T683-G688 PolarHBondContact O-N 3.1Å; T683-G688 VanDerWaalsContact O-N 3.1Å
684	A	91.3	Very high	88.1	Confident	1 Å²	1	11.1 Å²	11.1	1%	0.008	6%	0.059	C	C	.	.	I	π-helix	trans	-66.5	-38.3	173.9	0	0	0	0	0	113	Y680 V681 I682 G688 T689 Y759	Y680-A684 WeakPolarHBondContact O-CB 3.22Å; Y680-A684 PolarHBondContact O-N 3.04Å; V681-A684 PolarHBondContact O-N 3.25Å; I682-A684 VanDerWaalsContact C-N 3.33Å; I682-A684 PolarHBondContact O-N 3.2Å; A684-G688 VanDerWaalsContact O-CA 3.31Å; A684-G688 WeakPolarHBondContact O-CA 3.21Å; A684-G688 PolarHBondContact O-N 3.06Å; A684-T689 PolarHBondContact O-N 3.46Å; A684-Y759 HydrophobicContact CB-CD2 4.14Å; A684-Y759 HydrophobicContact CB-CE2 4.22Å
685	A	94.1	Very high	88.4	Confident	1 Å²	1	12 Å²	12	1%	0.008	6%	0.061	C	C	.	.	I	π-helix	trans	-64.9	-47.8	177.7	0	0	0	0	0	112.1	V681 I682 T689 I758 F762	V681-A685 VanDerWaalsContact O-CB 3.26Å; V681-A685 WeakPolarHBondContact O-CB 3.09Å; V681-A685 PolarHBondContact O-N 3.35Å; I682-A685 PolarHBondContact O-N 2.87Å; A685-T689 PolarHBondContact O-OG1 3.32Å; A685-I758 HydrophobicContact CB-CG2 4.43Å; A685-F762 WeakPolarHBondContact O-CD2 3.46Å
686	F	93.8	Very high	88.6	Confident	18 Å²	18	17.6 Å²	17.6	8%	0.079	9%	0.085	C	C	.	.	I	π-helix	trans	-91.5	-61.1	-172.6	-74	-75	0	0	0	112.5	L30 N33 V34 W37 I682 S690 I758 F762	L30-F686 HydrophobicContact CD1-CD2 4.33Å; L30-F686 HydrophobicContact CD1-CE2 3.54Å; L30-F686 HydrophobicContact CD1-CZ 4.11Å; N33-F686 HydrophobicContact CB-CB 3.89Å; N33-F686 HydrophobicContact CB-CD2 4.17Å; N33-F686 HydrophobicContact CB-CG 4.24Å; V34-F686 HydrophobicContact CG2-CD1 4.14Å; V34-F686 HydrophobicContact CG2-CE1 3.7Å; V34-F686 HydrophobicContact CG2-CE2 4.21Å; V34-F686 HydrophobicContact CG2-CZ 3.73Å; W37-F686 HydrophobicContact CB-CB 4.07Å; W37-F686 HydrophobicContact CB-CD1 3.8Å; W37-F686 HydrophobicContact CB-CG 4.4Å; W37-F686 AromaticContact CD1-CD1 3.8Å; W37-F686 HydrophobicContact CD2-CD1 4.32Å; W37-F686 AromaticContact CG-CD1 3.73Å; W37-F686 HydrophobicContact CG-CD1 3.73Å; I682-F686 HydrophobicContact CG2-CD2 4.08Å; I682-F686 HydrophobicContact CG2-CE2 4.45Å; I682-F686 WeakPolarHBondContact O-CD2 3.4Å; I682-F686 PolarHBondContact O-N 3.06Å; F686-S690 WeakPolarHBondContact O-CB 3.38Å; F686-S690 PolarHBondContact O-OG 3.31Å; F686-I758 HydrophobicContact CZ-CG2 4.42Å; F686-F762 HydrophobicContact CD1-CE2 4.01Å; F686-F762 AromaticContact CE1-CE2 3.83Å; F686-F762 HydrophobicContact CE1-CE2 3.83Å; F686-F762 HydrophobicContact CE1-CZ 4.35Å
687	I	91.3	Very high	88.6	Confident	31 Å²	31	17.2 Å²	17.2	16%	0.159	9%	0.089	C	C	.	.	I	π-helix	trans	-75.3	-41	-176.4	-58.6	-61.9	0	0	0	111	N33 L40 W534 T683 S690 L691	N33-I687 WeakPolarHBondContact OD1-CG1 3.3Å; L40-I687 HydrophobicContact CD1-CD1 3.8Å; L40-I687 HydrophobicContact CD1-CG2 4.22Å; W534-I687 HydrophobicContact CH2-CG2 4.15Å; W534-I687 HydrophobicContact CZ2-CG2 4.3Å; T683-I687 HydrophobicContact CG2-CB 4.38Å; T683-I687 WeakPolarHBondContact O-CB 3.46Å; T683-I687 PolarHBondContact O-N 3.21Å; I687-S690 PolarHBondContact O-N 2.9Å; I687-L691 HydrophobicContact CG2-CD1 3.73Å; I687-L691 HydrophobicContact CG2-CG 4.45Å; I687-L691 WeakPolarHBondContact O-CG 3.39Å; I687-L691 PolarHBondContact O-N 2.99Å; I687-L691 VanDerWaalsContact O-N 3.12Å
688	G	90.2	Very high	88.3	Confident	6 Å²	6	18.1 Å²	18.1	6%	0.062	9%	0.093	C	C	.	.	I	π-helix	trans	-55.7	-62.7	179.7	0	0	0	0	0	113.7	T683 A684 S690 L691 E692	T683-G688 PolarHBondContact O-N 3.1Å; T683-G688 VanDerWaalsContact O-N 3.1Å; A684-G688 VanDerWaalsContact O-CA 3.31Å; A684-G688 WeakPolarHBondContact O-CA 3.21Å; A684-G688 PolarHBondContact O-N 3.06Å; G688-S690 PolarHBondContact O-N 3.47Å; G688-L691 PolarHBondContact O-N 2.94Å; G688-E692 PolarHBondContact O-N 3.32Å; G688-E692 VanDerWaalsContact O-N 3.16Å
689	T	92.7	Very high	87.9	Confident	1 Å²	1	20.4 Å²	20.4	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-65.1	-27.6	-177.2	73	0	0	0	0	112.5	A684 A685 E692 L693 Y759 F762 K763	A684-T689 PolarHBondContact O-N 3.46Å; A685-T689 PolarHBondContact O-OG1 3.32Å; T689-E692 PolarHBondContact O-N 3.28Å; T689-L693 PolarHBondContact O-N 3.28Å; T689-Y759 HydrophobicContact CG2-CD2 4.24Å; T689-Y759 HydrophobicContact CG2-CE2 4.25Å; T689-F762 HydrophobicContact CG2-CB 4.03Å; T689-K763 HydrophobicContact CG2-CB 4.35Å
690	S	92.5	Very high	87.6	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.007	13%	0.127	C	C	.	.	H	α-helix	trans	-66.3	-43.1	176.1	-60.9	0	0	0	0	112.4	M41 F686 I687 G688 E692 L693 V694	M41-S690 WeakPolarHBondContact CE-OG 3.46Å; F686-S690 WeakPolarHBondContact O-CB 3.38Å; F686-S690 PolarHBondContact O-OG 3.31Å; I687-S690 PolarHBondContact O-N 2.9Å; G688-S690 PolarHBondContact O-N 3.47Å; S690-E692 VanDerWaalsContact C-N 3.34Å; S690-L693 PolarHBondContact O-N 3.43Å; S690-V694 WeakPolarHBondContact O-CG2 3.06Å; S690-V694 PolarHBondContact O-N 3.46Å
691	L	90	Very high	87.1	Confident	42 Å²	42	28.7 Å²	28.7	22%	0.22	14%	0.144	C	C	.	.	H	α-helix	trans	-72.5	-28.4	177.9	-68.1	169.1	0	0	0	112.3	L40 W534 I687 G688 R695 F696	L40-L691 HydrophobicContact CD1-CD2 4.36Å; L40-L691 HydrophobicContact CD1-CG 4.23Å; L40-L691 HydrophobicContact CD2-CD2 3.94Å; W534-L691 HydrophobicContact CH2-CD1 3.55Å; W534-L691 HydrophobicContact CZ2-CD1 4.1Å; I687-L691 HydrophobicContact CG2-CD1 3.73Å; I687-L691 HydrophobicContact CG2-CG 4.45Å; I687-L691 WeakPolarHBondContact O-CG 3.39Å; I687-L691 PolarHBondContact O-N 2.99Å; I687-L691 VanDerWaalsContact O-N 3.12Å; G688-L691 PolarHBondContact O-N 2.94Å; L691-R695 PolarHBondContact O-N 2.83Å; L691-F696 HydrophobicContact CB-CB 4.44Å; L691-F696 HydrophobicContact CD2-CB 4.22Å; L691-F696 HydrophobicContact CD2-CD2 4.32Å; L691-F696 HydrophobicContact CD2-CG 4.29Å; L691-F696 PolarHBondContact O-N 3.39Å; L691-F696 VanDerWaalsContact O-N 3.08Å
692	E	89	Confident	86.4	Confident	18 Å²	18	30.1 Å²	30.1	8%	0.084	15%	0.15	C	C	.	.	H	α-helix	trans	-66.8	-38.2	167.8	-69.7	-173.7	160.6	0	0	112.6	G688 T689 S690 R695 K763 V766 N770	G688-E692 PolarHBondContact O-N 3.32Å; G688-E692 VanDerWaalsContact O-N 3.16Å; T689-E692 PolarHBondContact O-N 3.28Å; S690-E692 VanDerWaalsContact C-N 3.34Å; E692-R695 VanDerWaalsContact O-CG 3.27Å; E692-R695 WeakPolarHBondContact O-CG 3.39Å; E692-R695 PolarHBondContact O-N 3.2Å; E692-R695 VanDerWaalsContact O-N 3.11Å; E692-K763 IonicContact OE1-NZ 3.79Å; E692-K763 PolarHBondContact OE1-NZ 3.32Å; E692-K763 VanDerWaalsContact OE2-CD 3.31Å; E692-K763 WeakPolarHBondContact OE2-CD 3.49Å; E692-K763 IonicContact OE2-NZ 3.75Å; E692-K763 PolarHBondContact OE2-NZ 3.16Å; E692-V766 HydrophobicContact CB-CG1 3.99Å; E692-N770 PolarHBondContact O-ND2 2.9Å
693	L	89.2	Confident	85.8	Confident	6 Å²	6	32.1 Å²	32.1	3%	0.031	17%	0.166	C	C	.	.	H	α-helix	trans	-66.6	-41.2	176	-175	62.9	0	0	0	111.9	M41 F44 W102 T689 S690 R695 V766 Y769	M41-L693 HydrophobicContact CE-CD2 3.74Å; M41-L693 HydrophobicContact SD-CD2 3.76Å; F44-L693 HydrophobicContact CD1-CD2 3.77Å; F44-L693 HydrophobicContact CD1-CG 4.18Å; F44-L693 HydrophobicContact CD2-CG 4.15Å; F44-L693 HydrophobicContact CE1-CD1 4.3Å; F44-L693 HydrophobicContact CE1-CD2 3.74Å; F44-L693 HydrophobicContact CE1-CG 3.92Å; F44-L693 HydrophobicContact CE2-CD1 4.39Å; F44-L693 HydrophobicContact CE2-CG 3.88Å; F44-L693 WeakPolarHBondContact CE2-O 3.47Å; F44-L693 HydrophobicContact CG-CD2 4.19Å; F44-L693 HydrophobicContact CG-CG 4.29Å; F44-L693 HydrophobicContact CZ-CD1 3.96Å; F44-L693 HydrophobicContact CZ-CD2 4.13Å; F44-L693 HydrophobicContact CZ-CG 3.76Å; W102-L693 HydrophobicContact CH2-CD2 3.87Å; W102-L693 HydrophobicContact CZ3-CD2 4.23Å; T689-L693 PolarHBondContact O-N 3.28Å; S690-L693 PolarHBondContact O-N 3.43Å; L693-R695 PolarHBondContact O-N 3.39Å; L693-V766 HydrophobicContact CB-CG1 3.84Å; L693-V766 HydrophobicContact CB-CG2 3.98Å; L693-V766 HydrophobicContact CD1-CG1 4.24Å; L693-V766 HydrophobicContact CD1-CG2 4.33Å; L693-V766 HydrophobicContact CD2-CG2 4.49Å; L693-V766 HydrophobicContact CG-CG2 4.49Å; L693-Y769 HydrophobicContact CD1-CD1 3.59Å; L693-Y769 HydrophobicContact CD1-CE1 4.17Å; L693-Y769 HydrophobicContact CD1-CG 4.1Å
694	V	84.8	Confident	85.2	Confident	21 Å²	21	34 Å²	34	13%	0.127	18%	0.179	C	C	.	.	H	α-helix	trans	-67.5	-20.2	171.8	174.6	0	0	0	0	112	F44 S690 F696 L699	F44-V694 HydrophobicContact CB-CG2 3.95Å; F44-V694 HydrophobicContact CD2-CG2 4.01Å; F44-V694 HydrophobicContact CG-CG2 4.4Å; S690-V694 WeakPolarHBondContact O-CG2 3.06Å; S690-V694 PolarHBondContact O-N 3.46Å; V694-F696 VanDerWaalsContact C-N 3.32Å; V694-L699 HydrophobicContact CG1-CD2 3.88Å
695	R	84.8	Confident	84.5	Confident	22 Å²	22	38.2 Å²	38.2	8%	0.083	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	49.7	-171.4	-60.5	-177.4	59.4	-158.4	-1.3	111.6	L691 E692 L693 S697 E698 L699 A774	L691-R695 PolarHBondContact O-N 2.83Å; E692-R695 VanDerWaalsContact O-CG 3.27Å; E692-R695 WeakPolarHBondContact O-CG 3.39Å; E692-R695 PolarHBondContact O-N 3.2Å; E692-R695 VanDerWaalsContact O-N 3.11Å; L693-R695 PolarHBondContact O-N 3.39Å; R695-S697 VanDerWaalsContact C-N 3.27Å; R695-S697 PolarHBondContact O-N 3.36Å; R695-S697 VanDerWaalsContact O-N 3.15Å; R695-E698 IonicContact CZ-OE1 2.72Å; R695-E698 IonicContact NE-OE1 2.77Å; R695-E698 PolarHBondContact NE-OE1 2.89Å; R695-E698 IonicContact NH2-OE1 2.72Å; R695-E698 PolarHBondContact NH2-OE1 3.37Å; R695-E698 PolarHBondContact O-N 3.44Å; R695-E698 VanDerWaalsContact O-N 3.11Å; R695-L699 WeakPolarHBondContact O-CB 3.48Å; R695-L699 PolarHBondContact O-N 3.35Å; R695-A774 PolarHBondContact NH1-O 2.93Å
696	F	81.9	Confident	83.6	Confident	121 Å²	121	41 Å²	41	53%	0.531	21%	0.209	S	C	.	.	H	α-helix	trans	-53	-40.9	-167	-177.7	-98.2	0	0	0	113.3	L691 V694 E698 F700	L691-F696 HydrophobicContact CB-CB 4.44Å; L691-F696 HydrophobicContact CD2-CB 4.22Å; L691-F696 HydrophobicContact CD2-CD2 4.32Å; L691-F696 HydrophobicContact CD2-CG 4.29Å; L691-F696 PolarHBondContact O-N 3.39Å; L691-F696 VanDerWaalsContact O-N 3.08Å; V694-F696 VanDerWaalsContact C-N 3.32Å; F696-E698 PolarHBondContact O-N 3.46Å; F696-F700 VanDerWaalsContact O-CB 3.24Å; F696-F700 WeakPolarHBondContact O-CB 3.36Å; F696-F700 PolarHBondContact O-N 2.84Å
697	S	77.9	Confident	82.6	Confident	49 Å²	49	45.8 Å²	45.8	34%	0.343	23%	0.233	S	C	.	.	H	α-helix	trans	-64.5	-42.1	-178.4	89	0	0	0	0	112.8	R695 N701	R695-S697 VanDerWaalsContact C-N 3.27Å; R695-S697 PolarHBondContact O-N 3.36Å; R695-S697 VanDerWaalsContact O-N 3.15Å; S697-N701 PolarHBondContact O-N 3.25Å; S697-N701 VanDerWaalsContact O-N 3.14Å
698	E	77.1	Confident	81.7	Confident	18 Å²	18	48.6 Å²	48.6	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-80	-36.2	-179	-53.2	100.5	100.4	0	0	111.6	R695 F696 N701 Y702 F724 Y775	R695-E698 IonicContact CZ-OE1 2.72Å; R695-E698 IonicContact NE-OE1 2.77Å; R695-E698 PolarHBondContact NE-OE1 2.89Å; R695-E698 IonicContact NH2-OE1 2.72Å; R695-E698 PolarHBondContact NH2-OE1 3.37Å; R695-E698 PolarHBondContact O-N 3.44Å; R695-E698 VanDerWaalsContact O-N 3.11Å; F696-E698 PolarHBondContact O-N 3.46Å; E698-N701 PolarHBondContact O-N 3.5Å; E698-Y702 VanDerWaalsContact O-CB 3.3Å; E698-Y702 WeakPolarHBondContact O-CB 3.41Å; E698-Y702 PolarHBondContact O-N 3.24Å; E698-F724 HydrophobicContact CB-CD2 4.22Å; E698-F724 HydrophobicContact CB-CE2 3.8Å; E698-F724 HydrophobicContact CB-CZ 4.49Å; E698-F724 HydrophobicContact CG-CD2 4.03Å; E698-F724 HydrophobicContact CG-CE2 3.88Å; E698-F724 HydrophobicContact CG-CZ 4.36Å; E698-Y775 PolarHBondContact OE1-OH 3.49Å
699	L	79.2	Confident	80.7	Confident	48 Å²	48	48.7 Å²	48.7	25%	0.251	25%	0.254	S	S	.	.	H	α-helix	trans	-63.8	-42.6	174.6	-174.3	64.8	0	0	0	110.9	L47 Y54 V694 R695 Y702 A703	L47-L699 HydrophobicContact CD1-CD2 4.37Å; Y54-L699 HydrophobicContact CE1-CD1 4.36Å; V694-L699 HydrophobicContact CG1-CD2 3.88Å; R695-L699 WeakPolarHBondContact O-CB 3.48Å; R695-L699 PolarHBondContact O-N 3.35Å; L699-Y702 HydrophobicContact CD1-CD1 4.44Å; L699-Y702 PolarHBondContact O-N 3.09Å; L699-A703 WeakPolarHBondContact O-CB 3.47Å; L699-A703 PolarHBondContact O-N 3.07Å
700	F	80	Confident	79.5	Confident	125 Å²	125	51.4 Å²	51.4	55%	0.548	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-47.2	172.9	-178	-100.8	0	0	0	111.5	F696 Y702 A703 C704	F696-F700 VanDerWaalsContact O-CB 3.24Å; F696-F700 WeakPolarHBondContact O-CB 3.36Å; F696-F700 PolarHBondContact O-N 2.84Å; F700-Y702 VanDerWaalsContact C-N 3.32Å; F700-Y702 PolarHBondContact O-N 3.41Å; F700-A703 PolarHBondContact O-N 2.93Å; F700-C704 PolarHBondContact O-N 3.22Å; F700-C704 PolarHBondContact O-SG 3.21Å; F700-C704 VanDerWaalsContact O-SG 3.32Å
701	N	75.7	Confident	78.3	Confident	70 Å²	70	51.8 Å²	51.8	37%	0.374	27%	0.268	S	S	.	.	H	α-helix	trans	-62.5	-38.6	177.5	-155.8	-95.8	0	0	0	112.3	S697 E698 R705	S697-N701 PolarHBondContact O-N 3.25Å; S697-N701 VanDerWaalsContact O-N 3.14Å; E698-N701 PolarHBondContact O-N 3.5Å; N701-R705 VanDerWaalsContact O-CG 3.32Å; N701-R705 WeakPolarHBondContact O-CG 3.4Å; N701-R705 PolarHBondContact O-N 3.03Å; N701-R705 VanDerWaalsContact OD1-CZ 3.26Å; N701-R705 PolarHBondContact OD1-NE 3.01Å; N701-R705 PolarHBondContact OD1-NH2 2.66Å
702	Y	76	Confident	77.3	Confident	31 Å²	31	53.8 Å²	53.8	12%	0.122	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-45.8	173.5	171.3	-111.2	0	0	0	111.9	Y54 E698 L699 F700 C704 R705 L706 V718 R719	Y54-Y702 HydrophobicContact CD2-CD1 4.15Å; Y54-Y702 AromaticContact CD2-CE1 3.66Å; Y54-Y702 HydrophobicContact CD2-CE1 3.66Å; Y54-Y702 HydrophobicContact CD2-CE2 4.39Å; Y54-Y702 AromaticContact CD2-CZ 3.79Å; Y54-Y702 AromaticContact CE2-CD1 3.49Å; Y54-Y702 HydrophobicContact CE2-CD1 3.49Å; Y54-Y702 VanDerWaalsContact CE2-CD1 3.49Å; Y54-Y702 AromaticContact CE2-CD2 3.91Å; Y54-Y702 HydrophobicContact CE2-CD2 3.91Å; Y54-Y702 AromaticContact CE2-CE1 3.46Å; Y54-Y702 HydrophobicContact CE2-CE1 3.46Å; Y54-Y702 VanDerWaalsContact CE2-CE1 3.46Å; Y54-Y702 AromaticContact CE2-CE2 3.87Å; Y54-Y702 HydrophobicContact CE2-CE2 3.87Å; Y54-Y702 AromaticContact CE2-CG 3.72Å; Y54-Y702 HydrophobicContact CE2-CG 3.72Å; Y54-Y702 AromaticContact CE2-CZ 3.65Å; Y54-Y702 AromaticContact CZ-CD1 3.93Å; E698-Y702 VanDerWaalsContact O-CB 3.3Å; E698-Y702 WeakPolarHBondContact O-CB 3.41Å; E698-Y702 PolarHBondContact O-N 3.24Å; L699-Y702 HydrophobicContact CD1-CD1 4.44Å; L699-Y702 PolarHBondContact O-N 3.09Å; F700-Y702 VanDerWaalsContact C-N 3.32Å; F700-Y702 PolarHBondContact O-N 3.41Å; Y702-C704 PolarHBondContact O-N 2.84Å; Y702-R705 PolarHBondContact O-N 3.18Å; Y702-L706 HydrophobicContact CE1-CD2 4.2Å; Y702-L706 VanDerWaalsContact O-CB 3.29Å; Y702-L706 WeakPolarHBondContact O-CB 3.27Å; Y702-L706 PolarHBondContact O-N 3.46Å; Y702-V718 HydrophobicContact CD2-CG1 4.05Å; Y702-V718 HydrophobicContact CE2-CG1 4.08Å; Y702-R719 HydrophobicContact CE2-CG 3.76Å; Y702-R719 WeakPolarHBondContact OH-CG 3.28Å
703	A	79.6	Confident	76.3	Confident	41 Å²	41	53 Å²	53	34%	0.339	27%	0.273	S	S	.	.	H	α-helix	trans	-60.1	-45.8	176.7	0	0	0	0	0	111.8	L699 F700 R705 L706 M707	L699-A703 WeakPolarHBondContact O-CB 3.47Å; L699-A703 PolarHBondContact O-N 3.07Å; F700-A703 PolarHBondContact O-N 2.93Å; A703-R705 PolarHBondContact O-N 3.19Å; A703-L706 PolarHBondContact O-N 3.31Å; A703-M707 WeakPolarHBondContact O-CG 3.42Å; A703-M707 PolarHBondContact O-N 3.41Å
704	C	79	Confident	75.3	Confident	42 Å²	42	54.7 Å²	54.7	28%	0.284	28%	0.281	S	S	.	.	H	α-helix	trans	-57.5	-47.8	173.7	-66.8	0	0	0	0	112.1	F700 Y702 L706 M707 C708	F700-C704 PolarHBondContact O-N 3.22Å; F700-C704 PolarHBondContact O-SG 3.21Å; F700-C704 VanDerWaalsContact O-SG 3.32Å; Y702-C704 PolarHBondContact O-N 2.84Å; C704-L706 VanDerWaalsContact C-N 3.32Å; C704-L706 PolarHBondContact O-N 2.89Å; C704-M707 PolarHBondContact O-N 3.14Å; C704-C708 PolarHBondContact O-N 3.2Å; C704-C708 PolarHBondContact O-SG 2.84Å; C704-C708 VanDerWaalsContact O-SG 3.35Å
705	R	75.7	Confident	74.6	Confident	91 Å²	91	57 Å²	57	34%	0.343	29%	0.289	S	S	.	.	H	α-helix	trans	-62.7	-38.3	176.2	-69.8	177.7	-162.6	-170.7	8.2	112.5	N701 Y702 A703 M707 C708 V709 V718 A721	N701-R705 VanDerWaalsContact O-CG 3.32Å; N701-R705 WeakPolarHBondContact O-CG 3.4Å; N701-R705 PolarHBondContact O-N 3.03Å; N701-R705 VanDerWaalsContact OD1-CZ 3.26Å; N701-R705 PolarHBondContact OD1-NE 3.01Å; N701-R705 PolarHBondContact OD1-NH2 2.66Å; Y702-R705 PolarHBondContact O-N 3.18Å; A703-R705 PolarHBondContact O-N 3.19Å; R705-M707 VanDerWaalsContact C-N 3.34Å; R705-C708 PolarHBondContact O-N 3.41Å; R705-C708 VanDerWaalsContact O-N 3.15Å; R705-V709 PolarHBondContact O-N 3.04Å; R705-V718 HydrophobicContact CB-CG1 3.7Å; R705-A721 PolarHBondContact NH1-O 2.91Å
706	L	75.4	Confident	73.7	Confident	58 Å²	58	57.8 Å²	57.8	30%	0.304	30%	0.3	S	S	.	.	H	α-helix	trans	-66.7	-34.9	-179.1	-173.1	63.5	0	0	0	111.9	Y702 A703 C704 C708 V709 K715	Y702-L706 HydrophobicContact CE1-CD2 4.2Å; Y702-L706 VanDerWaalsContact O-CB 3.29Å; Y702-L706 WeakPolarHBondContact O-CB 3.27Å; Y702-L706 PolarHBondContact O-N 3.46Å; A703-L706 PolarHBondContact O-N 3.31Å; C704-L706 VanDerWaalsContact C-N 3.32Å; C704-L706 PolarHBondContact O-N 2.89Å; L706-C708 VanDerWaalsContact C-N 3.31Å; L706-V709 HydrophobicContact CD1-CG2 4.44Å; L706-V709 WeakPolarHBondContact O-CB 3.26Å; L706-V709 PolarHBondContact O-N 3.31Å; L706-K715 HydrophobicContact CD1-CD 3.94Å; L706-K715 HydrophobicContact CD1-CG 3.91Å
707	M	73.1	Confident	72.9	Confident	119 Å²	119	52.8 Å²	52.8	59%	0.586	28%	0.283	S	S	*	.	H	α-helix	trans	-66.4	-30.5	171.5	-68.9	-173.2	-70.4	0	0	112.8	A703 C704 R705 V709	A703-M707 WeakPolarHBondContact O-CG 3.42Å; A703-M707 PolarHBondContact O-N 3.41Å; C704-M707 PolarHBondContact O-N 3.14Å; R705-M707 VanDerWaalsContact C-N 3.34Å; M707-V709 VanDerWaalsContact C-N 3.34Å; M707-V709 PolarHBondContact O-N 2.86Å
708	C	71.4	Confident	72.5	Confident	91 Å²	91	51.7 Å²	51.7	62%	0.615	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	0.7	179.2	-61.7	0	0	0	0	115.1	C704 R705 L706	C704-C708 PolarHBondContact O-N 3.2Å; C704-C708 PolarHBondContact O-SG 2.84Å; C704-C708 VanDerWaalsContact O-SG 3.35Å; R705-C708 PolarHBondContact O-N 3.41Å; R705-C708 VanDerWaalsContact O-N 3.15Å; L706-C708 VanDerWaalsContact C-N 3.31Å
709	V	70	Confident	72	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.042	29%	0.285	C	S	.	.			trans	-66.7	137.1	-177.4	163	0	0	0	0	112.4	G295 W296 R705 L706 M707 S711 E714 K715 V718	G295-V709 WeakPolarHBondContact CA-O 3.32Å; W296-V709 PolarHBondContact N-O 2.97Å; R705-V709 PolarHBondContact O-N 3.04Å; L706-V709 HydrophobicContact CD1-CG2 4.44Å; L706-V709 WeakPolarHBondContact O-CB 3.26Å; L706-V709 PolarHBondContact O-N 3.31Å; M707-V709 VanDerWaalsContact C-N 3.34Å; M707-V709 PolarHBondContact O-N 2.86Å; V709-S711 WeakPolarHBondContact CG1-O 3.11Å; V709-E714 HydrophobicContact CG1-CB 4.21Å; V709-K715 HydrophobicContact CG1-CG 3.96Å; V709-K715 HydrophobicContact CG2-CG 4.36Å; V709-V718 HydrophobicContact CG2-CG2 3.86Å
710	K	66.6	Low	71.2	Confident	58 Å²	58	58.4 Å²	58.4	25%	0.252	30%	0.298	S	S	.	.	S	Bend	trans	-97.3	-19.1	178.1	-52.4	-168.9	-179.3	-162.9	0	114.1	P291 C292 W296 E714	P291-K710 PolarHBondContact O-NZ 3.48Å; C292-K710 WeakPolarHBondContact O-CD 3.31Å; C292-K710 WeakPolarHBondContact O-CE 3.34Å; C292-K710 PolarHBondContact O-NZ 2.96Å; W296-K710 VanDerWaalsContact CD1-C 3.46Å; W296-K710 PolarHBondContact NE1-O 2.85Å; K710-E714 WeakPolarHBondContact CA-OE2 3.47Å; K710-E714 VanDerWaalsContact CB-OE2 3.3Å; K710-E714 WeakPolarHBondContact CB-OE2 3.46Å; K710-E714 PolarHBondContact N-OE2 2.84Å
711	S	68.8	Low	70.6	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.063	30%	0.295	C	S	.	.	S	Bend	trans	-148.8	145.4	177.1	178.6	0	0	0	0	111.8	Y390 V709 A713 E714	Y390-S711 VanDerWaalsContact OH-CB 3.28Å; Y390-S711 WeakPolarHBondContact OH-CB 3.45Å; V709-S711 WeakPolarHBondContact CG1-O 3.11Å; S711-A713 PolarHBondContact O-N 2.9Å; S711-A713 WeakPolarHBondContact OG-CB 3.47Å; S711-A713 PolarHBondContact OG-N 3.29Å; S711-E714 PolarHBondContact N-OE2 3.4Å; S711-E714 PolarHBondContact O-N 3.43Å
712	Q	69.2	Low	70	Confident	84 Å²	84	52 Å²	52	39%	0.393	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-30.7	171.5	-174.9	72.1	1.3	0	0	112.1	Y275 K715	Y275-Q712 HydrophobicContact CE1-CB 4Å; Y275-Q712 HydrophobicContact CE1-CG 3.77Å; Y275-Q712 VanDerWaalsContact OH-CG 3.23Å; Y275-Q712 WeakPolarHBondContact OH-CG 3.28Å; Q712-K715 WeakPolarHBondContact O-CB 3.28Å; Q712-K715 PolarHBondContact O-N 3.45Å; Q712-K715 VanDerWaalsContact OE1-CE 3.24Å
713	A	66.3	Low	69.5	Low	1 Å²	1	52.6 Å²	52.6	1%	0.008	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-41.9	174.7	0	0	0	0	0	113.7	A272 Y275 Y390 S711 K715 A716	A272-A713 HydrophobicContact CB-CB 3.81Å; A272-A713 WeakPolarHBondContact O-CB 3.3Å; Y275-A713 HydrophobicContact CD1-CB 3.53Å; Y275-A713 HydrophobicContact CE1-CB 4.43Å; Y275-A713 HydrophobicContact CG-CB 4.08Å; Y390-A713 HydrophobicContact CE2-CB 4.2Å; S711-A713 PolarHBondContact O-N 2.9Å; S711-A713 WeakPolarHBondContact OG-CB 3.47Å; S711-A713 PolarHBondContact OG-N 3.29Å; A713-K715 PolarHBondContact O-N 3.43Å; A713-A716 PolarHBondContact O-N 3.02Å
714	E	69.8	Low	69.1	Low	43 Å²	43	53 Å²	53	20%	0.201	28%	0.276	C	S	.	.	H	α-helix	trans	-68.6	-18.7	-179.6	-62.1	176.7	141.9	0	0	112.2	V709 K710 S711 A716 G717 V718	V709-E714 HydrophobicContact CG1-CB 4.21Å; K710-E714 WeakPolarHBondContact CA-OE2 3.47Å; K710-E714 VanDerWaalsContact CB-OE2 3.3Å; K710-E714 WeakPolarHBondContact CB-OE2 3.46Å; K710-E714 PolarHBondContact N-OE2 2.84Å; S711-E714 PolarHBondContact N-OE2 3.4Å; S711-E714 PolarHBondContact O-N 3.43Å; E714-A716 PolarHBondContact O-N 3.35Å; E714-G717 CarbonylContact O-C 3.47Å; E714-G717 WeakPolarHBondContact O-CA 3.35Å; E714-G717 PolarHBondContact O-N 3.23Å; E714-V718 PolarHBondContact O-N 2.91Å
715	K	70	Confident	69.1	Low	69 Å²	69	54.2 Å²	54.2	30%	0.3	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-27.8	175.4	-62.2	-172.6	177.4	168.8	0	112.5	L706 V709 Q712 A713 R719	L706-K715 HydrophobicContact CD1-CD 3.94Å; L706-K715 HydrophobicContact CD1-CG 3.91Å; V709-K715 HydrophobicContact CG1-CG 3.96Å; V709-K715 HydrophobicContact CG2-CG 4.36Å; Q712-K715 WeakPolarHBondContact O-CB 3.28Å; Q712-K715 PolarHBondContact O-N 3.45Å; Q712-K715 VanDerWaalsContact OE1-CE 3.24Å; A713-K715 PolarHBondContact O-N 3.43Å; K715-R719 VanDerWaalsContact O-CB 3.28Å; K715-R719 WeakPolarHBondContact O-CB 3.45Å; K715-R719 WeakPolarHBondContact O-CG 3.49Å; K715-R719 PolarHBondContact O-N 3Å; K715-R719 VanDerWaalsContact O-N 3.1Å; K715-R719 PolarHBondContact O-NE 3.28Å
716	A	65.4	Low	69.6	Low	38 Å²	38	50.1 Å²	50.1	31%	0.314	26%	0.263	S	S	.	.	H	α-helix	trans	-67.2	-45	171.2	0	0	0	0	0	111.3	A713 E714 K720	A713-A716 PolarHBondContact O-N 3.02Å; E714-A716 PolarHBondContact O-N 3.35Å; A716-K720 WeakPolarHBondContact O-CB 3.37Å; A716-K720 PolarHBondContact O-N 3.08Å
717	G	64.6	Low	70.2	Confident	17 Å²	17	48.8 Å²	48.8	18%	0.175	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-47	175.8	0	0	0	0	0	113.1	E714 R719 K720 A721	E714-G717 CarbonylContact O-C 3.47Å; E714-G717 WeakPolarHBondContact O-CA 3.35Å; E714-G717 PolarHBondContact O-N 3.23Å; G717-R719 PolarHBondContact O-N 2.86Å; G717-K720 PolarHBondContact O-N 2.86Å; G717-A721 VanDerWaalsContact O-CB 3.26Å; G717-A721 WeakPolarHBondContact O-CB 3.33Å; G717-A721 PolarHBondContact O-N 3.28Å
718	V	69.4	Low	71.1	Confident	25 Å²	25	43.3 Å²	43.3	15%	0.152	23%	0.228	C	C	.	.	H	α-helix	trans	-62	-44	177.6	173.6	0	0	0	0	111.4	Y702 R705 V709 E714 A721 S722	Y702-V718 HydrophobicContact CD2-CG1 4.05Å; Y702-V718 HydrophobicContact CE2-CG1 4.08Å; R705-V718 HydrophobicContact CB-CG1 3.7Å; V709-V718 HydrophobicContact CG2-CG2 3.86Å; E714-V718 PolarHBondContact O-N 2.91Å; V718-A721 CarbonylContact O-C 3.47Å; V718-A721 PolarHBondContact O-N 3.43Å; V718-S722 PolarHBondContact O-N 2.97Å; V718-S722 PolarHBondContact O-OG 3.45Å
719	R	66.5	Low	72	Confident	82 Å²	82	39 Å²	39	31%	0.309	20%	0.198	S	C	.	.	H	α-helix	trans	-59.6	-48.5	175.4	-77.1	179.6	-61.6	160.5	-1	111.8	M57 Y702 K715 G717 A721 S722 Q723	M57-R719 HydrophobicContact CE-CB 3.79Å; M57-R719 HydrophobicContact CE-CG 3.89Å; M57-R719 HydrophobicContact SD-CB 3.6Å; M57-R719 VanDerWaalsContact SD-CB 3.6Å; M57-R719 HydrophobicContact SD-CG 4.08Å; Y702-R719 HydrophobicContact CE2-CG 3.76Å; Y702-R719 WeakPolarHBondContact OH-CG 3.28Å; K715-R719 VanDerWaalsContact O-CB 3.28Å; K715-R719 WeakPolarHBondContact O-CB 3.45Å; K715-R719 WeakPolarHBondContact O-CG 3.49Å; K715-R719 PolarHBondContact O-N 3Å; K715-R719 VanDerWaalsContact O-N 3.1Å; K715-R719 PolarHBondContact O-NE 3.28Å; G717-R719 PolarHBondContact O-N 2.86Å; R719-A721 VanDerWaalsContact C-N 3.31Å; R719-A721 PolarHBondContact O-N 2.96Å; R719-S722 PolarHBondContact O-N 3.19Å; R719-S722 VanDerWaalsContact O-N 3.11Å; R719-Q723 PolarHBondContact O-N 3.05Å
720	K	63.3	Low	73	Confident	125 Å²	125	38.7 Å²	38.7	54%	0.543	20%	0.197	S	C	.	.	H	α-helix	trans	-61.1	-37.4	175.9	-170.1	172.1	-176.8	173.1	0	112.5	A716 G717 S722 Q723	A716-K720 WeakPolarHBondContact O-CB 3.37Å; A716-K720 PolarHBondContact O-N 3.08Å; G717-K720 PolarHBondContact O-N 2.86Å; K720-S722 VanDerWaalsContact C-N 3.26Å; K720-S722 PolarHBondContact O-N 3.26Å; K720-Q723 PolarHBondContact O-N 3.11Å
721	A	65.7	Low	74.2	Confident	57 Å²	57	36.5 Å²	36.5	47%	0.471	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	0.6	177	0	0	0	0	0	114.9	R705 G717 V718 R719	R705-A721 PolarHBondContact NH1-O 2.91Å; G717-A721 VanDerWaalsContact O-CB 3.26Å; G717-A721 WeakPolarHBondContact O-CB 3.33Å; G717-A721 PolarHBondContact O-N 3.28Å; V718-A721 CarbonylContact O-C 3.47Å; V718-A721 PolarHBondContact O-N 3.43Å; R719-A721 VanDerWaalsContact C-N 3.31Å; R719-A721 PolarHBondContact O-N 2.96Å
722	S	65	Low	75.4	Confident	4 Å²	4	36.1 Å²	36.1	3%	0.028	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	7.1	171.6	-77.7	0	0	0	0	112.8	V718 R719 K720 F724	V718-S722 PolarHBondContact O-N 2.97Å; V718-S722 PolarHBondContact O-OG 3.45Å; R719-S722 PolarHBondContact O-N 3.19Å; R719-S722 VanDerWaalsContact O-N 3.11Å; K720-S722 VanDerWaalsContact C-N 3.26Å; K720-S722 PolarHBondContact O-N 3.26Å; S722-F724 WeakPolarHBondContact O-CD2 3.35Å; S722-F724 VanDerWaalsContact O-CE2 3.24Å; S722-F724 WeakPolarHBondContact O-CE2 3.45Å
723	Q	64.8	Low	76.6	Confident	44 Å²	44	32.1 Å²	32.1	21%	0.206	17%	0.166	C	C	.	.			trans	-81.6	128.5	163.7	-46.5	-168.2	-85.4	0	0	108.6	M57 R719 K720 L776	M57-Q723 PolarHBondContact O-NE2 2.66Å; R719-Q723 PolarHBondContact O-N 3.05Å; K720-Q723 PolarHBondContact O-N 3.11Å; Q723-L776 HydrophobicContact CB-CD1 3.48Å; Q723-L776 VanDerWaalsContact CB-CD1 3.48Å
724	F	71.5	Confident	77.8	Confident	48 Å²	48	32.9 Å²	32.9	21%	0.211	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	150.4	-176.2	-66.8	-91.9	0	0	0	110.8	E698 S722 Y775 L776	E698-F724 HydrophobicContact CB-CD2 4.22Å; E698-F724 HydrophobicContact CB-CE2 3.8Å; E698-F724 HydrophobicContact CB-CZ 4.49Å; E698-F724 HydrophobicContact CG-CD2 4.03Å; E698-F724 HydrophobicContact CG-CE2 3.88Å; E698-F724 HydrophobicContact CG-CZ 4.36Å; S722-F724 WeakPolarHBondContact O-CD2 3.35Å; S722-F724 VanDerWaalsContact O-CE2 3.24Å; S722-F724 WeakPolarHBondContact O-CE2 3.45Å; F724-Y775 HydrophobicContact CB-CD1 4.31Å; F724-Y775 HydrophobicContact CB-CE1 4.27Å; F724-Y775 WeakPolarHBondContact O-CA 3.37Å; F724-Y775 WeakPolarHBondContact O-CD1 3.37Å; F724-L776 PolarHBondContact O-N 3.27Å
725	E	79.5	Confident	78.9	Confident	69 Å²	69	30.8 Å²	30.8	32%	0.322	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	146.1	163.6	-66.5	178.9	-156.4	0	0	109.1	K556 Q727 L776	K556-E725 WeakPolarHBondContact CE-OE2 3.43Å; K556-E725 IonicContact NZ-OE1 2.9Å; K556-E725 PolarHBondContact NZ-OE1 3.13Å; K556-E725 IonicContact NZ-OE2 3.14Å; K556-E725 PolarHBondContact NZ-OE2 2.88Å; E725-Q727 PolarHBondContact O-N 3.5Å; E725-L776 HydrophobicContact CG-CB 4.21Å
726	F	85.5	Confident	80.1	Confident	4 Å²	4	27.5 Å²	27.5	2%	0.018	14%	0.144	C	C	.	.			trans	-66.1	131	178.8	-174.2	-116.7	0	0	0	110.6	Y125 F728 F731 L771 Y775	Y125-F726 HydrophobicContact CD1-CE1 4Å; Y125-F726 HydrophobicContact CD1-CZ 4.4Å; Y125-F726 HydrophobicContact CD2-CE1 4.02Å; Y125-F726 AromaticContact CE1-CE1 3.81Å; Y125-F726 HydrophobicContact CE1-CE1 3.81Å; Y125-F726 AromaticContact CE1-CZ 3.79Å; Y125-F726 HydrophobicContact CE1-CZ 3.79Å; Y125-F726 AromaticContact CE2-CE1 3.81Å; Y125-F726 HydrophobicContact CE2-CE1 3.81Å; Y125-F726 HydrophobicContact CE2-CZ 4.2Å; Y125-F726 HydrophobicContact CG-CE1 4.14Å; Y125-F726 AromaticContact CZ-CE1 3.72Å; Y125-F726 AromaticContact CZ-CZ 3.69Å; F726-F728 VanDerWaalsContact C-N 3.34Å; F726-F728 HydrophobicContact CB-CD2 4.2Å; F726-F728 HydrophobicContact CB-CE2 3.97Å; F726-F728 HydrophobicContact CD1-CD1 4.07Å; F726-F728 AromaticContact CD1-CD2 3.5Å; F726-F728 HydrophobicContact CD1-CD2 3.5Å; F726-F728 VanDerWaalsContact CD1-CD2 3.5Å; F726-F728 HydrophobicContact CD1-CE1 4.16Å; F726-F728 AromaticContact CD1-CE2 3.59Å; F726-F728 HydrophobicContact CD1-CE2 3.59Å; F726-F728 AromaticContact CD1-CG 3.75Å; F726-F728 HydrophobicContact CD1-CG 3.75Å; F726-F728 AromaticContact CD1-CZ 3.93Å; F726-F728 HydrophobicContact CD1-CZ 3.93Å; F726-F728 HydrophobicContact CE1-CD1 4.26Å; F726-F728 HydrophobicContact CE1-CD2 4.37Å; F726-F728 HydrophobicContact CE1-CG 4.18Å; F726-F728 HydrophobicContact CG-CD2 4.28Å; F726-F728 HydrophobicContact CG-CE2 4.27Å; F726-F728 WeakPolarHBondContact O-CD2 3.33Å; F726-F728 PolarHBondContact O-N 2.91Å; F726-F728 VanDerWaalsContact O-N 3.1Å; F726-F731 AromaticContact CD2-CD2 3.81Å; F726-F731 HydrophobicContact CD2-CD2 3.81Å; F726-F731 AromaticContact CD2-CE2 3.8Å; F726-F731 HydrophobicContact CD2-CE2 3.8Å; F726-F731 HydrophobicContact CE1-CB 4.38Å; F726-F731 HydrophobicContact CE1-CD2 4.2Å; F726-F731 HydrophobicContact CE2-CB 4.32Å; F726-F731 HydrophobicContact CE2-CD1 4.33Å; F726-F731 AromaticContact CE2-CD2 3.21Å; F726-F731 HydrophobicContact CE2-CD2 3.21Å; F726-F731 AromaticContact CE2-CE2 3.47Å; F726-F731 HydrophobicContact CE2-CE2 3.47Å; F726-F731 VanDerWaalsContact CE2-CE2 3.47Å; F726-F731 AromaticContact CE2-CG 3.71Å; F726-F731 HydrophobicContact CE2-CG 3.71Å; F726-F731 HydrophobicContact CE2-CZ 4.16Å; F726-F731 HydrophobicContact CZ-CB 3.72Å; F726-F731 HydrophobicContact CZ-CD1 4.47Å; F726-F731 AromaticContact CZ-CD2 3.45Å; F726-F731 HydrophobicContact CZ-CD2 3.45Å; F726-F731 VanDerWaalsContact CZ-CD2 3.45Å; F726-F731 HydrophobicContact CZ-CE2 4.19Å; F726-F731 AromaticContact CZ-CG 3.63Å; F726-F731 HydrophobicContact CZ-CG 3.63Å; F726-L771 HydrophobicContact CB-CD2 3.88Å; F726-L771 HydrophobicContact CD1-CD2 3.63Å; F726-L771 HydrophobicContact CD2-CD2 3.88Å; F726-L771 HydrophobicContact CE1-CD2 4.09Å; F726-L771 HydrophobicContact CE2-CD2 4.3Å; F726-L771 HydrophobicContact CG-CD2 3.52Å; F726-L771 HydrophobicContact CZ-CD2 4.4Å; F726-Y775 HydrophobicContact CB-CD1 4.18Å; F726-Y775 HydrophobicContact CB-CD2 4.37Å; F726-Y775 HydrophobicContact CB-CG 3.97Å; F726-Y775 HydrophobicContact CD2-CD1 4.3Å; F726-Y775 AromaticContact CD2-CD2 3.59Å; F726-Y775 HydrophobicContact CD2-CD2 3.59Å; F726-Y775 HydrophobicContact CD2-CE1 4.26Å; F726-Y775 AromaticContact CD2-CE2 3.54Å; F726-Y775 HydrophobicContact CD2-CE2 3.54Å; F726-Y775 AromaticContact CD2-CG 4Å; F726-Y775 HydrophobicContact CD2-CG 4Å; F726-Y775 AromaticContact CD2-CZ 3.9Å; F726-Y775 HydrophobicContact CE2-CD2 4.36Å; F726-Y775 HydrophobicContact CE2-CE2 4.01Å; F726-Y775 HydrophobicContact CG-CD2 4.4Å; F726-Y775 HydrophobicContact CG-CG 4.47Å
727	Q	88.8	Confident	81.4	Confident	30 Å²	30	25.8 Å²	25.8	14%	0.14	13%	0.13	C	C	.	.			trans	-92.1	65.4	-172.4	-61.4	-179	25.2	0	0	110.9	F545 E725 G729 L730 F731	F545-Q727 VanDerWaalsContact CE1-OE1 3.27Å; F545-Q727 HydrophobicContact CE2-CG 4.21Å; F545-Q727 HydrophobicContact CZ-CG 4.16Å; F545-Q727 VanDerWaalsContact CZ-OE1 3.31Å; E725-Q727 PolarHBondContact O-N 3.5Å; Q727-G729 VanDerWaalsContact C-N 3.26Å; Q727-G729 PolarHBondContact O-N 2.95Å; Q727-L730 HydrophobicContact CB-CB 3.9Å; Q727-L730 HydrophobicContact CB-CD2 4.32Å; Q727-L730 WeakPolarHBondContact O-CA 3.48Å; Q727-L730 VanDerWaalsContact O-CB 3.29Å; Q727-L730 WeakPolarHBondContact O-CB 3.49Å; Q727-L730 PolarHBondContact O-N 3.43Å; Q727-F731 HydrophobicContact CB-CD2 4.19Å; Q727-F731 HydrophobicContact CB-CE2 4.1Å; Q727-F731 WeakPolarHBondContact O-CD2 3.22Å; Q727-F731 PolarHBondContact O-N 2.92Å
728	F	90.6	Very high	82.7	Confident	4 Å²	4	25 Å²	25	2%	0.018	12%	0.122	C	C	.	.	H	α-helix	trans	-42.7	-47.9	-171.9	-74.8	-106.7	0	0	0	114.1	D121 A122 Y125 F726 L730 F731 Y732 S778 I780 I784	D121-F728 HydrophobicContact CB-CE1 4.11Å; D121-F728 HydrophobicContact CB-CZ 3.97Å; D121-F728 WeakPolarHBondContact O-CE1 3.37Å; A122-F728 HydrophobicContact CB-CZ 4.33Å; Y125-F728 AromaticContact CD2-CD1 3.76Å; Y125-F728 HydrophobicContact CD2-CD1 3.76Å; Y125-F728 HydrophobicContact CD2-CE1 4.27Å; Y125-F728 HydrophobicContact CG-CD1 4.09Å; Y125-F728 HydrophobicContact CG-CE1 4.13Å; F726-F728 VanDerWaalsContact C-N 3.34Å; F726-F728 HydrophobicContact CB-CD2 4.2Å; F726-F728 HydrophobicContact CB-CE2 3.97Å; F726-F728 HydrophobicContact CD1-CD1 4.07Å; F726-F728 AromaticContact CD1-CD2 3.5Å; F726-F728 HydrophobicContact CD1-CD2 3.5Å; F726-F728 VanDerWaalsContact CD1-CD2 3.5Å; F726-F728 HydrophobicContact CD1-CE1 4.16Å; F726-F728 AromaticContact CD1-CE2 3.59Å; F726-F728 HydrophobicContact CD1-CE2 3.59Å; F726-F728 AromaticContact CD1-CG 3.75Å; F726-F728 HydrophobicContact CD1-CG 3.75Å; F726-F728 AromaticContact CD1-CZ 3.93Å; F726-F728 HydrophobicContact CD1-CZ 3.93Å; F726-F728 HydrophobicContact CE1-CD1 4.26Å; F726-F728 HydrophobicContact CE1-CD2 4.37Å; F726-F728 HydrophobicContact CE1-CG 4.18Å; F726-F728 HydrophobicContact CG-CD2 4.28Å; F726-F728 HydrophobicContact CG-CE2 4.27Å; F726-F728 WeakPolarHBondContact O-CD2 3.33Å; F726-F728 PolarHBondContact O-N 2.91Å; F726-F728 VanDerWaalsContact O-N 3.1Å; F728-L730 VanDerWaalsContact C-N 3.33Å; F728-L730 PolarHBondContact O-N 3.02Å; F728-F731 PolarHBondContact O-N 3.23Å; F728-Y732 HydrophobicContact CB-CD2 4.47Å; F728-Y732 VanDerWaalsContact O-CB 3.26Å; F728-Y732 WeakPolarHBondContact O-CB 3.41Å; F728-Y732 WeakPolarHBondContact O-CD2 3.29Å; F728-Y732 PolarHBondContact O-N 3.42Å; F728-S778 VanDerWaalsContact CE2-OG 3.29Å; F728-S778 WeakPolarHBondContact CE2-OG 3.16Å; F728-I780 HydrophobicContact CB-CD1 3.83Å; F728-I780 HydrophobicContact CD2-CD1 3.29Å; F728-I780 HydrophobicContact CD2-CG1 4.44Å; F728-I780 HydrophobicContact CE2-CD1 4.01Å; F728-I780 HydrophobicContact CG-CD1 3.74Å; F728-I784 HydrophobicContact CB-CD1 3.86Å
729	G	90	Very high	84	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-67	-26.4	-179.6	0	0	0	0	0	115.6	H560 M564 Q727 A733	H560-G729 WeakPolarHBondContact O-CA 3.08Å; M564-G729 WeakPolarHBondContact CA-O 3.47Å; M564-G729 WeakPolarHBondContact CB-O 3.17Å; Q727-G729 VanDerWaalsContact C-N 3.26Å; Q727-G729 PolarHBondContact O-N 2.95Å; G729-A733 WeakPolarHBondContact O-CB 3.34Å; G729-A733 PolarHBondContact O-N 3.49Å
730	L	91.1	Very high	85.4	Confident	1 Å²	1	20 Å²	20	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-73.5	-55.1	174.1	-179.7	70.8	0	0	0	110.3	P541 Y542 F545 Q727 F728 Y732 A733 W734	P541-L730 VanDerWaalsContact C-CD1 3.43Å; P541-L730 HydrophobicContact CB-CD1 3.36Å; P541-L730 HydrophobicContact CB-CG 4.43Å; P541-L730 VanDerWaalsContact O-CD1 3.23Å; P541-L730 WeakPolarHBondContact O-CD1 3.25Å; Y542-L730 HydrophobicContact CD1-CD2 4Å; Y542-L730 HydrophobicContact CE1-CD2 3.81Å; F545-L730 HydrophobicContact CB-CD1 4.14Å; Q727-L730 HydrophobicContact CB-CB 3.9Å; Q727-L730 HydrophobicContact CB-CD2 4.32Å; Q727-L730 WeakPolarHBondContact O-CA 3.48Å; Q727-L730 VanDerWaalsContact O-CB 3.29Å; Q727-L730 WeakPolarHBondContact O-CB 3.49Å; Q727-L730 PolarHBondContact O-N 3.43Å; F728-L730 VanDerWaalsContact C-N 3.33Å; F728-L730 PolarHBondContact O-N 3.02Å; L730-Y732 PolarHBondContact O-N 3.44Å; L730-A733 PolarHBondContact O-N 3.22Å; L730-W734 PolarHBondContact O-N 3.3Å; L730-W734 VanDerWaalsContact O-N 3.13Å
731	F	92.3	Very high	86.7	Confident	13 Å²	13	14 Å²	14	6%	0.057	7%	0.074	C	C	.	.	H	α-helix	trans	-66.4	-39.1	-176.5	-69	-75.7	0	0	0	112	Y125 F726 Q727 F728 A733 W734 S735 Y775	Y125-F731 HydrophobicContact CE2-CB 4.4Å; Y125-F731 WeakPolarHBondContact OH-CB 3.37Å; F726-F731 AromaticContact CD2-CD2 3.81Å; F726-F731 HydrophobicContact CD2-CD2 3.81Å; F726-F731 AromaticContact CD2-CE2 3.8Å; F726-F731 HydrophobicContact CD2-CE2 3.8Å; F726-F731 HydrophobicContact CE1-CB 4.38Å; F726-F731 HydrophobicContact CE1-CD2 4.2Å; F726-F731 HydrophobicContact CE2-CB 4.32Å; F726-F731 HydrophobicContact CE2-CD1 4.33Å; F726-F731 AromaticContact CE2-CD2 3.21Å; F726-F731 HydrophobicContact CE2-CD2 3.21Å; F726-F731 AromaticContact CE2-CE2 3.47Å; F726-F731 HydrophobicContact CE2-CE2 3.47Å; F726-F731 VanDerWaalsContact CE2-CE2 3.47Å; F726-F731 AromaticContact CE2-CG 3.71Å; F726-F731 HydrophobicContact CE2-CG 3.71Å; F726-F731 HydrophobicContact CE2-CZ 4.16Å; F726-F731 HydrophobicContact CZ-CB 3.72Å; F726-F731 HydrophobicContact CZ-CD1 4.47Å; F726-F731 AromaticContact CZ-CD2 3.45Å; F726-F731 HydrophobicContact CZ-CD2 3.45Å; F726-F731 VanDerWaalsContact CZ-CD2 3.45Å; F726-F731 HydrophobicContact CZ-CE2 4.19Å; F726-F731 AromaticContact CZ-CG 3.63Å; F726-F731 HydrophobicContact CZ-CG 3.63Å; Q727-F731 HydrophobicContact CB-CD2 4.19Å; Q727-F731 HydrophobicContact CB-CE2 4.1Å; Q727-F731 WeakPolarHBondContact O-CD2 3.22Å; Q727-F731 PolarHBondContact O-N 2.92Å; F728-F731 PolarHBondContact O-N 3.23Å; F731-A733 PolarHBondContact O-N 2.86Å; F731-W734 PolarHBondContact O-N 3.34Å; F731-S735 WeakPolarHBondContact O-CB 3.41Å; F731-S735 PolarHBondContact O-N 2.99Å; F731-S735 PolarHBondContact O-OG 3.22Å; F731-Y775 WeakPolarHBondContact CZ-OH 3.25Å
732	Y	94.3	Very high	88.1	Confident	0 Å²	0	11.4 Å²	11.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-56.5	-48.1	171.3	-92.6	-49.1	0	0	0	112.6	Y125 F128 M564 F728 L730 W734 L736 I784 H785 A788	Y125-Y732 HydrophobicContact CD2-CD1 4.1Å; Y125-Y732 AromaticContact CD2-CD2 3.97Å; Y125-Y732 HydrophobicContact CD2-CD2 3.97Å; Y125-Y732 AromaticContact CD2-CE1 3.71Å; Y125-Y732 HydrophobicContact CD2-CE1 3.71Å; Y125-Y732 AromaticContact CD2-CE2 3.6Å; Y125-Y732 HydrophobicContact CD2-CE2 3.6Å; Y125-Y732 HydrophobicContact CD2-CG 4.2Å; Y125-Y732 AromaticContact CD2-CZ 3.45Å; Y125-Y732 VanDerWaalsContact CD2-CZ 3.45Å; Y125-Y732 AromaticContact CE2-CD1 3.82Å; Y125-Y732 HydrophobicContact CE2-CD1 3.82Å; Y125-Y732 HydrophobicContact CE2-CD2 4.05Å; Y125-Y732 AromaticContact CE2-CE1 3.88Å; Y125-Y732 HydrophobicContact CE2-CE1 3.88Å; Y125-Y732 HydrophobicContact CE2-CE2 4.14Å; Y125-Y732 AromaticContact CE2-CG 3.89Å; Y125-Y732 HydrophobicContact CE2-CG 3.89Å; F128-Y732 HydrophobicContact CB-CE1 4.33Å; F128-Y732 HydrophobicContact CD1-CD1 4.24Å; F128-Y732 AromaticContact CD1-CE1 3.52Å; F128-Y732 HydrophobicContact CD1-CE1 3.52Å; F128-Y732 HydrophobicContact CE1-CD1 4.28Å; F128-Y732 AromaticContact CE1-CE1 3.94Å; F128-Y732 HydrophobicContact CE1-CE1 3.94Å; F128-Y732 AromaticContact CG-CE1 3.99Å; F128-Y732 HydrophobicContact CG-CE1 3.99Å; M564-Y732 HydrophobicContact CE-CG 4.15Å; M564-Y732 HydrophobicContact SD-CD2 4.16Å; M564-Y732 HydrophobicContact SD-CG 4.19Å; F728-Y732 HydrophobicContact CB-CD2 4.47Å; F728-Y732 VanDerWaalsContact O-CB 3.26Å; F728-Y732 WeakPolarHBondContact O-CB 3.41Å; F728-Y732 WeakPolarHBondContact O-CD2 3.29Å; F728-Y732 PolarHBondContact O-N 3.42Å; L730-Y732 PolarHBondContact O-N 3.44Å; Y732-W734 PolarHBondContact O-N 2.86Å; Y732-L736 HydrophobicContact CD1-CD1 4.38Å; Y732-L736 VanDerWaalsContact O-CB 3.23Å; Y732-L736 WeakPolarHBondContact O-CB 3.44Å; Y732-L736 WeakPolarHBondContact O-CD1 3.24Å; Y732-L736 WeakPolarHBondContact O-CG 3.36Å; Y732-L736 PolarHBondContact O-N 3.12Å; Y732-I784 HydrophobicContact CD2-CD1 4.2Å; Y732-I784 HydrophobicContact CD2-CG1 4.1Å; Y732-I784 HydrophobicContact CE2-CG1 4.3Å; Y732-I784 HydrophobicContact CE2-CG2 4.38Å; Y732-H785 AromaticContact CE2-ND1 3.98Å; Y732-H785 AromaticContact CZ-ND1 3.79Å; Y732-H785 PolarHBondContact OH-CE1 3.25Å; Y732-H785 PolarHBondContact OH-ND1 3.02Å; Y732-A788 HydrophobicContact CD1-CB 3.96Å; Y732-A788 HydrophobicContact CE1-CB 3.77Å; Y732-A788 HydrophobicContact CE2-CB 4.41Å; Y732-A788 HydrophobicContact CG-CB 4.4Å
733	A	94	Very high	89.6	Confident	0 Å²	0	11.4 Å²	11.4	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-65.6	-38.4	-176.9	0	0	0	0	0	112.6	M564 T567 G729 L730 F731 C737	M564-A733 HydrophobicContact CG-CB 4.39Å; T567-A733 HydrophobicContact CG2-CB 3.68Å; G729-A733 WeakPolarHBondContact O-CB 3.34Å; G729-A733 PolarHBondContact O-N 3.49Å; L730-A733 PolarHBondContact O-N 3.22Å; F731-A733 PolarHBondContact O-N 2.86Å; A733-C737 WeakPolarHBondContact O-CB 3.24Å; A733-C737 PolarHBondContact O-N 2.89Å
734	W	90.9	Very high	90.9	Very high	17 Å²	17	9.3 Å²	9.3	6%	0.064	4%	0.042	C	C	.	.	H	α-helix	trans	-64.6	-57.1	173.9	-168.8	-34.4	0	0	0	110.9	A538 P541 Y542 L730 F731 Y732 L736 C737 V738	A538-W734 HydrophobicContact CB-CH2 3.51Å; A538-W734 HydrophobicContact CB-CZ2 3.99Å; A538-W734 HydrophobicContact CB-CZ3 4.36Å; P541-W734 HydrophobicContact CB-CE3 4.36Å; P541-W734 HydrophobicContact CG-CE3 4.07Å; Y542-W734 HydrophobicContact CE2-CZ3 4.12Å; L730-W734 PolarHBondContact O-N 3.3Å; L730-W734 VanDerWaalsContact O-N 3.13Å; F731-W734 PolarHBondContact O-N 3.34Å; Y732-W734 PolarHBondContact O-N 2.86Å; W734-L736 PolarHBondContact O-N 3.13Å; W734-C737 PolarHBondContact O-N 3.02Å; W734-V738 PolarHBondContact O-N 3.31Å
735	S	93.3	Very high	91.8	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-54.8	-42.2	-179.1	-65.6	0	0	0	0	112	H129 F731 F739 K763	H129-S735 WeakPolarHBondContact NE2-CB 3.31Å; H129-S735 PolarHBondContact NE2-OG 3.19Å; F731-S735 WeakPolarHBondContact O-CB 3.41Å; F731-S735 PolarHBondContact O-N 2.99Å; F731-S735 PolarHBondContact O-OG 3.22Å; S735-F739 WeakPolarHBondContact O-CB 3.33Å; S735-F739 PolarHBondContact O-N 3.43Å; S735-K763 WeakPolarHBondContact OG-CE 3.38Å
736	L	95.2	Very high	92.5	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-71.8	-29.3	178.9	-75.2	163	0	0	0	113.3	F128 L132 M564 Y568 Y732 W734 F739 A740 A788 C791 M792	F128-L736 HydrophobicContact CE1-CD1 4.39Å; F128-L736 HydrophobicContact CE1-CD2 4Å; F128-L736 HydrophobicContact CE1-CG 4.37Å; F128-L736 HydrophobicContact CZ-CD2 4.02Å; L132-L736 HydrophobicContact CD2-CD2 4.5Å; M564-L736 HydrophobicContact CE-CD1 3.56Å; Y568-L736 HydrophobicContact CD2-CB 3.93Å; Y568-L736 HydrophobicContact CE2-CB 3.9Å; Y732-L736 HydrophobicContact CD1-CD1 4.38Å; Y732-L736 VanDerWaalsContact O-CB 3.23Å; Y732-L736 WeakPolarHBondContact O-CB 3.44Å; Y732-L736 WeakPolarHBondContact O-CD1 3.24Å; Y732-L736 WeakPolarHBondContact O-CG 3.36Å; Y732-L736 PolarHBondContact O-N 3.12Å; W734-L736 PolarHBondContact O-N 3.13Å; L736-F739 HydrophobicContact CD2-CD1 4.46Å; L736-A740 WeakPolarHBondContact O-CB 3.31Å; L736-A740 PolarHBondContact O-N 3.37Å; L736-A788 HydrophobicContact CD1-CB 4.17Å; L736-C791 HydrophobicContact CD1-CB 3.87Å; L736-M792 HydrophobicContact CD2-CB 3.88Å
737	C	93.2	Very high	92.8	Very high	2 Å²	2	3.8 Å²	3.8	1%	0.014	2%	0.017	C	C	.	.	H	α-helix	trans	-72.7	-41.2	173.3	-169.1	0	0	0	0	112.4	L571 A733 W734 F739 A740 V741	L571-C737 HydrophobicContact CB-CB 3.84Å; L571-C737 WeakPolarHBondContact CB-SG 3.39Å; L571-C737 HydrophobicContact CD1-CB 3.91Å; A733-C737 WeakPolarHBondContact O-CB 3.24Å; A733-C737 PolarHBondContact O-N 2.89Å; W734-C737 PolarHBondContact O-N 3.02Å; C737-F739 VanDerWaalsContact C-N 3.34Å; C737-A740 WeakPolarHBondContact O-CB 3.31Å; C737-A740 PolarHBondContact O-N 3.2Å; C737-A740 VanDerWaalsContact O-N 3.16Å; C737-V741 PolarHBondContact O-N 2.87Å
738	V	92.9	Very high	92.8	Very high	1 Å²	1	3 Å²	3	1%	0.006	2%	0.015	C	C	.	.	H	α-helix	trans	-66.9	-40.3	175.3	-178.8	0	0	0	0	110	W734 A740 V741 I742 Y759	W734-V738 PolarHBondContact O-N 3.31Å; V738-A740 VanDerWaalsContact C-N 3.29Å; V738-A740 PolarHBondContact O-N 2.85Å; V738-V741 PolarHBondContact O-N 3.38Å; V738-I742 HydrophobicContact CG1-CD1 4Å; V738-I742 WeakPolarHBondContact O-CD1 3.4Å; V738-I742 VanDerWaalsContact O-CG1 3.27Å; V738-I742 WeakPolarHBondContact O-CG1 3.36Å; V738-I742 PolarHBondContact O-N 3.28Å; V738-Y759 HydrophobicContact CB-CD1 4.26Å; V738-Y759 HydrophobicContact CB-CE1 3.66Å; V738-Y759 HydrophobicContact CG1-CD1 3.59Å; V738-Y759 HydrophobicContact CG1-CD2 4.24Å; V738-Y759 HydrophobicContact CG1-CE1 3.49Å; V738-Y759 VanDerWaalsContact CG1-CE1 3.49Å; V738-Y759 HydrophobicContact CG1-CE2 4.16Å; V738-Y759 HydrophobicContact CG1-CG 3.99Å; V738-Y759 HydrophobicContact CG2-CE1 4.31Å; V738-Y759 HydrophobicContact CG2-CE2 4.47Å
739	F	96.3	Very high	92.7	Very high	0 Å²	0	2.9 Å²	2.9	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-56.6	-39.4	169.1	179.2	-95.6	0	0	0	112.8	L132 Y135 S735 L736 C737 I742 C743 L760 M792 V796	L132-F739 HydrophobicContact CB-CD2 4.23Å; L132-F739 HydrophobicContact CB-CE2 4.26Å; L132-F739 HydrophobicContact CD1-CD2 4.48Å; L132-F739 HydrophobicContact CD2-CD1 4.4Å; L132-F739 HydrophobicContact CD2-CD2 3.96Å; L132-F739 HydrophobicContact CD2-CE1 4.31Å; L132-F739 HydrophobicContact CD2-CE2 3.84Å; L132-F739 HydrophobicContact CD2-CG 4.24Å; L132-F739 HydrophobicContact CD2-CZ 4.03Å; L132-F739 HydrophobicContact CG-CD2 4.45Å; Y135-F739 AromaticContact CD1-CE2 3.64Å; Y135-F739 HydrophobicContact CD1-CE2 3.64Å; Y135-F739 AromaticContact CD1-CZ 3.55Å; Y135-F739 HydrophobicContact CD1-CZ 3.55Å; Y135-F739 HydrophobicContact CE1-CE2 4.08Å; Y135-F739 AromaticContact CE1-CZ 3.7Å; Y135-F739 HydrophobicContact CE1-CZ 3.7Å; Y135-F739 HydrophobicContact CG-CZ 4.39Å; S735-F739 WeakPolarHBondContact O-CB 3.33Å; S735-F739 PolarHBondContact O-N 3.43Å; L736-F739 HydrophobicContact CD2-CD1 4.46Å; C737-F739 VanDerWaalsContact C-N 3.34Å; F739-I742 PolarHBondContact O-N 3.49Å; F739-C743 WeakPolarHBondContact CE1-SG 3.21Å; F739-C743 WeakPolarHBondContact CZ-SG 3.2Å; F739-C743 WeakPolarHBondContact O-CB 3.44Å; F739-C743 PolarHBondContact O-N 2.88Å; F739-C743 PolarHBondContact O-SG 3.24Å; F739-L760 HydrophobicContact CD2-CD1 4.17Å; F739-M792 HydrophobicContact CD1-CG 4.19Å; F739-M792 HydrophobicContact CE1-CB 4.45Å; F739-M792 HydrophobicContact CE1-CE 4.32Å; F739-M792 HydrophobicContact CE1-CG 3.42Å; F739-M792 VanDerWaalsContact CE1-CG 3.42Å; F739-M792 HydrophobicContact CZ-CE 3.78Å; F739-M792 HydrophobicContact CZ-CG 3.84Å; F739-M792 HydrophobicContact CZ-SD 4.46Å; F739-V796 HydrophobicContact CE1-CG2 4.24Å; F739-V796 HydrophobicContact CZ-CG2 4.43Å
740	A	94.8	Very high	92.9	Very high	0 Å²	0	2.9 Å²	2.9	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-66.2	-40.4	175.6	0	0	0	0	0	113.1	I572 L736 C737 V738 C743 A744 S795	I572-A740 HydrophobicContact CD1-CB 3.32Å; L736-A740 WeakPolarHBondContact O-CB 3.31Å; L736-A740 PolarHBondContact O-N 3.37Å; C737-A740 WeakPolarHBondContact O-CB 3.31Å; C737-A740 PolarHBondContact O-N 3.2Å; C737-A740 VanDerWaalsContact O-N 3.16Å; V738-A740 VanDerWaalsContact C-N 3.29Å; V738-A740 PolarHBondContact O-N 2.85Å; A740-C743 PolarHBondContact O-N 3.5Å; A740-A744 WeakPolarHBondContact O-CB 3.5Å; A740-A744 PolarHBondContact O-N 3.48Å; A740-S795 WeakPolarHBondContact CB-OG 3.39Å
741	V	91.9	Very high	92.9	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-61.9	-46.2	173.2	173.5	0	0	0	0	110.7	I575 F677 V681 C737 V738 C743 A744 Y745 I752	I575-V741 HydrophobicContact CG2-CG2 3.79Å; F677-V741 HydrophobicContact CB-CG1 3.99Å; F677-V741 HydrophobicContact CD1-CG1 3.59Å; F677-V741 HydrophobicContact CE1-CG1 4.4Å; F677-V741 HydrophobicContact CG-CG1 3.98Å; V681-V741 HydrophobicContact CG2-CG1 4.22Å; C737-V741 PolarHBondContact O-N 2.87Å; V738-V741 PolarHBondContact O-N 3.38Å; V741-C743 PolarHBondContact O-N 2.94Å; V741-A744 PolarHBondContact O-N 3.44Å; V741-Y745 HydrophobicContact CG1-CD2 4.48Å; V741-Y745 PolarHBondContact O-N 3.38Å; V741-I752 HydrophobicContact CG1-CD1 4.01Å
742	I	95.2	Very high	93	Very high	3 Å²	3	3.7 Å²	3.7	2%	0.015	2%	0.019	C	C	.	.	H	α-helix	trans	-59.4	-46.1	176.3	-63.6	157.8	0	0	0	110.6	T136 V681 V738 F739 S746 Y759	T136-I742 HydrophobicContact CG2-CG2 4.18Å; V681-I742 HydrophobicContact CG1-CG1 4.39Å; V681-I742 HydrophobicContact CG2-CG1 4.18Å; V738-I742 HydrophobicContact CG1-CD1 4Å; V738-I742 WeakPolarHBondContact O-CD1 3.4Å; V738-I742 VanDerWaalsContact O-CG1 3.27Å; V738-I742 WeakPolarHBondContact O-CG1 3.36Å; V738-I742 PolarHBondContact O-N 3.28Å; F739-I742 PolarHBondContact O-N 3.49Å; I742-S746 WeakPolarHBondContact O-CA 3.3Å; I742-S746 WeakPolarHBondContact O-CB 3.26Å; I742-S746 PolarHBondContact O-N 2.81Å; I742-Y759 HydrophobicContact CD1-CD1 4.36Å
743	C	95	Very high	93	Very high	3 Å²	3	3.7 Å²	3.7	2%	0.02	2%	0.019	C	C	.	.	H	α-helix	trans	-63.4	-54.2	177.7	-71.8	0	0	0	0	111.6	F739 A740 V741 Y745 S746 L799	F739-C743 WeakPolarHBondContact CE1-SG 3.21Å; F739-C743 WeakPolarHBondContact CZ-SG 3.2Å; F739-C743 WeakPolarHBondContact O-CB 3.44Å; F739-C743 PolarHBondContact O-N 2.88Å; F739-C743 PolarHBondContact O-SG 3.24Å; A740-C743 PolarHBondContact O-N 3.5Å; V741-C743 PolarHBondContact O-N 2.94Å; C743-Y745 PolarHBondContact O-N 3.41Å; C743-Y745 VanDerWaalsContact O-N 3.15Å; C743-S746 WeakPolarHBondContact O-CB 3.4Å; C743-S746 PolarHBondContact O-N 3.32Å; C743-S746 PolarHBondContact O-OG 3.13Å; C743-L799 WeakPolarHBondContact O-CD1 3.38Å
744	A	92	Very high	93.2	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-58.1	-30	-173.3	0	0	0	0	0	113.9	L576 A740 V741 N802	L576-A744 HydrophobicContact CD1-CB 3.74Å; L576-A744 HydrophobicContact CD2-CB 3.72Å; L576-A744 HydrophobicContact CG-CB 4.39Å; A740-A744 WeakPolarHBondContact O-CB 3.5Å; A740-A744 PolarHBondContact O-N 3.48Å; V741-A744 PolarHBondContact O-N 3.44Å; A744-N802 PolarHBondContact O-ND2 3.36Å
745	Y	90.5	Very high	93.4	Very high	3 Å²	3	5.6 Å²	5.6	1%	0.012	3%	0.031	C	C	.	.	H	α-helix	trans	-102.8	-5.3	175.6	-73.2	-80.3	0	0	0	114.6	L576 S580 F677 V741 C743 I747 V748 C749	L576-Y745 HydrophobicContact CD1-CD2 4.34Å; L576-Y745 HydrophobicContact CD1-CE2 3.63Å; S580-Y745 PolarHBondContact OG-OH 3.33Å; S580-Y745 VanDerWaalsContact OG-OH 3.14Å; F677-Y745 HydrophobicContact CB-CD2 4.21Å; F677-Y745 HydrophobicContact CB-CE2 4.39Å; F677-Y745 AromaticContact CD2-CD2 3.84Å; F677-Y745 HydrophobicContact CD2-CD2 3.84Å; F677-Y745 HydrophobicContact CD2-CE1 4.13Å; F677-Y745 AromaticContact CD2-CE2 3.17Å; F677-Y745 HydrophobicContact CD2-CE2 3.17Å; F677-Y745 AromaticContact CD2-CZ 3.37Å; F677-Y745 AromaticContact CE2-CE2 3.49Å; F677-Y745 HydrophobicContact CE2-CE2 3.49Å; F677-Y745 VanDerWaalsContact CE2-CE2 3.49Å; F677-Y745 AromaticContact CE2-CZ 3.55Å; F677-Y745 VanDerWaalsContact CE2-OH 3.22Å; F677-Y745 WeakPolarHBondContact CE2-OH 3.36Å; F677-Y745 HydrophobicContact CG-CD2 4.07Å; F677-Y745 AromaticContact CG-CE2 3.79Å; F677-Y745 HydrophobicContact CG-CE2 3.79Å; F677-Y745 HydrophobicContact CZ-CE2 4.29Å; V741-Y745 HydrophobicContact CG1-CD2 4.48Å; V741-Y745 PolarHBondContact O-N 3.38Å; C743-Y745 PolarHBondContact O-N 3.41Å; C743-Y745 VanDerWaalsContact O-N 3.15Å; Y745-I747 VanDerWaalsContact C-N 3.26Å; Y745-I747 PolarHBondContact O-N 3.02Å; Y745-I747 VanDerWaalsContact O-N 3.09Å; Y745-V748 HydrophobicContact CD1-CB 4.21Å; Y745-V748 HydrophobicContact CD1-CG1 4.13Å; Y745-V748 HydrophobicContact CE1-CG1 4.49Å; Y745-V748 PolarHBondContact O-N 3.38Å; Y745-V748 VanDerWaalsContact O-N 3.17Å; Y745-C749 CarbonylContact O-C 3.5Å; Y745-C749 WeakPolarHBondContact O-CA 3.43Å; Y745-C749 PolarHBondContact O-N 2.92Å
746	S	93.8	Very high	93.5	Very high	2 Å²	2	5.6 Å²	5.6	1%	0.014	3%	0.031	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-35.1	-174.5	59.6	0	0	0	0	115.4	C143 I742 C743 P750 L799	C143-S746 PolarHBondContact SG-O 3.34Å; I742-S746 WeakPolarHBondContact O-CA 3.3Å; I742-S746 WeakPolarHBondContact O-CB 3.26Å; I742-S746 PolarHBondContact O-N 2.81Å; C743-S746 WeakPolarHBondContact O-CB 3.4Å; C743-S746 PolarHBondContact O-N 3.32Å; C743-S746 PolarHBondContact O-OG 3.13Å; S746-P750 WeakPolarHBondContact O-CA 3.49Å; S746-L799 WeakPolarHBondContact OG-CD2 3.44Å
747	I	93	Very high	93.7	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.04	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-31.4	178.9	-67.8	178.1	0	0	0	111.6	I147 H182 F185 F189 Y745 L799 I803	I147-I747 HydrophobicContact CG2-CG2 4.43Å; H182-I747 HydrophobicContact CB-CG2 3.87Å; F185-I747 HydrophobicContact CB-CD1 4.01Å; F189-I747 HydrophobicContact CD2-CD1 3.85Å; F189-I747 HydrophobicContact CD2-CG1 4.21Å; F189-I747 HydrophobicContact CE2-CD1 3.94Å; F189-I747 HydrophobicContact CE2-CG1 3.87Å; Y745-I747 VanDerWaalsContact C-N 3.26Å; Y745-I747 PolarHBondContact O-N 3.02Å; Y745-I747 VanDerWaalsContact O-N 3.09Å; I747-L799 HydrophobicContact CB-CD1 4.03Å; I747-L799 HydrophobicContact CD1-CD1 4.24Å; I747-L799 HydrophobicContact CD1-CD2 4.19Å; I747-L799 HydrophobicContact CG1-CD1 4.21Å; I747-I803 HydrophobicContact CB-CD1 4.06Å; I747-I803 HydrophobicContact CD1-CD1 3.8Å; I747-I803 HydrophobicContact CG1-CD1 4.49Å; I747-I803 HydrophobicContact CG2-CD1 3.89Å; I747-I803 HydrophobicContact CG2-CG1 4.38Å
748	V	88.6	Confident	93.9	Very high	14 Å²	14	9.8 Å²	9.8	9%	0.085	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-43.2	178	177	0	0	0	0	111.4	T168 I169 Y745	T168-V748 VanDerWaalsContact CA-O 3.26Å; T168-V748 WeakPolarHBondContact CA-O 3.43Å; T168-V748 VanDerWaalsContact CB-O 3.31Å; T168-V748 WeakPolarHBondContact CB-O 3.43Å; I169-V748 HydrophobicContact CG2-CB 4.25Å; I169-V748 HydrophobicContact CG2-CG1 3.84Å; I169-V748 HydrophobicContact CG2-CG2 4.48Å; I169-V748 PolarHBondContact N-O 3.21Å; Y745-V748 HydrophobicContact CD1-CB 4.21Å; Y745-V748 HydrophobicContact CD1-CG1 4.13Å; Y745-V748 HydrophobicContact CE1-CG1 4.49Å; Y745-V748 PolarHBondContact O-N 3.38Å; Y745-V748 VanDerWaalsContact O-N 3.17Å
749	C	89.4	Confident	94.1	Very high	1 Å²	1	9.9 Å²	9.9	1%	0.007	5%	0.053	C	C	.	.	S	Bend	trans	-137.9	87.2	178.2	-179.9	0	0	0	0	109.7	F164 T168 Y745 L751 I752	F164-C749 WeakPolarHBondContact CZ-SG 3.32Å; T168-C749 HydrophobicContact CG2-CB 4.18Å; Y745-C749 CarbonylContact O-C 3.5Å; Y745-C749 WeakPolarHBondContact O-CA 3.43Å; Y745-C749 PolarHBondContact O-N 2.92Å; C749-L751 PolarHBondContact O-N 2.8Å; C749-I752 WeakPolarHBondContact O-CG2 3.33Å; C749-I752 PolarHBondContact O-N 3.26Å; C749-I752 VanDerWaalsContact O-N 3.15Å
750	P	93.7	Very high	94.1	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-28.5	-177.8	-33	39.4	0	0	0	116	C143 I147 L148 N151 S746 I752 T753	C143-P750 HydrophobicContact CB-CB 4.07Å; C143-P750 WeakPolarHBondContact O-CB 3.3Å; I147-P750 HydrophobicContact CB-CG 3.9Å; I147-P750 HydrophobicContact CG2-CG 3.6Å; L148-P750 HydrophobicContact CB-CB 3.9Å; L148-P750 HydrophobicContact CB-CG 4.21Å; L148-P750 HydrophobicContact CD1-CB 4.5Å; N151-P750 WeakPolarHBondContact ND2-CD 3.22Å; S746-P750 WeakPolarHBondContact O-CA 3.49Å; P750-I752 PolarHBondContact O-N 3.49Å; P750-I752 VanDerWaalsContact O-N 3.17Å; P750-T753 WeakPolarHBondContact O-CB 3.45Å; P750-T753 PolarHBondContact O-N 3.02Å; P750-T753 VanDerWaalsContact O-N 3.07Å; P750-T753 PolarHBondContact O-OG1 2.83Å
751	L	91.2	Very high	94.2	Very high	32 Å²	32	12.7 Å²	12.7	17%	0.168	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.4	-178.9	-169.8	68.3	0	0	0	113.7	Y23 I26 F164 V678 C749 T753 P754 F755	Y23-L751 HydrophobicContact CE1-CD2 3.63Å; I26-L751 HydrophobicContact CD1-CD2 4.46Å; F164-L751 HydrophobicContact CE2-CD2 4.21Å; V678-L751 HydrophobicContact CG1-CD2 4.42Å; C749-L751 PolarHBondContact O-N 2.8Å; L751-T753 PolarHBondContact O-N 3.48Å; L751-P754 VanDerWaalsContact O-CD 3.28Å; L751-P754 WeakPolarHBondContact O-CD 3.42Å; L751-P754 WeakPolarHBondContact O-CG 3.42Å; L751-F755 HydrophobicContact CD1-CE2 4.22Å; L751-F755 HydrophobicContact CD2-CE2 4.4Å; L751-F755 HydrophobicContact CG-CD2 4.47Å; L751-F755 HydrophobicContact CG-CE2 3.99Å; L751-F755 WeakPolarHBondContact O-CD2 3.35Å
752	I	93.4	Very high	94.4	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.7	-24.8	175.5	-155.4	169.4	0	0	0	112.5	F677 V678 V681 V741 C749 P750 G756	F677-I752 HydrophobicContact CB-CD1 3.92Å; V678-I752 HydrophobicContact CG2-CB 3.96Å; V678-I752 HydrophobicContact CG2-CG1 4.21Å; V681-I752 HydrophobicContact CB-CG1 4.36Å; V681-I752 HydrophobicContact CG2-CD1 3.96Å; V681-I752 HydrophobicContact CG2-CG1 4.01Å; V741-I752 HydrophobicContact CG1-CD1 4.01Å; C749-I752 WeakPolarHBondContact O-CG2 3.33Å; C749-I752 PolarHBondContact O-N 3.26Å; C749-I752 VanDerWaalsContact O-N 3.15Å; P750-I752 PolarHBondContact O-N 3.49Å; P750-I752 VanDerWaalsContact O-N 3.17Å; I752-G756 PolarHBondContact O-N 2.96Å
753	T	95.6	Very high	94.4	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-68.3	-47.3	-172.5	63.1	0	0	0	0	114.8	T140 C143 P750 L751 F755 G756 L757	T140-T753 WeakPolarHBondContact OG1-CB 3.48Å; T140-T753 PolarHBondContact OG1-O 3.33Å; C143-T753 HydrophobicContact CB-CG2 3.98Å; P750-T753 WeakPolarHBondContact O-CB 3.45Å; P750-T753 PolarHBondContact O-N 3.02Å; P750-T753 VanDerWaalsContact O-N 3.07Å; P750-T753 PolarHBondContact O-OG1 2.83Å; L751-T753 PolarHBondContact O-N 3.48Å; T753-F755 PolarHBondContact O-N 2.95Å; T753-G756 PolarHBondContact O-N 3.1Å; T753-L757 WeakPolarHBondContact O-CB 3.42Å; T753-L757 PolarHBondContact O-N 3.16Å
754	P	96.6	Very high	94.4	Very high	32 Å²	32	16.9 Å²	16.9	21%	0.208	8%	0.084	C	C	.	.	H	α-helix	trans	-62.1	-40.8	174.3	23.2	-35.3	0	0	0	113.2	T140 L144 L751 L757 I758	T140-P754 HydrophobicContact CG2-CB 4.31Å; L144-P754 HydrophobicContact CD1-CB 4.46Å; L144-P754 HydrophobicContact CD1-CG 4.37Å; L144-P754 HydrophobicContact CD2-CG 4.41Å; L751-P754 VanDerWaalsContact O-CD 3.28Å; L751-P754 WeakPolarHBondContact O-CD 3.42Å; L751-P754 WeakPolarHBondContact O-CG 3.42Å; P754-L757 PolarHBondContact O-N 3Å; P754-I758 WeakPolarHBondContact O-CG1 3.45Å; P754-I758 PolarHBondContact O-N 3.15Å
755	F	95.7	Very high	94.5	Very high	25 Å²	25	20.6 Å²	20.6	11%	0.11	10%	0.101	C	C	.	.	H	α-helix	trans	-68.4	-35.8	176.7	-62.3	-61.4	0	0	0	112.1	L30 V678 V681 I682 L751 T753 I758 Y759	L30-F755 HydrophobicContact CD1-CD1 4.46Å; L30-F755 HydrophobicContact CD1-CE1 3.86Å; L30-F755 HydrophobicContact CD2-CE1 3.91Å; L30-F755 HydrophobicContact CD2-CZ 4.15Å; L30-F755 HydrophobicContact CG-CE1 4.5Å; V678-F755 HydrophobicContact CG1-CD2 3.89Å; V678-F755 HydrophobicContact CG1-CE2 4.05Å; V681-F755 HydrophobicContact CG1-CB 4.02Å; I682-F755 HydrophobicContact CD1-CD1 4.21Å; I682-F755 HydrophobicContact CD1-CD2 4.07Å; I682-F755 HydrophobicContact CD1-CE1 4.13Å; I682-F755 HydrophobicContact CD1-CE2 3.98Å; I682-F755 HydrophobicContact CD1-CG 4.18Å; I682-F755 HydrophobicContact CD1-CZ 4.01Å; I682-F755 HydrophobicContact CG1-CB 4.13Å; I682-F755 HydrophobicContact CG1-CD1 3.73Å; I682-F755 HydrophobicContact CG1-CD2 4.06Å; I682-F755 HydrophobicContact CG1-CE1 4.12Å; I682-F755 HydrophobicContact CG1-CE2 4.41Å; I682-F755 HydrophobicContact CG1-CG 3.7Å; I682-F755 HydrophobicContact CG1-CZ 4.44Å; L751-F755 HydrophobicContact CD1-CE2 4.22Å; L751-F755 HydrophobicContact CD2-CE2 4.4Å; L751-F755 HydrophobicContact CG-CD2 4.47Å; L751-F755 HydrophobicContact CG-CE2 3.99Å; L751-F755 WeakPolarHBondContact O-CD2 3.35Å; T753-F755 PolarHBondContact O-N 2.95Å; F755-I758 HydrophobicContact CD1-CD1 4.42Å; F755-I758 PolarHBondContact O-N 3.33Å; F755-Y759 PolarHBondContact O-N 3.15Å
756	G	96.6	Very high	94.6	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-65.2	-37.2	172.3	0	0	0	0	0	113.6	I752 T753 Y759 L760	I752-G756 PolarHBondContact O-N 2.96Å; T753-G756 PolarHBondContact O-N 3.1Å; G756-Y759 WeakPolarHBondContact O-CB 3.49Å; G756-Y759 PolarHBondContact O-N 3.23Å; G756-L760 WeakPolarHBondContact O-CG 3.08Å; G756-L760 PolarHBondContact O-N 3.21Å
757	L	97.9	Very high	94.5	Very high	34 Å²	34	21 Å²	21	18%	0.178	10%	0.103	C	C	.	.	H	α-helix	trans	-64.3	-43.7	172.7	-177.9	59.4	0	0	0	111.3	I133 T136 A137 T753 P754 L760 I761	I133-L757 HydrophobicContact CG2-CD1 4.14Å; T136-L757 HydrophobicContact CG2-CB 4.2Å; T136-L757 HydrophobicContact CG2-CD1 4.5Å; A137-L757 HydrophobicContact CB-CD1 3.96Å; A137-L757 HydrophobicContact CB-CD2 4.25Å; T753-L757 WeakPolarHBondContact O-CB 3.42Å; T753-L757 PolarHBondContact O-N 3.16Å; P754-L757 PolarHBondContact O-N 3Å; L757-L760 PolarHBondContact O-N 2.96Å; L757-I761 HydrophobicContact CD1-CD1 3.89Å; L757-I761 HydrophobicContact CD1-CG1 4.24Å; L757-I761 HydrophobicContact CG-CD1 3.82Å; L757-I761 WeakPolarHBondContact O-CB 3.32Å; L757-I761 VanDerWaalsContact O-CG1 3.23Å; L757-I761 WeakPolarHBondContact O-CG1 3.38Å; L757-I761 PolarHBondContact O-N 3.04Å
758	I	97.2	Very high	94.5	Very high	55 Å²	55	22.9 Å²	22.9	28%	0.282	11%	0.11	S	C	.	.	H	α-helix	trans	-59.7	-46	174.1	-66.6	165.1	0	0	0	110.8	A685 F686 P754 F755 L760 I761 F762	A685-I758 HydrophobicContact CB-CG2 4.43Å; F686-I758 HydrophobicContact CZ-CG2 4.42Å; P754-I758 WeakPolarHBondContact O-CG1 3.45Å; P754-I758 PolarHBondContact O-N 3.15Å; F755-I758 HydrophobicContact CD1-CD1 4.42Å; F755-I758 PolarHBondContact O-N 3.33Å; I758-L760 PolarHBondContact O-N 3.03Å; I758-I761 PolarHBondContact O-N 3.22Å; I758-F762 HydrophobicContact CG2-CD1 4.4Å; I758-F762 HydrophobicContact CG2-CD2 4.17Å; I758-F762 HydrophobicContact CG2-CE1 4.21Å; I758-F762 HydrophobicContact CG2-CE2 3.96Å; I758-F762 HydrophobicContact CG2-CG 4.39Å; I758-F762 HydrophobicContact CG2-CZ 3.99Å; I758-F762 WeakPolarHBondContact O-CB 3.32Å; I758-F762 PolarHBondContact O-N 3.46Å
759	Y	97.2	Very high	94.5	Very high	3 Å²	3	22.8 Å²	22.8	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-53.4	-54.4	174.4	169.9	-97	0	0	0	111.6	A684 T689 V738 I742 F755 G756 I761 F762 K763	A684-Y759 HydrophobicContact CB-CD2 4.14Å; A684-Y759 HydrophobicContact CB-CE2 4.22Å; T689-Y759 HydrophobicContact CG2-CD2 4.24Å; T689-Y759 HydrophobicContact CG2-CE2 4.25Å; V738-Y759 HydrophobicContact CB-CD1 4.26Å; V738-Y759 HydrophobicContact CB-CE1 3.66Å; V738-Y759 HydrophobicContact CG1-CD1 3.59Å; V738-Y759 HydrophobicContact CG1-CD2 4.24Å; V738-Y759 HydrophobicContact CG1-CE1 3.49Å; V738-Y759 VanDerWaalsContact CG1-CE1 3.49Å; V738-Y759 HydrophobicContact CG1-CE2 4.16Å; V738-Y759 HydrophobicContact CG1-CG 3.99Å; V738-Y759 HydrophobicContact CG2-CE1 4.31Å; V738-Y759 HydrophobicContact CG2-CE2 4.47Å; I742-Y759 HydrophobicContact CD1-CD1 4.36Å; F755-Y759 PolarHBondContact O-N 3.15Å; G756-Y759 WeakPolarHBondContact O-CB 3.49Å; G756-Y759 PolarHBondContact O-N 3.23Å; Y759-I761 VanDerWaalsContact C-N 3.33Å; Y759-I761 PolarHBondContact O-N 2.69Å; Y759-F762 PolarHBondContact O-N 3.46Å; Y759-K763 HydrophobicContact CE1-CG 4.46Å; Y759-K763 WeakPolarHBondContact O-CB 3.49Å; Y759-K763 PolarHBondContact O-N 2.71Å
760	L	97.4	Very high	94.4	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-64.6	-37	-176.3	-68.2	171.6	0	0	0	112.6	L132 I133 T136 F739 G756 L757 I758 Y764	L132-L760 HydrophobicContact CB-CD1 4.26Å; L132-L760 HydrophobicContact CB-CD2 4.33Å; L132-L760 HydrophobicContact CD1-CD2 4.35Å; I133-L760 HydrophobicContact CG1-CB 3.82Å; T136-L760 HydrophobicContact CG2-CD1 3.98Å; T136-L760 WeakPolarHBondContact OG1-CD1 3.39Å; F739-L760 HydrophobicContact CD2-CD1 4.17Å; G756-L760 WeakPolarHBondContact O-CG 3.08Å; G756-L760 PolarHBondContact O-N 3.21Å; L757-L760 PolarHBondContact O-N 2.96Å; I758-L760 PolarHBondContact O-N 3.03Å; L760-Y764 WeakPolarHBondContact O-CB 3.38Å; L760-Y764 PolarHBondContact O-N 3.33Å
761	I	97.2	Very high	94.1	Very high	57 Å²	57	23.4 Å²	23.4	29%	0.292	11%	0.112	S	C	.	.	H	α-helix	trans	-64.1	-53.8	175.6	-71.5	171.5	0	0	0	110.1	I133 L757 I758 Y759 K763 Y764 F765	I133-I761 HydrophobicContact CD1-CG1 4.31Å; I133-I761 HydrophobicContact CG1-CG1 4.41Å; I133-I761 HydrophobicContact CG2-CG1 4.07Å; L757-I761 HydrophobicContact CD1-CD1 3.89Å; L757-I761 HydrophobicContact CD1-CG1 4.24Å; L757-I761 HydrophobicContact CG-CD1 3.82Å; L757-I761 WeakPolarHBondContact O-CB 3.32Å; L757-I761 VanDerWaalsContact O-CG1 3.23Å; L757-I761 WeakPolarHBondContact O-CG1 3.38Å; L757-I761 PolarHBondContact O-N 3.04Å; I758-I761 PolarHBondContact O-N 3.22Å; Y759-I761 VanDerWaalsContact C-N 3.33Å; Y759-I761 PolarHBondContact O-N 2.69Å; I761-K763 VanDerWaalsContact C-N 3.33Å; I761-K763 PolarHBondContact O-N 2.97Å; I761-Y764 PolarHBondContact O-N 3.11Å; I761-F765 HydrophobicContact CG2-CD2 3.74Å; I761-F765 HydrophobicContact CG2-CE2 3.5Å; I761-F765 WeakPolarHBondContact O-CD2 3.3Å; I761-F765 PolarHBondContact O-N 3.28Å
762	F	95.6	Very high	93.7	Very high	51 Å²	51	24.4 Å²	24.4	22%	0.224	11%	0.113	C	C	.	.	H	α-helix	trans	-60.3	-42.3	178.7	-76.3	7.7	0	0	0	111.8	W37 A685 F686 T689 I758 Y759 Y764 F765 V766	W37-F762 AromaticContact CE2-CE2 3.92Å; W37-F762 HydrophobicContact CZ2-CE2 4.2Å; W37-F762 HydrophobicContact CZ2-CZ 4.11Å; W37-F762 AromaticContact NE1-CD2 3.87Å; W37-F762 AromaticContact NE1-CE2 3.49Å; A685-F762 WeakPolarHBondContact O-CD2 3.46Å; F686-F762 HydrophobicContact CD1-CE2 4.01Å; F686-F762 AromaticContact CE1-CE2 3.83Å; F686-F762 HydrophobicContact CE1-CE2 3.83Å; F686-F762 HydrophobicContact CE1-CZ 4.35Å; T689-F762 HydrophobicContact CG2-CB 4.03Å; I758-F762 HydrophobicContact CG2-CD1 4.4Å; I758-F762 HydrophobicContact CG2-CD2 4.17Å; I758-F762 HydrophobicContact CG2-CE1 4.21Å; I758-F762 HydrophobicContact CG2-CE2 3.96Å; I758-F762 HydrophobicContact CG2-CG 4.39Å; I758-F762 HydrophobicContact CG2-CZ 3.99Å; I758-F762 WeakPolarHBondContact O-CB 3.32Å; I758-F762 PolarHBondContact O-N 3.46Å; Y759-F762 PolarHBondContact O-N 3.46Å; F762-Y764 PolarHBondContact O-N 2.97Å; F762-F765 PolarHBondContact O-N 3.17Å; F762-V766 WeakPolarHBondContact O-CB 3.41Å; F762-V766 WeakPolarHBondContact O-CG2 3.41Å; F762-V766 PolarHBondContact O-N 3.13Å
763	K	95.6	Very high	93.1	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-55.4	-49.1	174.8	-175.6	59.9	159.8	158.9	0	111.7	T689 E692 S735 Y759 I761 F765 V766 E767	T689-K763 HydrophobicContact CG2-CB 4.35Å; E692-K763 IonicContact OE1-NZ 3.79Å; E692-K763 PolarHBondContact OE1-NZ 3.32Å; E692-K763 VanDerWaalsContact OE2-CD 3.31Å; E692-K763 WeakPolarHBondContact OE2-CD 3.49Å; E692-K763 IonicContact OE2-NZ 3.75Å; E692-K763 PolarHBondContact OE2-NZ 3.16Å; S735-K763 WeakPolarHBondContact OG-CE 3.38Å; Y759-K763 HydrophobicContact CE1-CG 4.46Å; Y759-K763 WeakPolarHBondContact O-CB 3.49Å; Y759-K763 PolarHBondContact O-N 2.71Å; I761-K763 VanDerWaalsContact C-N 3.33Å; I761-K763 PolarHBondContact O-N 2.97Å; K763-F765 PolarHBondContact O-N 3.44Å; K763-V766 PolarHBondContact O-N 3.47Å; K763-E767 HydrophobicContact CD-CG 4.15Å; K763-E767 WeakPolarHBondContact CE-OE1 3.36Å; K763-E767 IonicContact NZ-OE1 2.72Å; K763-E767 PolarHBondContact NZ-OE1 3.37Å; K763-E767 WeakPolarHBondContact O-CB 3.45Å; K763-E767 WeakPolarHBondContact O-CG 3.44Å; K763-E767 PolarHBondContact O-N 3.03Å
764	Y	95.5	Very high	92.2	Very high	44 Å²	44	27 Å²	27	17%	0.173	13%	0.128	C	C	.	.	H	α-helix	trans	-62.1	-42.1	176.7	173.7	-95.4	0	0	0	113.2	L126 H129 F130 I133 L760 I761 F762 R768	L126-Y764 HydrophobicContact CB-CE2 4.01Å; L126-Y764 HydrophobicContact CD2-CD2 4.11Å; L126-Y764 HydrophobicContact CD2-CE2 4.24Å; L126-Y764 WeakPolarHBondContact O-CE2 3.28Å; H129-Y764 HydrophobicContact CB-CD2 4.15Å; F130-Y764 HydrophobicContact CB-CE2 4.33Å; I133-Y764 HydrophobicContact CD1-CD1 4.42Å; I133-Y764 HydrophobicContact CD1-CD2 4.49Å; I133-Y764 HydrophobicContact CD1-CG 3.97Å; L760-Y764 WeakPolarHBondContact O-CB 3.38Å; L760-Y764 PolarHBondContact O-N 3.33Å; I761-Y764 PolarHBondContact O-N 3.11Å; F762-Y764 PolarHBondContact O-N 2.97Å; Y764-R768 VanDerWaalsContact O-CB 3.28Å; Y764-R768 WeakPolarHBondContact O-CB 3.49Å; Y764-R768 PolarHBondContact O-N 2.87Å
765	F	93.6	Very high	91.4	Very high	77 Å²	77	26.2 Å²	26.2	34%	0.338	12%	0.121	S	C	.	.	H	α-helix	trans	-60.8	-49.5	175	-81.7	-72.6	0	0	0	111.8	Y106 F107 I761 F762 K763 R768 Y769	Y106-F765 HydrophobicContact CD1-CD1 4.39Å; Y106-F765 AromaticContact CE1-CD1 3.43Å; Y106-F765 HydrophobicContact CE1-CD1 3.43Å; Y106-F765 VanDerWaalsContact CE1-CD1 3.43Å; Y106-F765 AromaticContact CE1-CE1 3.56Å; Y106-F765 HydrophobicContact CE1-CE1 3.56Å; Y106-F765 HydrophobicContact CE2-CD1 4.39Å; Y106-F765 AromaticContact CZ-CD1 3.42Å; Y106-F765 VanDerWaalsContact CZ-CD1 3.42Å; Y106-F765 AromaticContact CZ-CE1 3.89Å; Y106-F765 WeakPolarHBondContact OH-CD1 3.47Å; F107-F765 AromaticContact CE1-CE1 3.88Å; F107-F765 HydrophobicContact CE1-CE1 3.88Å; F107-F765 HydrophobicContact CE1-CZ 4.45Å; F107-F765 AromaticContact CZ-CE1 3.95Å; F107-F765 HydrophobicContact CZ-CE1 3.95Å; F107-F765 HydrophobicContact CZ-CZ 4.47Å; I761-F765 HydrophobicContact CG2-CD2 3.74Å; I761-F765 HydrophobicContact CG2-CE2 3.5Å; I761-F765 WeakPolarHBondContact O-CD2 3.3Å; I761-F765 PolarHBondContact O-N 3.28Å; F762-F765 PolarHBondContact O-N 3.17Å; K763-F765 PolarHBondContact O-N 3.44Å; F765-R768 PolarHBondContact O-N 3.32Å; F765-Y769 PolarHBondContact O-N 2.78Å; F765-Y769 VanDerWaalsContact O-N 3.09Å
766	V	92.6	Very high	90.4	Very high	9 Å²	9	27.4 Å²	27.4	6%	0.055	13%	0.128	C	C	.	.	H	α-helix	trans	-64.2	-45.4	-179	168.2	0	0	0	0	111.8	E692 L693 F762 K763 Y769 N770	E692-V766 HydrophobicContact CB-CG1 3.99Å; L693-V766 HydrophobicContact CB-CG1 3.84Å; L693-V766 HydrophobicContact CB-CG2 3.98Å; L693-V766 HydrophobicContact CD1-CG1 4.24Å; L693-V766 HydrophobicContact CD1-CG2 4.33Å; L693-V766 HydrophobicContact CD2-CG2 4.49Å; L693-V766 HydrophobicContact CG-CG2 4.49Å; F762-V766 WeakPolarHBondContact O-CB 3.41Å; F762-V766 WeakPolarHBondContact O-CG2 3.41Å; F762-V766 PolarHBondContact O-N 3.13Å; K763-V766 PolarHBondContact O-N 3.47Å; V766-Y769 PolarHBondContact O-N 3.44Å; V766-N770 WeakPolarHBondContact O-CB 3.5Å; V766-N770 PolarHBondContact O-N 3.38Å
767	E	92	Very high	89.3	Confident	4 Å²	4	31.1 Å²	31.1	2%	0.019	15%	0.152	C	C	.	.	H	α-helix	trans	-68.6	-37.6	-179.6	-70.2	-174.3	150.4	0	0	112.2	Y125 L126 H129 K763 N770 L771	Y125-E767 HydrophobicContact CE1-CB 4.45Å; Y125-E767 WeakPolarHBondContact CE1-OE2 3.38Å; Y125-E767 PolarHBondContact OH-OE1 3.25Å; Y125-E767 PolarHBondContact OH-OE2 2.87Å; L126-E767 HydrophobicContact CD2-CB 4.21Å; H129-E767 IonicContact CD2-OE2 2.81Å; H129-E767 IonicContact CE1-OE2 2.66Å; H129-E767 IonicContact NE2-OE2 3.86Å; K763-E767 HydrophobicContact CD-CG 4.15Å; K763-E767 WeakPolarHBondContact CE-OE1 3.36Å; K763-E767 IonicContact NZ-OE1 2.72Å; K763-E767 PolarHBondContact NZ-OE1 3.37Å; K763-E767 WeakPolarHBondContact O-CB 3.45Å; K763-E767 WeakPolarHBondContact O-CG 3.44Å; K763-E767 PolarHBondContact O-N 3.03Å; E767-N770 PolarHBondContact O-N 2.85Å; E767-L771 VanDerWaalsContact O-CB 3.23Å; E767-L771 WeakPolarHBondContact O-CB 3.33Å; E767-L771 VanDerWaalsContact O-CG 3.23Å; E767-L771 WeakPolarHBondContact O-CG 3.32Å; E767-L771 PolarHBondContact O-N 3.35Å
768	R	92	Very high	88.1	Confident	40 Å²	40	29.9 Å²	29.9	15%	0.151	15%	0.146	C	C	.	.	H	α-helix	trans	-65.3	-39.5	174.5	-179.3	171.5	164.2	-157.5	4.7	112.5	Y106 L109 L126 Y764 F765 Y772	Y106-R768 HydrophobicContact CE2-CB 4.01Å; Y106-R768 HydrophobicContact CE2-CG 3.81Å; Y106-R768 WeakPolarHBondContact OH-CD 3.4Å; Y106-R768 PolarHBondContact OH-NH1 3.04Å; Y106-R768 VanDerWaalsContact OH-NH1 3.11Å; L109-R768 PolarHBondContact O-NH2 3.4Å; L126-R768 HydrophobicContact CD1-CB 3.64Å; L126-R768 HydrophobicContact CD1-CG 3.71Å; L126-R768 HydrophobicContact CD2-CB 4.09Å; Y764-R768 VanDerWaalsContact O-CB 3.28Å; Y764-R768 WeakPolarHBondContact O-CB 3.49Å; Y764-R768 PolarHBondContact O-N 2.87Å; F765-R768 PolarHBondContact O-N 3.32Å; R768-Y772 PolarHBondContact O-N 2.94Å
769	Y	88.4	Confident	86.8	Confident	13 Å²	13	33.4 Å²	33.4	5%	0.051	16%	0.156	C	C	.	.	H	α-helix	trans	-62.3	-51.5	173	-179.5	-86.8	0	0	0	111.1	F44 R48 W102 Y106 L693 F765 V766 L771 Y772 Y773	F44-Y769 AromaticContact CZ-CE1 3.83Å; F44-Y769 HydrophobicContact CZ-CE1 3.83Å; R48-Y769 PolarHBondContact NH1-OH 3Å; W102-Y769 HydrophobicContact CB-CE2 4.41Å; W102-Y769 HydrophobicContact CE3-CD2 4.06Å; W102-Y769 AromaticContact CE3-CE2 3.85Å; W102-Y769 HydrophobicContact CE3-CE2 3.85Å; W102-Y769 HydrophobicContact CZ3-CD2 4.45Å; Y106-Y769 HydrophobicContact CD2-CD2 4.46Å; L693-Y769 HydrophobicContact CD1-CD1 3.59Å; L693-Y769 HydrophobicContact CD1-CE1 4.17Å; L693-Y769 HydrophobicContact CD1-CG 4.1Å; F765-Y769 PolarHBondContact O-N 2.78Å; F765-Y769 VanDerWaalsContact O-N 3.09Å; V766-Y769 PolarHBondContact O-N 3.44Å; Y769-L771 PolarHBondContact O-N 3.02Å; Y769-Y772 PolarHBondContact O-N 3.34Å; Y769-Y773 HydrophobicContact CD1-CD2 4.23Å; Y769-Y773 AromaticContact CD2-CD2 3.56Å; Y769-Y773 HydrophobicContact CD2-CD2 3.56Å; Y769-Y773 AromaticContact CD2-CE2 3.72Å; Y769-Y773 HydrophobicContact CD2-CE2 3.72Å; Y769-Y773 HydrophobicContact CE1-CD2 4.07Å; Y769-Y773 AromaticContact CE2-CD2 3.38Å; Y769-Y773 HydrophobicContact CE2-CD2 3.38Å; Y769-Y773 AromaticContact CE2-CE2 3.51Å; Y769-Y773 HydrophobicContact CE2-CE2 3.51Å; Y769-Y773 HydrophobicContact CE2-CG 4.33Å; Y769-Y773 AromaticContact CG-CD2 3.98Å; Y769-Y773 HydrophobicContact CG-CD2 3.98Å; Y769-Y773 AromaticContact CZ-CD2 3.65Å; Y769-Y773 WeakPolarHBondContact O-CD2 3.23Å; Y769-Y773 PolarHBondContact O-N 3.34Å
770	N	88.4	Confident	85.7	Confident	9 Å²	9	33.4 Å²	33.4	5%	0.048	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-39.4	-177.6	-83.9	-25.4	0	0	0	113.1	E692 V766 E767 Y772 A774 Y775	E692-N770 PolarHBondContact O-ND2 2.9Å; V766-N770 WeakPolarHBondContact O-CB 3.5Å; V766-N770 PolarHBondContact O-N 3.38Å; E767-N770 PolarHBondContact O-N 2.85Å; N770-Y772 PolarHBondContact O-N 3.47Å; N770-A774 HydrophobicContact CB-CB 4.4Å; N770-A774 WeakPolarHBondContact O-CA 3.41Å; N770-A774 VanDerWaalsContact O-CB 3.25Å; N770-A774 WeakPolarHBondContact O-CB 3.4Å; N770-A774 PolarHBondContact O-N 3.16Å; N770-Y775 HydrophobicContact CB-CD2 4.09Å; N770-Y775 HydrophobicContact CB-CE2 3.85Å; N770-Y775 WeakPolarHBondContact O-CD2 3.4Å; N770-Y775 PolarHBondContact O-N 3.36Å
771	L	86.6	Confident	84.7	Confident	5 Å²	5	33.8 Å²	33.8	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-27.5	176.9	-80.8	167.9	0	0	0	113.2	L114 A122 Y125 L126 F726 E767 Y769	L114-L771 HydrophobicContact CD1-CB 4.18Å; A122-L771 HydrophobicContact CB-CD1 4.42Å; A122-L771 HydrophobicContact CB-CD2 4.11Å; Y125-L771 HydrophobicContact CD1-CD1 4.05Å; Y125-L771 HydrophobicContact CE1-CD1 4.48Å; L126-L771 HydrophobicContact CD1-CD1 4.13Å; L126-L771 HydrophobicContact CD2-CD1 3.91Å; L126-L771 HydrophobicContact CG-CD1 3.78Å; F726-L771 HydrophobicContact CB-CD2 3.88Å; F726-L771 HydrophobicContact CD1-CD2 3.63Å; F726-L771 HydrophobicContact CD2-CD2 3.88Å; F726-L771 HydrophobicContact CE1-CD2 4.09Å; F726-L771 HydrophobicContact CE2-CD2 4.3Å; F726-L771 HydrophobicContact CG-CD2 3.52Å; F726-L771 HydrophobicContact CZ-CD2 4.4Å; E767-L771 VanDerWaalsContact O-CB 3.23Å; E767-L771 WeakPolarHBondContact O-CB 3.33Å; E767-L771 VanDerWaalsContact O-CG 3.23Å; E767-L771 WeakPolarHBondContact O-CG 3.32Å; E767-L771 PolarHBondContact O-N 3.35Å; Y769-L771 PolarHBondContact O-N 3.02Å
772	Y	83.4	Confident	83.8	Confident	53 Å²	53	31.8 Å²	31.8	21%	0.208	15%	0.149	C	C	.	.	H	α-helix	trans	-89.4	-46.2	177.6	-171.4	-107.7	0	0	0	113	L109 D113 L114 K117 R768 Y769 N770	L109-Y772 HydrophobicContact CD1-CD1 3.88Å; L109-Y772 HydrophobicContact CD1-CD2 3.63Å; L109-Y772 HydrophobicContact CD1-CE1 3.7Å; L109-Y772 HydrophobicContact CD1-CE2 3.45Å; L109-Y772 VanDerWaalsContact CD1-CE2 3.45Å; L109-Y772 HydrophobicContact CD1-CG 3.83Å; L109-Y772 VanDerWaalsContact CD1-CZ 3.48Å; L109-Y772 HydrophobicContact CD2-CD1 3.85Å; L109-Y772 HydrophobicContact CD2-CD2 3.99Å; L109-Y772 HydrophobicContact CD2-CE1 4.5Å; L109-Y772 HydrophobicContact CD2-CG 3.54Å; L109-Y772 HydrophobicContact CG-CD2 4.44Å; L109-Y772 HydrophobicContact CG-CG 4.36Å; D113-Y772 HydrophobicContact CB-CE2 4.28Å; L114-Y772 HydrophobicContact CD1-CD2 4.2Å; K117-Y772 HydrophobicContact CB-CD2 4.01Å; K117-Y772 HydrophobicContact CB-CE2 3.81Å; K117-Y772 HydrophobicContact CG-CD2 4.03Å; K117-Y772 HydrophobicContact CG-CE2 3.97Å; R768-Y772 PolarHBondContact O-N 2.94Å; Y769-Y772 PolarHBondContact O-N 3.34Å; N770-Y772 PolarHBondContact O-N 3.47Å
773	Y	79.2	Confident	83.1	Confident	33 Å²	33	30.6 Å²	30.6	13%	0.129	14%	0.144	C	C	.	.	H	α-helix	trans	-96.9	-13.1	-170.5	-70.3	-69.2	0	0	0	115.3	A58 Y769	A58-Y773 WeakPolarHBondContact CB-O 3.47Å; Y769-Y773 HydrophobicContact CD1-CD2 4.23Å; Y769-Y773 AromaticContact CD2-CD2 3.56Å; Y769-Y773 HydrophobicContact CD2-CD2 3.56Å; Y769-Y773 AromaticContact CD2-CE2 3.72Å; Y769-Y773 HydrophobicContact CD2-CE2 3.72Å; Y769-Y773 HydrophobicContact CE1-CD2 4.07Å; Y769-Y773 AromaticContact CE2-CD2 3.38Å; Y769-Y773 HydrophobicContact CE2-CD2 3.38Å; Y769-Y773 AromaticContact CE2-CE2 3.51Å; Y769-Y773 HydrophobicContact CE2-CE2 3.51Å; Y769-Y773 HydrophobicContact CE2-CG 4.33Å; Y769-Y773 AromaticContact CG-CD2 3.98Å; Y769-Y773 HydrophobicContact CG-CD2 3.98Å; Y769-Y773 AromaticContact CZ-CD2 3.65Å; Y769-Y773 WeakPolarHBondContact O-CD2 3.23Å; Y769-Y773 PolarHBondContact O-N 3.34Å
774	A	77	Confident	82.7	Confident	20 Å²	20	30.8 Å²	30.8	17%	0.165	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.7	-21.2	-161.3	0	0	0	0	0	116.1	R695 N770	R695-A774 PolarHBondContact NH1-O 2.93Å; N770-A774 HydrophobicContact CB-CB 4.4Å; N770-A774 WeakPolarHBondContact O-CA 3.41Å; N770-A774 VanDerWaalsContact O-CB 3.25Å; N770-A774 WeakPolarHBondContact O-CB 3.4Å; N770-A774 PolarHBondContact O-N 3.16Å
775	Y	80.6	Confident	82.3	Confident	17 Å²	17	28.8 Å²	28.8	7%	0.067	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	153.8	-177.2	-71.6	-69.8	0	0	0	113.2	E698 F724 F726 F731 N770	E698-Y775 PolarHBondContact OE1-OH 3.49Å; F724-Y775 HydrophobicContact CB-CD1 4.31Å; F724-Y775 HydrophobicContact CB-CE1 4.27Å; F724-Y775 WeakPolarHBondContact O-CA 3.37Å; F724-Y775 WeakPolarHBondContact O-CD1 3.37Å; F726-Y775 HydrophobicContact CB-CD1 4.18Å; F726-Y775 HydrophobicContact CB-CD2 4.37Å; F726-Y775 HydrophobicContact CB-CG 3.97Å; F726-Y775 HydrophobicContact CD2-CD1 4.3Å; F726-Y775 AromaticContact CD2-CD2 3.59Å; F726-Y775 HydrophobicContact CD2-CD2 3.59Å; F726-Y775 HydrophobicContact CD2-CE1 4.26Å; F726-Y775 AromaticContact CD2-CE2 3.54Å; F726-Y775 HydrophobicContact CD2-CE2 3.54Å; F726-Y775 AromaticContact CD2-CG 4Å; F726-Y775 HydrophobicContact CD2-CG 4Å; F726-Y775 AromaticContact CD2-CZ 3.9Å; F726-Y775 HydrophobicContact CE2-CD2 4.36Å; F726-Y775 HydrophobicContact CE2-CE2 4.01Å; F726-Y775 HydrophobicContact CG-CD2 4.4Å; F726-Y775 HydrophobicContact CG-CG 4.47Å; F731-Y775 WeakPolarHBondContact CZ-OH 3.25Å; N770-Y775 HydrophobicContact CB-CD2 4.09Å; N770-Y775 HydrophobicContact CB-CE2 3.85Å; N770-Y775 WeakPolarHBondContact O-CD2 3.4Å; N770-Y775 PolarHBondContact O-N 3.36Å
776	L	74.8	Confident	82	Confident	49 Å²	49	25.9 Å²	25.9	26%	0.257	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	148.7	169.4	-87.4	77.2	0	0	0	111.7	Q723 F724 E725 S778	Q723-L776 HydrophobicContact CB-CD1 3.48Å; Q723-L776 VanDerWaalsContact CB-CD1 3.48Å; F724-L776 PolarHBondContact O-N 3.27Å; E725-L776 HydrophobicContact CG-CB 4.21Å; L776-S778 PolarHBondContact O-N 3.04Å
777	P	73.7	Confident	82	Confident	79 Å²	79	26.6 Å²	26.6	51%	0.513	13%	0.128	S	C	.	.			trans	-65.1	119.7	169.6	27.4	-34.1	0	0	0	110.9	A118	A118-P777 WeakPolarHBondContact O-CB 3.35Å
778	S	71.7	Confident	82.1	Confident	8 Å²	8	26.4 Å²	26.4	6%	0.056	13%	0.127	C	C	.	.			trans	-110.7	133.5	170.8	61.3	0	0	0	0	110.1	F728 L776	F728-S778 VanDerWaalsContact CE2-OG 3.29Å; F728-S778 WeakPolarHBondContact CE2-OG 3.16Å; L776-S778 PolarHBondContact O-N 3.04Å
779	R	70.4	Confident	82.2	Confident	129 Å²	129	24.7 Å²	24.7	49%	0.487	12%	0.121	S	C	.	.			trans	-86.7	117.2	167	-64.2	-169.2	-170.5	-179.4	6.4	109.4	D121	D121-R779 WeakPolarHBondContact OD2-CA 3.24Å
780	I	75.1	Confident	82.4	Confident	3 Å²	3	24.8 Å²	24.8	2%	0.015	12%	0.123	C	C	.	.			trans	-116.7	166.8	178.6	-68.3	179.6	0	0	0	108.6	D121 N213 H560 F728 I784	D121-I780 PolarHBondContact OD2-N 2.98Å; N213-I780 PolarHBondContact ND2-O 2.83Å; H560-I780 HydrophobicContact CB-CD1 4.49Å; H560-I780 WeakPolarHBondContact CD2-CD1 3.14Å; F728-I780 HydrophobicContact CB-CD1 3.83Å; F728-I780 HydrophobicContact CD2-CD1 3.29Å; F728-I780 HydrophobicContact CD2-CG1 4.44Å; F728-I780 HydrophobicContact CE2-CD1 4.01Å; F728-I780 HydrophobicContact CG-CD1 3.74Å; I780-I784 HydrophobicContact CG2-CB 4.36Å; I780-I784 HydrophobicContact CG2-CD1 4.23Å; I780-I784 HydrophobicContact CG2-CG2 3.94Å
781	D	74.8	Confident	82.7	Confident	10 Å²	10	24.9 Å²	24.9	5%	0.053	12%	0.124	C	C	.	.			trans	-88.4	143.6	179.9	-173.3	64.6	0	0	0	115.1	N213 S557 H783 I784 P969	N213-D781 PolarHBondContact ND2-OD1 2.71Å; S557-D781 WeakPolarHBondContact OG-CB 3.34Å; S557-D781 PolarHBondContact OG-N 3.12Å; S557-D781 VanDerWaalsContact OG-N 3.13Å; D781-H783 PolarHBondContact O-N 2.81Å; D781-H783 WeakPolarHBondContact OD2-CB 3.06Å; D781-H783 IonicContact OD2-CD2 3.49Å; D781-H783 PolarHBondContact OD2-CD2 2.81Å; D781-H783 IonicContact OD2-CG 3.52Å; D781-H783 PolarHBondContact OD2-N 3.06Å; D781-I784 WeakPolarHBondContact O-CG2 3.13Å; D781-I784 PolarHBondContact O-N 3.15Å; D781-I784 VanDerWaalsContact O-N 3.08Å; D781-P969 HydrophobicContact CB-CB 4.16Å; D781-P969 HydrophobicContact CB-CG 3.76Å; D781-P969 VanDerWaalsContact OD1-CB 3.27Å; D781-P969 WeakPolarHBondContact OD1-CB 3.47Å; D781-P969 WeakPolarHBondContact OD2-CB 3.42Å; D781-P969 WeakPolarHBondContact OD2-CG 3.06Å
782	S	77.9	Confident	83.1	Confident	15 Å²	15	24.6 Å²	24.6	11%	0.105	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-24.3	176.9	-71.6	0	0	0	0	115.6	S208 I784 H785	S208-S782 WeakPolarHBondContact OG-CB 3.34Å; S208-S782 PolarHBondContact OG-OG 3.35Å; S782-I784 PolarHBondContact O-N 3.02Å; S782-H785 PolarHBondContact O-N 3.11Å
783	H	81.4	Confident	83.8	Confident	25 Å²	25	22.1 Å²	22.1	12%	0.116	11%	0.113	C	C	.	.	H	α-helix	trans	-53.9	-31.3	172.7	-88.6	-108	0	0	0	113.2	L561 D781 H785 W786 L787 A844 G845 H968	L561-H783 HydrophobicContact CD1-CB 4.46Å; D781-H783 PolarHBondContact O-N 2.81Å; D781-H783 WeakPolarHBondContact OD2-CB 3.06Å; D781-H783 IonicContact OD2-CD2 3.49Å; D781-H783 PolarHBondContact OD2-CD2 2.81Å; D781-H783 IonicContact OD2-CG 3.52Å; D781-H783 PolarHBondContact OD2-N 3.06Å; H783-H785 VanDerWaalsContact C-N 3.34Å; H783-H785 PolarHBondContact O-N 3.4Å; H783-W786 PolarHBondContact O-N 3.09Å; H783-L787 PolarHBondContact O-N 2.88Å; H783-A844 WeakPolarHBondContact CD2-CB 3.2Å; H783-A844 VanDerWaalsContact CE1-CB 3.49Å; H783-A844 WeakPolarHBondContact CE1-CB 3.39Å; H783-A844 VanDerWaalsContact NE2-CB 3.28Å; H783-A844 WeakPolarHBondContact NE2-CB 3.46Å; H783-A844 PolarHBondContact NE2-O 3.09Å; H783-G845 PolarHBondContact NE2-N 2.98Å; H783-H968 PolarHBondContact NE2-O 2.95Å; H783-H968 VanDerWaalsContact NE2-O 3.15Å
784	I	87.1	Confident	84.5	Confident	4 Å²	4	21.8 Å²	21.8	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-65.6	-36	-177.4	-158.5	169	0	0	0	112.6	H560 M564 F728 Y732 I780 D781 S782 L787 A788	H560-I784 HydrophobicContact CB-CD1 3.86Å; M564-I784 HydrophobicContact SD-CG1 3.86Å; F728-I784 HydrophobicContact CB-CD1 3.86Å; Y732-I784 HydrophobicContact CD2-CD1 4.2Å; Y732-I784 HydrophobicContact CD2-CG1 4.1Å; Y732-I784 HydrophobicContact CE2-CG1 4.3Å; Y732-I784 HydrophobicContact CE2-CG2 4.38Å; I780-I784 HydrophobicContact CG2-CB 4.36Å; I780-I784 HydrophobicContact CG2-CD1 4.23Å; I780-I784 HydrophobicContact CG2-CG2 3.94Å; D781-I784 WeakPolarHBondContact O-CG2 3.13Å; D781-I784 PolarHBondContact O-N 3.15Å; D781-I784 VanDerWaalsContact O-N 3.08Å; S782-I784 PolarHBondContact O-N 3.02Å; I784-L787 PolarHBondContact O-N 2.76Å; I784-A788 PolarHBondContact O-N 3.45Å
785	H	88	Confident	85.3	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.009	11%	0.11	C	C	.	.	H	α-helix	trans	-73.7	-32.1	179	-56.9	-69.6	0	0	0	111.6	F204 Y732 S782 H783 A788 I789	F204-H785 HydrophobicContact CD2-CB 4.26Å; F204-H785 HydrophobicContact CE2-CB 3.67Å; F204-H785 AromaticContact CE2-CD2 3.38Å; F204-H785 WeakPolarHBondContact CE2-CD2 3.3Å; F204-H785 AromaticContact CE2-CG 3.62Å; F204-H785 HydrophobicContact CZ-CB 3.81Å; F204-H785 AromaticContact CZ-CD2 3.67Å; Y732-H785 AromaticContact CE2-ND1 3.98Å; Y732-H785 AromaticContact CZ-ND1 3.79Å; Y732-H785 PolarHBondContact OH-CE1 3.25Å; Y732-H785 PolarHBondContact OH-ND1 3.02Å; S782-H785 PolarHBondContact O-N 3.11Å; H783-H785 VanDerWaalsContact C-N 3.34Å; H783-H785 PolarHBondContact O-N 3.4Å; H785-A788 PolarHBondContact O-N 3.2Å; H785-I789 WeakPolarHBondContact O-CG1 3.38Å; H785-I789 PolarHBondContact O-N 3.13Å; H785-I789 VanDerWaalsContact O-N 3.1Å
786	W	87.7	Confident	86.1	Confident	17 Å²	17	20 Å²	20	6%	0.064	11%	0.107	C	C	.	.	H	α-helix	trans	-67.9	-40.4	171.2	-71.9	107.6	0	0	0	112.2	F204 H783 A788 I789 S790 M843 A844	F204-W786 HydrophobicContact CD1-CZ2 4.19Å; F204-W786 AromaticContact CD1-NE1 3.95Å; F204-W786 AromaticContact CE1-NE1 3.52Å; H783-W786 PolarHBondContact O-N 3.09Å; W786-A788 VanDerWaalsContact C-N 3.34Å; W786-I789 HydrophobicContact CD2-CD1 4.45Å; W786-I789 HydrophobicContact CE3-CD1 3.83Å; W786-I789 HydrophobicContact CZ3-CD1 4.1Å; W786-I789 PolarHBondContact O-N 3.36Å; W786-S790 PolarHBondContact O-N 3.07Å; W786-S790 PolarHBondContact O-OG 3.04Å; W786-S790 VanDerWaalsContact O-OG 3.1Å; W786-M843 HydrophobicContact CH2-CB 4.48Å; W786-M843 HydrophobicContact CH2-CE 3.18Å; W786-M843 HydrophobicContact CH2-SD 3.64Å; W786-M843 HydrophobicContact CZ2-CB 3.9Å; W786-M843 HydrophobicContact CZ2-CE 3.81Å; W786-M843 HydrophobicContact CZ2-CG 4.48Å; W786-M843 HydrophobicContact CZ2-SD 3.75Å; W786-M843 HydrophobicContact CZ3-CE 3.69Å; W786-A844 HydrophobicContact CG-CB 4.25Å
787	L	91.3	Very high	87	Confident	23 Å²	23	19.5 Å²	19.5	12%	0.12	10%	0.102	C	C	.	.	H	α-helix	trans	-61.8	-41.7	171.9	-179.2	65	0	0	0	111.4	L561 M564 I565 H783 I784 I789 S790 C791	L561-L787 HydrophobicContact CD1-CB 4.13Å; L561-L787 HydrophobicContact CD1-CD2 3.63Å; L561-L787 HydrophobicContact CD1-CG 4.49Å; L561-L787 HydrophobicContact CG-CD2 4.36Å; M564-L787 HydrophobicContact CB-CD2 3.97Å; M564-L787 HydrophobicContact CE-CD2 4.3Å; M564-L787 HydrophobicContact CE-CG 4.09Å; M564-L787 HydrophobicContact CG-CD2 3.77Å; M564-L787 HydrophobicContact SD-CB 4.45Å; M564-L787 HydrophobicContact SD-CD2 3.7Å; M564-L787 HydrophobicContact SD-CG 4.07Å; I565-L787 HydrophobicContact CD1-CD2 4.21Å; I565-L787 HydrophobicContact CG1-CD1 4.09Å; I565-L787 HydrophobicContact CG1-CD2 3.49Å; I565-L787 VanDerWaalsContact CG1-CD2 3.49Å; I565-L787 HydrophobicContact CG1-CG 4.45Å; H783-L787 PolarHBondContact O-N 2.88Å; I784-L787 PolarHBondContact O-N 2.76Å; L787-I789 PolarHBondContact O-N 2.87Å; L787-S790 PolarHBondContact O-N 3.37Å; L787-S790 VanDerWaalsContact O-N 3.14Å; L787-C791 WeakPolarHBondContact O-CB 3.44Å; L787-C791 PolarHBondContact O-N 3.5Å; L787-C791 PolarHBondContact O-SG 3Å
788	A	94.4	Very high	87.9	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-59.2	-43	176.2	0	0	0	0	0	112.8	F128 M564 Y732 L736 I784 H785 W786 C791 M792	F128-A788 HydrophobicContact CD2-CB 4.38Å; F128-A788 HydrophobicContact CE1-CB 4.12Å; F128-A788 HydrophobicContact CE2-CB 3.87Å; F128-A788 HydrophobicContact CZ-CB 3.71Å; F128-A788 WeakPolarHBondContact CZ-O 3.47Å; M564-A788 HydrophobicContact CE-CB 3.87Å; Y732-A788 HydrophobicContact CD1-CB 3.96Å; Y732-A788 HydrophobicContact CE1-CB 3.77Å; Y732-A788 HydrophobicContact CE2-CB 4.41Å; Y732-A788 HydrophobicContact CG-CB 4.4Å; L736-A788 HydrophobicContact CD1-CB 4.17Å; I784-A788 PolarHBondContact O-N 3.45Å; H785-A788 PolarHBondContact O-N 3.2Å; W786-A788 VanDerWaalsContact C-N 3.34Å; A788-C791 PolarHBondContact O-N 2.9Å; A788-M792 PolarHBondContact O-N 2.89Å
789	I	93.6	Very high	88.9	Confident	4 Å²	4	17 Å²	17	2%	0.021	8%	0.084	C	C	.	.	H	α-helix	trans	-58.8	-48.1	172	-66.2	162.5	0	0	0	110.8	F128 M197 F200 H785 W786 L787 C791 M792 L793	F128-I789 HydrophobicContact CE2-CG1 4.23Å; M197-I789 HydrophobicContact CB-CG2 3.93Å; M197-I789 HydrophobicContact CG-CG2 4.09Å; M197-I789 HydrophobicContact SD-CB 4.26Å; M197-I789 HydrophobicContact SD-CG1 3.85Å; M197-I789 HydrophobicContact SD-CG2 4.12Å; F200-I789 HydrophobicContact CD1-CD1 3.75Å; F200-I789 HydrophobicContact CD1-CG1 3.87Å; F200-I789 HydrophobicContact CE1-CD1 3.92Å; F200-I789 HydrophobicContact CE1-CG1 4.02Å; H785-I789 WeakPolarHBondContact O-CG1 3.38Å; H785-I789 PolarHBondContact O-N 3.13Å; H785-I789 VanDerWaalsContact O-N 3.1Å; W786-I789 HydrophobicContact CD2-CD1 4.45Å; W786-I789 HydrophobicContact CE3-CD1 3.83Å; W786-I789 HydrophobicContact CZ3-CD1 4.1Å; W786-I789 PolarHBondContact O-N 3.36Å; L787-I789 PolarHBondContact O-N 2.87Å; I789-C791 PolarHBondContact O-N 2.98Å; I789-M792 PolarHBondContact O-N 3.27Å; I789-L793 HydrophobicContact CG2-CD1 4.1Å; I789-L793 WeakPolarHBondContact O-CG 3.25Å; I789-L793 PolarHBondContact O-N 3.32Å
790	S	93.1	Very high	90	Very high	16 Å²	16	11.4 Å²	11.4	11%	0.112	6%	0.063	C	C	.	.	H	α-helix	trans	-62.8	-42.5	-179.7	-57.5	0	0	0	0	112.6	W786 L787 L793 A794	W786-S790 PolarHBondContact O-N 3.07Å; W786-S790 PolarHBondContact O-OG 3.04Å; W786-S790 VanDerWaalsContact O-OG 3.1Å; L787-S790 PolarHBondContact O-N 3.37Å; L787-S790 VanDerWaalsContact O-N 3.14Å; S790-L793 PolarHBondContact O-N 3.47Å; S790-A794 WeakPolarHBondContact O-CB 3.32Å; S790-A794 PolarHBondContact O-N 2.96Å
791	C	95.1	Very high	90.7	Very high	10 Å²	10	13.8 Å²	13.8	7%	0.068	8%	0.076	C	C	.	.	H	α-helix	trans	-64.3	-41.2	175.7	-73.1	0	0	0	0	112	Y568 L736 L787 A788 I789 A794 S795	Y568-C791 HydrophobicContact CD1-CB 4.32Å; Y568-C791 HydrophobicContact CD2-CB 4.4Å; Y568-C791 HydrophobicContact CE1-CB 4.08Å; Y568-C791 HydrophobicContact CE2-CB 4.16Å; Y568-C791 HydrophobicContact CG-CB 4.48Å; Y568-C791 PolarHBondContact OH-O 3.02Å; Y568-C791 VanDerWaalsContact OH-O 3.08Å; L736-C791 HydrophobicContact CD1-CB 3.87Å; L787-C791 WeakPolarHBondContact O-CB 3.44Å; L787-C791 PolarHBondContact O-N 3.5Å; L787-C791 PolarHBondContact O-SG 3Å; A788-C791 PolarHBondContact O-N 2.9Å; I789-C791 PolarHBondContact O-N 2.98Å; C791-A794 PolarHBondContact O-N 3.46Å; C791-S795 PolarHBondContact O-N 2.94Å; C791-S795 PolarHBondContact O-OG 2.99Å
792	M	95.7	Very high	91.3	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.2	-44.2	175	-174.1	-162.6	158.3	0	0	111.8	F128 L132 Y135 A193 M197 L736 F739 A788 I789 A794 S795 V796	F128-M792 HydrophobicContact CZ-CB 4.18Å; L132-M792 HydrophobicContact CD2-CE 4.27Å; L132-M792 HydrophobicContact CD2-CG 3.82Å; L132-M792 HydrophobicContact CD2-SD 3.59Å; L132-M792 VanDerWaalsContact CD2-SD 3.59Å; Y135-M792 HydrophobicContact CD1-CE 4.43Å; Y135-M792 HydrophobicContact CD2-CE 4.22Å; Y135-M792 HydrophobicContact CG-CE 4.01Å; A193-M792 HydrophobicContact CB-CE 4.17Å; M197-M792 HydrophobicContact CE-CE 4.19Å; M197-M792 HydrophobicContact CE-SD 3.45Å; M197-M792 WeakPolarHBondContact CE-SD 3.41Å; M197-M792 HydrophobicContact CG-CE 4.32Å; M197-M792 HydrophobicContact CG-SD 3.66Å; M197-M792 HydrophobicContact SD-SD 3.44Å; L736-M792 HydrophobicContact CD2-CB 3.88Å; F739-M792 HydrophobicContact CD1-CG 4.19Å; F739-M792 HydrophobicContact CE1-CB 4.45Å; F739-M792 HydrophobicContact CE1-CE 4.32Å; F739-M792 HydrophobicContact CE1-CG 3.42Å; F739-M792 VanDerWaalsContact CE1-CG 3.42Å; F739-M792 HydrophobicContact CZ-CE 3.78Å; F739-M792 HydrophobicContact CZ-CG 3.84Å; F739-M792 HydrophobicContact CZ-SD 4.46Å; A788-M792 PolarHBondContact O-N 2.89Å; I789-M792 PolarHBondContact O-N 3.27Å; M792-A794 VanDerWaalsContact C-N 3.33Å; M792-A794 PolarHBondContact O-N 2.94Å; M792-S795 VanDerWaalsContact O-CB 3.26Å; M792-S795 WeakPolarHBondContact O-CB 3.44Å; M792-S795 PolarHBondContact O-N 2.73Å; M792-S795 VanDerWaalsContact O-N 3.13Å; M792-V796 PolarHBondContact O-N 3.45Å; M792-V796 VanDerWaalsContact O-N 3.17Å
793	L	96.3	Very high	91.8	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-66.7	-36.1	177.5	-67.9	172.7	0	0	0	111.7	A193 M197 I789 S790 S795 V796 F797 M833 T836	A193-L793 HydrophobicContact CB-CD2 4.05Å; M197-L793 HydrophobicContact CG-CD2 4.29Å; M197-L793 HydrophobicContact CG-CG 4.37Å; I789-L793 HydrophobicContact CG2-CD1 4.1Å; I789-L793 WeakPolarHBondContact O-CG 3.25Å; I789-L793 PolarHBondContact O-N 3.32Å; S790-L793 PolarHBondContact O-N 3.47Å; L793-S795 VanDerWaalsContact C-N 3.32Å; L793-S795 PolarHBondContact O-N 3.4Å; L793-V796 PolarHBondContact O-N 3.05Å; L793-F797 WeakPolarHBondContact O-CB 3.48Å; L793-F797 PolarHBondContact O-N 3.5Å; L793-M833 HydrophobicContact CB-CG 4.47Å; L793-T836 HydrophobicContact CD1-CG2 3.62Å; L793-T836 VanDerWaalsContact CD1-OG1 3.27Å; L793-T836 WeakPolarHBondContact CD1-OG1 3.27Å
794	A	94.4	Very high	92.2	Very high	27 Å²	27	13.7 Å²	13.7	22%	0.223	7%	0.073	C	C	.	.	H	α-helix	trans	-62.9	-36.6	170	0	0	0	0	0	112.5	S790 C791 M792 V796 F797 L798 M833	S790-A794 WeakPolarHBondContact O-CB 3.32Å; S790-A794 PolarHBondContact O-N 2.96Å; C791-A794 PolarHBondContact O-N 3.46Å; M792-A794 VanDerWaalsContact C-N 3.33Å; M792-A794 PolarHBondContact O-N 2.94Å; A794-V796 VanDerWaalsContact C-N 3.33Å; A794-V796 PolarHBondContact O-N 3.36Å; A794-F797 PolarHBondContact O-N 2.88Å; A794-L798 WeakPolarHBondContact O-CG 3.3Å; A794-L798 PolarHBondContact O-N 2.87Å; A794-M833 HydrophobicContact CB-SD 4.19Å
795	S	94.6	Very high	92	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.5	-38	174.5	-57.1	0	0	0	0	112.8	Y568 A740 C791 M792 L793	Y568-S795 PolarHBondContact OH-OG 3.26Å; Y568-S795 VanDerWaalsContact OH-OG 3.05Å; A740-S795 WeakPolarHBondContact CB-OG 3.39Å; C791-S795 PolarHBondContact O-N 2.94Å; C791-S795 PolarHBondContact O-OG 2.99Å; M792-S795 VanDerWaalsContact O-CB 3.26Å; M792-S795 WeakPolarHBondContact O-CB 3.44Å; M792-S795 PolarHBondContact O-N 2.73Å; M792-S795 VanDerWaalsContact O-N 3.13Å; L793-S795 VanDerWaalsContact C-N 3.32Å; L793-S795 PolarHBondContact O-N 3.4Å
796	V	96.1	Very high	91.7	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-83	-26.4	177.7	-173.2	0	0	0	0	111.9	Y135 F190 A193 F739 M792 L793 A794 L799 Q800	Y135-V796 HydrophobicContact CE1-CG2 4.29Å; Y135-V796 HydrophobicContact CE2-CG2 4.46Å; Y135-V796 WeakPolarHBondContact OH-CG1 3.18Å; Y135-V796 WeakPolarHBondContact OH-CG2 3.33Å; F190-V796 HydrophobicContact CB-CG1 4.07Å; F190-V796 HydrophobicContact CD2-CB 4.28Å; F190-V796 HydrophobicContact CD2-CG1 4.12Å; A193-V796 HydrophobicContact CB-CB 4.29Å; A193-V796 HydrophobicContact CB-CG1 4.23Å; A193-V796 HydrophobicContact CB-CG2 3.93Å; F739-V796 HydrophobicContact CE1-CG2 4.24Å; F739-V796 HydrophobicContact CZ-CG2 4.43Å; M792-V796 PolarHBondContact O-N 3.45Å; M792-V796 VanDerWaalsContact O-N 3.17Å; L793-V796 PolarHBondContact O-N 3.05Å; A794-V796 VanDerWaalsContact C-N 3.33Å; A794-V796 PolarHBondContact O-N 3.36Å; V796-L799 WeakPolarHBondContact O-CB 3.27Å; V796-L799 PolarHBondContact O-N 2.95Å; V796-Q800 PolarHBondContact O-N 3.3Å
797	F	95.2	Very high	91.5	Very high	37 Å²	37	17.2 Å²	17.2	16%	0.162	9%	0.091	C	C	.	.	H	α-helix	trans	-65.2	-38.3	168.1	-177.9	-98.4	0	0	0	112	F190 L793 A794 L799 Q800 L801 L826 A830 M833	F190-F797 HydrophobicContact CE2-CB 4.31Å; L793-F797 WeakPolarHBondContact O-CB 3.48Å; L793-F797 PolarHBondContact O-N 3.5Å; A794-F797 PolarHBondContact O-N 2.88Å; F797-L799 VanDerWaalsContact C-N 3.29Å; F797-L799 PolarHBondContact O-N 2.79Å; F797-Q800 PolarHBondContact O-N 3.17Å; F797-Q800 VanDerWaalsContact O-N 3.13Å; F797-L801 HydrophobicContact CE1-CD1 4.29Å; F797-L801 PolarHBondContact O-N 3.3Å; F797-L826 HydrophobicContact CD2-CD1 4.08Å; F797-L826 HydrophobicContact CE1-CD1 4.42Å; F797-L826 HydrophobicContact CE2-CD1 3.47Å; F797-L826 VanDerWaalsContact CE2-CD1 3.47Å; F797-L826 HydrophobicContact CE2-CG 3.86Å; F797-L826 HydrophobicContact CZ-CD1 3.68Å; F797-L826 HydrophobicContact CZ-CG 3.96Å; F797-A830 HydrophobicContact CE2-CB 3.86Å; F797-A830 HydrophobicContact CZ-CB 4.32Å; F797-M833 HydrophobicContact CB-CE 4.43Å; F797-M833 HydrophobicContact CB-SD 4.16Å; F797-M833 HydrophobicContact CD1-CE 4.12Å; F797-M833 HydrophobicContact CD2-CE 4.22Å; F797-M833 HydrophobicContact CE1-CE 4.46Å; F797-M833 HydrophobicContact CG-CE 3.99Å; F797-M833 HydrophobicContact CG-SD 4.36Å
798	L	91.9	Very high	91.2	Very high	36 Å²	36	19 Å²	19	19%	0.188	10%	0.103	C	C	.	.	H	α-helix	trans	-62.6	-32.6	175.2	-74.2	167.7	0	0	0	113	I572 L576 A794 L801 N802	I572-L798 HydrophobicContact CD1-CD1 4.47Å; I572-L798 HydrophobicContact CG2-CD1 4.06Å; L576-L798 HydrophobicContact CD2-CD1 4.19Å; A794-L798 WeakPolarHBondContact O-CG 3.3Å; A794-L798 PolarHBondContact O-N 2.87Å; L798-L801 PolarHBondContact O-N 3.11Å; L798-N802 PolarHBondContact O-N 3.06Å; L798-N802 PolarHBondContact O-OD1 3.27Å
799	L	92.9	Very high	90.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.4	-47.6	169.9	163.4	61.7	0	0	0	111.8	F189 C743 S746 I747 V796 F797 L801 N802 I803	F189-L799 HydrophobicContact CD2-CD2 4.03Å; C743-L799 WeakPolarHBondContact O-CD1 3.38Å; S746-L799 WeakPolarHBondContact OG-CD2 3.44Å; I747-L799 HydrophobicContact CB-CD1 4.03Å; I747-L799 HydrophobicContact CD1-CD1 4.24Å; I747-L799 HydrophobicContact CD1-CD2 4.19Å; I747-L799 HydrophobicContact CG1-CD1 4.21Å; V796-L799 WeakPolarHBondContact O-CB 3.27Å; V796-L799 PolarHBondContact O-N 2.95Å; F797-L799 VanDerWaalsContact C-N 3.29Å; F797-L799 PolarHBondContact O-N 2.79Å; L799-L801 VanDerWaalsContact C-N 3.33Å; L799-L801 PolarHBondContact O-N 3.44Å; L799-N802 PolarHBondContact O-N 3.06Å; L799-I803 HydrophobicContact CD1-CD1 3.72Å; L799-I803 HydrophobicContact CD1-CG1 4.26Å; L799-I803 HydrophobicContact CG-CD1 4.17Å; L799-I803 WeakPolarHBondContact O-CG1 3.42Å; L799-I803 PolarHBondContact O-N 3.43Å; L799-I803 VanDerWaalsContact O-N 3.1Å
800	Q	93.1	Very high	89.5	Confident	10 Å²	10	24.5 Å²	24.5	5%	0.047	13%	0.128	C	C	.	.	H	α-helix	trans	-64	-39.3	176.6	-69.9	-176.1	-11.8	0	0	112.1	G186 V796 F797 N802 I803 F804 L826 S829	G186-Q800 WeakPolarHBondContact O-CG 3.43Å; G186-Q800 PolarHBondContact O-NE2 2.94Å; V796-Q800 PolarHBondContact O-N 3.3Å; F797-Q800 PolarHBondContact O-N 3.17Å; F797-Q800 VanDerWaalsContact O-N 3.13Å; Q800-N802 VanDerWaalsContact C-N 3.35Å; Q800-N802 PolarHBondContact O-N 3Å; Q800-I803 PolarHBondContact O-N 3.37Å; Q800-F804 WeakPolarHBondContact O-CB 3.03Å; Q800-F804 PolarHBondContact O-N 3.28Å; Q800-L826 HydrophobicContact CB-CD1 3.71Å; Q800-S829 PolarHBondContact NE2-OG 2.88Å; Q800-S829 PolarHBondContact OE1-OG 3.22Å
801	L	90.5	Very high	88.4	Confident	54 Å²	54	25.1 Å²	25.1	28%	0.283	13%	0.134	S	C	.	.	H	α-helix	trans	-61.1	-43.3	176.2	-171.3	152.2	0	0	0	111.1	F797 L798 L799 I803 F804 M805 L826	F797-L801 HydrophobicContact CE1-CD1 4.29Å; F797-L801 PolarHBondContact O-N 3.3Å; L798-L801 PolarHBondContact O-N 3.11Å; L799-L801 VanDerWaalsContact C-N 3.33Å; L799-L801 PolarHBondContact O-N 3.44Å; L801-I803 PolarHBondContact O-N 3.49Å; L801-F804 PolarHBondContact O-N 2.86Å; L801-M805 HydrophobicContact CD2-CE 4.31Å; L801-M805 HydrophobicContact CD2-CG 3.94Å; L801-M805 HydrophobicContact CG-CE 4.48Å; L801-M805 WeakPolarHBondContact O-CB 3.39Å; L801-M805 VanDerWaalsContact O-CG 3.24Å; L801-M805 WeakPolarHBondContact O-CG 3.31Å; L801-M805 PolarHBondContact O-N 3.3Å; L801-L826 HydrophobicContact CB-CD1 4.39Å
802	N	86.3	Confident	87.3	Confident	11 Å²	11	32.7 Å²	32.7	6%	0.059	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-44.6	174.8	-75	-2	0	0	0	112.4	F669 A744 L798 L799 Q800 M805 F806	F669-N802 HydrophobicContact CE1-CB 4.16Å; F669-N802 HydrophobicContact CZ-CB 4.2Å; A744-N802 PolarHBondContact O-ND2 3.36Å; L798-N802 PolarHBondContact O-N 3.06Å; L798-N802 PolarHBondContact O-OD1 3.27Å; L799-N802 PolarHBondContact O-N 3.06Å; Q800-N802 VanDerWaalsContact C-N 3.35Å; Q800-N802 PolarHBondContact O-N 3Å; N802-M805 PolarHBondContact O-N 2.92Å; N802-F806 WeakPolarHBondContact O-CB 3.49Å; N802-F806 PolarHBondContact O-N 3.4Å
803	I	88.5	Confident	86.1	Confident	5 Å²	5	36.6 Å²	36.6	3%	0.026	20%	0.197	C	C	.	.	H	α-helix	trans	-63.8	-45.1	177.5	-66.9	164.6	0	0	0	110.8	I747 L799 Q800 L801 F806 I807	I747-I803 HydrophobicContact CB-CD1 4.06Å; I747-I803 HydrophobicContact CD1-CD1 3.8Å; I747-I803 HydrophobicContact CG1-CD1 4.49Å; I747-I803 HydrophobicContact CG2-CD1 3.89Å; I747-I803 HydrophobicContact CG2-CG1 4.38Å; L799-I803 HydrophobicContact CD1-CD1 3.72Å; L799-I803 HydrophobicContact CD1-CG1 4.26Å; L799-I803 HydrophobicContact CG-CD1 4.17Å; L799-I803 WeakPolarHBondContact O-CG1 3.42Å; L799-I803 PolarHBondContact O-N 3.43Å; L799-I803 VanDerWaalsContact O-N 3.1Å; Q800-I803 PolarHBondContact O-N 3.37Å; L801-I803 PolarHBondContact O-N 3.49Å; I803-F806 PolarHBondContact O-N 3.47Å; I803-I807 HydrophobicContact CG2-CD1 3.76Å; I803-I807 WeakPolarHBondContact O-CB 3.34Å; I803-I807 VanDerWaalsContact O-CG1 3.31Å; I803-I807 WeakPolarHBondContact O-CG1 3.41Å; I803-I807 PolarHBondContact O-N 3.5Å
804	F	89.4	Confident	85.1	Confident	32 Å²	32	37 Å²	37	14%	0.14	20%	0.2	C	C	.	.	H	α-helix	trans	-59.5	-47.1	176.4	173.8	-105.2	0	0	0	111.5	Q800 L801 I807 V808 S822 L823 L826	Q800-F804 WeakPolarHBondContact O-CB 3.03Å; Q800-F804 PolarHBondContact O-N 3.28Å; L801-F804 PolarHBondContact O-N 2.86Å; F804-I807 PolarHBondContact O-N 3.5Å; F804-V808 HydrophobicContact CD1-CG2 4.34Å; F804-V808 HydrophobicContact CD2-CG2 4.11Å; F804-V808 HydrophobicContact CE1-CG2 3.92Å; F804-V808 HydrophobicContact CE2-CG2 3.64Å; F804-V808 HydrophobicContact CG-CG2 4.43Å; F804-V808 HydrophobicContact CZ-CG2 3.55Å; F804-V808 WeakPolarHBondContact O-CB 3.48Å; F804-V808 WeakPolarHBondContact O-CG2 3.43Å; F804-V808 PolarHBondContact O-N 2.92Å; F804-S822 WeakPolarHBondContact CA-OG 3.17Å; F804-L823 HydrophobicContact CD2-CB 4.49Å; F804-L823 HydrophobicContact CE2-CB 3.89Å; F804-L823 HydrophobicContact CE2-CD1 4.05Å; F804-L823 HydrophobicContact CZ-CD1 4.04Å; F804-L826 HydrophobicContact CB-CD2 4.48Å; F804-L826 HydrophobicContact CD1-CD2 4.12Å; F804-L826 HydrophobicContact CG-CD2 4.22Å
805	M	83.6	Confident	84.5	Confident	78 Å²	78	38.7 Å²	38.7	38%	0.384	21%	0.21	S	C	.	.	H	α-helix	trans	-62.6	-45.1	177.5	-68.1	-63.6	170.8	0	0	111.7	F669 L801 N802 I807 V808 L809	F669-M805 HydrophobicContact CE2-CB 3.85Å; F669-M805 HydrophobicContact CZ-CB 4.24Å; L801-M805 HydrophobicContact CD2-CE 4.31Å; L801-M805 HydrophobicContact CD2-CG 3.94Å; L801-M805 HydrophobicContact CG-CE 4.48Å; L801-M805 WeakPolarHBondContact O-CB 3.39Å; L801-M805 VanDerWaalsContact O-CG 3.24Å; L801-M805 WeakPolarHBondContact O-CG 3.31Å; L801-M805 PolarHBondContact O-N 3.3Å; N802-M805 PolarHBondContact O-N 2.92Å; M805-I807 VanDerWaalsContact C-N 3.27Å; M805-I807 PolarHBondContact O-N 2.99Å; M805-V808 PolarHBondContact O-N 3.38Å; M805-L809 WeakPolarHBondContact O-CB 3.37Å; M805-L809 WeakPolarHBondContact O-CG 3.28Å; M805-L809 PolarHBondContact O-N 3.29Å
806	F	81.4	Confident	84.1	Confident	13 Å²	13	45.7 Å²	45.7	6%	0.057	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-36.7	175.4	-178.9	-92.6	0	0	0	113	I169 L179 F669 N802 I803 R810	I169-F806 HydrophobicContact CB-CZ 4.4Å; I169-F806 HydrophobicContact CD1-CD1 3.86Å; I169-F806 HydrophobicContact CD1-CE1 3.67Å; I169-F806 HydrophobicContact CD1-CZ 4.34Å; I169-F806 HydrophobicContact CG1-CD1 4.42Å; I169-F806 HydrophobicContact CG1-CE1 3.74Å; I169-F806 HydrophobicContact CG1-CZ 4.02Å; I169-F806 HydrophobicContact CG2-CD2 4.43Å; I169-F806 HydrophobicContact CG2-CE1 4.17Å; I169-F806 HydrophobicContact CG2-CE2 3.94Å; I169-F806 HydrophobicContact CG2-CZ 3.78Å; L179-F806 HydrophobicContact CD2-CE1 4.35Å; F669-F806 HydrophobicContact CB-CD2 4.42Å; F669-F806 HydrophobicContact CD2-CB 4.4Å; N802-F806 WeakPolarHBondContact O-CB 3.49Å; N802-F806 PolarHBondContact O-N 3.4Å; I803-F806 PolarHBondContact O-N 3.47Å; F806-R810 VanDerWaalsContact CZ-CZ 3.44Å
807	I	84.6	Confident	83.8	Confident	6 Å²	6	48.3 Å²	48.3	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-70.4	-44.8	175.1	-72.4	166.2	0	0	0	111.3	T183 I803 F804 M805 R810 A811 V814 L818 V819	T183-I807 WeakPolarHBondContact OG1-CD1 3.07Å; I803-I807 HydrophobicContact CG2-CD1 3.76Å; I803-I807 WeakPolarHBondContact O-CB 3.34Å; I803-I807 VanDerWaalsContact O-CG1 3.31Å; I803-I807 WeakPolarHBondContact O-CG1 3.41Å; I803-I807 PolarHBondContact O-N 3.5Å; F804-I807 PolarHBondContact O-N 3.5Å; M805-I807 VanDerWaalsContact C-N 3.27Å; M805-I807 PolarHBondContact O-N 2.99Å; I807-R810 CarbonylContact O-C 3.42Å; I807-R810 PolarHBondContact O-N 2.93Å; I807-R810 VanDerWaalsContact O-N 3.13Å; I807-A811 PolarHBondContact O-N 3.26Å; I807-A811 VanDerWaalsContact O-N 3.17Å; I807-V814 HydrophobicContact CG2-CG1 4.33Å; I807-L818 HydrophobicContact CD1-CD2 3.84Å; I807-L818 HydrophobicContact CD1-CG 4.18Å; I807-L818 HydrophobicContact CG1-CD2 4Å; I807-L818 HydrophobicContact CG2-CD2 4.23Å; I807-V819 HydrophobicContact CG2-CB 4.37Å; I807-V819 HydrophobicContact CG2-CG2 3.87Å
808	V	83.9	Confident	83.6	Confident	61 Å²	61	46.6 Å²	46.6	37%	0.37	26%	0.257	S	S	.	.	H	α-helix	trans	-64.6	-40.1	179.5	168.6	0	0	0	0	111.8	F804 M805 R810 A811 V819	F804-V808 HydrophobicContact CD1-CG2 4.34Å; F804-V808 HydrophobicContact CD2-CG2 4.11Å; F804-V808 HydrophobicContact CE1-CG2 3.92Å; F804-V808 HydrophobicContact CE2-CG2 3.64Å; F804-V808 HydrophobicContact CG-CG2 4.43Å; F804-V808 HydrophobicContact CZ-CG2 3.55Å; F804-V808 WeakPolarHBondContact O-CB 3.48Å; F804-V808 WeakPolarHBondContact O-CG2 3.43Å; F804-V808 PolarHBondContact O-N 2.92Å; M805-V808 PolarHBondContact O-N 3.38Å; V808-R810 PolarHBondContact O-N 2.81Å; V808-R810 VanDerWaalsContact O-N 3.12Å; V808-A811 WeakPolarHBondContact O-CB 3.3Å; V808-A811 PolarHBondContact O-N 2.91Å; V808-V819 HydrophobicContact CG2-CG1 4.24Å
809	L	76.8	Confident	83.5	Confident	57 Å²	57	46.2 Å²	46.2	30%	0.298	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-19.2	174.7	-70.3	171.8	0	0	0	113.5	W665 V668 F669 M805	W665-L809 HydrophobicContact CB-CD2 3.64Å; W665-L809 HydrophobicContact CE3-CD2 4.49Å; V668-L809 HydrophobicContact CB-CD1 3.93Å; V668-L809 HydrophobicContact CG1-CD1 4.24Å; F669-L809 HydrophobicContact CD2-CD1 4.16Å; F669-L809 HydrophobicContact CE2-CD1 4.31Å; M805-L809 WeakPolarHBondContact O-CB 3.37Å; M805-L809 WeakPolarHBondContact O-CG 3.28Å; M805-L809 PolarHBondContact O-N 3.29Å
810	R	75.5	Confident	83.5	Confident	61 Å²	61	50.8 Å²	50.8	23%	0.23	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	8	176.7	-66.3	177.2	167.5	-158	-3.9	112.9	I172 A174 F806 I807 V808 N812 T813 V814	I172-R810 PolarHBondContact O-NH1 3.46Å; A174-R810 HydrophobicContact CB-CB 4.3Å; F806-R810 VanDerWaalsContact CZ-CZ 3.44Å; I807-R810 CarbonylContact O-C 3.42Å; I807-R810 PolarHBondContact O-N 2.93Å; I807-R810 VanDerWaalsContact O-N 3.13Å; V808-R810 PolarHBondContact O-N 2.81Å; V808-R810 VanDerWaalsContact O-N 3.12Å; R810-N812 VanDerWaalsContact C-N 3.27Å; R810-N812 PolarHBondContact O-N 3.29Å; R810-T813 PolarHBondContact O-N 3.47Å; R810-T813 PolarHBondContact O-OG1 2.99Å; R810-V814 HydrophobicContact CB-CG2 3.7Å; R810-V814 WeakPolarHBondContact O-CG2 3.46Å; R810-V814 PolarHBondContact O-N 2.82Å
811	A	71.2	Confident	83.5	Confident	29 Å²	29	52 Å²	52	24%	0.24	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-54.4	-33.6	-167.3	0	0	0	0	0	115.3	I807 V808 T813 V814	I807-A811 PolarHBondContact O-N 3.26Å; I807-A811 VanDerWaalsContact O-N 3.17Å; V808-A811 WeakPolarHBondContact O-CB 3.3Å; V808-A811 PolarHBondContact O-N 2.91Å; A811-T813 PolarHBondContact O-N 3.07Å; A811-V814 PolarHBondContact O-N 3.19Å
812	N	71.1	Confident	83.6	Confident	170 Å²	170	49.9 Å²	49.9	91%	0.909	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-63.2	-11.1	176.1	-65.8	-5.1	0	0	0	113.9	R810	R810-N812 VanDerWaalsContact C-N 3.27Å; R810-N812 PolarHBondContact O-N 3.29Å
813	T	69.8	Low	83.9	Confident	81 Å²	81	52.9 Å²	52.9	50%	0.497	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-132	3.8	-174.1	57.1	0	0	0	0	113.4	A174 R810 A811	A174-T813 CarbonylContact C-O 3.58Å; A174-T813 WeakPolarHBondContact CB-OG1 3.32Å; R810-T813 PolarHBondContact O-N 3.47Å; R810-T813 PolarHBondContact O-OG1 2.99Å; A811-T813 PolarHBondContact O-N 3.07Å
814	V	75.5	Confident	84.3	Confident	10 Å²	10	57.7 Å²	57.7	6%	0.061	32%	0.319	C	S	.	.	S	Bend	trans	-117.5	140.6	-177.8	174.9	0	0	0	0	109	A174 L179 I807 R810 A811 H816 L818	A174-V814 HydrophobicContact CB-CG2 3.89Å; L179-V814 HydrophobicContact CD1-CG2 4.3Å; I807-V814 HydrophobicContact CG2-CG1 4.33Å; R810-V814 HydrophobicContact CB-CG2 3.7Å; R810-V814 WeakPolarHBondContact O-CG2 3.46Å; R810-V814 PolarHBondContact O-N 2.82Å; A811-V814 PolarHBondContact O-N 3.19Å; V814-H816 PolarHBondContact O-N 3.09Å; V814-L818 HydrophobicContact CG1-CB 4.03Å; V814-L818 HydrophobicContact CG1-CD2 3.64Å; V814-L818 HydrophobicContact CG1-CG 4.44Å
815	S	82	Confident	84.5	Confident	62 Å²	62	56.5 Å²	56.5	43%	0.434	32%	0.316	S	S	.	.			trans	-55.1	127.2	176.8	62.3	0	0	0	0	112.1	A817 L818	S815-A817 PolarHBondContact O-N 3.34Å; S815-L818 WeakPolarHBondContact O-CB 3.36Å; S815-L818 PolarHBondContact O-N 3.17Å
816	H	86.8	Confident	85.1	Confident	146 Å²	146	53.9 Å²	53.9	68%	0.676	30%	0.303	S	S	*	.	H	α-helix	trans	-52.4	-32.7	178	-61.8	-58	0	0	0	113.3	V814 L818 V819 I820	V814-H816 PolarHBondContact O-N 3.09Å; H816-L818 VanDerWaalsContact C-N 3.28Å; H816-L818 PolarHBondContact O-N 3.11Å; H816-V819 WeakPolarHBondContact O-CB 3.48Å; H816-V819 PolarHBondContact O-N 2.78Å; H816-V819 VanDerWaalsContact O-N 3.15Å; H816-I820 VanDerWaalsContact O-CG1 3.32Å; H816-I820 WeakPolarHBondContact O-CG1 3.26Å; H816-I820 PolarHBondContact O-N 3.09Å
817	A	90.4	Very high	85.8	Confident	55 Å²	55	57.2 Å²	57.2	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-56.7	-36.8	175.1	0	0	0	0	0	113.5	W180 S815 C821	W180-A817 HydrophobicContact CH2-CB 4.43Å; W180-A817 HydrophobicContact CZ2-CB 4.04Å; S815-A817 PolarHBondContact O-N 3.34Å; A817-C821 WeakPolarHBondContact O-CB 3.31Å; A817-C821 PolarHBondContact O-N 3.3Å
818	L	90.1	Very high	86.3	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-69.9	-42.5	176	-168.2	81.4	0	0	0	111.2	L179 W180 I807 V814 S815 H816 I820 C821 S822	L179-L818 HydrophobicContact CB-CD2 3.72Å; W180-L818 HydrophobicContact CB-CD1 4.26Å; W180-L818 HydrophobicContact CD2-CD1 3.56Å; W180-L818 HydrophobicContact CE3-CD1 4.08Å; W180-L818 HydrophobicContact CG-CD1 3.65Å; W180-L818 HydrophobicContact CZ2-CB 4.48Å; W180-L818 HydrophobicContact CZ2-CD1 4.34Å; I807-L818 HydrophobicContact CD1-CD2 3.84Å; I807-L818 HydrophobicContact CD1-CG 4.18Å; I807-L818 HydrophobicContact CG1-CD2 4Å; I807-L818 HydrophobicContact CG2-CD2 4.23Å; V814-L818 HydrophobicContact CG1-CB 4.03Å; V814-L818 HydrophobicContact CG1-CD2 3.64Å; V814-L818 HydrophobicContact CG1-CG 4.44Å; S815-L818 WeakPolarHBondContact O-CB 3.36Å; S815-L818 PolarHBondContact O-N 3.17Å; H816-L818 VanDerWaalsContact C-N 3.28Å; H816-L818 PolarHBondContact O-N 3.11Å; L818-I820 VanDerWaalsContact C-N 3.35Å; L818-I820 PolarHBondContact O-N 3.39Å; L818-C821 PolarHBondContact O-N 3.48Å; L818-S822 WeakPolarHBondContact O-CB 3.36Å; L818-S822 PolarHBondContact O-N 2.94Å
819	V	90.6	Very high	86.9	Confident	27 Å²	27	58.7 Å²	58.7	16%	0.164	32%	0.322	C	S	.	.	H	α-helix	trans	-60.9	-46.1	177.5	-169.4	0	0	0	0	110.3	I807 V808 H816 S822 L823	I807-V819 HydrophobicContact CG2-CB 4.37Å; I807-V819 HydrophobicContact CG2-CG2 3.87Å; V808-V819 HydrophobicContact CG2-CG1 4.24Å; H816-V819 WeakPolarHBondContact O-CB 3.48Å; H816-V819 PolarHBondContact O-N 2.78Å; H816-V819 VanDerWaalsContact O-N 3.15Å; V819-S822 PolarHBondContact O-N 2.94Å; V819-L823 WeakPolarHBondContact O-CB 3.49Å; V819-L823 PolarHBondContact O-N 3.22Å
820	I	92	Very high	87.8	Confident	97 Å²	97	57.1 Å²	57.1	50%	0.497	32%	0.317	S	S	.	.	H	α-helix	trans	-64.5	-45.4	176.9	-66.2	164.2	0	0	0	110.8	H816 L818 S822 L823 L824	H816-I820 VanDerWaalsContact O-CG1 3.32Å; H816-I820 WeakPolarHBondContact O-CG1 3.26Å; H816-I820 PolarHBondContact O-N 3.09Å; L818-I820 VanDerWaalsContact C-N 3.35Å; L818-I820 PolarHBondContact O-N 3.39Å; I820-S822 PolarHBondContact O-N 3.46Å; I820-L823 PolarHBondContact O-N 3.13Å; I820-L824 HydrophobicContact CG2-CD1 3.83Å; I820-L824 HydrophobicContact CG2-CG 4.31Å; I820-L824 WeakPolarHBondContact O-CB 3.41Å; I820-L824 VanDerWaalsContact O-CG 3.3Å; I820-L824 WeakPolarHBondContact O-CG 3.34Å; I820-L824 PolarHBondContact O-N 3.07Å
821	C	93.5	Very high	88.8	Confident	35 Å²	35	59.1 Å²	59.1	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-45.2	177.2	-177	0	0	0	0	112	W180 A817 L818 L824 G825	W180-C821 HydrophobicContact CH2-CB 4.18Å; W180-C821 HydrophobicContact CZ3-CB 4.12Å; A817-C821 WeakPolarHBondContact O-CB 3.31Å; A817-C821 PolarHBondContact O-N 3.3Å; L818-C821 PolarHBondContact O-N 3.48Å; C821-L824 PolarHBondContact O-N 3.29Å; C821-G825 PolarHBondContact O-N 3.44Å
822	S	92	Very high	89.9	Confident	9 Å²	9	59.1 Å²	59.1	6%	0.063	33%	0.327	C	S	.	.	H	α-helix	trans	-62.5	-44.9	176.7	-170.9	0	0	0	0	111.8	F804 L818 V819 I820 G825 L826	F804-S822 WeakPolarHBondContact CA-OG 3.17Å; L818-S822 WeakPolarHBondContact O-CB 3.36Å; L818-S822 PolarHBondContact O-N 2.94Å; V819-S822 PolarHBondContact O-N 2.94Å; I820-S822 PolarHBondContact O-N 3.46Å; S822-G825 PolarHBondContact O-N 3.17Å; S822-L826 WeakPolarHBondContact O-CB 3.3Å; S822-L826 PolarHBondContact O-N 2.93Å
823	L	93.8	Very high	91	Very high	74 Å²	74	52.3 Å²	52.3	39%	0.387	29%	0.29	S	S	.	.	H	α-helix	trans	-62.4	-46	176.4	-178.5	59.3	0	0	0	112.5	F804 V819 I820 G825 L826 I827	F804-L823 HydrophobicContact CD2-CB 4.49Å; F804-L823 HydrophobicContact CE2-CB 3.89Å; F804-L823 HydrophobicContact CE2-CD1 4.05Å; F804-L823 HydrophobicContact CZ-CD1 4.04Å; V819-L823 WeakPolarHBondContact O-CB 3.49Å; V819-L823 PolarHBondContact O-N 3.22Å; I820-L823 PolarHBondContact O-N 3.13Å; L823-G825 VanDerWaalsContact C-N 3.35Å; L823-G825 PolarHBondContact O-N 2.77Å; L823-L826 PolarHBondContact O-N 2.94Å; L823-I827 HydrophobicContact CD1-CD1 4.03Å; L823-I827 HydrophobicContact CD1-CG1 4.35Å; L823-I827 HydrophobicContact CG-CD1 3.92Å; L823-I827 VanDerWaalsContact O-CG1 3.31Å; L823-I827 WeakPolarHBondContact O-CG1 3.41Å; L823-I827 PolarHBondContact O-N 3.06Å
824	L	95.6	Very high	92	Very high	107 Å²	107	52.8 Å²	52.8	56%	0.56	29%	0.289	S	S	*	.	H	α-helix	trans	-63.6	-40.5	177.3	-70.8	173	0	0	0	111.6	I820 C821 I827 F828	I820-L824 HydrophobicContact CG2-CD1 3.83Å; I820-L824 HydrophobicContact CG2-CG 4.31Å; I820-L824 WeakPolarHBondContact O-CB 3.41Å; I820-L824 VanDerWaalsContact O-CG 3.3Å; I820-L824 WeakPolarHBondContact O-CG 3.34Å; I820-L824 PolarHBondContact O-N 3.07Å; C821-L824 PolarHBondContact O-N 3.29Å; L824-I827 PolarHBondContact O-N 2.71Å; L824-F828 VanDerWaalsContact O-CB 3.27Å; L824-F828 WeakPolarHBondContact O-CB 3.38Å; L824-F828 PolarHBondContact O-N 2.62Å
825	G	95.1	Very high	92.8	Very high	7 Å²	7	57.7 Å²	57.7	7%	0.072	31%	0.31	C	S	.	.	H	α-helix	trans	-61.4	-41.3	173.5	0	0	0	0	0	113.1	C821 S822 L823 S829	C821-G825 PolarHBondContact O-N 3.44Å; S822-G825 PolarHBondContact O-N 3.17Å; L823-G825 VanDerWaalsContact C-N 3.35Å; L823-G825 PolarHBondContact O-N 2.77Å; G825-S829 VanDerWaalsContact O-CB 3.31Å; G825-S829 WeakPolarHBondContact O-CB 3.48Å; G825-S829 PolarHBondContact O-N 2.83Å; G825-S829 PolarHBondContact O-OG 3.17Å
826	L	95.2	Very high	93.1	Very high	22 Å²	22	55.1 Å²	55.1	12%	0.115	29%	0.291	C	S	.	.	H	α-helix	trans	-66	-45.8	176.1	-168.3	73.4	0	0	0	111.5	F797 Q800 L801 F804 S822 L823 S829 A830	F797-L826 HydrophobicContact CD2-CD1 4.08Å; F797-L826 HydrophobicContact CE1-CD1 4.42Å; F797-L826 HydrophobicContact CE2-CD1 3.47Å; F797-L826 VanDerWaalsContact CE2-CD1 3.47Å; F797-L826 HydrophobicContact CE2-CG 3.86Å; F797-L826 HydrophobicContact CZ-CD1 3.68Å; F797-L826 HydrophobicContact CZ-CG 3.96Å; Q800-L826 HydrophobicContact CB-CD1 3.71Å; L801-L826 HydrophobicContact CB-CD1 4.39Å; F804-L826 HydrophobicContact CB-CD2 4.48Å; F804-L826 HydrophobicContact CD1-CD2 4.12Å; F804-L826 HydrophobicContact CG-CD2 4.22Å; S822-L826 WeakPolarHBondContact O-CB 3.3Å; S822-L826 PolarHBondContact O-N 2.93Å; L823-L826 PolarHBondContact O-N 2.94Å; L826-S829 PolarHBondContact O-N 3.15Å; L826-A830 WeakPolarHBondContact O-CB 3.24Å; L826-A830 PolarHBondContact O-N 3.02Å
827	I	96.5	Very high	93.1	Very high	84 Å²	84	50.8 Å²	50.8	43%	0.431	27%	0.273	S	S	.	.	H	α-helix	trans	-62	-47.2	177.1	-69.6	166.3	0	0	0	110.9	L823 L824 S829 A830 I831	L823-I827 HydrophobicContact CD1-CD1 4.03Å; L823-I827 HydrophobicContact CD1-CG1 4.35Å; L823-I827 HydrophobicContact CG-CD1 3.92Å; L823-I827 VanDerWaalsContact O-CG1 3.31Å; L823-I827 WeakPolarHBondContact O-CG1 3.41Å; L823-I827 PolarHBondContact O-N 3.06Å; L824-I827 PolarHBondContact O-N 2.71Å; I827-S829 VanDerWaalsContact C-N 3.32Å; I827-S829 PolarHBondContact O-N 3.36Å; I827-A830 WeakPolarHBondContact O-CB 3.27Å; I827-A830 PolarHBondContact O-N 3.46Å; I827-I831 HydrophobicContact CG2-CD1 3.99Å; I827-I831 WeakPolarHBondContact O-CG1 3.37Å; I827-I831 PolarHBondContact O-N 3.27Å
828	F	96	Very high	92.9	Very high	97 Å²	97	52.7 Å²	52.7	43%	0.425	27%	0.274	S	S	.	.	H	α-helix	trans	-58.9	-43.9	176.8	174.5	-100.8	0	0	0	111.8	L191 L824 I831 L832	L191-F828 HydrophobicContact CD2-CE1 3.94Å; L191-F828 HydrophobicContact CD2-CZ 4.44Å; L824-F828 VanDerWaalsContact O-CB 3.27Å; L824-F828 WeakPolarHBondContact O-CB 3.38Å; L824-F828 PolarHBondContact O-N 2.62Å; F828-I831 PolarHBondContact O-N 2.94Å; F828-L832 HydrophobicContact CD1-CD1 4.11Å; F828-L832 HydrophobicContact CE1-CD1 3.46Å; F828-L832 VanDerWaalsContact CE1-CD1 3.46Å; F828-L832 HydrophobicContact CE1-CG 4.27Å; F828-L832 HydrophobicContact CE2-CD1 4.46Å; F828-L832 HydrophobicContact CZ-CD1 3.67Å; F828-L832 HydrophobicContact CZ-CG 4.23Å; F828-L832 PolarHBondContact O-N 2.71Å
829	S	96.4	Very high	92.6	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.007	28%	0.283	C	S	.	.	H	α-helix	trans	-68.1	-35.7	177.9	-56.1	0	0	0	0	112.2	F190 Q800 G825 L826 I827 L832 M833	F190-S829 WeakPolarHBondContact CD1-OG 3.47Å; F190-S829 WeakPolarHBondContact CZ-O 3.48Å; Q800-S829 PolarHBondContact NE2-OG 2.88Å; Q800-S829 PolarHBondContact OE1-OG 3.22Å; G825-S829 VanDerWaalsContact O-CB 3.31Å; G825-S829 WeakPolarHBondContact O-CB 3.48Å; G825-S829 PolarHBondContact O-N 2.83Å; G825-S829 PolarHBondContact O-OG 3.17Å; L826-S829 PolarHBondContact O-N 3.15Å; I827-S829 VanDerWaalsContact C-N 3.32Å; I827-S829 PolarHBondContact O-N 3.36Å; S829-L832 PolarHBondContact O-N 3.31Å; S829-M833 VanDerWaalsContact O-CB 3.31Å; S829-M833 WeakPolarHBondContact O-CB 3.49Å; S829-M833 PolarHBondContact O-N 3.24Å
830	A	95.7	Very high	91.9	Very high	23 Å²	23	52.8 Å²	52.8	19%	0.19	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-43.5	171.7	0	0	0	0	0	112.1	F797 L826 I827 M833 I834	F797-A830 HydrophobicContact CE2-CB 3.86Å; F797-A830 HydrophobicContact CZ-CB 4.32Å; L826-A830 WeakPolarHBondContact O-CB 3.24Å; L826-A830 PolarHBondContact O-N 3.02Å; I827-A830 WeakPolarHBondContact O-CB 3.27Å; I827-A830 PolarHBondContact O-N 3.46Å; A830-M833 PolarHBondContact O-N 2.77Å; A830-I834 WeakPolarHBondContact O-CB 3.44Å; A830-I834 VanDerWaalsContact O-CG1 3.25Å; A830-I834 WeakPolarHBondContact O-CG1 3.37Å; A830-I834 PolarHBondContact O-N 2.71Å
831	I	95.9	Very high	91	Very high	104 Å²	104	53.3 Å²	53.3	53%	0.533	27%	0.271	S	S	.	.	H	α-helix	trans	-60.6	-47.4	175.7	-68.1	164	0	0	0	110.6	I827 F828 M833 I834 F835	I827-I831 HydrophobicContact CG2-CD1 3.99Å; I827-I831 WeakPolarHBondContact O-CG1 3.37Å; I827-I831 PolarHBondContact O-N 3.27Å; F828-I831 PolarHBondContact O-N 2.94Å; I831-M833 PolarHBondContact O-N 3.15Å; I831-I834 PolarHBondContact O-N 3.31Å; I831-F835 WeakPolarHBondContact O-CB 3.37Å; I831-F835 PolarHBondContact O-N 3.05Å
832	L	94.6	Very high	90	Very high	29 Å²	29	56.2 Å²	56.2	15%	0.152	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-42	176.1	-72.3	-175.7	0	0	0	112.3	F190 L191 F194 F828 S829 F835 T836	F190-L832 HydrophobicContact CE1-CB 3.89Å; F190-L832 HydrophobicContact CE1-CD1 4.09Å; F190-L832 HydrophobicContact CZ-CB 4.42Å; L191-L832 HydrophobicContact CD2-CD1 4.38Å; F194-L832 HydrophobicContact CD2-CB 3.98Å; F194-L832 HydrophobicContact CD2-CD1 4.29Å; F194-L832 HydrophobicContact CE1-CD2 4.48Å; F194-L832 HydrophobicContact CE2-CB 3.89Å; F194-L832 HydrophobicContact CE2-CD1 4.44Å; F194-L832 HydrophobicContact CE2-CD2 3.95Å; F194-L832 HydrophobicContact CE2-CG 4.32Å; F194-L832 HydrophobicContact CG-CD1 4.37Å; F194-L832 HydrophobicContact CZ-CD2 3.89Å; F828-L832 HydrophobicContact CD1-CD1 4.11Å; F828-L832 HydrophobicContact CE1-CD1 3.46Å; F828-L832 VanDerWaalsContact CE1-CD1 3.46Å; F828-L832 HydrophobicContact CE1-CG 4.27Å; F828-L832 HydrophobicContact CE2-CD1 4.46Å; F828-L832 HydrophobicContact CZ-CD1 3.67Å; F828-L832 HydrophobicContact CZ-CG 4.23Å; F828-L832 PolarHBondContact O-N 2.71Å; S829-L832 PolarHBondContact O-N 3.31Å; L832-F835 PolarHBondContact O-N 3.27Å; L832-T836 VanDerWaalsContact O-CG2 3.3Å; L832-T836 WeakPolarHBondContact O-CG2 3.19Å; L832-T836 PolarHBondContact O-N 2.91Å
833	M	92.9	Very high	88.9	Confident	27 Å²	27	57.6 Å²	57.6	13%	0.133	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-50.1	176.1	-177.7	173.5	60.9	0	0	111	F190 L793 A794 F797 S829 A830 I831 F835 T836 I837	F190-M833 HydrophobicContact CZ-CB 4.21Å; L793-M833 HydrophobicContact CB-CG 4.47Å; A794-M833 HydrophobicContact CB-SD 4.19Å; F797-M833 HydrophobicContact CB-CE 4.43Å; F797-M833 HydrophobicContact CB-SD 4.16Å; F797-M833 HydrophobicContact CD1-CE 4.12Å; F797-M833 HydrophobicContact CD2-CE 4.22Å; F797-M833 HydrophobicContact CE1-CE 4.46Å; F797-M833 HydrophobicContact CG-CE 3.99Å; F797-M833 HydrophobicContact CG-SD 4.36Å; S829-M833 VanDerWaalsContact O-CB 3.31Å; S829-M833 WeakPolarHBondContact O-CB 3.49Å; S829-M833 PolarHBondContact O-N 3.24Å; A830-M833 PolarHBondContact O-N 2.77Å; I831-M833 PolarHBondContact O-N 3.15Å; M833-F835 VanDerWaalsContact C-N 3.28Å; M833-F835 PolarHBondContact O-N 2.91Å; M833-T836 PolarHBondContact O-N 3.39Å; M833-T836 PolarHBondContact O-OG1 3.47Å; M833-I837 HydrophobicContact CG-CD1 3.87Å; M833-I837 WeakPolarHBondContact O-CG1 3.5Å; M833-I837 PolarHBondContact O-N 3.41Å
834	I	92.5	Very high	87.4	Confident	91 Å²	91	54.4 Å²	54.4	47%	0.467	27%	0.273	S	S	.	.	H	α-helix	trans	-57.6	-42.1	176.1	-70.5	165	0	0	0	110.6	A830 I831 T836 I837 I838	A830-I834 WeakPolarHBondContact O-CB 3.44Å; A830-I834 VanDerWaalsContact O-CG1 3.25Å; A830-I834 WeakPolarHBondContact O-CG1 3.37Å; A830-I834 PolarHBondContact O-N 2.71Å; I831-I834 PolarHBondContact O-N 3.31Å; I834-T836 PolarHBondContact O-N 3.44Å; I834-I837 PolarHBondContact O-N 2.92Å; I834-I838 HydrophobicContact CG2-CD1 3.62Å; I834-I838 HydrophobicContact CG2-CG1 4.28Å; I834-I838 WeakPolarHBondContact O-CB 3.28Å; I834-I838 WeakPolarHBondContact O-CG1 3.19Å; I834-I838 PolarHBondContact O-N 3.15Å
835	F	90.7	Very high	85.5	Confident	113 Å²	113	50.8 Å²	50.8	50%	0.496	26%	0.262	S	S	.	.	H	α-helix	trans	-61.6	-42.5	174	178.3	-97.7	0	0	0	112.6	I831 L832 M833 I837 T839	I831-F835 WeakPolarHBondContact O-CB 3.37Å; I831-F835 PolarHBondContact O-N 3.05Å; L832-F835 PolarHBondContact O-N 3.27Å; M833-F835 VanDerWaalsContact C-N 3.28Å; M833-F835 PolarHBondContact O-N 2.91Å; F835-I837 PolarHBondContact O-N 3.34Å; F835-T839 HydrophobicContact CD1-CG2 4.36Å; F835-T839 HydrophobicContact CD2-CG2 4.08Å; F835-T839 HydrophobicContact CE1-CG2 4.02Å; F835-T839 HydrophobicContact CE2-CG2 3.73Å; F835-T839 HydrophobicContact CG-CG2 4.39Å; F835-T839 HydrophobicContact CZ-CG2 3.71Å; F835-T839 WeakPolarHBondContact O-CB 3.28Å; F835-T839 VanDerWaalsContact O-CG2 3.31Å; F835-T839 WeakPolarHBondContact O-CG2 3.46Å; F835-T839 PolarHBondContact O-N 3.37Å; F835-T839 PolarHBondContact O-OG1 2.93Å
836	T	88.4	Confident	83.4	Confident	8 Å²	8	51.5 Å²	51.5	5%	0.049	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-37.4	174.8	68.2	0	0	0	0	112.9	F194 L793 L832 M833 I834 T839 G840	F194-T836 HydrophobicContact CD2-CG2 3.72Å; F194-T836 HydrophobicContact CE2-CG2 3.43Å; F194-T836 VanDerWaalsContact CE2-CG2 3.43Å; L793-T836 HydrophobicContact CD1-CG2 3.62Å; L793-T836 VanDerWaalsContact CD1-OG1 3.27Å; L793-T836 WeakPolarHBondContact CD1-OG1 3.27Å; L832-T836 VanDerWaalsContact O-CG2 3.3Å; L832-T836 WeakPolarHBondContact O-CG2 3.19Å; L832-T836 PolarHBondContact O-N 2.91Å; M833-T836 PolarHBondContact O-N 3.39Å; M833-T836 PolarHBondContact O-OG1 3.47Å; I834-T836 PolarHBondContact O-N 3.44Å; T836-T839 PolarHBondContact O-OG1 2.9Å; T836-G840 WeakPolarHBondContact O-CA 3.16Å; T836-G840 PolarHBondContact O-N 3.28Å
837	I	87	Confident	81.4	Confident	55 Å²	55	51.2 Å²	51.2	28%	0.282	27%	0.266	S	S	.	.	H	α-helix	trans	-65.8	-54.2	177.1	-69.1	167.6	0	0	0	109.2	M833 I834 F835 T839 G840 W841	M833-I837 HydrophobicContact CG-CD1 3.87Å; M833-I837 WeakPolarHBondContact O-CG1 3.5Å; M833-I837 PolarHBondContact O-N 3.41Å; I834-I837 PolarHBondContact O-N 2.92Å; F835-I837 PolarHBondContact O-N 3.34Å; I837-T839 PolarHBondContact O-N 3.31Å; I837-G840 PolarHBondContact O-N 3.37Å; I837-W841 WeakPolarHBondContact O-CB 3.1Å; I837-W841 VanDerWaalsContact O-CD1 3.25Å; I837-W841 PolarHBondContact O-N 2.93Å
838	I	86.4	Confident	79.2	Confident	94 Å²	94	50.5 Å²	50.5	48%	0.482	27%	0.268	S	S	.	.	H	α-helix	trans	-58.1	-50.5	179.4	-70.1	171.7	0	0	0	110.6	I834 G840 W841 I842	I834-I838 HydrophobicContact CG2-CD1 3.62Å; I834-I838 HydrophobicContact CG2-CG1 4.28Å; I834-I838 WeakPolarHBondContact O-CB 3.28Å; I834-I838 WeakPolarHBondContact O-CG1 3.19Å; I834-I838 PolarHBondContact O-N 3.15Å; I838-G840 PolarHBondContact O-N 3.33Å; I838-W841 PolarHBondContact O-N 3.22Å; I838-I842 HydrophobicContact CG2-CD1 3.64Å; I838-I842 HydrophobicContact CG2-CG1 4.44Å; I838-I842 VanDerWaalsContact O-CB 3.32Å; I838-I842 WeakPolarHBondContact O-CB 3.43Å; I838-I842 WeakPolarHBondContact O-CG1 3.3Å; I838-I842 PolarHBondContact O-N 3.39Å
839	T	83.3	Confident	77	Confident	32 Å²	32	46.1 Å²	46.1	20%	0.196	25%	0.25	C	C	.	.	H	α-helix	trans	-66.2	-37.2	-179.3	56.4	0	0	0	0	112.3	F835 T836 I837 M843	F835-T839 HydrophobicContact CD1-CG2 4.36Å; F835-T839 HydrophobicContact CD2-CG2 4.08Å; F835-T839 HydrophobicContact CE1-CG2 4.02Å; F835-T839 HydrophobicContact CE2-CG2 3.73Å; F835-T839 HydrophobicContact CG-CG2 4.39Å; F835-T839 HydrophobicContact CZ-CG2 3.71Å; F835-T839 WeakPolarHBondContact O-CB 3.28Å; F835-T839 VanDerWaalsContact O-CG2 3.31Å; F835-T839 WeakPolarHBondContact O-CG2 3.46Å; F835-T839 PolarHBondContact O-N 3.37Å; F835-T839 PolarHBondContact O-OG1 2.93Å; T836-T839 PolarHBondContact O-OG1 2.9Å; I837-T839 PolarHBondContact O-N 3.31Å; T839-M843 VanDerWaalsContact C-CE 3.46Å; T839-M843 WeakPolarHBondContact O-CB 3.42Å; T839-M843 WeakPolarHBondContact O-CE 3.48Å; T839-M843 WeakPolarHBondContact O-CG 2.67Å; T839-M843 PolarHBondContact O-N 2.97Å
840	G	77.2	Confident	75.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.7	-49.8	174.7	0	0	0	0	0	113.2	T836 I837 I838 I842 M843 A844	T836-G840 WeakPolarHBondContact O-CA 3.16Å; T836-G840 PolarHBondContact O-N 3.28Å; I837-G840 PolarHBondContact O-N 3.37Å; I838-G840 PolarHBondContact O-N 3.33Å; G840-I842 VanDerWaalsContact C-N 3.35Å; G840-I842 PolarHBondContact O-N 2.82Å; G840-M843 PolarHBondContact O-N 3.45Å; G840-A844 VanDerWaalsContact O-CB 3.3Å; G840-A844 WeakPolarHBondContact O-CB 2.86Å; G840-A844 PolarHBondContact O-N 3.03Å
841	W	72	Confident	73.6	Confident	107 Å²	107	51.5 Å²	51.5	41%	0.405	27%	0.268	S	S	.	.	H	α-helix	trans	-62	-40.7	175.1	-84.6	95.3	0	0	0	112.1	I837 I838 G845	I837-W841 WeakPolarHBondContact O-CB 3.1Å; I837-W841 VanDerWaalsContact O-CD1 3.25Å; I837-W841 PolarHBondContact O-N 2.93Å; I838-W841 PolarHBondContact O-N 3.22Å; W841-G845 PolarHBondContact O-N 3.15Å
842	I	73.5	Confident	71.7	Confident	96 Å²	96	50.4 Å²	50.4	49%	0.492	26%	0.263	S	S	.	.	H	α-helix	trans	-60.5	-50.1	172.2	-71.7	170.3	0	0	0	110	I838 G840 A844 S846	I838-I842 HydrophobicContact CG2-CD1 3.64Å; I838-I842 HydrophobicContact CG2-CG1 4.44Å; I838-I842 VanDerWaalsContact O-CB 3.32Å; I838-I842 WeakPolarHBondContact O-CB 3.43Å; I838-I842 WeakPolarHBondContact O-CG1 3.3Å; I838-I842 PolarHBondContact O-N 3.39Å; G840-I842 VanDerWaalsContact C-N 3.35Å; G840-I842 PolarHBondContact O-N 2.82Å; I842-A844 PolarHBondContact O-N 3.33Å; I842-S846 WeakPolarHBondContact O-CA 3.35Å; I842-S846 WeakPolarHBondContact O-CB 3.48Å; I842-S846 PolarHBondContact O-N 3.26Å
843	M	67.3	Low	70	Confident	39 Å²	39	50 Å²	50	19%	0.192	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-35	-178.6	-79.8	-178.9	-81.8	0	0	113.9	R205 W786 T839 G840 S846 S847	R205-M843 HydrophobicContact CG-SD 4.5Å; R205-M843 PolarHBondContact NE-SD 2.1Å; R205-M843 PolarHBondContact NH2-SD 3.05Å; W786-M843 HydrophobicContact CH2-CB 4.48Å; W786-M843 HydrophobicContact CH2-CE 3.18Å; W786-M843 HydrophobicContact CH2-SD 3.64Å; W786-M843 HydrophobicContact CZ2-CB 3.9Å; W786-M843 HydrophobicContact CZ2-CE 3.81Å; W786-M843 HydrophobicContact CZ2-CG 4.48Å; W786-M843 HydrophobicContact CZ2-SD 3.75Å; W786-M843 HydrophobicContact CZ3-CE 3.69Å; T839-M843 VanDerWaalsContact C-CE 3.46Å; T839-M843 WeakPolarHBondContact O-CB 3.42Å; T839-M843 WeakPolarHBondContact O-CE 3.48Å; T839-M843 WeakPolarHBondContact O-CG 2.67Å; T839-M843 PolarHBondContact O-N 2.97Å; G840-M843 PolarHBondContact O-N 3.45Å; M843-S846 CarbonylContact O-C 3.36Å; M843-S847 PolarHBondContact O-N 3.23Å
844	A	62.8	Low	68.7	Low	7 Å²	7	50.7 Å²	50.7	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-75.4	-45.2	179.2	0	0	0	0	0	111	H783 W786 G840 I842 S846 R850	H783-A844 WeakPolarHBondContact CD2-CB 3.2Å; H783-A844 VanDerWaalsContact CE1-CB 3.49Å; H783-A844 WeakPolarHBondContact CE1-CB 3.39Å; H783-A844 VanDerWaalsContact NE2-CB 3.28Å; H783-A844 WeakPolarHBondContact NE2-CB 3.46Å; H783-A844 PolarHBondContact NE2-O 3.09Å; W786-A844 HydrophobicContact CG-CB 4.25Å; G840-A844 VanDerWaalsContact O-CB 3.3Å; G840-A844 WeakPolarHBondContact O-CB 2.86Å; G840-A844 PolarHBondContact O-N 3.03Å; I842-A844 PolarHBondContact O-N 3.33Å; A844-S846 VanDerWaalsContact C-N 3.3Å; A844-S846 PolarHBondContact O-N 3.2Å; A844-R850 PolarHBondContact O-NH2 3.4Å
845	G	55.3	Low	67.3	Low	31 Å²	31	54.3 Å²	54.3	32%	0.32	27%	0.271	S	S	.	.	H	α-helix	trans	-67.6	-28.2	172.9	0	0	0	0	0	113.4	H783 W841 R850	H783-G845 PolarHBondContact NE2-N 2.98Å; W841-G845 PolarHBondContact O-N 3.15Å; G845-R850 PolarHBondContact O-NH1 3.45Å; G845-R850 PolarHBondContact O-NH2 3.01Å
846	S	51.6	Low	65.9	Low	22 Å²	22	52.3 Å²	52.3	15%	0.154	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	70.6	173.4	171.6	0	0	0	0	110	I842 M843 A844 S848 K851	I842-S846 WeakPolarHBondContact O-CA 3.35Å; I842-S846 WeakPolarHBondContact O-CB 3.48Å; I842-S846 PolarHBondContact O-N 3.26Å; M843-S846 CarbonylContact O-C 3.36Å; A844-S846 VanDerWaalsContact C-N 3.3Å; A844-S846 PolarHBondContact O-N 3.2Å; S846-S848 PolarHBondContact O-N 2.92Å; S846-K851 WeakPolarHBondContact OG-CD 3.26Å; S846-K851 WeakPolarHBondContact OG-CE 3.41Å; S846-K851 PolarHBondContact OG-NZ 3.43Å; S846-K851 VanDerWaalsContact OG-NZ 3.11Å
847	S	54.2	Low	64.5	Low	16 Å²	16	52 Å²	52	11%	0.112	26%	0.264	C	S	.	.			trans	-44.1	122.2	154.5	169.5	0	0	0	0	107.8	M843 A849 R850 K851 V970 R971	M843-S847 PolarHBondContact O-N 3.23Å; S847-A849 PolarHBondContact O-N 3.48Å; S847-A849 PolarHBondContact OG-N 3.41Å; S847-R850 WeakPolarHBondContact O-CB 3.26Å; S847-R850 PolarHBondContact O-N 2.82Å; S847-K851 PolarHBondContact O-N 3.33Å; S847-V970 WeakPolarHBondContact CB-O 3.34Å; S847-V970 PolarHBondContact OG-O 3.05Å; S847-R971 PolarHBondContact OG-O 3.39Å
848	S	49.1	Very low	63	Low	68 Å²	68	55.4 Å²	55.4	48%	0.476	28%	0.278	S	S	.	.	H	α-helix	trans	-54.4	-27.3	-176.6	-54.4	0	0	0	0	111.7	S846 K851 L852	S846-S848 PolarHBondContact O-N 2.92Å; S848-K851 CarbonylContact O-C 3.49Å; S848-K851 PolarHBondContact O-N 2.94Å; S848-L852 WeakPolarHBondContact O-CB 3.42Å; S848-L852 PolarHBondContact O-N 2.84Å
849	A	50.5	Low	61.4	Low	6 Å²	6	55.8 Å²	55.8	5%	0.05	28%	0.281	C	S	.	.	H	α-helix	trans	-76	-26	177	0	0	0	0	0	115.7	S847 L852 L853 R971 I972	S847-A849 PolarHBondContact O-N 3.48Å; S847-A849 PolarHBondContact OG-N 3.41Å; A849-L852 PolarHBondContact O-N 3.3Å; A849-L853 WeakPolarHBondContact O-CG 3.27Å; A849-L853 PolarHBondContact O-N 3.48Å; A849-R971 WeakPolarHBondContact CB-O 3.48Å; A849-I972 HydrophobicContact CB-CB 3.42Å; A849-I972 VanDerWaalsContact CB-CB 3.42Å; A849-I972 HydrophobicContact CB-CD1 3.9Å; A849-I972 HydrophobicContact CB-CG1 3.67Å; A849-I972 HydrophobicContact CB-CG2 4.43Å
850	R	60	Low	59.8	Low	12 Å²	12	57.1 Å²	57.1	5%	0.045	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-49.4	162.5	-97.3	173.4	-86.5	-177.9	7.9	110.2	A844 G845 S847 L852 L853 F854 V970	A844-R850 PolarHBondContact O-NH2 3.4Å; G845-R850 PolarHBondContact O-NH1 3.45Å; G845-R850 PolarHBondContact O-NH2 3.01Å; S847-R850 WeakPolarHBondContact O-CB 3.26Å; S847-R850 PolarHBondContact O-N 2.82Å; R850-L852 VanDerWaalsContact C-N 3.3Å; R850-L852 PolarHBondContact O-N 3.25Å; R850-L853 PolarHBondContact O-N 3.34Å; R850-F854 HydrophobicContact CB-CD2 4.45Å; R850-F854 HydrophobicContact CB-CE2 4.29Å; R850-F854 HydrophobicContact CG-CE2 4.38Å; R850-F854 WeakPolarHBondContact O-CD2 3.43Å; R850-F854 WeakPolarHBondContact O-CG 3.5Å; R850-F854 PolarHBondContact O-N 3.33Å; R850-V970 HydrophobicContact CG-CB 4.11Å; R850-V970 HydrophobicContact CG-CG1 3.36Å; R850-V970 VanDerWaalsContact CZ-N 3.31Å; R850-V970 PolarHBondContact NE-O 2.84Å
851	K	59.6	Low	58.2	Low	125 Å²	125	60.8 Å²	60.8	54%	0.543	32%	0.315	S	S	.	.	H	α-helix	trans	-63.8	-36.2	176.8	-78.6	-173.8	176.8	158.9	0	111.8	S846 S847 S848 F854 R855	S846-K851 WeakPolarHBondContact OG-CD 3.26Å; S846-K851 WeakPolarHBondContact OG-CE 3.41Å; S846-K851 PolarHBondContact OG-NZ 3.43Å; S846-K851 VanDerWaalsContact OG-NZ 3.11Å; S847-K851 PolarHBondContact O-N 3.33Å; S848-K851 CarbonylContact O-C 3.49Å; S848-K851 PolarHBondContact O-N 2.94Å; K851-F854 PolarHBondContact O-N 3.16Å; K851-R855 WeakPolarHBondContact O-CB 3.48Å; K851-R855 PolarHBondContact O-N 3.47Å
852	L	55.9	Low	56.9	Low	81 Å²	81	59.2 Å²	59.2	42%	0.424	32%	0.324	S	S	.	.	H	α-helix	trans	-64.3	-46.2	174.9	-169.1	64.4	0	0	0	111.5	S848 A849 R850 R855 N856	S848-L852 WeakPolarHBondContact O-CB 3.42Å; S848-L852 PolarHBondContact O-N 2.84Å; A849-L852 PolarHBondContact O-N 3.3Å; R850-L852 VanDerWaalsContact C-N 3.3Å; R850-L852 PolarHBondContact O-N 3.25Å; L852-R855 PolarHBondContact O-N 2.79Å; L852-N856 VanDerWaalsContact O-CB 3.24Å; L852-N856 WeakPolarHBondContact O-CB 3.4Å; L852-N856 PolarHBondContact O-N 2.97Å; L852-N856 PolarHBondContact O-OD1 2.85Å; L852-N856 VanDerWaalsContact O-OD1 3.14Å
853	L	59	Low	55.5	Low	20 Å²	20	58.4 Å²	58.4	11%	0.105	32%	0.324	C	S	.	.	H	α-helix	trans	-58.4	-51.9	172.5	-77.7	170	0	0	0	111.4	F214 K423 A427 F461 A849 R850 R855 N856 A857 I972	F214-L853 HydrophobicContact CZ-CD1 3.92Å; K423-L853 HydrophobicContact CB-CD2 4.1Å; A427-L853 HydrophobicContact CB-CB 3.95Å; A427-L853 HydrophobicContact CB-CD2 4.43Å; F461-L853 HydrophobicContact CZ-CD1 4.28Å; A849-L853 WeakPolarHBondContact O-CG 3.27Å; A849-L853 PolarHBondContact O-N 3.48Å; R850-L853 PolarHBondContact O-N 3.34Å; L853-R855 VanDerWaalsContact C-N 3.29Å; L853-R855 PolarHBondContact O-N 3.31Å; L853-N856 PolarHBondContact O-N 3.36Å; L853-A857 WeakPolarHBondContact O-CB 3.4Å; L853-A857 PolarHBondContact O-N 3.4Å; L853-I972 HydrophobicContact CD1-CD1 3.82Å; L853-I972 HydrophobicContact CD1-CG1 4.43Å; L853-I972 HydrophobicContact CD2-CD1 4.09Å; L853-I972 HydrophobicContact CG-CD1 3.69Å
854	F	65.7	Low	54.1	Low	42 Å²	42	62 Å²	62	18%	0.184	34%	0.344	C	S	.	.	H	α-helix	trans	-68.6	-23.2	-178.1	-63.5	-44.7	0	0	0	114.3	A427 C430 K431 F461 R850 K851	A427-F854 HydrophobicContact CB-CD1 4.4Å; A427-F854 WeakPolarHBondContact O-CE1 3.33Å; C430-F854 HydrophobicContact CB-CE1 4.42Å; K431-F854 HydrophobicContact CB-CD1 3.79Å; K431-F854 HydrophobicContact CB-CE1 3.87Å; K431-F854 HydrophobicContact CD-CD1 4.36Å; K431-F854 HydrophobicContact CG-CD1 4.3Å; F461-F854 HydrophobicContact CE2-CE1 4.09Å; F461-F854 AromaticContact CE2-CZ 3.89Å; F461-F854 HydrophobicContact CE2-CZ 3.89Å; R850-F854 HydrophobicContact CB-CD2 4.45Å; R850-F854 HydrophobicContact CB-CE2 4.29Å; R850-F854 HydrophobicContact CG-CE2 4.38Å; R850-F854 WeakPolarHBondContact O-CD2 3.43Å; R850-F854 WeakPolarHBondContact O-CG 3.5Å; R850-F854 PolarHBondContact O-N 3.33Å; K851-F854 PolarHBondContact O-N 3.16Å
855	R	63.6	Low	52.9	Low	166 Å²	166	69 Å²	69	63%	0.626	38%	0.38	S	S	*	.	H	α-helix	trans	-82	-46	173.6	-168.2	-179.6	83	149.8	7.1	111.5	K851 L852 L853 A857 H858	K851-R855 WeakPolarHBondContact O-CB 3.48Å; K851-R855 PolarHBondContact O-N 3.47Å; L852-R855 PolarHBondContact O-N 2.79Å; L853-R855 VanDerWaalsContact C-N 3.29Å; L853-R855 PolarHBondContact O-N 3.31Å; R855-A857 PolarHBondContact O-N 2.94Å; R855-H858 PolarHBondContact O-N 3.15Å
856	N	61	Low	51.9	Low	71 Å²	71	72.6 Å²	72.6	38%	0.38	40%	0.401	S	S	.	.	H	α-helix	trans	-65.4	-27.3	175	-65.5	17.4	0	0	0	110.9	L852 L853 H858 L859	L852-N856 VanDerWaalsContact O-CB 3.24Å; L852-N856 WeakPolarHBondContact O-CB 3.4Å; L852-N856 PolarHBondContact O-N 2.97Å; L852-N856 PolarHBondContact O-OD1 2.85Å; L852-N856 VanDerWaalsContact O-OD1 3.14Å; L853-N856 PolarHBondContact O-N 3.36Å; N856-H858 PolarHBondContact O-N 3.03Å; N856-H858 VanDerWaalsContact O-N 3.16Å; N856-L859 PolarHBondContact O-N 2.92Å
857	A	58.7	Low	50.9	Low	3 Å²	3	76.3 Å²	76.3	3%	0.025	43%	0.427	C	S	.	.	H	α-helix	trans	-65.5	-4.9	169.6	0	0	0	0	0	115.1	Y424 L853 R855	Y424-A857 HydrophobicContact CD2-CB 4.41Å; Y424-A857 HydrophobicContact CE2-CB 4.29Å; L853-A857 WeakPolarHBondContact O-CB 3.4Å; L853-A857 PolarHBondContact O-N 3.4Å; R855-A857 PolarHBondContact O-N 2.94Å
858	H	56.3	Low	49.8	Very low	125 Å²	125	81.4 Å²	81.4	58%	0.579	46%	0.457	S	S	*	.	H	α-helix	trans	-101	-23.8	165.7	-91.9	-57	0	0	0	113.1	K431 R855 N856	K431-H858 PolarHBondContact NZ-CD2 3.33Å; K431-H858 PolarHBondContact NZ-CE1 3.06Å; K431-H858 PolarHBondContact NZ-NE2 3.44Å; R855-H858 PolarHBondContact O-N 3.15Å; N856-H858 PolarHBondContact O-N 3.03Å; N856-H858 VanDerWaalsContact O-N 3.16Å
859	L	52.5	Low	48.9	Very low	102 Å²	102	85.2 Å²	85.2	53%	0.534	47%	0.472	S	S	.	.	H	α-helix	trans	-79.9	-31.7	-169.8	-75	165.7	0	0	0	113	N856 T863	N856-L859 PolarHBondContact O-N 2.92Å; L859-T863 WeakPolarHBondContact O-CG2 3.45Å
860	V	50.5	Low	47.9	Very low	60 Å²	60	93.6 Å²	93.6	36%	0.364	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-74.5	-39.1	177.4	-173.3	0	0	0	0	111.3	Y424 A862 T863	Y424-V860 HydrophobicContact CD2-CB 4.31Å; Y424-V860 HydrophobicContact CD2-CG2 4.06Å; Y424-V860 HydrophobicContact CE2-CB 3.66Å; Y424-V860 HydrophobicContact CE2-CG1 4.46Å; Y424-V860 HydrophobicContact CE2-CG2 3.86Å; V860-A862 PolarHBondContact O-N 3.4Å; V860-T863 PolarHBondContact O-N 3.29Å; V860-T863 VanDerWaalsContact O-N 3.08Å; V860-T863 PolarHBondContact O-OG1 3.31Å; V860-T863 VanDerWaalsContact O-OG1 3.12Å
861	S	43.4	Very low	46.5	Very low	78 Å²	78	102.1 Å²	102.1	55%	0.545	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-66.3	15.7	174.9	-169	0	0	0	0	114.6
862	A	45	Very low	45	Very low	73 Å²	73	101.3 Å²	101.3	60%	0.603	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-143	8.5	178	0	0	0	0	0	112.7	V860	V860-A862 PolarHBondContact O-N 3.4Å
863	T	43.7	Very low	43.7	Very low	79 Å²	79	106.1 Å²	106.1	49%	0.485	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.7	-18.6	178.2	50.4	0	0	0	0	114.3	L859 V860	L859-T863 WeakPolarHBondContact O-CG2 3.45Å; V860-T863 PolarHBondContact O-N 3.29Å; V860-T863 VanDerWaalsContact O-N 3.08Å; V860-T863 PolarHBondContact O-OG1 3.31Å; V860-T863 VanDerWaalsContact O-OG1 3.12Å
864	D	38.6	Very low	42.2	Very low	116 Å²	116	116 Å²	116	62%	0.62	62%	0.618	S	S	*	*	S	Bend	trans	-95.5	-8.8	-170.1	-58.3	-6.6	0	0	0	112.7	S866	D864-S866 PolarHBondContact O-N 3.11Å
865	D	37.2	Very low	40.3	Very low	152 Å²	152	121.6 Å²	121.6	81%	0.813	65%	0.65	S	S	*	*	S	Bend	trans	-83.7	0.9	-179.2	-79.2	-37.3	0	0	0	114.8
866	S	33.4	Very low	38.7	Very low	107 Å²	107	118.4 Å²	118.4	75%	0.748	65%	0.653	S	S	*	*	S	Bend	trans	-145.6	28.4	-170.1	75.5	0	0	0	0	116.8	D864	D864-S866 PolarHBondContact O-N 3.11Å
867	S	30.4	Very low	37	Very low	101 Å²	101	121 Å²	121	71%	0.706	67%	0.673	S	S	*	*			trans	-145.2	79.7	169.9	64.8	0	0	0	0	112.3
868	V	31.9	Very low	35.6	Very low	122 Å²	122	127.9 Å²	127.9	74%	0.739	71%	0.709	S	S	*	*			trans	-108.9	142	167.9	177.4	0	0	0	0	108.3
869	D	29.9	Very low	34.1	Very low	149 Å²	149	127.1 Å²	127.1	80%	0.797	72%	0.717	S	S	*	*	S	Bend	trans	69.2	154.3	179	-62	-34.2	0	0	0	119
870	Q	30.2	Very low	33	Very low	181 Å²	181	128.8 Å²	128.8	85%	0.846	73%	0.731	S	S	*	*			trans	64	70.5	173	-53.7	-170.3	15.1	0	0	117.8
871	H	29.8	Very low	31.8	Very low	192 Å²	192	134.1 Å²	134.1	89%	0.889	75%	0.752	S	S	*	*				-157.4	111.5	108.3	-117.2	-74	0	0	0	113.6
872	S	28.2	Very low	31.1	Very low	108 Å²	108	139.2 Å²	139.2	76%	0.755	77%	0.767	S	S	*	*			trans	-73.3	167.5	164.2	-63.4	0	0	0	0	111.2
873	Q	27.9	Very low	30.1	Very low	182 Å²	182	147.6 Å²	147.6	85%	0.85	78%	0.783	S	S	*	*			trans	73.5	85.6	161.4	-167.5	178.5	-1.7	0	0	117.2
874	Y	27.9	Very low	29.3	Very low	228 Å²	228	147.3 Å²	147.3	89%	0.894	80%	0.796	S	S	*	*			trans	-151.1	74.8	137.4	-124.8	-74.7	0	0	0	113.3
875	N	27.1	Very low	28.8	Very low	159 Å²	159	147.1 Å²	147.1	85%	0.85	80%	0.803	S	S	*	*			trans	-85.7	122.6	160.8	-81.6	-19.1	0	0	0	108.9
876	S	28.3	Very low	28.4	Very low	98 Å²	98	148.1 Å²	148.1	69%	0.685	80%	0.803	S	S	*	*			trans	179.1	134	146.9	-82.8	0	0	0	0	111.6
877	P	27.3	Very low	28.2	Very low	125 Å²	125	149.4 Å²	149.4	81%	0.812	80%	0.801	S	S	*	*			trans	-81.6	152.2	160.9	35.3	-32.5	0	0	0	110.4
878	I	28.6	Very low	28.1	Very low	149 Å²	149	150.5 Å²	150.5	76%	0.764	80%	0.799	S	S	*	*			trans	-130.3	94	170.7	-54.5	-177.5	0	0	0	110.8	V880	I878-V880 HydrophobicContact CG2-CG2 3.69Å
879	S	25.2	Very low	28	Very low	109 Å²	109	150.9 Å²	150.9	76%	0.762	80%	0.797	S	S	*	*			trans	-80	116.7	148.3	50.3	0	0	0	0	108.3	Q881	S879-Q881 PolarHBondContact O-N 3.41Å
880	V	27.9	Very low	28.1	Very low	136 Å²	136	150.3 Å²	150.3	82%	0.824	79%	0.792	S	S	*	*			trans	-82.5	115.7	171	-176.3	0	0	0	0	108.8	I878	I878-V880 HydrophobicContact CG2-CG2 3.69Å
881	Q	26.9	Very low	28.2	Very low	173 Å²	173	146.5 Å²	146.5	81%	0.808	78%	0.782	S	S	*	*			trans	-100.1	165.4	179.9	-163.7	171.3	2.9	0	0	111.2	S879 R883	S879-Q881 PolarHBondContact O-N 3.41Å; Q881-R883 PolarHBondContact O-N 3.25Å
882	H	27.4	Very low	28.1	Very low	184 Å²	184	144.6 Å²	144.6	85%	0.852	78%	0.778	S	S	*	*			trans	-42.4	124.3	176.9	-85.5	-104.8	0	0	0	114.9
883	R	25.6	Very low	28.2	Very low	249 Å²	249	143.5 Å²	143.5	94%	0.94	78%	0.775	S	S	*	*				-158.8	136.8	104.7	-115.2	174.1	178.4	146.9	0.6	110.1	Q881	Q881-R883 PolarHBondContact O-N 3.25Å
884	G	25.4	Very low	28.5	Very low	73 Å²	73	142.1 Å²	142.1	75%	0.753	78%	0.779	S	S	*	*			trans	-112.5	143.6	-179.1	0	0	0	0	0	111.7
885	S	27.9	Very low	28.7	Very low	112 Å²	112	134.8 Å²	134.8	78%	0.783	77%	0.773	S	S	*	*			trans	-159.1	125.5	151.8	55.3	0	0	0	0	110.6
886	H	29.4	Very low	28.9	Very low	173 Å²	173	132.3 Å²	132.3	80%	0.801	76%	0.759	S	S	*	*			trans	66	128.4	144.1	-96.5	-100.6	0	0	0	122.7
887	L	28.5	Very low	29.1	Very low	134 Å²	134	139.6 Å²	139.6	70%	0.702	77%	0.772	S	S	*	*			trans	83.9	83.9	135.5	-127.7	66.3	0	0	0	119.4
888	N	28	Very low	29.3	Very low	125 Å²	125	141.4 Å²	141.4	67%	0.668	77%	0.767	S	S	*	*				67.9	131.5	116.1	-71.9	38.5	0	0	0	122.7
889	D	31.1	Very low	29.4	Very low	130 Å²	130	139.7 Å²	139.7	70%	0.695	77%	0.768	S	S	*	*				105.8	143.1	119.5	-89.4	-39.6	0	0	0	123.1
890	I	32.6	Very low	29.7	Very low	136 Å²	136	140.8 Å²	140.8	70%	0.697	77%	0.77	S	S	*	*			trans	79.4	81.1	148.6	-68	163.7	0	0	0	119.3
891	T	30.7	Very low	30	Very low	102 Å²	102	139.6 Å²	139.6	63%	0.626	76%	0.763	S	S	*	*				67.9	135.2	126.4	61.8	0	0	0	0	123.7
892	N	28.2	Very low	30.1	Very low	151 Å²	151	137.9 Å²	137.9	81%	0.807	76%	0.759	S	S	*	*				51	148.9	126.5	-42.8	-22	0	0	0	119.7
893	A	31.4	Very low	30.5	Very low	85 Å²	85	133.1 Å²	133.1	70%	0.702	75%	0.751	S	S	*	*			cis	-171.5	174.2	29.8	0	0	0	0	0	113.6
894	V	32.8	Very low	30.6	Very low	154 Å²	154	126 Å²	126	93%	0.933	74%	0.736	S	S	*	*			trans	69.5	144.8	157.9	-172.5	0	0	0	0	118.7
895	G	33.8	Very low	30.7	Very low	74 Å²	74	131.7 Å²	131.7	76%	0.763	74%	0.74	S	S	*	*			trans	164.9	4.5	167.1	0	0	0	0	0	119.9
896	D	30.1	Very low	30.8	Very low	106 Å²	106	132 Å²	132	57%	0.567	74%	0.74	S	S	*	*			trans	-49	134.8	-168.8	-173.9	21.7	0	0	0	118	K898	D896-K898 WeakPolarHBondContact OD1-CG 3.43Å; D896-K898 IonicContact OD1-NZ 2.74Å; D896-K898 VanDerWaalsContact OD2-CE 3.31Å; D896-K898 WeakPolarHBondContact OD2-CE 3.26Å; D896-K898 IonicContact OD2-NZ 3.7Å; D896-K898 PolarHBondContact OD2-NZ 3.44Å
897	R	33.6	Very low	30.8	Very low	251 Å²	251	133.2 Å²	133.2	95%	0.947	75%	0.748	S	S	*	*			trans	-155	133.8	141.3	-113.6	171.5	-159.6	-152.2	3.2	114.2
898	K	30.1	Very low	30.7	Very low	164 Å²	164	134.7 Å²	134.7	71%	0.713	75%	0.751	S	S	*	*			trans	-102	171.3	-163.4	-72.2	151.3	174.9	139.8	0	115.7	D896	D896-K898 WeakPolarHBondContact OD1-CG 3.43Å; D896-K898 IonicContact OD1-NZ 2.74Å; D896-K898 VanDerWaalsContact OD2-CE 3.31Å; D896-K898 WeakPolarHBondContact OD2-CE 3.26Å; D896-K898 IonicContact OD2-NZ 3.7Å; D896-K898 PolarHBondContact OD2-NZ 3.44Å
899	S	31.8	Very low	30.7	Very low	112 Å²	112	140.4 Å²	140.4	78%	0.783	76%	0.763	S	S	*	*			trans	128	144.8	140.4	70.4	0	0	0	0	114
900	V	31.6	Very low	30.5	Very low	133 Å²	133	139.8 Å²	139.8	81%	0.806	76%	0.76	S	S	*	*			cis	-169.5	143.3	-4.9	121.9	0	0	0	0	106.3
901	V	34.2	Very low	30.4	Very low	110 Å²	110	140.4 Å²	140.4	67%	0.667	76%	0.764	S	S	*	*			cis	-158.7	158.3	-10.4	114.2	0	0	0	0	109.6
902	D	28.8	Very low	30.4	Very low	138 Å²	138	139.9 Å²	139.9	74%	0.738	77%	0.765	S	S	*	*			trans	5.5	164.7	153.6	-37.7	-36.6	0	0	0	122.6
903	A	34.4	Very low	30.4	Very low	83 Å²	83	140.3 Å²	140.3	69%	0.686	77%	0.767	S	S	*	*			cis	-139.7	146.5	12.4	0	0	0	0	0	111
904	T	27.8	Very low	30.6	Very low	100 Å²	100	140.9 Å²	140.9	61%	0.613	76%	0.764	S	S	*	*				69.2	126	61.8	-37.4	0	0	0	0	110.9
905	F	28.4	Very low	30.6	Very low	193 Å²	193	141.4 Å²	141.4	85%	0.846	76%	0.762	S	S	*	*			cis	-139.7	157.6	39.6	-68.6	-102.2	0	0	0	115.3
906	P	29.2	Very low	30.4	Very low	119 Å²	119	145.3 Å²	145.3	77%	0.773	76%	0.76	S	S	*	*			trans	-101.7	165.5	158.8	38.9	-31.5	0	0	0	112.8
907	M	30.9	Very low	30.4	Very low	197 Å²	197	149.8 Å²	149.8	97%	0.97	78%	0.775	S	S	*	*			trans	-149.4	142.5	162.6	-140.6	-177.3	-169.3	0	0	112.9
908	H	25.5	Very low	30.1	Very low	165 Å²	165	143.6 Å²	143.6	76%	0.764	77%	0.765	S	S	*	*			trans	-73.3	147	177.4	-100.1	-100.7	0	0	0	112.9
909	R	28.4	Very low	30.2	Very low	246 Å²	246	145.2 Å²	145.2	93%	0.928	78%	0.775	S	S	*	*				-156.6	148.4	120.5	-131	173.8	-178.3	165.9	0.9	112.4
910	N	26.6	Very low	29.9	Very low	117 Å²	117	148 Å²	148	63%	0.626	78%	0.776	S	S	*	*			trans	-86.7	157.9	179.6	-50.8	-5.6	0	0	0	110.2
911	N	29.8	Very low	29.9	Very low	148 Å²	148	147.6 Å²	147.6	79%	0.791	78%	0.778	S	S	*	*				-178.6	152.8	110.2	-96.4	8.4	0	0	0	114.7
912	S	30.7	Very low	29.5	Very low	92 Å²	92	148.7 Å²	148.7	64%	0.643	78%	0.779	S	S	*	*			trans	56.3	92.8	147.8	63.3	0	0	0	0	120.9
913	D	29.7	Very low	29.7	Very low	159 Å²	159	149.4 Å²	149.4	85%	0.85	78%	0.782	S	S	*	*				82.6	154.1	107.4	-66.5	-38.2	0	0	0	122.4
914	P	35.2	Very low	29.2	Very low	97 Å²	97	152.4 Å²	152.4	63%	0.63	79%	0.786	S	S	*	*			trans	-128.3	-168	-144.2	44.7	-30	0	0	0	113.9
915	N	33.4	Very low	29.5	Very low	166 Å²	166	155.2 Å²	155.2	89%	0.888	80%	0.795	S	S	*	*			trans	-145	150.2	138.8	-107.6	-42.1	0	0	0	111.5
916	Q	29.1	Very low	29.4	Very low	155 Å²	155	151.1 Å²	151.1	72%	0.724	79%	0.791	S	S	*	*			trans	-98.5	159.1	-178	-60.8	167.3	-23.8	0	0	110.1
917	F	30	Very low	29.6	Very low	201 Å²	201	155.1 Å²	155.1	88%	0.882	80%	0.8	S	S	*	*				-167.2	128.4	106.1	-112.4	-76.8	0	0	0	111.4
918	T	26.5	Very low	29.5	Very low	121 Å²	121	149.6 Å²	149.6	74%	0.742	79%	0.785	S	S	*	*			trans	-106.2	142.2	172.8	44.5	0	0	0	0	110.1
919	Q	31.5	Very low	29.7	Very low	197 Å²	197	151.7 Å²	151.7	92%	0.921	79%	0.792	S	S	*	*			trans	-149.8	146.8	146.8	-125.5	168.2	3.5	0	0	111.9
920	Q	26.2	Very low	29.7	Very low	172 Å²	172	146.6 Å²	146.6	80%	0.804	78%	0.783	S	S	*	*			trans	-109.4	153.6	-179.3	-63.4	148.9	-91.9	0	0	109.5
921	S	31.1	Very low	29.9	Very low	123 Å²	123	149.1 Å²	149.1	86%	0.86	80%	0.796	S	S	*	*			trans	-147.1	150.9	143.1	57	0	0	0	0	110.2
922	I	26.4	Very low	29.8	Very low	133 Å²	133	147.9 Å²	147.9	68%	0.682	79%	0.794	S	S	*	*			trans	-124.6	139.6	179.5	-63.7	163.9	0	0	0	106
923	I	32.5	Very low	29.9	Very low	154 Å²	154	150.1 Å²	150.1	79%	0.79	80%	0.804	S	S	*	*			trans	-146.9	122.7	155.8	-92	132.9	0	0	0	107.5	I925	I923-I925 HydrophobicContact CG2-CG1 4.3Å
924	D	25.1	Very low	29.9	Very low	145 Å²	145	147.6 Å²	147.6	78%	0.775	80%	0.798	S	S	*	*			trans	-88.2	135.1	166.2	-70.4	-70.2	0	0	0	109.7
925	I	33.2	Very low	30	Very low	159 Å²	159	149.7 Å²	149.7	82%	0.815	81%	0.809	S	S	*	*			trans	-134.5	116.9	151.4	-59.7	-176.7	0	0	0	108.2	I923	I923-I925 HydrophobicContact CG2-CG1 4.3Å
926	S	27	Very low	30.4	Very low	108 Å²	108	147.2 Å²	147.2	76%	0.755	80%	0.802	S	S	*	*			trans	-113	136.8	165.3	59.3	0	0	0	0	108.8
927	Q	32.5	Very low	30.8	Very low	203 Å²	203	145.7 Å²	145.7	95%	0.949	81%	0.806	S	S	*	*			trans	-158.8	142.2	155.5	-117.4	165.1	44.2	0	0	113.5
928	A	29.3	Very low	31.1	Very low	81 Å²	81	141.7 Å²	141.7	67%	0.669	80%	0.803	S	S	*	*			trans	-78	165.5	-169.2	0	0	0	0	0	114.4
929	K	30.4	Very low	31.7	Very low	209 Å²	209	141.1 Å²	141.1	91%	0.909	80%	0.801	S	S	*	*				-161.5	155	108.4	-106.6	167.2	-175.4	176.9	0	113.7
930	N	27.6	Very low	31.8	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	80%	0.796	S	S	*	*			trans	-85.5	160.5	-178.8	-52.6	-26	0	0	0	111.4
931	L	31.1	Very low	32.2	Very low	170 Å²	170	138.2 Å²	138.2	89%	0.89	80%	0.796	S	S	*	*				-151.1	147.7	128.2	-138.9	73.1	0	0	0	111.2
932	T	27.6	Very low	32.6	Very low	123 Å²	123	137 Å²	137	76%	0.755	79%	0.787	S	S	*	*			trans	-142.6	124.7	-171.8	48.3	0	0	0	0	111.7
933	T	31.6	Very low	33.2	Very low	138 Å²	138	136.3 Å²	136.3	85%	0.847	79%	0.791	S	S	*	*			trans	-172.7	154.2	164.4	29.4	0	0	0	0	108.2
934	S	31.6	Very low	33.7	Very low	106 Å²	106	134 Å²	134	74%	0.741	79%	0.787	S	S	*	*			cis	-169	147.6	-21.9	46.1	0	0	0	0	108.6
935	V	36.6	Very low	34.1	Very low	142 Å²	142	132.5 Å²	132.5	86%	0.861	79%	0.787	S	S	*	*			trans	-113	139.2	-178.4	-179.2	0	0	0	0	111.5
936	P	42.1	Very low	34.3	Very low	113 Å²	113	130.3 Å²	130.3	73%	0.734	78%	0.783	S	S	*	*			trans	-124.2	171.1	152.2	33	-17.2	0	0	0	112.6
937	P	37.7	Very low	34.5	Very low	124 Å²	124	132.4 Å²	132.4	81%	0.805	79%	0.785	S	S	*	*			trans	-123.6	176.2	-135.8	40.6	-28.8	0	0	0	117.8
938	S	35.5	Very low	34.5	Very low	116 Å²	116	131 Å²	131	81%	0.811	78%	0.783	S	S	*	*			trans	-75.9	159.9	173.8	-40.3	0	0	0	0	114.2
939	P	39.6	Very low	34.8	Very low	109 Å²	109	132.9 Å²	132.9	71%	0.708	79%	0.786	S	S	*	*			trans	-142.2	123.5	146.1	32.3	-13.8	0	0	0	117.4
940	L	33.8	Very low	35.2	Very low	155 Å²	155	128.4 Å²	128.4	81%	0.812	78%	0.779	S	S	*	*				76.1	150.8	122.9	-63.6	172.4	0	0	0	125.1
941	L	34.6	Very low	35.5	Very low	154 Å²	154	127.8 Å²	127.8	81%	0.806	78%	0.783	S	S	*	*			trans	70.3	149.2	163.1	-89.5	64.9	0	0	0	120.1
942	S	38.7	Very low	35.4	Very low	97 Å²	97	125.9 Å²	125.9	68%	0.678	78%	0.778	S	S	*	*			cis	-168.2	-167.6	-33.2	66.4	0	0	0	0	109.8
943	P	39.4	Very low	35.4	Very low	119 Å²	119	125.2 Å²	125.2	77%	0.773	78%	0.777	S	S	*	*				-123.6	-131.2	-124.3	31.2	-2.5	0	0	0	115.9
944	P	42.4	Very low	35.1	Very low	106 Å²	106	123.6 Å²	123.6	69%	0.688	77%	0.771	S	S	*	*				-133.6	174.2	-102	43.7	-27.6	0	0	0	118.4
945	S	34.5	Very low	34.9	Very low	113 Å²	113	126.4 Å²	126.4	79%	0.79	78%	0.777	S	S	*	*			trans	69.9	173	154.1	-61.6	0	0	0	0	117.6
946	P	37.8	Very low	34.4	Very low	112 Å²	112	127.4 Å²	127.4	73%	0.727	77%	0.773	S	S	*	*			cis	-132.1	170.6	-1.1	42.6	-26.4	0	0	0	117.7
947	L	29.5	Very low	33.8	Very low	153 Å²	153	127.1 Å²	127.1	80%	0.801	77%	0.769	S	S	*	*			trans	20.2	129.4	145.2	-70.3	153.2	0	0	0	122.3
948	L	33.7	Very low	33.1	Very low	173 Å²	173	130.8 Å²	130.8	91%	0.906	77%	0.772	S	S	*	*				-150.1	151.4	128.4	-144.7	75	0	0	0	111.9
949	T	35.7	Very low	32.7	Very low	120 Å²	120	130.8 Å²	130.8	74%	0.736	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-101.2	162.7	-173.3	38.3	0	0	0	0	113.7
950	P	37.3	Very low	32	Very low	116 Å²	116	137.1 Å²	137.1	75%	0.753	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-98.9	159.1	-165.9	38	-36.2	0	0	0	115.1
951	P	35.6	Very low	31.7	Very low	125 Å²	125	135.6 Å²	135.6	81%	0.812	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-92.7	162	159.6	35.9	-31.6	0	0	0	112.8
952	T	29.3	Very low	31.4	Very low	129 Å²	129	133.9 Å²	133.9	79%	0.791	76%	0.757	S	S	*	*			trans	-102.5	-164.1	-176.3	52.6	0	0	0	0	112.5
953	C	25.8	Very low	30.8	Very low	110 Å²	110	137.2 Å²	137.2	74%	0.743	77%	0.766	S	S	*	*			trans	70.9	112.6	176.1	-60.5	0	0	0	0	115.5
954	S	25.5	Very low	30.3	Very low	103 Å²	103	137 Å²	137	72%	0.72	76%	0.758	S	S	*	*				79.6	94.2	53.3	78.9	0	0	0	0	114.6
955	L	28.3	Very low	29.6	Very low	166 Å²	166	141.5 Å²	141.5	87%	0.869	76%	0.762	S	S	*	*			trans	-159.7	156.9	144.2	-113.7	164.6	0	0	0	111.2
956	Q	26	Very low	29.3	Very low	163 Å²	163	142.8 Å²	142.8	76%	0.762	76%	0.755	S	S	*	*			trans	-86.6	132.4	-168.9	-63.8	162.6	-42.6	0	0	111.5
957	V	28.7	Very low	28.8	Very low	107 Å²	107	140.6 Å²	140.6	65%	0.648	74%	0.742	S	S	*	*			trans	-133.5	95.1	160.7	-177.9	0	0	0	0	108.3	N959	V957-N959 PolarHBondContact O-N 3.34Å
958	F	24.1	Very low	28.7	Very low	200 Å²	200	137.2 Å²	137.2	88%	0.877	72%	0.722	S	S	*	*			trans	-64.1	115.2	172.8	-107.1	-98.4	0	0	0	109.6
959	N	25.9	Very low	28.5	Very low	117 Å²	117	130.7 Å²	130.7	63%	0.626	69%	0.69	S	S	*	*			trans	-138.1	78.5	174.6	-156.5	-17.3	0	0	0	113.5	V957 N961	V957-N959 PolarHBondContact O-N 3.34Å; N959-N961 PolarHBondContact O-N 3.17Å; N959-N961 PolarHBondContact O-ND2 3.44Å
960	R	25.5	Very low	28.2	Very low	241 Å²	241	125.6 Å²	125.6	91%	0.909	66%	0.659	S	S	*	*	S	Bend	trans	60.2	43.4	136.9	-144.1	173.8	-164.8	174.3	4.7	117.6
961	N	28.2	Very low	27.8	Very low	124 Å²	124	122.3 Å²	122.3	66%	0.663	63%	0.631	S	S	*	*			trans	-139.9	24.4	-174.3	-85	-80	0	0	0	118.3	N959	N959-N961 PolarHBondContact O-N 3.17Å; N959-N961 PolarHBondContact O-ND2 3.44Å
962	D	27.1	Very low	27.8	Very low	117 Å²	117	117.8 Å²	117.8	63%	0.626	60%	0.6	S	S	*	*			trans	-120.5	-7.8	-170.2	-92.7	-62	0	0	0	120	N964	D962-N964 VanDerWaalsContact C-N 3.34Å; D962-N964 PolarHBondContact O-N 3.22Å
963	I	27.2	Very low	27.9	Very low	168 Å²	168	114.6 Å²	114.6	86%	0.862	58%	0.578	S	S	*	*	S	Bend	trans	-92.9	30.7	-170.8	-45.2	-177.9	0	0	0	113.1
964	N	28.6	Very low	28.1	Very low	115 Å²	115	115.3 Å²	115.3	62%	0.615	57%	0.574	S	S	*	*			trans	-155.6	49.5	179.8	-101.1	-72.6	0	0	0	114.8	D962 H966	D962-N964 VanDerWaalsContact C-N 3.34Å; D962-N964 PolarHBondContact O-N 3.22Å; N964-H966 PolarHBondContact O-N 3.47Å
965	R	28.5	Very low	28.1	Very low	200 Å²	200	120.3 Å²	120.3	76%	0.755	58%	0.583	S	S	*	*			trans	-95.3	55.6	173	-85.7	-178.4	160.7	175	-5	113.4
966	H	26.6	Very low	28.1	Very low	139 Å²	139	119.1 Å²	119.1	64%	0.644	57%	0.573	S	S	*	*			trans	-115.6	57.7	-179.3	-74.2	-55.9	0	0	0	114.7	N964	N964-H966 PolarHBondContact O-N 3.47Å
967	S	27.4	Very low	28	Very low	67 Å²	67	120.3 Å²	120.3	47%	0.469	58%	0.579	S	S	.	*			trans	-160.1	88.2	164.6	59.2	0	0	0	0	113.8
968	H	28.3	Very low	27.9	Very low	82 Å²	82	121 Å²	121	38%	0.38	57%	0.573	S	S	.	*			trans	-148	113.5	172.6	-76.6	-24.8	0	0	0	111.3	R434 D460 H783	R434-H968 PolarHBondContact NH2-CE1 3.47Å; R434-H968 VanDerWaalsContact NH2-CE1 3.32Å; D460-H968 IonicContact OD1-CE1 3.96Å; D460-H968 IonicContact OD1-ND1 3.14Å; H783-H968 PolarHBondContact NE2-O 2.95Å; H783-H968 VanDerWaalsContact NE2-O 3.15Å
969	P	28.8	Very low	28	Very low	35 Å²	35	117.1 Å²	117.1	23%	0.227	57%	0.566	C	S	.	*			trans	-155.8	137.6	146.7	39.3	-22	0	0	0	118.1	D781	D781-P969 HydrophobicContact CB-CB 4.16Å; D781-P969 HydrophobicContact CB-CG 3.76Å; D781-P969 VanDerWaalsContact OD1-CB 3.27Å; D781-P969 WeakPolarHBondContact OD1-CB 3.47Å; D781-P969 WeakPolarHBondContact OD2-CB 3.42Å; D781-P969 WeakPolarHBondContact OD2-CG 3.06Å
970	V	28.9	Very low	28.1	Very low	13 Å²	13	113.4 Å²	113.4	8%	0.079	55%	0.551	C	S	.	*			trans	-157.5	111.8	-153	155.2	0	0	0	0	114.7	F214 F461 S847 R850	F214-V970 HydrophobicContact CB-CB 4.47Å; F214-V970 HydrophobicContact CB-CG2 4.06Å; F214-V970 HydrophobicContact CD1-CB 3.41Å; F214-V970 VanDerWaalsContact CD1-CB 3.41Å; F214-V970 HydrophobicContact CD1-CG1 3.07Å; F214-V970 HydrophobicContact CD1-CG2 3.9Å; F214-V970 HydrophobicContact CD2-CG1 4.32Å; F214-V970 HydrophobicContact CE1-CB 3.76Å; F214-V970 HydrophobicContact CE1-CG1 2.95Å; F214-V970 HydrophobicContact CE2-CG1 4.24Å; F214-V970 HydrophobicContact CG-CB 4.14Å; F214-V970 HydrophobicContact CG-CG1 3.78Å; F214-V970 HydrophobicContact CG-CG2 4.13Å; F214-V970 HydrophobicContact CZ-CG1 3.61Å; F461-V970 HydrophobicContact CB-CG1 3.82Å; F461-V970 HydrophobicContact CB-CG2 3.93Å; F461-V970 HydrophobicContact CD2-CG1 3.6Å; F461-V970 HydrophobicContact CE2-CG1 4.41Å; F461-V970 HydrophobicContact CG-CG1 4Å; S847-V970 WeakPolarHBondContact CB-O 3.34Å; S847-V970 PolarHBondContact OG-O 3.05Å; R850-V970 HydrophobicContact CG-CB 4.11Å; R850-V970 HydrophobicContact CG-CG1 3.36Å; R850-V970 VanDerWaalsContact CZ-N 3.31Å; R850-V970 PolarHBondContact NE-O 2.84Å
971	R	30.2	Very low	28.3	Very low	48 Å²	48	104 Å²	104	18%	0.181	52%	0.521	C	S	.	.			trans	18.4	161.2	162	-59.9	-137.1	160.3	135.7	15.2	124.2	P212 F214 E216 V464 S847 A849	P212-R971 HydrophobicContact CB-CB 3.62Å; P212-R971 VanDerWaalsContact CB-CD 3.45Å; P212-R971 HydrophobicContact CB-CG 3.52Å; P212-R971 HydrophobicContact CG-CG 4.25Å; P212-R971 PolarHBondContact O-NE 3.24Å; F214-R971 HydrophobicContact CB-CG 4.22Å; F214-R971 HydrophobicContact CD1-CB 3.24Å; F214-R971 HydrophobicContact CD1-CG 3.21Å; F214-R971 HydrophobicContact CD2-CG 4.42Å; F214-R971 VanDerWaalsContact CE1-CA 3.49Å; F214-R971 HydrophobicContact CE1-CB 3.08Å; F214-R971 HydrophobicContact CE1-CG 3.61Å; F214-R971 HydrophobicContact CG-CB 4.17Å; F214-R971 HydrophobicContact CG-CG 3.71Å; F214-R971 HydrophobicContact CZ-CB 3.91Å; F214-R971 HydrophobicContact CZ-CG 4.38Å; F214-R971 WeakPolarHBondContact O-CD 2.97Å; F214-R971 WeakPolarHBondContact O-CG 3.4Å; F214-R971 PolarHBondContact O-NE 3.2Å; F214-R971 PolarHBondContact O-NH1 3.45Å; F214-R971 VanDerWaalsContact O-NH1 3.11Å; F214-R971 PolarHBondContact O-NH2 3.15Å; E216-R971 HydrophobicContact CG-CB 4.04Å; E216-R971 HydrophobicContact CG-CG 4.22Å; E216-R971 WeakPolarHBondContact OE1-CD 3.48Å; E216-R971 IonicContact OE1-NE 3.83Å; E216-R971 IonicContact OE1-NH1 2.69Å; V464-R971 VanDerWaalsContact CG1-NH2 3.32Å; S847-R971 PolarHBondContact OG-O 3.39Å; A849-R971 WeakPolarHBondContact CB-O 3.48Å
972	I	35.7	Very low	28.3	Very low	29 Å²	29	100.4 Å²	100.4	15%	0.149	50%	0.504	C	S	.	.				-143.5	162.7	62.2	-78.5	179.7	0	0	0	111.6	T209 R210 P212 E216 A849 L853	T209-I972 CarbonylContact C-O 3.47Å; T209-I972 VanDerWaalsContact C-O 3.3Å; T209-I972 VanDerWaalsContact O-O 3.08Å; R210-I972 CarbonylContact C-O 3.5Å; R210-I972 WeakPolarHBondContact CA-O 3.34Å; R210-I972 PolarHBondContact N-O 3.08Å; R210-I972 CarbonylContact O-C 3.27Å; R210-I972 VanDerWaalsContact O-O 3.13Å; P212-I972 VanDerWaalsContact CB-C 3.46Å; E216-I972 HydrophobicContact CG-CG1 4.02Å; A849-I972 HydrophobicContact CB-CB 3.42Å; A849-I972 VanDerWaalsContact CB-CB 3.42Å; A849-I972 HydrophobicContact CB-CD1 3.9Å; A849-I972 HydrophobicContact CB-CG1 3.67Å; A849-I972 HydrophobicContact CB-CG2 4.43Å; L853-I972 HydrophobicContact CD1-CD1 3.82Å; L853-I972 HydrophobicContact CD1-CG1 4.43Å; L853-I972 HydrophobicContact CD2-CD1 4.09Å; L853-I972 HydrophobicContact CG-CD1 3.69Å
973	N	29.6	Very low	28.3	Very low	62 Å²	62	99.1 Å²	99.1	33%	0.332	50%	0.496	S	S	.	.			cis	-142.6	173.9	6.3	-158.4	6.7	0	0	0	112.3	R210 P212 K423	R210-N973 PolarHBondContact O-N 3.45Å; P212-N973 WeakPolarHBondContact CG-O 3.46Å; K423-N973 PolarHBondContact NZ-OD1 2.74Å; K423-N973 VanDerWaalsContact NZ-OD1 3.16Å
974	N	30.9	Very low	28.3	Very low	125 Å²	125	95.2 Å²	95.2	67%	0.668	48%	0.477	S	S	*	.				153.8	156.3	127.7	-89.8	-3.6	0	0	0	113.5	E976	N974-E976 PolarHBondContact O-N 2.77Å
975	K	25.2	Very low	28.2	Very low	208 Å²	208	97.1 Å²	97.1	90%	0.904	49%	0.487	S	S	*	.			trans	-56.1	119.2	-170.1	-61.8	178.4	177.5	-176.4	0	113.7
976	E	27.9	Very low	28.2	Very low	141 Å²	141	96.7 Å²	96.7	66%	0.659	49%	0.491	S	S	*	.			trans	-168.5	120.7	151	-108.6	166.4	-154.7	0	0	107.2	N974 F978	N974-E976 PolarHBondContact O-N 2.77Å; E976-F978 HydrophobicContact CB-CD2 4.18Å; E976-F978 HydrophobicContact CB-CE2 4.14Å; E976-F978 HydrophobicContact CG-CD2 4.32Å; E976-F978 HydrophobicContact CG-CE2 3.76Å
977	Q	24.2	Very low	28.3	Very low	189 Å²	189	98.4 Å²	98.4	88%	0.883	50%	0.499	S	S	*	.			trans	-87	121.4	168.2	-78	165.1	-79.9	0	0	108
978	F	26.9	Very low	28.2	Very low	122 Å²	122	104.9 Å²	104.9	54%	0.535	52%	0.519	S	S	.	.			trans	-137.6	126.1	166.7	-77.4	-59	0	0	0	110.8	N65 T68 E976	N65-F978 VanDerWaalsContact ND2-CE2 3.29Å; N65-F978 WeakPolarHBondContact ND2-CE2 3.32Å; N65-F978 WeakPolarHBondContact ND2-CZ 3.25Å; T68-F978 HydrophobicContact CG2-CD1 3.51Å; T68-F978 HydrophobicContact CG2-CE1 3.28Å; T68-F978 HydrophobicContact CG2-CG 4.48Å; T68-F978 HydrophobicContact CG2-CZ 4.08Å; E976-F978 HydrophobicContact CB-CD2 4.18Å; E976-F978 HydrophobicContact CB-CE2 4.14Å; E976-F978 HydrophobicContact CG-CD2 4.32Å; E976-F978 HydrophobicContact CG-CE2 3.76Å
979	V	25.6	Very low	28.1	Very low	118 Å²	118	112.2 Å²	112.2	72%	0.715	54%	0.543	S	S	*	.			trans	-115.6	164.3	-179.4	-177.9	0	0	0	0	107.8
980	A	28	Very low	28.1	Very low	38 Å²	38	119 Å²	119	31%	0.314	57%	0.572	S	S	.	*			trans	69.6	168.6	168.8	0	0	0	0	0	115.8
981	P	30.1	Very low	28	Very low	45 Å²	45	123.6 Å²	123.6	29%	0.292	60%	0.604	S	S	.	*				-133.1	152.7	-66	36.4	-23.3	0	0	0	113.5	F70 L983	F70-P981 VanDerWaalsContact CB-CD 3.43Å; F70-P981 HydrophobicContact CB-CG 3.96Å; F70-P981 WeakPolarHBondContact O-CD 3.31Å; F70-P981 WeakPolarHBondContact O-CG 3.23Å; P981-L983 PolarHBondContact O-N 2.88Å
982	V	28.8	Very low	27.9	Very low	48 Å²	48	128.8 Å²	128.8	29%	0.291	63%	0.634	S	S	.	*	S	Bend	trans	-82.8	107.3	159.9	176.4	0	0	0	0	108.5	L984	V982-L984 PolarHBondContact O-N 2.66Å; V982-L984 VanDerWaalsContact O-N 3.11Å
983	L	27.1	Very low	27.7	Very low	89 Å²	89	131.6 Å²	131.6	47%	0.466	66%	0.661	S	S	.	*	S	Bend	trans	18.2	79.5	160.3	-71.6	167.3	0	0	0	115.1	Y405 P981	Y405-L983 HydrophobicContact CD2-CB 4.47Å; Y405-L983 HydrophobicContact CE2-CB 4.13Å; Y405-L983 WeakPolarHBondContact CE2-O 3.22Å; Y405-L983 PolarHBondContact OH-O 3.01Å; P981-L983 PolarHBondContact O-N 2.88Å
984	L	27.3	Very low	27.6	Very low	86 Å²	86	135.7 Å²	135.7	45%	0.45	68%	0.683	S	S	.	*			trans	-163.4	56.4	174.3	-124.1	172.8	0	0	0	113.4	Y254 Y405 I409 V982	Y254-L984 HydrophobicContact CE2-CD1 4.37Å; Y405-L984 WeakPolarHBondContact OH-CG 3.49Å; I409-L984 HydrophobicContact CD1-CD1 4.06Å; I409-L984 HydrophobicContact CD1-CD2 3.95Å; I409-L984 HydrophobicContact CD1-CG 4.08Å; V982-L984 PolarHBondContact O-N 2.66Å; V982-L984 VanDerWaalsContact O-N 3.11Å
985	N	27.2	Very low	27.4	Very low	155 Å²	155	138.3 Å²	138.3	83%	0.829	69%	0.689	S	S	*	*			trans	-176	109.6	159.5	-98.1	-22.6	0	0	0	110
986	F	27.1	Very low	27.6	Very low	191 Å²	191	136.4 Å²	136.4	84%	0.838	69%	0.685	S	S	*	*			trans	-164.5	30.7	167	-120.9	-69.5	0	0	0	113.3
987	Q	28.4	Very low	27.6	Very low	176 Å²	176	135.5 Å²	135.5	82%	0.822	69%	0.694	S	S	*	*	S	Bend	trans	-143.4	27.3	-172.4	-151.1	176.7	5.2	0	0	114.6
988	K	27.1	Very low	27.8	Very low	202 Å²	202	133 Å²	133	88%	0.878	69%	0.693	S	S	*	*	S	Bend	trans	-155.7	138.5	163	-112.5	175.2	-178.4	-176.9	0	108.3
989	R	25.6	Very low	27.8	Very low	237 Å²	237	136.4 Å²	136.4	89%	0.894	71%	0.71	S	S	*	*			trans	71.1	98.4	-169.4	-51.9	178.3	179.7	-166	-2.6	114.6
990	H	29.4	Very low	27.9	Very low	178 Å²	178	136.4 Å²	136.4	82%	0.824	72%	0.715	S	S	*	*				-168.4	89.3	110.4	-105.2	-83.3	0	0	0	108.5
991	S	26	Very low	27.8	Very low	109 Å²	109	143 Å²	143	76%	0.762	74%	0.742	S	S	*	*			trans	-127.8	155.5	158.4	179.5	0	0	0	0	105.5
992	I	28.4	Very low	27.9	Very low	157 Å²	157	147.8 Å²	147.8	81%	0.805	76%	0.764	S	S	*	*			trans	77.1	148.2	-169.9	-48.8	165.2	0	0	0	112.6
993	A	31	Very low	27.8	Very low	88 Å²	88	151.4 Å²	151.4	73%	0.727	79%	0.791	S	S	*	*			trans	70.8	111.4	-164.3	0	0	0	0	0	112.6
994	N	27.9	Very low	27.9	Very low	148 Å²	148	151.5 Å²	151.5	79%	0.791	80%	0.799	S	S	*	*			cis	57.9	128.4	24	-74.1	-2.5	0	0	0	113.8
995	F	27.2	Very low	28.1	Very low	179 Å²	179	155.1 Å²	155.1	79%	0.785	82%	0.818	S	S	*	*			cis	-161	-176.1	-4.1	-160.7	-110.9	0	0	0	108.8
996	M	27.6	Very low	28.3	Very low	168 Å²	168	153.2 Å²	153.2	83%	0.828	82%	0.816	S	S	*	*			trans	68.2	112.2	171.7	-56.1	-170.9	172.3	0	0	119.3
997	S	28	Very low	28.5	Very low	122 Å²	122	152.3 Å²	152.3	85%	0.853	82%	0.815	S	S	*	*			trans	-174.3	34.6	131.3	42.6	0	0	0	0	114.7
998	T	29.5	Very low	28.8	Very low	138 Å²	138	150.8 Å²	150.8	85%	0.847	81%	0.812	S	S	*	*			trans	-135	69.6	168	54.8	0	0	0	0	111.8
999	Q	26.8	Very low	29.1	Very low	192 Å²	192	147.6 Å²	147.6	90%	0.897	81%	0.805	S	S	*	*			trans	-65.3	149.5	150.6	-93	-175.1	-16.6	0	0	108.6
1000	S	26.9	Very low	29.6	Very low	118 Å²	118	140.7 Å²	140.7	83%	0.825	79%	0.793	S	S	*	*			trans	84	67.7	-178.9	87	0	0	0	0	118.2
1001	M	27.5	Very low	29.8	Very low	178 Å²	178	138.3 Å²	138.3	88%	0.877	79%	0.787	S	S	*	*	S	Bend		-167.5	150.6	121.6	-108.9	-179.3	-171.4	0	0	112.6
1002	I	30.8	Very low	30.1	Very low	145 Å²	145	140 Å²	140	74%	0.744	79%	0.787	S	S	*	*			trans	60.7	74.1	167.6	-50.4	161.4	0	0	0	114.5
1003	S	26.2	Very low	30.4	Very low	123 Å²	123	140.5 Å²	140.5	86%	0.86	79%	0.785	S	S	*	*			trans	-70.9	111	143.4	51.7	0	0	0	0	109.8
1004	S	29.5	Very low	30.5	Very low	91 Å²	91	141 Å²	141	64%	0.636	78%	0.783	S	S	*	*			trans	-174.1	157.3	154.7	52.6	0	0	0	0	112.7
1005	L	31.7	Very low	30.8	Very low	163 Å²	163	142.1 Å²	142.1	85%	0.853	78%	0.784	S	S	*	*			trans	70.4	81.6	166	-58.9	177.2	0	0	0	118.8
1006	S	32.1	Very low	31.2	Very low	114 Å²	114	139.4 Å²	139.4	80%	0.797	78%	0.777	S	S	*	*				78.6	101.3	124.7	-145.4	0	0	0	0	119.5
1007	E	31.8	Very low	31.6	Very low	172 Å²	172	139 Å²	139	80%	0.804	77%	0.773	S	S	*	*			trans	-59.5	151.8	142.3	-62.3	155.9	118.5	0	0	110.6
1008	N	33.9	Very low	31.9	Very low	144 Å²	144	140 Å²	140	77%	0.77	77%	0.769	S	S	*	*				-176.1	144.6	119.7	-99	-22	0	0	0	113.8
1009	N	33.9	Very low	32.1	Very low	135 Å²	135	142.7 Å²	142.7	72%	0.722	77%	0.772	S	S	*	*			trans	70.4	93.9	154.2	-60.6	2.6	0	0	0	120.7
1010	S	35.6	Very low	32.4	Very low	92 Å²	92	140.7 Å²	140.7	64%	0.643	77%	0.767	S	S	*	*				70	117.8	107.9	-71.7	0	0	0	0	123.1
1011	D	33.2	Very low	33	Very low	129 Å²	129	146.4 Å²	146.4	69%	0.69	79%	0.788	S	S	*	*				58.9	106.1	120.4	-40.8	-36.2	0	0	0	120.3
1012	N	33.3	Very low	33.3	Very low	143 Å²	143	144.9 Å²	144.9	77%	0.765	78%	0.784	S	S	*	*				-177.8	144.8	86.3	-100.1	-66.7	0	0	0	116.6
1013	H	33.1	Very low	33.4	Very low	168 Å²	168	144.8 Å²	144.8	78%	0.778	79%	0.786	S	S	*	*			trans	28.4	124.9	144.1	-90.7	-91.8	0	0	0	123.6
1014	S	33.8	Very low	33.8	Very low	98 Å²	98	146.1 Å²	146.1	69%	0.685	78%	0.782	S	S	*	*				114.3	125.6	112.7	68.8	0	0	0	0	122
1015	Q	35.4	Very low	34.1	Very low	173 Å²	173	149.3 Å²	149.3	81%	0.808	79%	0.791	S	S	*	*			trans	85.1	125.7	134.9	-81.3	-175	-15.1	0	0	124.2
1016	L	34.7	Very low	34.2	Very low	122 Å²	122	148.4 Å²	148.4	64%	0.639	79%	0.787	S	S	*	*			trans	96.3	126.4	134.8	-102.6	66.6	0	0	0	122.9
1017	E	35.1	Very low	34.4	Very low	160 Å²	160	150.7 Å²	150.7	75%	0.748	79%	0.786	S	S	*	*			trans	67.5	99.6	139.7	-78	157.5	-159.5	0	0	122.3
1018	D	34.2	Very low	34.5	Very low	143 Å²	143	149.2 Å²	149.2	77%	0.765	79%	0.785	S	S	*	*				25.5	123.8	116.8	-68.1	-17.3	0	0	0	119.7
1019	H	35.4	Very low	34.6	Very low	194 Å²	194	149.6 Å²	149.6	90%	0.898	79%	0.786	S	S	*	*				-157.2	150	110.6	-120.3	-87.3	0	0	0	111.8
1020	N	33.4	Very low	34.7	Very low	150 Å²	150	150.8 Å²	150.8	80%	0.802	79%	0.791	S	S	*	*			trans	-91.3	148.9	177.6	-71.7	-75.8	0	0	0	112.6
1021	D	38.8	Very low	34.6	Very low	238 Å²	238	156.2 Å²	156.2	100%	1.273	81%	0.805	S	S	*	*			trans	-156.4	0	140.2	-128	7.1	0	0	0	110.1

Retrieved 1,021 of 1,021 residues in 396.7 ms (Link to these results)

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