A0A3Q0KNL0_SCHMA Loading...

Vacuolar protein sorting-associated protein 18 homolog

AlphaFold DB , UniProt , Accession A0A3Q0KNL0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,253 aa.

						>A0A3Q0KNL0_SCHMA|A0A3Q0KNL0
MQRGSLNSGEQQSSAEFFAHDGIFSLDSAQWFRVVNSLTNLQVCNNYLVGATSKNTLIRTPTVPPYNISEIEISRLSDDRVHNIFLDPMGWHTVISMQSGTNFYINKGMKKVRPLNKTKDHLFDSIAWNHHNVNELSTQEILIGTNDGLIFETMLMFNEDSFFSSGTIEQYWIQMINLGHSVTGVEVIRFPTGSPNVLVGEPQRCVVFTTTPCRMYQFAGWINANSSTTGSILSHLAANTATSGISNAINAYTGGHRSSLVNEYNQQQSVGIQNTTIFPIITGLFSSVFNSDEKLPVGSKVTEFPGSFGYSDLKLYRSVKDELPSKFAWMTGPGVYFGYIRTEQLSMPPFTKLSTNDQPIDVKSFPSEAVSTLPTTTDNTDDPNQLKDIFSGRGVNLTRNTKLIPYPIIHMLERPGVPLGICLTEFHLIIVYVDRIKAVNTLDGRAVYSMPLNNIIGCERALGISRDSLSNRIWIFSNNHLARLNMKNELCRIWQIYLDRLQFDEARQFCQDPSQMDTINIREAEYNFDNGNYGLAAKLFARSSIPFEQIALRFFRLSSSSSPSTTHTIDFPSTIIPSTLIQQGYEINDDHDIMEALISQSQYQTNEKLTGIIDSSIKQCKSLITSIHSYNNSSIISSTLTPLKIFLSSKLNYLIEQKNQLLNHTNKSSLVNISGQIILLAIWLIELLLTELNIINDRLKMITKQDHNDMDEIGNDGDRTVGINNDNNDDHDHVKLTLQNRLASVRREFRTILALPEVLNFLPEAKSLIYDLLENHGENDELVYFMELMKDYPRLVDHYIRQCMYSDALKILATYPNCLDRLYDHASCLSSKRPEEFVNVCLRLNNKLDSNRLLPSIMLLPNNQAIRYLEDTIEKYTNDISNQAIHHMLISLYANEYHLNHNDDRLMKYLEKVSIQAIHMKRLKQQHQQQNIVDDGDLFNDYQLLNMDLNELSLFEHDHDIMNDCPIGNGMNKLKCLTDQSKEQNIQSLLPYDPGYVLRLCKEVDHLKGVLYILQLLDMHQEALQLAIELNDIPCAKEIAQSEFLNSIVRRQLWIQLAHHIISTDGGMQEAINLLRDCPLLKLEDILPYFHQFVTIDQFKDVICTSLDSYNERIDNVKNEIQSTMKTIDELRTQSNNLRYRYEIIENDSRCTHCNHLLTLRAFYVFPCGHNFHISCLTELVKPYLSAEENSKLSKALESQNLGNNSSISNFEDIFDEIIANDCVLCGHIAIENLSKLYYENQIDYENELSIWQ
					

Structure Viewer

Loading PAE data...

(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	32.4	Very low	30.4	Very low	247 Å²	247	159.1 Å²	159.1	100%	1.217	87%	0.871	S	S	*	*				0	132.3	0	-88.4	-173.9	134	0	0	108.5
2	Q	31.9	Very low	29.9	Very low	200 Å²	200	160.9 Å²	160.9	94%	0.935	87%	0.869	S	S	*	*			trans	57.2	111.5	173.6	-72.5	-179.1	-11.1	0	0	120.6
3	R	28.5	Very low	29.7	Very low	255 Å²	255	156.8 Å²	156.8	96%	0.962	86%	0.86	S	S	*	*			trans	-72.1	146.6	166.3	-74.4	176.1	170.6	-179.3	-4.1	110.9
4	G	34.5	Very low	29.4	Very low	80 Å²	80	154.5 Å²	154.5	83%	0.825	86%	0.861	S	S	*	*			trans	-151.1	107.5	155.1	0	0	0	0	0	109
5	S	30.2	Very low	29.3	Very low	111 Å²	111	149.1 Å²	149.1	78%	0.776	84%	0.844	S	S	*	*			trans	-82.4	139.1	169.7	63.8	0	0	0	0	109.6
6	L	35.4	Very low	29.2	Very low	161 Å²	161	149.6 Å²	149.6	84%	0.843	84%	0.837	S	S	*	*			trans	-169.2	104.6	147.7	-99.4	147.3	0	0	0	110.1
7	N	29.7	Very low	29.5	Very low	143 Å²	143	149.2 Å²	149.2	77%	0.765	83%	0.825	S	S	*	*			trans	36.7	121.6	140.8	-71.7	0.3	0	0	0	123
8	S	29.5	Very low	30.3	Very low	117 Å²	117	148.2 Å²	148.2	82%	0.818	81%	0.811	S	S	*	*				56.8	105.8	128.6	67.3	0	0	0	0	119.3
9	G	28.7	Very low	31	Very low	72 Å²	72	143.3 Å²	143.3	74%	0.742	79%	0.792	S	S	*	*			trans	-171.4	98	161.4	0	0	0	0	0	108.5	Q11	G9-Q11 PolarHBondContact O-N 3.41Å; G9-Q11 VanDerWaalsContact O-N 3.1Å
10	E	28.7	Very low	31.6	Very low	195 Å²	195	143.4 Å²	143.4	91%	0.911	79%	0.786	S	S	*	*			trans	-55.7	108.4	172.4	-68.5	170.9	144.5	0	0	109.8
11	Q	25.1	Very low	32.6	Very low	169 Å²	169	140.5 Å²	140.5	79%	0.79	77%	0.77	S	S	*	*			trans	-178.1	130.8	151.8	-102.9	164.6	22.3	0	0	109.4	G9	G9-Q11 PolarHBondContact O-N 3.41Å; G9-Q11 VanDerWaalsContact O-N 3.1Å
12	Q	24.3	Very low	34.1	Very low	181 Å²	181	131.2 Å²	131.2	85%	0.846	74%	0.737	S	S	*	*			trans	76.7	96.5	158.6	-59.5	166.5	-4.2	0	0	118.2
13	S	27	Very low	36.3	Very low	107 Å²	107	122.2 Å²	122.2	75%	0.748	70%	0.695	S	S	*	*				-161.9	112.4	113.7	60.2	0	0	0	0	110.8	A15	S13-A15 PolarHBondContact O-N 3.27Å
14	S	26.2	Very low	38.9	Very low	125 Å²	125	110.7 Å²	110.7	87%	0.874	65%	0.652	S	S	*	*			trans	-74.2	61.5	179.6	36.5	0	0	0	0	112.2
15	A	27	Very low	41.3	Very low	74 Å²	74	108.8 Å²	108.8	61%	0.612	63%	0.626	S	S	*	*			trans	-137.7	51.3	178.1	0	0	0	0	0	111	S13 F17	S13-A15 PolarHBondContact O-N 3.27Å; A15-F17 PolarHBondContact O-N 3.48Å
16	E	28.8	Very low	44	Very low	157 Å²	157	104.4 Å²	104.4	73%	0.734	59%	0.594	S	S	*	*			trans	-81.8	111	171.4	-75.7	-178.5	169.7	0	0	109.5	F18	E16-F18 PolarHBondContact O-N 2.84Å
17	F	34.1	Very low	46.4	Very low	143 Å²	143	99.7 Å²	99.7	63%	0.627	57%	0.569	S	S	*	*			trans	-43.6	123.7	168.9	-77.9	-108.1	0	0	0	110.1	A15 A19	A15-F17 PolarHBondContact O-N 3.48Å; F17-A19 PolarHBondContact O-N 3.28Å
18	F	43.6	Very low	49.1	Very low	131 Å²	131	95.2 Å²	95.2	58%	0.575	55%	0.55	S	S	*	.	S	Bend	trans	-68.2	55.6	176.2	-67.5	-82.8	0	0	0	112.7	E16	E16-F18 PolarHBondContact O-N 2.84Å
19	A	43.2	Very low	51.9	Low	54 Å²	54	90 Å²	90	45%	0.446	51%	0.514	S	S	.	.			trans	-95	2.7	170.1	0	0	0	0	0	112.1	F17 D21 M450	F17-A19 PolarHBondContact O-N 3.28Å; A19-D21 PolarHBondContact O-N 3.35Å; A19-M450 HydrophobicContact CB-CE 4.5Å
20	H	42.6	Very low	54.4	Low	146 Å²	146	94.4 Å²	94.4	68%	0.676	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-10.6	-161.6	-86.6	-68.3	0	0	0	117.2
21	D	53.9	Low	57	Low	83 Å²	83	88.3 Å²	88.3	44%	0.444	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-0.9	-178.6	-69.8	-2.6	0	0	0	113.8	A19 I23 R492	A19-D21 PolarHBondContact O-N 3.35Å; D21-I23 HydrophobicContact CB-CD1 3.94Å; D21-I23 HydrophobicContact CB-CG1 3.88Å; D21-I23 PolarHBondContact O-N 3.15Å; D21-R492 IonicContact OD2-NH1 2.75Å; D21-R492 PolarHBondContact OD2-NH1 3.5Å
22	G	63.5	Low	59.8	Low	51 Å²	51	80.4 Å²	80.4	53%	0.526	45%	0.447	S	S	.	.			trans	61.6	10	177.6	0	0	0	0	0	115.3
23	I	77.4	Confident	62.4	Low	11 Å²	11	81.1 Å²	81.1	6%	0.056	44%	0.442	C	S	.	.			trans	-68.3	-44	-173.3	-57.6	173.6	0	0	0	111.1	D21 M486 K487	D21-I23 HydrophobicContact CB-CD1 3.94Å; D21-I23 HydrophobicContact CB-CG1 3.88Å; D21-I23 PolarHBondContact O-N 3.15Å; I23-M486 CarbonylContact O-C 3.54Å; I23-M486 VanDerWaalsContact O-CA 3.31Å; I23-M486 WeakPolarHBondContact O-CA 3.43Å; I23-K487 CarbonylContact C-O 3.52Å; I23-K487 WeakPolarHBondContact CA-O 3.36Å; I23-K487 PolarHBondContact O-N 3.46Å; I23-K487 VanDerWaalsContact O-O 3.14Å
24	F	84.6	Confident	64.8	Low	13 Å²	13	77 Å²	77	6%	0.057	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.4	-176.6	-62.8	-80.7	0	0	0	110.5	H427 I429 A438 V447 Y448 L484 N485 M486	F24-H427 HydrophobicContact CZ-CB 3.93Å; F24-H427 AromaticContact CZ-CG 3.63Å; F24-H427 AromaticContact CZ-ND1 3.8Å; F24-I429 HydrophobicContact CD1-CD1 4.5Å; F24-I429 HydrophobicContact CE1-CD1 3.78Å; F24-I429 HydrophobicContact CZ-CD1 3.96Å; F24-A438 HydrophobicContact CD2-CB 4.15Å; F24-A438 HydrophobicContact CE2-CB 3.7Å; F24-A438 HydrophobicContact CZ-CB 3.96Å; F24-V447 HydrophobicContact CE2-CG2 4Å; F24-Y448 HydrophobicContact CB-CD1 3.92Å; F24-Y448 HydrophobicContact CB-CD2 3.8Å; F24-Y448 HydrophobicContact CB-CE1 3.93Å; F24-Y448 HydrophobicContact CB-CE2 3.8Å; F24-Y448 HydrophobicContact CB-CG 3.84Å; F24-Y448 HydrophobicContact CD2-CD1 4.47Å; F24-Y448 HydrophobicContact CD2-CD2 4.37Å; F24-Y448 AromaticContact CD2-CG 3.98Å; F24-Y448 HydrophobicContact CD2-CG 3.98Å; F24-Y448 HydrophobicContact CG-CD1 4.33Å; F24-Y448 HydrophobicContact CG-CG 4.2Å; F24-Y448 WeakPolarHBondContact O-CE2 3.39Å; F24-L484 HydrophobicContact CB-CD1 4.17Å; F24-L484 HydrophobicContact CD1-CD1 4.23Å; F24-L484 HydrophobicContact CD1-CD2 4Å; F24-L484 HydrophobicContact CD1-CG 4.14Å; F24-L484 HydrophobicContact CE1-CD2 4.39Å; F24-N485 WeakPolarHBondContact CA-O 3.39Å; F24-M486 HydrophobicContact CD1-CG 3.75Å; F24-M486 HydrophobicContact CE1-CB 4.41Å; F24-M486 HydrophobicContact CE1-CG 3.59Å; F24-M486 HydrophobicContact CE1-SD 3.89Å
25	S	84.8	Confident	67.3	Low	41 Å²	41	77.1 Å²	77.1	29%	0.287	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	150.7	168.2	89.9	0	0	0	0	109.3	L484 N485	S25-L484 CarbonylContact O-C 3.52Å; S25-N485 PolarHBondContact N-O 3.13Å; S25-N485 PolarHBondContact O-N 2.95Å; S25-N485 WeakPolarHBondContact OG-CB 3.34Å; S25-N485 PolarHBondContact OG-ND2 2.71Å; S25-N485 VanDerWaalsContact OG-ND2 3.07Å
26	L	86.4	Confident	70	Confident	18 Å²	18	74.8 Å²	74.8	9%	0.094	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.4	-179.7	-174.7	74.3	0	0	0	108.9	L452 I455 I475 A482 L484	L26-L452 HydrophobicContact CD2-CD2 3.43Å; L26-L452 VanDerWaalsContact CD2-CD2 3.43Å; L26-I455 HydrophobicContact CB-CD1 3.72Å; L26-I455 HydrophobicContact CD2-CB 4.09Å; L26-I455 HydrophobicContact CD2-CD1 3.53Å; L26-I455 HydrophobicContact CD2-CG1 4.4Å; L26-I455 HydrophobicContact CD2-CG2 3.95Å; L26-I455 HydrophobicContact CG-CD1 3.83Å; L26-I455 HydrophobicContact CG-CG2 4.04Å; L26-I475 HydrophobicContact CD1-CD1 3.74Å; L26-I475 HydrophobicContact CD2-CD1 4.48Å; L26-A482 HydrophobicContact CD1-CB 3.76Å; L26-A482 HydrophobicContact CD2-CB 4.12Å; L26-A482 HydrophobicContact CG-CB 3.95Å; L26-L484 HydrophobicContact CD1-CB 4.17Å; L26-L484 HydrophobicContact CD1-CD1 4.27Å
27	D	86.6	Confident	72.8	Confident	62 Å²	62	69.2 Å²	69.2	33%	0.332	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	140.3	179.9	-62.8	-15	0	0	0	110.3	A482 R483 N485	D27-A482 CarbonylContact O-C 3.56Å; D27-A482 WeakPolarHBondContact O-CA 3.4Å; D27-R483 PolarHBondContact N-O 3.07Å; D27-R483 PolarHBondContact O-N 3.38Å; D27-R483 IonicContact OD2-CZ 2.8Å; D27-R483 IonicContact OD2-NH2 2.92Å; D27-R483 PolarHBondContact OD2-NH2 3.11Å; D27-N485 PolarHBondContact OD1-ND2 3.48Å; D27-N485 PolarHBondContact OD2-ND2 3.31Å
28	S	86.1	Confident	75.5	Confident	50 Å²	50	62.5 Å²	62.5	35%	0.35	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	130.5	170.7	-170.2	0	0	0	0	110.7	Q30 I455	S28-Q30 PolarHBondContact O-N 2.84Å; S28-Q30 VanDerWaalsContact O-N 3.08Å; S28-I455 PolarHBondContact OG-O 2.79Å
29	A	86.6	Confident	77.8	Confident	8 Å²	8	58.6 Å²	58.6	7%	0.066	32%	0.32	C	S	.	.			trans	-85.4	77.1	178.5	0	0	0	0	0	110.9	W31 F32 W474 L481	A29-W31 HydrophobicContact CB-CZ2 4.45Å; A29-W31 PolarHBondContact O-N 3.07Å; A29-W31 VanDerWaalsContact O-N 3.09Å; A29-F32 PolarHBondContact O-N 2.93Å; A29-W474 HydrophobicContact CB-CZ3 3.8Å; A29-L481 HydrophobicContact CB-CB 3.87Å; A29-L481 WeakPolarHBondContact CB-O 3.33Å; A29-L481 PolarHBondContact N-O 3.38Å
30	Q	82.2	Confident	80.1	Confident	164 Å²	164	57.4 Å²	57.4	77%	0.766	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.1	-173.3	-62.8	-177.5	-5.1	0	0	114.6	S28 F32	S28-Q30 PolarHBondContact O-N 2.84Å; S28-Q30 VanDerWaalsContact O-N 3.08Å; Q30-F32 PolarHBondContact O-N 2.94Å
31	W	83.8	Confident	82.6	Confident	67 Å²	67	50.6 Å²	50.6	25%	0.254	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-19.5	178	59.3	-97.4	0	0	0	113.1	A29 T60 Y66 W474	A29-W31 HydrophobicContact CB-CZ2 4.45Å; A29-W31 PolarHBondContact O-N 3.07Å; A29-W31 VanDerWaalsContact O-N 3.09Å; W31-T60 HydrophobicContact CH2-CG2 4.39Å; W31-T60 HydrophobicContact CZ3-CG2 4.05Å; W31-Y66 HydrophobicContact CB-CD2 4.2Å; W31-Y66 HydrophobicContact CB-CE2 4.2Å; W31-Y66 AromaticContact CD2-CD1 3.87Å; W31-Y66 HydrophobicContact CD2-CD1 3.87Å; W31-Y66 AromaticContact CD2-CE1 3.91Å; W31-Y66 HydrophobicContact CD2-CE1 3.91Å; W31-Y66 HydrophobicContact CD2-CG 4.21Å; W31-Y66 AromaticContact CE2-CE1 3.94Å; W31-Y66 AromaticContact CE3-CD1 3.73Å; W31-Y66 HydrophobicContact CE3-CD1 3.73Å; W31-Y66 HydrophobicContact CE3-CE1 4.24Å; W31-Y66 AromaticContact CE3-CG 3.96Å; W31-Y66 HydrophobicContact CE3-CG 3.96Å; W31-Y66 HydrophobicContact CG-CD1 4.42Å; W31-Y66 HydrophobicContact CG-CD2 4.37Å; W31-Y66 HydrophobicContact CG-CE1 4.23Å; W31-Y66 HydrophobicContact CG-CE2 4.18Å; W31-Y66 HydrophobicContact CG-CG 4.48Å; W31-Y66 HydrophobicContact CH2-CD1 4.43Å; W31-Y66 HydrophobicContact CZ2-CE1 4.36Å; W31-Y66 HydrophobicContact CZ3-CD1 4.01Å; W31-W474 AromaticContact CZ2-CH2 3.83Å; W31-W474 HydrophobicContact CZ2-CH2 3.83Å; W31-W474 HydrophobicContact CZ2-CZ3 4.11Å
32	F	83.7	Confident	84.4	Confident	3 Å²	3	49.3 Å²	49.3	1%	0.013	27%	0.266	C	S	.	.			trans	-102.9	114.8	-180	-170.6	-91.8	0	0	0	110.2	A29 Q30 V34 L38 L48 I58 T60 L481	A29-F32 PolarHBondContact O-N 2.93Å; Q30-F32 PolarHBondContact O-N 2.94Å; F32-V34 HydrophobicContact CD1-CG2 4.01Å; F32-V34 HydrophobicContact CE1-CG2 3.18Å; F32-V34 HydrophobicContact CE2-CG2 4.38Å; F32-V34 HydrophobicContact CZ-CG2 3.42Å; F32-V34 VanDerWaalsContact CZ-CG2 3.42Å; F32-L38 HydrophobicContact CE1-CD1 3.73Å; F32-L38 HydrophobicContact CE1-CG 4.49Å; F32-L38 HydrophobicContact CZ-CD1 4.26Å; F32-L38 HydrophobicContact CZ-CD2 4.44Å; F32-L48 HydrophobicContact CE2-CD2 3.74Å; F32-L48 HydrophobicContact CZ-CD2 4.08Å; F32-I58 HydrophobicContact CE2-CG2 4.13Å; F32-I58 HydrophobicContact CZ-CG2 4.35Å; F32-T60 HydrophobicContact CD2-CG2 4.11Å; F32-T60 HydrophobicContact CE2-CG2 3.94Å; F32-L481 HydrophobicContact CB-CD1 3.78Å; F32-L481 HydrophobicContact CB-CG 4.43Å; F32-L481 HydrophobicContact CD1-CB 4.34Å; F32-L481 HydrophobicContact CD1-CD1 3.25Å; F32-L481 HydrophobicContact CD1-CG 3.49Å; F32-L481 VanDerWaalsContact CD1-CG 3.49Å; F32-L481 HydrophobicContact CD2-CD1 3.82Å; F32-L481 HydrophobicContact CE1-CD1 3.63Å; F32-L481 HydrophobicContact CE1-CG 3.85Å; F32-L481 HydrophobicContact CE2-CD1 4.17Å; F32-L481 HydrophobicContact CG-CD1 3.33Å; F32-L481 HydrophobicContact CG-CG 4.05Å; F32-L481 HydrophobicContact CZ-CD1 4.07Å
33	R	77.6	Confident	85.8	Confident	196 Å²	196	46.9 Å²	46.9	74%	0.74	24%	0.241	S	C	*	.			trans	-136.9	134.7	170.7	-73.4	-172	178.8	-164.9	-1.3	109.1
34	V	79.2	Confident	86.5	Confident	20 Å²	20	47.2 Å²	47.2	12%	0.121	24%	0.244	C	C	.	.			trans	-116.2	142	178.9	-165.9	0	0	0	0	109.3	F32 N36 L38 T52 I58	F32-V34 HydrophobicContact CD1-CG2 4.01Å; F32-V34 HydrophobicContact CE1-CG2 3.18Å; F32-V34 HydrophobicContact CE2-CG2 4.38Å; F32-V34 HydrophobicContact CZ-CG2 3.42Å; F32-V34 VanDerWaalsContact CZ-CG2 3.42Å; V34-N36 WeakPolarHBondContact CB-O 3.39Å; V34-N36 WeakPolarHBondContact CG1-O 3.39Å; V34-L38 HydrophobicContact CG2-CD2 4.19Å; V34-L38 HydrophobicContact CG2-CG 4.18Å; V34-T52 HydrophobicContact CG1-CG2 3.76Å; V34-I58 HydrophobicContact CB-CD1 4.13Å; V34-I58 HydrophobicContact CG1-CD1 3.22Å; V34-I58 HydrophobicContact CG2-CD1 3.7Å
35	V	77.3	Confident	86.7	Confident	128 Å²	128	49.6 Å²	49.6	78%	0.776	26%	0.258	S	S	*	.	S	Bend	trans	-73.3	-36.4	177.4	-177.5	0	0	0	0	111.6
36	N	83.9	Confident	86.9	Confident	24 Å²	24	50 Å²	50	13%	0.128	26%	0.256	C	S	.	.	S	Bend	trans	-107.9	145.9	179	-52.7	-48	0	0	0	109.8	V34 L38 T52 K54	V34-N36 WeakPolarHBondContact CB-O 3.39Å; V34-N36 WeakPolarHBondContact CG1-O 3.39Å; N36-L38 PolarHBondContact O-N 3.46Å; N36-T52 HydrophobicContact CB-CG2 4.21Å; N36-K54 HydrophobicContact CB-CG 4.33Å; N36-K54 WeakPolarHBondContact OD1-CD 3.37Å; N36-K54 WeakPolarHBondContact OD1-CE 3.12Å; N36-K54 PolarHBondContact OD1-NZ 3.26Å
37	S	88	Confident	87.1	Confident	41 Å²	41	51.2 Å²	51.2	29%	0.287	26%	0.26	S	S	.	.			trans	-61.6	128.9	-179.2	-57.8	0	0	0	0	112.2	T52 S53 N478 N479	S37-T52 CarbonylContact O-C 3.46Å; S37-T52 VanDerWaalsContact O-CA 3.27Å; S37-T52 WeakPolarHBondContact O-CA 3.46Å; S37-S53 PolarHBondContact O-N 3.24Å; S37-N478 CarbonylContact C-O 3.52Å; S37-N478 WeakPolarHBondContact CA-O 3.39Å; S37-N479 PolarHBondContact OG-OD1 2.69Å
38	L	90.9	Very high	87.4	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	145.2	169.8	-71.8	175.9	0	0	0	111.1	F32 V34 N36 L41 A51 T52 I58 L462 N478	F32-L38 HydrophobicContact CE1-CD1 3.73Å; F32-L38 HydrophobicContact CE1-CG 4.49Å; F32-L38 HydrophobicContact CZ-CD1 4.26Å; F32-L38 HydrophobicContact CZ-CD2 4.44Å; V34-L38 HydrophobicContact CG2-CD2 4.19Å; V34-L38 HydrophobicContact CG2-CG 4.18Å; N36-L38 PolarHBondContact O-N 3.46Å; L38-L41 HydrophobicContact CD1-CD1 3.93Å; L38-A51 CarbonylContact C-O 3.56Å; L38-A51 VanDerWaalsContact CA-O 3.32Å; L38-A51 WeakPolarHBondContact CA-O 3.29Å; L38-T52 HydrophobicContact CD2-CG2 4.49Å; L38-I58 HydrophobicContact CD2-CD1 4.27Å; L38-L462 WeakPolarHBondContact O-CD1 3.36Å; L38-N478 WeakPolarHBondContact CB-O 3.42Å; L38-N478 PolarHBondContact N-O 2.95Å
39	T	90.9	Very high	87.7	Confident	48 Å²	48	45.9 Å²	45.9	29%	0.294	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	-43.4	174.4	61	0	0	0	0	111.4	A51	T39-A51 PolarHBondContact N-O 3.07Å; T39-A51 PolarHBondContact OG1-O 2.99Å
40	N	93	Very high	88	Confident	29 Å²	29	45.5 Å²	45.5	16%	0.155	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	150.9	-178.6	-51.8	77.9	0	0	0	109.2	G50 A51 H82 I84	N40-G50 CarbonylContact O-C 3.57Å; N40-G50 WeakPolarHBondContact O-CA 3.3Å; N40-A51 PolarHBondContact O-N 3.05Å; N40-H82 PolarHBondContact ND2-O 3.27Å; N40-H82 VanDerWaalsContact ND2-O 3.11Å; N40-I84 HydrophobicContact CB-CD1 3.92Å; N40-I84 HydrophobicContact CB-CG1 4.05Å
41	L	93.5	Very high	88.6	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.021	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	134.3	179.3	-166.5	111.6	0	0	0	110.3	L38 V43 L48 V49 F476 L481	L38-L41 HydrophobicContact CD1-CD1 3.93Å; L41-V43 HydrophobicContact CD2-CG2 3.85Å; L41-L48 HydrophobicContact CD1-CD1 4.04Å; L41-L48 HydrophobicContact CD1-CD2 3.79Å; L41-L48 HydrophobicContact CD1-CG 4.01Å; L41-L48 HydrophobicContact CD2-CD1 4.08Å; L41-L48 HydrophobicContact CD2-CG 4.39Å; L41-L48 HydrophobicContact CG-CD1 4.34Å; L41-L48 HydrophobicContact CG-CD2 4.45Å; L41-L48 HydrophobicContact CG-CG 4.22Å; L41-V49 CarbonylContact C-O 3.51Å; L41-V49 WeakPolarHBondContact CA-O 3.47Å; L41-F476 HydrophobicContact CB-CB 4.41Å; L41-F476 HydrophobicContact CB-CD1 3.63Å; L41-F476 HydrophobicContact CB-CD2 3.9Å; L41-F476 HydrophobicContact CB-CE1 3.72Å; L41-F476 HydrophobicContact CB-CE2 3.98Å; L41-F476 HydrophobicContact CB-CG 3.73Å; L41-F476 HydrophobicContact CB-CZ 3.91Å; L41-F476 HydrophobicContact CD2-CB 4.18Å; L41-F476 HydrophobicContact CD2-CD1 3.93Å; L41-F476 HydrophobicContact CD2-CG 4.2Å; L41-F476 HydrophobicContact CG-CD1 4.38Å; L41-F476 HydrophobicContact CG-CG 4.43Å; L41-L481 HydrophobicContact CD1-CD2 3.85Å; L41-L481 HydrophobicContact CD2-CD2 3.87Å
42	Q	93.7	Very high	89	Confident	56 Å²	56	34.5 Å²	34.5	26%	0.262	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142.8	172	-67	-63.3	-13.9	0	0	109.9	V49 I84 L86	Q42-V49 PolarHBondContact N-O 2.82Å; Q42-V49 PolarHBondContact O-N 2.78Å; Q42-I84 WeakPolarHBondContact CG-O 3.27Å; Q42-L86 HydrophobicContact CB-CB 3.89Å
43	V	92.8	Very high	89.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	120.7	178.4	-171.3	0	0	0	0	109.4	L41 Y47 L48 T62 S465 R466 D467 W474	L41-V43 HydrophobicContact CD2-CG2 3.85Å; V43-Y47 WeakPolarHBondContact CA-O 3.42Å; V43-L48 HydrophobicContact CG2-CB 4.09Å; V43-L48 HydrophobicContact CG2-CD1 3.84Å; V43-L48 HydrophobicContact CG2-CG 3.9Å; V43-T62 HydrophobicContact CG1-CG2 3.82Å; V43-S465 PolarHBondContact N-OG 3.39Å; V43-R466 CarbonylContact O-C 3.59Å; V43-D467 HydrophobicContact CG1-CB 4.2Å; V43-D467 WeakPolarHBondContact O-CA 3.27Å; V43-W474 HydrophobicContact CG2-CB 4.34Å; V43-W474 HydrophobicContact CG2-CG 4.08Å
44	C	90.8	Very high	89.7	Confident	17 Å²	17	34.4 Å²	34.4	12%	0.115	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	141.5	175.6	-73.9	0	0	0	0	109.4	N46 Y47 L86 D87	C44-N46 VanDerWaalsContact C-N 3.32Å; C44-N46 PolarHBondContact O-N 3.31Å; C44-Y47 PolarHBondContact N-O 3.23Å; C44-Y47 WeakPolarHBondContact O-CA 3.45Å; C44-Y47 WeakPolarHBondContact O-CB 3.49Å; C44-Y47 PolarHBondContact O-N 3.04Å; C44-L86 HydrophobicContact CB-CD2 3.83Å; C44-L86 HydrophobicContact CB-CG 4.14Å; C44-D87 WeakPolarHBondContact CB-O 3.4Å
45	N	88.6	Confident	90.3	Very high	64 Å²	64	33.6 Å²	33.6	34%	0.342	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	46.7	178.7	-163.6	19.7	0	0	0	113.7	Y47 M89 D467 L469	N45-Y47 PolarHBondContact O-N 2.82Å; N45-M89 WeakPolarHBondContact CB-O 3.42Å; N45-M89 PolarHBondContact ND2-O 2.87Å; N45-D467 PolarHBondContact N-OD1 3.12Å; N45-L469 HydrophobicContact CB-CD1 3.74Å
46	N	90	Very high	91	Very high	48 Å²	48	28.6 Å²	28.6	26%	0.257	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	16	-172.4	-63.6	-60.7	0	0	0	114.9	C44 P61 T62 V63 D467 R472	C44-N46 VanDerWaalsContact C-N 3.32Å; C44-N46 PolarHBondContact O-N 3.31Å; N46-P61 CarbonylContact O-C 3.54Å; N46-P61 WeakPolarHBondContact O-CA 3.24Å; N46-T62 VanDerWaalsContact C-OG1 3.28Å; N46-T62 WeakPolarHBondContact CA-OG1 3.21Å; N46-T62 WeakPolarHBondContact CB-OG1 3.42Å; N46-T62 PolarHBondContact O-N 3.33Å; N46-T62 PolarHBondContact O-OG1 3.15Å; N46-V63 HydrophobicContact CB-CG2 3.9Å; N46-D467 WeakPolarHBondContact CA-OD2 3.4Å; N46-D467 PolarHBondContact N-OD2 2.75Å; N46-R472 PolarHBondContact OD1-NH1 2.96Å
47	Y	90.9	Very high	91.4	Very high	44 Å²	44	27.4 Å²	27.4	17%	0.173	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.6	178.1	-158.1	-108.4	0	0	0	109.7	V43 C44 N45 V49 R59 L86	V43-Y47 WeakPolarHBondContact CA-O 3.42Å; C44-Y47 PolarHBondContact N-O 3.23Å; C44-Y47 WeakPolarHBondContact O-CA 3.45Å; C44-Y47 WeakPolarHBondContact O-CB 3.49Å; C44-Y47 PolarHBondContact O-N 3.04Å; N45-Y47 PolarHBondContact O-N 2.82Å; Y47-V49 HydrophobicContact CD1-CG2 3.8Å; Y47-V49 HydrophobicContact CE1-CG2 3.85Å; Y47-R59 HydrophobicContact CE1-CB 3.91Å; Y47-R59 HydrophobicContact CE1-CG 4.34Å; Y47-R59 WeakPolarHBondContact OH-CB 3.43Å; Y47-L86 WeakPolarHBondContact O-CD2 3.49Å
48	L	92.1	Very high	91.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.1	-179.4	-179.5	151.2	0	0	0	109.5	F32 L41 V43 R59 T60 T62 L481	F32-L48 HydrophobicContact CE2-CD2 3.74Å; F32-L48 HydrophobicContact CZ-CD2 4.08Å; L41-L48 HydrophobicContact CD1-CD1 4.04Å; L41-L48 HydrophobicContact CD1-CD2 3.79Å; L41-L48 HydrophobicContact CD1-CG 4.01Å; L41-L48 HydrophobicContact CD2-CD1 4.08Å; L41-L48 HydrophobicContact CD2-CG 4.39Å; L41-L48 HydrophobicContact CG-CD1 4.34Å; L41-L48 HydrophobicContact CG-CD2 4.45Å; L41-L48 HydrophobicContact CG-CG 4.22Å; V43-L48 HydrophobicContact CG2-CB 4.09Å; V43-L48 HydrophobicContact CG2-CD1 3.84Å; V43-L48 HydrophobicContact CG2-CG 3.9Å; L48-R59 CarbonylContact O-C 3.53Å; L48-R59 WeakPolarHBondContact O-CA 3.45Å; L48-T60 WeakPolarHBondContact CA-O 3.49Å; L48-T60 HydrophobicContact CB-CG2 3.99Å; L48-T60 WeakPolarHBondContact CB-O 3.5Å; L48-T60 HydrophobicContact CD2-CG2 3.73Å; L48-T60 HydrophobicContact CG-CG2 4.37Å; L48-T60 PolarHBondContact N-O 3.03Å; L48-T60 PolarHBondContact O-N 3.01Å; L48-T62 HydrophobicContact CB-CG2 3.74Å; L48-T62 HydrophobicContact CD1-CG2 4.34Å; L48-L481 HydrophobicContact CD1-CD1 3.52Å
49	V	93.3	Very high	91.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	126.9	173.5	-176.8	0	0	0	0	109.2	L41 Q42 Y47 L57 I58 R59 I84 L86 T93	L41-V49 CarbonylContact C-O 3.51Å; L41-V49 WeakPolarHBondContact CA-O 3.47Å; Q42-V49 PolarHBondContact N-O 2.82Å; Q42-V49 PolarHBondContact O-N 2.78Å; Y47-V49 HydrophobicContact CD1-CG2 3.8Å; Y47-V49 HydrophobicContact CE1-CG2 3.85Å; V49-L57 HydrophobicContact CG1-CD1 3.48Å; V49-L57 VanDerWaalsContact CG1-CD1 3.48Å; V49-L57 HydrophobicContact CG1-CD2 4.36Å; V49-L57 HydrophobicContact CG1-CG 3.98Å; V49-I58 CarbonylContact C-O 3.55Å; V49-I58 VanDerWaalsContact CA-O 3.25Å; V49-I58 WeakPolarHBondContact CA-O 3.26Å; V49-R59 HydrophobicContact CG1-CG 4.28Å; V49-R59 HydrophobicContact CG2-CG 4.1Å; V49-I84 HydrophobicContact CG1-CG2 4.14Å; V49-L86 HydrophobicContact CB-CD2 4.49Å; V49-L86 HydrophobicContact CG2-CD1 3.83Å; V49-L86 HydrophobicContact CG2-CD2 4.01Å; V49-L86 HydrophobicContact CG2-CG 4.49Å; V49-T93 HydrophobicContact CG1-CG2 3.92Å
50	G	92.8	Very high	91.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	153.9	176.2	0	0	0	0	0	112.3	N40 L57 I58	N40-G50 CarbonylContact O-C 3.57Å; N40-G50 WeakPolarHBondContact O-CA 3.3Å; G50-L57 CarbonylContact O-C 3.49Å; G50-L57 WeakPolarHBondContact O-CA 3.47Å; G50-I58 PolarHBondContact N-O 3.13Å; G50-I58 PolarHBondContact O-N 3.09Å
51	A	93.2	Very high	91.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	149.1	169.1	0	0	0	0	0	110.2	L38 T39 N40 T56 V81 I84	L38-A51 CarbonylContact C-O 3.56Å; L38-A51 VanDerWaalsContact CA-O 3.32Å; L38-A51 WeakPolarHBondContact CA-O 3.29Å; T39-A51 PolarHBondContact N-O 3.07Å; T39-A51 PolarHBondContact OG1-O 2.99Å; N40-A51 PolarHBondContact O-N 3.05Å; A51-T56 CarbonylContact C-O 3.59Å; A51-T56 WeakPolarHBondContact CA-O 3.29Å; A51-V81 HydrophobicContact CB-CB 3.96Å; A51-V81 HydrophobicContact CB-CG1 3.94Å; A51-V81 HydrophobicContact CB-CG2 3.76Å; A51-I84 HydrophobicContact CB-CD1 3.37Å; A51-I84 HydrophobicContact CB-CG1 4.26Å; A51-I84 VanDerWaalsContact N-CD1 3.26Å
52	T	92.2	Very high	91.2	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	165.7	173.6	78.7	0	0	0	0	112.3	V34 N36 S37 L38 K54 N55 T56 I58	V34-T52 HydrophobicContact CG1-CG2 3.76Å; N36-T52 HydrophobicContact CB-CG2 4.21Å; S37-T52 CarbonylContact O-C 3.46Å; S37-T52 VanDerWaalsContact O-CA 3.27Å; S37-T52 WeakPolarHBondContact O-CA 3.46Å; L38-T52 HydrophobicContact CD2-CG2 4.49Å; T52-K54 PolarHBondContact O-N 2.8Å; T52-K54 VanDerWaalsContact O-N 3.08Å; T52-K54 PolarHBondContact OG1-N 3.36Å; T52-N55 PolarHBondContact O-N 3.1Å; T52-T56 WeakPolarHBondContact CG2-OG1 3.22Å; T52-T56 PolarHBondContact N-O 3.04Å; T52-T56 PolarHBondContact OG1-N 3.43Å; T52-T56 PolarHBondContact OG1-OG1 2.91Å; T52-I58 HydrophobicContact CG2-CD1 3.45Å; T52-I58 VanDerWaalsContact CG2-CD1 3.45Å; T52-I58 HydrophobicContact CG2-CG1 4.01Å
53	S	89.6	Confident	90.9	Very high	62 Å²	62	23.9 Å²	23.9	43%	0.434	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-11.5	175.1	60.7	0	0	0	0	115	S37	S37-S53 PolarHBondContact O-N 3.24Å
54	K	88.1	Confident	90.4	Very high	135 Å²	135	27.8 Å²	27.8	59%	0.587	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	21.1	172.7	-66.4	-165.2	-174.6	155.5	0	113	N36 T52 T56	N36-K54 HydrophobicContact CB-CG 4.33Å; N36-K54 WeakPolarHBondContact OD1-CD 3.37Å; N36-K54 WeakPolarHBondContact OD1-CE 3.12Å; N36-K54 PolarHBondContact OD1-NZ 3.26Å; T52-K54 PolarHBondContact O-N 2.8Å; T52-K54 VanDerWaalsContact O-N 3.08Å; T52-K54 PolarHBondContact OG1-N 3.36Å; K54-T56 PolarHBondContact O-N 3.31Å
55	N	90.4	Very high	89.8	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.016	18%	0.176	C	C	.	.	S	Bend	trans	54.6	38.7	-177.8	-58	-26.4	0	0	0	113	T52 I73 L76 D79	T52-N55 PolarHBondContact O-N 3.1Å; N55-I73 HydrophobicContact CB-CB 4.47Å; N55-I73 VanDerWaalsContact O-CB 3.24Å; N55-I73 WeakPolarHBondContact O-CB 3.4Å; N55-I73 WeakPolarHBondContact O-CG1 3.28Å; N55-I73 PolarHBondContact O-N 3.03Å; N55-L76 PolarHBondContact ND2-O 3.17Å; N55-D79 VanDerWaalsContact CG-O 3.29Å; N55-D79 PolarHBondContact ND2-O 3.25Å; N55-D79 PolarHBondContact OD1-O 3.27Å; N55-D79 VanDerWaalsContact OD1-O 3.14Å
56	T	92.1	Very high	89.5	Confident	22 Å²	22	32.6 Å²	32.6	14%	0.135	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	131.8	170.3	66.9	0	0	0	0	109.9	A51 T52 K54 I71	A51-T56 CarbonylContact C-O 3.59Å; A51-T56 WeakPolarHBondContact CA-O 3.29Å; T52-T56 WeakPolarHBondContact CG2-OG1 3.22Å; T52-T56 PolarHBondContact N-O 3.04Å; T52-T56 PolarHBondContact OG1-N 3.43Å; T52-T56 PolarHBondContact OG1-OG1 2.91Å; K54-T56 PolarHBondContact O-N 3.31Å; T56-I71 CarbonylContact C-O 3.54Å; T56-I71 WeakPolarHBondContact CA-O 3.36Å
57	L	92.8	Very high	89.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.1	172.6	-169.9	75.1	0	0	0	109	V49 G50 R59 E70 I71 I73 I84 I95 I105	V49-L57 HydrophobicContact CG1-CD1 3.48Å; V49-L57 VanDerWaalsContact CG1-CD1 3.48Å; V49-L57 HydrophobicContact CG1-CD2 4.36Å; V49-L57 HydrophobicContact CG1-CG 3.98Å; G50-L57 CarbonylContact O-C 3.49Å; G50-L57 WeakPolarHBondContact O-CA 3.47Å; L57-R59 HydrophobicContact CD2-CG 4.09Å; L57-R59 HydrophobicContact CG-CG 4.27Å; L57-E70 CarbonylContact O-C 3.54Å; L57-E70 WeakPolarHBondContact O-CA 3.22Å; L57-I71 HydrophobicContact CB-CB 4.34Å; L57-I71 PolarHBondContact N-O 3.43Å; L57-I71 PolarHBondContact O-N 3.32Å; L57-I73 HydrophobicContact CB-CD1 3.99Å; L57-I73 HydrophobicContact CB-CG1 3.92Å; L57-I73 HydrophobicContact CD1-CD1 4.48Å; L57-I84 HydrophobicContact CD1-CD1 4.16Å; L57-I95 HydrophobicContact CD1-CD1 3.74Å; L57-I95 HydrophobicContact CD1-CG1 4.24Å; L57-I95 HydrophobicContact CD2-CD1 3.93Å; L57-I95 HydrophobicContact CG-CD1 4.31Å; L57-I105 HydrophobicContact CD2-CD1 4.47Å; L57-I105 HydrophobicContact CD2-CG2 3.95Å
58	I	92.5	Very high	89.1	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.3	174.9	-60.2	177.4	0	0	0	107.3	F32 V34 L38 V49 G50 T52 I68 S69 E70	F32-I58 HydrophobicContact CE2-CG2 4.13Å; F32-I58 HydrophobicContact CZ-CG2 4.35Å; V34-I58 HydrophobicContact CB-CD1 4.13Å; V34-I58 HydrophobicContact CG1-CD1 3.22Å; V34-I58 HydrophobicContact CG2-CD1 3.7Å; L38-I58 HydrophobicContact CD2-CD1 4.27Å; V49-I58 CarbonylContact C-O 3.55Å; V49-I58 VanDerWaalsContact CA-O 3.25Å; V49-I58 WeakPolarHBondContact CA-O 3.26Å; G50-I58 PolarHBondContact N-O 3.13Å; G50-I58 PolarHBondContact O-N 3.09Å; T52-I58 HydrophobicContact CG2-CD1 3.45Å; T52-I58 VanDerWaalsContact CG2-CD1 3.45Å; T52-I58 HydrophobicContact CG2-CG1 4.01Å; I58-I68 HydrophobicContact CG2-CG2 3.75Å; I58-S69 WeakPolarHBondContact CA-O 3.46Å; I58-E70 HydrophobicContact CG1-CG 4.4Å
59	R	91.2	Very high	88.9	Confident	5 Å²	5	39.7 Å²	39.7	2%	0.019	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.2	171.4	-52.5	174.3	152.9	-173.5	-16.6	109.7	Y47 L48 V49 L57 S69 T93 I105 N106	Y47-R59 HydrophobicContact CE1-CB 3.91Å; Y47-R59 HydrophobicContact CE1-CG 4.34Å; Y47-R59 WeakPolarHBondContact OH-CB 3.43Å; L48-R59 CarbonylContact O-C 3.53Å; L48-R59 WeakPolarHBondContact O-CA 3.45Å; V49-R59 HydrophobicContact CG1-CG 4.28Å; V49-R59 HydrophobicContact CG2-CG 4.1Å; L57-R59 HydrophobicContact CD2-CG 4.09Å; L57-R59 HydrophobicContact CG-CG 4.27Å; R59-S69 WeakPolarHBondContact CB-OG 3.19Å; R59-S69 PolarHBondContact N-O 3.29Å; R59-S69 PolarHBondContact O-N 2.83Å; R59-S69 PolarHBondContact O-OG 2.89Å; R59-T93 PolarHBondContact NH2-OG1 2.98Å; R59-I105 VanDerWaalsContact NH1-CD1 3.32Å; R59-I105 PolarHBondContact NH2-O 3.28Å; R59-N106 PolarHBondContact NH1-O 3.47Å
60	T	90.8	Very high	88.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	140.2	-179.6	-170.4	0	0	0	0	111	W31 F32 L48 N67	W31-T60 HydrophobicContact CH2-CG2 4.39Å; W31-T60 HydrophobicContact CZ3-CG2 4.05Å; F32-T60 HydrophobicContact CD2-CG2 4.11Å; F32-T60 HydrophobicContact CE2-CG2 3.94Å; L48-T60 WeakPolarHBondContact CA-O 3.49Å; L48-T60 HydrophobicContact CB-CG2 3.99Å; L48-T60 WeakPolarHBondContact CB-O 3.5Å; L48-T60 HydrophobicContact CD2-CG2 3.73Å; L48-T60 HydrophobicContact CG-CG2 4.37Å; L48-T60 PolarHBondContact N-O 3.03Å; L48-T60 PolarHBondContact O-N 3.01Å; T60-N67 PolarHBondContact OG1-O 3.46Å
61	P	90.4	Very high	88.7	Confident	36 Å²	36	46.1 Å²	46.1	23%	0.234	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	138	167.7	30.7	-33	0	0	0	109.8	N46 V63 P65 N67	N46-P61 CarbonylContact O-C 3.54Å; N46-P61 WeakPolarHBondContact O-CA 3.24Å; P61-V63 PolarHBondContact O-N 3.38Å; P61-P65 VanDerWaalsContact CG-O 3.26Å; P61-P65 WeakPolarHBondContact CG-O 3.45Å; P61-N67 VanDerWaalsContact CD-O 3.27Å; P61-N67 WeakPolarHBondContact CD-O 3.49Å
62	T	86.5	Confident	88.6	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.031	28%	0.275	C	S	.	.	S	Bend	trans	-78	-0.3	173.8	63.2	0	0	0	0	113.2	V43 N46 L48 W474	V43-T62 HydrophobicContact CG1-CG2 3.82Å; N46-T62 VanDerWaalsContact C-OG1 3.28Å; N46-T62 WeakPolarHBondContact CA-OG1 3.21Å; N46-T62 WeakPolarHBondContact CB-OG1 3.42Å; N46-T62 PolarHBondContact O-N 3.33Å; N46-T62 PolarHBondContact O-OG1 3.15Å; L48-T62 HydrophobicContact CB-CG2 3.74Å; L48-T62 HydrophobicContact CD1-CG2 4.34Å; T62-W474 HydrophobicContact CG2-CZ2 4.03Å
63	V	86.9	Confident	88.5	Confident	59 Å²	59	51.6 Å²	51.6	36%	0.358	28%	0.277	S	S	.	.	S	Bend	trans	-119	141.3	176.6	179.8	0	0	0	0	107.3	N46 P61	N46-V63 HydrophobicContact CB-CG2 3.9Å; P61-V63 PolarHBondContact O-N 3.38Å
64	P	83.4	Confident	88.2	Confident	82 Å²	82	49.6 Å²	49.6	53%	0.532	26%	0.263	S	S	.	.	S	Bend	trans	-54.1	143.2	175.2	-22.2	29.7	0	0	0	112.2	Y66	P64-Y66 HydrophobicContact CB-CE2 4.3Å; P64-Y66 HydrophobicContact CG-CD2 4.45Å; P64-Y66 HydrophobicContact CG-CE1 4.14Å; P64-Y66 HydrophobicContact CG-CE2 3.73Å
65	P	77.8	Confident	87.8	Confident	89 Å²	89	53.3 Å²	53.3	58%	0.578	27%	0.274	S	S	*	.	S	Bend	cis	-81.3	122.5	2.7	31.6	-32.2	0	0	0	111.5	P61 N67	P61-P65 VanDerWaalsContact CG-O 3.26Å; P61-P65 WeakPolarHBondContact CG-O 3.45Å; P65-N67 PolarHBondContact O-N 3.32Å
66	Y	83.6	Confident	87.1	Confident	93 Å²	93	58.8 Å²	58.8	37%	0.365	30%	0.303	S	S	.	.			trans	-68.3	59.2	-176.6	-54.8	-66.7	0	0	0	113	W31 P64 I68	W31-Y66 HydrophobicContact CB-CD2 4.2Å; W31-Y66 HydrophobicContact CB-CE2 4.2Å; W31-Y66 AromaticContact CD2-CD1 3.87Å; W31-Y66 HydrophobicContact CD2-CD1 3.87Å; W31-Y66 AromaticContact CD2-CE1 3.91Å; W31-Y66 HydrophobicContact CD2-CE1 3.91Å; W31-Y66 HydrophobicContact CD2-CG 4.21Å; W31-Y66 AromaticContact CE2-CE1 3.94Å; W31-Y66 AromaticContact CE3-CD1 3.73Å; W31-Y66 HydrophobicContact CE3-CD1 3.73Å; W31-Y66 HydrophobicContact CE3-CE1 4.24Å; W31-Y66 AromaticContact CE3-CG 3.96Å; W31-Y66 HydrophobicContact CE3-CG 3.96Å; W31-Y66 HydrophobicContact CG-CD1 4.42Å; W31-Y66 HydrophobicContact CG-CD2 4.37Å; W31-Y66 HydrophobicContact CG-CE1 4.23Å; W31-Y66 HydrophobicContact CG-CE2 4.18Å; W31-Y66 HydrophobicContact CG-CG 4.48Å; W31-Y66 HydrophobicContact CH2-CD1 4.43Å; W31-Y66 HydrophobicContact CZ2-CE1 4.36Å; W31-Y66 HydrophobicContact CZ3-CD1 4.01Å; P64-Y66 HydrophobicContact CB-CE2 4.3Å; P64-Y66 HydrophobicContact CG-CD2 4.45Å; P64-Y66 HydrophobicContact CG-CE1 4.14Å; P64-Y66 HydrophobicContact CG-CE2 3.73Å; Y66-I68 PolarHBondContact O-N 3.39Å
67	N	84.8	Confident	86.2	Confident	117 Å²	117	62.3 Å²	62.3	63%	0.626	33%	0.328	S	S	*	.			trans	-73.6	111.9	-178.5	-67	-22.2	0	0	0	108.8	T60 P61 P65	T60-N67 PolarHBondContact OG1-O 3.46Å; P61-N67 VanDerWaalsContact CD-O 3.27Å; P61-N67 WeakPolarHBondContact CD-O 3.49Å; P65-N67 PolarHBondContact O-N 3.32Å
68	I	86.4	Confident	85.6	Confident	76 Å²	76	69.5 Å²	69.5	39%	0.39	37%	0.366	S	S	.	.			trans	-92.9	121.4	179.6	-57.7	173.6	0	0	0	108.4	I58 Y66 E70	I58-I68 HydrophobicContact CG2-CG2 3.75Å; Y66-I68 PolarHBondContact O-N 3.39Å; I68-E70 HydrophobicContact CG2-CG 4.48Å
69	S	88.5	Confident	85.4	Confident	47 Å²	47	70.2 Å²	70.2	33%	0.329	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.6	170.5	64.3	0	0	0	0	110.4	I58 R59	I58-S69 WeakPolarHBondContact CA-O 3.46Å; R59-S69 WeakPolarHBondContact CB-OG 3.19Å; R59-S69 PolarHBondContact N-O 3.29Å; R59-S69 PolarHBondContact O-N 2.83Å; R59-S69 PolarHBondContact O-OG 2.89Å
70	E	89.8	Confident	85.4	Confident	116 Å²	116	78.4 Å²	78.4	54%	0.542	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.2	175.1	-59.7	-171.5	176.2	0	0	110.1	L57 I58 I68	L57-E70 CarbonylContact O-C 3.54Å; L57-E70 WeakPolarHBondContact O-CA 3.22Å; I58-E70 HydrophobicContact CG1-CG 4.4Å; I68-E70 HydrophobicContact CG2-CG 4.48Å
71	I	91.2	Very high	85.5	Confident	19 Å²	19	79 Å²	79	10%	0.097	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	123.3	-177	-55.1	177	0	0	0	108.6	T56 L57 I73 I105 V112	T56-I71 CarbonylContact C-O 3.54Å; T56-I71 WeakPolarHBondContact CA-O 3.36Å; L57-I71 HydrophobicContact CB-CB 4.34Å; L57-I71 PolarHBondContact N-O 3.43Å; L57-I71 PolarHBondContact O-N 3.32Å; I71-I73 PolarHBondContact O-N 3.37Å; I71-I105 HydrophobicContact CD1-CD1 3.46Å; I71-I105 VanDerWaalsContact CD1-CD1 3.46Å; I71-I105 HydrophobicContact CG2-CD1 4.34Å; I71-V112 HydrophobicContact CG2-CG1 4.23Å
72	E	90.7	Very high	85.6	Confident	105 Å²	105	79.9 Å²	79.9	49%	0.491	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	122	175.6	-172.7	-178.8	-164	0	0	110.3	R75	E72-R75 WeakPolarHBondContact OE1-CG 3.4Å; E72-R75 IonicContact OE1-NE 3.3Å; E72-R75 PolarHBondContact OE1-NE 3.44Å; E72-R75 IonicContact OE2-NE 3.35Å; E72-R75 IonicContact OE2-NH2 3.85Å
73	I	90.4	Very high	86	Confident	11 Å²	11	81.3 Å²	81.3	6%	0.056	41%	0.413	C	S	.	.			trans	-85.1	-55.7	179.3	-56	163.1	0	0	0	109.8	N55 L57 I71 V81 I95 M97 F103 V112	N55-I73 HydrophobicContact CB-CB 4.47Å; N55-I73 VanDerWaalsContact O-CB 3.24Å; N55-I73 WeakPolarHBondContact O-CB 3.4Å; N55-I73 WeakPolarHBondContact O-CG1 3.28Å; N55-I73 PolarHBondContact O-N 3.03Å; L57-I73 HydrophobicContact CB-CD1 3.99Å; L57-I73 HydrophobicContact CB-CG1 3.92Å; L57-I73 HydrophobicContact CD1-CD1 4.48Å; I71-I73 PolarHBondContact O-N 3.37Å; I73-V81 HydrophobicContact CD1-CG2 3.79Å; I73-I95 HydrophobicContact CD1-CD1 4.07Å; I73-I95 HydrophobicContact CD1-CG2 4.25Å; I73-I95 HydrophobicContact CG1-CD1 4.12Å; I73-I95 HydrophobicContact CG2-CG2 4.49Å; I73-M97 HydrophobicContact CG2-SD 3.93Å; I73-F103 HydrophobicContact CG2-CD2 3.73Å; I73-F103 HydrophobicContact CG2-CE2 3.98Å; I73-F103 HydrophobicContact CG2-CG 4.12Å; I73-V112 HydrophobicContact CG2-CG2 4.5Å
74	S	84.7	Confident	86.4	Confident	20 Å²	20	78.5 Å²	78.5	14%	0.14	40%	0.396	C	S	.	.			trans	-146.1	140.4	-177.4	-179	0	0	0	0	110.9	L76	S74-L76 VanDerWaalsContact C-N 3.3Å; S74-L76 PolarHBondContact OG-N 3.48Å
75	R	78.8	Confident	86.9	Confident	213 Å²	213	75.4 Å²	75.4	80%	0.804	37%	0.374	S	S	*	.	S	Bend	trans	-78.9	-14.4	174.1	-77.6	174.2	-174.6	178.5	3.7	113.6	E72 S77	E72-R75 WeakPolarHBondContact OE1-CG 3.4Å; E72-R75 IonicContact OE1-NE 3.3Å; E72-R75 PolarHBondContact OE1-NE 3.44Å; E72-R75 IonicContact OE2-NE 3.35Å; E72-R75 IonicContact OE2-NH2 3.85Å; R75-S77 PolarHBondContact O-N 3.06Å
76	L	76.4	Confident	87.7	Confident	119 Å²	119	71.7 Å²	71.7	62%	0.623	35%	0.349	S	S	*	.			trans	-75.2	110.2	-179.2	-63.1	167.5	0	0	0	108	N55 S74 D78 D79	N55-L76 PolarHBondContact ND2-O 3.17Å; S74-L76 VanDerWaalsContact C-N 3.3Å; S74-L76 PolarHBondContact OG-N 3.48Å; L76-D78 PolarHBondContact O-N 2.9Å; L76-D79 HydrophobicContact CB-CB 4.48Å
77	S	71.8	Confident	88.1	Confident	95 Å²	95	67.4 Å²	67.4	66%	0.664	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-23.6	-178.9	50.9	0	0	0	0	113.8	R75	R75-S77 PolarHBondContact O-N 3.06Å
78	D	81.2	Confident	88.3	Confident	151 Å²	151	62.2 Å²	62.2	81%	0.807	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-20.2	-169.4	-60.9	-5.7	0	0	0	112.1	L76	L76-D78 PolarHBondContact O-N 2.9Å
79	D	88.6	Confident	88.3	Confident	17 Å²	17	60.6 Å²	60.6	9%	0.091	30%	0.297	C	S	.	.			trans	-94	126.9	178.2	-171.6	17.2	0	0	0	109.7	N55 L76 M97 Q98 S99	N55-D79 VanDerWaalsContact CG-O 3.29Å; N55-D79 PolarHBondContact ND2-O 3.25Å; N55-D79 PolarHBondContact OD1-O 3.27Å; N55-D79 VanDerWaalsContact OD1-O 3.14Å; L76-D79 HydrophobicContact CB-CB 4.48Å; D79-M97 HydrophobicContact CB-CE 4.15Å; D79-M97 VanDerWaalsContact OD2-CB 3.31Å; D79-M97 WeakPolarHBondContact OD2-CB 3.41Å; D79-Q98 PolarHBondContact OD1-N 3.38Å; D79-S99 VanDerWaalsContact CG-CB 3.42Å; D79-S99 WeakPolarHBondContact OD1-CB 3.5Å; D79-S99 PolarHBondContact OD1-N 3.28Å; D79-S99 PolarHBondContact OD1-OG 3.45Å; D79-S99 WeakPolarHBondContact OD2-CB 3.4Å; D79-S99 PolarHBondContact OD2-OG 2.88Å
80	R	90.7	Very high	88.3	Confident	176 Å²	176	58.6 Å²	58.6	66%	0.664	28%	0.283	S	S	*	.			trans	-111.2	153.5	-176.7	-64	-177.6	-176.6	-179.3	1.7	110.2	H82 Q98	R80-H82 PolarHBondContact O-N 2.85Å; R80-Q98 WeakPolarHBondContact O-CB 3.23Å; R80-Q98 PolarHBondContact O-N 3.23Å
81	V	93.4	Very high	88.3	Confident	13 Å²	13	54.8 Å²	54.8	8%	0.079	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	125	170.8	178.9	0	0	0	0	109.2	A51 I73 I84 I95 M97	A51-V81 HydrophobicContact CB-CB 3.96Å; A51-V81 HydrophobicContact CB-CG1 3.94Å; A51-V81 HydrophobicContact CB-CG2 3.76Å; I73-V81 HydrophobicContact CD1-CG2 3.79Å; V81-I84 HydrophobicContact CG1-CD1 4.42Å; V81-I84 HydrophobicContact CG1-CG1 3.8Å; V81-I95 HydrophobicContact CG1-CG2 3.91Å; V81-I95 HydrophobicContact CG2-CG2 4.17Å; V81-M97 HydrophobicContact CB-SD 4.5Å; V81-M97 HydrophobicContact CG2-CE 4.42Å; V81-M97 HydrophobicContact CG2-SD 3.76Å
82	H	92.4	Very high	88.4	Confident	54 Å²	54	53.9 Å²	53.9	25%	0.25	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-54.7	174.7	175.8	75.2	0	0	0	110.5	N40 R80 S96 Q98 L122 D124	N40-H82 PolarHBondContact ND2-O 3.27Å; N40-H82 VanDerWaalsContact ND2-O 3.11Å; R80-H82 PolarHBondContact O-N 2.85Å; H82-S96 WeakPolarHBondContact CA-O 3.42Å; H82-S96 WeakPolarHBondContact CB-O 3.47Å; H82-S96 PolarHBondContact N-O 2.81Å; H82-Q98 PolarHBondContact ND1-OE1 2.81Å; H82-Q98 VanDerWaalsContact ND1-OE1 3.1Å; H82-L122 HydrophobicContact CB-CD1 3.66Å; H82-L122 HydrophobicContact CB-CG 4.36Å; H82-D124 IonicContact CD2-OD1 3.43Å; H82-D124 IonicContact CE1-OD1 3.64Å; H82-D124 IonicContact NE2-OD1 3.85Å; H82-D124 PolarHBondContact NE2-OD1 3.24Å
83	N	93.8	Very high	88.6	Confident	35 Å²	35	48.9 Å²	48.9	19%	0.187	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	158.8	178.6	-151.5	-6.7	0	0	0	112.3	F85 S96 D124	N83-F85 HydrophobicContact CB-CE2 3.94Å; N83-F85 HydrophobicContact CB-CZ 3.77Å; N83-F85 WeakPolarHBondContact ND2-CE1 3.19Å; N83-F85 VanDerWaalsContact ND2-CZ 3.34Å; N83-F85 WeakPolarHBondContact ND2-CZ 3.4Å; N83-S96 PolarHBondContact N-O 2.66Å; N83-S96 PolarHBondContact O-N 2.89Å; N83-D124 PolarHBondContact ND2-O 2.97Å
84	I	95.2	Very high	88.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.9	174.9	-53.1	173.2	0	0	0	108.2	N40 Q42 V49 A51 L57 V81 T93 I95	N40-I84 HydrophobicContact CB-CD1 3.92Å; N40-I84 HydrophobicContact CB-CG1 4.05Å; Q42-I84 WeakPolarHBondContact CG-O 3.27Å; V49-I84 HydrophobicContact CG1-CG2 4.14Å; A51-I84 HydrophobicContact CB-CD1 3.37Å; A51-I84 HydrophobicContact CB-CG1 4.26Å; A51-I84 VanDerWaalsContact N-CD1 3.26Å; L57-I84 HydrophobicContact CD1-CD1 4.16Å; V81-I84 HydrophobicContact CG1-CD1 4.42Å; V81-I84 HydrophobicContact CG1-CG1 3.8Å; I84-T93 HydrophobicContact CG2-CG2 3.51Å; I84-I95 HydrophobicContact CG2-CG1 4.47Å
85	F	95.2	Very high	89.3	Confident	18 Å²	18	47.4 Å²	47.4	8%	0.079	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.5	176.7	-52.6	-81.2	0	0	0	108.8	N83 T93 V94 F123 I126 W128	N83-F85 HydrophobicContact CB-CE2 3.94Å; N83-F85 HydrophobicContact CB-CZ 3.77Å; N83-F85 WeakPolarHBondContact ND2-CE1 3.19Å; N83-F85 VanDerWaalsContact ND2-CZ 3.34Å; N83-F85 WeakPolarHBondContact ND2-CZ 3.4Å; F85-T93 CarbonylContact O-C 3.54Å; F85-T93 VanDerWaalsContact O-CA 3.27Å; F85-T93 WeakPolarHBondContact O-CA 3.39Å; F85-T93 WeakPolarHBondContact O-CG2 3.46Å; F85-V94 PolarHBondContact N-O 3.37Å; F85-V94 PolarHBondContact O-N 2.94Å; F85-F123 HydrophobicContact CE2-CB 3.82Å; F85-F123 HydrophobicContact CZ-CB 4.34Å; F85-F123 WeakPolarHBondContact CZ-O 3.48Å; F85-I126 HydrophobicContact CB-CB 4.29Å; F85-I126 HydrophobicContact CB-CD1 3.74Å; F85-I126 HydrophobicContact CB-CG1 4.17Å; F85-I126 HydrophobicContact CD1-CB 4.12Å; F85-I126 HydrophobicContact CD1-CD1 4.37Å; F85-I126 HydrophobicContact CD1-CG1 3.97Å; F85-I126 HydrophobicContact CD2-CD1 3.47Å; F85-I126 VanDerWaalsContact CD2-CD1 3.47Å; F85-I126 HydrophobicContact CD2-CG1 3.81Å; F85-I126 HydrophobicContact CE1-CG1 4.33Å; F85-I126 HydrophobicContact CE2-CD1 4.17Å; F85-I126 HydrophobicContact CE2-CG1 4.18Å; F85-I126 HydrophobicContact CG-CB 4.11Å; F85-I126 HydrophobicContact CG-CD1 3.58Å; F85-I126 HydrophobicContact CG-CG1 3.69Å; F85-I126 HydrophobicContact CZ-CG1 4.42Å; F85-W128 HydrophobicContact CB-CZ2 3.79Å
86	L	94	Very high	90.1	Very high	10 Å²	10	37.3 Å²	37.3	5%	0.052	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.3	175.1	-176.1	63.5	0	0	0	107.9	Q42 C44 Y47 V49 W128	Q42-L86 HydrophobicContact CB-CB 3.89Å; C44-L86 HydrophobicContact CB-CD2 3.83Å; C44-L86 HydrophobicContact CB-CG 4.14Å; Y47-L86 WeakPolarHBondContact O-CD2 3.49Å; V49-L86 HydrophobicContact CB-CD2 4.49Å; V49-L86 HydrophobicContact CG2-CD1 3.83Å; V49-L86 HydrophobicContact CG2-CD2 4.01Å; V49-L86 HydrophobicContact CG2-CG 4.49Å; L86-W128 PolarHBondContact O-NE1 3.45Å; L86-W128 VanDerWaalsContact O-NE1 3.1Å
87	D	92	Very high	91	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	16%	0.159	C	C	.	.			trans	-70.3	158.5	176.5	80	-58.6	0	0	0	111.6	C44 M89 G90 W91 H92 W128	C44-D87 WeakPolarHBondContact CB-O 3.4Å; D87-M89 PolarHBondContact O-N 3.35Å; D87-M89 WeakPolarHBondContact OD2-CB 3.48Å; D87-M89 PolarHBondContact OD2-N 2.68Å; D87-M89 VanDerWaalsContact OD2-N 3.15Å; D87-G90 PolarHBondContact O-N 2.93Å; D87-G90 VanDerWaalsContact OD1-C 3.27Å; D87-G90 WeakPolarHBondContact OD1-CA 3.4Å; D87-G90 PolarHBondContact OD1-N 3.32Å; D87-G90 VanDerWaalsContact OD1-N 3.09Å; D87-W91 PolarHBondContact OD1-N 3.43Å; D87-H92 HydrophobicContact CB-CB 4.2Å; D87-H92 PolarHBondContact N-O 3.45Å; D87-H92 PolarHBondContact OD1-N 3.35Å; D87-W128 HydrophobicContact CB-CD2 3.63Å; D87-W128 HydrophobicContact CB-CE3 3.66Å; D87-W128 HydrophobicContact CB-CG 4.08Å; D87-W128 HydrophobicContact CB-CH2 4.33Å; D87-W128 HydrophobicContact CB-CZ2 4.31Å; D87-W128 HydrophobicContact CB-CZ3 4.03Å
88	P	88.2	Confident	91.9	Very high	8 Å²	8	32.7 Å²	32.7	5%	0.052	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-28.4	-178.5	-27.5	34.6	0	0	0	114.8	W128 H130	P88-W128 VanDerWaalsContact CD-CB 3.46Å; P88-W128 HydrophobicContact CG-CB 4.07Å; P88-H130 VanDerWaalsContact CG-ND1 3.27Å; P88-H130 WeakPolarHBondContact CG-ND1 3.41Å
89	M	87	Confident	92.4	Very high	42 Å²	42	28.3 Å²	28.3	21%	0.207	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-9.5	179.8	-59.6	-60.3	108.2	0	0	113.2	N45 D87 W91 L469	N45-M89 WeakPolarHBondContact CB-O 3.42Å; N45-M89 PolarHBondContact ND2-O 2.87Å; D87-M89 PolarHBondContact O-N 3.35Å; D87-M89 WeakPolarHBondContact OD2-CB 3.48Å; D87-M89 PolarHBondContact OD2-N 2.68Å; D87-M89 VanDerWaalsContact OD2-N 3.15Å; M89-W91 HydrophobicContact CB-CD2 3.6Å; M89-W91 HydrophobicContact CB-CE3 3.78Å; M89-W91 HydrophobicContact CB-CG 4.08Å; M89-W91 HydrophobicContact CB-CH2 4.22Å; M89-W91 HydrophobicContact CB-CZ2 4.06Å; M89-W91 HydrophobicContact CB-CZ3 4.08Å; M89-W91 HydrophobicContact CG-CD2 4.44Å; M89-W91 HydrophobicContact CG-CE3 4.19Å; M89-W91 HydrophobicContact CG-CH2 4.13Å; M89-W91 HydrophobicContact CG-CZ2 4.38Å; M89-W91 HydrophobicContact CG-CZ3 4.03Å; M89-L469 HydrophobicContact CE-CD1 3.9Å
90	G	88.8	Confident	92.4	Very high	4 Å²	4	27.7 Å²	27.7	4%	0.041	13%	0.132	C	C	.	.	S	Bend	trans	75	20.3	-179.3	0	0	0	0	0	114.3	D87	D87-G90 PolarHBondContact O-N 2.93Å; D87-G90 VanDerWaalsContact OD1-C 3.27Å; D87-G90 WeakPolarHBondContact OD1-CA 3.4Å; D87-G90 PolarHBondContact OD1-N 3.32Å; D87-G90 VanDerWaalsContact OD1-N 3.09Å
91	W	89.9	Confident	92.5	Very high	36 Å²	36	21.5 Å²	21.5	14%	0.136	11%	0.114	C	C	.	.			trans	-92.5	-33.2	-179.6	-60.9	-22.2	0	0	0	114.4	D87 M89 N106 K107 E135	D87-W91 PolarHBondContact OD1-N 3.43Å; M89-W91 HydrophobicContact CB-CD2 3.6Å; M89-W91 HydrophobicContact CB-CE3 3.78Å; M89-W91 HydrophobicContact CB-CG 4.08Å; M89-W91 HydrophobicContact CB-CH2 4.22Å; M89-W91 HydrophobicContact CB-CZ2 4.06Å; M89-W91 HydrophobicContact CB-CZ3 4.08Å; M89-W91 HydrophobicContact CG-CD2 4.44Å; M89-W91 HydrophobicContact CG-CE3 4.19Å; M89-W91 HydrophobicContact CG-CH2 4.13Å; M89-W91 HydrophobicContact CG-CZ2 4.38Å; M89-W91 HydrophobicContact CG-CZ3 4.03Å; W91-N106 CarbonylContact O-C 3.52Å; W91-N106 VanDerWaalsContact O-C 3.25Å; W91-N106 WeakPolarHBondContact O-CA 3.43Å; W91-K107 PolarHBondContact O-N 3.33Å; W91-E135 HydrophobicContact CD2-CB 4.24Å; W91-E135 HydrophobicContact CD2-CG 3.78Å; W91-E135 HydrophobicContact CE3-CB 4.35Å; W91-E135 HydrophobicContact CE3-CG 4.02Å; W91-E135 HydrophobicContact CG-CB 4.49Å; W91-E135 HydrophobicContact CG-CG 4.31Å; W91-E135 HydrophobicContact CH2-CG 4.16Å; W91-E135 HydrophobicContact CZ2-CG 3.92Å; W91-E135 HydrophobicContact CZ3-CG 4.21Å
92	H	92.9	Very high	92.6	Very high	1 Å²	1	21 Å²	21	1%	0.005	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.9	-172.2	-56.4	-67.6	0	0	0	110.2	D87 Y104 W128 N132 N134 E135 S137 T138	D87-H92 HydrophobicContact CB-CB 4.2Å; D87-H92 PolarHBondContact N-O 3.45Å; D87-H92 PolarHBondContact OD1-N 3.35Å; H92-Y104 HydrophobicContact CB-CE2 4.11Å; H92-Y104 PolarHBondContact CE1-OH 3.48Å; H92-Y104 AromaticContact ND1-CE2 3.91Å; H92-Y104 AromaticContact ND1-CZ 3.77Å; H92-Y104 PolarHBondContact ND1-OH 3.42Å; H92-W128 HydrophobicContact CB-CH2 4.16Å; H92-W128 HydrophobicContact CB-CZ3 4.04Å; H92-N132 PolarHBondContact NE2-ND2 3.3Å; H92-N134 PolarHBondContact NE2-O 3.36Å; H92-E135 PolarHBondContact CE1-O 3.27Å; H92-S137 PolarHBondContact NE2-O 3.43Å; H92-T138 HydrophobicContact CB-CG2 3.99Å
93	T	94.8	Very high	92.6	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.8	173.2	-42.2	0	0	0	0	109.8	V49 R59 I84 F85 I95 I105	V49-T93 HydrophobicContact CG1-CG2 3.92Å; R59-T93 PolarHBondContact NH2-OG1 2.98Å; I84-T93 HydrophobicContact CG2-CG2 3.51Å; F85-T93 CarbonylContact O-C 3.54Å; F85-T93 VanDerWaalsContact O-CA 3.27Å; F85-T93 WeakPolarHBondContact O-CA 3.39Å; F85-T93 WeakPolarHBondContact O-CG2 3.46Å; T93-I95 HydrophobicContact CG2-CG1 4.27Å; T93-I105 PolarHBondContact N-O 3.04Å; T93-I105 PolarHBondContact O-N 3.03Å
94	V	95.3	Very high	92.6	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.9	169.5	175.1	0	0	0	0	108.5	F85 F103 Y104 F123 I126 W128 L155	F85-V94 PolarHBondContact N-O 3.37Å; F85-V94 PolarHBondContact O-N 2.94Å; V94-F103 CarbonylContact C-O 3.49Å; V94-F103 WeakPolarHBondContact CA-O 3.44Å; V94-Y104 HydrophobicContact CG2-CD2 4.08Å; V94-F123 HydrophobicContact CG1-CD2 3.82Å; V94-F123 HydrophobicContact CG1-CE2 3.99Å; V94-I126 HydrophobicContact CB-CD1 3.76Å; V94-I126 HydrophobicContact CG1-CD1 3.77Å; V94-I126 HydrophobicContact CG2-CD1 4.18Å; V94-W128 HydrophobicContact CG2-CH2 3.89Å; V94-L155 HydrophobicContact CG2-CD1 3.92Å
95	I	95.3	Very high	92.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.7	-177.8	-55.5	160.5	0	0	0	107.1	L57 I73 V81 I84 T93 M97 N102 F103 I105 V112	L57-I95 HydrophobicContact CD1-CD1 3.74Å; L57-I95 HydrophobicContact CD1-CG1 4.24Å; L57-I95 HydrophobicContact CD2-CD1 3.93Å; L57-I95 HydrophobicContact CG-CD1 4.31Å; I73-I95 HydrophobicContact CD1-CD1 4.07Å; I73-I95 HydrophobicContact CD1-CG2 4.25Å; I73-I95 HydrophobicContact CG1-CD1 4.12Å; I73-I95 HydrophobicContact CG2-CG2 4.49Å; V81-I95 HydrophobicContact CG1-CG2 3.91Å; V81-I95 HydrophobicContact CG2-CG2 4.17Å; I84-I95 HydrophobicContact CG2-CG1 4.47Å; T93-I95 HydrophobicContact CG2-CG1 4.27Å; I95-M97 HydrophobicContact CG2-SD 4.36Å; I95-N102 CarbonylContact O-C 3.53Å; I95-N102 WeakPolarHBondContact O-CA 3.2Å; I95-F103 HydrophobicContact CB-CB 4.3Å; I95-F103 PolarHBondContact N-O 2.87Å; I95-F103 PolarHBondContact O-N 3.18Å; I95-I105 HydrophobicContact CD1-CG2 4.33Å; I95-V112 HydrophobicContact CD1-CG1 4.16Å
96	S	95.4	Very high	92.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.6	173.5	-166.1	0	0	0	0	109.5	H82 N83 N102 F123	H82-S96 WeakPolarHBondContact CA-O 3.42Å; H82-S96 WeakPolarHBondContact CB-O 3.47Å; H82-S96 PolarHBondContact N-O 2.81Å; N83-S96 PolarHBondContact N-O 2.66Å; N83-S96 PolarHBondContact O-N 2.89Å; S96-N102 VanDerWaalsContact CA-OD1 3.27Å; S96-N102 WeakPolarHBondContact CA-OD1 3.5Å; S96-N102 WeakPolarHBondContact CB-OD1 3.31Å; S96-N102 PolarHBondContact OG-OD1 3Å; S96-F123 PolarHBondContact OG-N 3.49Å
97	M	94	Very high	91.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	153.4	175.6	-56.4	-65.9	-69.2	0	0	110.7	I73 D79 V81 I95 S99 G100 T101 F103 L122	I73-M97 HydrophobicContact CG2-SD 3.93Å; D79-M97 HydrophobicContact CB-CE 4.15Å; D79-M97 VanDerWaalsContact OD2-CB 3.31Å; D79-M97 WeakPolarHBondContact OD2-CB 3.41Å; V81-M97 HydrophobicContact CB-SD 4.5Å; V81-M97 HydrophobicContact CG2-CE 4.42Å; V81-M97 HydrophobicContact CG2-SD 3.76Å; I95-M97 HydrophobicContact CG2-SD 4.36Å; M97-S99 PolarHBondContact O-N 3.09Å; M97-S99 VanDerWaalsContact O-N 3.14Å; M97-G100 PolarHBondContact O-N 2.91Å; M97-T101 WeakPolarHBondContact CB-O 3.47Å; M97-T101 VanDerWaalsContact CG-O 3.25Å; M97-T101 WeakPolarHBondContact CG-O 3.17Å; M97-T101 PolarHBondContact N-O 2.92Å; M97-F103 HydrophobicContact CG-CD2 3.91Å; M97-F103 HydrophobicContact CG-CE2 3.62Å; M97-F103 HydrophobicContact SD-CD2 4.47Å; M97-F103 HydrophobicContact SD-CE2 4.35Å; M97-L122 WeakPolarHBondContact O-CD1 3.29Å
98	Q	92.3	Very high	91.3	Very high	118 Å²	118	24.4 Å²	24.4	55%	0.551	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.6	178.3	-166.2	67.9	26.8	0	0	112.7	D79 R80 H82 G100	D79-Q98 PolarHBondContact OD1-N 3.38Å; R80-Q98 WeakPolarHBondContact O-CB 3.23Å; R80-Q98 PolarHBondContact O-N 3.23Å; H82-Q98 PolarHBondContact ND1-OE1 2.81Å; H82-Q98 VanDerWaalsContact ND1-OE1 3.1Å; Q98-G100 PolarHBondContact O-N 3.39Å
99	S	90.4	Very high	91.2	Very high	58 Å²	58	24.7 Å²	24.7	41%	0.406	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-9.2	171.6	63.9	0	0	0	0	115.1	D79 M97 T101	D79-S99 VanDerWaalsContact CG-CB 3.42Å; D79-S99 WeakPolarHBondContact OD1-CB 3.5Å; D79-S99 PolarHBondContact OD1-N 3.28Å; D79-S99 PolarHBondContact OD1-OG 3.45Å; D79-S99 WeakPolarHBondContact OD2-CB 3.4Å; D79-S99 PolarHBondContact OD2-OG 2.88Å; M97-S99 PolarHBondContact O-N 3.09Å; M97-S99 VanDerWaalsContact O-N 3.14Å; S99-T101 VanDerWaalsContact C-N 3.3Å; S99-T101 PolarHBondContact OG-N 3.27Å; S99-T101 PolarHBondContact OG-OG1 3.5Å
100	G	90.2	Very high	91.1	Very high	5 Å²	5	31.6 Å²	31.6	5%	0.052	17%	0.168	C	C	.	.	S	Bend	trans	79.6	10.1	-169.9	0	0	0	0	0	113.6	M97 Q98 N102 D120	M97-G100 PolarHBondContact O-N 2.91Å; Q98-G100 PolarHBondContact O-N 3.39Å; G100-N102 PolarHBondContact O-ND2 2.84Å; G100-D120 PolarHBondContact O-N 3.46Å
101	T	92.6	Very high	91.1	Very high	45 Å²	45	39.4 Å²	39.4	28%	0.276	20%	0.2	S	C	.	.			trans	-85	129.9	168.5	59.1	0	0	0	0	110.1	M97 S99	M97-T101 WeakPolarHBondContact CB-O 3.47Å; M97-T101 VanDerWaalsContact CG-O 3.25Å; M97-T101 WeakPolarHBondContact CG-O 3.17Å; M97-T101 PolarHBondContact N-O 2.92Å; S99-T101 VanDerWaalsContact C-N 3.3Å; S99-T101 PolarHBondContact OG-N 3.27Å; S99-T101 PolarHBondContact OG-OG1 3.5Å
102	N	94	Very high	91.1	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.011	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.6	-176.4	-58.5	-63	0	0	0	110.6	I95 S96 G100 P114 L115 T118 H121 F123	I95-N102 CarbonylContact O-C 3.53Å; I95-N102 WeakPolarHBondContact O-CA 3.2Å; S96-N102 VanDerWaalsContact CA-OD1 3.27Å; S96-N102 WeakPolarHBondContact CA-OD1 3.5Å; S96-N102 WeakPolarHBondContact CB-OD1 3.31Å; S96-N102 PolarHBondContact OG-OD1 3Å; G100-N102 PolarHBondContact O-ND2 2.84Å; N102-P114 WeakPolarHBondContact O-CA 3.26Å; N102-L115 HydrophobicContact CB-CB 4.31Å; N102-L115 HydrophobicContact CB-CD1 4.17Å; N102-L115 PolarHBondContact O-N 3.22Å; N102-T118 WeakPolarHBondContact CB-OG1 3.33Å; N102-T118 PolarHBondContact ND2-O 2.97Å; N102-T118 PolarHBondContact ND2-OG1 2.83Å; N102-T118 VanDerWaalsContact ND2-OG1 3.15Å; N102-H121 PolarHBondContact ND2-O 3.18Å; N102-F123 HydrophobicContact CB-CD2 4.35Å; N102-F123 HydrophobicContact CB-CE2 3.81Å; N102-F123 HydrophobicContact CB-CZ 4.12Å; N102-F123 WeakPolarHBondContact ND2-CZ 3.39Å
103	F	93.6	Very high	91	Very high	25 Å²	25	43 Å²	43	11%	0.11	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	147.4	-178.6	-63.4	-88.1	0	0	0	111	I73 V94 I95 M97 V112 R113 P114	I73-F103 HydrophobicContact CG2-CD2 3.73Å; I73-F103 HydrophobicContact CG2-CE2 3.98Å; I73-F103 HydrophobicContact CG2-CG 4.12Å; V94-F103 CarbonylContact C-O 3.49Å; V94-F103 WeakPolarHBondContact CA-O 3.44Å; I95-F103 HydrophobicContact CB-CB 4.3Å; I95-F103 PolarHBondContact N-O 2.87Å; I95-F103 PolarHBondContact O-N 3.18Å; M97-F103 HydrophobicContact CG-CD2 3.91Å; M97-F103 HydrophobicContact CG-CE2 3.62Å; M97-F103 HydrophobicContact SD-CD2 4.47Å; M97-F103 HydrophobicContact SD-CE2 4.35Å; F103-V112 HydrophobicContact CB-CB 4.21Å; F103-V112 HydrophobicContact CD1-CB 4.28Å; F103-V112 HydrophobicContact CD1-CG2 3.87Å; F103-V112 HydrophobicContact CE1-CG2 4.43Å; F103-V112 HydrophobicContact CG-CG2 4.38Å; F103-R113 CarbonylContact C-O 3.52Å; F103-R113 WeakPolarHBondContact CA-O 3.39Å; F103-P114 HydrophobicContact CD1-CB 4.15Å; F103-P114 HydrophobicContact CE1-CB 3.99Å
104	Y	93.8	Very high	90.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	144	174.3	168.6	-96.6	0	0	0	110.7	H92 V94 N106 M109 R113 T138 L155 I168	H92-Y104 HydrophobicContact CB-CE2 4.11Å; H92-Y104 PolarHBondContact CE1-OH 3.48Å; H92-Y104 AromaticContact ND1-CE2 3.91Å; H92-Y104 AromaticContact ND1-CZ 3.77Å; H92-Y104 PolarHBondContact ND1-OH 3.42Å; V94-Y104 HydrophobicContact CG2-CD2 4.08Å; Y104-N106 HydrophobicContact CE1-CB 4.35Å; Y104-M109 HydrophobicContact CD1-CE 4.32Å; Y104-M109 HydrophobicContact CD1-SD 4.14Å; Y104-M109 HydrophobicContact CE1-SD 3.88Å; Y104-R113 PolarHBondContact N-O 2.68Å; Y104-R113 PolarHBondContact O-N 2.97Å; Y104-T138 HydrophobicContact CE2-CG2 4.13Å; Y104-L155 HydrophobicContact CD2-CB 4.36Å; Y104-L155 HydrophobicContact CD2-CD1 3.52Å; Y104-L155 HydrophobicContact CE2-CB 4.09Å; Y104-L155 HydrophobicContact CE2-CD1 3.94Å; Y104-L155 HydrophobicContact CG-CD1 4.14Å; Y104-I168 HydrophobicContact CD1-CD1 4.22Å; Y104-I168 HydrophobicContact CD1-CG2 3.71Å; Y104-I168 HydrophobicContact CE1-CG2 4.01Å; Y104-I168 HydrophobicContact CG-CG2 4.27Å
105	I	92.8	Very high	90.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	127.2	174.5	-176	177.3	0	0	0	110.2	L57 R59 I71 T93 I95 M109 V112	L57-I105 HydrophobicContact CD2-CD1 4.47Å; L57-I105 HydrophobicContact CD2-CG2 3.95Å; R59-I105 VanDerWaalsContact NH1-CD1 3.32Å; R59-I105 PolarHBondContact NH2-O 3.28Å; I71-I105 HydrophobicContact CD1-CD1 3.46Å; I71-I105 VanDerWaalsContact CD1-CD1 3.46Å; I71-I105 HydrophobicContact CG2-CD1 4.34Å; T93-I105 PolarHBondContact N-O 3.04Å; T93-I105 PolarHBondContact O-N 3.03Å; I95-I105 HydrophobicContact CD1-CG2 4.33Å; I105-M109 HydrophobicContact CD1-CB 4.47Å; I105-M109 HydrophobicContact CG1-CB 3.68Å; I105-V112 HydrophobicContact CB-CG1 4.04Å; I105-V112 HydrophobicContact CD1-CG1 3.94Å; I105-V112 HydrophobicContact CG2-CG1 3.93Å
106	N	90	Very high	89.9	Confident	6 Å²	6	51.9 Å²	51.9	3%	0.032	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	178.9	172.1	83.5	-18.5	0	0	0	111.6	R59 W91 Y104 G108 M109	R59-N106 PolarHBondContact NH1-O 3.47Å; W91-N106 CarbonylContact O-C 3.52Å; W91-N106 VanDerWaalsContact O-C 3.25Å; W91-N106 WeakPolarHBondContact O-CA 3.43Å; Y104-N106 HydrophobicContact CE1-CB 4.35Å; N106-G108 VanDerWaalsContact C-N 3.3Å; N106-G108 PolarHBondContact O-N 3.11Å; N106-G108 PolarHBondContact OD1-N 2.98Å; N106-G108 VanDerWaalsContact OD1-N 3.14Å; N106-M109 HydrophobicContact CB-SD 4.25Å; N106-M109 PolarHBondContact N-SD 3.36Å; N106-M109 VanDerWaalsContact N-SD 3.43Å; N106-M109 PolarHBondContact O-N 2.86Å; N106-M109 VanDerWaalsContact OD1-CB 3.24Å; N106-M109 WeakPolarHBondContact OD1-CB 3.48Å; N106-M109 WeakPolarHBondContact OD1-CG 3.37Å; N106-M109 PolarHBondContact OD1-N 2.79Å; N106-M109 PolarHBondContact OD1-SD 2.91Å; N106-M109 VanDerWaalsContact OD1-SD 3.42Å
107	K	84.9	Confident	89.4	Confident	111 Å²	111	56.7 Å²	56.7	48%	0.483	29%	0.288	S	S	.	.	S	Bend	trans	-61.4	-33.2	178.8	-174.7	176.2	171.7	-168.5	0	113.5	W91	W91-K107 PolarHBondContact O-N 3.33Å
108	G	81.6	Confident	89	Confident	52 Å²	52	56.7 Å²	56.7	54%	0.536	29%	0.288	S	S	.	.	S	Bend	trans	-83.1	-22.2	179.7	0	0	0	0	0	115	N106	N106-G108 VanDerWaalsContact C-N 3.3Å; N106-G108 PolarHBondContact O-N 3.11Å; N106-G108 PolarHBondContact OD1-N 2.98Å; N106-G108 VanDerWaalsContact OD1-N 3.14Å
109	M	85.8	Confident	88.4	Confident	13 Å²	13	57.4 Å²	57.4	6%	0.064	29%	0.289	C	S	.	.			trans	-75	129.3	-177.1	-78.1	164	76	0	0	111.8	Y104 I105 N106 R113 F157	Y104-M109 HydrophobicContact CD1-CE 4.32Å; Y104-M109 HydrophobicContact CD1-SD 4.14Å; Y104-M109 HydrophobicContact CE1-SD 3.88Å; I105-M109 HydrophobicContact CD1-CB 4.47Å; I105-M109 HydrophobicContact CG1-CB 3.68Å; N106-M109 HydrophobicContact CB-SD 4.25Å; N106-M109 PolarHBondContact N-SD 3.36Å; N106-M109 VanDerWaalsContact N-SD 3.43Å; N106-M109 PolarHBondContact O-N 2.86Å; N106-M109 VanDerWaalsContact OD1-CB 3.24Å; N106-M109 WeakPolarHBondContact OD1-CB 3.48Å; N106-M109 WeakPolarHBondContact OD1-CG 3.37Å; N106-M109 PolarHBondContact OD1-N 2.79Å; N106-M109 PolarHBondContact OD1-SD 2.91Å; N106-M109 VanDerWaalsContact OD1-SD 3.42Å; M109-R113 HydrophobicContact CE-CB 3.89Å; M109-R113 HydrophobicContact CE-CG 3.47Å; M109-R113 VanDerWaalsContact CE-CG 3.47Å; M109-F157 HydrophobicContact CE-CD2 4.49Å; M109-F157 HydrophobicContact CG-CD2 3.91Å; M109-F157 HydrophobicContact CG-CE1 4.25Å; M109-F157 HydrophobicContact CG-CE2 3.62Å; M109-F157 HydrophobicContact CG-CG 4.35Å; M109-F157 HydrophobicContact CG-CZ 3.81Å; M109-F157 HydrophobicContact SD-CD2 3.63Å; M109-F157 HydrophobicContact SD-CE2 3.93Å; M109-F157 HydrophobicContact SD-CG 4.1Å
110	K	85.5	Confident	88.2	Confident	188 Å²	188	60.2 Å²	60.2	82%	0.817	30%	0.3	S	S	*	.	S	Bend	trans	-88.3	-12.8	175.4	-63.4	-176	-179.5	178.7	0	114.2
111	K	88.2	Confident	88.2	Confident	168 Å²	168	62 Å²	62	73%	0.73	31%	0.307	S	S	*	.	S	Bend	trans	-135.8	142.9	179.4	-67.2	-173.2	178.6	-177.8	0	108.9
112	V	90.8	Very high	88.3	Confident	21 Å²	21	60.8 Å²	60.8	13%	0.127	30%	0.299	C	S	.	.			trans	-67.3	148.3	171.7	-60.8	0	0	0	0	110.4	I71 I73 I95 F103 I105	I71-V112 HydrophobicContact CG2-CG1 4.23Å; I73-V112 HydrophobicContact CG2-CG2 4.5Å; I95-V112 HydrophobicContact CD1-CG1 4.16Å; F103-V112 HydrophobicContact CB-CB 4.21Å; F103-V112 HydrophobicContact CD1-CB 4.28Å; F103-V112 HydrophobicContact CD1-CG2 3.87Å; F103-V112 HydrophobicContact CE1-CG2 4.43Å; F103-V112 HydrophobicContact CG-CG2 4.38Å; I105-V112 HydrophobicContact CB-CG1 4.04Å; I105-V112 HydrophobicContact CD1-CG1 3.94Å; I105-V112 HydrophobicContact CG2-CG1 3.93Å
113	R	89.7	Confident	88.3	Confident	90 Å²	90	60.7 Å²	60.7	34%	0.34	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	137.9	172.2	-71.2	-176	-179.8	-154.9	2.4	110.2	F103 Y104 M109 I168	F103-R113 CarbonylContact C-O 3.52Å; F103-R113 WeakPolarHBondContact CA-O 3.39Å; Y104-R113 PolarHBondContact N-O 2.68Å; Y104-R113 PolarHBondContact O-N 2.97Å; M109-R113 HydrophobicContact CE-CB 3.89Å; M109-R113 HydrophobicContact CE-CG 3.47Å; M109-R113 VanDerWaalsContact CE-CG 3.47Å; R113-I168 HydrophobicContact CB-CD1 3.3Å; R113-I168 HydrophobicContact CG-CD1 4.05Å
114	P	89.3	Confident	88.4	Confident	66 Å²	66	60.7 Å²	60.7	43%	0.429	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	145.9	178.1	30.1	-34.4	0	0	0	111.4	N102 F103	N102-P114 WeakPolarHBondContact O-CA 3.26Å; F103-P114 HydrophobicContact CD1-CB 4.15Å; F103-P114 HydrophobicContact CE1-CB 3.99Å
115	L	89.7	Confident	88.5	Confident	5 Å²	5	61 Å²	61	3%	0.026	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	103.7	169.8	-60.9	176.8	0	0	0	108	N102 T118 F123 L155 I168 E169	N102-L115 HydrophobicContact CB-CB 4.31Å; N102-L115 HydrophobicContact CB-CD1 4.17Å; N102-L115 PolarHBondContact O-N 3.22Å; L115-T118 HydrophobicContact CB-CG2 4.05Å; L115-T118 VanDerWaalsContact CB-OG1 3.3Å; L115-T118 WeakPolarHBondContact CB-OG1 3.47Å; L115-T118 PolarHBondContact O-OG1 3.31Å; L115-F123 HydrophobicContact CD1-CE2 4.37Å; L115-L155 HydrophobicContact CD2-CD2 3.97Å; L115-I168 HydrophobicContact CD2-CB 4.34Å; L115-I168 HydrophobicContact CD2-CG2 4.29Å; L115-E169 VanDerWaalsContact CA-OE1 3.22Å; L115-E169 WeakPolarHBondContact CA-OE1 3.27Å; L115-E169 HydrophobicContact CD2-CG 3.92Å
116	N	84.1	Confident	88.6	Confident	117 Å²	117	61.7 Å²	61.7	63%	0.626	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-78.8	-27.9	-169.7	-67.4	-32	0	0	0	112.6	T118 E169	N116-T118 PolarHBondContact O-N 3.34Å; N116-E169 PolarHBondContact N-OE1 3.08Å
117	K	83.6	Confident	88.8	Confident	101 Å²	101	61.5 Å²	61.5	44%	0.439	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-75.7	-13	179.8	-68.3	-175.2	-177.6	168.3	0	113.3	E169 W172	K117-E169 HydrophobicContact CD-CB 4.18Å; K117-E169 PolarHBondContact N-OE1 3.3Å; K117-E169 VanDerWaalsContact N-OE1 3.16Å; K117-W172 HydrophobicContact CD-CB 4.29Å
118	T	85.4	Confident	89.2	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-109.6	10.8	-170.2	71.5	0	0	0	0	112.7	N102 L115 N116 D120 H121 F123 W172	N102-T118 WeakPolarHBondContact CB-OG1 3.33Å; N102-T118 PolarHBondContact ND2-O 2.97Å; N102-T118 PolarHBondContact ND2-OG1 2.83Å; N102-T118 VanDerWaalsContact ND2-OG1 3.15Å; L115-T118 HydrophobicContact CB-CG2 4.05Å; L115-T118 VanDerWaalsContact CB-OG1 3.3Å; L115-T118 WeakPolarHBondContact CB-OG1 3.47Å; L115-T118 PolarHBondContact O-OG1 3.31Å; N116-T118 PolarHBondContact O-N 3.34Å; T118-D120 PolarHBondContact O-N 2.81Å; T118-H121 PolarHBondContact O-N 3.43Å; T118-F123 HydrophobicContact CG2-CZ 3.89Å; T118-W172 HydrophobicContact CG2-CD2 3.92Å; T118-W172 HydrophobicContact CG2-CE3 3.52Å; T118-W172 HydrophobicContact CG2-CH2 3.32Å; T118-W172 HydrophobicContact CG2-CZ2 3.68Å; T118-W172 HydrophobicContact CG2-CZ3 3.2Å
119	K	79.8	Confident	89.4	Confident	132 Å²	132	55.4 Å²	55.4	57%	0.574	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	138.9	178.2	-167.2	-176.3	174.4	-171.8	0	109.7	H121	K119-H121 VanDerWaalsContact C-N 3.26Å; K119-H121 PolarHBondContact O-N 3.49Å
120	D	86.3	Confident	89.2	Confident	117 Å²	117	57.6 Å²	57.6	63%	0.626	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	4.2	-179.5	-46.5	-39.6	0	0	0	114.7	G100 T118	G100-D120 PolarHBondContact O-N 3.46Å; T118-D120 PolarHBondContact O-N 2.81Å
121	H	91.1	Very high	88.8	Confident	44 Å²	44	51.2 Å²	51.2	20%	0.204	25%	0.246	C	C	.	.			trans	-106.3	121.8	170.6	-67.1	-50.7	0	0	0	111.1	N102 T118 K119 F123 T145 F151	N102-H121 PolarHBondContact ND2-O 3.18Å; T118-H121 PolarHBondContact O-N 3.43Å; K119-H121 VanDerWaalsContact C-N 3.26Å; K119-H121 PolarHBondContact O-N 3.49Å; H121-F123 HydrophobicContact CB-CE1 4.11Å; H121-T145 HydrophobicContact CB-CG2 4.08Å; H121-F151 AromaticContact NE2-CZ 3.76Å
122	L	93.5	Very high	88.4	Confident	19 Å²	19	43.8 Å²	43.8	10%	0.099	21%	0.214	C	C	.	.			trans	-88.3	126.3	175	-164.5	69.9	0	0	0	109.4	H82 M97 T145 N146	H82-L122 HydrophobicContact CB-CD1 3.66Å; H82-L122 HydrophobicContact CB-CG 4.36Å; M97-L122 WeakPolarHBondContact O-CD1 3.29Å; L122-T145 CarbonylContact O-C 3.6Å; L122-T145 WeakPolarHBondContact O-CA 3.41Å; L122-T145 WeakPolarHBondContact O-CB 3.49Å; L122-N146 HydrophobicContact CB-CB 3.98Å; L122-N146 VanDerWaalsContact CB-OD1 3.3Å; L122-N146 WeakPolarHBondContact CB-OD1 3.4Å; L122-N146 HydrophobicContact CD2-CB 4.07Å; L122-N146 HydrophobicContact CG-CB 4.48Å; L122-N146 PolarHBondContact N-OD1 3.28Å; L122-N146 PolarHBondContact O-N 2.83Å; L122-N146 PolarHBondContact O-OD1 3.35Å
123	F	95.8	Very high	87.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	120.8	-178	-58.1	-15.3	0	0	0	110.6	F85 V94 S96 N102 L115 T118 H121 I126 I143 T145 W172	F85-F123 HydrophobicContact CE2-CB 3.82Å; F85-F123 HydrophobicContact CZ-CB 4.34Å; F85-F123 WeakPolarHBondContact CZ-O 3.48Å; V94-F123 HydrophobicContact CG1-CD2 3.82Å; V94-F123 HydrophobicContact CG1-CE2 3.99Å; S96-F123 PolarHBondContact OG-N 3.49Å; N102-F123 HydrophobicContact CB-CD2 4.35Å; N102-F123 HydrophobicContact CB-CE2 3.81Å; N102-F123 HydrophobicContact CB-CZ 4.12Å; N102-F123 WeakPolarHBondContact ND2-CZ 3.39Å; L115-F123 HydrophobicContact CD1-CE2 4.37Å; T118-F123 HydrophobicContact CG2-CZ 3.89Å; H121-F123 HydrophobicContact CB-CE1 4.11Å; F123-I126 HydrophobicContact CD2-CD1 4.48Å; F123-I143 HydrophobicContact CB-CG2 4.16Å; F123-I143 HydrophobicContact CD1-CG2 3.54Å; F123-I143 HydrophobicContact CD2-CG2 3.9Å; F123-I143 HydrophobicContact CE1-CG2 3.78Å; F123-I143 HydrophobicContact CE2-CD1 4.1Å; F123-I143 HydrophobicContact CE2-CG2 4.11Å; F123-I143 HydrophobicContact CG-CG2 3.61Å; F123-I143 HydrophobicContact CZ-CD1 4.27Å; F123-I143 HydrophobicContact CZ-CG2 4.04Å; F123-T145 HydrophobicContact CD1-CG2 4.26Å; F123-W172 AromaticContact CE1-CH2 3.77Å; F123-W172 HydrophobicContact CE1-CH2 3.77Å; F123-W172 HydrophobicContact CE1-CZ2 4.23Å; F123-W172 AromaticContact CZ-CH2 3.49Å; F123-W172 HydrophobicContact CZ-CH2 3.49Å; F123-W172 VanDerWaalsContact CZ-CH2 3.49Å; F123-W172 HydrophobicContact CZ-CZ2 4.31Å; F123-W172 HydrophobicContact CZ-CZ3 4.22Å
124	D	94.4	Very high	87.4	Confident	24 Å²	24	47.4 Å²	47.4	13%	0.128	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-27.8	-179.4	-74.4	9.1	0	0	0	111.3	H82 N83 G144 N146 S181 V182	H82-D124 IonicContact CD2-OD1 3.43Å; H82-D124 IonicContact CE1-OD1 3.64Å; H82-D124 IonicContact NE2-OD1 3.85Å; H82-D124 PolarHBondContact NE2-OD1 3.24Å; N83-D124 PolarHBondContact ND2-O 2.97Å; D124-G144 PolarHBondContact N-O 3.16Å; D124-N146 VanDerWaalsContact OD2-CA 3.27Å; D124-N146 WeakPolarHBondContact OD2-CA 3.27Å; D124-S181 WeakPolarHBondContact OD2-CB 3.28Å; D124-S181 PolarHBondContact OD2-OG 3.19Å; D124-V182 VanDerWaalsContact CB-O 3.29Å; D124-V182 WeakPolarHBondContact CB-O 3.46Å
125	S	95.3	Very high	87.2	Confident	7 Å²	7	48.8 Å²	48.8	5%	0.049	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	152.2	178.2	56.4	0	0	0	0	113.1	G144 V182 V185	S125-G144 PolarHBondContact N-O 2.87Å; S125-G144 PolarHBondContact O-N 3.25Å; S125-V182 WeakPolarHBondContact CB-O 3.46Å; S125-V182 PolarHBondContact OG-O 3.28Å; S125-V185 WeakPolarHBondContact OG-CG2 3.33Å
126	I	96	Very high	87	Confident	14 Å²	14	51.8 Å²	51.8	7%	0.072	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	126.8	174.2	-60.6	-171.2	0	0	0	108.4	F85 V94 F123 W128 I141 L142 I143	F85-I126 HydrophobicContact CB-CB 4.29Å; F85-I126 HydrophobicContact CB-CD1 3.74Å; F85-I126 HydrophobicContact CB-CG1 4.17Å; F85-I126 HydrophobicContact CD1-CB 4.12Å; F85-I126 HydrophobicContact CD1-CD1 4.37Å; F85-I126 HydrophobicContact CD1-CG1 3.97Å; F85-I126 HydrophobicContact CD2-CD1 3.47Å; F85-I126 VanDerWaalsContact CD2-CD1 3.47Å; F85-I126 HydrophobicContact CD2-CG1 3.81Å; F85-I126 HydrophobicContact CE1-CG1 4.33Å; F85-I126 HydrophobicContact CE2-CD1 4.17Å; F85-I126 HydrophobicContact CE2-CG1 4.18Å; F85-I126 HydrophobicContact CG-CB 4.11Å; F85-I126 HydrophobicContact CG-CD1 3.58Å; F85-I126 HydrophobicContact CG-CG1 3.69Å; F85-I126 HydrophobicContact CZ-CG1 4.42Å; V94-I126 HydrophobicContact CB-CD1 3.76Å; V94-I126 HydrophobicContact CG1-CD1 3.77Å; V94-I126 HydrophobicContact CG2-CD1 4.18Å; F123-I126 HydrophobicContact CD2-CD1 4.48Å; I126-W128 HydrophobicContact CD1-CZ2 4.47Å; I126-W128 HydrophobicContact CG2-CD2 3.94Å; I126-W128 HydrophobicContact CG2-CE3 4.34Å; I126-W128 HydrophobicContact CG2-CG 4.36Å; I126-W128 HydrophobicContact CG2-CH2 4.48Å; I126-W128 HydrophobicContact CG2-CZ2 4.09Å; I126-I141 HydrophobicContact CG2-CD1 4.34Å; I126-L142 CarbonylContact C-O 3.5Å; I126-L142 WeakPolarHBondContact CA-O 3.47Å; I126-I143 HydrophobicContact CD1-CG1 4.31Å; I126-I143 HydrophobicContact CG1-CG1 4.14Å; I126-I143 HydrophobicContact CG1-CG2 4.33Å; I126-I143 HydrophobicContact CG2-CG1 4.45Å
127	A	94.3	Very high	87.1	Confident	2 Å²	2	46.5 Å²	46.5	2%	0.017	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	107.2	168.1	0	0	0	0	0	109.7	L142 V185 V187	A127-L142 HydrophobicContact CB-CB 4.19Å; A127-L142 PolarHBondContact N-O 3.01Å; A127-L142 PolarHBondContact O-N 2.84Å; A127-V185 HydrophobicContact CB-CB 4.09Å; A127-V185 HydrophobicContact CB-CG1 3.74Å; A127-V185 WeakPolarHBondContact CB-O 3.35Å; A127-V187 HydrophobicContact CB-CB 4.38Å; A127-V187 HydrophobicContact CB-CG2 3.61Å
128	W	92.3	Very high	87.3	Confident	25 Å²	25	41.8 Å²	41.8	10%	0.095	21%	0.212	C	C	.	.			trans	-76.3	151	178.2	-63.9	105.2	0	0	0	111.8	F85 L86 D87 P88 H92 V94 I126 H130 T138 I141	F85-W128 HydrophobicContact CB-CZ2 3.79Å; L86-W128 PolarHBondContact O-NE1 3.45Å; L86-W128 VanDerWaalsContact O-NE1 3.1Å; D87-W128 HydrophobicContact CB-CD2 3.63Å; D87-W128 HydrophobicContact CB-CE3 3.66Å; D87-W128 HydrophobicContact CB-CG 4.08Å; D87-W128 HydrophobicContact CB-CH2 4.33Å; D87-W128 HydrophobicContact CB-CZ2 4.31Å; D87-W128 HydrophobicContact CB-CZ3 4.03Å; P88-W128 VanDerWaalsContact CD-CB 3.46Å; P88-W128 HydrophobicContact CG-CB 4.07Å; H92-W128 HydrophobicContact CB-CH2 4.16Å; H92-W128 HydrophobicContact CB-CZ3 4.04Å; V94-W128 HydrophobicContact CG2-CH2 3.89Å; I126-W128 HydrophobicContact CD1-CZ2 4.47Å; I126-W128 HydrophobicContact CG2-CD2 3.94Å; I126-W128 HydrophobicContact CG2-CE3 4.34Å; I126-W128 HydrophobicContact CG2-CG 4.36Å; I126-W128 HydrophobicContact CG2-CH2 4.48Å; I126-W128 HydrophobicContact CG2-CZ2 4.09Å; W128-H130 PolarHBondContact O-N 2.85Å; W128-H130 VanDerWaalsContact O-N 3.13Å; W128-T138 HydrophobicContact CZ3-CG2 3.94Å; W128-I141 HydrophobicContact CE3-CG2 3.94Å; W128-I141 HydrophobicContact CZ3-CD1 4.22Å; W128-I141 HydrophobicContact CZ3-CG2 4.44Å
129	N	86.3	Confident	87.3	Confident	11 Å²	11	44.1 Å²	44.1	6%	0.059	22%	0.223	C	C	.	.			trans	-74.6	102.4	166.1	-174.7	-8.5	0	0	0	109.7	H131 N132 Q139	N129-H131 PolarHBondContact O-N 3.22Å; N129-H131 VanDerWaalsContact O-N 3.1Å; N129-H131 PolarHBondContact OD1-N 3.04Å; N129-N132 HydrophobicContact CB-CB 4.45Å; N129-N132 WeakPolarHBondContact O-CB 3.29Å; N129-N132 PolarHBondContact O-N 2.92Å; N129-N132 VanDerWaalsContact O-N 3.1Å; N129-Q139 HydrophobicContact CB-CB 4.42Å; N129-Q139 WeakPolarHBondContact ND2-CB 3.43Å; N129-Q139 PolarHBondContact ND2-OE1 3.09Å
130	H	82.8	Confident	87.6	Confident	59 Å²	59	39.5 Å²	39.5	27%	0.273	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.8	178.5	-70	-76.9	0	0	0	114.6	P88 W128 E186	P88-H130 VanDerWaalsContact CG-ND1 3.27Å; P88-H130 WeakPolarHBondContact CG-ND1 3.41Å; W128-H130 PolarHBondContact O-N 2.85Å; W128-H130 VanDerWaalsContact O-N 3.13Å; H130-E186 IonicContact NE2-OE2 3.77Å
131	H	76.7	Confident	87.9	Confident	54 Å²	54	33.9 Å²	33.9	25%	0.25	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	12.8	178.3	-54	-72.1	0	0	0	112.5	N129 V133 T192	N129-H131 PolarHBondContact O-N 3.22Å; N129-H131 VanDerWaalsContact O-N 3.1Å; N129-H131 PolarHBondContact OD1-N 3.04Å; H131-V133 PolarHBondContact O-N 2.87Å; H131-T192 VanDerWaalsContact CE1-CB 3.44Å; H131-T192 WeakPolarHBondContact CE1-CB 2.99Å
132	N	79.8	Confident	88.1	Confident	11 Å²	11	31.8 Å²	31.8	6%	0.059	16%	0.164	C	C	.	.			trans	-64.9	122.9	177.9	-174.5	27.9	0	0	0	111	H92 N129 N134 S137 Q139	H92-N132 PolarHBondContact NE2-ND2 3.3Å; N129-N132 HydrophobicContact CB-CB 4.45Å; N129-N132 WeakPolarHBondContact O-CB 3.29Å; N129-N132 PolarHBondContact O-N 2.92Å; N129-N132 VanDerWaalsContact O-N 3.1Å; N132-N134 PolarHBondContact ND2-O 3.04Å; N132-N134 PolarHBondContact OD1-N 2.93Å; N132-N134 PolarHBondContact OD1-O 3.15Å; N132-S137 PolarHBondContact ND2-O 3.32Å; N132-S137 PolarHBondContact OD1-O 3.41Å; N132-Q139 WeakPolarHBondContact OD1-CG 3.22Å; N132-Q139 PolarHBondContact OD1-NE2 3.14Å
133	V	78.9	Confident	88.2	Confident	121 Å²	121	31 Å²	31	73%	0.733	16%	0.159	S	C	*	.			trans	-107.1	-2.4	176.6	-66.9	0	0	0	0	112.8	H131	H131-V133 PolarHBondContact O-N 2.87Å
134	N	80.5	Confident	88.2	Confident	66 Å²	66	31 Å²	31	35%	0.353	16%	0.159	S	C	.	.			trans	-106.7	117.2	-174.6	-172.2	-10.3	0	0	0	111.1	H92 N132 L136	H92-N134 PolarHBondContact NE2-O 3.36Å; N132-N134 PolarHBondContact ND2-O 3.04Å; N132-N134 PolarHBondContact OD1-N 2.93Å; N132-N134 PolarHBondContact OD1-O 3.15Å; N134-L136 PolarHBondContact O-N 2.98Å; N134-L136 WeakPolarHBondContact OD1-CB 3.34Å; N134-L136 PolarHBondContact OD1-N 2.95Å
135	E	85.2	Confident	88.3	Confident	95 Å²	95	29.8 Å²	29.8	44%	0.444	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-16	177.6	-53.9	-164	156.8	0	0	113.7	W91 H92	W91-E135 HydrophobicContact CD2-CB 4.24Å; W91-E135 HydrophobicContact CD2-CG 3.78Å; W91-E135 HydrophobicContact CE3-CB 4.35Å; W91-E135 HydrophobicContact CE3-CG 4.02Å; W91-E135 HydrophobicContact CG-CB 4.49Å; W91-E135 HydrophobicContact CG-CG 4.31Å; W91-E135 HydrophobicContact CH2-CG 4.16Å; W91-E135 HydrophobicContact CZ2-CG 3.92Å; W91-E135 HydrophobicContact CZ3-CG 4.21Å; H92-E135 PolarHBondContact CE1-O 3.27Å
136	L	85.7	Confident	88.2	Confident	68 Å²	68	32 Å²	32	36%	0.356	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-17.3	-176.7	-60.6	177.2	0	0	0	113.5	N134 M156 F157	N134-L136 PolarHBondContact O-N 2.98Å; N134-L136 WeakPolarHBondContact OD1-CB 3.34Å; N134-L136 PolarHBondContact OD1-N 2.95Å; L136-M156 WeakPolarHBondContact O-CA 3.48Å; L136-F157 HydrophobicContact CD2-CD1 4.18Å; L136-F157 PolarHBondContact O-N 2.98Å
137	S	86	Confident	88	Confident	6 Å²	6	35.2 Å²	35.2	4%	0.042	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.2	-177.3	177.9	0	0	0	0	110.4	H92 N132 Q139 L155	H92-S137 PolarHBondContact NE2-O 3.43Å; N132-S137 PolarHBondContact ND2-O 3.32Å; N132-S137 PolarHBondContact OD1-O 3.41Å; S137-Q139 PolarHBondContact O-N 2.91Å; S137-Q139 PolarHBondContact OG-N 3.49Å; S137-Q139 VanDerWaalsContact OG-N 3.15Å; S137-L155 WeakPolarHBondContact CA-O 3.35Å
138	T	87.1	Confident	87.9	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.012	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	-12	173.6	59.7	0	0	0	0	113.5	H92 Y104 W128 L155	H92-T138 HydrophobicContact CB-CG2 3.99Å; Y104-T138 HydrophobicContact CE2-CG2 4.13Å; W128-T138 HydrophobicContact CZ3-CG2 3.94Å; T138-L155 HydrophobicContact CG2-CB 3.86Å; T138-L155 HydrophobicContact CG2-CD1 4.43Å; T138-L155 HydrophobicContact CG2-CG 4.47Å; T138-L155 PolarHBondContact N-O 3.36Å; T138-L155 PolarHBondContact OG1-N 3.41Å; T138-L155 PolarHBondContact OG1-O 3.06Å
139	Q	85.4	Confident	87.9	Confident	50 Å²	50	34.8 Å²	34.8	23%	0.234	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	53.5	-165.1	-158.5	-57.8	-179.2	26.7	0	0	110.8	N129 N132 S137 I141	N129-Q139 HydrophobicContact CB-CB 4.42Å; N129-Q139 WeakPolarHBondContact ND2-CB 3.43Å; N129-Q139 PolarHBondContact ND2-OE1 3.09Å; N132-Q139 WeakPolarHBondContact OD1-CG 3.22Å; N132-Q139 PolarHBondContact OD1-NE2 3.14Å; S137-Q139 PolarHBondContact O-N 2.91Å; S137-Q139 PolarHBondContact OG-N 3.49Å; S137-Q139 VanDerWaalsContact OG-N 3.15Å; Q139-I141 PolarHBondContact O-N 3.3Å
140	E	86.7	Confident	88.3	Confident	34 Å²	34	34.2 Å²	34.2	16%	0.159	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	121	-178.5	-47.2	82.9	178.3	0	0	110.5	T153 Y171 R189 L284 F285	E140-T153 WeakPolarHBondContact CA-O 3.27Å; E140-Y171 VanDerWaalsContact CG-OH 3.27Å; E140-Y171 WeakPolarHBondContact CG-OH 3.49Å; E140-R189 PolarHBondContact O-NH2 2.96Å; E140-R189 IonicContact OE2-NH1 3.66Å; E140-L284 HydrophobicContact CB-CD2 4.09Å; E140-L284 HydrophobicContact CG-CB 4.16Å; E140-L284 HydrophobicContact CG-CD2 3.86Å; E140-F285 HydrophobicContact CB-CE2 4.21Å
141	I	92.7	Very high	88.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	153	176.3	60.9	172.8	0	0	0	109.9	I126 W128 Q139 I143 E152 T153 L155	I126-I141 HydrophobicContact CG2-CD1 4.34Å; W128-I141 HydrophobicContact CE3-CG2 3.94Å; W128-I141 HydrophobicContact CZ3-CD1 4.22Å; W128-I141 HydrophobicContact CZ3-CG2 4.44Å; Q139-I141 PolarHBondContact O-N 3.3Å; I141-I143 HydrophobicContact CD1-CD1 4.18Å; I141-I143 HydrophobicContact CD1-CG1 4.32Å; I141-E152 WeakPolarHBondContact O-CA 3.38Å; I141-T153 HydrophobicContact CD1-CG2 3.95Å; I141-T153 HydrophobicContact CG1-CG2 3.67Å; I141-T153 WeakPolarHBondContact CG1-O 3.17Å; I141-T153 PolarHBondContact N-O 3.46Å; I141-T153 PolarHBondContact O-N 2.86Å; I141-T153 VanDerWaalsContact O-N 3.12Å; I141-L155 HydrophobicContact CD1-CD1 4.31Å; I141-L155 HydrophobicContact CD1-CG 4.47Å
142	L	94.7	Very high	89.6	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	136.2	170.8	-64.2	178	0	0	0	110	I126 A127 I150 F151 E152 M175 V185 V187 V207 F285 F289	I126-L142 CarbonylContact C-O 3.5Å; I126-L142 WeakPolarHBondContact CA-O 3.47Å; A127-L142 HydrophobicContact CB-CB 4.19Å; A127-L142 PolarHBondContact N-O 3.01Å; A127-L142 PolarHBondContact O-N 2.84Å; L142-I150 HydrophobicContact CB-CG2 4.15Å; L142-I150 HydrophobicContact CD2-CG2 4.23Å; L142-F151 CarbonylContact C-O 3.53Å; L142-F151 VanDerWaalsContact CA-O 3.29Å; L142-F151 WeakPolarHBondContact CA-O 3.18Å; L142-E152 HydrophobicContact CD2-CB 3.91Å; L142-E152 HydrophobicContact CD2-CG 4.17Å; L142-M175 HydrophobicContact CD2-CG 4.28Å; L142-V185 HydrophobicContact CB-CG1 4.21Å; L142-V185 HydrophobicContact CD1-CG1 4.35Å; L142-V187 HydrophobicContact CD1-CG2 3.74Å; L142-V187 HydrophobicContact CG-CG2 4.43Å; L142-V207 HydrophobicContact CD1-CG1 4.05Å; L142-V207 HydrophobicContact CD1-CG2 4.22Å; L142-F285 HydrophobicContact CD1-CD1 4.32Å; L142-F285 HydrophobicContact CD1-CD2 4.28Å; L142-F285 HydrophobicContact CD1-CE1 4.32Å; L142-F285 HydrophobicContact CD1-CE2 4.28Å; L142-F285 HydrophobicContact CD1-CG 4.27Å; L142-F285 HydrophobicContact CD1-CZ 4.27Å; L142-F285 HydrophobicContact CD2-CB 4.39Å; L142-F285 HydrophobicContact CD2-CD2 3.53Å; L142-F285 HydrophobicContact CD2-CE2 3.87Å; L142-F285 HydrophobicContact CD2-CG 4.05Å; L142-F285 HydrophobicContact CG-CD2 3.93Å; L142-F285 HydrophobicContact CG-CE2 3.79Å; L142-F285 HydrophobicContact CG-CG 4.4Å; L142-F285 HydrophobicContact CG-CZ 4.16Å; L142-F289 HydrophobicContact CD1-CE2 3.99Å; L142-F289 HydrophobicContact CD1-CZ 4.11Å
143	I	96.2	Very high	90.1	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.5	-179.6	-59.7	178.2	0	0	0	108.6	F123 I126 I141 I150 F151 T153 W172	F123-I143 HydrophobicContact CB-CG2 4.16Å; F123-I143 HydrophobicContact CD1-CG2 3.54Å; F123-I143 HydrophobicContact CD2-CG2 3.9Å; F123-I143 HydrophobicContact CE1-CG2 3.78Å; F123-I143 HydrophobicContact CE2-CD1 4.1Å; F123-I143 HydrophobicContact CE2-CG2 4.11Å; F123-I143 HydrophobicContact CG-CG2 3.61Å; F123-I143 HydrophobicContact CZ-CD1 4.27Å; F123-I143 HydrophobicContact CZ-CG2 4.04Å; I126-I143 HydrophobicContact CD1-CG1 4.31Å; I126-I143 HydrophobicContact CG1-CG1 4.14Å; I126-I143 HydrophobicContact CG1-CG2 4.33Å; I126-I143 HydrophobicContact CG2-CG1 4.45Å; I141-I143 HydrophobicContact CD1-CD1 4.18Å; I141-I143 HydrophobicContact CD1-CG1 4.32Å; I143-I150 CarbonylContact O-C 3.56Å; I143-I150 VanDerWaalsContact O-CA 3.31Å; I143-I150 WeakPolarHBondContact O-CA 3.36Å; I143-F151 PolarHBondContact N-O 3.18Å; I143-F151 PolarHBondContact O-N 2.91Å; I143-T153 HydrophobicContact CD1-CG2 3.6Å; I143-T153 HydrophobicContact CG1-CG2 4.33Å; I143-W172 HydrophobicContact CB-CH2 4.5Å; I143-W172 HydrophobicContact CD1-CH2 3.86Å; I143-W172 HydrophobicContact CD1-CZ3 3.74Å; I143-W172 HydrophobicContact CG2-CH2 4.48Å
144	G	95.4	Very high	90.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	132.1	174.3	0	0	0	0	0	111.6	D124 S125 L149	D124-G144 PolarHBondContact N-O 3.16Å; S125-G144 PolarHBondContact N-O 2.87Å; S125-G144 PolarHBondContact O-N 3.25Å; G144-L149 CarbonylContact C-O 3.57Å; G144-L149 WeakPolarHBondContact CA-O 3.39Å
145	T	95.8	Very high	91	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	162.4	-179.5	72.9	0	0	0	0	113.3	H121 L122 F123 D147 G148 L149 F151 V182	H121-T145 HydrophobicContact CB-CG2 4.08Å; L122-T145 CarbonylContact O-C 3.6Å; L122-T145 WeakPolarHBondContact O-CA 3.41Å; L122-T145 WeakPolarHBondContact O-CB 3.49Å; F123-T145 HydrophobicContact CD1-CG2 4.26Å; T145-D147 PolarHBondContact O-N 3.44Å; T145-D147 PolarHBondContact OG1-N 3.09Å; T145-G148 PolarHBondContact O-N 2.92Å; T145-G148 VanDerWaalsContact O-N 3.11Å; T145-L149 HydrophobicContact CG2-CB 4.37Å; T145-L149 PolarHBondContact N-O 3.43Å; T145-L149 WeakPolarHBondContact OG1-CB 3.46Å; T145-L149 PolarHBondContact OG1-N 2.84Å; T145-L149 VanDerWaalsContact OG1-N 3.15Å; T145-L149 PolarHBondContact OG1-O 3.43Å; T145-F151 HydrophobicContact CG2-CD2 3.89Å; T145-F151 HydrophobicContact CG2-CE2 3.8Å; T145-V182 PolarHBondContact O-N 3.27Å
146	N	94	Very high	91	Very high	53 Å²	53	19.1 Å²	19.1	28%	0.283	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.3	172.8	74.8	-56	0	0	0	113.8	L122 D124 G148 S181	L122-N146 HydrophobicContact CB-CB 3.98Å; L122-N146 VanDerWaalsContact CB-OD1 3.3Å; L122-N146 WeakPolarHBondContact CB-OD1 3.4Å; L122-N146 HydrophobicContact CD2-CB 4.07Å; L122-N146 HydrophobicContact CG-CB 4.48Å; L122-N146 PolarHBondContact N-OD1 3.28Å; L122-N146 PolarHBondContact O-N 2.83Å; L122-N146 PolarHBondContact O-OD1 3.35Å; D124-N146 VanDerWaalsContact OD2-CA 3.27Å; D124-N146 WeakPolarHBondContact OD2-CA 3.27Å; N146-G148 VanDerWaalsContact C-N 3.29Å; N146-S181 WeakPolarHBondContact O-CA 3.28Å; N146-S181 VanDerWaalsContact O-CB 3.27Å; N146-S181 WeakPolarHBondContact O-CB 3.41Å; N146-S181 PolarHBondContact O-N 3.13Å
147	D	92.2	Very high	90.6	Very high	81 Å²	81	16.9 Å²	16.9	43%	0.433	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-2.6	179.2	-59.2	-29.1	0	0	0	112.8	T145	T145-D147 PolarHBondContact O-N 3.44Å; T145-D147 PolarHBondContact OG1-N 3.09Å
148	G	91.3	Very high	90	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	91.9	8.3	179.7	0	0	0	0	0	115.5	T145 N146 N177 L178 H180	T145-G148 PolarHBondContact O-N 2.92Å; T145-G148 VanDerWaalsContact O-N 3.11Å; N146-G148 VanDerWaalsContact C-N 3.29Å; G148-N177 CarbonylContact O-C 3.59Å; G148-N177 WeakPolarHBondContact O-CA 3.49Å; G148-L178 PolarHBondContact O-N 2.9Å; G148-H180 WeakPolarHBondContact CA-O 3.32Å
149	L	93.5	Very high	88.9	Confident	18 Å²	18	27.4 Å²	27.4	9%	0.094	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	140.6	178.5	-55.1	173.4	0	0	0	110.4	G144 T145 F151 Q174 N177	G144-L149 CarbonylContact C-O 3.57Å; G144-L149 WeakPolarHBondContact CA-O 3.39Å; T145-L149 HydrophobicContact CG2-CB 4.37Å; T145-L149 PolarHBondContact N-O 3.43Å; T145-L149 WeakPolarHBondContact OG1-CB 3.46Å; T145-L149 PolarHBondContact OG1-N 2.84Å; T145-L149 VanDerWaalsContact OG1-N 3.15Å; T145-L149 PolarHBondContact OG1-O 3.43Å; L149-F151 HydrophobicContact CB-CD2 4.15Å; L149-F151 HydrophobicContact CB-CE2 3.56Å; L149-F151 HydrophobicContact CB-CZ 4.06Å; L149-F151 HydrophobicContact CD1-CE2 3.83Å; L149-F151 HydrophobicContact CD1-CZ 3.72Å; L149-F151 HydrophobicContact CG-CE2 4.33Å; L149-F151 HydrophobicContact CG-CZ 4.49Å; L149-Q174 HydrophobicContact CD2-CG 4.45Å; L149-N177 HydrophobicContact CD2-CB 3.62Å; L149-N177 VanDerWaalsContact CD2-CG 3.45Å; L149-N177 WeakPolarHBondContact CD2-ND2 3.5Å
150	I	94	Very high	87.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.2	166.7	-54.6	179.4	0	0	0	108.2	L142 I143 M175 I176 L178 V182 T209 F289	L142-I150 HydrophobicContact CB-CG2 4.15Å; L142-I150 HydrophobicContact CD2-CG2 4.23Å; I143-I150 CarbonylContact O-C 3.56Å; I143-I150 VanDerWaalsContact O-CA 3.31Å; I143-I150 WeakPolarHBondContact O-CA 3.36Å; I150-M175 WeakPolarHBondContact O-CB 3.44Å; I150-M175 PolarHBondContact O-N 3.23Å; I150-I176 HydrophobicContact CB-CG2 3.93Å; I150-I176 HydrophobicContact CD1-CG2 3.6Å; I150-I176 HydrophobicContact CG1-CG2 3.89Å; I150-I176 PolarHBondContact N-O 3.47Å; I150-L178 HydrophobicContact CD1-CD1 4.17Å; I150-V182 HydrophobicContact CG1-CG1 4.5Å; I150-V182 HydrophobicContact CG1-CG2 4.21Å; I150-T209 HydrophobicContact CD1-CG2 3.86Å; I150-F289 HydrophobicContact CD1-CE1 4.22Å; I150-F289 HydrophobicContact CD1-CZ 4.38Å
151	F	93.2	Very high	86	Confident	8 Å²	8	32.5 Å²	32.5	4%	0.035	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.9	176.6	-67	-82.6	0	0	0	111.4	H121 L142 I143 T145 L149 W172 I173 Q174	H121-F151 AromaticContact NE2-CZ 3.76Å; L142-F151 CarbonylContact C-O 3.53Å; L142-F151 VanDerWaalsContact CA-O 3.29Å; L142-F151 WeakPolarHBondContact CA-O 3.18Å; I143-F151 PolarHBondContact N-O 3.18Å; I143-F151 PolarHBondContact O-N 2.91Å; T145-F151 HydrophobicContact CG2-CD2 3.89Å; T145-F151 HydrophobicContact CG2-CE2 3.8Å; L149-F151 HydrophobicContact CB-CD2 4.15Å; L149-F151 HydrophobicContact CB-CE2 3.56Å; L149-F151 HydrophobicContact CB-CZ 4.06Å; L149-F151 HydrophobicContact CD1-CE2 3.83Å; L149-F151 HydrophobicContact CD1-CZ 3.72Å; L149-F151 HydrophobicContact CG-CE2 4.33Å; L149-F151 HydrophobicContact CG-CZ 4.49Å; F151-W172 HydrophobicContact CB-CD2 4.42Å; F151-W172 HydrophobicContact CB-CH2 4.09Å; F151-W172 HydrophobicContact CB-CZ2 3.71Å; F151-W172 AromaticContact CD1-CD1 3.7Å; F151-W172 HydrophobicContact CD1-CD2 4.42Å; F151-W172 AromaticContact CD1-CE2 3.59Å; F151-W172 HydrophobicContact CD1-CG 4.47Å; F151-W172 AromaticContact CD1-CZ2 4Å; F151-W172 HydrophobicContact CD1-CZ2 4Å; F151-W172 AromaticContact CD1-NE1 3.1Å; F151-W172 AromaticContact CD2-CE2 4Å; F151-W172 HydrophobicContact CD2-CH2 4.39Å; F151-W172 AromaticContact CD2-CZ2 3.51Å; F151-W172 HydrophobicContact CD2-CZ2 3.51Å; F151-W172 AromaticContact CE1-CD1 3.87Å; F151-W172 HydrophobicContact CE1-CZ2 4.48Å; F151-W172 AromaticContact CE1-NE1 3.2Å; F151-W172 HydrophobicContact CE2-CZ2 4.04Å; F151-W172 HydrophobicContact CG-CD2 4.48Å; F151-W172 AromaticContact CG-CE2 3.55Å; F151-W172 HydrophobicContact CG-CH2 4.32Å; F151-W172 AromaticContact CG-CZ2 3.47Å; F151-W172 HydrophobicContact CG-CZ2 3.47Å; F151-W172 VanDerWaalsContact CG-CZ2 3.47Å; F151-W172 AromaticContact CG-NE1 3.57Å; F151-W172 HydrophobicContact CZ-CZ2 4.49Å; F151-W172 AromaticContact CZ-NE1 3.74Å; F151-I173 CarbonylContact C-O 3.6Å; F151-I173 WeakPolarHBondContact CA-O 3.41Å; F151-Q174 HydrophobicContact CD1-CB 3.82Å; F151-Q174 HydrophobicContact CD1-CG 4.25Å; F151-Q174 HydrophobicContact CE1-CB 3.6Å; F151-Q174 HydrophobicContact CE1-CG 3.88Å; F151-Q174 HydrophobicContact CZ-CG 4.36Å
152	E	92.8	Very high	83.7	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	132.5	166.3	-170.2	-168.9	138.5	0	0	109.9	I141 L142 Y171 I173 M175 G283 L284 F285	I141-E152 WeakPolarHBondContact O-CA 3.38Å; L142-E152 HydrophobicContact CD2-CB 3.91Å; L142-E152 HydrophobicContact CD2-CG 4.17Å; E152-Y171 HydrophobicContact CB-CE2 4.26Å; E152-Y171 HydrophobicContact CG-CE2 3.79Å; E152-Y171 WeakPolarHBondContact OE1-CE2 3.4Å; E152-Y171 PolarHBondContact OE1-OH 3.49Å; E152-I173 PolarHBondContact N-O 3.12Å; E152-I173 PolarHBondContact O-N 3.42Å; E152-M175 HydrophobicContact CB-CG 3.9Å; E152-M175 HydrophobicContact CB-SD 3.74Å; E152-G283 WeakPolarHBondContact OE1-CA 3.28Å; E152-G283 VanDerWaalsContact OE2-C 3.24Å; E152-G283 VanDerWaalsContact OE2-CA 3.27Å; E152-G283 WeakPolarHBondContact OE2-CA 3.32Å; E152-L284 VanDerWaalsContact CD-N 3.3Å; E152-L284 PolarHBondContact OE1-N 3.38Å; E152-L284 PolarHBondContact OE2-N 2.99Å; E152-F285 HydrophobicContact CG-CD2 3.84Å; E152-F285 HydrophobicContact CG-CE2 4.39Å; E152-F285 PolarHBondContact OE2-N 2.75Å
153	T	90.7	Very high	81.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	166.1	176.6	-167.5	0	0	0	0	112	E140 I141 I143 L155 Y171 W172	E140-T153 WeakPolarHBondContact CA-O 3.27Å; I141-T153 HydrophobicContact CD1-CG2 3.95Å; I141-T153 HydrophobicContact CG1-CG2 3.67Å; I141-T153 WeakPolarHBondContact CG1-O 3.17Å; I141-T153 PolarHBondContact N-O 3.46Å; I141-T153 PolarHBondContact O-N 2.86Å; I141-T153 VanDerWaalsContact O-N 3.12Å; I143-T153 HydrophobicContact CD1-CG2 3.6Å; I143-T153 HydrophobicContact CG1-CG2 4.33Å; T153-L155 HydrophobicContact CG2-CD2 4.47Å; T153-Y171 WeakPolarHBondContact CB-O 3.46Å; T153-Y171 PolarHBondContact OG1-O 3.13Å; T153-W172 HydrophobicContact CG2-CE3 4.11Å; T153-W172 HydrophobicContact CG2-CZ3 3.88Å
154	M	88.9	Confident	78.7	Confident	31 Å²	31	55 Å²	55	15%	0.153	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	126.4	168.6	175.2	171.8	70.3	0	0	108.7	M156 Q170 Y171	M154-M156 HydrophobicContact CE-CG 4.47Å; M154-M156 HydrophobicContact CE-SD 3.86Å; M154-M156 HydrophobicContact CG-CG 4.17Å; M154-M156 HydrophobicContact SD-CG 4.48Å; M154-M156 HydrophobicContact SD-SD 4.35Å; M154-Q170 HydrophobicContact CB-CB 4.4Å; M154-Q170 HydrophobicContact CE-CB 3.91Å; M154-Q170 HydrophobicContact CE-CG 3.74Å; M154-Q170 HydrophobicContact CG-CG 4.39Å; M154-Q170 PolarHBondContact O-N 3.15Å; M154-Y171 HydrophobicContact CB-CD1 4.32Å; M154-Y171 HydrophobicContact CB-CE1 3.68Å
155	L	89.3	Confident	76.4	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.1	179.3	-54.8	179.4	0	0	0	109.3	V94 Y104 L115 S137 T138 I141 T153 I168 E169	V94-L155 HydrophobicContact CG2-CD1 3.92Å; Y104-L155 HydrophobicContact CD2-CB 4.36Å; Y104-L155 HydrophobicContact CD2-CD1 3.52Å; Y104-L155 HydrophobicContact CE2-CB 4.09Å; Y104-L155 HydrophobicContact CE2-CD1 3.94Å; Y104-L155 HydrophobicContact CG-CD1 4.14Å; L115-L155 HydrophobicContact CD2-CD2 3.97Å; S137-L155 WeakPolarHBondContact CA-O 3.35Å; T138-L155 HydrophobicContact CG2-CB 3.86Å; T138-L155 HydrophobicContact CG2-CD1 4.43Å; T138-L155 HydrophobicContact CG2-CG 4.47Å; T138-L155 PolarHBondContact N-O 3.36Å; T138-L155 PolarHBondContact OG1-N 3.41Å; T138-L155 PolarHBondContact OG1-O 3.06Å; I141-L155 HydrophobicContact CD1-CD1 4.31Å; I141-L155 HydrophobicContact CD1-CG 4.47Å; T153-L155 HydrophobicContact CG2-CD2 4.47Å; L155-I168 HydrophobicContact CB-CG2 4.09Å; L155-I168 HydrophobicContact CD2-CG2 4.25Å; L155-E169 HydrophobicContact CD2-CG 4.09Å
156	M	84.9	Confident	74.5	Confident	48 Å²	48	63.3 Å²	63.3	24%	0.236	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.5	179.6	-68.5	-172.9	65.6	0	0	112.2	L136 M154 I168 Q170	L136-M156 WeakPolarHBondContact O-CA 3.48Å; M154-M156 HydrophobicContact CE-CG 4.47Å; M154-M156 HydrophobicContact CE-SD 3.86Å; M154-M156 HydrophobicContact CG-CG 4.17Å; M154-M156 HydrophobicContact SD-CG 4.48Å; M154-M156 HydrophobicContact SD-SD 4.35Å; M156-I168 PolarHBondContact N-O 3.21Å; M156-Q170 HydrophobicContact CB-CG 4.18Å; M156-Q170 HydrophobicContact CG-CG 3.82Å; M156-Q170 HydrophobicContact SD-CG 3.83Å
157	F	78.9	Confident	73.3	Confident	21 Å²	21	64.4 Å²	64.4	9%	0.092	35%	0.353	C	S	.	.			trans	-118.9	120.4	173.4	-179.6	-105.3	0	0	0	110.9	M109 L136 E159	M109-F157 HydrophobicContact CE-CD2 4.49Å; M109-F157 HydrophobicContact CG-CD2 3.91Å; M109-F157 HydrophobicContact CG-CE1 4.25Å; M109-F157 HydrophobicContact CG-CE2 3.62Å; M109-F157 HydrophobicContact CG-CG 4.35Å; M109-F157 HydrophobicContact CG-CZ 3.81Å; M109-F157 HydrophobicContact SD-CD2 3.63Å; M109-F157 HydrophobicContact SD-CE2 3.93Å; M109-F157 HydrophobicContact SD-CG 4.1Å; L136-F157 HydrophobicContact CD2-CD1 4.18Å; L136-F157 PolarHBondContact O-N 2.98Å; F157-E159 HydrophobicContact CD1-CG 4.34Å; F157-E159 HydrophobicContact CE1-CG 3.64Å; F157-E159 HydrophobicContact CZ-CG 4.39Å
158	N	71.7	Confident	72.8	Confident	97 Å²	97	61 Å²	61	52%	0.519	34%	0.335	S	S	.	.			trans	-110.9	119.9	172.6	-76.9	-5.7	0	0	0	110.1	D160 S161	N158-D160 PolarHBondContact O-N 3.18Å; N158-S161 PolarHBondContact O-N 3.07Å; N158-S161 PolarHBondContact O-OG 3.39Å
159	E	64.1	Low	72.4	Confident	133 Å²	133	61 Å²	61	62%	0.621	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-32	179	-71	-165.6	163.4	0	0	112.7	F157 S161	F157-E159 HydrophobicContact CD1-CG 4.34Å; F157-E159 HydrophobicContact CE1-CG 3.64Å; F157-E159 HydrophobicContact CZ-CG 4.39Å; E159-S161 PolarHBondContact O-N 2.83Å; E159-S161 VanDerWaalsContact O-N 3.16Å
160	D	56.6	Low	71.7	Confident	156 Å²	156	64.6 Å²	64.6	83%	0.834	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	1.5	-174.4	-63.4	-30	0	0	0	114.7	N158 F162	N158-D160 PolarHBondContact O-N 3.18Å; D160-F162 PolarHBondContact O-N 2.96Å
161	S	55.1	Low	71.2	Confident	35 Å²	35	66 Å²	66	25%	0.245	36%	0.357	C	S	.	.			trans	-80.3	50.2	-178.7	63.5	0	0	0	0	113.7	N158 E159 F163	N158-S161 PolarHBondContact O-N 3.07Å; N158-S161 PolarHBondContact O-OG 3.39Å; E159-S161 PolarHBondContact O-N 2.83Å; E159-S161 VanDerWaalsContact O-N 3.16Å; S161-F163 VanDerWaalsContact C-N 3.29Å; S161-F163 PolarHBondContact O-N 3.33Å
162	F	45.5	Very low	70.9	Confident	178 Å²	178	67.9 Å²	67.9	78%	0.781	36%	0.364	S	S	*	.	S	Bend	trans	-72.1	-19.5	172.3	-86.1	-88.1	0	0	0	113.4	D160	D160-F162 PolarHBondContact O-N 2.96Å
163	F	44.4	Very low	70.7	Confident	200 Å²	200	69.7 Å²	69.7	88%	0.877	37%	0.373	S	S	*	.	S	Bend	trans	-130.9	13.7	-171.5	-68.3	-76	0	0	0	115.8	S161	S161-F163 VanDerWaalsContact C-N 3.29Å; S161-F163 PolarHBondContact O-N 3.33Å
164	S	40	Very low	70.7	Confident	94 Å²	94	74.9 Å²	74.9	66%	0.657	40%	0.398	S	S	*	.	S	Bend	trans	-143.6	134.6	177.5	-63.5	0	0	0	0	110.3	G166	S164-G166 PolarHBondContact O-N 2.95Å
165	S	47.1	Very low	70.6	Confident	130 Å²	130	74.6 Å²	74.6	91%	0.909	40%	0.396	S	S	*	.			trans	-64.6	61.7	172.3	-72.2	0	0	0	0	111	T167	S165-T167 PolarHBondContact O-N 3.39Å
166	G	55.7	Low	70.6	Confident	45 Å²	45	75.2 Å²	75.2	46%	0.464	40%	0.399	S	S	.	.			trans	-65.7	102.3	172.3	0	0	0	0	0	108	S164 I168	S164-G166 PolarHBondContact O-N 2.95Å; G166-I168 PolarHBondContact O-N 3.24Å
167	T	70.6	Confident	70.9	Confident	76 Å²	76	77.2 Å²	77.2	47%	0.466	41%	0.411	S	S	.	.			trans	-57.3	131.7	167.6	44.7	0	0	0	0	108.5	S165 E169	S165-T167 PolarHBondContact O-N 3.39Å; T167-E169 PolarHBondContact O-N 3.03Å
168	I	81.5	Confident	71.4	Confident	9 Å²	9	77 Å²	77	5%	0.046	41%	0.411	C	S	.	.	S	Bend	trans	-66.8	-35.2	-178.6	-61.2	167.6	0	0	0	109.2	Y104 R113 L115 L155 M156 G166 Q170	Y104-I168 HydrophobicContact CD1-CD1 4.22Å; Y104-I168 HydrophobicContact CD1-CG2 3.71Å; Y104-I168 HydrophobicContact CE1-CG2 4.01Å; Y104-I168 HydrophobicContact CG-CG2 4.27Å; R113-I168 HydrophobicContact CB-CD1 3.3Å; R113-I168 HydrophobicContact CG-CD1 4.05Å; L115-I168 HydrophobicContact CD2-CB 4.34Å; L115-I168 HydrophobicContact CD2-CG2 4.29Å; L155-I168 HydrophobicContact CB-CG2 4.09Å; L155-I168 HydrophobicContact CD2-CG2 4.25Å; M156-I168 PolarHBondContact N-O 3.21Å; G166-I168 PolarHBondContact O-N 3.24Å; I168-Q170 PolarHBondContact O-N 3.28Å
169	E	81.6	Confident	72.2	Confident	2 Å²	2	74.8 Å²	74.8	1%	0.009	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	109.2	177.6	-44.4	96.4	132.8	0	0	110.3	L115 N116 K117 L155 T167	L115-E169 VanDerWaalsContact CA-OE1 3.22Å; L115-E169 WeakPolarHBondContact CA-OE1 3.27Å; L115-E169 HydrophobicContact CD2-CG 3.92Å; N116-E169 PolarHBondContact N-OE1 3.08Å; K117-E169 HydrophobicContact CD-CB 4.18Å; K117-E169 PolarHBondContact N-OE1 3.3Å; K117-E169 VanDerWaalsContact N-OE1 3.16Å; L155-E169 HydrophobicContact CD2-CG 4.09Å; T167-E169 PolarHBondContact O-N 3.03Å
170	Q	79.8	Confident	73.5	Confident	92 Å²	92	73.3 Å²	73.3	43%	0.43	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	-44.1	176	-61.8	-58.3	-51.5	0	0	110.8	M154 M156 I168	M154-Q170 HydrophobicContact CB-CB 4.4Å; M154-Q170 HydrophobicContact CE-CB 3.91Å; M154-Q170 HydrophobicContact CE-CG 3.74Å; M154-Q170 HydrophobicContact CG-CG 4.39Å; M154-Q170 PolarHBondContact O-N 3.15Å; M156-Q170 HydrophobicContact CB-CG 4.18Å; M156-Q170 HydrophobicContact CG-CG 3.82Å; M156-Q170 HydrophobicContact SD-CG 3.83Å; I168-Q170 PolarHBondContact O-N 3.28Å
171	Y	83.6	Confident	75.2	Confident	30 Å²	30	67 Å²	67	12%	0.118	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	166.2	173.7	64.9	-89.7	0	0	0	110.6	E140 E152 T153 M154 I173	E140-Y171 VanDerWaalsContact CG-OH 3.27Å; E140-Y171 WeakPolarHBondContact CG-OH 3.49Å; E152-Y171 HydrophobicContact CB-CE2 4.26Å; E152-Y171 HydrophobicContact CG-CE2 3.79Å; E152-Y171 WeakPolarHBondContact OE1-CE2 3.4Å; E152-Y171 PolarHBondContact OE1-OH 3.49Å; T153-Y171 WeakPolarHBondContact CB-O 3.46Å; T153-Y171 PolarHBondContact OG1-O 3.13Å; M154-Y171 HydrophobicContact CB-CD1 4.32Å; M154-Y171 HydrophobicContact CB-CE1 3.68Å; Y171-I173 HydrophobicContact CD2-CB 4.47Å; Y171-I173 HydrophobicContact CD2-CD1 3.49Å; Y171-I173 VanDerWaalsContact CD2-CD1 3.49Å; Y171-I173 HydrophobicContact CD2-CG1 3.76Å; Y171-I173 HydrophobicContact CE2-CD1 3.82Å; Y171-I173 HydrophobicContact CE2-CG1 4.37Å; Y171-I173 HydrophobicContact CG-CD1 4.36Å
172	W	86.5	Confident	77.1	Confident	47 Å²	47	65.3 Å²	65.3	18%	0.178	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	104.5	178.2	-173.7	-92.5	0	0	0	108.2	K117 T118 F123 I143 F151 T153	K117-W172 HydrophobicContact CD-CB 4.29Å; T118-W172 HydrophobicContact CG2-CD2 3.92Å; T118-W172 HydrophobicContact CG2-CE3 3.52Å; T118-W172 HydrophobicContact CG2-CH2 3.32Å; T118-W172 HydrophobicContact CG2-CZ2 3.68Å; T118-W172 HydrophobicContact CG2-CZ3 3.2Å; F123-W172 AromaticContact CE1-CH2 3.77Å; F123-W172 HydrophobicContact CE1-CH2 3.77Å; F123-W172 HydrophobicContact CE1-CZ2 4.23Å; F123-W172 AromaticContact CZ-CH2 3.49Å; F123-W172 HydrophobicContact CZ-CH2 3.49Å; F123-W172 VanDerWaalsContact CZ-CH2 3.49Å; F123-W172 HydrophobicContact CZ-CZ2 4.31Å; F123-W172 HydrophobicContact CZ-CZ3 4.22Å; I143-W172 HydrophobicContact CB-CH2 4.5Å; I143-W172 HydrophobicContact CD1-CH2 3.86Å; I143-W172 HydrophobicContact CD1-CZ3 3.74Å; I143-W172 HydrophobicContact CG2-CH2 4.48Å; F151-W172 HydrophobicContact CB-CD2 4.42Å; F151-W172 HydrophobicContact CB-CH2 4.09Å; F151-W172 HydrophobicContact CB-CZ2 3.71Å; F151-W172 AromaticContact CD1-CD1 3.7Å; F151-W172 HydrophobicContact CD1-CD2 4.42Å; F151-W172 AromaticContact CD1-CE2 3.59Å; F151-W172 HydrophobicContact CD1-CG 4.47Å; F151-W172 AromaticContact CD1-CZ2 4Å; F151-W172 HydrophobicContact CD1-CZ2 4Å; F151-W172 AromaticContact CD1-NE1 3.1Å; F151-W172 AromaticContact CD2-CE2 4Å; F151-W172 HydrophobicContact CD2-CH2 4.39Å; F151-W172 AromaticContact CD2-CZ2 3.51Å; F151-W172 HydrophobicContact CD2-CZ2 3.51Å; F151-W172 AromaticContact CE1-CD1 3.87Å; F151-W172 HydrophobicContact CE1-CZ2 4.48Å; F151-W172 AromaticContact CE1-NE1 3.2Å; F151-W172 HydrophobicContact CE2-CZ2 4.04Å; F151-W172 HydrophobicContact CG-CD2 4.48Å; F151-W172 AromaticContact CG-CE2 3.55Å; F151-W172 HydrophobicContact CG-CH2 4.32Å; F151-W172 AromaticContact CG-CZ2 3.47Å; F151-W172 HydrophobicContact CG-CZ2 3.47Å; F151-W172 VanDerWaalsContact CG-CZ2 3.47Å; F151-W172 AromaticContact CG-NE1 3.57Å; F151-W172 HydrophobicContact CZ-CZ2 4.49Å; F151-W172 AromaticContact CZ-NE1 3.74Å; T153-W172 HydrophobicContact CG2-CE3 4.11Å; T153-W172 HydrophobicContact CG2-CZ3 3.88Å
173	I	88.2	Confident	79.5	Confident	39 Å²	39	57.9 Å²	57.9	20%	0.2	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.3	-172	-62.9	165.3	0	0	0	109.1	F151 E152 Y171 M175 I281	F151-I173 CarbonylContact C-O 3.6Å; F151-I173 WeakPolarHBondContact CA-O 3.41Å; E152-I173 PolarHBondContact N-O 3.12Å; E152-I173 PolarHBondContact O-N 3.42Å; Y171-I173 HydrophobicContact CD2-CB 4.47Å; Y171-I173 HydrophobicContact CD2-CD1 3.49Å; Y171-I173 VanDerWaalsContact CD2-CD1 3.49Å; Y171-I173 HydrophobicContact CD2-CG1 3.76Å; Y171-I173 HydrophobicContact CE2-CD1 3.82Å; Y171-I173 HydrophobicContact CE2-CG1 4.37Å; Y171-I173 HydrophobicContact CG-CD1 4.36Å; I173-M175 HydrophobicContact CB-SD 4.42Å; I173-M175 HydrophobicContact CG2-SD 3.77Å; I173-I281 HydrophobicContact CD1-CG2 4.26Å; I173-I281 WeakPolarHBondContact CD1-O 3.39Å
174	Q	90.2	Very high	81.8	Confident	109 Å²	109	48.7 Å²	48.7	51%	0.509	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	125.9	173.3	-169.6	-177.5	-52.7	0	0	109.9	L149 F151	L149-Q174 HydrophobicContact CD2-CG 4.45Å; F151-Q174 HydrophobicContact CD1-CB 3.82Å; F151-Q174 HydrophobicContact CD1-CG 4.25Å; F151-Q174 HydrophobicContact CE1-CB 3.6Å; F151-Q174 HydrophobicContact CE1-CG 3.88Å; F151-Q174 HydrophobicContact CZ-CG 4.36Å
175	M	87.6	Confident	84.4	Confident	24 Å²	24	44.3 Å²	44.3	12%	0.118	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-50.1	-177	-56.8	-50.3	-60	0	0	112.5	L142 I150 E152 I173 F285 S286 F289	L142-M175 HydrophobicContact CD2-CG 4.28Å; I150-M175 WeakPolarHBondContact O-CB 3.44Å; I150-M175 PolarHBondContact O-N 3.23Å; E152-M175 HydrophobicContact CB-CG 3.9Å; E152-M175 HydrophobicContact CB-SD 3.74Å; I173-M175 HydrophobicContact CB-SD 4.42Å; I173-M175 HydrophobicContact CG2-SD 3.77Å; M175-F285 HydrophobicContact CE-CB 3.97Å; M175-F285 WeakPolarHBondContact CE-O 3.32Å; M175-S286 VanDerWaalsContact CE-N 3.32Å; M175-F289 HydrophobicContact CB-CB 4.34Å; M175-F289 HydrophobicContact CB-CD2 3.74Å; M175-F289 HydrophobicContact CB-CE2 4.16Å; M175-F289 HydrophobicContact CB-CG 4.04Å; M175-F289 HydrophobicContact CE-CB 4.39Å; M175-F289 HydrophobicContact CE-CD2 3.88Å; M175-F289 HydrophobicContact CG-CD2 4.22Å; M175-F289 HydrophobicContact CG-CE2 4.45Å
176	I	89.9	Confident	86.6	Confident	15 Å²	15	40.2 Å²	40.2	8%	0.077	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	158.1	-177	-167.5	164	0	0	0	110.8	I150 L178 F218 F289 L295 P296	I150-I176 HydrophobicContact CB-CG2 3.93Å; I150-I176 HydrophobicContact CD1-CG2 3.6Å; I150-I176 HydrophobicContact CG1-CG2 3.89Å; I150-I176 PolarHBondContact N-O 3.47Å; I176-L178 HydrophobicContact CD1-CD2 4.11Å; I176-L178 HydrophobicContact CG1-CD2 4.25Å; I176-L178 HydrophobicContact CG2-CD2 4.41Å; I176-F218 HydrophobicContact CD1-CE1 4.11Å; I176-F218 HydrophobicContact CD1-CZ 4.15Å; I176-F289 HydrophobicContact CB-CD1 4.02Å; I176-F289 HydrophobicContact CD1-CD1 4.23Å; I176-F289 HydrophobicContact CG2-CD1 3.66Å; I176-F289 HydrophobicContact CG2-CE1 3.77Å; I176-F289 HydrophobicContact CG2-CG 4.46Å; I176-L295 HydrophobicContact CD1-CD2 4.39Å; I176-P296 HydrophobicContact CD1-CG 4.42Å
177	N	91.1	Very high	88.3	Confident	89 Å²	89	38.8 Å²	38.8	48%	0.476	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	114.5	170.8	-174.3	-9.5	0	0	0	110.2	G148 L149 G179	G148-N177 CarbonylContact O-C 3.59Å; G148-N177 WeakPolarHBondContact O-CA 3.49Å; L149-N177 HydrophobicContact CD2-CB 3.62Å; L149-N177 VanDerWaalsContact CD2-CG 3.45Å; L149-N177 WeakPolarHBondContact CD2-ND2 3.5Å; N177-G179 WeakPolarHBondContact OD1-CA 3.17Å; N177-G179 PolarHBondContact OD1-N 3.22Å
178	L	89.5	Confident	89.1	Confident	17 Å²	17	35.4 Å²	35.4	9%	0.089	19%	0.188	C	C	.	.			trans	-88.9	-8.3	179.6	-57.5	-179.4	0	0	0	113.5	G148 I150 I176 H180 V182 T209 T211 Y216 F218 L295	G148-L178 PolarHBondContact O-N 2.9Å; I150-L178 HydrophobicContact CD1-CD1 4.17Å; I176-L178 HydrophobicContact CD1-CD2 4.11Å; I176-L178 HydrophobicContact CG1-CD2 4.25Å; I176-L178 HydrophobicContact CG2-CD2 4.41Å; L178-H180 PolarHBondContact O-N 3.27Å; L178-V182 HydrophobicContact CD1-CG2 4.37Å; L178-T209 HydrophobicContact CD1-CG2 3.38Å; L178-T211 HydrophobicContact CB-CG2 4.42Å; L178-T211 HydrophobicContact CD1-CG2 4.4Å; L178-Y216 HydrophobicContact CB-CE2 4.48Å; L178-Y216 HydrophobicContact CD1-CD2 3.86Å; L178-Y216 HydrophobicContact CD1-CE2 3.97Å; L178-Y216 HydrophobicContact CD1-CG 4.47Å; L178-Y216 HydrophobicContact CD2-CD1 4.35Å; L178-Y216 HydrophobicContact CD2-CD2 4.43Å; L178-Y216 HydrophobicContact CD2-CE1 4.33Å; L178-Y216 HydrophobicContact CD2-CE2 4.38Å; L178-Y216 HydrophobicContact CD2-CG 4.42Å; L178-F218 HydrophobicContact CD2-CZ 3.9Å; L178-L295 HydrophobicContact CD2-CD2 4.29Å
179	G	87.8	Confident	89.1	Confident	50 Å²	50	36 Å²	36	52%	0.515	19%	0.189	S	C	.	.	S	Bend	trans	74.9	-1.4	176.7	0	0	0	0	0	116	N177	N177-G179 WeakPolarHBondContact OD1-CA 3.17Å; N177-G179 PolarHBondContact OD1-N 3.22Å
180	H	90.8	Very high	88.8	Confident	102 Å²	102	38.2 Å²	38.2	47%	0.472	20%	0.199	S	C	.	.	S	Bend	trans	-140.7	149.3	177.1	-62.8	-72	0	0	0	109.8	G148 L178 V182 T211	G148-H180 WeakPolarHBondContact CA-O 3.32Å; L178-H180 PolarHBondContact O-N 3.27Å; H180-V182 PolarHBondContact O-N 3.39Å; H180-T211 HydrophobicContact CB-CG2 3.94Å
181	S	93.7	Very high	88.3	Confident	24 Å²	24	35.7 Å²	35.7	17%	0.168	19%	0.191	C	C	.	.			trans	-39.7	125.5	176.9	154.3	0	0	0	0	112.8	D124 N146 T183 T211 P212	D124-S181 WeakPolarHBondContact OD2-CB 3.28Å; D124-S181 PolarHBondContact OD2-OG 3.19Å; N146-S181 WeakPolarHBondContact O-CA 3.28Å; N146-S181 VanDerWaalsContact O-CB 3.27Å; N146-S181 WeakPolarHBondContact O-CB 3.41Å; N146-S181 PolarHBondContact O-N 3.13Å; S181-T183 PolarHBondContact O-N 3.16Å; S181-T183 VanDerWaalsContact O-N 3.16Å; S181-T211 WeakPolarHBondContact O-CA 3.46Å; S181-P212 WeakPolarHBondContact O-CD 3.23Å
182	V	95.2	Very high	87.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.189	C	C	.	.			trans	-85.9	84.8	178.5	-167.9	0	0	0	0	109.2	D124 S125 T145 I150 L178 H180 G184 V185 T209 T210	D124-V182 VanDerWaalsContact CB-O 3.29Å; D124-V182 WeakPolarHBondContact CB-O 3.46Å; S125-V182 WeakPolarHBondContact CB-O 3.46Å; S125-V182 PolarHBondContact OG-O 3.28Å; T145-V182 PolarHBondContact O-N 3.27Å; I150-V182 HydrophobicContact CG1-CG1 4.5Å; I150-V182 HydrophobicContact CG1-CG2 4.21Å; L178-V182 HydrophobicContact CD1-CG2 4.37Å; H180-V182 PolarHBondContact O-N 3.39Å; V182-G184 VanDerWaalsContact C-N 3.26Å; V182-G184 PolarHBondContact O-N 2.81Å; V182-V185 HydrophobicContact CG1-CG2 3.34Å; V182-T209 HydrophobicContact CG1-CG2 3.35Å; V182-T210 CarbonylContact C-O 3.49Å
183	T	93.8	Very high	85.7	Confident	21 Å²	21	34 Å²	34	13%	0.129	20%	0.195	C	C	.	.			trans	-69.3	-15.1	-178.3	51	0	0	0	0	115.2	S181 T210 P212 S311	S181-T183 PolarHBondContact O-N 3.16Å; S181-T183 VanDerWaalsContact O-N 3.16Å; T183-T210 PolarHBondContact N-O 3.45Å; T183-T210 PolarHBondContact OG1-O 3.41Å; T183-T210 PolarHBondContact OG1-OG1 3.24Å; T183-P212 HydrophobicContact CG2-CG 3.85Å; T183-S311 WeakPolarHBondContact CB-OG 3.32Å; T183-S311 PolarHBondContact OG1-OG 2.8Å
184	G	93.9	Very high	83.4	Confident	7 Å²	7	34.3 Å²	34.3	7%	0.072	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	138.6	176.6	0	0	0	0	0	111.5	V182 T209 T210	V182-G184 VanDerWaalsContact C-N 3.26Å; V182-G184 PolarHBondContact O-N 2.81Å; G184-T209 CarbonylContact O-C 3.52Å; G184-T209 VanDerWaalsContact O-CA 3.29Å; G184-T209 WeakPolarHBondContact O-CA 3.19Å; G184-T210 WeakPolarHBondContact CA-OG1 3.39Å; G184-T210 PolarHBondContact N-O 3.47Å; G184-T210 PolarHBondContact N-OG1 2.95Å; G184-T210 PolarHBondContact O-N 3.5Å
185	V	95.1	Very high	81.1	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	128.9	170.5	-173.6	0	0	0	0	107.2	S125 A127 L142 V182 V207 F208 T209	S125-V185 WeakPolarHBondContact OG-CG2 3.33Å; A127-V185 HydrophobicContact CB-CB 4.09Å; A127-V185 HydrophobicContact CB-CG1 3.74Å; A127-V185 WeakPolarHBondContact CB-O 3.35Å; L142-V185 HydrophobicContact CB-CG1 4.21Å; L142-V185 HydrophobicContact CD1-CG1 4.35Å; V182-V185 HydrophobicContact CG1-CG2 3.34Å; V185-V207 HydrophobicContact CG1-CG1 3.78Å; V185-F208 CarbonylContact C-O 3.57Å; V185-F208 WeakPolarHBondContact CA-O 3.26Å; V185-T209 HydrophobicContact CG2-CG2 4.03Å
186	E	93.1	Very high	78.7	Confident	43 Å²	43	40 Å²	40	20%	0.201	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137	178.1	-72.5	-71	179.3	0	0	109.4	H130 V207 F208 L313 L315	H130-E186 IonicContact NE2-OE2 3.77Å; E186-V207 CarbonylContact O-C 3.59Å; E186-V207 WeakPolarHBondContact O-CA 3.38Å; E186-F208 HydrophobicContact CB-CB 4.43Å; E186-F208 PolarHBondContact N-O 3.27Å; E186-F208 PolarHBondContact O-N 2.98Å; E186-L313 HydrophobicContact CB-CD2 4.19Å; E186-L313 HydrophobicContact CG-CD2 3.85Å; E186-L313 HydrophobicContact CG-CG 4.36Å; E186-L315 HydrophobicContact CB-CD1 3.67Å; E186-L315 HydrophobicContact CB-CG 4.25Å; E186-L315 HydrophobicContact CG-CD1 3.96Å; E186-L315 HydrophobicContact CG-CG 4.06Å
187	V	90.5	Very high	76.7	Confident	15 Å²	15	40.8 Å²	40.8	9%	0.091	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.2	-174.6	176.6	0	0	0	0	109.7	A127 L142 R189 V207 F285	A127-V187 HydrophobicContact CB-CB 4.38Å; A127-V187 HydrophobicContact CB-CG2 3.61Å; L142-V187 HydrophobicContact CD1-CG2 3.74Å; L142-V187 HydrophobicContact CG-CG2 4.43Å; V187-R189 HydrophobicContact CG1-CG 3.9Å; V187-V207 HydrophobicContact CG2-CG1 4.15Å; V187-V207 HydrophobicContact CG2-CG2 4.13Å; V187-F285 HydrophobicContact CG1-CE1 3.83Å; V187-F285 HydrophobicContact CG1-CZ 4.13Å; V187-F285 HydrophobicContact CG2-CE1 4.41Å; V187-F285 HydrophobicContact CG2-CZ 4.42Å
188	I	88	Confident	74.1	Confident	5 Å²	5	42.5 Å²	42.5	3%	0.026	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.1	174.3	-54.8	175.9	0	0	0	108.2	C205 V206 F208 L315 L323 P324 I340 L345 L397	I188-C205 WeakPolarHBondContact O-CA 3.3Å; I188-V206 PolarHBondContact N-O 3.48Å; I188-V206 PolarHBondContact O-N 3Å; I188-F208 HydrophobicContact CD1-CD2 4.06Å; I188-F208 HydrophobicContact CD1-CE2 3.73Å; I188-L315 HydrophobicContact CD1-CD1 4.32Å; I188-L315 HydrophobicContact CG1-CD1 4.34Å; I188-L323 HydrophobicContact CG2-CD2 3.8Å; I188-P324 HydrophobicContact CD1-CG 3.64Å; I188-P324 HydrophobicContact CG1-CG 3.9Å; I188-I340 HydrophobicContact CD1-CD1 4.12Å; I188-I340 HydrophobicContact CD1-CG2 4.36Å; I188-L345 HydrophobicContact CG2-CD1 3.75Å; I188-L397 HydrophobicContact CD1-CD1 4.46Å
189	R	82	Confident	71.8	Confident	21 Å²	21	48.3 Å²	48.3	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	139.9	176.9	-56	-178.6	-172.3	-172.3	9.7	110.1	E140 V187 R204 I222	E140-R189 PolarHBondContact O-NH2 2.96Å; E140-R189 IonicContact OE2-NH1 3.66Å; V187-R189 HydrophobicContact CG1-CG 3.9Å; R189-R204 CarbonylContact C-O 3.6Å; R189-R204 VanDerWaalsContact CA-O 3.31Å; R189-R204 WeakPolarHBondContact CA-O 3.1Å; R189-I222 HydrophobicContact CG-CD1 3.94Å
190	F	75	Confident	69.7	Low	50 Å²	50	47.5 Å²	47.5	22%	0.219	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	135.6	173.8	-171.4	-93.4	0	0	0	112.2	R204 L323 L345	F190-R204 PolarHBondContact N-O 2.87Å; F190-R204 PolarHBondContact O-N 2.95Å; F190-L323 HydrophobicContact CD2-CD1 3.76Å; F190-L323 HydrophobicContact CD2-CD2 4.41Å; F190-L323 HydrophobicContact CD2-CG 4.4Å; F190-L323 HydrophobicContact CE2-CD1 4.24Å; F190-L345 HydrophobicContact CB-CB 3.9Å; F190-L345 HydrophobicContact CD1-CB 4.31Å; F190-L345 WeakPolarHBondContact CD1-O 3.46Å; F190-L345 HydrophobicContact CG-CB 4.01Å
191	P	68.5	Low	68.2	Low	39 Å²	39	47.2 Å²	47.2	25%	0.253	28%	0.282	S	S	.	.	S	Bend	cis	-57.5	141.4	-7.5	25.3	-33.1	0	0	0	110.5	G193 V197 Q203	P191-G193 PolarHBondContact O-N 3.23Å; P191-V197 HydrophobicContact CB-CG2 4.33Å; P191-V197 HydrophobicContact CG-CG2 4.09Å; P191-Q203 PolarHBondContact O-NE2 3.34Å
192	T	63.1	Low	66.7	Low	12 Å²	12	49.2 Å²	49.2	7%	0.074	30%	0.295	C	S	.	.			trans	-51	131.1	172.1	40	0	0	0	0	106.9	H131 S194 E322 L323	H131-T192 VanDerWaalsContact CE1-CB 3.44Å; H131-T192 WeakPolarHBondContact CE1-CB 2.99Å; T192-S194 PolarHBondContact O-N 2.96Å; T192-E322 HydrophobicContact CG2-CB 4Å; T192-E322 PolarHBondContact OG1-OE2 3.45Å; T192-L323 HydrophobicContact CG2-CD2 3.67Å; T192-L323 HydrophobicContact CG2-CG 4.18Å
193	G	51.9	Low	65.7	Low	29 Å²	29	50.4 Å²	50.4	30%	0.299	30%	0.3	S	S	.	.			trans	-64.4	79.8	-174.9	0	0	0	0	0	110.9	P191	P191-G193 PolarHBondContact O-N 3.23Å
194	S	41	Very low	64.9	Low	46 Å²	46	50.5 Å²	50.5	32%	0.322	30%	0.298	S	S	.	.			trans	-76.7	152.7	164.7	79	0	0	0	0	107.4	T192 N196 V197	T192-S194 PolarHBondContact O-N 2.96Å; S194-N196 PolarHBondContact O-N 3.31Å; S194-N196 WeakPolarHBondContact OG-CA 3.1Å; S194-N196 VanDerWaalsContact OG-CB 3.26Å; S194-N196 WeakPolarHBondContact OG-CB 3.2Å; S194-N196 PolarHBondContact OG-N 3.24Å; S194-V197 PolarHBondContact O-N 3.49Å; S194-V197 PolarHBondContact OG-N 3.46Å
195	P	40.9	Very low	64.4	Low	130 Å²	130	50.2 Å²	50.2	84%	0.844	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-8.5	166.3	24.4	-33.3	0	0	0	113
196	N	37.5	Very low	64	Low	122 Å²	122	50 Å²	50	65%	0.652	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-2.5	177.2	-50.5	-34.2	0	0	0	113.8	S194 L198	S194-N196 PolarHBondContact O-N 3.31Å; S194-N196 WeakPolarHBondContact OG-CA 3.1Å; S194-N196 VanDerWaalsContact OG-CB 3.26Å; S194-N196 WeakPolarHBondContact OG-CB 3.2Å; S194-N196 PolarHBondContact OG-N 3.24Å; N196-L198 PolarHBondContact O-N 3.15Å
197	V	47.6	Very low	63.9	Low	32 Å²	32	48 Å²	48	19%	0.194	28%	0.284	C	S	.	.	S	Bend	trans	-70.4	113.2	169.1	-178.9	0	0	0	0	107.2	P191 S194 V199 E201	P191-V197 HydrophobicContact CB-CG2 4.33Å; P191-V197 HydrophobicContact CG-CG2 4.09Å; S194-V197 PolarHBondContact O-N 3.49Å; S194-V197 PolarHBondContact OG-N 3.46Å; V197-V199 PolarHBondContact O-N 2.9Å; V197-E201 HydrophobicContact CG1-CB 4.33Å
198	L	37.7	Very low	64	Low	125 Å²	125	47.3 Å²	47.3	65%	0.654	28%	0.28	S	S	*	.			trans	-54.8	128.2	176.9	-71.9	168.6	0	0	0	108.8	N196 G200 E201	N196-L198 PolarHBondContact O-N 3.15Å; L198-G200 PolarHBondContact O-N 3.28Å; L198-E201 HydrophobicContact CB-CG 4.41Å; L198-E201 PolarHBondContact O-N 3.17Å; L198-E201 VanDerWaalsContact O-N 3.16Å
199	V	40	Very low	64.3	Low	139 Å²	139	47.1 Å²	47.1	84%	0.842	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	110.9	176	179.8	0	0	0	0	108.8	V197	V197-V199 PolarHBondContact O-N 2.9Å
200	G	45.1	Very low	64.9	Low	33 Å²	33	46.1 Å²	46.1	34%	0.34	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	116.1	-5.9	177.3	0	0	0	0	0	116.8	L198 N225	L198-G200 PolarHBondContact O-N 3.28Å; G200-N225 WeakPolarHBondContact CA-ND2 3.21Å
201	E	57.7	Low	65.8	Low	96 Å²	96	43.8 Å²	43.8	45%	0.449	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-73.1	136.5	174	-72.7	-167	166.3	0	0	112.4	V197 L198 Q203	V197-E201 HydrophobicContact CG1-CB 4.33Å; L198-E201 HydrophobicContact CB-CG 4.41Å; L198-E201 PolarHBondContact O-N 3.17Å; L198-E201 VanDerWaalsContact O-N 3.16Å; E201-Q203 PolarHBondContact O-N 2.95Å
202	P	63.6	Low	66.8	Low	66 Å²	66	42.8 Å²	42.8	43%	0.429	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	120.4	177.6	29.6	-34.7	0	0	0	110	W221 N223	P202-W221 HydrophobicContact CB-CE3 3.77Å; P202-W221 HydrophobicContact CB-CZ3 4.08Å; P202-W221 HydrophobicContact CG-CE3 4.38Å; P202-W221 HydrophobicContact CG-CZ3 4.2Å; P202-N223 WeakPolarHBondContact CA-OD1 3.27Å; P202-N223 VanDerWaalsContact CB-OD1 3.23Å; P202-N223 WeakPolarHBondContact CB-OD1 3.41Å
203	Q	72.7	Confident	68.1	Low	24 Å²	24	44.3 Å²	44.3	11%	0.112	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	144.8	175.2	-54.2	-178.9	-47.3	0	0	109.6	P191 E201 W221 I222	P191-Q203 PolarHBondContact O-NE2 3.34Å; E201-Q203 PolarHBondContact O-N 2.95Å; Q203-W221 CarbonylContact O-C 3.58Å; Q203-W221 WeakPolarHBondContact O-CA 3.42Å; Q203-I222 HydrophobicContact CB-CD1 4.12Å; Q203-I222 HydrophobicContact CB-CG1 3.67Å; Q203-I222 PolarHBondContact N-O 3.24Å; Q203-I222 PolarHBondContact O-N 2.9Å
204	R	77.7	Confident	70	Confident	24 Å²	24	46.6 Å²	46.6	9%	0.091	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	138.2	172.3	-60.2	174.7	-149.6	-161.1	10.7	108.7	R189 F190 W221 M347 F390	R189-R204 CarbonylContact C-O 3.6Å; R189-R204 VanDerWaalsContact CA-O 3.31Å; R189-R204 WeakPolarHBondContact CA-O 3.1Å; F190-R204 PolarHBondContact N-O 2.87Å; F190-R204 PolarHBondContact O-N 2.95Å; R204-W221 HydrophobicContact CG-CD2 4.31Å; R204-W221 HydrophobicContact CG-CE3 3.7Å; R204-W221 HydrophobicContact CG-CH2 3.8Å; R204-W221 HydrophobicContact CG-CZ2 4.37Å; R204-W221 HydrophobicContact CG-CZ3 3.43Å; R204-W221 VanDerWaalsContact CG-CZ3 3.43Å; R204-M347 PolarHBondContact NH1-O 3.45Å; R204-M347 PolarHBondContact NH2-O 3.38Å; R204-F390 HydrophobicContact CB-CD1 4.28Å; R204-F390 HydrophobicContact CB-CE1 3.98Å; R204-F390 HydrophobicContact CB-CZ 4.33Å; R204-F390 HydrophobicContact CG-CD1 4.39Å; R204-F390 HydrophobicContact CG-CE1 4.35Å; R204-F390 HydrophobicContact CG-CZ 4.46Å
205	C	83.2	Confident	72.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.3	-177.9	-178.3	0	0	0	0	109.6	I188 A219 G220 I222 F285 V288	I188-C205 WeakPolarHBondContact O-CA 3.3Å; C205-A219 WeakPolarHBondContact O-CA 3.43Å; C205-G220 PolarHBondContact N-O 2.93Å; C205-G220 PolarHBondContact O-N 3.32Å; C205-I222 HydrophobicContact CB-CD1 4.03Å; C205-I222 HydrophobicContact CB-CG1 4.2Å; C205-I222 HydrophobicContact CB-CG2 3.7Å; C205-F285 VanDerWaalsContact SG-CE1 3.59Å; C205-V288 HydrophobicContact CB-CG2 3.97Å
206	V	87.7	Confident	74.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.4	168.3	-177.1	0	0	0	0	109.1	I188 F208 Q217 F218 A219 L345 F390 V395 L397	I188-V206 PolarHBondContact N-O 3.48Å; I188-V206 PolarHBondContact O-N 3Å; V206-F208 HydrophobicContact CG1-CE2 4.4Å; V206-Q217 HydrophobicContact CG1-CG 3.55Å; V206-F218 CarbonylContact C-O 3.57Å; V206-F218 WeakPolarHBondContact CA-O 3.41Å; V206-F218 WeakPolarHBondContact CG1-O 3.28Å; V206-A219 HydrophobicContact CG2-CB 3.9Å; V206-L345 HydrophobicContact CG2-CD2 3.93Å; V206-F390 HydrophobicContact CG2-CE1 4.19Å; V206-V395 HydrophobicContact CG2-CG1 4.42Å; V206-L397 HydrophobicContact CB-CD1 3.66Å; V206-L397 HydrophobicContact CG1-CD1 3.57Å; V206-L397 HydrophobicContact CG1-CG 4.24Å; V206-L397 HydrophobicContact CG2-CD1 3.7Å; V206-L397 HydrophobicContact CG2-CG 4.25Å
207	V	90.5	Very high	77.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	117.6	178.9	-171.7	0	0	0	0	108.6	L142 V185 E186 V187 Q217 F218 V288 F289	L142-V207 HydrophobicContact CD1-CG1 4.05Å; L142-V207 HydrophobicContact CD1-CG2 4.22Å; V185-V207 HydrophobicContact CG1-CG1 3.78Å; E186-V207 CarbonylContact O-C 3.59Å; E186-V207 WeakPolarHBondContact O-CA 3.38Å; V187-V207 HydrophobicContact CG2-CG1 4.15Å; V187-V207 HydrophobicContact CG2-CG2 4.13Å; V207-Q217 WeakPolarHBondContact O-CA 3.19Å; V207-F218 HydrophobicContact CB-CB 4.36Å; V207-F218 HydrophobicContact CB-CD2 4.4Å; V207-F218 PolarHBondContact N-O 3.4Å; V207-F218 PolarHBondContact O-N 2.95Å; V207-V288 HydrophobicContact CG2-CG1 4.12Å; V207-F289 HydrophobicContact CB-CZ 4.27Å; V207-F289 HydrophobicContact CG1-CZ 4.09Å; V207-F289 HydrophobicContact CG2-CE2 4.47Å; V207-F289 HydrophobicContact CG2-CZ 4.2Å
208	F	93	Very high	79.4	Confident	1 Å²	1	31.6 Å²	31.6	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	132.2	167	-74.1	-74.6	0	0	0	109	V185 E186 I188 V206 M215 Y216 Q217 L313 L397 T398	V185-F208 CarbonylContact C-O 3.57Å; V185-F208 WeakPolarHBondContact CA-O 3.26Å; E186-F208 HydrophobicContact CB-CB 4.43Å; E186-F208 PolarHBondContact N-O 3.27Å; E186-F208 PolarHBondContact O-N 2.98Å; I188-F208 HydrophobicContact CD1-CD2 4.06Å; I188-F208 HydrophobicContact CD1-CE2 3.73Å; V206-F208 HydrophobicContact CG1-CE2 4.4Å; F208-M215 HydrophobicContact CD1-SD 4.29Å; F208-Y216 WeakPolarHBondContact CA-O 3.32Å; F208-Q217 HydrophobicContact CD1-CB 4.08Å; F208-Q217 HydrophobicContact CD1-CG 4.12Å; F208-Q217 HydrophobicContact CE1-CB 3.94Å; F208-Q217 HydrophobicContact CE1-CG 3.68Å; F208-Q217 HydrophobicContact CZ-CG 4.13Å; F208-L313 HydrophobicContact CB-CD2 4.03Å; F208-L397 HydrophobicContact CE2-CD1 4.25Å; F208-L397 HydrophobicContact CZ-CB 4.08Å; F208-L397 HydrophobicContact CZ-CD1 4.37Å; F208-T398 HydrophobicContact CE1-CG2 4.07Å; F208-T398 HydrophobicContact CZ-CG2 4.31Å
209	T	93.8	Very high	81.6	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	131.1	177.2	-56.2	0	0	0	0	110.4	I150 L178 V182 G184 V185 M215 Y216	I150-T209 HydrophobicContact CD1-CG2 3.86Å; L178-T209 HydrophobicContact CD1-CG2 3.38Å; V182-T209 HydrophobicContact CG1-CG2 3.35Å; G184-T209 CarbonylContact O-C 3.52Å; G184-T209 VanDerWaalsContact O-CA 3.29Å; G184-T209 WeakPolarHBondContact O-CA 3.19Å; V185-T209 HydrophobicContact CG2-CG2 4.03Å; T209-M215 CarbonylContact O-C 3.25Å; T209-M215 WeakPolarHBondContact O-CA 3.46Å; T209-Y216 PolarHBondContact N-O 2.81Å; T209-Y216 PolarHBondContact O-N 3.33Å
210	T	94.7	Very high	83.4	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	137.4	178.8	55.1	0	0	0	0	111.5	V182 T183 G184 R214 M215 L313 W329	V182-T210 CarbonylContact C-O 3.49Å; T183-T210 PolarHBondContact N-O 3.45Å; T183-T210 PolarHBondContact OG1-O 3.41Å; T183-T210 PolarHBondContact OG1-OG1 3.24Å; G184-T210 WeakPolarHBondContact CA-OG1 3.39Å; G184-T210 PolarHBondContact N-O 3.47Å; G184-T210 PolarHBondContact N-OG1 2.95Å; G184-T210 PolarHBondContact O-N 3.5Å; T210-R214 CarbonylContact C-O 3.46Å; T210-R214 WeakPolarHBondContact CA-O 3.44Å; T210-M215 HydrophobicContact CG2-CB 3.97Å; T210-M215 HydrophobicContact CG2-CG 3.78Å; T210-M215 HydrophobicContact CG2-SD 4.49Å; T210-L313 HydrophobicContact CG2-CB 4.11Å; T210-L313 HydrophobicContact CG2-CD1 4.2Å; T210-L313 HydrophobicContact CG2-CD2 4.04Å; T210-L313 HydrophobicContact CG2-CG 4.34Å; T210-W329 HydrophobicContact CG2-CD2 3.98Å; T210-W329 HydrophobicContact CG2-CG 3.88Å
211	T	93.5	Very high	84.9	Confident	2 Å²	2	21.1 Å²	21.1	1%	0.012	11%	0.109	C	C	.	.			trans	-107.9	169.4	162.7	61.4	0	0	0	0	107.9	L178 H180 S181 C213 R214 Y216 W329	L178-T211 HydrophobicContact CB-CG2 4.42Å; L178-T211 HydrophobicContact CD1-CG2 4.4Å; H180-T211 HydrophobicContact CB-CG2 3.94Å; S181-T211 WeakPolarHBondContact O-CA 3.46Å; T211-C213 PolarHBondContact O-N 3.1Å; T211-R214 PolarHBondContact N-O 3.33Å; T211-R214 PolarHBondContact O-N 3.14Å; T211-R214 WeakPolarHBondContact OG1-CA 3.43Å; T211-R214 WeakPolarHBondContact OG1-CB 3.37Å; T211-R214 PolarHBondContact OG1-N 2.76Å; T211-R214 PolarHBondContact OG1-O 2.74Å; T211-Y216 HydrophobicContact CG2-CE2 3.74Å; T211-W329 WeakPolarHBondContact O-CZ2 3.36Å
212	P	90.4	Very high	85.8	Confident	17 Å²	17	16.5 Å²	16.5	11%	0.11	9%	0.087	C	C	.	.	S	Bend	trans	-56.9	-18	-177.3	-26.1	33.1	0	0	0	115.9	S181 T183 S307 G309	S181-P212 WeakPolarHBondContact O-CD 3.23Å; T183-P212 HydrophobicContact CG2-CG 3.85Å; P212-S307 WeakPolarHBondContact CB-OG 3.26Å; P212-S307 WeakPolarHBondContact O-CB 3.47Å; P212-S307 PolarHBondContact O-OG 3.4Å; P212-G309 WeakPolarHBondContact CG-O 3.29Å
213	C	90.1	Very high	85.8	Confident	45 Å²	45	17 Å²	17	30%	0.304	9%	0.087	S	C	.	.	S	Bend	trans	-125.9	-16.3	179.3	-53.9	0	0	0	0	114.6	T211 E303 F304 S307 W329	T211-C213 PolarHBondContact O-N 3.1Å; C213-E303 WeakPolarHBondContact O-CA 3.33Å; C213-F304 PolarHBondContact O-N 2.92Å; C213-S307 WeakPolarHBondContact SG-CB 3.34Å; C213-W329 WeakPolarHBondContact O-CH2 3.23Å
214	R	92.3	Very high	84.9	Confident	76 Å²	76	18.5 Å²	18.5	29%	0.287	10%	0.102	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.2	-173.1	-60.1	178.2	174.5	139.9	13.9	112.8	T210 T211 Y216 V301 T302 E303	T210-R214 CarbonylContact C-O 3.46Å; T210-R214 WeakPolarHBondContact CA-O 3.44Å; T211-R214 PolarHBondContact N-O 3.33Å; T211-R214 PolarHBondContact O-N 3.14Å; T211-R214 WeakPolarHBondContact OG1-CA 3.43Å; T211-R214 WeakPolarHBondContact OG1-CB 3.37Å; T211-R214 PolarHBondContact OG1-N 2.76Å; T211-R214 PolarHBondContact OG1-O 2.74Å; R214-Y216 HydrophobicContact CB-CE2 3.8Å; R214-Y216 VanDerWaalsContact CD-OH 3.27Å; R214-Y216 WeakPolarHBondContact CD-OH 3.02Å; R214-V301 HydrophobicContact CB-CG1 4.27Å; R214-V301 HydrophobicContact CG-CG1 4.42Å; R214-T302 CarbonylContact C-O 3.59Å; R214-T302 VanDerWaalsContact CA-O 3.3Å; R214-T302 WeakPolarHBondContact CA-O 3.37Å; R214-E303 HydrophobicContact CG-CB 3.96Å; R214-E303 HydrophobicContact CG-CG 3.79Å; R214-E303 IonicContact CZ-OE1 3.73Å; R214-E303 IonicContact CZ-OE2 3.04Å; R214-E303 IonicContact NE-OE1 4Å; R214-E303 PolarHBondContact NE-OE1 3.25Å; R214-E303 IonicContact NE-OE2 3.83Å; R214-E303 PolarHBondContact NE-OE2 3.36Å; R214-E303 IonicContact NH2-OE1 3.52Å; R214-E303 PolarHBondContact NH2-OE1 3.07Å; R214-E303 IonicContact NH2-OE2 3.91Å; R214-E303 PolarHBondContact NH2-OE2 3.31Å
215	M	92.7	Very high	83.2	Confident	3 Å²	3	22.7 Å²	22.7	2%	0.015	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.3	166.5	-176.2	-180	77.6	0	0	109.5	F208 T209 T210 V301 T302 F327 W329 Y336 T398	F208-M215 HydrophobicContact CD1-SD 4.29Å; T209-M215 CarbonylContact O-C 3.25Å; T209-M215 WeakPolarHBondContact O-CA 3.46Å; T210-M215 HydrophobicContact CG2-CB 3.97Å; T210-M215 HydrophobicContact CG2-CG 3.78Å; T210-M215 HydrophobicContact CG2-SD 4.49Å; M215-V301 CarbonylContact O-C 3.57Å; M215-V301 WeakPolarHBondContact O-CA 3.22Å; M215-T302 PolarHBondContact N-O 3.08Å; M215-T302 PolarHBondContact O-N 3.3Å; M215-F327 HydrophobicContact CE-CE2 4.02Å; M215-F327 HydrophobicContact CE-CZ 4.39Å; M215-F327 HydrophobicContact SD-CD2 4.37Å; M215-F327 HydrophobicContact SD-CE2 4.07Å; M215-W329 HydrophobicContact CB-CD2 4.19Å; M215-W329 HydrophobicContact CB-CE3 3.66Å; M215-W329 HydrophobicContact CB-CH2 4Å; M215-W329 HydrophobicContact CB-CZ2 4.48Å; M215-W329 HydrophobicContact CB-CZ3 3.54Å; M215-W329 VanDerWaalsContact N-CH2 3.34Å; M215-W329 HydrophobicContact SD-CE3 4.34Å; M215-Y336 HydrophobicContact CE-CD1 4.32Å; M215-Y336 HydrophobicContact CE-CE1 3.87Å; M215-T398 HydrophobicContact CE-CG2 4.26Å
216	Y	91.5	Very high	81	Confident	9 Å²	9	25.2 Å²	25.2	4%	0.035	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	142.6	174.7	-55	-94.5	0	0	0	109.4	L178 F208 T209 T211 R214 F218 L295 K300 V301	L178-Y216 HydrophobicContact CB-CE2 4.48Å; L178-Y216 HydrophobicContact CD1-CD2 3.86Å; L178-Y216 HydrophobicContact CD1-CE2 3.97Å; L178-Y216 HydrophobicContact CD1-CG 4.47Å; L178-Y216 HydrophobicContact CD2-CD1 4.35Å; L178-Y216 HydrophobicContact CD2-CD2 4.43Å; L178-Y216 HydrophobicContact CD2-CE1 4.33Å; L178-Y216 HydrophobicContact CD2-CE2 4.38Å; L178-Y216 HydrophobicContact CD2-CG 4.42Å; F208-Y216 WeakPolarHBondContact CA-O 3.32Å; T209-Y216 PolarHBondContact N-O 2.81Å; T209-Y216 PolarHBondContact O-N 3.33Å; T211-Y216 HydrophobicContact CG2-CE2 3.74Å; R214-Y216 HydrophobicContact CB-CE2 3.8Å; R214-Y216 VanDerWaalsContact CD-OH 3.27Å; R214-Y216 WeakPolarHBondContact CD-OH 3.02Å; Y216-F218 HydrophobicContact CD1-CZ 4.11Å; Y216-F218 HydrophobicContact CG-CE2 4.35Å; Y216-F218 AromaticContact CG-CZ 3.99Å; Y216-F218 HydrophobicContact CG-CZ 3.99Å; Y216-L295 HydrophobicContact CD1-CD2 3.95Å; Y216-L295 HydrophobicContact CE1-CD1 4.42Å; Y216-L295 HydrophobicContact CE1-CD2 3.99Å; Y216-K300 CarbonylContact C-O 3.59Å; Y216-K300 VanDerWaalsContact CA-O 3.31Å; Y216-K300 WeakPolarHBondContact CA-O 3.49Å; Y216-V301 HydrophobicContact CD1-CB 4.46Å; Y216-V301 HydrophobicContact CD1-CG1 4.17Å; Y216-V301 HydrophobicContact CD1-CG2 3.64Å; Y216-V301 HydrophobicContact CE1-CG1 3.94Å; Y216-V301 HydrophobicContact CE1-CG2 3.87Å
217	Q	90.8	Very high	78.5	Confident	4 Å²	4	27.4 Å²	27.4	2%	0.019	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	114.9	169.4	-176.9	-161.1	-37.2	0	0	107.6	V206 V207 F208 S299 K300 V395	V206-Q217 HydrophobicContact CG1-CG 3.55Å; V207-Q217 WeakPolarHBondContact O-CA 3.19Å; F208-Q217 HydrophobicContact CD1-CB 4.08Å; F208-Q217 HydrophobicContact CD1-CG 4.12Å; F208-Q217 HydrophobicContact CE1-CB 3.94Å; F208-Q217 HydrophobicContact CE1-CG 3.68Å; F208-Q217 HydrophobicContact CZ-CG 4.13Å; Q217-S299 WeakPolarHBondContact O-CA 3.37Å; Q217-K300 HydrophobicContact CB-CB 4.22Å; Q217-K300 PolarHBondContact N-O 3.1Å; Q217-K300 PolarHBondContact O-N 3.44Å; Q217-V395 PolarHBondContact NE2-O 3.33Å
218	F	88.6	Confident	75.6	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.4	174.6	-52.9	-73.1	0	0	0	108.7	I176 L178 V206 V207 Y216 V288 F289 L295 P296 S299	I176-F218 HydrophobicContact CD1-CE1 4.11Å; I176-F218 HydrophobicContact CD1-CZ 4.15Å; L178-F218 HydrophobicContact CD2-CZ 3.9Å; V206-F218 CarbonylContact C-O 3.57Å; V206-F218 WeakPolarHBondContact CA-O 3.41Å; V206-F218 WeakPolarHBondContact CG1-O 3.28Å; V207-F218 HydrophobicContact CB-CB 4.36Å; V207-F218 HydrophobicContact CB-CD2 4.4Å; V207-F218 PolarHBondContact N-O 3.4Å; V207-F218 PolarHBondContact O-N 2.95Å; Y216-F218 HydrophobicContact CD1-CZ 4.11Å; Y216-F218 HydrophobicContact CG-CE2 4.35Å; Y216-F218 AromaticContact CG-CZ 3.99Å; Y216-F218 HydrophobicContact CG-CZ 3.99Å; F218-V288 HydrophobicContact CB-CG1 3.93Å; F218-F289 HydrophobicContact CB-CE1 4.36Å; F218-F289 HydrophobicContact CD1-CD1 4.45Å; F218-F289 HydrophobicContact CD2-CD1 4.23Å; F218-F289 AromaticContact CD2-CE1 3.52Å; F218-F289 HydrophobicContact CD2-CE1 3.52Å; F218-F289 HydrophobicContact CD2-CZ 4.35Å; F218-F289 AromaticContact CE2-CE1 3.88Å; F218-F289 HydrophobicContact CE2-CE1 3.88Å; F218-F289 HydrophobicContact CG-CD1 4.18Å; F218-F289 AromaticContact CG-CE1 3.87Å; F218-F289 HydrophobicContact CG-CE1 3.87Å; F218-L295 HydrophobicContact CE1-CD2 3.95Å; F218-L295 HydrophobicContact CZ-CD2 4.21Å; F218-P296 HydrophobicContact CD1-CB 4.45Å; F218-P296 HydrophobicContact CD1-CG 3.81Å; F218-P296 HydrophobicContact CE1-CG 4.16Å; F218-S299 VanDerWaalsContact CD1-OG 3.23Å; F218-S299 WeakPolarHBondContact CD1-OG 3.33Å; F218-S299 WeakPolarHBondContact CE1-OG 3.14Å
219	A	84	Confident	72.7	Confident	23 Å²	23	36.2 Å²	36.2	19%	0.19	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	141.7	177.8	0	0	0	0	0	109.3	C205 V206 F390 V395	C205-A219 WeakPolarHBondContact O-CA 3.43Å; V206-A219 HydrophobicContact CG2-CB 3.9Å; A219-F390 HydrophobicContact CB-CD1 4.32Å; A219-V395 HydrophobicContact CB-CB 4Å; A219-V395 HydrophobicContact CB-CG1 4.17Å; A219-V395 HydrophobicContact CB-CG2 4.31Å
220	G	78.5	Confident	69.7	Low	4 Å²	4	40 Å²	40	4%	0.041	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	-169.2	176.5	0	0	0	0	0	111.9	C205	C205-G220 PolarHBondContact N-O 2.93Å; C205-G220 PolarHBondContact O-N 3.32Å
221	W	76.1	Confident	66.7	Low	49 Å²	49	44.6 Å²	44.6	19%	0.186	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	149.4	178.4	-61.6	92.2	0	0	0	110.6	P202 Q203 R204 S287 P349 D388 F390	P202-W221 HydrophobicContact CB-CE3 3.77Å; P202-W221 HydrophobicContact CB-CZ3 4.08Å; P202-W221 HydrophobicContact CG-CE3 4.38Å; P202-W221 HydrophobicContact CG-CZ3 4.2Å; Q203-W221 CarbonylContact O-C 3.58Å; Q203-W221 WeakPolarHBondContact O-CA 3.42Å; R204-W221 HydrophobicContact CG-CD2 4.31Å; R204-W221 HydrophobicContact CG-CE3 3.7Å; R204-W221 HydrophobicContact CG-CH2 3.8Å; R204-W221 HydrophobicContact CG-CZ2 4.37Å; R204-W221 HydrophobicContact CG-CZ3 3.43Å; R204-W221 VanDerWaalsContact CG-CZ3 3.43Å; W221-S287 WeakPolarHBondContact O-CB 3.49Å; W221-S287 PolarHBondContact O-OG 2.88Å; W221-P349 HydrophobicContact CH2-CB 4.05Å; W221-P349 HydrophobicContact CZ2-CB 4.34Å; W221-D388 PolarHBondContact NE1-OD2 3.49Å; W221-F390 HydrophobicContact CZ2-CB 4.11Å
222	I	76	Confident	63.8	Low	0 Å²	0	50.3 Å²	50.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.7	168.4	63	-179.9	0	0	0	107.8	R189 Q203 C205 L284 F285 V288	R189-I222 HydrophobicContact CG-CD1 3.94Å; Q203-I222 HydrophobicContact CB-CD1 4.12Å; Q203-I222 HydrophobicContact CB-CG1 3.67Å; Q203-I222 PolarHBondContact N-O 3.24Å; Q203-I222 PolarHBondContact O-N 2.9Å; C205-I222 HydrophobicContact CB-CD1 4.03Å; C205-I222 HydrophobicContact CB-CG1 4.2Å; C205-I222 HydrophobicContact CB-CG2 3.7Å; I222-L284 HydrophobicContact CB-CD1 4Å; I222-L284 HydrophobicContact CB-CG 4.1Å; I222-L284 HydrophobicContact CD1-CD2 4.43Å; I222-L284 HydrophobicContact CG2-CG 4.4Å; I222-L284 WeakPolarHBondContact CG2-O 3.49Å; I222-F285 HydrophobicContact CG2-CD1 4.1Å; I222-V288 HydrophobicContact CG2-CG2 3.75Å
223	N	64.2	Low	61.1	Low	77 Å²	77	55.4 Å²	55.4	41%	0.412	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124.9	178	-74.5	-9	0	0	0	109	P202 N225 S226 L284	P202-N223 WeakPolarHBondContact CA-OD1 3.27Å; P202-N223 VanDerWaalsContact CB-OD1 3.23Å; P202-N223 WeakPolarHBondContact CB-OD1 3.41Å; N223-N225 PolarHBondContact O-N 2.96Å; N223-N225 VanDerWaalsContact O-N 3.09Å; N223-S226 PolarHBondContact O-N 3.48Å; N223-S226 PolarHBondContact O-OG 3.38Å; N223-L284 WeakPolarHBondContact O-CD1 3.35Å
224	A	52.7	Low	58.3	Low	54 Å²	54	57.2 Å²	57.2	45%	0.446	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-61.2	-19.2	176.5	0	0	0	0	0	113.1
225	N	43.8	Very low	55.4	Low	113 Å²	113	60.8 Å²	60.8	60%	0.604	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-88.8	-2.4	-172.8	-71.3	-1.4	0	0	0	115.4	G200 N223	G200-N225 WeakPolarHBondContact CA-ND2 3.21Å; N223-N225 PolarHBondContact O-N 2.96Å; N223-N225 VanDerWaalsContact O-N 3.09Å
226	S	36.1	Very low	52.5	Low	53 Å²	53	66.4 Å²	66.4	37%	0.371	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-96.3	1.9	-177.8	52.3	0	0	0	0	115.3	N223	N223-S226 PolarHBondContact O-N 3.48Å; N223-S226 PolarHBondContact O-OG 3.38Å
227	S	35.9	Very low	49.7	Very low	46 Å²	46	70.5 Å²	70.5	32%	0.322	44%	0.437	S	S	.	.	S	Bend	trans	-95.5	108.4	168.3	58.6	0	0	0	0	110.3	T229	S227-T229 VanDerWaalsContact C-N 3.31Å; S227-T229 PolarHBondContact O-N 3.42Å
228	T	28.8	Very low	46.9	Very low	100 Å²	100	73.7 Å²	73.7	61%	0.613	46%	0.464	S	S	*	.			trans	-60.4	85.2	170.5	35.6	0	0	0	0	111.5
229	T	33	Very low	44	Very low	86 Å²	86	80.3 Å²	80.3	53%	0.528	50%	0.5	S	S	.	.			trans	-133.7	32.7	157.3	54.4	0	0	0	0	111.7	S227 S231	S227-T229 VanDerWaalsContact C-N 3.31Å; S227-T229 PolarHBondContact O-N 3.42Å; T229-S231 PolarHBondContact O-N 3.25Å
230	G	30.5	Very low	41.4	Very low	78 Å²	78	85.6 Å²	85.6	80%	0.804	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	12.9	164.8	0	0	0	0	0	115.4
231	S	32	Very low	38.9	Very low	97 Å²	97	90 Å²	90	68%	0.678	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.7	4.4	-173.1	-169.4	0	0	0	0	116.5	T229	T229-S231 PolarHBondContact O-N 3.25Å
232	I	32.1	Very low	36.7	Very low	123 Å²	123	93.9 Å²	93.9	63%	0.631	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	-30.5	178	-58.7	178.4	0	0	0	112.7
233	L	33.3	Very low	34.5	Very low	123 Å²	123	99.7 Å²	99.7	64%	0.644	64%	0.636	S	S	*	*	H	α-helix	trans	-80.7	-16.9	-179.5	-75	166.3	0	0	0	114.4	H235	L233-H235 VanDerWaalsContact C-N 3.28Å; L233-H235 PolarHBondContact O-N 3.1Å
234	S	32.2	Very low	32.7	Very low	83 Å²	83	99.2 Å²	99.2	58%	0.58	65%	0.649	S	S	*	*	H	α-helix	trans	-73.4	-15.4	174.5	51.3	0	0	0	0	114.1
235	H	31.1	Very low	31.6	Very low	152 Å²	152	104.9 Å²	104.9	70%	0.704	67%	0.67	S	S	*	*	H	α-helix	trans	-100.4	-13.1	178.7	-93.2	-72.1	0	0	0	114.9	L233	L233-H235 VanDerWaalsContact C-N 3.28Å; L233-H235 PolarHBondContact O-N 3.1Å
236	L	31.1	Very low	30.7	Very low	121 Å²	121	104.4 Å²	104.4	63%	0.634	68%	0.676	S	S	*	*	H	α-helix	trans	-97.7	-23.3	178.2	-76.1	160.8	0	0	0	113.2	A238	L236-A238 PolarHBondContact O-N 3.49Å; L236-A238 VanDerWaalsContact O-N 3.15Å
237	A	33.6	Very low	30.2	Very low	94 Å²	94	109.4 Å²	109.4	78%	0.777	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-1	174.1	0	0	0	0	0	114.4
238	A	31.2	Very low	29.9	Very low	71 Å²	71	112 Å²	112	59%	0.587	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-7.3	-176	0	0	0	0	0	114.9	L236	L236-A238 PolarHBondContact O-N 3.49Å; L236-A238 VanDerWaalsContact O-N 3.15Å
239	N	28	Very low	29.9	Very low	139 Å²	139	114.9 Å²	114.9	74%	0.743	73%	0.733	S	S	*	*	S	Bend	trans	-140.5	54.7	-170.1	-80.6	-24.2	0	0	0	114.1
240	T	30.3	Very low	29.6	Very low	135 Å²	135	118.9 Å²	118.9	83%	0.828	75%	0.751	S	S	*	*			trans	-152.7	64.2	155.6	38.3	0	0	0	0	109.9	T242	T240-T242 PolarHBondContact O-N 2.91Å
241	A	25.9	Very low	29.5	Very low	96 Å²	96	118.7 Å²	118.7	79%	0.793	74%	0.742	S	S	*	*			trans	-79.5	102.2	159.9	0	0	0	0	0	108.3
242	T	28.4	Very low	29.3	Very low	131 Å²	131	124.9 Å²	124.9	80%	0.804	75%	0.752	S	S	*	*			trans	179.7	133.4	139.3	41.3	0	0	0	0	111	T240	T240-T242 PolarHBondContact O-N 2.91Å
243	S	30.5	Very low	29.3	Very low	121 Å²	121	125.4 Å²	125.4	85%	0.846	76%	0.761	S	S	*	*			trans	70.3	103.1	160.7	63.8	0	0	0	0	119.6
244	G	27.1	Very low	29	Very low	68 Å²	68	123.5 Å²	123.5	70%	0.701	77%	0.771	S	S	*	*				92.7	90.6	124.8	0	0	0	0	0	116.5
245	I	29	Very low	28.7	Very low	172 Å²	172	122.8 Å²	122.8	88%	0.882	78%	0.777	S	S	*	*				167.4	85.3	124.3	-77.3	150.6	0	0	0	105.9
246	S	24.7	Very low	28.6	Very low	104 Å²	104	125.2 Å²	125.2	73%	0.727	79%	0.788	S	S	*	*			trans	-77.9	116.2	161.2	45.8	0	0	0	0	108.4
247	N	26	Very low	28.3	Very low	158 Å²	158	131.1 Å²	131.1	85%	0.845	80%	0.802	S	S	*	*			trans	156.9	91.3	149.5	-80.6	-12.4	0	0	0	110.2
248	A	29.2	Very low	28.1	Very low	100 Å²	100	131.9 Å²	131.9	83%	0.826	80%	0.801	S	S	*	*	S	Bend	trans	-173.1	-9.4	157.4	0	0	0	0	0	116.4
249	I	29.3	Very low	27.8	Very low	160 Å²	160	133.3 Å²	133.3	82%	0.821	81%	0.807	S	S	*	*	S	Bend	trans	-103.9	-0.4	-165.5	-64.1	177.9	0	0	0	115.4
250	N	26.7	Very low	27.8	Very low	170 Å²	170	135 Å²	135	91%	0.909	82%	0.815	S	S	*	*	S	Bend	trans	-114.5	34.8	-174.7	-77.3	-6.4	0	0	0	116.5
251	A	27	Very low	27.6	Very low	74 Å²	74	134.3 Å²	134.3	61%	0.612	81%	0.811	S	S	*	*	S	Bend	trans	-125.2	137.2	166.7	0	0	0	0	0	109.3
252	Y	29.5	Very low	27.7	Very low	227 Å²	227	136.2 Å²	136.2	89%	0.89	81%	0.807	S	S	*	*	S	Bend	trans	91.1	51.2	-179.8	-54.3	-77.9	0	0	0	117.9
253	T	31.3	Very low	27.6	Very low	134 Å²	134	137.8 Å²	137.8	82%	0.822	81%	0.805	S	S	*	*			trans	-153.2	94.9	142.9	41.9	0	0	0	0	110.7
254	G	27	Very low	27.4	Very low	84 Å²	84	143.7 Å²	143.7	87%	0.866	81%	0.811	S	S	*	*			trans	-115.1	129.6	149.4	0	0	0	0	0	105.5
255	G	26	Very low	27.2	Very low	67 Å²	67	147 Å²	147	69%	0.691	81%	0.812	S	S	*	*			cis	138.4	90.5	16.7	0	0	0	0	0	106.2
256	H	29.6	Very low	27.1	Very low	203 Å²	203	146.2 Å²	146.2	94%	0.94	81%	0.805	S	S	*	*			trans	-148.8	113.1	156.4	-97.2	-64.1	0	0	0	109.9
257	R	23.9	Very low	27.3	Very low	246 Å²	246	148.6 Å²	148.6	93%	0.928	81%	0.805	S	S	*	*			trans	-76.3	145.6	172.8	-73.8	173.5	159.7	-174.2	-5.3	111
258	S	29	Very low	27.3	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	80%	0.8	S	S	*	*				-176.2	104.7	127.4	-138.1	0	0	0	0	109.5
259	S	24.6	Very low	27.1	Very low	100 Å²	100	148.8 Å²	148.8	70%	0.699	80%	0.795	S	S	*	*				68.1	113.5	98.2	104.4	0	0	0	0	114.8
260	L	28.9	Very low	27	Very low	175 Å²	175	148.2 Å²	148.2	92%	0.916	80%	0.799	S	S	*	*				-174.8	137.7	119.8	-91.4	170.2	0	0	0	110.5
261	V	25.4	Very low	27	Very low	121 Å²	121	143 Å²	143	73%	0.733	79%	0.785	S	S	*	*			trans	-108.6	150.4	-170.8	173.7	0	0	0	0	108.8
262	N	29.1	Very low	27.1	Very low	136 Å²	136	147.2 Å²	147.2	73%	0.727	80%	0.795	S	S	*	*			trans	163.2	109.9	137.4	-84.9	-5.6	0	0	0	109.5
263	E	25	Very low	27.1	Very low	163 Å²	163	144.7 Å²	144.7	76%	0.762	79%	0.792	S	S	*	*				65.4	110	89.9	-76.2	-168.7	159.2	0	0	113.7
264	Y	27.2	Very low	26.7	Very low	245 Å²	245	145.8 Å²	145.8	96%	0.961	79%	0.793	S	S	*	*				-162.6	132.8	128.3	-108.8	-77.8	0	0	0	110.3
265	N	23.9	Very low	26.7	Very low	137 Å²	137	147.6 Å²	147.6	73%	0.733	79%	0.787	S	S	*	*			trans	-126.7	152.6	-166.3	-138.4	-16.1	0	0	0	108.8
266	Q	25.6	Very low	26.8	Very low	157 Å²	157	151.1 Å²	151.1	73%	0.734	80%	0.796	S	S	*	*			trans	75.9	123.1	158	-55.1	173.6	14	0	0	119.7
267	Q	28.4	Very low	26.7	Very low	153 Å²	153	148.7 Å²	148.7	72%	0.715	79%	0.788	S	S	*	*				178.1	133.1	96.3	-90.8	177.1	-0	0	0	114
268	Q	27.9	Very low	26.7	Very low	158 Å²	158	145.6 Å²	145.6	74%	0.738	78%	0.781	S	S	*	*			trans	63.6	108.4	138.2	-65.9	171.4	6.7	0	0	119.8
269	S	23.9	Very low	26.7	Very low	104 Å²	104	145 Å²	145	73%	0.727	78%	0.775	S	S	*	*				81.1	124	63.5	75.4	0	0	0	0	115.4
270	V	28.2	Very low	27.3	Very low	148 Å²	148	147.4 Å²	147.4	90%	0.897	78%	0.778	S	S	*	*			trans	146.6	125.4	149.7	179	0	0	0	0	105.1
271	G	25.9	Very low	28.4	Very low	60 Å²	60	143 Å²	143	62%	0.619	76%	0.755	S	S	*	*			cis	148	149.1	18.7	0	0	0	0	0	106.1
272	I	29.2	Very low	30.1	Very low	163 Å²	163	140.6 Å²	140.6	84%	0.836	74%	0.741	S	S	*	*			trans	114.9	89.3	166	-54	157.7	0	0	0	116.5
273	Q	28.4	Very low	31.9	Very low	174 Å²	174	134.4 Å²	134.4	81%	0.813	71%	0.708	S	S	*	*				50.5	109.6	125.3	-58.2	-176.8	-4.2	0	0	122.6
274	N	23.2	Very low	34.5	Very low	157 Å²	157	127.1 Å²	127.1	84%	0.84	68%	0.675	S	S	*	*				48.2	95.4	129.9	-64.8	-5.1	0	0	0	120.8
275	T	28.1	Very low	37.2	Very low	123 Å²	123	115.5 Å²	115.5	76%	0.755	63%	0.629	S	S	*	*			trans	-141.7	137.4	137.2	37	0	0	0	0	108.4	I277	T275-I277 WeakPolarHBondContact O-CG1 3.47Å; T275-I277 PolarHBondContact O-N 3.5Å
276	T	26.7	Very low	39.9	Very low	141 Å²	141	110.2 Å²	110.2	87%	0.865	60%	0.603	S	S	*	*			trans	-48.4	110.4	-179	46.9	0	0	0	0	113
277	I	27.5	Very low	42.2	Very low	151 Å²	151	106 Å²	106	77%	0.774	59%	0.591	S	S	*	*			trans	-105.2	108.3	-179.6	-50.5	-172.2	0	0	0	108.9	T275	T275-I277 WeakPolarHBondContact O-CG1 3.47Å; T275-I277 PolarHBondContact O-N 3.5Å
278	F	25.3	Very low	44.7	Very low	182 Å²	182	98.9 Å²	98.9	80%	0.798	56%	0.558	S	S	*	*			trans	-64.3	134.8	158.6	-76	-88.3	0	0	0	108.2	I280	F278-I280 PolarHBondContact O-N 3.36Å; F278-I280 VanDerWaalsContact O-N 3.13Å
279	P	28.2	Very low	47.3	Very low	97 Å²	97	91.7 Å²	91.7	63%	0.63	52%	0.524	S	S	*	.			trans	-68.6	116.6	178	28.5	-30.3	0	0	0	108.5	I281	P279-I281 PolarHBondContact O-N 3.27Å
280	I	37.5	Very low	49.3	Very low	150 Å²	150	92.2 Å²	92.2	77%	0.769	52%	0.519	S	S	*	.			trans	-71	106.2	170.5	-61.4	170.9	0	0	0	106	F278 T282	F278-I280 PolarHBondContact O-N 3.36Å; F278-I280 VanDerWaalsContact O-N 3.13Å; I280-T282 PolarHBondContact O-N 2.71Å; I280-T282 VanDerWaalsContact O-N 3.16Å
281	I	52.6	Low	50.6	Low	82 Å²	82	86.9 Å²	86.9	42%	0.421	49%	0.488	S	S	.	.			trans	-72.9	105.2	174.6	-57.4	173.1	0	0	0	107	I173 P279	I173-I281 HydrophobicContact CD1-CG2 4.26Å; I173-I281 WeakPolarHBondContact CD1-O 3.39Å; P279-I281 PolarHBondContact O-N 3.27Å
282	T	59.5	Low	52	Low	72 Å²	72	92.8 Å²	92.8	44%	0.442	51%	0.506	S	S	.	.			trans	-79.5	123.2	169.9	48.3	0	0	0	0	109.2	I280	I280-T282 PolarHBondContact O-N 2.71Å; I280-T282 VanDerWaalsContact O-N 3.16Å
283	G	67.8	Low	53.4	Low	5 Å²	5	91.5 Å²	91.5	5%	0.052	50%	0.496	C	S	.	.			trans	-65.7	152.2	179.3	0	0	0	0	0	113	E152 F285 S286	E152-G283 WeakPolarHBondContact OE1-CA 3.28Å; E152-G283 VanDerWaalsContact OE2-C 3.24Å; E152-G283 VanDerWaalsContact OE2-CA 3.27Å; E152-G283 WeakPolarHBondContact OE2-CA 3.32Å; G283-F285 PolarHBondContact O-N 3.33Å; G283-S286 VanDerWaalsContact O-CB 3.26Å; G283-S286 WeakPolarHBondContact O-CB 3.48Å; G283-S286 PolarHBondContact O-N 3.45Å; G283-S286 VanDerWaalsContact O-N 3.16Å
284	L	79.6	Confident	55.2	Low	10 Å²	10	92.9 Å²	92.9	5%	0.052	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-36	-179.9	-179.4	66.8	0	0	0	112.2	E140 E152 I222 N223 S286	E140-L284 HydrophobicContact CB-CD2 4.09Å; E140-L284 HydrophobicContact CG-CB 4.16Å; E140-L284 HydrophobicContact CG-CD2 3.86Å; E152-L284 VanDerWaalsContact CD-N 3.3Å; E152-L284 PolarHBondContact OE1-N 3.38Å; E152-L284 PolarHBondContact OE2-N 2.99Å; I222-L284 HydrophobicContact CB-CD1 4Å; I222-L284 HydrophobicContact CB-CG 4.1Å; I222-L284 HydrophobicContact CD1-CD2 4.43Å; I222-L284 HydrophobicContact CG2-CG 4.4Å; I222-L284 WeakPolarHBondContact CG2-O 3.49Å; N223-L284 WeakPolarHBondContact O-CD1 3.35Å; L284-S286 VanDerWaalsContact C-N 3.35Å
285	F	84.7	Confident	57.6	Low	1 Å²	1	88.2 Å²	88.2	0%	0.004	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	4.9	-177	-63.6	-79.9	0	0	0	113.5	E140 L142 E152 M175 V187 C205 I222 G283 S287 V288 F289	E140-F285 HydrophobicContact CB-CE2 4.21Å; L142-F285 HydrophobicContact CD1-CD1 4.32Å; L142-F285 HydrophobicContact CD1-CD2 4.28Å; L142-F285 HydrophobicContact CD1-CE1 4.32Å; L142-F285 HydrophobicContact CD1-CE2 4.28Å; L142-F285 HydrophobicContact CD1-CG 4.27Å; L142-F285 HydrophobicContact CD1-CZ 4.27Å; L142-F285 HydrophobicContact CD2-CB 4.39Å; L142-F285 HydrophobicContact CD2-CD2 3.53Å; L142-F285 HydrophobicContact CD2-CE2 3.87Å; L142-F285 HydrophobicContact CD2-CG 4.05Å; L142-F285 HydrophobicContact CG-CD2 3.93Å; L142-F285 HydrophobicContact CG-CE2 3.79Å; L142-F285 HydrophobicContact CG-CG 4.4Å; L142-F285 HydrophobicContact CG-CZ 4.16Å; E152-F285 HydrophobicContact CG-CD2 3.84Å; E152-F285 HydrophobicContact CG-CE2 4.39Å; E152-F285 PolarHBondContact OE2-N 2.75Å; M175-F285 HydrophobicContact CE-CB 3.97Å; M175-F285 WeakPolarHBondContact CE-O 3.32Å; V187-F285 HydrophobicContact CG1-CE1 3.83Å; V187-F285 HydrophobicContact CG1-CZ 4.13Å; V187-F285 HydrophobicContact CG2-CE1 4.41Å; V187-F285 HydrophobicContact CG2-CZ 4.42Å; C205-F285 VanDerWaalsContact SG-CE1 3.59Å; I222-F285 HydrophobicContact CG2-CD1 4.1Å; G283-F285 PolarHBondContact O-N 3.33Å; F285-S287 VanDerWaalsContact C-N 3.28Å; F285-S287 PolarHBondContact O-N 3.41Å; F285-V288 WeakPolarHBondContact O-CB 3.12Å; F285-V288 PolarHBondContact O-N 2.99Å; F285-F289 HydrophobicContact CB-CD2 4.01Å; F285-F289 HydrophobicContact CB-CE2 3.96Å; F285-F289 WeakPolarHBondContact O-CD2 3.33Å; F285-F289 PolarHBondContact O-N 3.27Å
286	S	79.8	Confident	59.5	Low	26 Å²	26	82.9 Å²	82.9	18%	0.182	44%	0.442	C	S	.	.	H	α-helix	trans	-57.5	-41.2	-175.9	-174.6	0	0	0	0	112	M175 G283 L284 V288 F289 N290	M175-S286 VanDerWaalsContact CE-N 3.32Å; G283-S286 VanDerWaalsContact O-CB 3.26Å; G283-S286 WeakPolarHBondContact O-CB 3.48Å; G283-S286 PolarHBondContact O-N 3.45Å; G283-S286 VanDerWaalsContact O-N 3.16Å; L284-S286 VanDerWaalsContact C-N 3.35Å; S286-V288 PolarHBondContact O-N 3.15Å; S286-F289 PolarHBondContact O-N 3.09Å; S286-N290 WeakPolarHBondContact O-CB 3.36Å; S286-N290 PolarHBondContact O-N 3.07Å; S286-N290 PolarHBondContact O-ND2 3.19Å; S286-N290 PolarHBondContact O-OD1 3.02Å; S286-N290 VanDerWaalsContact OG-CG 3.31Å; S286-N290 PolarHBondContact OG-ND2 3.42Å; S286-N290 PolarHBondContact OG-OD1 3.41Å; S286-N290 VanDerWaalsContact OG-OD1 3.14Å
287	S	74.9	Confident	61.1	Low	70 Å²	70	80.4 Å²	80.4	49%	0.49	43%	0.426	S	S	.	.	H	α-helix	trans	-67.6	-15.3	175.9	37.6	0	0	0	0	115	W221 F285	W221-S287 WeakPolarHBondContact O-CB 3.49Å; W221-S287 PolarHBondContact O-OG 2.88Å; F285-S287 VanDerWaalsContact C-N 3.28Å; F285-S287 PolarHBondContact O-N 3.41Å
288	V	80.6	Confident	62.7	Low	2 Å²	2	74.5 Å²	74.5	1%	0.012	40%	0.402	C	S	.	.	H	α-helix	trans	-88.2	-31.3	176.9	-176	0	0	0	0	111.4	C205 V207 F218 I222 F285 S286	C205-V288 HydrophobicContact CB-CG2 3.97Å; V207-V288 HydrophobicContact CG2-CG1 4.12Å; F218-V288 HydrophobicContact CB-CG1 3.93Å; I222-V288 HydrophobicContact CG2-CG2 3.75Å; F285-V288 WeakPolarHBondContact O-CB 3.12Å; F285-V288 PolarHBondContact O-N 2.99Å; S286-V288 PolarHBondContact O-N 3.15Å
289	F	82.2	Confident	65	Low	7 Å²	7	67.1 Å²	67.1	3%	0.031	37%	0.374	C	S	.	.	H	α-helix	trans	-106.1	-9.3	-177.9	-64.4	-77	0	0	0	114.4	L142 I150 M175 I176 V207 F218 F285 S286 S291 P296	L142-F289 HydrophobicContact CD1-CE2 3.99Å; L142-F289 HydrophobicContact CD1-CZ 4.11Å; I150-F289 HydrophobicContact CD1-CE1 4.22Å; I150-F289 HydrophobicContact CD1-CZ 4.38Å; M175-F289 HydrophobicContact CB-CB 4.34Å; M175-F289 HydrophobicContact CB-CD2 3.74Å; M175-F289 HydrophobicContact CB-CE2 4.16Å; M175-F289 HydrophobicContact CB-CG 4.04Å; M175-F289 HydrophobicContact CE-CB 4.39Å; M175-F289 HydrophobicContact CE-CD2 3.88Å; M175-F289 HydrophobicContact CG-CD2 4.22Å; M175-F289 HydrophobicContact CG-CE2 4.45Å; I176-F289 HydrophobicContact CB-CD1 4.02Å; I176-F289 HydrophobicContact CD1-CD1 4.23Å; I176-F289 HydrophobicContact CG2-CD1 3.66Å; I176-F289 HydrophobicContact CG2-CE1 3.77Å; I176-F289 HydrophobicContact CG2-CG 4.46Å; V207-F289 HydrophobicContact CB-CZ 4.27Å; V207-F289 HydrophobicContact CG1-CZ 4.09Å; V207-F289 HydrophobicContact CG2-CE2 4.47Å; V207-F289 HydrophobicContact CG2-CZ 4.2Å; F218-F289 HydrophobicContact CB-CE1 4.36Å; F218-F289 HydrophobicContact CD1-CD1 4.45Å; F218-F289 HydrophobicContact CD2-CD1 4.23Å; F218-F289 AromaticContact CD2-CE1 3.52Å; F218-F289 HydrophobicContact CD2-CE1 3.52Å; F218-F289 HydrophobicContact CD2-CZ 4.35Å; F218-F289 AromaticContact CE2-CE1 3.88Å; F218-F289 HydrophobicContact CE2-CE1 3.88Å; F218-F289 HydrophobicContact CG-CD1 4.18Å; F218-F289 AromaticContact CG-CE1 3.87Å; F218-F289 HydrophobicContact CG-CE1 3.87Å; F285-F289 HydrophobicContact CB-CD2 4.01Å; F285-F289 HydrophobicContact CB-CE2 3.96Å; F285-F289 WeakPolarHBondContact O-CD2 3.33Å; F285-F289 PolarHBondContact O-N 3.27Å; S286-F289 PolarHBondContact O-N 3.09Å; F289-S291 PolarHBondContact O-N 3.47Å; F289-P296 WeakPolarHBondContact O-CG 3.44Å
290	N	64.7	Low	67.6	Low	116 Å²	116	65.4 Å²	65.4	62%	0.62	36%	0.356	S	S	*	.			trans	-73.4	104	-175.6	-85.4	-0.9	0	0	0	112.2	S286	S286-N290 WeakPolarHBondContact O-CB 3.36Å; S286-N290 PolarHBondContact O-N 3.07Å; S286-N290 PolarHBondContact O-ND2 3.19Å; S286-N290 PolarHBondContact O-OD1 3.02Å; S286-N290 VanDerWaalsContact OG-CG 3.31Å; S286-N290 PolarHBondContact OG-ND2 3.42Å; S286-N290 PolarHBondContact OG-OD1 3.41Å; S286-N290 VanDerWaalsContact OG-OD1 3.14Å
291	S	57.2	Low	70	Confident	35 Å²	35	61.2 Å²	61.2	25%	0.245	34%	0.337	C	S	.	.			trans	-140.3	145.2	150.9	58.2	0	0	0	0	109	F289 E293 L295 P296	F289-S291 PolarHBondContact O-N 3.47Å; S291-E293 PolarHBondContact O-N 3.14Å; S291-E293 VanDerWaalsContact O-N 3.13Å; S291-E293 PolarHBondContact OG-O 3.49Å; S291-L295 PolarHBondContact OG-O 3.14Å; S291-P296 WeakPolarHBondContact OG-CA 3.07Å; S291-P296 VanDerWaalsContact OG-N 3.17Å
292	D	54.5	Low	71.7	Confident	185 Å²	185	58.3 Å²	58.3	99%	0.989	32%	0.323	S	S	*	.	S	Bend	trans	-63.9	-11.1	166.7	-67.7	-36.2	0	0	0	112.1
293	E	58.9	Low	73.2	Confident	135 Å²	135	60.1 Å²	60.1	63%	0.631	33%	0.327	S	S	*	.	S	Bend	trans	-84.2	157.4	174	-60.5	-170.6	166.3	0	0	112.1	S291 L295	S291-E293 PolarHBondContact O-N 3.14Å; S291-E293 VanDerWaalsContact O-N 3.13Å; S291-E293 PolarHBondContact OG-O 3.49Å; E293-L295 PolarHBondContact O-N 3.16Å
294	K	66.1	Low	74.1	Confident	204 Å²	204	61.4 Å²	61.4	89%	0.887	33%	0.331	S	S	*	.	S	Bend	trans	-55	-25.7	178.9	-76.7	-174.9	177.2	-179.3	0	113.8
295	L	73.3	Confident	74.3	Confident	58 Å²	58	66.1 Å²	66.1	30%	0.304	36%	0.362	S	S	.	.	S	Bend	trans	-137.9	137.9	177.7	-72.8	167.9	0	0	0	109.3	I176 L178 Y216 F218 S291 E293 V301	I176-L295 HydrophobicContact CD1-CD2 4.39Å; L178-L295 HydrophobicContact CD2-CD2 4.29Å; Y216-L295 HydrophobicContact CD1-CD2 3.95Å; Y216-L295 HydrophobicContact CE1-CD1 4.42Å; Y216-L295 HydrophobicContact CE1-CD2 3.99Å; F218-L295 HydrophobicContact CE1-CD2 3.95Å; F218-L295 HydrophobicContact CZ-CD2 4.21Å; S291-L295 PolarHBondContact OG-O 3.14Å; E293-L295 PolarHBondContact O-N 3.16Å; L295-V301 HydrophobicContact CD1-CG2 4.11Å
296	P	67.3	Low	73.9	Confident	12 Å²	12	68.3 Å²	68.3	8%	0.078	39%	0.386	C	S	.	.			trans	-51.6	140.9	175.2	-25.5	30.8	0	0	0	113.2	I176 F218 F289 S291 G298 S299	I176-P296 HydrophobicContact CD1-CG 4.42Å; F218-P296 HydrophobicContact CD1-CB 4.45Å; F218-P296 HydrophobicContact CD1-CG 3.81Å; F218-P296 HydrophobicContact CE1-CG 4.16Å; F289-P296 WeakPolarHBondContact O-CG 3.44Å; S291-P296 WeakPolarHBondContact OG-CA 3.07Å; S291-P296 VanDerWaalsContact OG-N 3.17Å; P296-G298 PolarHBondContact O-N 3.31Å; P296-S299 WeakPolarHBondContact CB-OG 3.38Å; P296-S299 VanDerWaalsContact CD-OG 3.31Å; P296-S299 WeakPolarHBondContact CD-OG 3.14Å; P296-S299 VanDerWaalsContact O-CB 3.27Å; P296-S299 WeakPolarHBondContact O-CB 3.33Å; P296-S299 PolarHBondContact O-N 3.45Å; P296-S299 PolarHBondContact O-OG 3.33Å
297	V	60	Low	74	Confident	88 Å²	88	69.4 Å²	69.4	53%	0.533	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	123.1	173.1	-178.4	0	0	0	0	109
298	G	62.2	Low	74.4	Confident	27 Å²	27	69.3 Å²	69.3	28%	0.278	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.3	-3.1	-176.3	0	0	0	0	0	114.9	P296 K300	P296-G298 PolarHBondContact O-N 3.31Å; G298-K300 PolarHBondContact O-N 3.09Å
299	S	74.4	Confident	74.6	Confident	28 Å²	28	71.9 Å²	71.9	20%	0.196	41%	0.411	C	S	.	.			trans	-59.7	128.8	172.2	-56.6	0	0	0	0	111.2	Q217 F218 P296	Q217-S299 WeakPolarHBondContact O-CA 3.37Å; F218-S299 VanDerWaalsContact CD1-OG 3.23Å; F218-S299 WeakPolarHBondContact CD1-OG 3.33Å; F218-S299 WeakPolarHBondContact CE1-OG 3.14Å; P296-S299 WeakPolarHBondContact CB-OG 3.38Å; P296-S299 VanDerWaalsContact CD-OG 3.31Å; P296-S299 WeakPolarHBondContact CD-OG 3.14Å; P296-S299 VanDerWaalsContact O-CB 3.27Å; P296-S299 WeakPolarHBondContact O-CB 3.33Å; P296-S299 PolarHBondContact O-N 3.45Å; P296-S299 PolarHBondContact O-OG 3.33Å
300	K	82.4	Confident	74.9	Confident	60 Å²	60	75.4 Å²	75.4	26%	0.261	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.9	171.9	-179.6	-179.4	179.3	-175.7	0	109.9	Y216 Q217 G298 N396 T398	Y216-K300 CarbonylContact C-O 3.59Å; Y216-K300 VanDerWaalsContact CA-O 3.31Å; Y216-K300 WeakPolarHBondContact CA-O 3.49Å; Q217-K300 HydrophobicContact CB-CB 4.22Å; Q217-K300 PolarHBondContact N-O 3.1Å; Q217-K300 PolarHBondContact O-N 3.44Å; G298-K300 PolarHBondContact O-N 3.09Å; K300-N396 VanDerWaalsContact NZ-CG 3.27Å; K300-N396 PolarHBondContact NZ-ND2 2.79Å; K300-N396 PolarHBondContact NZ-OD1 3.35Å; K300-T398 PolarHBondContact NZ-OG1 3.34Å
301	V	86.9	Confident	76.2	Confident	62 Å²	62	70.4 Å²	70.4	38%	0.376	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.9	177.4	-170.4	0	0	0	0	109.6	R214 M215 Y216 L295	R214-V301 HydrophobicContact CB-CG1 4.27Å; R214-V301 HydrophobicContact CG-CG1 4.42Å; M215-V301 CarbonylContact O-C 3.57Å; M215-V301 WeakPolarHBondContact O-CA 3.22Å; Y216-V301 HydrophobicContact CD1-CB 4.46Å; Y216-V301 HydrophobicContact CD1-CG1 4.17Å; Y216-V301 HydrophobicContact CD1-CG2 3.64Å; Y216-V301 HydrophobicContact CE1-CG1 3.94Å; Y216-V301 HydrophobicContact CE1-CG2 3.87Å; L295-V301 HydrophobicContact CD1-CG2 4.11Å
302	T	89.4	Confident	77.9	Confident	21 Å²	21	70.1 Å²	70.1	13%	0.129	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	125	172.3	-53.8	0	0	0	0	108.2	R214 M215 F304 Y336	R214-T302 CarbonylContact C-O 3.59Å; R214-T302 VanDerWaalsContact CA-O 3.3Å; R214-T302 WeakPolarHBondContact CA-O 3.37Å; M215-T302 PolarHBondContact N-O 3.08Å; M215-T302 PolarHBondContact O-N 3.3Å; T302-F304 HydrophobicContact CG2-CE2 3.82Å; T302-F304 HydrophobicContact CG2-CZ 4.26Å; T302-Y336 HydrophobicContact CG2-CE1 4.17Å
303	E	89.9	Confident	79.8	Confident	110 Å²	110	61.7 Å²	61.7	51%	0.514	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	140.6	-176.7	-175.8	163.4	-169.6	0	0	111	C213 R214	C213-E303 WeakPolarHBondContact O-CA 3.33Å; R214-E303 HydrophobicContact CG-CB 3.96Å; R214-E303 HydrophobicContact CG-CG 3.79Å; R214-E303 IonicContact CZ-OE1 3.73Å; R214-E303 IonicContact CZ-OE2 3.04Å; R214-E303 IonicContact NE-OE1 4Å; R214-E303 PolarHBondContact NE-OE1 3.25Å; R214-E303 IonicContact NE-OE2 3.83Å; R214-E303 PolarHBondContact NE-OE2 3.36Å; R214-E303 IonicContact NH2-OE1 3.52Å; R214-E303 PolarHBondContact NH2-OE1 3.07Å; R214-E303 IonicContact NH2-OE2 3.91Å; R214-E303 PolarHBondContact NH2-OE2 3.31Å
304	F	87.8	Confident	81.4	Confident	33 Å²	33	58.5 Å²	58.5	15%	0.145	33%	0.333	C	S	.	.			trans	-122	142.5	173.8	-73.1	-78.7	0	0	0	111.4	C213 T302 W329 T331 P333 Y336 L403	C213-F304 PolarHBondContact O-N 2.92Å; T302-F304 HydrophobicContact CG2-CE2 3.82Å; T302-F304 HydrophobicContact CG2-CZ 4.26Å; F304-W329 HydrophobicContact CD2-CE3 4.23Å; F304-W329 HydrophobicContact CD2-CH2 4.07Å; F304-W329 AromaticContact CD2-CZ3 3.53Å; F304-W329 HydrophobicContact CD2-CZ3 3.53Å; F304-W329 HydrophobicContact CE2-CE3 4.23Å; F304-W329 AromaticContact CE2-CZ3 3.81Å; F304-W329 HydrophobicContact CE2-CZ3 3.81Å; F304-T331 HydrophobicContact CD2-CG2 3.76Å; F304-T331 HydrophobicContact CE2-CG2 4.34Å; F304-T331 HydrophobicContact CG-CG2 4.32Å; F304-P333 HydrophobicContact CB-CG 4.26Å; F304-P333 HydrophobicContact CD1-CG 4.31Å; F304-Y336 HydrophobicContact CE1-CD2 4.49Å; F304-Y336 HydrophobicContact CE2-CD1 4.09Å; F304-Y336 AromaticContact CE2-CD2 3.74Å; F304-Y336 HydrophobicContact CE2-CD2 3.74Å; F304-Y336 HydrophobicContact CE2-CE2 4.27Å; F304-Y336 AromaticContact CE2-CG 3.61Å; F304-Y336 HydrophobicContact CE2-CG 3.61Å; F304-Y336 AromaticContact CZ-CD2 3.36Å; F304-Y336 HydrophobicContact CZ-CD2 3.36Å; F304-Y336 AromaticContact CZ-CE2 3.77Å; F304-Y336 HydrophobicContact CZ-CE2 3.77Å; F304-Y336 AromaticContact CZ-CG 3.76Å; F304-Y336 HydrophobicContact CZ-CG 3.76Å; F304-L403 HydrophobicContact CD1-CD1 4.47Å; F304-L403 HydrophobicContact CD1-CD2 4.39Å; F304-L403 HydrophobicContact CE1-CD1 4.09Å; F304-L403 HydrophobicContact CE1-CD2 4.13Å; F304-L403 HydrophobicContact CZ-CD1 4.32Å
305	P	83.2	Confident	82.6	Confident	108 Å²	108	50.5 Å²	50.5	70%	0.701	30%	0.3	S	S	*	.	S	Bend	trans	-73.1	135.8	174.3	30.5	-33.4	0	0	0	110.7	P333	P305-P333 WeakPolarHBondContact O-CD 3.44Å
306	G	75.7	Confident	83.4	Confident	48 Å²	48	48 Å²	48	50%	0.495	29%	0.287	S	S	.	.			trans	86.6	137.9	177.3	0	0	0	0	0	113.5	G332	G306-G332 WeakPolarHBondContact O-CA 3.48Å; G306-G332 PolarHBondContact O-N 2.9Å
307	S	82.7	Confident	84.3	Confident	49 Å²	49	50.7 Å²	50.7	34%	0.343	30%	0.295	S	S	.	.			trans	-146.3	148.7	-178.4	-175.3	0	0	0	0	111.2	P212 C213 G309	P212-S307 WeakPolarHBondContact CB-OG 3.26Å; P212-S307 WeakPolarHBondContact O-CB 3.47Å; P212-S307 PolarHBondContact O-OG 3.4Å; C213-S307 WeakPolarHBondContact SG-CB 3.34Å; S307-G309 PolarHBondContact OG-N 3.31Å
308	F	83.8	Confident	85.3	Confident	67 Å²	67	47.6 Å²	47.6	29%	0.294	28%	0.278	S	S	.	.			trans	-81.3	-2.8	169.3	-54.8	-59	0	0	0	112.5	Y310 T331 G332 Y406 V417 P418	F308-Y310 HydrophobicContact CB-CD1 3.74Å; F308-Y310 HydrophobicContact CB-CE1 3.43Å; F308-Y310 VanDerWaalsContact CB-CE1 3.43Å; F308-Y310 HydrophobicContact CB-CG 4.42Å; F308-Y310 HydrophobicContact CG-CE1 4.41Å; F308-Y310 WeakPolarHBondContact O-CD1 3.07Å; F308-T331 WeakPolarHBondContact CE2-O 3.49Å; F308-G332 WeakPolarHBondContact CZ-O 3.44Å; F308-Y406 AromaticContact CE2-CE2 3.94Å; F308-Y406 HydrophobicContact CE2-CE2 3.94Å; F308-Y406 AromaticContact CZ-CE2 3.85Å; F308-Y406 HydrophobicContact CZ-CE2 3.85Å; F308-V417 HydrophobicContact CD1-CG1 3.7Å; F308-V417 HydrophobicContact CE1-CG1 3.99Å; F308-V417 HydrophobicContact CG-CG1 4.05Å; F308-P418 HydrophobicContact CD2-CG 4.37Å; F308-P418 HydrophobicContact CE2-CG 3.68Å; F308-P418 HydrophobicContact CZ-CG 4.04Å
309	G	85	Confident	86	Confident	56 Å²	56	51.7 Å²	51.7	58%	0.577	30%	0.297	S	S	*	.	S	Bend	trans	85.3	-10	-169.6	0	0	0	0	0	113.4	P212 S307	P212-G309 WeakPolarHBondContact CG-O 3.29Å; S307-G309 PolarHBondContact OG-N 3.31Å
310	Y	88.7	Confident	85.9	Confident	82 Å²	82	59.6 Å²	59.6	32%	0.322	33%	0.328	S	S	.	.			trans	-134.9	163	173	62.3	-82.7	0	0	0	109.7	F308 M330 V417 P418	F308-Y310 HydrophobicContact CB-CD1 3.74Å; F308-Y310 HydrophobicContact CB-CE1 3.43Å; F308-Y310 VanDerWaalsContact CB-CE1 3.43Å; F308-Y310 HydrophobicContact CB-CG 4.42Å; F308-Y310 HydrophobicContact CG-CE1 4.41Å; F308-Y310 WeakPolarHBondContact O-CD1 3.07Å; Y310-M330 HydrophobicContact CD2-CE 3.52Å; Y310-M330 HydrophobicContact CE2-CE 3.34Å; Y310-V417 WeakPolarHBondContact OH-CG1 3.38Å; Y310-P418 PolarHBondContact OH-O 3.35Å
311	S	91.8	Very high	85.6	Confident	11 Å²	11	60.4 Å²	60.4	8%	0.077	34%	0.335	C	S	.	.			trans	-145.8	164.3	172.6	91.9	0	0	0	0	109.8	T183 W329 M330	T183-S311 WeakPolarHBondContact CB-OG 3.32Å; T183-S311 PolarHBondContact OG1-OG 2.8Å; S311-W329 VanDerWaalsContact CB-NE1 3.35Å; S311-W329 PolarHBondContact OG-NE1 3.44Å; S311-M330 VanDerWaalsContact CB-O 3.32Å; S311-M330 WeakPolarHBondContact CB-O 3.47Å
312	D	91.4	Very high	85	Confident	28 Å²	28	63.6 Å²	63.6	15%	0.15	35%	0.346	C	S	.	.			trans	-134.9	123.3	178.3	-172.8	17.3	0	0	0	108.5	K314 W329 M330 I421	D312-K314 VanDerWaalsContact OD1-CE 3.28Å; D312-K314 WeakPolarHBondContact OD1-CE 3.49Å; D312-K314 IonicContact OD1-NZ 3.33Å; D312-K314 PolarHBondContact OD1-NZ 2.81Å; D312-K314 VanDerWaalsContact OD2-CE 3.3Å; D312-K314 WeakPolarHBondContact OD2-CE 3.37Å; D312-K314 IonicContact OD2-NZ 3.75Å; D312-K314 PolarHBondContact OD2-NZ 3.49Å; D312-W329 WeakPolarHBondContact O-CA 3.4Å; D312-M330 HydrophobicContact CB-CB 4.17Å; D312-M330 HydrophobicContact CB-CE 3.94Å; D312-M330 PolarHBondContact O-N 3.32Å; D312-I421 HydrophobicContact CB-CG1 4.17Å; D312-I421 PolarHBondContact OD2-N 3.46Å
313	L	94.3	Very high	84.6	Confident	8 Å²	8	63.7 Å²	63.7	4%	0.042	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.9	177	177.4	67	0	0	0	108.5	E186 F208 T210 W329	E186-L313 HydrophobicContact CB-CD2 4.19Å; E186-L313 HydrophobicContact CG-CD2 3.85Å; E186-L313 HydrophobicContact CG-CG 4.36Å; F208-L313 HydrophobicContact CB-CD2 4.03Å; T210-L313 HydrophobicContact CG2-CB 4.11Å; T210-L313 HydrophobicContact CG2-CD1 4.2Å; T210-L313 HydrophobicContact CG2-CD2 4.04Å; T210-L313 HydrophobicContact CG2-CG 4.34Å; L313-W329 HydrophobicContact CD1-CB 4.06Å
314	K	92.8	Very high	84.4	Confident	69 Å²	69	59.2 Å²	59.2	30%	0.3	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.7	177.3	-63.3	-62.6	-174.9	-123.5	0	110.8	D312 F327 A328 I421 L423	D312-K314 VanDerWaalsContact OD1-CE 3.28Å; D312-K314 WeakPolarHBondContact OD1-CE 3.49Å; D312-K314 IonicContact OD1-NZ 3.33Å; D312-K314 PolarHBondContact OD1-NZ 2.81Å; D312-K314 VanDerWaalsContact OD2-CE 3.3Å; D312-K314 WeakPolarHBondContact OD2-CE 3.37Å; D312-K314 IonicContact OD2-NZ 3.75Å; D312-K314 PolarHBondContact OD2-NZ 3.49Å; K314-F327 CarbonylContact O-C 3.53Å; K314-F327 WeakPolarHBondContact O-CA 3.49Å; K314-A328 PolarHBondContact N-O 2.87Å; K314-A328 PolarHBondContact O-N 2.66Å; K314-I421 WeakPolarHBondContact CE-O 3.47Å; K314-I421 HydrophobicContact CG-CD1 4.41Å; K314-I421 HydrophobicContact CG-CG1 3.99Å; K314-L423 WeakPolarHBondContact O-CD1 3.44Å
315	L	91.9	Very high	84.5	Confident	35 Å²	35	58.9 Å²	58.9	18%	0.183	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	142	168.5	-58	-173.9	0	0	0	110.1	E186 I188 P324 K326 F327 I340	E186-L315 HydrophobicContact CB-CD1 3.67Å; E186-L315 HydrophobicContact CB-CG 4.25Å; E186-L315 HydrophobicContact CG-CD1 3.96Å; E186-L315 HydrophobicContact CG-CG 4.06Å; I188-L315 HydrophobicContact CD1-CD1 4.32Å; I188-L315 HydrophobicContact CG1-CD1 4.34Å; L315-P324 HydrophobicContact CB-CB 4.07Å; L315-P324 HydrophobicContact CD1-CB 4.37Å; L315-P324 HydrophobicContact CD1-CG 4.15Å; L315-K326 WeakPolarHBondContact CA-O 3.44Å; L315-F327 HydrophobicContact CD2-CB 3.38Å; L315-I340 HydrophobicContact CD2-CD1 4.06Å
316	Y	90.1	Very high	84.9	Confident	7 Å²	7	54.7 Å²	54.7	3%	0.027	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	125.4	171.8	-179.8	-86.3	0	0	0	109.5	P324 S325 K326 L423 T424 E425	Y316-P324 CarbonylContact O-C 3.55Å; Y316-P324 VanDerWaalsContact O-CA 3.32Å; Y316-P324 WeakPolarHBondContact O-CA 3.42Å; Y316-S325 PolarHBondContact O-N 3.13Å; Y316-K326 PolarHBondContact N-O 3Å; Y316-K326 PolarHBondContact O-N 2.97Å; Y316-L423 HydrophobicContact CD2-CB 4.18Å; Y316-T424 VanDerWaalsContact CD2-C 3.44Å; Y316-T424 WeakPolarHBondContact CD2-O 3.46Å; Y316-T424 WeakPolarHBondContact CE2-O 3.12Å; Y316-E425 HydrophobicContact CE1-CG 4.4Å; Y316-E425 HydrophobicContact CE2-CB 4.41Å; Y316-E425 VanDerWaalsContact CE2-N 3.29Å; Y316-E425 WeakPolarHBondContact OH-CB 3.21Å
317	R	86.5	Confident	85.7	Confident	67 Å²	67	52.4 Å²	52.4	25%	0.253	28%	0.275	S	S	.	.			trans	-118.2	130.8	168.5	-178.2	175.9	64	-170.8	0.2	108.4	D321 E322 P324	R317-D321 WeakPolarHBondContact CD-O 3.28Å; R317-D321 VanDerWaalsContact CG-O 3.25Å; R317-D321 WeakPolarHBondContact CG-O 3.29Å; R317-E322 WeakPolarHBondContact CD-O 3.46Å; R317-P324 HydrophobicContact CB-CB 4.45Å
318	S	80.6	Confident	86.3	Confident	24 Å²	24	50.1 Å²	50.1	17%	0.168	26%	0.259	C	S	.	.			trans	-73	151.7	171	-176.8	0	0	0	0	109.5	K320 D321	S318-K320 PolarHBondContact O-N 3.16Å; S318-K320 VanDerWaalsContact O-N 3.13Å; S318-D321 WeakPolarHBondContact CB-OD2 3.35Å; S318-D321 PolarHBondContact O-N 3.11Å; S318-D321 VanDerWaalsContact O-N 3.1Å
319	V	75.8	Confident	86.8	Confident	113 Å²	113	46.9 Å²	46.9	69%	0.685	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.7	177.6	-177.1	0	0	0	0	111.6
320	K	73.6	Confident	87.3	Confident	193 Å²	193	44.2 Å²	44.2	84%	0.839	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-19.9	179.1	-60.2	-178.8	-177.8	177.3	0	113.7	S318	S318-K320 PolarHBondContact O-N 3.16Å; S318-K320 VanDerWaalsContact O-N 3.13Å
321	D	75.5	Confident	87.4	Confident	77 Å²	77	40.5 Å²	40.5	41%	0.412	20%	0.203	S	C	.	.			trans	-101.2	135.7	-171.9	-60.5	-20.6	0	0	0	110.2	R317 S318	R317-D321 WeakPolarHBondContact CD-O 3.28Å; R317-D321 VanDerWaalsContact CG-O 3.25Å; R317-D321 WeakPolarHBondContact CG-O 3.29Å; S318-D321 WeakPolarHBondContact CB-OD2 3.35Å; S318-D321 PolarHBondContact O-N 3.11Å; S318-D321 VanDerWaalsContact O-N 3.1Å
322	E	74.9	Confident	87.2	Confident	130 Å²	130	40.8 Å²	40.8	61%	0.607	21%	0.207	S	C	*	.	S	Bend	trans	-74.4	-33.7	176.4	-59.9	-170.5	165.7	0	0	112.5	T192 R317	T192-E322 HydrophobicContact CG2-CB 4Å; T192-E322 PolarHBondContact OG1-OE2 3.45Å; R317-E322 WeakPolarHBondContact CD-O 3.46Å
323	L	80.3	Confident	87.1	Confident	22 Å²	22	42 Å²	42	12%	0.115	22%	0.217	C	C	.	.	S	Bend	trans	-102.5	150.9	-179.3	-68.1	174.2	0	0	0	111.4	I188 F190 T192 T342 L345	I188-L323 HydrophobicContact CG2-CD2 3.8Å; F190-L323 HydrophobicContact CD2-CD1 3.76Å; F190-L323 HydrophobicContact CD2-CD2 4.41Å; F190-L323 HydrophobicContact CD2-CG 4.4Å; F190-L323 HydrophobicContact CE2-CD1 4.24Å; T192-L323 HydrophobicContact CG2-CD2 3.67Å; T192-L323 HydrophobicContact CG2-CG 4.18Å; L323-T342 HydrophobicContact CB-CG2 3.76Å; L323-T342 HydrophobicContact CD1-CG2 3.96Å; L323-L345 HydrophobicContact CD1-CD1 4Å
324	P	86.9	Confident	86.9	Confident	16 Å²	16	41.6 Å²	41.6	10%	0.104	22%	0.215	C	C	.	.			trans	-67.1	141.4	171.8	30.2	-34.8	0	0	0	110.9	I188 L315 Y316 R317 I340 T342	I188-P324 HydrophobicContact CD1-CG 3.64Å; I188-P324 HydrophobicContact CG1-CG 3.9Å; L315-P324 HydrophobicContact CB-CB 4.07Å; L315-P324 HydrophobicContact CD1-CB 4.37Å; L315-P324 HydrophobicContact CD1-CG 4.15Å; Y316-P324 CarbonylContact O-C 3.55Å; Y316-P324 VanDerWaalsContact O-CA 3.32Å; Y316-P324 WeakPolarHBondContact O-CA 3.42Å; R317-P324 HydrophobicContact CB-CB 4.45Å; P324-I340 HydrophobicContact CB-CD1 3.94Å; P324-I340 HydrophobicContact CG-CD1 3.96Å; P324-T342 WeakPolarHBondContact O-CG2 3.34Å
325	S	88.1	Confident	86.9	Confident	27 Å²	27	38.3 Å²	38.3	19%	0.189	20%	0.201	C	C	.	.			trans	-106.6	-21.4	-175.8	59.5	0	0	0	0	113.7	Y316 Y339 I340	Y316-S325 PolarHBondContact O-N 3.13Å; S325-Y339 CarbonylContact O-C 3.55Å; S325-Y339 WeakPolarHBondContact O-CA 3.5Å; S325-I340 PolarHBondContact O-N 2.56Å
326	K	92.1	Very high	87	Confident	19 Å²	19	37.7 Å²	37.7	8%	0.083	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	156.2	-177.8	-48.7	172.6	-171.9	-174.8	0	111.1	L315 Y316 F337 G338 Y339 E425	L315-K326 WeakPolarHBondContact CA-O 3.44Å; Y316-K326 PolarHBondContact N-O 3Å; Y316-K326 PolarHBondContact O-N 2.97Å; K326-F337 HydrophobicContact CB-CE2 4.06Å; K326-F337 HydrophobicContact CB-CZ 4.47Å; K326-F337 HydrophobicContact CD-CE2 4.18Å; K326-F337 HydrophobicContact CD-CZ 4.05Å; K326-G338 CarbonylContact C-O 3.59Å; K326-G338 WeakPolarHBondContact CA-O 3.41Å; K326-Y339 HydrophobicContact CD-CD1 4.44Å; K326-Y339 HydrophobicContact CD-CE1 4.14Å; K326-Y339 HydrophobicContact CG-CD1 3.93Å; K326-Y339 HydrophobicContact CG-CE1 4.14Å; K326-E425 PolarHBondContact NZ-O 2.97Å
327	F	94	Very high	87.2	Confident	1 Å²	1	37.4 Å²	37.4	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	152.7	172.6	75	-83	0	0	0	110.8	M215 K314 L315 Y336 F337 G338 I340 T398 T401	M215-F327 HydrophobicContact CE-CE2 4.02Å; M215-F327 HydrophobicContact CE-CZ 4.39Å; M215-F327 HydrophobicContact SD-CD2 4.37Å; M215-F327 HydrophobicContact SD-CE2 4.07Å; K314-F327 CarbonylContact O-C 3.53Å; K314-F327 WeakPolarHBondContact O-CA 3.49Å; L315-F327 HydrophobicContact CD2-CB 3.38Å; F327-Y336 AromaticContact CE2-CD1 3.63Å; F327-Y336 HydrophobicContact CE2-CD1 3.63Å; F327-Y336 AromaticContact CE2-CE1 3.7Å; F327-Y336 HydrophobicContact CE2-CE1 3.7Å; F327-Y336 HydrophobicContact CZ-CD1 4.13Å; F327-Y336 AromaticContact CZ-CE1 3.76Å; F327-Y336 HydrophobicContact CZ-CE1 3.76Å; F327-F337 WeakPolarHBondContact O-CA 3.49Å; F327-F337 WeakPolarHBondContact O-CD2 3.39Å; F327-G338 WeakPolarHBondContact CD1-O 3.49Å; F327-G338 PolarHBondContact N-O 3.48Å; F327-G338 PolarHBondContact O-N 3.33Å; F327-I340 HydrophobicContact CB-CD1 4.42Å; F327-I340 HydrophobicContact CD1-CG1 4.07Å; F327-T398 HydrophobicContact CE1-CG2 3.62Å; F327-T398 HydrophobicContact CZ-CG2 3.63Å; F327-T401 HydrophobicContact CE1-CG2 4.09Å; F327-T401 HydrophobicContact CZ-CG2 3.76Å
328	A	94.8	Very high	87.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	134	170.8	0	0	0	0	0	109.8	K314 V335 Y336 F337 I421 L423 L428	K314-A328 PolarHBondContact N-O 2.87Å; K314-A328 PolarHBondContact O-N 2.66Å; A328-V335 HydrophobicContact CB-CG1 3.79Å; A328-Y336 CarbonylContact C-O 3.52Å; A328-Y336 WeakPolarHBondContact CA-O 3.34Å; A328-F337 HydrophobicContact CB-CD2 4.37Å; A328-I421 HydrophobicContact CB-CD1 3.88Å; A328-L423 HydrophobicContact CB-CD1 3.67Å; A328-L423 HydrophobicContact CB-CD2 3.76Å; A328-L423 HydrophobicContact CB-CG 3.78Å; A328-L428 HydrophobicContact CB-CD1 4.13Å
329	W	94.8	Very high	87.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.1	178.7	174.4	38.9	0	0	0	109.7	T210 T211 C213 M215 F304 S311 D312 L313 T331 V335 Y336	T210-W329 HydrophobicContact CG2-CD2 3.98Å; T210-W329 HydrophobicContact CG2-CG 3.88Å; T211-W329 WeakPolarHBondContact O-CZ2 3.36Å; C213-W329 WeakPolarHBondContact O-CH2 3.23Å; M215-W329 HydrophobicContact CB-CD2 4.19Å; M215-W329 HydrophobicContact CB-CE3 3.66Å; M215-W329 HydrophobicContact CB-CH2 4Å; M215-W329 HydrophobicContact CB-CZ2 4.48Å; M215-W329 HydrophobicContact CB-CZ3 3.54Å; M215-W329 VanDerWaalsContact N-CH2 3.34Å; M215-W329 HydrophobicContact SD-CE3 4.34Å; F304-W329 HydrophobicContact CD2-CE3 4.23Å; F304-W329 HydrophobicContact CD2-CH2 4.07Å; F304-W329 AromaticContact CD2-CZ3 3.53Å; F304-W329 HydrophobicContact CD2-CZ3 3.53Å; F304-W329 HydrophobicContact CE2-CE3 4.23Å; F304-W329 AromaticContact CE2-CZ3 3.81Å; F304-W329 HydrophobicContact CE2-CZ3 3.81Å; S311-W329 VanDerWaalsContact CB-NE1 3.35Å; S311-W329 PolarHBondContact OG-NE1 3.44Å; D312-W329 WeakPolarHBondContact O-CA 3.4Å; L313-W329 HydrophobicContact CD1-CB 4.06Å; W329-T331 HydrophobicContact CD2-CG2 3.53Å; W329-T331 HydrophobicContact CE3-CG2 3.57Å; W329-T331 HydrophobicContact CG-CG2 4.12Å; W329-T331 HydrophobicContact CH2-CG2 3.95Å; W329-T331 HydrophobicContact CZ2-CG2 3.93Å; W329-T331 HydrophobicContact CZ3-CG2 3.81Å; W329-T331 PolarHBondContact O-N 3.4Å; W329-V335 CarbonylContact O-C 3.48Å; W329-V335 WeakPolarHBondContact O-CA 3.41Å; W329-Y336 HydrophobicContact CE3-CD1 4.14Å; W329-Y336 PolarHBondContact N-O 3.28Å; W329-Y336 PolarHBondContact O-N 3.27Å
330	M	93.5	Very high	88.5	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	117.5	178.2	-171.5	179.5	67.8	0	0	110.1	Y310 S311 D312 Y406 P418 I421	Y310-M330 HydrophobicContact CD2-CE 3.52Å; Y310-M330 HydrophobicContact CE2-CE 3.34Å; S311-M330 VanDerWaalsContact CB-O 3.32Å; S311-M330 WeakPolarHBondContact CB-O 3.47Å; D312-M330 HydrophobicContact CB-CB 4.17Å; D312-M330 HydrophobicContact CB-CE 3.94Å; D312-M330 PolarHBondContact O-N 3.32Å; M330-Y406 HydrophobicContact CG-CE1 4.48Å; M330-Y406 WeakPolarHBondContact CG-OH 3.44Å; M330-P418 HydrophobicContact CG-CG 4.33Å; M330-P418 HydrophobicContact SD-CB 3.92Å; M330-P418 HydrophobicContact SD-CG 3.83Å; M330-I421 HydrophobicContact CB-CD1 4.02Å; M330-I421 HydrophobicContact CB-CG1 4.29Å; M330-I421 HydrophobicContact CB-CG2 4.23Å; M330-I421 HydrophobicContact CG-CG2 4.22Å; M330-I421 HydrophobicContact SD-CG2 4.12Å
331	T	91.8	Very high	88.8	Confident	3 Å²	3	26.5 Å²	26.5	2%	0.018	13%	0.133	C	C	.	.			trans	-121.4	169.5	-179.2	70.4	0	0	0	0	110.6	F304 F308 W329 P333 G334 Y406	F304-T331 HydrophobicContact CD2-CG2 3.76Å; F304-T331 HydrophobicContact CE2-CG2 4.34Å; F304-T331 HydrophobicContact CG-CG2 4.32Å; F308-T331 WeakPolarHBondContact CE2-O 3.49Å; W329-T331 HydrophobicContact CD2-CG2 3.53Å; W329-T331 HydrophobicContact CE3-CG2 3.57Å; W329-T331 HydrophobicContact CG-CG2 4.12Å; W329-T331 HydrophobicContact CH2-CG2 3.95Å; W329-T331 HydrophobicContact CZ2-CG2 3.93Å; W329-T331 HydrophobicContact CZ3-CG2 3.81Å; W329-T331 PolarHBondContact O-N 3.4Å; T331-P333 WeakPolarHBondContact OG1-CD 3.08Å; T331-G334 CarbonylContact C-O 3.49Å; T331-G334 WeakPolarHBondContact CA-O 3.46Å; T331-G334 WeakPolarHBondContact CB-O 3.26Å; T331-G334 PolarHBondContact N-O 2.55Å; T331-G334 PolarHBondContact O-N 2.9Å; T331-G334 VanDerWaalsContact O-O 3.05Å; T331-G334 PolarHBondContact OG1-O 3.16Å; T331-Y406 PolarHBondContact N-OH 2.94Å; T331-Y406 WeakPolarHBondContact O-CE2 3.48Å; T331-Y406 PolarHBondContact O-OH 2.9Å
332	G	87.5	Confident	88.7	Confident	17 Å²	17	25.1 Å²	25.1	18%	0.175	13%	0.128	C	C	.	.	S	Bend	trans	-52.6	-50.4	175.6	0	0	0	0	0	114.9	G306 F308	G306-G332 WeakPolarHBondContact O-CA 3.48Å; G306-G332 PolarHBondContact O-N 2.9Å; F308-G332 WeakPolarHBondContact CZ-O 3.44Å
333	P	88.9	Confident	88.4	Confident	54 Å²	54	25 Å²	25	35%	0.351	13%	0.127	S	C	.	.	S	Bend	trans	-80.5	-18	-176.3	28.7	-34.6	0	0	0	114.7	F304 P305 T331 L403	F304-P333 HydrophobicContact CB-CG 4.26Å; F304-P333 HydrophobicContact CD1-CG 4.31Å; P305-P333 WeakPolarHBondContact O-CD 3.44Å; T331-P333 WeakPolarHBondContact OG1-CD 3.08Å; P333-L403 HydrophobicContact CB-CD2 4.24Å; P333-L403 HydrophobicContact CG-CD2 4.12Å
334	G	90.3	Very high	87.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.6	-166.6	-175.7	0	0	0	0	0	112.5	T331 I404 Y406	T331-G334 CarbonylContact C-O 3.49Å; T331-G334 WeakPolarHBondContact CA-O 3.46Å; T331-G334 WeakPolarHBondContact CB-O 3.26Å; T331-G334 PolarHBondContact N-O 2.55Å; T331-G334 PolarHBondContact O-N 2.9Å; T331-G334 VanDerWaalsContact O-O 3.05Å; T331-G334 PolarHBondContact OG1-O 3.16Å; G334-I404 CarbonylContact C-O 3.59Å; G334-I404 VanDerWaalsContact CA-O 3.29Å; G334-I404 WeakPolarHBondContact CA-O 3.12Å; G334-Y406 VanDerWaalsContact CA-CE2 3.41Å; G334-Y406 PolarHBondContact O-OH 3.3Å
335	V	92.9	Very high	86.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	117.2	174.1	-177.3	0	0	0	0	109.3	A328 W329 F337 I404 Y406 I421 L428 I430	A328-V335 HydrophobicContact CB-CG1 3.79Å; W329-V335 CarbonylContact O-C 3.48Å; W329-V335 WeakPolarHBondContact O-CA 3.41Å; V335-F337 PolarHBondContact O-N 2.66Å; V335-I404 PolarHBondContact N-O 3.23Å; V335-I404 PolarHBondContact O-N 3.19Å; V335-Y406 HydrophobicContact CG2-CD1 4.44Å; V335-Y406 HydrophobicContact CG2-CE1 3.63Å; V335-I421 HydrophobicContact CG1-CD1 3.96Å; V335-I421 HydrophobicContact CG2-CG2 4.09Å; V335-L428 HydrophobicContact CB-CD2 3.6Å; V335-L428 HydrophobicContact CG1-CD1 4.01Å; V335-L428 HydrophobicContact CG1-CD2 3.62Å; V335-L428 HydrophobicContact CG1-CG 4.47Å; V335-L428 HydrophobicContact CG2-CD2 3.85Å; V335-I430 HydrophobicContact CG2-CD1 4.29Å
336	Y	93.8	Very high	85.7	Confident	22 Å²	22	27.7 Å²	27.7	9%	0.086	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	107.6	174.2	-175.2	-120	0	0	0	109.3	M215 T302 F304 F327 A328 W329 T401	M215-Y336 HydrophobicContact CE-CD1 4.32Å; M215-Y336 HydrophobicContact CE-CE1 3.87Å; T302-Y336 HydrophobicContact CG2-CE1 4.17Å; F304-Y336 HydrophobicContact CE1-CD2 4.49Å; F304-Y336 HydrophobicContact CE2-CD1 4.09Å; F304-Y336 AromaticContact CE2-CD2 3.74Å; F304-Y336 HydrophobicContact CE2-CD2 3.74Å; F304-Y336 HydrophobicContact CE2-CE2 4.27Å; F304-Y336 AromaticContact CE2-CG 3.61Å; F304-Y336 HydrophobicContact CE2-CG 3.61Å; F304-Y336 AromaticContact CZ-CD2 3.36Å; F304-Y336 HydrophobicContact CZ-CD2 3.36Å; F304-Y336 AromaticContact CZ-CE2 3.77Å; F304-Y336 HydrophobicContact CZ-CE2 3.77Å; F304-Y336 AromaticContact CZ-CG 3.76Å; F304-Y336 HydrophobicContact CZ-CG 3.76Å; F327-Y336 AromaticContact CE2-CD1 3.63Å; F327-Y336 HydrophobicContact CE2-CD1 3.63Å; F327-Y336 AromaticContact CE2-CE1 3.7Å; F327-Y336 HydrophobicContact CE2-CE1 3.7Å; F327-Y336 HydrophobicContact CZ-CD1 4.13Å; F327-Y336 AromaticContact CZ-CE1 3.76Å; F327-Y336 HydrophobicContact CZ-CE1 3.76Å; A328-Y336 CarbonylContact C-O 3.52Å; A328-Y336 WeakPolarHBondContact CA-O 3.34Å; W329-Y336 HydrophobicContact CE3-CD1 4.14Å; W329-Y336 PolarHBondContact N-O 3.28Å; W329-Y336 PolarHBondContact O-N 3.27Å; Y336-T401 HydrophobicContact CE1-CG2 4.34Å; Y336-T401 HydrophobicContact CE2-CG2 4.42Å; Y336-T401 VanDerWaalsContact OH-CB 3.26Å; Y336-T401 WeakPolarHBondContact OH-CB 3.43Å; Y336-T401 WeakPolarHBondContact OH-CG2 3.47Å; Y336-T401 PolarHBondContact OH-OG1 3.42Å
337	F	93.8	Very high	84.1	Confident	1 Å²	1	30.6 Å²	30.6	0%	0.004	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	143.2	-174.6	167.6	-95.4	0	0	0	110.5	K326 F327 A328 V335 Y339 T401 K402 I404 L423 T441	K326-F337 HydrophobicContact CB-CE2 4.06Å; K326-F337 HydrophobicContact CB-CZ 4.47Å; K326-F337 HydrophobicContact CD-CE2 4.18Å; K326-F337 HydrophobicContact CD-CZ 4.05Å; F327-F337 WeakPolarHBondContact O-CA 3.49Å; F327-F337 WeakPolarHBondContact O-CD2 3.39Å; A328-F337 HydrophobicContact CB-CD2 4.37Å; V335-F337 PolarHBondContact O-N 2.66Å; F337-Y339 HydrophobicContact CE1-CD2 4.47Å; F337-Y339 AromaticContact CE1-CE2 3.91Å; F337-Y339 HydrophobicContact CE1-CE2 3.91Å; F337-Y339 HydrophobicContact CZ-CE2 4.21Å; F337-T401 CarbonylContact O-C 3.54Å; F337-T401 VanDerWaalsContact O-CA 3.28Å; F337-T401 WeakPolarHBondContact O-CA 3.45Å; F337-K402 HydrophobicContact CD1-CG 4.11Å; F337-K402 PolarHBondContact N-O 3.1Å; F337-K402 PolarHBondContact O-N 2.96Å; F337-I404 HydrophobicContact CB-CD1 3.88Å; F337-I404 HydrophobicContact CB-CG1 4.35Å; F337-I404 HydrophobicContact CD1-CD1 4.32Å; F337-I404 HydrophobicContact CG-CD1 4.17Å; F337-L423 HydrophobicContact CD2-CD2 4.03Å; F337-L423 HydrophobicContact CE2-CD2 4.07Å; F337-T441 HydrophobicContact CD2-CG2 4.28Å; F337-T441 HydrophobicContact CE1-CG2 4.44Å; F337-T441 HydrophobicContact CE2-CG2 3.82Å; F337-T441 HydrophobicContact CZ-CG2 3.91Å
338	G	92	Very high	82	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	177.7	173.6	0	0	0	0	0	113.5	K326 F327	K326-G338 CarbonylContact C-O 3.59Å; K326-G338 WeakPolarHBondContact CA-O 3.41Å; F327-G338 WeakPolarHBondContact CD1-O 3.49Å; F327-G338 PolarHBondContact N-O 3.48Å; F327-G338 PolarHBondContact O-N 3.33Å
339	Y	90.4	Very high	79.8	Confident	64 Å²	64	36.6 Å²	36.6	25%	0.251	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	152.4	176.9	-65.3	-101.9	0	0	0	110.2	S325 K326 F337 R399 N400	S325-Y339 CarbonylContact O-C 3.55Å; S325-Y339 WeakPolarHBondContact O-CA 3.5Å; K326-Y339 HydrophobicContact CD-CD1 4.44Å; K326-Y339 HydrophobicContact CD-CE1 4.14Å; K326-Y339 HydrophobicContact CG-CD1 3.93Å; K326-Y339 HydrophobicContact CG-CE1 4.14Å; F337-Y339 HydrophobicContact CE1-CD2 4.47Å; F337-Y339 AromaticContact CE1-CE2 3.91Å; F337-Y339 HydrophobicContact CE1-CE2 3.91Å; F337-Y339 HydrophobicContact CZ-CE2 4.21Å; Y339-R399 PolarHBondContact N-O 3.06Å; Y339-R399 PolarHBondContact O-N 3.3Å; Y339-N400 HydrophobicContact CD2-CB 4.02Å
340	I	88.3	Confident	77.6	Confident	10 Å²	10	42.6 Å²	42.6	5%	0.051	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	124.5	177.8	-58.2	175.6	0	0	0	108.3	I188 L315 P324 S325 F327 T342 L397	I188-I340 HydrophobicContact CD1-CD1 4.12Å; I188-I340 HydrophobicContact CD1-CG2 4.36Å; L315-I340 HydrophobicContact CD2-CD1 4.06Å; P324-I340 HydrophobicContact CB-CD1 3.94Å; P324-I340 HydrophobicContact CG-CD1 3.96Å; S325-I340 PolarHBondContact O-N 2.56Å; F327-I340 HydrophobicContact CB-CD1 4.42Å; F327-I340 HydrophobicContact CD1-CG1 4.07Å; I340-T342 VanDerWaalsContact C-N 3.28Å; I340-T342 HydrophobicContact CG2-CG2 4.45Å; I340-T342 PolarHBondContact O-N 3.3Å; I340-L397 CarbonylContact C-O 3.59Å; I340-L397 VanDerWaalsContact CA-O 3.31Å; I340-L397 WeakPolarHBondContact CA-O 3.5Å; I340-L397 HydrophobicContact CG2-CB 4.3Å; I340-L397 HydrophobicContact CG2-CD1 4.33Å
341	R	80.8	Confident	75.2	Confident	93 Å²	93	44.7 Å²	44.7	35%	0.351	24%	0.236	S	C	.	.			trans	-75	78.3	175.4	-61.3	-173.3	-179.7	-161.7	-6.9	109.9	E343 Q344 L397 R399	R341-E343 PolarHBondContact O-N 3.43Å; R341-Q344 HydrophobicContact CB-CB 4.38Å; R341-Q344 HydrophobicContact CB-CG 4.12Å; R341-Q344 PolarHBondContact O-N 2.99Å; R341-Q344 VanDerWaalsContact O-N 3.16Å; R341-L397 PolarHBondContact N-O 3.1Å; R341-R399 HydrophobicContact CG-CB 3.61Å; R341-R399 HydrophobicContact CG-CG 4.37Å
342	T	73.4	Confident	72.5	Confident	48 Å²	48	53.5 Å²	53.5	29%	0.294	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-31	176.1	51.3	0	0	0	0	112.1	L323 P324 I340 Q344 L345 S346	L323-T342 HydrophobicContact CB-CG2 3.76Å; L323-T342 HydrophobicContact CD1-CG2 3.96Å; P324-T342 WeakPolarHBondContact O-CG2 3.34Å; I340-T342 VanDerWaalsContact C-N 3.28Å; I340-T342 HydrophobicContact CG2-CG2 4.45Å; I340-T342 PolarHBondContact O-N 3.3Å; T342-Q344 VanDerWaalsContact C-N 3.26Å; T342-Q344 PolarHBondContact O-N 3.26Å; T342-L345 WeakPolarHBondContact O-CB 3.36Å; T342-L345 PolarHBondContact O-N 3.12Å; T342-S346 PolarHBondContact O-N 3.17Å
343	E	68.2	Low	69.9	Low	128 Å²	128	59.4 Å²	59.4	60%	0.598	30%	0.301	S	S	*	.	H	α-helix	trans	-55.7	-35.7	174.2	-64.4	160.4	-165.5	0	0	113.2	R341 L345 S346 M347	R341-E343 PolarHBondContact O-N 3.43Å; E343-L345 VanDerWaalsContact C-N 3.26Å; E343-L345 PolarHBondContact O-N 3.02Å; E343-S346 PolarHBondContact O-N 2.8Å; E343-S346 PolarHBondContact O-OG 3.33Å; E343-M347 WeakPolarHBondContact O-CG 3.36Å; E343-M347 PolarHBondContact O-N 3.45Å
344	Q	67.4	Low	67	Low	54 Å²	54	61.1 Å²	61.1	25%	0.252	31%	0.313	S	S	.	.	H	α-helix	trans	-71.3	-23.7	178.3	-72.8	-169.7	-22	0	0	112.7	R341 T342 S346 N396 L397	R341-Q344 HydrophobicContact CB-CB 4.38Å; R341-Q344 HydrophobicContact CB-CG 4.12Å; R341-Q344 PolarHBondContact O-N 2.99Å; R341-Q344 VanDerWaalsContact O-N 3.16Å; T342-Q344 VanDerWaalsContact C-N 3.26Å; T342-Q344 PolarHBondContact O-N 3.26Å; Q344-S346 VanDerWaalsContact C-N 3.32Å; Q344-N396 PolarHBondContact OE1-O 2.9Å; Q344-L397 HydrophobicContact CB-CD2 4.22Å
345	L	67.9	Low	64.2	Low	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-73	-28.5	173.9	-64.5	166.6	0	0	0	111.1	I188 F190 V206 L323 T342 E343 F390 L397	I188-L345 HydrophobicContact CG2-CD1 3.75Å; F190-L345 HydrophobicContact CB-CB 3.9Å; F190-L345 HydrophobicContact CD1-CB 4.31Å; F190-L345 WeakPolarHBondContact CD1-O 3.46Å; F190-L345 HydrophobicContact CG-CB 4.01Å; V206-L345 HydrophobicContact CG2-CD2 3.93Å; L323-L345 HydrophobicContact CD1-CD1 4Å; T342-L345 WeakPolarHBondContact O-CB 3.36Å; T342-L345 PolarHBondContact O-N 3.12Å; E343-L345 VanDerWaalsContact C-N 3.26Å; E343-L345 PolarHBondContact O-N 3.02Å; L345-F390 HydrophobicContact CD2-CE1 4.36Å; L345-F390 HydrophobicContact CD2-CZ 4.17Å; L345-L397 HydrophobicContact CD1-CD1 4.29Å; L345-L397 HydrophobicContact CD1-CD2 4.43Å; L345-L397 HydrophobicContact CD2-CD1 4.17Å; L345-L397 HydrophobicContact CD2-CD2 4.02Å; L345-L397 HydrophobicContact CG-CD1 4.4Å; L345-L397 HydrophobicContact CG-CD2 3.88Å
346	S	63.9	Low	60.9	Low	68 Å²	68	73.4 Å²	73.4	48%	0.476	38%	0.384	S	S	.	.	H	α-helix	trans	-90.7	-11.9	-178	63.5	0	0	0	0	115.5	T342 E343 Q344	T342-S346 PolarHBondContact O-N 3.17Å; E343-S346 PolarHBondContact O-N 2.8Å; E343-S346 PolarHBondContact O-OG 3.33Å; Q344-S346 VanDerWaalsContact C-N 3.32Å
347	M	57.7	Low	57.8	Low	80 Å²	80	80.1 Å²	80.1	39%	0.394	42%	0.421	S	S	.	.	S	Bend	trans	-58.9	142.7	-180	-73.5	-62.5	-69.8	0	0	112.5	R204 E343 T351	R204-M347 PolarHBondContact NH1-O 3.45Å; R204-M347 PolarHBondContact NH2-O 3.38Å; E343-M347 WeakPolarHBondContact O-CG 3.36Å; E343-M347 PolarHBondContact O-N 3.45Å; M347-T351 HydrophobicContact CE-CG2 3.44Å; M347-T351 VanDerWaalsContact CE-CG2 3.44Å
348	P	49.3	Very low	54.5	Low	76 Å²	76	87.5 Å²	87.5	49%	0.494	46%	0.456	S	S	.	.			trans	-57.5	149.2	176.2	-21.8	31.8	0	0	0	112.8	F350 T351	P348-F350 PolarHBondContact O-N 2.87Å; P348-T351 PolarHBondContact O-OG1 3.46Å
349	P	50.1	Low	51.4	Low	50 Å²	50	92.8 Å²	92.8	33%	0.325	49%	0.49	S	S	.	.	S	Bend	trans	-56.9	-22.9	-175.6	16.2	-26.6	0	0	0	114.4	W221	W221-P349 HydrophobicContact CH2-CB 4.05Å; W221-P349 HydrophobicContact CZ2-CB 4.34Å
350	F	48.4	Very low	48.4	Very low	127 Å²	127	97.4 Å²	97.4	56%	0.557	52%	0.518	S	S	*	.	S	Bend	trans	-128.2	87.8	-179.7	-52.5	-71.8	0	0	0	109.9	P348 L386	P348-F350 PolarHBondContact O-N 2.87Å; F350-L386 HydrophobicContact CB-CD2 4.24Å; F350-L386 HydrophobicContact CD1-CB 4.21Å
351	T	41.6	Very low	45.4	Very low	44 Å²	44	103.5 Å²	103.5	27%	0.27	55%	0.55	S	S	.	*			trans	-111.2	124.9	174.8	-39	0	0	0	0	109.3	M347 P348 L353	M347-T351 HydrophobicContact CE-CG2 3.44Å; M347-T351 VanDerWaalsContact CE-CG2 3.44Å; P348-T351 PolarHBondContact O-OG1 3.46Å; T351-L353 PolarHBondContact O-N 3.11Å; T351-L353 VanDerWaalsContact O-N 3.11Å
352	K	35.9	Very low	43	Very low	187 Å²	187	105.4 Å²	105.4	81%	0.813	57%	0.572	S	S	*	*			trans	-61.4	113.7	170.6	-81.9	-177.6	174.8	-179.2	0	108.1	S354	K352-S354 PolarHBondContact O-N 3.43Å
353	L	32.5	Very low	40.8	Very low	142 Å²	142	111.5 Å²	111.5	74%	0.743	59%	0.594	S	S	*	*			trans	-63.4	106.8	165	-100.9	89.9	0	0	0	107.5	T351 T355 I389	T351-L353 PolarHBondContact O-N 3.11Å; T351-L353 VanDerWaalsContact O-N 3.11Å; L353-T355 PolarHBondContact O-N 2.74Å; L353-I389 HydrophobicContact CD1-CD1 4.23Å; L353-I389 HydrophobicContact CD1-CG1 4.27Å
354	S	29	Very low	38.9	Very low	89 Å²	89	109.9 Å²	109.9	62%	0.622	60%	0.597	S	S	*	*			trans	-70.9	112.9	156.8	58.6	0	0	0	0	106.9	K352 N356	K352-S354 PolarHBondContact O-N 3.43Å; S354-N356 PolarHBondContact O-N 3.25Å
355	T	30.1	Very low	37.1	Very low	126 Å²	126	116.9 Å²	116.9	77%	0.773	63%	0.627	S	S	*	*	S	Bend	trans	-62.8	78.8	160.9	50.1	0	0	0	0	108	L353	L353-T355 PolarHBondContact O-N 2.74Å
356	N	25.1	Very low	35.1	Very low	133 Å²	133	122.5 Å²	122.5	71%	0.711	66%	0.664	S	S	*	*			trans	-166.7	25.6	173	-96.7	-13	0	0	0	114.1	S354 Q358	S354-N356 PolarHBondContact O-N 3.25Å; N356-Q358 PolarHBondContact O-N 3.43Å
357	D	28.6	Very low	33.1	Very low	162 Å²	162	124.3 Å²	124.3	87%	0.866	68%	0.676	S	S	*	*			trans	-75.7	73.2	157.8	-81.3	-12.8	0	0	0	108.3
358	Q	24.7	Very low	31.8	Very low	157 Å²	157	129.8 Å²	129.8	73%	0.734	70%	0.701	S	S	*	*			trans	-66.1	137.1	158	-73.7	-140.9	-15.8	0	0	108.1	N356 I360	N356-Q358 PolarHBondContact O-N 3.43Å; Q358-I360 PolarHBondContact O-N 2.95Å; Q358-I360 VanDerWaalsContact O-N 3.14Å
359	P	26.1	Very low	30.8	Very low	110 Å²	110	130.6 Å²	130.6	71%	0.714	71%	0.714	S	S	*	*			trans	-62	121.9	173.5	27.8	-30.4	0	0	0	107.2	D361	P359-D361 PolarHBondContact O-N 3.35Å
360	I	28.3	Very low	29.7	Very low	162 Å²	162	134.6 Å²	134.6	83%	0.831	74%	0.737	S	S	*	*			trans	-58.2	112.3	169	-66.8	170.7	0	0	0	106.4	Q358 V362	Q358-I360 PolarHBondContact O-N 2.95Å; Q358-I360 VanDerWaalsContact O-N 3.14Å; I360-V362 PolarHBondContact O-N 3.18Å; I360-V362 VanDerWaalsContact O-N 3.1Å
361	D	25.3	Very low	28.7	Very low	137 Å²	137	133.5 Å²	133.5	73%	0.733	75%	0.746	S	S	*	*			trans	-50.6	107	178.1	-102.4	-29	0	0	0	110.6	P359	P359-D361 PolarHBondContact O-N 3.35Å
362	V	29.5	Very low	28.1	Very low	134 Å²	134	137.9 Å²	137.9	81%	0.812	77%	0.772	S	S	*	*			trans	-94.1	95.3	153.9	-178.9	0	0	0	0	106.1	I360 S364	I360-V362 PolarHBondContact O-N 3.18Å; I360-V362 VanDerWaalsContact O-N 3.1Å; V362-S364 PolarHBondContact O-N 3.31Å
363	K	27.9	Very low	27.4	Very low	175 Å²	175	137 Å²	137	76%	0.761	78%	0.776	S	S	*	*			trans	-59.8	114.7	170	-74.6	176.9	176.8	174	0	109.6
364	S	27.7	Very low	27.2	Very low	95 Å²	95	135.9 Å²	135.9	66%	0.664	78%	0.777	S	S	*	*			trans	137.5	98.3	144.1	60.4	0	0	0	0	111.1	V362	V362-S364 PolarHBondContact O-N 3.31Å
365	F	28.7	Very low	26.9	Very low	201 Å²	201	137.9 Å²	137.9	88%	0.882	79%	0.785	S	S	*	*				-173.7	140.5	129.1	-90.2	-66.5	0	0	0	107.9
366	P	27.5	Very low	26.8	Very low	117 Å²	117	138.6 Å²	138.6	76%	0.76	79%	0.79	S	S	*	*			trans	-80	145.3	-167.5	-3.9	22	0	0	0	113.2
367	S	21.8	Very low	26.9	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	79%	0.789	S	S	*	*			trans	-11.8	135.2	157.1	57.8	0	0	0	0	119.1
368	E	29	Very low	26.8	Very low	195 Å²	195	137.9 Å²	137.9	91%	0.911	79%	0.79	S	S	*	*				-165.9	133.4	125	-106.5	171.3	-164.4	0	0	112.9
369	A	29.6	Very low	27	Very low	93 Å²	93	137.2 Å²	137.2	77%	0.769	79%	0.792	S	S	*	*			trans	62.5	99.1	160.7	0	0	0	0	0	119.9
370	V	26.8	Very low	27.2	Very low	134 Å²	134	138.3 Å²	138.3	81%	0.812	80%	0.796	S	S	*	*				80.8	116.5	68.6	177.1	0	0	0	0	115.3
371	S	26.5	Very low	27.6	Very low	105 Å²	105	136 Å²	136	73%	0.734	79%	0.786	S	S	*	*			trans	86.7	137.7	143.5	73.3	0	0	0	0	120
372	T	29	Very low	28.1	Very low	135 Å²	135	134.8 Å²	134.8	83%	0.828	78%	0.779	S	S	*	*			cis	-157.9	137.1	14.9	34.6	0	0	0	0	109.6
373	L	21.6	Very low	28.9	Very low	169 Å²	169	134.2 Å²	134.2	89%	0.885	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-97.7	140.8	161.8	-97.4	120.8	0	0	0	109.7
374	P	27.7	Very low	29.4	Very low	118 Å²	118	133.1 Å²	133.1	77%	0.766	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-93.1	117.1	159.3	15.8	1.6	0	0	0	110.7
375	T	23.2	Very low	29.9	Very low	131 Å²	131	135 Å²	135	80%	0.804	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-68.2	125.1	161.5	43.7	0	0	0	0	110.4
376	T	28.7	Very low	30.3	Very low	141 Å²	141	131 Å²	131	87%	0.865	77%	0.767	S	S	*	*			trans	-131.9	122.1	152	42.9	0	0	0	0	108.8
377	T	26.7	Very low	31.1	Very low	112 Å²	112	131 Å²	131	69%	0.687	75%	0.754	S	S	*	*			trans	-69.9	132.6	177.7	46.3	0	0	0	0	110.7
378	D	27.2	Very low	32.5	Very low	168 Å²	168	127.5 Å²	127.5	90%	0.898	73%	0.727	S	S	*	*			trans	-142.5	111.1	140.2	-98.1	-26.2	0	0	0	108.3
379	N	27.2	Very low	33.7	Very low	144 Å²	144	120.1 Å²	120.1	77%	0.77	69%	0.694	S	S	*	*			trans	-91.3	111.3	177.8	-72.8	-40.6	0	0	0	108
380	T	30.3	Very low	35.1	Very low	132 Å²	132	116.3 Å²	116.3	81%	0.81	66%	0.66	S	S	*	*			trans	-178.6	88.8	145.9	44.8	0	0	0	0	107.1
381	D	37.5	Very low	36.4	Very low	115 Å²	115	113.8 Å²	113.8	62%	0.615	65%	0.648	S	S	*	*			trans	-146.8	124.3	167	-87.3	-40.2	0	0	0	110	K387	D381-K387 IonicContact OD1-NZ 3.97Å; D381-K387 IonicContact OD2-NZ 3.96Å; D381-K387 PolarHBondContact OD2-NZ 3.3Å
382	D	36.6	Very low	37.4	Very low	111 Å²	111	110.1 Å²	110.1	59%	0.594	63%	0.627	S	S	*	*			trans	-64.1	122.2	-173.7	-142.6	-9	0	0	0	110.4	N384 Q385	D382-N384 PolarHBondContact O-N 3.45Å; D382-Q385 PolarHBondContact O-N 2.81Å
383	P	45.3	Very low	38.5	Very low	122 Å²	122	114.7 Å²	114.7	79%	0.792	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-3	-174.4	24.5	-32.3	0	0	0	114.5
384	N	39.7	Very low	40.1	Very low	151 Å²	151	108.8 Å²	108.8	81%	0.807	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-2.5	179.3	-75.1	-28.5	0	0	0	114.7	D382	D382-N384 PolarHBondContact O-N 3.45Å
385	Q	37.6	Very low	41.9	Very low	134 Å²	134	103.8 Å²	103.8	63%	0.626	58%	0.576	S	S	*	*	S	Bend	trans	-82.3	122.7	175.5	-94	-175.1	10.1	0	0	112	D382 K387	D382-Q385 PolarHBondContact O-N 2.81Å; Q385-K387 PolarHBondContact O-N 2.69Å
386	L	36.5	Very low	44.4	Very low	119 Å²	119	100.1 Å²	100.1	62%	0.623	55%	0.551	S	S	*	*			trans	-63.1	103.9	167.4	-71.5	162.7	0	0	0	108.6	F350	F350-L386 HydrophobicContact CB-CD2 4.24Å; F350-L386 HydrophobicContact CD1-CB 4.21Å
387	K	43.8	Very low	46.9	Very low	116 Å²	116	93.4 Å²	93.4	50%	0.504	51%	0.51	S	S	.	.			trans	-86.9	132	174.4	-76.4	-177.7	173	-176.5	0	110.4	D381 Q385 I389	D381-K387 IonicContact OD1-NZ 3.97Å; D381-K387 IonicContact OD2-NZ 3.96Å; D381-K387 PolarHBondContact OD2-NZ 3.3Å; Q385-K387 PolarHBondContact O-N 2.69Å; K387-I389 PolarHBondContact O-N 2.95Å
388	D	51.9	Low	49.6	Very low	32 Å²	32	88.4 Å²	88.4	17%	0.171	48%	0.479	C	S	.	.			trans	-70.4	119	168.8	172.7	15.9	0	0	0	109.5	W221 F390 S391	W221-D388 PolarHBondContact NE1-OD2 3.49Å; D388-F390 PolarHBondContact O-N 3.49Å; D388-F390 PolarHBondContact OD1-N 2.95Å; D388-S391 PolarHBondContact O-N 3.44Å; D388-S391 WeakPolarHBondContact OD2-CB 3.31Å; D388-S391 PolarHBondContact OD2-N 3.4Å; D388-S391 PolarHBondContact OD2-OG 3.26Å
389	I	54.1	Low	52.2	Low	41 Å²	41	85.7 Å²	85.7	21%	0.21	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-62.3	-29.2	-177.8	-60.1	169.9	0	0	0	111	L353 K387 V395	L353-I389 HydrophobicContact CD1-CD1 4.23Å; L353-I389 HydrophobicContact CD1-CG1 4.27Å; K387-I389 PolarHBondContact O-N 2.95Å; I389-V395 HydrophobicContact CG2-CG2 4.17Å; I389-V395 WeakPolarHBondContact O-CG2 3.34Å
390	F	59.7	Low	54.8	Low	12 Å²	12	84.2 Å²	84.2	5%	0.053	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-88.5	-11.6	-179.9	-83.3	-97.6	0	0	0	114	R204 V206 A219 W221 L345 D388 V395	R204-F390 HydrophobicContact CB-CD1 4.28Å; R204-F390 HydrophobicContact CB-CE1 3.98Å; R204-F390 HydrophobicContact CB-CZ 4.33Å; R204-F390 HydrophobicContact CG-CD1 4.39Å; R204-F390 HydrophobicContact CG-CE1 4.35Å; R204-F390 HydrophobicContact CG-CZ 4.46Å; V206-F390 HydrophobicContact CG2-CE1 4.19Å; A219-F390 HydrophobicContact CB-CD1 4.32Å; W221-F390 HydrophobicContact CZ2-CB 4.11Å; L345-F390 HydrophobicContact CD2-CE1 4.36Å; L345-F390 HydrophobicContact CD2-CZ 4.17Å; D388-F390 PolarHBondContact O-N 3.49Å; D388-F390 PolarHBondContact OD1-N 2.95Å; F390-V395 HydrophobicContact CD1-CG2 3.82Å; F390-V395 HydrophobicContact CD2-CG2 4.01Å; F390-V395 HydrophobicContact CE1-CG1 4.02Å; F390-V395 HydrophobicContact CE1-CG2 3.87Å; F390-V395 HydrophobicContact CE2-CG2 4.04Å; F390-V395 HydrophobicContact CG-CG2 3.89Å; F390-V395 HydrophobicContact CZ-CG1 4.11Å; F390-V395 HydrophobicContact CZ-CG2 3.97Å
391	S	53.8	Low	57.6	Low	82 Å²	82	80.5 Å²	80.5	57%	0.573	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-92.8	2.8	173.4	-67	0	0	0	0	113.2	D388	D388-S391 PolarHBondContact O-N 3.44Å; D388-S391 WeakPolarHBondContact OD2-CB 3.31Å; D388-S391 PolarHBondContact OD2-N 3.4Å; D388-S391 PolarHBondContact OD2-OG 3.26Å
392	G	48	Very low	60.1	Low	27 Å²	27	78 Å²	78	28%	0.278	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151	178.5	-175.3	0	0	0	0	0	113.9	G394	G392-G394 PolarHBondContact O-N 3.17Å
393	R	51.3	Low	62.8	Low	232 Å²	232	76.2 Å²	76.2	88%	0.875	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	22	-168.4	-67.9	-178.4	179	169.8	0.8	117.7
394	G	56	Low	64.9	Low	44 Å²	44	70.6 Å²	70.6	45%	0.454	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-22.9	-168.9	0	0	0	0	0	117.2	G392 N396	G392-G394 PolarHBondContact O-N 3.17Å; G394-N396 PolarHBondContact O-N 3.23Å
395	V	65.9	Low	67.3	Low	13 Å²	13	67.8 Å²	67.8	8%	0.079	35%	0.353	C	S	.	.			trans	-85.3	101.4	-170.1	-171.8	0	0	0	0	111.5	V206 Q217 A219 I389 F390 L397	V206-V395 HydrophobicContact CG2-CG1 4.42Å; Q217-V395 PolarHBondContact NE2-O 3.33Å; A219-V395 HydrophobicContact CB-CB 4Å; A219-V395 HydrophobicContact CB-CG1 4.17Å; A219-V395 HydrophobicContact CB-CG2 4.31Å; I389-V395 HydrophobicContact CG2-CG2 4.17Å; I389-V395 WeakPolarHBondContact O-CG2 3.34Å; F390-V395 HydrophobicContact CD1-CG2 3.82Å; F390-V395 HydrophobicContact CD2-CG2 4.01Å; F390-V395 HydrophobicContact CE1-CG1 4.02Å; F390-V395 HydrophobicContact CE1-CG2 3.87Å; F390-V395 HydrophobicContact CE2-CG2 4.04Å; F390-V395 HydrophobicContact CG-CG2 3.89Å; F390-V395 HydrophobicContact CZ-CG1 4.11Å; F390-V395 HydrophobicContact CZ-CG2 3.97Å; V395-L397 HydrophobicContact CG1-CD2 3.99Å; V395-L397 HydrophobicContact CG1-CG 4.15Å
396	N	75.4	Confident	69.7	Low	55 Å²	55	62.9 Å²	62.9	29%	0.294	33%	0.329	S	S	.	.			trans	-115.9	93.2	170.9	179.6	6.4	0	0	0	109.7	K300 Q344 G394 T398	K300-N396 VanDerWaalsContact NZ-CG 3.27Å; K300-N396 PolarHBondContact NZ-ND2 2.79Å; K300-N396 PolarHBondContact NZ-OD1 3.35Å; Q344-N396 PolarHBondContact OE1-O 2.9Å; G394-N396 PolarHBondContact O-N 3.23Å; N396-T398 PolarHBondContact O-N 3.26Å; N396-T398 PolarHBondContact OD1-N 3.12Å; N396-T398 VanDerWaalsContact OD1-N 3.08Å; N396-T398 PolarHBondContact OD1-O 2.96Å; N396-T398 PolarHBondContact OD1-OG1 2.88Å
397	L	79.9	Confident	71.8	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.306	C	S	.	.			trans	-69.5	-17.6	179.1	-67.8	-167.2	0	0	0	113.1	I188 V206 F208 I340 R341 Q344 L345 V395	I188-L397 HydrophobicContact CD1-CD1 4.46Å; V206-L397 HydrophobicContact CB-CD1 3.66Å; V206-L397 HydrophobicContact CG1-CD1 3.57Å; V206-L397 HydrophobicContact CG1-CG 4.24Å; V206-L397 HydrophobicContact CG2-CD1 3.7Å; V206-L397 HydrophobicContact CG2-CG 4.25Å; F208-L397 HydrophobicContact CE2-CD1 4.25Å; F208-L397 HydrophobicContact CZ-CB 4.08Å; F208-L397 HydrophobicContact CZ-CD1 4.37Å; I340-L397 CarbonylContact C-O 3.59Å; I340-L397 VanDerWaalsContact CA-O 3.31Å; I340-L397 WeakPolarHBondContact CA-O 3.5Å; I340-L397 HydrophobicContact CG2-CB 4.3Å; I340-L397 HydrophobicContact CG2-CD1 4.33Å; R341-L397 PolarHBondContact N-O 3.1Å; Q344-L397 HydrophobicContact CB-CD2 4.22Å; L345-L397 HydrophobicContact CD1-CD1 4.29Å; L345-L397 HydrophobicContact CD1-CD2 4.43Å; L345-L397 HydrophobicContact CD2-CD1 4.17Å; L345-L397 HydrophobicContact CD2-CD2 4.02Å; L345-L397 HydrophobicContact CG-CD1 4.4Å; L345-L397 HydrophobicContact CG-CD2 3.88Å; V395-L397 HydrophobicContact CG1-CD2 3.99Å; V395-L397 HydrophobicContact CG1-CG 4.15Å
398	T	83.2	Confident	73.2	Confident	6 Å²	6	58.2 Å²	58.2	4%	0.037	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	127.3	-177.1	63.4	0	0	0	0	111.8	F208 M215 K300 F327 N396	F208-T398 HydrophobicContact CE1-CG2 4.07Å; F208-T398 HydrophobicContact CZ-CG2 4.31Å; M215-T398 HydrophobicContact CE-CG2 4.26Å; K300-T398 PolarHBondContact NZ-OG1 3.34Å; F327-T398 HydrophobicContact CE1-CG2 3.62Å; F327-T398 HydrophobicContact CZ-CG2 3.63Å; N396-T398 PolarHBondContact O-N 3.26Å; N396-T398 PolarHBondContact OD1-N 3.12Å; N396-T398 VanDerWaalsContact OD1-N 3.08Å; N396-T398 PolarHBondContact OD1-O 2.96Å; N396-T398 PolarHBondContact OD1-OG1 2.88Å
399	R	83.1	Confident	73.5	Confident	111 Å²	111	58.8 Å²	58.8	42%	0.419	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	148.9	177.2	-177.2	172.3	179.4	-177.6	0.7	111.3	Y339 R341 T401	Y339-R399 PolarHBondContact N-O 3.06Å; Y339-R399 PolarHBondContact O-N 3.3Å; R341-R399 HydrophobicContact CG-CB 3.61Å; R341-R399 HydrophobicContact CG-CG 4.37Å; R399-T401 PolarHBondContact O-N 2.95Å; R399-T401 VanDerWaalsContact O-N 3.1Å
400	N	81.5	Confident	73.4	Confident	113 Å²	113	63.9 Å²	63.9	60%	0.604	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.3	41.8	173.7	-63.6	3.9	0	0	0	112.6	Y339	Y339-N400 HydrophobicContact CD2-CB 4.02Å
401	T	89.2	Confident	72.7	Confident	55 Å²	55	72.7 Å²	72.7	34%	0.337	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	135.2	-175.9	51.8	0	0	0	0	110.7	F327 Y336 F337 R399	F327-T401 HydrophobicContact CE1-CG2 4.09Å; F327-T401 HydrophobicContact CZ-CG2 3.76Å; Y336-T401 HydrophobicContact CE1-CG2 4.34Å; Y336-T401 HydrophobicContact CE2-CG2 4.42Å; Y336-T401 VanDerWaalsContact OH-CB 3.26Å; Y336-T401 WeakPolarHBondContact OH-CB 3.43Å; Y336-T401 WeakPolarHBondContact OH-CG2 3.47Å; Y336-T401 PolarHBondContact OH-OG1 3.42Å; F337-T401 CarbonylContact O-C 3.54Å; F337-T401 VanDerWaalsContact O-CA 3.28Å; F337-T401 WeakPolarHBondContact O-CA 3.45Å; R399-T401 PolarHBondContact O-N 2.95Å; R399-T401 VanDerWaalsContact O-N 3.1Å
402	K	90.6	Very high	72.4	Confident	63 Å²	63	77 Å²	77	27%	0.274	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	150.6	176.6	62.6	176.4	-177.8	174.4	0	111.2	F337 I404 T441 L442	F337-K402 HydrophobicContact CD1-CG 4.11Å; F337-K402 PolarHBondContact N-O 3.1Å; F337-K402 PolarHBondContact O-N 2.96Å; K402-I404 HydrophobicContact CD-CG1 4.3Å; K402-I404 HydrophobicContact CG-CG1 4.19Å; K402-T441 WeakPolarHBondContact CE-O 3.32Å; K402-T441 PolarHBondContact NZ-O 3.22Å; K402-L442 PolarHBondContact NZ-O 3.49Å
403	L	91.5	Very high	72.7	Confident	72 Å²	72	79.1 Å²	79.1	38%	0.377	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	112.1	171.1	-173.9	67.8	0	0	0	108.8	F304 P333 P405	F304-L403 HydrophobicContact CD1-CD1 4.47Å; F304-L403 HydrophobicContact CD1-CD2 4.39Å; F304-L403 HydrophobicContact CE1-CD1 4.09Å; F304-L403 HydrophobicContact CE1-CD2 4.13Å; F304-L403 HydrophobicContact CZ-CD1 4.32Å; P333-L403 HydrophobicContact CB-CD2 4.24Å; P333-L403 HydrophobicContact CG-CD2 4.12Å; L403-P405 WeakPolarHBondContact O-CD 3.26Å
404	I	91.1	Very high	73	Confident	5 Å²	5	78.8 Å²	78.8	3%	0.026	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	113	176.3	-58.7	177.8	0	0	0	107.7	G334 V335 F337 K402 L428 V439	G334-I404 CarbonylContact C-O 3.59Å; G334-I404 VanDerWaalsContact CA-O 3.29Å; G334-I404 WeakPolarHBondContact CA-O 3.12Å; V335-I404 PolarHBondContact N-O 3.23Å; V335-I404 PolarHBondContact O-N 3.19Å; F337-I404 HydrophobicContact CB-CD1 3.88Å; F337-I404 HydrophobicContact CB-CG1 4.35Å; F337-I404 HydrophobicContact CD1-CD1 4.32Å; F337-I404 HydrophobicContact CG-CD1 4.17Å; K402-I404 HydrophobicContact CD-CG1 4.3Å; K402-I404 HydrophobicContact CG-CG1 4.19Å; I404-L428 HydrophobicContact CD1-CD2 4.14Å; I404-L428 HydrophobicContact CG2-CD2 4.47Å; I404-V439 HydrophobicContact CG2-CG1 3.83Å
405	P	88.9	Confident	73.2	Confident	92 Å²	92	81.4 Å²	81.4	60%	0.597	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.7	150.4	178.4	28.4	-34.3	0	0	0	110.6	L403	L403-P405 WeakPolarHBondContact O-CD 3.26Å
406	Y	88.5	Confident	73.6	Confident	30 Å²	30	82.1 Å²	82.1	12%	0.118	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-62.1	127.6	174.9	-66.2	-66	0	0	0	110.3	F308 M330 T331 G334 V335 I408 P418 I430	F308-Y406 AromaticContact CE2-CE2 3.94Å; F308-Y406 HydrophobicContact CE2-CE2 3.94Å; F308-Y406 AromaticContact CZ-CE2 3.85Å; F308-Y406 HydrophobicContact CZ-CE2 3.85Å; M330-Y406 HydrophobicContact CG-CE1 4.48Å; M330-Y406 WeakPolarHBondContact CG-OH 3.44Å; T331-Y406 PolarHBondContact N-OH 2.94Å; T331-Y406 WeakPolarHBondContact O-CE2 3.48Å; T331-Y406 PolarHBondContact O-OH 2.9Å; G334-Y406 VanDerWaalsContact CA-CE2 3.41Å; G334-Y406 PolarHBondContact O-OH 3.3Å; V335-Y406 HydrophobicContact CG2-CD1 4.44Å; V335-Y406 HydrophobicContact CG2-CE1 3.63Å; Y406-I408 PolarHBondContact O-N 3.26Å; Y406-P418 HydrophobicContact CD1-CB 4.35Å; Y406-P418 HydrophobicContact CD1-CG 4.19Å; Y406-P418 HydrophobicContact CE1-CB 3.94Å; Y406-P418 HydrophobicContact CE1-CG 3.6Å; Y406-P418 HydrophobicContact CE2-CG 4.24Å; Y406-I430 HydrophobicContact CD1-CD1 4.07Å; Y406-I430 HydrophobicContact CD1-CG2 4.39Å; Y406-I430 HydrophobicContact CE1-CD1 4.45Å
407	P	80.9	Confident	74.1	Confident	21 Å²	21	83 Å²	83	14%	0.136	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-67.2	116.4	-174.1	23.4	-33.3	0	0	0	112.1	I430 K437 V439 A446	P407-I430 HydrophobicContact CG-CD1 4.46Å; P407-K437 HydrophobicContact CB-CD 4.13Å; P407-K437 HydrophobicContact CG-CB 4.06Å; P407-K437 HydrophobicContact CG-CD 3.64Å; P407-K437 HydrophobicContact CG-CG 4.47Å; P407-K437 PolarHBondContact O-NZ 3.2Å; P407-V439 HydrophobicContact CB-CG2 4.32Å; P407-V439 HydrophobicContact CG-CG2 3.76Å; P407-A446 HydrophobicContact CB-CB 3.92Å
408	I	72.8	Confident	74.7	Confident	116 Å²	116	83.1 Å²	83.1	60%	0.595	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-96.4	127	172.5	-54.3	170.4	0	0	0	107.9	Y406	Y406-I408 PolarHBondContact O-N 3.26Å
409	I	59	Low	75.1	Confident	45 Å²	45	85.2 Å²	85.2	23%	0.231	43%	0.434	C	S	.	.			trans	-110.8	106	174.3	-61.8	173.4	0	0	0	107.7	S449	I409-S449 WeakPolarHBondContact CD1-OG 3.37Å
410	H	51.7	Low	75.5	Confident	147 Å²	147	80.1 Å²	80.1	68%	0.681	42%	0.415	S	S	*	.	S	Bend	trans	59.7	150.8	175	-70.3	-77.8	0	0	0	118.2	L412 E413	H410-L412 PolarHBondContact O-N 3.23Å; H410-E413 PolarHBondContact O-N 2.87Å
411	M	45	Very low	76.1	Confident	197 Å²	197	74.7 Å²	74.7	97%	0.97	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	8.2	-168.5	-69.5	-79.2	-174.4	0	0	117.6
412	L	47.6	Very low	76.3	Confident	174 Å²	174	72.2 Å²	72.2	91%	0.911	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	-13.8	-178.7	-79.1	150.5	0	0	0	113.6	H410	H410-L412 PolarHBondContact O-N 3.23Å
413	E	54.2	Low	76.4	Confident	70 Å²	70	69.3 Å²	69.3	33%	0.327	36%	0.359	S	S	.	.			trans	-90.3	121.4	178.5	-67.9	-167.5	156.7	0	0	111.2	H410 R435 K437	H410-E413 PolarHBondContact O-N 2.87Å; E413-R435 VanDerWaalsContact CD-NH1 3.3Å; E413-R435 IonicContact OE1-CZ 3.43Å; E413-R435 IonicContact OE1-NH1 3.99Å; E413-R435 PolarHBondContact OE1-NH1 2.94Å; E413-R435 IonicContact OE2-NH1 3.83Å; E413-K437 IonicContact OE2-NZ 3.62Å; E413-K437 PolarHBondContact OE2-NZ 3.07Å
414	R	56.1	Low	76.4	Confident	225 Å²	225	66 Å²	66	85%	0.849	34%	0.342	S	S	*	.			trans	-65.4	137.8	163.5	-69.1	-177.3	-178.5	178.8	0.3	108.1	G416	R414-G416 PolarHBondContact O-N 3.32Å
415	P	61.5	Low	76.2	Confident	100 Å²	100	69.2 Å²	69.2	65%	0.649	36%	0.357	S	S	*	.			trans	-57.8	107.1	173.5	23.9	-31.6	0	0	0	108
416	G	73.5	Confident	76.2	Confident	28 Å²	28	65.1 Å²	65.1	29%	0.289	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-63.4	147.4	174.1	0	0	0	0	0	108.8	R414 Y432	R414-G416 PolarHBondContact O-N 3.32Å; G416-Y432 WeakPolarHBondContact O-CD1 3.48Å; G416-Y432 VanDerWaalsContact O-CE1 3.23Å; G416-Y432 WeakPolarHBondContact O-CE1 3.46Å
417	V	86.8	Confident	76.3	Confident	74 Å²	74	63.8 Å²	63.8	45%	0.448	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-74.2	125.7	174	-169.5	0	0	0	0	108	F308 Y310	F308-V417 HydrophobicContact CD1-CG1 3.7Å; F308-V417 HydrophobicContact CE1-CG1 3.99Å; F308-V417 HydrophobicContact CG-CG1 4.05Å; Y310-V417 WeakPolarHBondContact OH-CG1 3.38Å
418	P	92	Very high	76.9	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.006	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	136.2	177.8	30.8	-36.9	0	0	0	110.2	F308 Y310 M330 Y406 I430 Y432	F308-P418 HydrophobicContact CD2-CG 4.37Å; F308-P418 HydrophobicContact CE2-CG 3.68Å; F308-P418 HydrophobicContact CZ-CG 4.04Å; Y310-P418 PolarHBondContact OH-O 3.35Å; M330-P418 HydrophobicContact CG-CG 4.33Å; M330-P418 HydrophobicContact SD-CB 3.92Å; M330-P418 HydrophobicContact SD-CG 3.83Å; Y406-P418 HydrophobicContact CD1-CB 4.35Å; Y406-P418 HydrophobicContact CD1-CG 4.19Å; Y406-P418 HydrophobicContact CE1-CB 3.94Å; Y406-P418 HydrophobicContact CE1-CG 3.6Å; Y406-P418 HydrophobicContact CE2-CG 4.24Å; P418-I430 HydrophobicContact CB-CG2 3.81Å; P418-Y432 HydrophobicContact CB-CD1 4.48Å; P418-Y432 HydrophobicContact CB-CE1 4.15Å
419	L	91.1	Very high	77.8	Confident	51 Å²	51	57.3 Å²	57.3	27%	0.267	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-34.3	179.1	-65.9	177.3	0	0	0	112.4	V431 V433 A461	L419-V431 PolarHBondContact N-O 3.04Å; L419-V433 HydrophobicContact CD1-CB 4.47Å; L419-V433 HydrophobicContact CD1-CG2 3.99Å; L419-V433 HydrophobicContact CD2-CG2 4.03Å; L419-V433 HydrophobicContact CG-CG2 4.14Å; L419-A461 HydrophobicContact CD1-CB 4.24Å; L419-A461 WeakPolarHBondContact CD1-O 3.31Å
420	G	91.9	Very high	79.5	Confident	3 Å²	3	55.2 Å²	55.2	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176	166.1	179.5	0	0	0	0	0	111.8	V431	G420-V431 PolarHBondContact O-N 3.33Å; G420-V431 VanDerWaalsContact O-N 3.1Å
421	I	94.7	Very high	81.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	158.8	-177.3	60.9	166.2	0	0	0	111.6	D312 K314 A328 M330 V335 L428 I429 I430	D312-I421 HydrophobicContact CB-CG1 4.17Å; D312-I421 PolarHBondContact OD2-N 3.46Å; K314-I421 WeakPolarHBondContact CE-O 3.47Å; K314-I421 HydrophobicContact CG-CD1 4.41Å; K314-I421 HydrophobicContact CG-CG1 3.99Å; A328-I421 HydrophobicContact CB-CD1 3.88Å; M330-I421 HydrophobicContact CB-CD1 4.02Å; M330-I421 HydrophobicContact CB-CG1 4.29Å; M330-I421 HydrophobicContact CB-CG2 4.23Å; M330-I421 HydrophobicContact CG-CG2 4.22Å; M330-I421 HydrophobicContact SD-CG2 4.12Å; V335-I421 HydrophobicContact CG1-CD1 3.96Å; V335-I421 HydrophobicContact CG2-CG2 4.09Å; I421-L428 HydrophobicContact CB-CD1 4.16Å; I421-L428 HydrophobicContact CD1-CD1 4.43Å; I421-I429 CarbonylContact C-O 3.58Å; I421-I429 VanDerWaalsContact CA-O 3.29Å; I421-I429 WeakPolarHBondContact CA-O 3.4Å; I421-I430 HydrophobicContact CG2-CG1 4.29Å; I421-I430 HydrophobicContact CG2-CG2 4.49Å
422	C	93.9	Very high	83.6	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.02	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	141.4	172.5	175.5	0	0	0	0	109.5	I429 I464 R466	C422-I429 HydrophobicContact CB-CB 4.19Å; C422-I429 PolarHBondContact N-O 3.29Å; C422-I429 PolarHBondContact O-N 2.88Å; C422-I464 HydrophobicContact CB-CD1 3.66Å; C422-I464 HydrophobicContact CB-CG1 4.22Å; C422-R466 VanDerWaalsContact SG-CB 3.53Å; C422-R466 WeakPolarHBondContact SG-CD 3.43Å
423	L	92.5	Very high	85.5	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	143	173.8	-72.9	174.5	0	0	0	110.7	K314 Y316 A328 F337 L428 R466	K314-L423 WeakPolarHBondContact O-CD1 3.44Å; Y316-L423 HydrophobicContact CD2-CB 4.18Å; A328-L423 HydrophobicContact CB-CD1 3.67Å; A328-L423 HydrophobicContact CB-CD2 3.76Å; A328-L423 HydrophobicContact CB-CG 3.78Å; F337-L423 HydrophobicContact CD2-CD2 4.03Å; F337-L423 HydrophobicContact CE2-CD2 4.07Å; L423-L428 HydrophobicContact CD2-CB 4.33Å; L423-L428 HydrophobicContact CD2-CD1 3.82Å; L423-R466 PolarHBondContact O-NH1 2.62Å
424	T	90.2	Very high	87	Confident	3 Å²	3	32.7 Å²	32.7	2%	0.018	17%	0.172	C	C	.	.			trans	-113.4	-171.1	162.2	77.7	0	0	0	0	108.3	Y316 F426 H427 I429 I473 M486 E489	Y316-T424 VanDerWaalsContact CD2-C 3.44Å; Y316-T424 WeakPolarHBondContact CD2-O 3.46Å; Y316-T424 WeakPolarHBondContact CE2-O 3.12Å; T424-F426 VanDerWaalsContact C-N 3.31Å; T424-F426 PolarHBondContact O-N 3.47Å; T424-F426 PolarHBondContact OG1-N 3.05Å; T424-H427 HydrophobicContact CG2-CB 4.43Å; T424-H427 PolarHBondContact N-O 3.45Å; T424-H427 WeakPolarHBondContact OG1-CA 3.42Å; T424-H427 VanDerWaalsContact OG1-CB 3.26Å; T424-H427 WeakPolarHBondContact OG1-CB 3.41Å; T424-H427 PolarHBondContact OG1-N 3.2Å; T424-H427 PolarHBondContact OG1-O 2.84Å; T424-I429 HydrophobicContact CG2-CD1 4.35Å; T424-I429 HydrophobicContact CG2-CG1 3.98Å; T424-I473 HydrophobicContact CG2-CD1 3.89Å; T424-M486 HydrophobicContact CG2-CE 4.29Å; T424-M486 HydrophobicContact CG2-SD 3.39Å; T424-M486 WeakPolarHBondContact CG2-SD 3.46Å; T424-E489 WeakPolarHBondContact CB-OE1 3.31Å; T424-E489 PolarHBondContact OG1-OE1 3.19Å
425	E	87.2	Confident	88.5	Confident	71 Å²	71	24 Å²	24	33%	0.332	14%	0.139	S	C	.	.	S	Bend	trans	-63.3	-41.3	178	-162.4	175.8	156	0	0	111	Y316 K326 E489	Y316-E425 HydrophobicContact CE1-CG 4.4Å; Y316-E425 HydrophobicContact CE2-CB 4.41Å; Y316-E425 VanDerWaalsContact CE2-N 3.29Å; Y316-E425 WeakPolarHBondContact OH-CB 3.21Å; K326-E425 PolarHBondContact NZ-O 2.97Å; E425-E489 PolarHBondContact N-OE1 3.34Å
426	F	88.5	Confident	89.8	Confident	6 Å²	6	19.2 Å²	19.2	3%	0.026	11%	0.108	C	C	.	.	S	Bend	trans	-123.5	-4.3	-176.4	-59.8	-78.9	0	0	0	114.8	T424 T441 L442 E489 L490 I493 F509	T424-F426 VanDerWaalsContact C-N 3.31Å; T424-F426 PolarHBondContact O-N 3.47Å; T424-F426 PolarHBondContact OG1-N 3.05Å; F426-T441 VanDerWaalsContact C-OG1 3.27Å; F426-T441 WeakPolarHBondContact O-CB 3.41Å; F426-T441 PolarHBondContact O-N 3.41Å; F426-T441 PolarHBondContact O-OG1 3.2Å; F426-L442 HydrophobicContact CD1-CD1 4.08Å; F426-L442 HydrophobicContact CD1-CG 4.4Å; F426-E489 HydrophobicContact CB-CG 4.5Å; F426-E489 HydrophobicContact CD2-CG 4.18Å; F426-E489 PolarHBondContact N-OE1 3.28Å; F426-L490 HydrophobicContact CD2-CD2 4.05Å; F426-L490 HydrophobicContact CE2-CD2 3.43Å; F426-L490 VanDerWaalsContact CE2-CD2 3.43Å; F426-L490 HydrophobicContact CZ-CD2 4.24Å; F426-I493 HydrophobicContact CB-CD1 4Å; F426-I493 HydrophobicContact CD1-CD1 3.57Å; F426-I493 HydrophobicContact CD1-CG1 4.38Å; F426-I493 HydrophobicContact CD2-CD1 3.1Å; F426-I493 HydrophobicContact CD2-CG1 4.41Å; F426-I493 HydrophobicContact CE1-CD1 3.73Å; F426-I493 HydrophobicContact CE1-CG2 4.25Å; F426-I493 HydrophobicContact CE2-CD1 3.27Å; F426-I493 HydrophobicContact CG-CD1 3.24Å; F426-I493 HydrophobicContact CG-CG1 4.2Å; F426-I493 HydrophobicContact CZ-CD1 3.59Å; F426-F509 HydrophobicContact CE1-CE1 4.33Å; F426-F509 HydrophobicContact CE1-CZ 4.17Å; F426-F509 HydrophobicContact CE2-CE1 4.32Å; F426-F509 HydrophobicContact CZ-CD1 4.49Å; F426-F509 AromaticContact CZ-CE1 3.58Å; F426-F509 HydrophobicContact CZ-CE1 3.58Å; F426-F509 AromaticContact CZ-CZ 3.79Å; F426-F509 HydrophobicContact CZ-CZ 3.79Å
427	H	90.7	Very high	90.6	Very high	3 Å²	3	18.1 Å²	18.1	1%	0.014	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144.6	-173.7	-54.1	87.2	0	0	0	113	F24 T424 I429 V439 V447 E489	F24-H427 HydrophobicContact CZ-CB 3.93Å; F24-H427 AromaticContact CZ-CG 3.63Å; F24-H427 AromaticContact CZ-ND1 3.8Å; T424-H427 HydrophobicContact CG2-CB 4.43Å; T424-H427 PolarHBondContact N-O 3.45Å; T424-H427 WeakPolarHBondContact OG1-CA 3.42Å; T424-H427 VanDerWaalsContact OG1-CB 3.26Å; T424-H427 WeakPolarHBondContact OG1-CB 3.41Å; T424-H427 PolarHBondContact OG1-N 3.2Å; T424-H427 PolarHBondContact OG1-O 2.84Å; H427-I429 HydrophobicContact CB-CD1 4.19Å; H427-V439 CarbonylContact C-O 3.59Å; H427-V439 VanDerWaalsContact CA-O 3.29Å; H427-V439 WeakPolarHBondContact CA-O 3.4Å; H427-V447 VanDerWaalsContact CD2-CG2 3.47Å; H427-V447 WeakPolarHBondContact CD2-CG2 3.26Å; H427-E489 IonicContact CE1-OE1 3.87Å; H427-E489 WeakPolarHBondContact ND1-CG 3.42Å; H427-E489 IonicContact ND1-OE1 2.88Å; H427-E489 PolarHBondContact ND1-OE1 3.12Å; H427-E489 VanDerWaalsContact ND1-OE1 3.12Å
428	L	93.2	Very high	90.7	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	113.4	167.1	172.4	68.3	0	0	0	107.6	A328 V335 I404 I421 L423 I430 A438 V439 T441	A328-L428 HydrophobicContact CB-CD1 4.13Å; V335-L428 HydrophobicContact CB-CD2 3.6Å; V335-L428 HydrophobicContact CG1-CD1 4.01Å; V335-L428 HydrophobicContact CG1-CD2 3.62Å; V335-L428 HydrophobicContact CG1-CG 4.47Å; V335-L428 HydrophobicContact CG2-CD2 3.85Å; I404-L428 HydrophobicContact CD1-CD2 4.14Å; I404-L428 HydrophobicContact CG2-CD2 4.47Å; I421-L428 HydrophobicContact CB-CD1 4.16Å; I421-L428 HydrophobicContact CD1-CD1 4.43Å; L423-L428 HydrophobicContact CD2-CB 4.33Å; L423-L428 HydrophobicContact CD2-CD1 3.82Å; L428-I430 HydrophobicContact CD2-CD1 4.13Å; L428-I430 HydrophobicContact CD2-CG1 4.32Å; L428-I430 HydrophobicContact CG-CD1 4.38Å; L428-I430 HydrophobicContact CG-CG1 4.06Å; L428-A438 WeakPolarHBondContact O-CA 3.46Å; L428-V439 PolarHBondContact N-O 3.12Å; L428-V439 PolarHBondContact O-N 3.1Å; L428-T441 HydrophobicContact CB-CG2 4.1Å
429	I	93.3	Very high	90.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	128.5	177	-50.3	-55.3	0	0	0	108.7	F24 I421 C422 T424 H427 I436 K437 A438 I464 I473 L484	F24-I429 HydrophobicContact CD1-CD1 4.5Å; F24-I429 HydrophobicContact CE1-CD1 3.78Å; F24-I429 HydrophobicContact CZ-CD1 3.96Å; I421-I429 CarbonylContact C-O 3.58Å; I421-I429 VanDerWaalsContact CA-O 3.29Å; I421-I429 WeakPolarHBondContact CA-O 3.4Å; C422-I429 HydrophobicContact CB-CB 4.19Å; C422-I429 PolarHBondContact N-O 3.29Å; C422-I429 PolarHBondContact O-N 2.88Å; T424-I429 HydrophobicContact CG2-CD1 4.35Å; T424-I429 HydrophobicContact CG2-CG1 3.98Å; H427-I429 HydrophobicContact CB-CD1 4.19Å; I429-I436 HydrophobicContact CG2-CD1 3.44Å; I429-I436 VanDerWaalsContact CG2-CD1 3.44Å; I429-I436 HydrophobicContact CG2-CG1 3.82Å; I429-K437 WeakPolarHBondContact CA-O 3.42Å; I429-A438 HydrophobicContact CD1-CB 3.4Å; I429-I464 HydrophobicContact CB-CD1 4.38Å; I429-I464 HydrophobicContact CG2-CD1 3.78Å; I429-I473 HydrophobicContact CG1-CD1 4.28Å; I429-L484 HydrophobicContact CD1-CD2 4.19Å; I429-L484 HydrophobicContact CG1-CD2 4.21Å; I429-L484 HydrophobicContact CG2-CD2 4.14Å
430	I	93.4	Very high	90.5	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.005	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.7	180	-50.6	176.5	0	0	0	107.7	V335 Y406 P407 P418 I421 L428 Y432 K437 V439	V335-I430 HydrophobicContact CG2-CD1 4.29Å; Y406-I430 HydrophobicContact CD1-CD1 4.07Å; Y406-I430 HydrophobicContact CD1-CG2 4.39Å; Y406-I430 HydrophobicContact CE1-CD1 4.45Å; P407-I430 HydrophobicContact CG-CD1 4.46Å; P418-I430 HydrophobicContact CB-CG2 3.81Å; I421-I430 HydrophobicContact CG2-CG1 4.29Å; I421-I430 HydrophobicContact CG2-CG2 4.49Å; L428-I430 HydrophobicContact CD2-CD1 4.13Å; L428-I430 HydrophobicContact CD2-CG1 4.32Å; L428-I430 HydrophobicContact CG-CD1 4.38Å; L428-I430 HydrophobicContact CG-CG1 4.06Å; I430-Y432 HydrophobicContact CB-CE2 4.14Å; I430-Y432 HydrophobicContact CG2-CD2 4.39Å; I430-Y432 HydrophobicContact CG2-CE1 4.36Å; I430-Y432 HydrophobicContact CG2-CE2 3.67Å; I430-K437 PolarHBondContact N-O 2.99Å; I430-K437 PolarHBondContact O-N 3.42Å; I430-V439 HydrophobicContact CD1-CG2 4.35Å
431	V	92.4	Very high	90.4	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	132.4	176.4	173.2	0	0	0	0	109.6	L419 G420 I436 L452 A461 I464 I475	L419-V431 PolarHBondContact N-O 3.04Å; G420-V431 PolarHBondContact O-N 3.33Å; G420-V431 VanDerWaalsContact O-N 3.1Å; V431-I436 HydrophobicContact CG2-CB 4.48Å; V431-I436 HydrophobicContact CG2-CD1 4.06Å; V431-I436 HydrophobicContact CG2-CG1 4.16Å; V431-L452 HydrophobicContact CG1-CD1 4.35Å; V431-A461 HydrophobicContact CG1-CB 4.01Å; V431-I464 HydrophobicContact CB-CB 4.35Å; V431-I464 HydrophobicContact CG2-CB 3.87Å; V431-I464 HydrophobicContact CG2-CD1 3.61Å; V431-I464 HydrophobicContact CG2-CG1 4.22Å; V431-I464 HydrophobicContact CG2-CG2 4.37Å; V431-I475 HydrophobicContact CG1-CG2 4.26Å; V431-I475 HydrophobicContact CG2-CD1 4.26Å; V431-I475 HydrophobicContact CG2-CG1 4.29Å
432	Y	90.6	Very high	90	Very high	6 Å²	6	12.7 Å²	12.7	2%	0.024	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	172	170.2	-57.5	-91.5	0	0	0	108.9	G416 P418 I430 D434 R435 K437	G416-Y432 WeakPolarHBondContact O-CD1 3.48Å; G416-Y432 VanDerWaalsContact O-CE1 3.23Å; G416-Y432 WeakPolarHBondContact O-CE1 3.46Å; P418-Y432 HydrophobicContact CB-CD1 4.48Å; P418-Y432 HydrophobicContact CB-CE1 4.15Å; I430-Y432 HydrophobicContact CB-CE2 4.14Å; I430-Y432 HydrophobicContact CG2-CD2 4.39Å; I430-Y432 HydrophobicContact CG2-CE1 4.36Å; I430-Y432 HydrophobicContact CG2-CE2 3.67Å; Y432-D434 PolarHBondContact O-N 3.39Å; Y432-R435 WeakPolarHBondContact CA-O 3.38Å; Y432-R435 WeakPolarHBondContact CB-O 3.36Å; Y432-R435 HydrophobicContact CD2-CG 3.9Å; Y432-R435 HydrophobicContact CG-CG 4.21Å; Y432-R435 PolarHBondContact N-O 3.22Å; Y432-K437 HydrophobicContact CD2-CG 4.36Å; Y432-K437 HydrophobicContact CE2-CB 4.2Å; Y432-K437 HydrophobicContact CE2-CD 3.86Å; Y432-K437 HydrophobicContact CE2-CG 3.93Å
433	V	88.4	Confident	89.4	Confident	52 Å²	52	14.8 Å²	14.8	32%	0.315	7%	0.074	S	C	.	.	S	Bend	trans	-55.1	-36.5	179.6	179.9	0	0	0	0	113	L419 R460 A461	L419-V433 HydrophobicContact CD1-CB 4.47Å; L419-V433 HydrophobicContact CD1-CG2 3.99Å; L419-V433 HydrophobicContact CD2-CG2 4.03Å; L419-V433 HydrophobicContact CG-CG2 4.14Å; V433-R460 HydrophobicContact CG1-CB 3.69Å; V433-R460 HydrophobicContact CG1-CG 3.54Å; V433-R460 WeakPolarHBondContact O-CA 3.37Å; V433-A461 PolarHBondContact O-N 3.13Å
434	D	85.2	Confident	89	Confident	57 Å²	57	16.2 Å²	16.2	31%	0.305	9%	0.09	S	C	.	.	S	Bend	trans	-121.1	-5.8	-170.9	63.5	-24.7	0	0	0	114.4	Y432 P451 L452	Y432-D434 PolarHBondContact O-N 3.39Å; D434-P451 CarbonylContact O-C 3.6Å; D434-P451 WeakPolarHBondContact O-CA 3.3Å; D434-L452 PolarHBondContact O-N 3.46Å
435	R	86.7	Confident	88.6	Confident	43 Å²	43	23.7 Å²	23.7	16%	0.162	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	160.2	-175.3	63.7	-168.9	136.5	-115.9	-37.1	112.9	E413 Y432 M450	E413-R435 VanDerWaalsContact CD-NH1 3.3Å; E413-R435 IonicContact OE1-CZ 3.43Å; E413-R435 IonicContact OE1-NH1 3.99Å; E413-R435 PolarHBondContact OE1-NH1 2.94Å; E413-R435 IonicContact OE2-NH1 3.83Å; Y432-R435 WeakPolarHBondContact CA-O 3.38Å; Y432-R435 WeakPolarHBondContact CB-O 3.36Å; Y432-R435 HydrophobicContact CD2-CG 3.9Å; Y432-R435 HydrophobicContact CG-CG 4.21Å; Y432-R435 PolarHBondContact N-O 3.22Å; R435-M450 CarbonylContact C-O 3.6Å; R435-M450 VanDerWaalsContact CA-O 3.25Å; R435-M450 WeakPolarHBondContact CA-O 3.39Å; R435-M450 WeakPolarHBondContact CB-O 3.24Å
436	I	89.8	Confident	88.5	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	139.3	169.1	178.7	164.4	0	0	0	109.1	I429 V431 Y448 S449 M450 L452 I475 L484	I429-I436 HydrophobicContact CG2-CD1 3.44Å; I429-I436 VanDerWaalsContact CG2-CD1 3.44Å; I429-I436 HydrophobicContact CG2-CG1 3.82Å; V431-I436 HydrophobicContact CG2-CB 4.48Å; V431-I436 HydrophobicContact CG2-CD1 4.06Å; V431-I436 HydrophobicContact CG2-CG1 4.16Å; I436-Y448 HydrophobicContact CG2-CE1 3.93Å; I436-S449 WeakPolarHBondContact O-CA 3.39Å; I436-M450 HydrophobicContact CG2-CB 4.05Å; I436-M450 PolarHBondContact N-O 3.46Å; I436-M450 PolarHBondContact O-N 3.17Å; I436-L452 HydrophobicContact CB-CD2 4.24Å; I436-L452 HydrophobicContact CG2-CD2 3.88Å; I436-I475 HydrophobicContact CB-CD1 4.39Å; I436-I475 HydrophobicContact CD1-CD1 3.39Å; I436-I475 HydrophobicContact CD1-CG1 4.45Å; I436-I475 HydrophobicContact CG1-CD1 4.43Å; I436-L484 HydrophobicContact CD1-CD1 4.06Å; I436-L484 HydrophobicContact CD1-CD2 3.93Å
437	K	89.4	Confident	88.3	Confident	4 Å²	4	23.1 Å²	23.1	2%	0.017	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.9	173.4	-60.8	-171.9	179.3	-169.3	0	110.1	P407 E413 I429 I430 Y432 Y448	P407-K437 HydrophobicContact CB-CD 4.13Å; P407-K437 HydrophobicContact CG-CB 4.06Å; P407-K437 HydrophobicContact CG-CD 3.64Å; P407-K437 HydrophobicContact CG-CG 4.47Å; P407-K437 PolarHBondContact O-NZ 3.2Å; E413-K437 IonicContact OE2-NZ 3.62Å; E413-K437 PolarHBondContact OE2-NZ 3.07Å; I429-K437 WeakPolarHBondContact CA-O 3.42Å; I430-K437 PolarHBondContact N-O 2.99Å; I430-K437 PolarHBondContact O-N 3.42Å; Y432-K437 HydrophobicContact CD2-CG 4.36Å; Y432-K437 HydrophobicContact CE2-CB 4.2Å; Y432-K437 HydrophobicContact CE2-CD 3.86Å; Y432-K437 HydrophobicContact CE2-CG 3.93Å; K437-Y448 CarbonylContact C-O 3.58Å; K437-Y448 VanDerWaalsContact CA-O 3.22Å; K437-Y448 WeakPolarHBondContact CA-O 3.12Å
438	A	90.3	Very high	88	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.6	170.4	0	0	0	0	0	109.5	F24 L428 I429 A446 V447 Y448	F24-A438 HydrophobicContact CD2-CB 4.15Å; F24-A438 HydrophobicContact CE2-CB 3.7Å; F24-A438 HydrophobicContact CZ-CB 3.96Å; L428-A438 WeakPolarHBondContact O-CA 3.46Å; I429-A438 HydrophobicContact CD1-CB 3.4Å; A438-A446 CarbonylContact O-C 3.47Å; A438-A446 WeakPolarHBondContact O-CA 3.41Å; A438-V447 HydrophobicContact CB-CG2 3.99Å; A438-V447 PolarHBondContact O-N 3.14Å; A438-Y448 PolarHBondContact N-O 3.28Å; A438-Y448 PolarHBondContact O-N 3.32Å
439	V	90	Very high	87.6	Confident	2 Å²	2	24.6 Å²	24.6	1%	0.012	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.5	178.3	-177.6	0	0	0	0	108.8	I404 P407 H427 L428 I430 T441 G444 R445 A446	I404-V439 HydrophobicContact CG2-CG1 3.83Å; P407-V439 HydrophobicContact CB-CG2 4.32Å; P407-V439 HydrophobicContact CG-CG2 3.76Å; H427-V439 CarbonylContact C-O 3.59Å; H427-V439 VanDerWaalsContact CA-O 3.29Å; H427-V439 WeakPolarHBondContact CA-O 3.4Å; L428-V439 PolarHBondContact N-O 3.12Å; L428-V439 PolarHBondContact O-N 3.1Å; I430-V439 HydrophobicContact CD1-CG2 4.35Å; V439-T441 PolarHBondContact O-N 3.1Å; V439-G444 WeakPolarHBondContact CG1-O 3.46Å; V439-R445 CarbonylContact C-O 3.52Å; V439-R445 WeakPolarHBondContact CA-O 3.15Å; V439-A446 HydrophobicContact CG2-CB 4.49Å
440	N	88.8	Confident	87.2	Confident	2 Å²	2	27 Å²	27	1%	0.011	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	125.5	174.9	-176.4	-43.3	0	0	0	109.7	L442 D443 G444 R445 V447 I496	N440-L442 VanDerWaalsContact C-N 3.27Å; N440-L442 PolarHBondContact O-N 3.42Å; N440-L442 WeakPolarHBondContact OD1-CA 3.5Å; N440-L442 VanDerWaalsContact OD1-CB 3.27Å; N440-L442 WeakPolarHBondContact OD1-CB 3.47Å; N440-L442 PolarHBondContact OD1-N 2.97Å; N440-D443 WeakPolarHBondContact CB-OD1 3.5Å; N440-G444 WeakPolarHBondContact O-CA 3.35Å; N440-G444 PolarHBondContact O-N 3.07Å; N440-R445 PolarHBondContact N-O 3.3Å; N440-V447 HydrophobicContact CB-CG1 3.87Å; N440-I496 WeakPolarHBondContact ND2-CD1 2.9Å
441	T	89.1	Confident	86.7	Confident	3 Å²	3	29.5 Å²	29.5	2%	0.018	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.7	-176.3	59.1	0	0	0	0	113.1	F337 K402 F426 L428 V439	F337-T441 HydrophobicContact CD2-CG2 4.28Å; F337-T441 HydrophobicContact CE1-CG2 4.44Å; F337-T441 HydrophobicContact CE2-CG2 3.82Å; F337-T441 HydrophobicContact CZ-CG2 3.91Å; K402-T441 WeakPolarHBondContact CE-O 3.32Å; K402-T441 PolarHBondContact NZ-O 3.22Å; F426-T441 VanDerWaalsContact C-OG1 3.27Å; F426-T441 WeakPolarHBondContact O-CB 3.41Å; F426-T441 PolarHBondContact O-N 3.41Å; F426-T441 PolarHBondContact O-OG1 3.2Å; L428-T441 HydrophobicContact CB-CG2 4.1Å; V439-T441 PolarHBondContact O-N 3.1Å
442	L	85.6	Confident	86.3	Confident	8 Å²	8	29.5 Å²	29.5	4%	0.042	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-67.3	174.3	-59.1	175	0	0	0	109.2	K402 F426 N440 I493 I496 Y497 R500	K402-L442 PolarHBondContact NZ-O 3.49Å; F426-L442 HydrophobicContact CD1-CD1 4.08Å; F426-L442 HydrophobicContact CD1-CG 4.4Å; N440-L442 VanDerWaalsContact C-N 3.27Å; N440-L442 PolarHBondContact O-N 3.42Å; N440-L442 WeakPolarHBondContact OD1-CA 3.5Å; N440-L442 VanDerWaalsContact OD1-CB 3.27Å; N440-L442 WeakPolarHBondContact OD1-CB 3.47Å; N440-L442 PolarHBondContact OD1-N 2.97Å; L442-I493 HydrophobicContact CD1-CG2 4Å; L442-I496 HydrophobicContact CB-CG2 3.89Å; L442-I496 HydrophobicContact CD1-CG2 4.3Å; L442-Y497 HydrophobicContact CD1-CE2 4Å; L442-R500 PolarHBondContact O-NH2 3.5Å
443	D	82.6	Confident	85.5	Confident	47 Å²	47	32.6 Å²	32.6	25%	0.251	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-12.5	-172.6	71.4	-3.9	0	0	0	115.1	N440 R445 I496	N440-D443 WeakPolarHBondContact CB-OD1 3.5Å; D443-R445 VanDerWaalsContact C-N 3.31Å; D443-R445 PolarHBondContact OD1-N 3.17Å; D443-R445 WeakPolarHBondContact OD2-CD 3.41Å; D443-R445 WeakPolarHBondContact OD2-CG 3.11Å; D443-I496 HydrophobicContact CB-CG2 4.28Å
444	G	83	Confident	84.5	Confident	33 Å²	33	37.1 Å²	37.1	34%	0.34	20%	0.2	S	C	.	.			trans	77.8	7.8	-178.3	0	0	0	0	0	114.8	V439 N440	V439-G444 WeakPolarHBondContact CG1-O 3.46Å; N440-G444 WeakPolarHBondContact O-CA 3.35Å; N440-G444 PolarHBondContact O-N 3.07Å
445	R	83.6	Confident	84.1	Confident	159 Å²	159	36.4 Å²	36.4	60%	0.6	20%	0.196	S	C	*	.			trans	-83.4	142.3	-179.7	-67.1	-175.5	175.7	156.9	-3.7	111.5	V439 N440 D443 V447	V439-R445 CarbonylContact C-O 3.52Å; V439-R445 WeakPolarHBondContact CA-O 3.15Å; N440-R445 PolarHBondContact N-O 3.3Å; D443-R445 VanDerWaalsContact C-N 3.31Å; D443-R445 PolarHBondContact OD1-N 3.17Å; D443-R445 WeakPolarHBondContact OD2-CD 3.41Å; D443-R445 WeakPolarHBondContact OD2-CG 3.11Å; R445-V447 PolarHBondContact O-N 3.4Å
446	A	84.8	Confident	83.4	Confident	37 Å²	37	34.3 Å²	34.3	31%	0.306	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	115.1	170.8	0	0	0	0	0	109.5	P407 A438 V439	P407-A446 HydrophobicContact CB-CB 3.92Å; A438-A446 CarbonylContact O-C 3.47Å; A438-A446 WeakPolarHBondContact O-CA 3.41Å; V439-A446 HydrophobicContact CG2-CB 4.49Å
447	V	83.3	Confident	82.3	Confident	28 Å²	28	36.5 Å²	36.5	17%	0.17	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-19.1	-178.6	-63.7	0	0	0	0	112.8	F24 H427 A438 N440 R445	F24-V447 HydrophobicContact CE2-CG2 4Å; H427-V447 VanDerWaalsContact CD2-CG2 3.47Å; H427-V447 WeakPolarHBondContact CD2-CG2 3.26Å; A438-V447 HydrophobicContact CB-CG2 3.99Å; A438-V447 PolarHBondContact O-N 3.14Å; N440-V447 HydrophobicContact CB-CG1 3.87Å; R445-V447 PolarHBondContact O-N 3.4Å
448	Y	84.2	Confident	80.9	Confident	12 Å²	12	41.2 Å²	41.2	5%	0.047	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	138.2	-177.9	-173.7	-109.9	0	0	0	110.2	F24 I436 K437 A438 M450 L484	F24-Y448 HydrophobicContact CB-CD1 3.92Å; F24-Y448 HydrophobicContact CB-CD2 3.8Å; F24-Y448 HydrophobicContact CB-CE1 3.93Å; F24-Y448 HydrophobicContact CB-CE2 3.8Å; F24-Y448 HydrophobicContact CB-CG 3.84Å; F24-Y448 HydrophobicContact CD2-CD1 4.47Å; F24-Y448 HydrophobicContact CD2-CD2 4.37Å; F24-Y448 AromaticContact CD2-CG 3.98Å; F24-Y448 HydrophobicContact CD2-CG 3.98Å; F24-Y448 HydrophobicContact CG-CD1 4.33Å; F24-Y448 HydrophobicContact CG-CG 4.2Å; F24-Y448 WeakPolarHBondContact O-CE2 3.39Å; I436-Y448 HydrophobicContact CG2-CE1 3.93Å; K437-Y448 CarbonylContact C-O 3.58Å; K437-Y448 VanDerWaalsContact CA-O 3.22Å; K437-Y448 WeakPolarHBondContact CA-O 3.12Å; A438-Y448 PolarHBondContact N-O 3.28Å; A438-Y448 PolarHBondContact O-N 3.32Å; Y448-M450 HydrophobicContact CE1-CB 3.67Å; Y448-M450 HydrophobicContact CE2-CB 4.35Å; Y448-M450 HydrophobicContact CE2-CE 4.18Å; Y448-M450 WeakPolarHBondContact OH-CB 3.39Å; Y448-L484 HydrophobicContact CE1-CD1 4.44Å
449	S	86.1	Confident	80.2	Confident	23 Å²	23	43.2 Å²	43.2	16%	0.161	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	118.2	171.4	179.8	0	0	0	0	108.9	I409 I436	I409-S449 WeakPolarHBondContact CD1-OG 3.37Å; I436-S449 WeakPolarHBondContact O-CA 3.39Å
450	M	83.8	Confident	80	Confident	51 Å²	51	52.1 Å²	52.1	25%	0.251	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129.9	-177	-173.5	67.1	76.2	0	0	110.9	A19 R435 I436 Y448	A19-M450 HydrophobicContact CB-CE 4.5Å; R435-M450 CarbonylContact C-O 3.6Å; R435-M450 VanDerWaalsContact CA-O 3.25Å; R435-M450 WeakPolarHBondContact CA-O 3.39Å; R435-M450 WeakPolarHBondContact CB-O 3.24Å; I436-M450 HydrophobicContact CG2-CB 4.05Å; I436-M450 PolarHBondContact N-O 3.46Å; I436-M450 PolarHBondContact O-N 3.17Å; Y448-M450 HydrophobicContact CE1-CB 3.67Å; Y448-M450 HydrophobicContact CE2-CB 4.35Å; Y448-M450 HydrophobicContact CE2-CE 4.18Å; Y448-M450 WeakPolarHBondContact OH-CB 3.39Å
451	P	83.6	Confident	80.1	Confident	53 Å²	53	52.2 Å²	52.2	34%	0.344	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	136.8	169.6	27.4	-33.9	0	0	0	111	D434	D434-P451 CarbonylContact O-C 3.6Å; D434-P451 WeakPolarHBondContact O-CA 3.3Å
452	L	82.8	Confident	80.1	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.301	C	S	.	.	S	Bend	trans	-83.9	-15.8	-177.3	-69	174	0	0	0	113.4	L26 V431 D434 I436 N454 I455 I456 A461 I475	L26-L452 HydrophobicContact CD2-CD2 3.43Å; L26-L452 VanDerWaalsContact CD2-CD2 3.43Å; V431-L452 HydrophobicContact CG1-CD1 4.35Å; D434-L452 PolarHBondContact O-N 3.46Å; I436-L452 HydrophobicContact CB-CD2 4.24Å; I436-L452 HydrophobicContact CG2-CD2 3.88Å; L452-N454 PolarHBondContact O-N 2.93Å; L452-I455 PolarHBondContact O-N 3.22Å; L452-I456 HydrophobicContact CB-CD1 4.02Å; L452-I456 HydrophobicContact CB-CG1 4.38Å; L452-I456 HydrophobicContact CD1-CD1 4.16Å; L452-I456 HydrophobicContact CD2-CD1 3.99Å; L452-I456 HydrophobicContact CG-CD1 4.27Å; L452-I456 PolarHBondContact O-N 3.3Å; L452-I456 VanDerWaalsContact O-N 3.15Å; L452-A461 HydrophobicContact CD1-CB 3.64Å; L452-I475 HydrophobicContact CD1-CG2 4.28Å; L452-I475 HydrophobicContact CD2-CD1 4.18Å
453	N	73.5	Confident	80.4	Confident	71 Å²	71	55 Å²	55	38%	0.38	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-37.6	-170.6	-61.9	-2.7	0	0	0	113.2	C458	N453-C458 WeakPolarHBondContact O-CA 3.49Å; N453-C458 PolarHBondContact O-N 2.86Å
454	N	68.8	Low	80.9	Confident	146 Å²	146	53.7 Å²	53.7	78%	0.781	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-20.2	-174.8	-67.8	-6.1	0	0	0	114.1	L452	L452-N454 PolarHBondContact O-N 2.93Å
455	I	75.4	Confident	81.3	Confident	42 Å²	42	52.3 Å²	52.3	22%	0.215	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-31.5	-170.6	-63.7	164.7	0	0	0	111.2	L26 S28 L452 G457 A482	L26-I455 HydrophobicContact CB-CD1 3.72Å; L26-I455 HydrophobicContact CD2-CB 4.09Å; L26-I455 HydrophobicContact CD2-CD1 3.53Å; L26-I455 HydrophobicContact CD2-CG1 4.4Å; L26-I455 HydrophobicContact CD2-CG2 3.95Å; L26-I455 HydrophobicContact CG-CD1 3.83Å; L26-I455 HydrophobicContact CG-CG2 4.04Å; S28-I455 PolarHBondContact OG-O 2.79Å; L452-I455 PolarHBondContact O-N 3.22Å; I455-G457 VanDerWaalsContact C-N 3.33Å; I455-A482 HydrophobicContact CG2-CB 3.91Å
456	I	73.7	Confident	81.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	26	-179.7	-50.2	-170.7	0	0	0	110.2	L452 C458 E459 I475 S477 H480 A482	L452-I456 HydrophobicContact CB-CD1 4.02Å; L452-I456 HydrophobicContact CB-CG1 4.38Å; L452-I456 HydrophobicContact CD1-CD1 4.16Å; L452-I456 HydrophobicContact CD2-CD1 3.99Å; L452-I456 HydrophobicContact CG-CD1 4.27Å; L452-I456 PolarHBondContact O-N 3.3Å; L452-I456 VanDerWaalsContact O-N 3.15Å; I456-C458 PolarHBondContact O-N 3.29Å; I456-E459 HydrophobicContact CG2-CB 4.34Å; I456-E459 WeakPolarHBondContact O-CB 3.47Å; I456-E459 PolarHBondContact O-N 3.22Å; I456-E459 VanDerWaalsContact O-N 3.08Å; I456-I475 HydrophobicContact CD1-CG2 3.87Å; I456-S477 WeakPolarHBondContact CG2-OG 3.35Å; I456-H480 HydrophobicContact CG2-CB 3.95Å; I456-H480 PolarHBondContact O-CD2 3.39Å; I456-A482 HydrophobicContact CD1-CB 4.31Å; I456-A482 HydrophobicContact CG1-CB 4.15Å
457	G	65	Low	81.8	Confident	46 Å²	46	45.1 Å²	45.1	47%	0.474	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	34.4	172.4	0	0	0	0	0	115.1	I455 E459	I455-G457 VanDerWaalsContact C-N 3.33Å; G457-E459 PolarHBondContact O-N 3.24Å
458	C	61.7	Low	81.6	Confident	102 Å²	102	45.8 Å²	45.8	69%	0.689	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	15.1	-174.1	-60	0	0	0	0	114.6	N453 I456	N453-C458 WeakPolarHBondContact O-CA 3.49Å; N453-C458 PolarHBondContact O-N 2.86Å; I456-C458 PolarHBondContact O-N 3.29Å
459	E	75.1	Confident	81.5	Confident	43 Å²	43	48.4 Å²	48.4	20%	0.201	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-87.5	162.4	175.3	-59.3	-171.9	159	0	0	112.4	I456 G457 S477 N479 H480	I456-E459 HydrophobicContact CG2-CB 4.34Å; I456-E459 WeakPolarHBondContact O-CB 3.47Å; I456-E459 PolarHBondContact O-N 3.22Å; I456-E459 VanDerWaalsContact O-N 3.08Å; G457-E459 PolarHBondContact O-N 3.24Å; E459-S477 WeakPolarHBondContact OE2-CB 3.38Å; E459-S477 PolarHBondContact OE2-OG 2.95Å; E459-N479 PolarHBondContact OE1-ND2 3.31Å; E459-N479 PolarHBondContact OE2-N 3.32Å; E459-H480 IonicContact OE2-CD2 3.95Å
460	R	85.8	Confident	81.3	Confident	189 Å²	189	49 Å²	49	71%	0.713	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-77.9	136.2	174.3	-67.3	-177.7	-179.1	177.2	1.8	110	V433 S477	V433-R460 HydrophobicContact CG1-CB 3.69Å; V433-R460 HydrophobicContact CG1-CG 3.54Å; V433-R460 WeakPolarHBondContact O-CA 3.37Å; R460-S477 WeakPolarHBondContact O-CB 3.38Å
461	A	89.7	Confident	81.3	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.033	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	145.1	167.8	0	0	0	0	0	110.1	L419 V431 V433 L452 I475	L419-A461 HydrophobicContact CD1-CB 4.24Å; L419-A461 WeakPolarHBondContact CD1-O 3.31Å; V431-A461 HydrophobicContact CG1-CB 4.01Å; V433-A461 PolarHBondContact O-N 3.13Å; L452-A461 HydrophobicContact CD1-CB 3.64Å; A461-I475 HydrophobicContact CB-CG2 4.22Å
462	L	90.1	Very high	81.5	Confident	62 Å²	62	50.4 Å²	50.4	33%	0.325	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-35.8	175.3	-68.8	179.1	0	0	0	111.8	L38 F476 N478	L38-L462 WeakPolarHBondContact O-CD1 3.36Å; L462-F476 HydrophobicContact CB-CD2 3.76Å; L462-F476 HydrophobicContact CB-CE2 3.42Å; L462-F476 VanDerWaalsContact CB-CE2 3.42Å; L462-F476 HydrophobicContact CB-CZ 4.09Å; L462-F476 HydrophobicContact CD1-CD2 4Å; L462-F476 HydrophobicContact CD1-CE2 3.89Å; L462-F476 HydrophobicContact CG-CD2 4.47Å; L462-F476 HydrophobicContact CG-CE2 4.34Å; L462-F476 PolarHBondContact N-O 2.95Å; L462-N478 WeakPolarHBondContact CD1-OD1 3.43Å
463	G	91.3	Very high	82	Confident	8 Å²	8	50.4 Å²	50.4	8%	0.082	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177	-175.6	-178.3	0	0	0	0	0	114.1	F476	G463-F476 VanDerWaalsContact CA-CE1 3.5Å; G463-F476 WeakPolarHBondContact O-CD1 3.12Å; G463-F476 PolarHBondContact O-N 3.47Å
464	I	93.5	Very high	82.9	Confident	18 Å²	18	47.3 Å²	47.3	9%	0.092	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	141	-179.4	-175	164.9	0	0	0	109.6	C422 I429 V431 I473 W474	C422-I464 HydrophobicContact CB-CD1 3.66Å; C422-I464 HydrophobicContact CB-CG1 4.22Å; I429-I464 HydrophobicContact CB-CD1 4.38Å; I429-I464 HydrophobicContact CG2-CD1 3.78Å; V431-I464 HydrophobicContact CB-CB 4.35Å; V431-I464 HydrophobicContact CG2-CB 3.87Å; V431-I464 HydrophobicContact CG2-CD1 3.61Å; V431-I464 HydrophobicContact CG2-CG1 4.22Å; V431-I464 HydrophobicContact CG2-CG2 4.37Å; I464-I473 HydrophobicContact CD1-CG2 3.54Å; I464-I473 HydrophobicContact CG1-CG2 3.77Å; I464-W474 CarbonylContact C-O 3.58Å; I464-W474 WeakPolarHBondContact CA-O 3.27Å
465	S	91.9	Very high	84	Confident	5 Å²	5	40.4 Å²	40.4	4%	0.035	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	134.7	175.4	-179.2	0	0	0	0	109.7	V43 W474	V43-S465 PolarHBondContact N-OG 3.39Å; S465-W474 PolarHBondContact N-O 2.93Å; S465-W474 PolarHBondContact O-N 3.02Å
466	R	90.5	Very high	84.7	Confident	44 Å²	44	39 Å²	39	17%	0.166	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.6	174.5	174.9	176.7	169.6	-152.3	-1.8	110.1	V43 C422 L423 S468 N471 R472 I473	V43-R466 CarbonylContact O-C 3.59Å; C422-R466 VanDerWaalsContact SG-CB 3.53Å; C422-R466 WeakPolarHBondContact SG-CD 3.43Å; L423-R466 PolarHBondContact O-NH1 2.62Å; R466-S468 PolarHBondContact O-N 3.22Å; R466-N471 PolarHBondContact NH2-OD1 2.88Å; R466-R472 WeakPolarHBondContact CA-O 3.38Å; R466-I473 HydrophobicContact CB-CG1 4.26Å; R466-I473 HydrophobicContact CG-CG1 4.12Å
467	D	88.5	Confident	85.5	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.208	C	C	.	.			trans	-78.3	111.6	163.7	-175.5	-4.6	0	0	0	109.2	V43 N45 N46 L469 S470 N471 R472	V43-D467 HydrophobicContact CG1-CB 4.2Å; V43-D467 WeakPolarHBondContact O-CA 3.27Å; N45-D467 PolarHBondContact N-OD1 3.12Å; N46-D467 WeakPolarHBondContact CA-OD2 3.4Å; N46-D467 PolarHBondContact N-OD2 2.75Å; D467-L469 PolarHBondContact O-N 2.77Å; D467-L469 PolarHBondContact OD1-N 3.37Å; D467-L469 VanDerWaalsContact OD1-N 3.11Å; D467-S470 VanDerWaalsContact CB-OG 3.27Å; D467-S470 WeakPolarHBondContact CB-OG 3.38Å; D467-S470 PolarHBondContact OD1-N 3.04Å; D467-S470 VanDerWaalsContact OD2-CB 3.26Å; D467-S470 WeakPolarHBondContact OD2-CB 3.41Å; D467-S470 PolarHBondContact OD2-OG 3.4Å; D467-N471 VanDerWaalsContact O-CA 3.26Å; D467-N471 WeakPolarHBondContact O-CA 3.26Å; D467-N471 PolarHBondContact O-N 3.13Å; D467-R472 PolarHBondContact N-O 2.97Å
468	S	79.4	Confident	86.6	Confident	42 Å²	42	39.8 Å²	39.8	29%	0.294	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.4	-177.1	58.3	0	0	0	0	113.5	R466	R466-S468 PolarHBondContact O-N 3.22Å
469	L	81	Confident	87.8	Confident	68 Å²	68	37.3 Å²	37.3	36%	0.356	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-46.1	-179.7	-70.6	168.4	0	0	0	112	N45 M89 D467	N45-L469 HydrophobicContact CB-CD1 3.74Å; M89-L469 HydrophobicContact CE-CD1 3.9Å; D467-L469 PolarHBondContact O-N 2.77Å; D467-L469 PolarHBondContact OD1-N 3.37Å; D467-L469 VanDerWaalsContact OD1-N 3.11Å
470	S	82.6	Confident	88.3	Confident	36 Å²	36	37.9 Å²	37.9	25%	0.252	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-5.7	-179.9	73.8	0	0	0	0	114.2	D467 R472	D467-S470 VanDerWaalsContact CB-OG 3.27Å; D467-S470 WeakPolarHBondContact CB-OG 3.38Å; D467-S470 PolarHBondContact OD1-N 3.04Å; D467-S470 VanDerWaalsContact OD2-CB 3.26Å; D467-S470 WeakPolarHBondContact OD2-CB 3.41Å; D467-S470 PolarHBondContact OD2-OG 3.4Å; S470-R472 PolarHBondContact O-N 3.45Å; S470-R472 VanDerWaalsContact O-N 3.11Å; S470-R472 WeakPolarHBondContact OG-CB 3.44Å; S470-R472 WeakPolarHBondContact OG-CD 3.41Å; S470-R472 WeakPolarHBondContact OG-CG 3.42Å
471	N	83.3	Confident	88.5	Confident	45 Å²	45	28.9 Å²	28.9	24%	0.241	15%	0.15	C	C	.	.			trans	54.2	22	-172.8	-73	-22.1	0	0	0	114.3	R466 D467 M486	R466-N471 PolarHBondContact NH2-OD1 2.88Å; D467-N471 VanDerWaalsContact O-CA 3.26Å; D467-N471 WeakPolarHBondContact O-CA 3.26Å; D467-N471 PolarHBondContact O-N 3.13Å; N471-M486 WeakPolarHBondContact O-CE 3.03Å
472	R	89	Confident	88.5	Confident	88 Å²	88	28.7 Å²	28.7	33%	0.332	15%	0.148	S	C	.	.			trans	-86.6	133.7	177	-66.8	174.8	178.7	176.6	-0.9	110.6	N46 R466 D467 S470	N46-R472 PolarHBondContact OD1-NH1 2.96Å; R466-R472 WeakPolarHBondContact CA-O 3.38Å; D467-R472 PolarHBondContact N-O 2.97Å; S470-R472 PolarHBondContact O-N 3.45Å; S470-R472 VanDerWaalsContact O-N 3.11Å; S470-R472 WeakPolarHBondContact OG-CB 3.44Å; S470-R472 WeakPolarHBondContact OG-CD 3.41Å; S470-R472 WeakPolarHBondContact OG-CG 3.42Å
473	I	91.9	Very high	88.5	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	129.3	-179.2	-61.3	171.2	0	0	0	108.8	T424 I429 I464 R466 R483 L484 M486	T424-I473 HydrophobicContact CG2-CD1 3.89Å; I429-I473 HydrophobicContact CG1-CD1 4.28Å; I464-I473 HydrophobicContact CD1-CG2 3.54Å; I464-I473 HydrophobicContact CG1-CG2 3.77Å; R466-I473 HydrophobicContact CB-CG1 4.26Å; R466-I473 HydrophobicContact CG-CG1 4.12Å; I473-R483 WeakPolarHBondContact O-CA 3.23Å; I473-L484 HydrophobicContact CB-CB 4.11Å; I473-L484 HydrophobicContact CB-CD2 4.46Å; I473-L484 HydrophobicContact CD1-CD2 4.22Å; I473-L484 HydrophobicContact CG2-CB 4.17Å; I473-L484 HydrophobicContact CG2-CD2 4.25Å; I473-L484 PolarHBondContact O-N 3.37Å; I473-M486 HydrophobicContact CD1-CE 4.21Å; I473-M486 HydrophobicContact CD1-SD 4.04Å
474	W	92.1	Very high	88.5	Confident	6 Å²	6	29.4 Å²	29.4	2%	0.023	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.7	-177.3	-62.7	91.6	0	0	0	110.2	A29 W31 V43 T62 I464 S465 A482 R483	A29-W474 HydrophobicContact CB-CZ3 3.8Å; W31-W474 AromaticContact CZ2-CH2 3.83Å; W31-W474 HydrophobicContact CZ2-CH2 3.83Å; W31-W474 HydrophobicContact CZ2-CZ3 4.11Å; V43-W474 HydrophobicContact CG2-CB 4.34Å; V43-W474 HydrophobicContact CG2-CG 4.08Å; T62-W474 HydrophobicContact CG2-CZ2 4.03Å; I464-W474 CarbonylContact C-O 3.58Å; I464-W474 WeakPolarHBondContact CA-O 3.27Å; S465-W474 PolarHBondContact N-O 2.93Å; S465-W474 PolarHBondContact O-N 3.02Å; W474-A482 CarbonylContact C-O 3.58Å; W474-A482 WeakPolarHBondContact CA-O 3.27Å; W474-R483 HydrophobicContact CE3-CB 4.07Å; W474-R483 HydrophobicContact CH2-CB 4.26Å; W474-R483 HydrophobicContact CH2-CG 4.4Å; W474-R483 HydrophobicContact CZ2-CG 4.45Å; W474-R483 HydrophobicContact CZ3-CB 3.92Å; W474-R483 HydrophobicContact CZ3-CG 4.48Å
475	I	92.6	Very high	88.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135	173.8	-52	171.6	0	0	0	106.3	L26 V431 I436 L452 I456 A461 A482	L26-I475 HydrophobicContact CD1-CD1 3.74Å; L26-I475 HydrophobicContact CD2-CD1 4.48Å; V431-I475 HydrophobicContact CG1-CG2 4.26Å; V431-I475 HydrophobicContact CG2-CD1 4.26Å; V431-I475 HydrophobicContact CG2-CG1 4.29Å; I436-I475 HydrophobicContact CB-CD1 4.39Å; I436-I475 HydrophobicContact CD1-CD1 3.39Å; I436-I475 HydrophobicContact CD1-CG1 4.45Å; I436-I475 HydrophobicContact CG1-CD1 4.43Å; L452-I475 HydrophobicContact CD1-CG2 4.28Å; L452-I475 HydrophobicContact CD2-CD1 4.18Å; I456-I475 HydrophobicContact CD1-CG2 3.87Å; A461-I475 HydrophobicContact CB-CG2 4.22Å; I475-A482 HydrophobicContact CB-CB 4.47Å; I475-A482 PolarHBondContact N-O 3.24Å; I475-A482 PolarHBondContact O-N 3.27Å
476	F	91.2	Very high	87.9	Confident	14 Å²	14	32.3 Å²	32.3	6%	0.061	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	145.9	-176.3	67.5	-83.8	0	0	0	111.9	L41 L462 G463 H480 L481	L41-F476 HydrophobicContact CB-CB 4.41Å; L41-F476 HydrophobicContact CB-CD1 3.63Å; L41-F476 HydrophobicContact CB-CD2 3.9Å; L41-F476 HydrophobicContact CB-CE1 3.72Å; L41-F476 HydrophobicContact CB-CE2 3.98Å; L41-F476 HydrophobicContact CB-CG 3.73Å; L41-F476 HydrophobicContact CB-CZ 3.91Å; L41-F476 HydrophobicContact CD2-CB 4.18Å; L41-F476 HydrophobicContact CD2-CD1 3.93Å; L41-F476 HydrophobicContact CD2-CG 4.2Å; L41-F476 HydrophobicContact CG-CD1 4.38Å; L41-F476 HydrophobicContact CG-CG 4.43Å; L462-F476 HydrophobicContact CB-CD2 3.76Å; L462-F476 HydrophobicContact CB-CE2 3.42Å; L462-F476 VanDerWaalsContact CB-CE2 3.42Å; L462-F476 HydrophobicContact CB-CZ 4.09Å; L462-F476 HydrophobicContact CD1-CD2 4Å; L462-F476 HydrophobicContact CD1-CE2 3.89Å; L462-F476 HydrophobicContact CG-CD2 4.47Å; L462-F476 HydrophobicContact CG-CE2 4.34Å; L462-F476 PolarHBondContact N-O 2.95Å; G463-F476 VanDerWaalsContact CA-CE1 3.5Å; G463-F476 WeakPolarHBondContact O-CD1 3.12Å; G463-F476 PolarHBondContact O-N 3.47Å; F476-H480 WeakPolarHBondContact CA-O 3.21Å; F476-L481 HydrophobicContact CB-CD2 3.33Å
477	S	90.2	Very high	87.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-171.2	162.1	68.8	0	0	0	0	110.7	I456 E459 R460 N479 H480	I456-S477 WeakPolarHBondContact CG2-OG 3.35Å; E459-S477 WeakPolarHBondContact OE2-CB 3.38Å; E459-S477 PolarHBondContact OE2-OG 2.95Å; R460-S477 WeakPolarHBondContact O-CB 3.38Å; S477-N479 VanDerWaalsContact C-N 3.26Å; S477-N479 PolarHBondContact O-N 3.19Å; S477-N479 PolarHBondContact OG-N 3.14Å; S477-H480 PolarHBondContact N-O 3.43Å; S477-H480 PolarHBondContact OG-N 3.4Å; S477-H480 PolarHBondContact OG-O 2.99Å
478	N	88	Confident	86.7	Confident	61 Å²	61	40.5 Å²	40.5	33%	0.326	20%	0.199	S	C	.	.	S	Bend	trans	-49.8	-45.8	169.1	-67.7	-10.4	0	0	0	112.1	S37 L38 L462	S37-N478 CarbonylContact C-O 3.52Å; S37-N478 WeakPolarHBondContact CA-O 3.39Å; L38-N478 WeakPolarHBondContact CB-O 3.42Å; L38-N478 PolarHBondContact N-O 2.95Å; L462-N478 WeakPolarHBondContact CD1-OD1 3.43Å
479	N	85.7	Confident	86.8	Confident	50 Å²	50	40 Å²	40	27%	0.267	19%	0.192	S	C	.	.	S	Bend	trans	-123.6	-10.7	-170.3	-59.6	-30	0	0	0	114.8	S37 E459 S477	S37-N479 PolarHBondContact OG-OD1 2.69Å; E459-N479 PolarHBondContact OE1-ND2 3.31Å; E459-N479 PolarHBondContact OE2-N 3.32Å; S477-N479 VanDerWaalsContact C-N 3.26Å; S477-N479 PolarHBondContact O-N 3.19Å; S477-N479 PolarHBondContact OG-N 3.14Å
480	H	86.8	Confident	86.8	Confident	55 Å²	55	39.5 Å²	39.5	26%	0.255	19%	0.189	S	C	.	.			trans	-128.2	149.1	-172.8	-63.6	-64	0	0	0	112.9	I456 E459 F476 S477	I456-H480 HydrophobicContact CG2-CB 3.95Å; I456-H480 PolarHBondContact O-CD2 3.39Å; E459-H480 IonicContact OE2-CD2 3.95Å; F476-H480 WeakPolarHBondContact CA-O 3.21Å; S477-H480 PolarHBondContact N-O 3.43Å; S477-H480 PolarHBondContact OG-N 3.4Å; S477-H480 PolarHBondContact OG-O 2.99Å
481	L	89.5	Confident	86.4	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	138.9	170.3	-72.7	-178.1	0	0	0	109.7	A29 F32 L41 L48 F476	A29-L481 HydrophobicContact CB-CB 3.87Å; A29-L481 WeakPolarHBondContact CB-O 3.33Å; A29-L481 PolarHBondContact N-O 3.38Å; F32-L481 HydrophobicContact CB-CD1 3.78Å; F32-L481 HydrophobicContact CB-CG 4.43Å; F32-L481 HydrophobicContact CD1-CB 4.34Å; F32-L481 HydrophobicContact CD1-CD1 3.25Å; F32-L481 HydrophobicContact CD1-CG 3.49Å; F32-L481 VanDerWaalsContact CD1-CG 3.49Å; F32-L481 HydrophobicContact CD2-CD1 3.82Å; F32-L481 HydrophobicContact CE1-CD1 3.63Å; F32-L481 HydrophobicContact CE1-CG 3.85Å; F32-L481 HydrophobicContact CE2-CD1 4.17Å; F32-L481 HydrophobicContact CG-CD1 3.33Å; F32-L481 HydrophobicContact CG-CG 4.05Å; F32-L481 HydrophobicContact CZ-CD1 4.07Å; L41-L481 HydrophobicContact CD1-CD2 3.85Å; L41-L481 HydrophobicContact CD2-CD2 3.87Å; L48-L481 HydrophobicContact CD1-CD1 3.52Å; F476-L481 HydrophobicContact CB-CD2 3.33Å
482	A	89.3	Confident	86.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	139.4	172.2	0	0	0	0	0	110.1	L26 D27 I455 I456 W474 I475	L26-A482 HydrophobicContact CD1-CB 3.76Å; L26-A482 HydrophobicContact CD2-CB 4.12Å; L26-A482 HydrophobicContact CG-CB 3.95Å; D27-A482 CarbonylContact O-C 3.56Å; D27-A482 WeakPolarHBondContact O-CA 3.4Å; I455-A482 HydrophobicContact CG2-CB 3.91Å; I456-A482 HydrophobicContact CD1-CB 4.31Å; I456-A482 HydrophobicContact CG1-CB 4.15Å; W474-A482 CarbonylContact C-O 3.58Å; W474-A482 WeakPolarHBondContact CA-O 3.27Å; I475-A482 HydrophobicContact CB-CB 4.47Å; I475-A482 PolarHBondContact N-O 3.24Å; I475-A482 PolarHBondContact O-N 3.27Å
483	R	90.6	Very high	85.9	Confident	80 Å²	80	38.4 Å²	38.4	30%	0.302	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.9	177.6	-176.2	-173.7	67.6	179.6	-2.7	109.2	D27 I473 W474 N485	D27-R483 PolarHBondContact N-O 3.07Å; D27-R483 PolarHBondContact O-N 3.38Å; D27-R483 IonicContact OD2-CZ 2.8Å; D27-R483 IonicContact OD2-NH2 2.92Å; D27-R483 PolarHBondContact OD2-NH2 3.11Å; I473-R483 WeakPolarHBondContact O-CA 3.23Å; W474-R483 HydrophobicContact CE3-CB 4.07Å; W474-R483 HydrophobicContact CH2-CB 4.26Å; W474-R483 HydrophobicContact CH2-CG 4.4Å; W474-R483 HydrophobicContact CZ2-CG 4.45Å; W474-R483 HydrophobicContact CZ3-CB 3.92Å; W474-R483 HydrophobicContact CZ3-CG 4.48Å; R483-N485 PolarHBondContact NE-OD1 3.02Å; R483-N485 PolarHBondContact NH2-OD1 3.02Å; R483-N485 VanDerWaalsContact NH2-OD1 3.15Å; R483-N485 PolarHBondContact O-N 3.34Å
484	L	90.5	Very high	85.6	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.026	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	113.2	172.3	-175.3	74.3	0	0	0	108.8	F24 S25 L26 I429 I436 Y448 I473	F24-L484 HydrophobicContact CB-CD1 4.17Å; F24-L484 HydrophobicContact CD1-CD1 4.23Å; F24-L484 HydrophobicContact CD1-CD2 4Å; F24-L484 HydrophobicContact CD1-CG 4.14Å; F24-L484 HydrophobicContact CE1-CD2 4.39Å; S25-L484 CarbonylContact O-C 3.52Å; L26-L484 HydrophobicContact CD1-CB 4.17Å; L26-L484 HydrophobicContact CD1-CD1 4.27Å; I429-L484 HydrophobicContact CD1-CD2 4.19Å; I429-L484 HydrophobicContact CG1-CD2 4.21Å; I429-L484 HydrophobicContact CG2-CD2 4.14Å; I436-L484 HydrophobicContact CD1-CD1 4.06Å; I436-L484 HydrophobicContact CD1-CD2 3.93Å; Y448-L484 HydrophobicContact CE1-CD1 4.44Å; I473-L484 HydrophobicContact CB-CB 4.11Å; I473-L484 HydrophobicContact CB-CD2 4.46Å; I473-L484 HydrophobicContact CD1-CD2 4.22Å; I473-L484 HydrophobicContact CG2-CB 4.17Å; I473-L484 HydrophobicContact CG2-CD2 4.25Å; I473-L484 PolarHBondContact O-N 3.37Å
485	N	87.6	Confident	85.3	Confident	28 Å²	28	42.4 Å²	42.4	15%	0.15	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	139.6	171.4	-57.6	-29.6	0	0	0	109.9	F24 S25 D27 R483	F24-N485 WeakPolarHBondContact CA-O 3.39Å; S25-N485 PolarHBondContact N-O 3.13Å; S25-N485 PolarHBondContact O-N 2.95Å; S25-N485 WeakPolarHBondContact OG-CB 3.34Å; S25-N485 PolarHBondContact OG-ND2 2.71Å; S25-N485 VanDerWaalsContact OG-ND2 3.07Å; D27-N485 PolarHBondContact OD1-ND2 3.48Å; D27-N485 PolarHBondContact OD2-ND2 3.31Å; R483-N485 PolarHBondContact NE-OD1 3.02Å; R483-N485 PolarHBondContact NH2-OD1 3.02Å; R483-N485 VanDerWaalsContact NH2-OD1 3.15Å; R483-N485 PolarHBondContact O-N 3.34Å
486	M	84.8	Confident	84.9	Confident	56 Å²	56	42.9 Å²	42.9	28%	0.276	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.2	174.7	-54.6	179.2	-69.4	0	0	107.6	I23 F24 T424 N471 I473	I23-M486 CarbonylContact O-C 3.54Å; I23-M486 VanDerWaalsContact O-CA 3.31Å; I23-M486 WeakPolarHBondContact O-CA 3.43Å; F24-M486 HydrophobicContact CD1-CG 3.75Å; F24-M486 HydrophobicContact CE1-CB 4.41Å; F24-M486 HydrophobicContact CE1-CG 3.59Å; F24-M486 HydrophobicContact CE1-SD 3.89Å; T424-M486 HydrophobicContact CG2-CE 4.29Å; T424-M486 HydrophobicContact CG2-SD 3.39Å; T424-M486 WeakPolarHBondContact CG2-SD 3.46Å; N471-M486 WeakPolarHBondContact O-CE 3.03Å; I473-M486 HydrophobicContact CD1-CE 4.21Å; I473-M486 HydrophobicContact CD1-SD 4.04Å
487	K	79.6	Confident	84.8	Confident	137 Å²	137	43.7 Å²	43.7	60%	0.596	21%	0.207	S	C	*	.			trans	-123.8	141.1	174.6	-66.2	-175.2	180	-178.7	0	107.7	I23 E489	I23-K487 CarbonylContact C-O 3.52Å; I23-K487 WeakPolarHBondContact CA-O 3.36Å; I23-K487 PolarHBondContact O-N 3.46Å; I23-K487 VanDerWaalsContact O-O 3.14Å; K487-E489 VanDerWaalsContact C-N 3.31Å; K487-E489 PolarHBondContact O-N 3.32Å
488	N	75.2	Confident	84.7	Confident	78 Å²	78	44 Å²	44	42%	0.417	21%	0.208	S	C	.	.			trans	51	43.9	175.3	-155.8	9.4	0	0	0	114.9	L490 C491 Q511	N488-L490 PolarHBondContact O-N 3.01Å; N488-C491 HydrophobicContact CB-CB 4.39Å; N488-C491 WeakPolarHBondContact ND2-CB 3.35Å; N488-C491 PolarHBondContact ND2-SG 3.31Å; N488-C491 WeakPolarHBondContact O-CB 3.33Å; N488-C491 PolarHBondContact O-N 2.93Å; N488-C491 VanDerWaalsContact O-N 3.08Å; N488-C491 PolarHBondContact OD1-N 3.49Å; N488-Q511 PolarHBondContact OD1-OE1 3.18Å
489	E	80.7	Confident	84.7	Confident	33 Å²	33	46.2 Å²	46.2	15%	0.154	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-25.5	178.4	-168.8	176.9	-177.2	0	0	112.4	T424 E425 F426 H427 K487	T424-E489 WeakPolarHBondContact CB-OE1 3.31Å; T424-E489 PolarHBondContact OG1-OE1 3.19Å; E425-E489 PolarHBondContact N-OE1 3.34Å; F426-E489 HydrophobicContact CB-CG 4.5Å; F426-E489 HydrophobicContact CD2-CG 4.18Å; F426-E489 PolarHBondContact N-OE1 3.28Å; H427-E489 IonicContact CE1-OE1 3.87Å; H427-E489 WeakPolarHBondContact ND1-CG 3.42Å; H427-E489 IonicContact ND1-OE1 2.88Å; H427-E489 PolarHBondContact ND1-OE1 3.12Å; H427-E489 VanDerWaalsContact ND1-OE1 3.12Å; K487-E489 VanDerWaalsContact C-N 3.31Å; K487-E489 PolarHBondContact O-N 3.32Å
490	L	81.9	Confident	84.8	Confident	56 Å²	56	49 Å²	49	29%	0.293	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-13.8	-176.3	-51.3	179.3	0	0	0	115	F426 N488 R492 I493 F509	F426-L490 HydrophobicContact CD2-CD2 4.05Å; F426-L490 HydrophobicContact CE2-CD2 3.43Å; F426-L490 VanDerWaalsContact CE2-CD2 3.43Å; F426-L490 HydrophobicContact CZ-CD2 4.24Å; N488-L490 PolarHBondContact O-N 3.01Å; L490-R492 PolarHBondContact O-N 3.3Å; L490-I493 HydrophobicContact CB-CD1 4.27Å; L490-I493 HydrophobicContact CD2-CD1 3.56Å; L490-I493 HydrophobicContact CG-CD1 4.5Å; L490-I493 PolarHBondContact O-N 2.9Å; L490-F509 HydrophobicContact CD2-CD1 4.16Å; L490-F509 HydrophobicContact CD2-CE1 4.34Å
491	C	74.6	Confident	84.8	Confident	45 Å²	45	50.9 Å²	50.9	30%	0.304	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48	-39.8	-167.8	-168.6	0	0	0	0	114.8	N488 W494	N488-C491 HydrophobicContact CB-CB 4.39Å; N488-C491 WeakPolarHBondContact ND2-CB 3.35Å; N488-C491 PolarHBondContact ND2-SG 3.31Å; N488-C491 WeakPolarHBondContact O-CB 3.33Å; N488-C491 PolarHBondContact O-N 2.93Å; N488-C491 VanDerWaalsContact O-N 3.08Å; N488-C491 PolarHBondContact OD1-N 3.49Å; C491-W494 VanDerWaalsContact O-CD1 3.27Å; C491-W494 PolarHBondContact O-NE1 2.92Å
492	R	77.2	Confident	84.7	Confident	100 Å²	100	54 Å²	54	38%	0.377	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-3.9	-172.6	-164.3	165.4	-176.3	130.3	8.1	113.8	D21 L490 Q495 I496	D21-R492 IonicContact OD2-NH1 2.75Å; D21-R492 PolarHBondContact OD2-NH1 3.5Å; L490-R492 PolarHBondContact O-N 3.3Å; R492-Q495 PolarHBondContact O-N 2.94Å; R492-I496 WeakPolarHBondContact O-CG1 3.41Å; R492-I496 PolarHBondContact O-N 3.3Å
493	I	84.2	Confident	84.7	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-68.5	-43.6	-170.9	-62.2	-178.8	0	0	0	111.2	F426 L442 L490 Q495 I496 Y497 F509	F426-I493 HydrophobicContact CB-CD1 4Å; F426-I493 HydrophobicContact CD1-CD1 3.57Å; F426-I493 HydrophobicContact CD1-CG1 4.38Å; F426-I493 HydrophobicContact CD2-CD1 3.1Å; F426-I493 HydrophobicContact CD2-CG1 4.41Å; F426-I493 HydrophobicContact CE1-CD1 3.73Å; F426-I493 HydrophobicContact CE1-CG2 4.25Å; F426-I493 HydrophobicContact CE2-CD1 3.27Å; F426-I493 HydrophobicContact CG-CD1 3.24Å; F426-I493 HydrophobicContact CG-CG1 4.2Å; F426-I493 HydrophobicContact CZ-CD1 3.59Å; L442-I493 HydrophobicContact CD1-CG2 4Å; L490-I493 HydrophobicContact CB-CD1 4.27Å; L490-I493 HydrophobicContact CD2-CD1 3.56Å; L490-I493 HydrophobicContact CG-CD1 4.5Å; L490-I493 PolarHBondContact O-N 2.9Å; I493-Q495 VanDerWaalsContact C-N 3.28Å; I493-Q495 PolarHBondContact O-N 2.95Å; I493-I496 PolarHBondContact O-N 2.74Å; I493-I496 VanDerWaalsContact O-N 3.13Å; I493-Y497 HydrophobicContact CG2-CD2 3.68Å; I493-Y497 HydrophobicContact CG2-CE2 3.42Å; I493-Y497 VanDerWaalsContact CG2-CE2 3.42Å; I493-Y497 WeakPolarHBondContact O-CD2 3.47Å; I493-Y497 PolarHBondContact O-N 3.42Å; I493-Y497 VanDerWaalsContact O-N 3.09Å; I493-F509 HydrophobicContact CB-CB 4.36Å; I493-F509 HydrophobicContact CB-CG 4.3Å; I493-F509 HydrophobicContact CG2-CB 4.15Å; I493-F509 HydrophobicContact CG2-CD1 4.03Å; I493-F509 HydrophobicContact CG2-CD2 3.65Å; I493-F509 HydrophobicContact CG2-CE1 4.38Å; I493-F509 HydrophobicContact CG2-CE2 4.06Å; I493-F509 HydrophobicContact CG2-CG 3.66Å; I493-F509 HydrophobicContact CG2-CZ 4.4Å
494	W	85.5	Confident	84.6	Confident	17 Å²	17	56 Å²	56	6%	0.064	27%	0.269	C	S	.	.	H	α-helix	trans	-60.3	-38.1	177.6	70	-87.8	0	0	0	111.8	C491 I496 Y497 L498 A506 F509 Q515 T518 I519	C491-W494 VanDerWaalsContact O-CD1 3.27Å; C491-W494 PolarHBondContact O-NE1 2.92Å; W494-I496 PolarHBondContact O-N 3.09Å; W494-Y497 PolarHBondContact O-N 3.31Å; W494-L498 HydrophobicContact CE3-CD2 4.21Å; W494-L498 HydrophobicContact CZ3-CD2 3.83Å; W494-L498 VanDerWaalsContact O-CB 3.25Å; W494-L498 WeakPolarHBondContact O-CB 3.5Å; W494-L498 PolarHBondContact O-N 3.26Å; W494-A506 WeakPolarHBondContact CB-O 3.41Å; W494-F509 HydrophobicContact CB-CB 4.13Å; W494-Q515 HydrophobicContact CD2-CB 4.14Å; W494-Q515 HydrophobicContact CD2-CG 4.39Å; W494-Q515 HydrophobicContact CE3-CB 4.3Å; W494-Q515 HydrophobicContact CH2-CB 4.08Å; W494-Q515 HydrophobicContact CH2-CG 4.16Å; W494-Q515 HydrophobicContact CZ2-CB 3.92Å; W494-Q515 HydrophobicContact CZ2-CG 3.57Å; W494-Q515 HydrophobicContact CZ3-CB 4.27Å; W494-T518 HydrophobicContact CH2-CG2 4.21Å; W494-T518 HydrophobicContact CZ3-CG2 4.07Å; W494-I519 HydrophobicContact CE3-CD1 4.05Å; W494-I519 HydrophobicContact CE3-CG1 3.91Å; W494-I519 HydrophobicContact CZ3-CG1 4.2Å
495	Q	85.6	Confident	84.4	Confident	74 Å²	74	58.9 Å²	58.9	35%	0.346	28%	0.282	S	S	.	.	H	α-helix	trans	-64	-39.6	175.8	-63.4	-177.2	-17.4	0	0	111.9	R492 I493 L498 D499	R492-Q495 PolarHBondContact O-N 2.94Å; I493-Q495 VanDerWaalsContact C-N 3.28Å; I493-Q495 PolarHBondContact O-N 2.95Å; Q495-L498 WeakPolarHBondContact O-CB 3.27Å; Q495-L498 PolarHBondContact O-N 3.09Å; Q495-D499 WeakPolarHBondContact O-CB 3.25Å; Q495-D499 PolarHBondContact O-N 3.45Å
496	I	85	Confident	84.4	Confident	10 Å²	10	57.5 Å²	57.5	5%	0.051	27%	0.274	C	S	.	.	H	α-helix	trans	-65.8	-42.3	178.1	-64.7	166.8	0	0	0	110.8	N440 L442 D443 R492 I493 W494 R500	N440-I496 WeakPolarHBondContact ND2-CD1 2.9Å; L442-I496 HydrophobicContact CB-CG2 3.89Å; L442-I496 HydrophobicContact CD1-CG2 4.3Å; D443-I496 HydrophobicContact CB-CG2 4.28Å; R492-I496 WeakPolarHBondContact O-CG1 3.41Å; R492-I496 PolarHBondContact O-N 3.3Å; I493-I496 PolarHBondContact O-N 2.74Å; I493-I496 VanDerWaalsContact O-N 3.13Å; W494-I496 PolarHBondContact O-N 3.09Å; I496-R500 VanDerWaalsContact O-CG 3.28Å; I496-R500 WeakPolarHBondContact O-CG 3.44Å; I496-R500 PolarHBondContact O-N 3.18Å
497	Y	88.3	Confident	84.6	Confident	31 Å²	31	58 Å²	58	12%	0.122	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-36.7	175	-74.6	-61.5	0	0	0	112.1	L442 I493 W494 R500 L501 Q502 E505 F509	L442-Y497 HydrophobicContact CD1-CE2 4Å; I493-Y497 HydrophobicContact CG2-CD2 3.68Å; I493-Y497 HydrophobicContact CG2-CE2 3.42Å; I493-Y497 VanDerWaalsContact CG2-CE2 3.42Å; I493-Y497 WeakPolarHBondContact O-CD2 3.47Å; I493-Y497 PolarHBondContact O-N 3.42Å; I493-Y497 VanDerWaalsContact O-N 3.09Å; W494-Y497 PolarHBondContact O-N 3.31Å; Y497-R500 CarbonylContact O-C 3.51Å; Y497-R500 WeakPolarHBondContact O-CA 3.35Å; Y497-R500 WeakPolarHBondContact O-CB 3.3Å; Y497-R500 PolarHBondContact O-N 3.2Å; Y497-R500 VanDerWaalsContact O-N 3.12Å; Y497-L501 PolarHBondContact O-N 2.98Å; Y497-Q502 HydrophobicContact CD1-CB 4.14Å; Y497-Q502 PolarHBondContact O-N 3.31Å; Y497-E505 HydrophobicContact CD1-CB 3.74Å; Y497-E505 HydrophobicContact CD1-CG 4.46Å; Y497-E505 HydrophobicContact CD2-CB 4.14Å; Y497-E505 HydrophobicContact CE1-CB 4.03Å; Y497-E505 HydrophobicContact CE1-CG 4.45Å; Y497-E505 HydrophobicContact CE2-CB 4.39Å; Y497-E505 HydrophobicContact CG-CB 3.81Å; Y497-F509 AromaticContact CD2-CD2 3.76Å; Y497-F509 HydrophobicContact CD2-CD2 3.76Å; Y497-F509 HydrophobicContact CD2-CE2 4.04Å; Y497-F509 AromaticContact CE2-CD2 3.59Å; Y497-F509 HydrophobicContact CE2-CD2 3.59Å; Y497-F509 AromaticContact CE2-CE2 3.39Å; Y497-F509 HydrophobicContact CE2-CE2 3.39Å; Y497-F509 HydrophobicContact CE2-CZ 4.37Å
498	L	88.1	Confident	85	Confident	5 Å²	5	58.8 Å²	58.8	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-62.8	-44	175.6	-173.2	59.5	0	0	0	112.3	W494 Q495 R500 L501 F503 A506 T518 I519 R522	W494-L498 HydrophobicContact CE3-CD2 4.21Å; W494-L498 HydrophobicContact CZ3-CD2 3.83Å; W494-L498 VanDerWaalsContact O-CB 3.25Å; W494-L498 WeakPolarHBondContact O-CB 3.5Å; W494-L498 PolarHBondContact O-N 3.26Å; Q495-L498 WeakPolarHBondContact O-CB 3.27Å; Q495-L498 PolarHBondContact O-N 3.09Å; L498-R500 PolarHBondContact O-N 3.44Å; L498-L501 PolarHBondContact O-N 2.9Å; L498-F503 HydrophobicContact CD1-CD1 3.82Å; L498-F503 HydrophobicContact CD1-CE1 3.86Å; L498-A506 HydrophobicContact CB-CB 4.4Å; L498-T518 HydrophobicContact CD2-CG2 4.18Å; L498-I519 HydrophobicContact CD1-CB 4.31Å; L498-I519 HydrophobicContact CD1-CG1 4.04Å; L498-I519 HydrophobicContact CD1-CG2 4.24Å; L498-I519 HydrophobicContact CD2-CG1 4.11Å; L498-R522 HydrophobicContact CD1-CB 3.73Å; L498-R522 HydrophobicContact CD1-CG 4.19Å; L498-R522 HydrophobicContact CD2-CB 4.49Å; L498-R522 HydrophobicContact CD2-CG 4.1Å; L498-R522 HydrophobicContact CG-CB 4.35Å; L498-R522 HydrophobicContact CG-CG 4.27Å
499	D	87.2	Confident	85.4	Confident	108 Å²	108	56.8 Å²	56.8	58%	0.578	27%	0.267	S	S	*	.	H	α-helix	trans	-66.5	-21.1	175.7	-72.4	-14.9	0	0	0	112.4	Q495 L501 R522	Q495-D499 WeakPolarHBondContact O-CB 3.25Å; Q495-D499 PolarHBondContact O-N 3.45Å; D499-L501 VanDerWaalsContact C-N 3.34Å; D499-R522 IonicContact OD1-NH1 2.73Å; D499-R522 PolarHBondContact OD1-NH1 3.49Å
500	R	87.7	Confident	85.5	Confident	110 Å²	110	56.6 Å²	56.6	42%	0.415	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	1.9	172.8	-71	173.5	177.8	-160.3	-7.9	114	L442 I496 Y497 L498 Q502	L442-R500 PolarHBondContact O-NH2 3.5Å; I496-R500 VanDerWaalsContact O-CG 3.28Å; I496-R500 WeakPolarHBondContact O-CG 3.44Å; I496-R500 PolarHBondContact O-N 3.18Å; Y497-R500 CarbonylContact O-C 3.51Å; Y497-R500 WeakPolarHBondContact O-CA 3.35Å; Y497-R500 WeakPolarHBondContact O-CB 3.3Å; Y497-R500 PolarHBondContact O-N 3.2Å; Y497-R500 VanDerWaalsContact O-N 3.12Å; L498-R500 PolarHBondContact O-N 3.44Å; R500-Q502 HydrophobicContact CB-CB 4.4Å; R500-Q502 HydrophobicContact CB-CG 4.13Å; R500-Q502 PolarHBondContact O-N 2.83Å
501	L	87.2	Confident	85.4	Confident	94 Å²	94	58.6 Å²	58.6	49%	0.492	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	24.2	-173.7	-52.4	170.8	0	0	0	113.1	Y497 L498 D499 F503 Y526	Y497-L501 PolarHBondContact O-N 2.98Å; L498-L501 PolarHBondContact O-N 2.9Å; D499-L501 VanDerWaalsContact C-N 3.34Å; L501-F503 HydrophobicContact CB-CE2 4.25Å; L501-F503 HydrophobicContact CB-CZ 4.26Å; L501-F503 HydrophobicContact CD2-CZ 3.88Å; L501-F503 WeakPolarHBondContact O-CD2 3.35Å; L501-F503 PolarHBondContact O-N 3.27Å; L501-Y526 HydrophobicContact CD1-CD2 4.14Å; L501-Y526 HydrophobicContact CD1-CE2 3.72Å; L501-Y526 HydrophobicContact CD2-CD2 4.02Å; L501-Y526 HydrophobicContact CD2-CE2 4.41Å
502	Q	88.4	Confident	85.7	Confident	65 Å²	65	60.3 Å²	60.3	30%	0.304	28%	0.283	S	S	.	.			trans	-95.3	76.5	175.9	-74	-168.6	-75.3	0	0	108.9	Y497 R500 E505 A506	Y497-Q502 HydrophobicContact CD1-CB 4.14Å; Y497-Q502 PolarHBondContact O-N 3.31Å; R500-Q502 HydrophobicContact CB-CB 4.4Å; R500-Q502 HydrophobicContact CB-CG 4.13Å; R500-Q502 PolarHBondContact O-N 2.83Å; Q502-E505 HydrophobicContact CB-CB 4.45Å; Q502-E505 WeakPolarHBondContact CB-OE2 3.28Å; Q502-E505 PolarHBondContact NE2-OE1 3.2Å; Q502-A506 WeakPolarHBondContact O-CB 3.38Å; Q502-A506 PolarHBondContact O-N 3.43Å; Q502-A506 VanDerWaalsContact O-N 3.07Å
503	F	89.3	Confident	86	Confident	19 Å²	19	61 Å²	61	8%	0.083	30%	0.3	C	S	.	.	H	α-helix	trans	-68	-39.1	-170	-56.4	-72.4	0	0	0	112.7	L498 L501 A506 R507 I519 R522 E523 Y526	L498-F503 HydrophobicContact CD1-CD1 3.82Å; L498-F503 HydrophobicContact CD1-CE1 3.86Å; L501-F503 HydrophobicContact CB-CE2 4.25Å; L501-F503 HydrophobicContact CB-CZ 4.26Å; L501-F503 HydrophobicContact CD2-CZ 3.88Å; L501-F503 WeakPolarHBondContact O-CD2 3.35Å; L501-F503 PolarHBondContact O-N 3.27Å; F503-A506 PolarHBondContact O-N 3.46Å; F503-R507 WeakPolarHBondContact O-CG 3Å; F503-R507 PolarHBondContact O-N 3.46Å; F503-I519 HydrophobicContact CD1-CG2 4.33Å; F503-R522 HydrophobicContact CE1-CB 4.34Å; F503-E523 HydrophobicContact CB-CG 4.3Å; F503-E523 HydrophobicContact CD1-CB 3.62Å; F503-E523 HydrophobicContact CD1-CG 4.01Å; F503-E523 HydrophobicContact CD2-CB 4.33Å; F503-E523 HydrophobicContact CD2-CG 3.82Å; F503-E523 HydrophobicContact CE1-CB 3.74Å; F503-E523 HydrophobicContact CE1-CG 4.27Å; F503-E523 HydrophobicContact CE2-CB 4.43Å; F503-E523 HydrophobicContact CE2-CG 4.1Å; F503-E523 HydrophobicContact CG-CB 3.93Å; F503-E523 HydrophobicContact CG-CG 3.77Å; F503-E523 HydrophobicContact CZ-CB 4.15Å; F503-E523 HydrophobicContact CZ-CG 4.32Å; F503-Y526 AromaticContact CE2-CD1 3.69Å; F503-Y526 HydrophobicContact CE2-CD1 3.69Å; F503-Y526 HydrophobicContact CE2-CE1 4.2Å; F503-Y526 HydrophobicContact CE2-CG 4.04Å; F503-Y526 HydrophobicContact CZ-CD1 4.06Å; F503-Y526 AromaticContact CZ-CG 3.94Å; F503-Y526 HydrophobicContact CZ-CG 3.94Å
504	D	88.5	Confident	86	Confident	105 Å²	105	64.6 Å²	64.6	56%	0.561	33%	0.325	S	S	*	.	H	α-helix	trans	-64.3	-45.5	-178.8	-66.2	-30.6	0	0	0	111.8	A506 R507 Q508	D504-A506 VanDerWaalsContact C-N 3.35Å; D504-R507 PolarHBondContact O-N 2.93Å; D504-R507 IonicContact OD1-CZ 3.76Å; D504-R507 IonicContact OD1-NH1 3.12Å; D504-R507 PolarHBondContact OD1-NH1 2.75Å; D504-Q508 PolarHBondContact O-N 3.06Å
505	E	86.7	Confident	86	Confident	64 Å²	64	64.6 Å²	64.6	30%	0.299	33%	0.326	S	S	.	.	H	α-helix	trans	-64.7	-40.2	174.9	-61.9	91.4	149.2	0	0	111	Y497 Q502 R507 Q508 F509	Y497-E505 HydrophobicContact CD1-CB 3.74Å; Y497-E505 HydrophobicContact CD1-CG 4.46Å; Y497-E505 HydrophobicContact CD2-CB 4.14Å; Y497-E505 HydrophobicContact CE1-CB 4.03Å; Y497-E505 HydrophobicContact CE1-CG 4.45Å; Y497-E505 HydrophobicContact CE2-CB 4.39Å; Y497-E505 HydrophobicContact CG-CB 3.81Å; Q502-E505 HydrophobicContact CB-CB 4.45Å; Q502-E505 WeakPolarHBondContact CB-OE2 3.28Å; Q502-E505 PolarHBondContact NE2-OE1 3.2Å; E505-R507 VanDerWaalsContact C-N 3.33Å; E505-R507 PolarHBondContact O-N 3.17Å; E505-Q508 PolarHBondContact O-N 3.35Å; E505-F509 WeakPolarHBondContact O-CD2 3.46Å
506	A	87.5	Confident	86.1	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-41.9	176.7	0	0	0	0	0	111.9	W494 L498 Q502 F503 D504 Q508 F509 C510 I519	W494-A506 WeakPolarHBondContact CB-O 3.41Å; L498-A506 HydrophobicContact CB-CB 4.4Å; Q502-A506 WeakPolarHBondContact O-CB 3.38Å; Q502-A506 PolarHBondContact O-N 3.43Å; Q502-A506 VanDerWaalsContact O-N 3.07Å; F503-A506 PolarHBondContact O-N 3.46Å; D504-A506 VanDerWaalsContact C-N 3.35Å; A506-Q508 VanDerWaalsContact C-N 3.3Å; A506-Q508 PolarHBondContact O-N 3.32Å; A506-F509 PolarHBondContact O-N 3.32Å; A506-C510 PolarHBondContact O-N 2.75Å; A506-I519 HydrophobicContact CB-CD1 3.58Å; A506-I519 HydrophobicContact CB-CG1 4.3Å
507	R	89.5	Confident	86.2	Confident	67 Å²	67	65.1 Å²	65.1	25%	0.253	33%	0.33	S	S	.	.	H	α-helix	trans	-63.2	-33	177.8	-68.6	-166.3	-149.8	97.7	-12.2	113	F503 D504 E505 F509 C510 M516 I519 E523	F503-R507 WeakPolarHBondContact O-CG 3Å; F503-R507 PolarHBondContact O-N 3.46Å; D504-R507 PolarHBondContact O-N 2.93Å; D504-R507 IonicContact OD1-CZ 3.76Å; D504-R507 IonicContact OD1-NH1 3.12Å; D504-R507 PolarHBondContact OD1-NH1 2.75Å; E505-R507 VanDerWaalsContact C-N 3.33Å; E505-R507 PolarHBondContact O-N 3.17Å; R507-F509 PolarHBondContact O-N 2.92Å; R507-C510 PolarHBondContact O-N 3.05Å; R507-M516 HydrophobicContact CB-CE 4.18Å; R507-M516 HydrophobicContact CB-SD 4.28Å; R507-M516 HydrophobicContact CG-CE 4.3Å; R507-M516 HydrophobicContact CG-SD 3.74Å; R507-I519 HydrophobicContact CG-CD1 4.39Å; R507-I519 HydrophobicContact CG-CG2 3.96Å; R507-E523 IonicContact CZ-OE1 3.65Å; R507-E523 IonicContact CZ-OE2 3.45Å; R507-E523 IonicContact NE-OE2 2.68Å; R507-E523 IonicContact NH2-OE1 3.74Å; R507-E523 PolarHBondContact NH2-OE1 3.46Å; R507-E523 IonicContact NH2-OE2 3.44Å; R507-E523 PolarHBondContact NH2-OE2 2.89Å
508	Q	87.1	Confident	86.3	Confident	152 Å²	152	66.3 Å²	66.3	71%	0.71	34%	0.34	S	S	*	.	H	α-helix	trans	-64.9	-27.6	177.9	-68.2	177.6	12.7	0	0	113	D504 E505 A506	D504-Q508 PolarHBondContact O-N 3.06Å; E505-Q508 PolarHBondContact O-N 3.35Å; A506-Q508 VanDerWaalsContact C-N 3.3Å; A506-Q508 PolarHBondContact O-N 3.32Å
509	F	83.7	Confident	86.3	Confident	37 Å²	37	66 Å²	66	16%	0.162	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	6.1	-178.8	-64.3	-73.3	0	0	0	113.8	F426 L490 I493 W494 Y497 E505 A506 R507	F426-F509 HydrophobicContact CE1-CE1 4.33Å; F426-F509 HydrophobicContact CE1-CZ 4.17Å; F426-F509 HydrophobicContact CE2-CE1 4.32Å; F426-F509 HydrophobicContact CZ-CD1 4.49Å; F426-F509 AromaticContact CZ-CE1 3.58Å; F426-F509 HydrophobicContact CZ-CE1 3.58Å; F426-F509 AromaticContact CZ-CZ 3.79Å; F426-F509 HydrophobicContact CZ-CZ 3.79Å; L490-F509 HydrophobicContact CD2-CD1 4.16Å; L490-F509 HydrophobicContact CD2-CE1 4.34Å; I493-F509 HydrophobicContact CB-CB 4.36Å; I493-F509 HydrophobicContact CB-CG 4.3Å; I493-F509 HydrophobicContact CG2-CB 4.15Å; I493-F509 HydrophobicContact CG2-CD1 4.03Å; I493-F509 HydrophobicContact CG2-CD2 3.65Å; I493-F509 HydrophobicContact CG2-CE1 4.38Å; I493-F509 HydrophobicContact CG2-CE2 4.06Å; I493-F509 HydrophobicContact CG2-CG 3.66Å; I493-F509 HydrophobicContact CG2-CZ 4.4Å; W494-F509 HydrophobicContact CB-CB 4.13Å; Y497-F509 AromaticContact CD2-CD2 3.76Å; Y497-F509 HydrophobicContact CD2-CD2 3.76Å; Y497-F509 HydrophobicContact CD2-CE2 4.04Å; Y497-F509 AromaticContact CE2-CD2 3.59Å; Y497-F509 HydrophobicContact CE2-CD2 3.59Å; Y497-F509 AromaticContact CE2-CE2 3.39Å; Y497-F509 HydrophobicContact CE2-CE2 3.39Å; Y497-F509 HydrophobicContact CE2-CZ 4.37Å; E505-F509 WeakPolarHBondContact O-CD2 3.46Å; A506-F509 PolarHBondContact O-N 3.32Å; R507-F509 PolarHBondContact O-N 2.92Å
510	C	82.5	Confident	86.4	Confident	29 Å²	29	62 Å²	62	20%	0.196	32%	0.317	C	S	.	.			trans	-69.6	130.2	173.7	-76.7	0	0	0	0	111.8	A506 R507 Q515 M516 I519	A506-C510 PolarHBondContact O-N 2.75Å; R507-C510 PolarHBondContact O-N 3.05Å; C510-Q515 HydrophobicContact CB-CB 4.48Å; C510-M516 HydrophobicContact CB-CE 4.08Å; C510-I519 WeakPolarHBondContact SG-CD1 3.46Å
511	Q	80.4	Confident	86.5	Confident	98 Å²	98	58.1 Å²	58.1	46%	0.458	31%	0.305	S	S	.	.			trans	-103.9	-34.1	174.2	-64.7	179.5	-11.6	0	0	112	N488	N488-Q511 PolarHBondContact OD1-OE1 3.18Å
512	D	81	Confident	86.6	Confident	81 Å²	81	59 Å²	59	43%	0.433	30%	0.301	S	S	.	.	S	Bend	trans	-114.2	147.5	-175.8	-51.2	-53.7	0	0	0	112.3	S514 Q515 M516	D512-S514 PolarHBondContact O-N 3.19Å; D512-Q515 HydrophobicContact CB-CG 4Å; D512-Q515 WeakPolarHBondContact O-CB 3.49Å; D512-Q515 PolarHBondContact O-N 3.17Å; D512-Q515 PolarHBondContact OD2-NE2 3.27Å; D512-M516 PolarHBondContact O-N 3.47Å
513	P	82.1	Confident	86.8	Confident	113 Å²	113	56.8 Å²	56.8	73%	0.734	29%	0.291	S	S	*	.	H	α-helix	trans	-58.3	-29.8	173.4	-26.1	35.1	0	0	0	114.2	Q515 M516 D517	P513-Q515 VanDerWaalsContact C-N 3.34Å; P513-M516 PolarHBondContact O-N 3.43Å; P513-D517 WeakPolarHBondContact O-CB 3.21Å; P513-D517 PolarHBondContact O-N 3.4Å
514	S	83.8	Confident	86.8	Confident	77 Å²	77	55.9 Å²	55.9	54%	0.538	29%	0.287	S	S	.	.	H	α-helix	trans	-66.8	-34.4	175.1	58.1	0	0	0	0	112.6	D512 T518	D512-S514 PolarHBondContact O-N 3.19Å; S514-T518 PolarHBondContact O-N 3.28Å; S514-T518 PolarHBondContact O-OG1 3.1Å
515	Q	87.4	Confident	86.9	Confident	18 Å²	18	54 Å²	54	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-67.5	-43.7	173.9	-58.4	173.1	4.1	0	0	109.7	W494 C510 D512 P513 D517 T518 I519	W494-Q515 HydrophobicContact CD2-CB 4.14Å; W494-Q515 HydrophobicContact CD2-CG 4.39Å; W494-Q515 HydrophobicContact CE3-CB 4.3Å; W494-Q515 HydrophobicContact CH2-CB 4.08Å; W494-Q515 HydrophobicContact CH2-CG 4.16Å; W494-Q515 HydrophobicContact CZ2-CB 3.92Å; W494-Q515 HydrophobicContact CZ2-CG 3.57Å; W494-Q515 HydrophobicContact CZ3-CB 4.27Å; C510-Q515 HydrophobicContact CB-CB 4.48Å; D512-Q515 HydrophobicContact CB-CG 4Å; D512-Q515 WeakPolarHBondContact O-CB 3.49Å; D512-Q515 PolarHBondContact O-N 3.17Å; D512-Q515 PolarHBondContact OD2-NE2 3.27Å; P513-Q515 VanDerWaalsContact C-N 3.34Å; Q515-D517 PolarHBondContact O-N 3.4Å; Q515-T518 WeakPolarHBondContact O-CB 3.44Å; Q515-T518 PolarHBondContact O-N 3.11Å; Q515-I519 WeakPolarHBondContact O-CG1 3.43Å; Q515-I519 PolarHBondContact O-N 3.39Å
516	M	86	Confident	87.1	Confident	63 Å²	63	55.5 Å²	55.5	31%	0.31	28%	0.278	S	S	.	.	H	α-helix	trans	-62	-42.5	176.7	-172.5	65	76.2	0	0	111.9	R507 C510 D512 P513 T518 I519 N520	R507-M516 HydrophobicContact CB-CE 4.18Å; R507-M516 HydrophobicContact CB-SD 4.28Å; R507-M516 HydrophobicContact CG-CE 4.3Å; R507-M516 HydrophobicContact CG-SD 3.74Å; C510-M516 HydrophobicContact CB-CE 4.08Å; D512-M516 PolarHBondContact O-N 3.47Å; P513-M516 PolarHBondContact O-N 3.43Å; M516-T518 VanDerWaalsContact C-N 3.34Å; M516-T518 PolarHBondContact O-N 3.38Å; M516-I519 PolarHBondContact O-N 3.36Å; M516-N520 WeakPolarHBondContact O-CB 3.41Å; M516-N520 VanDerWaalsContact O-CG 3.24Å; M516-N520 PolarHBondContact O-N 2.95Å; M516-N520 PolarHBondContact O-ND2 2.89Å
517	D	87.6	Confident	87.2	Confident	31 Å²	31	56 Å²	56	17%	0.166	28%	0.282	C	S	.	.	H	α-helix	trans	-59.9	-44.2	174.2	-179.2	58.5	0	0	0	111.7	P513 Q515 I519 N520 I521 S543 S544	P513-D517 WeakPolarHBondContact O-CB 3.21Å; P513-D517 PolarHBondContact O-N 3.4Å; Q515-D517 PolarHBondContact O-N 3.4Å; D517-I519 VanDerWaalsContact C-N 3.31Å; D517-I519 PolarHBondContact O-N 3.23Å; D517-N520 PolarHBondContact O-N 2.94Å; D517-I521 WeakPolarHBondContact O-CB 3.3Å; D517-I521 VanDerWaalsContact O-CG1 3.25Å; D517-I521 WeakPolarHBondContact O-CG1 3.32Å; D517-I521 PolarHBondContact O-N 3.29Å; D517-I521 WeakPolarHBondContact OD2-CD1 3.33Å; D517-S543 WeakPolarHBondContact OD1-CA 3.26Å; D517-S544 PolarHBondContact OD1-N 3.44Å; D517-S544 WeakPolarHBondContact OD2-CB 3.42Å; D517-S544 PolarHBondContact OD2-OG 2.94Å
518	T	89.7	Confident	87.1	Confident	56 Å²	56	54.3 Å²	54.3	34%	0.344	28%	0.276	S	S	.	.	H	α-helix	trans	-59.8	-40.7	175.8	-55	0	0	0	0	112.2	W494 L498 S514 Q515 M516 R522	W494-T518 HydrophobicContact CH2-CG2 4.21Å; W494-T518 HydrophobicContact CZ3-CG2 4.07Å; L498-T518 HydrophobicContact CD2-CG2 4.18Å; S514-T518 PolarHBondContact O-N 3.28Å; S514-T518 PolarHBondContact O-OG1 3.1Å; Q515-T518 WeakPolarHBondContact O-CB 3.44Å; Q515-T518 PolarHBondContact O-N 3.11Å; M516-T518 VanDerWaalsContact C-N 3.34Å; M516-T518 PolarHBondContact O-N 3.38Å; T518-R522 WeakPolarHBondContact O-CG 3.45Å; T518-R522 PolarHBondContact O-N 2.94Å; T518-R522 VanDerWaalsContact O-N 3.11Å
519	I	89.7	Confident	87.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.3	-48.4	176.2	-66.4	176.8	0	0	0	110.7	W494 L498 F503 A506 R507 C510 Q515 M516 D517 I521 R522 E523	W494-I519 HydrophobicContact CE3-CD1 4.05Å; W494-I519 HydrophobicContact CE3-CG1 3.91Å; W494-I519 HydrophobicContact CZ3-CG1 4.2Å; L498-I519 HydrophobicContact CD1-CB 4.31Å; L498-I519 HydrophobicContact CD1-CG1 4.04Å; L498-I519 HydrophobicContact CD1-CG2 4.24Å; L498-I519 HydrophobicContact CD2-CG1 4.11Å; F503-I519 HydrophobicContact CD1-CG2 4.33Å; A506-I519 HydrophobicContact CB-CD1 3.58Å; A506-I519 HydrophobicContact CB-CG1 4.3Å; R507-I519 HydrophobicContact CG-CD1 4.39Å; R507-I519 HydrophobicContact CG-CG2 3.96Å; C510-I519 WeakPolarHBondContact SG-CD1 3.46Å; Q515-I519 WeakPolarHBondContact O-CG1 3.43Å; Q515-I519 PolarHBondContact O-N 3.39Å; M516-I519 PolarHBondContact O-N 3.36Å; D517-I519 VanDerWaalsContact C-N 3.31Å; D517-I519 PolarHBondContact O-N 3.23Å; I519-I521 VanDerWaalsContact C-N 3.28Å; I519-I521 PolarHBondContact O-N 2.85Å; I519-R522 PolarHBondContact O-N 3.4Å; I519-E523 WeakPolarHBondContact O-CB 3.39Å; I519-E523 PolarHBondContact O-N 2.86Å
520	N	88.7	Confident	87.3	Confident	22 Å²	22	55.9 Å²	55.9	12%	0.118	29%	0.291	C	S	.	.	H	α-helix	trans	-59.7	-39.8	179.7	-70.6	-23.5	0	0	0	111.4	M516 D517 A524	M516-N520 WeakPolarHBondContact O-CB 3.41Å; M516-N520 VanDerWaalsContact O-CG 3.24Å; M516-N520 PolarHBondContact O-N 2.95Å; M516-N520 PolarHBondContact O-ND2 2.89Å; D517-N520 PolarHBondContact O-N 2.94Å; N520-A524 WeakPolarHBondContact O-CB 3.43Å; N520-A524 PolarHBondContact O-N 3.03Å
521	I	89.5	Confident	87.2	Confident	30 Å²	30	56 Å²	56	15%	0.154	30%	0.298	C	S	.	.	H	α-helix	trans	-60.7	-53.9	174.7	-72.9	166.9	0	0	0	110.8	D517 I519 E523 A524 E525 I545	D517-I521 WeakPolarHBondContact O-CB 3.3Å; D517-I521 VanDerWaalsContact O-CG1 3.25Å; D517-I521 WeakPolarHBondContact O-CG1 3.32Å; D517-I521 PolarHBondContact O-N 3.29Å; D517-I521 WeakPolarHBondContact OD2-CD1 3.33Å; I519-I521 VanDerWaalsContact C-N 3.28Å; I519-I521 PolarHBondContact O-N 2.85Å; I521-E523 VanDerWaalsContact C-N 3.31Å; I521-E523 PolarHBondContact O-N 2.93Å; I521-A524 WeakPolarHBondContact O-CB 3.36Å; I521-A524 PolarHBondContact O-N 3Å; I521-E525 WeakPolarHBondContact O-CG 3.35Å; I521-E525 PolarHBondContact O-N 2.54Å; I521-I545 HydrophobicContact CB-CD1 4.3Å; I521-I545 HydrophobicContact CD1-CD1 4.2Å; I521-I545 HydrophobicContact CD1-CG1 3.88Å; I521-I545 HydrophobicContact CG1-CD1 3.8Å; I521-I545 HydrophobicContact CG1-CG1 3.96Å; I521-I545 HydrophobicContact CG2-CD1 3.72Å
522	R	90.6	Very high	87.5	Confident	112 Å²	112	55.9 Å²	55.9	42%	0.423	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-38.9	-178.8	-81.5	-80.9	-170.5	87.9	1.5	112.4	L498 D499 F503 T518 I519 Y526	L498-R522 HydrophobicContact CD1-CB 3.73Å; L498-R522 HydrophobicContact CD1-CG 4.19Å; L498-R522 HydrophobicContact CD2-CB 4.49Å; L498-R522 HydrophobicContact CD2-CG 4.1Å; L498-R522 HydrophobicContact CG-CB 4.35Å; L498-R522 HydrophobicContact CG-CG 4.27Å; D499-R522 IonicContact OD1-NH1 2.73Å; D499-R522 PolarHBondContact OD1-NH1 3.49Å; F503-R522 HydrophobicContact CE1-CB 4.34Å; T518-R522 WeakPolarHBondContact O-CG 3.45Å; T518-R522 PolarHBondContact O-N 2.94Å; T518-R522 VanDerWaalsContact O-N 3.11Å; I519-R522 PolarHBondContact O-N 3.4Å; R522-Y526 WeakPolarHBondContact O-CB 3.42Å; R522-Y526 PolarHBondContact O-N 3.43Å
523	E	91.9	Very high	87.7	Confident	19 Å²	19	56 Å²	56	9%	0.089	30%	0.295	C	S	.	.	H	α-helix	trans	-70.2	-38.8	175.9	-171.5	-174.2	-168.8	0	0	111.9	F503 R507 I519 I521 Y526 N527 L539	F503-E523 HydrophobicContact CB-CG 4.3Å; F503-E523 HydrophobicContact CD1-CB 3.62Å; F503-E523 HydrophobicContact CD1-CG 4.01Å; F503-E523 HydrophobicContact CD2-CB 4.33Å; F503-E523 HydrophobicContact CD2-CG 3.82Å; F503-E523 HydrophobicContact CE1-CB 3.74Å; F503-E523 HydrophobicContact CE1-CG 4.27Å; F503-E523 HydrophobicContact CE2-CB 4.43Å; F503-E523 HydrophobicContact CE2-CG 4.1Å; F503-E523 HydrophobicContact CG-CB 3.93Å; F503-E523 HydrophobicContact CG-CG 3.77Å; F503-E523 HydrophobicContact CZ-CB 4.15Å; F503-E523 HydrophobicContact CZ-CG 4.32Å; R507-E523 IonicContact CZ-OE1 3.65Å; R507-E523 IonicContact CZ-OE2 3.45Å; R507-E523 IonicContact NE-OE2 2.68Å; R507-E523 IonicContact NH2-OE1 3.74Å; R507-E523 PolarHBondContact NH2-OE1 3.46Å; R507-E523 IonicContact NH2-OE2 3.44Å; R507-E523 PolarHBondContact NH2-OE2 2.89Å; I519-E523 WeakPolarHBondContact O-CB 3.39Å; I519-E523 PolarHBondContact O-N 2.86Å; I521-E523 VanDerWaalsContact C-N 3.31Å; I521-E523 PolarHBondContact O-N 2.93Å; E523-Y526 PolarHBondContact O-N 2.84Å; E523-N527 WeakPolarHBondContact O-CB 2.79Å; E523-N527 PolarHBondContact O-N 2.95Å; E523-N527 PolarHBondContact O-ND2 2.87Å; E523-L539 HydrophobicContact CB-CD1 4.01Å; E523-L539 HydrophobicContact CG-CD1 3.55Å
524	A	89.5	Confident	87.8	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.7	-44.5	174.8	0	0	0	0	0	111.2	N520 I521 N527 F528 A536 L539 F540	N520-A524 WeakPolarHBondContact O-CB 3.43Å; N520-A524 PolarHBondContact O-N 3.03Å; I521-A524 WeakPolarHBondContact O-CB 3.36Å; I521-A524 PolarHBondContact O-N 3Å; A524-N527 PolarHBondContact O-N 3.03Å; A524-F528 VanDerWaalsContact O-CB 3.26Å; A524-F528 WeakPolarHBondContact O-CB 3.47Å; A524-F528 PolarHBondContact O-N 2.83Å; A524-A536 WeakPolarHBondContact O-CB 3.22Å; A524-L539 HydrophobicContact CB-CB 3.63Å; A524-F540 HydrophobicContact CB-CB 4.49Å; A524-F540 HydrophobicContact CB-CD1 3.57Å; A524-F540 HydrophobicContact CB-CD2 3.79Å; A524-F540 HydrophobicContact CB-CE1 3.55Å; A524-F540 HydrophobicContact CB-CE2 3.77Å; A524-F540 HydrophobicContact CB-CG 3.67Å; A524-F540 HydrophobicContact CB-CZ 3.65Å
525	E	90.5	Very high	87.8	Confident	65 Å²	65	52.3 Å²	52.3	30%	0.304	27%	0.269	S	S	.	.	H	α-helix	trans	-61.3	-47.6	173.9	-71.3	-175	147.3	0	0	111.5	I521 N527 F528 D529 F540 R553	I521-E525 WeakPolarHBondContact O-CG 3.35Å; I521-E525 PolarHBondContact O-N 2.54Å; E525-N527 VanDerWaalsContact C-N 3.33Å; E525-N527 PolarHBondContact O-N 3.45Å; E525-F528 WeakPolarHBondContact O-CB 3.46Å; E525-F528 PolarHBondContact O-N 3.07Å; E525-F528 VanDerWaalsContact O-N 3.15Å; E525-D529 PolarHBondContact O-N 3.2Å; E525-F540 HydrophobicContact CG-CE1 4.14Å; E525-F540 HydrophobicContact CG-CZ 3.91Å; E525-R553 IonicContact OE1-NH1 3.85Å
526	Y	91.1	Very high	87.9	Confident	95 Å²	95	51.5 Å²	51.5	37%	0.373	27%	0.265	S	S	.	.	H	α-helix	trans	-58.1	-43.3	176.1	178.1	-102	0	0	0	112.5	L501 F503 R522 E523 N530	L501-Y526 HydrophobicContact CD1-CD2 4.14Å; L501-Y526 HydrophobicContact CD1-CE2 3.72Å; L501-Y526 HydrophobicContact CD2-CD2 4.02Å; L501-Y526 HydrophobicContact CD2-CE2 4.41Å; F503-Y526 AromaticContact CE2-CD1 3.69Å; F503-Y526 HydrophobicContact CE2-CD1 3.69Å; F503-Y526 HydrophobicContact CE2-CE1 4.2Å; F503-Y526 HydrophobicContact CE2-CG 4.04Å; F503-Y526 HydrophobicContact CZ-CD1 4.06Å; F503-Y526 AromaticContact CZ-CG 3.94Å; F503-Y526 HydrophobicContact CZ-CG 3.94Å; R522-Y526 WeakPolarHBondContact O-CB 3.42Å; R522-Y526 PolarHBondContact O-N 3.43Å; E523-Y526 PolarHBondContact O-N 2.84Å; Y526-N530 WeakPolarHBondContact CD1-ND2 3.17Å; Y526-N530 WeakPolarHBondContact CD2-ND2 3.22Å; Y526-N530 WeakPolarHBondContact CE1-ND2 3.39Å; Y526-N530 WeakPolarHBondContact CE2-ND2 3.44Å; Y526-N530 WeakPolarHBondContact O-CB 3.45Å; Y526-N530 VanDerWaalsContact O-CG 3.31Å; Y526-N530 PolarHBondContact O-N 3.13Å; Y526-N530 VanDerWaalsContact O-N 3.11Å; Y526-N530 PolarHBondContact O-ND2 3.46Å
527	N	88.5	Confident	87.9	Confident	12 Å²	12	48.5 Å²	48.5	6%	0.064	25%	0.251	C	S	.	.	H	α-helix	trans	-71.6	-32.5	177.6	-80.7	-81.3	0	0	0	112.8	E523 A524 E525 G531 N532 L535 A536	E523-N527 WeakPolarHBondContact O-CB 2.79Å; E523-N527 PolarHBondContact O-N 2.95Å; E523-N527 PolarHBondContact O-ND2 2.87Å; A524-N527 PolarHBondContact O-N 3.03Å; E525-N527 VanDerWaalsContact C-N 3.33Å; E525-N527 PolarHBondContact O-N 3.45Å; N527-G531 PolarHBondContact O-N 3.05Å; N527-N532 HydrophobicContact CB-CB 4.15Å; N527-N532 CarbonylContact O-C 3.52Å; N527-N532 WeakPolarHBondContact O-CA 3.33Å; N527-N532 PolarHBondContact O-N 3.29Å; N527-L535 HydrophobicContact CB-CD2 4.45Å; N527-L535 VanDerWaalsContact CG-CD2 3.5Å; N527-L535 WeakPolarHBondContact OD1-CD2 3.4Å; N527-A536 HydrophobicContact CB-CB 4.01Å
528	F	88	Confident	87.8	Confident	31 Å²	31	52.6 Å²	52.6	14%	0.136	27%	0.267	C	S	.	.	H	α-helix	trans	-65.4	-44.4	175.3	-170.6	-86.4	0	0	0	111.1	A524 E525 N530 G531 Y533 A536 F540 R553 F554 L557	A524-F528 VanDerWaalsContact O-CB 3.26Å; A524-F528 WeakPolarHBondContact O-CB 3.47Å; A524-F528 PolarHBondContact O-N 2.83Å; E525-F528 WeakPolarHBondContact O-CB 3.46Å; E525-F528 PolarHBondContact O-N 3.07Å; E525-F528 VanDerWaalsContact O-N 3.15Å; F528-N530 VanDerWaalsContact C-N 3.34Å; F528-N530 PolarHBondContact O-N 3.1Å; F528-G531 PolarHBondContact O-N 3.23Å; F528-Y533 HydrophobicContact CD2-CD1 4.13Å; F528-Y533 HydrophobicContact CE2-CD1 4.32Å; F528-Y533 WeakPolarHBondContact O-CE1 3.43Å; F528-A536 HydrophobicContact CB-CB 3.97Å; F528-A536 HydrophobicContact CD2-CB 4.42Å; F528-F540 HydrophobicContact CB-CE2 4.07Å; F528-F540 AromaticContact CD2-CE2 3.99Å; F528-F540 HydrophobicContact CD2-CE2 3.99Å; F528-F540 HydrophobicContact CG-CE2 4.29Å; F528-R553 HydrophobicContact CE2-CB 4.28Å; F528-R553 HydrophobicContact CZ-CB 4Å; F528-F554 HydrophobicContact CD2-CD1 4.48Å; F528-F554 AromaticContact CD2-CE1 3.8Å; F528-F554 HydrophobicContact CD2-CE1 3.8Å; F528-F554 AromaticContact CD2-CZ 3.97Å; F528-F554 HydrophobicContact CD2-CZ 3.97Å; F528-F554 AromaticContact CE2-CD1 3.92Å; F528-F554 HydrophobicContact CE2-CD1 3.92Å; F528-F554 AromaticContact CE2-CE1 3.7Å; F528-F554 HydrophobicContact CE2-CE1 3.7Å; F528-F554 HydrophobicContact CE2-CZ 4.1Å; F528-L557 HydrophobicContact CD2-CD1 4.42Å; F528-L557 HydrophobicContact CE1-CD1 4.29Å; F528-L557 HydrophobicContact CE2-CD1 3.47Å; F528-L557 VanDerWaalsContact CE2-CD1 3.47Å; F528-L557 HydrophobicContact CZ-CD1 3.39Å; F528-L557 HydrophobicContact CZ-CD2 4.47Å; F528-L557 HydrophobicContact CZ-CG 4.01Å
529	D	87.7	Confident	87.7	Confident	133 Å²	133	50.9 Å²	50.9	71%	0.711	26%	0.256	S	S	*	.	H	α-helix	trans	-68.8	-32.3	178.8	-68.3	-16.3	0	0	0	112.3	E525 G531	E525-D529 PolarHBondContact O-N 3.2Å; D529-G531 VanDerWaalsContact C-N 3.29Å; D529-G531 PolarHBondContact O-N 3.18Å
530	N	86.4	Confident	87.6	Confident	88 Å²	88	51 Å²	51	47%	0.471	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	3.7	176.4	-71.3	-45.6	0	0	0	114.6	Y526 F528 N532	Y526-N530 WeakPolarHBondContact CD1-ND2 3.17Å; Y526-N530 WeakPolarHBondContact CD2-ND2 3.22Å; Y526-N530 WeakPolarHBondContact CE1-ND2 3.39Å; Y526-N530 WeakPolarHBondContact CE2-ND2 3.44Å; Y526-N530 WeakPolarHBondContact O-CB 3.45Å; Y526-N530 VanDerWaalsContact O-CG 3.31Å; Y526-N530 PolarHBondContact O-N 3.13Å; Y526-N530 VanDerWaalsContact O-N 3.11Å; Y526-N530 PolarHBondContact O-ND2 3.46Å; F528-N530 VanDerWaalsContact C-N 3.34Å; F528-N530 PolarHBondContact O-N 3.1Å; N530-N532 VanDerWaalsContact C-N 3.3Å; N530-N532 PolarHBondContact O-N 3.32Å
531	G	82	Confident	87.4	Confident	33 Å²	33	49.9 Å²	49.9	34%	0.34	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	3.7	179.1	0	0	0	0	0	115.3	N527 F528 D529 Y533	N527-G531 PolarHBondContact O-N 3.05Å; F528-G531 PolarHBondContact O-N 3.23Å; D529-G531 VanDerWaalsContact C-N 3.29Å; D529-G531 PolarHBondContact O-N 3.18Å; G531-Y533 WeakPolarHBondContact O-CD2 3.41Å; G531-Y533 PolarHBondContact O-N 2.9Å
532	N	85.8	Confident	87.1	Confident	94 Å²	94	54.6 Å²	54.6	50%	0.503	27%	0.266	S	S	.	.			trans	-82.4	58.8	175.7	-70.5	-21.6	0	0	0	111.1	N527 N530 G534 L535 A536	N527-N532 HydrophobicContact CB-CB 4.15Å; N527-N532 CarbonylContact O-C 3.52Å; N527-N532 WeakPolarHBondContact O-CA 3.33Å; N527-N532 PolarHBondContact O-N 3.29Å; N530-N532 VanDerWaalsContact C-N 3.3Å; N530-N532 PolarHBondContact O-N 3.32Å; N532-G534 PolarHBondContact O-N 3.46Å; N532-G534 VanDerWaalsContact O-N 3.16Å; N532-L535 PolarHBondContact O-N 3.48Å; N532-L535 VanDerWaalsContact O-N 3.17Å; N532-A536 PolarHBondContact O-N 3.38Å; N532-A536 VanDerWaalsContact O-N 3.08Å
533	Y	86.4	Confident	86.8	Confident	84 Å²	84	49.5 Å²	49.5	33%	0.329	25%	0.248	S	C	.	.	H	α-helix	trans	-60	-31.3	-171.5	-55.4	-59.7	0	0	0	114	F528 G531 A536 A537 L557 P642	F528-Y533 HydrophobicContact CD2-CD1 4.13Å; F528-Y533 HydrophobicContact CE2-CD1 4.32Å; F528-Y533 WeakPolarHBondContact O-CE1 3.43Å; G531-Y533 WeakPolarHBondContact O-CD2 3.41Å; G531-Y533 PolarHBondContact O-N 2.9Å; Y533-A536 PolarHBondContact O-N 3.47Å; Y533-A537 VanDerWaalsContact O-CB 3.23Å; Y533-A537 WeakPolarHBondContact O-CB 3.18Å; Y533-A537 PolarHBondContact O-N 3.3Å; Y533-L557 HydrophobicContact CD1-CD1 3.5Å; Y533-L557 HydrophobicContact CE1-CD1 3.37Å; Y533-L557 HydrophobicContact CE1-CD2 4.08Å; Y533-L557 HydrophobicContact CE1-CG 4.38Å; Y533-L557 HydrophobicContact CG-CD1 4.2Å; Y533-P642 HydrophobicContact CG-CG 4.4Å
534	G	83	Confident	86.3	Confident	29 Å²	29	52.7 Å²	52.7	30%	0.299	27%	0.272	S	S	.	.	H	α-helix	trans	-67.1	-39.5	178.5	0	0	0	0	0	113.5	N532 K538	N532-G534 PolarHBondContact O-N 3.46Å; N532-G534 VanDerWaalsContact O-N 3.16Å; G534-K538 WeakPolarHBondContact O-CG 3.31Å; G534-K538 PolarHBondContact O-N 2.99Å
535	L	84.6	Confident	85.9	Confident	84 Å²	84	54 Å²	54	44%	0.44	28%	0.279	S	S	.	.	H	α-helix	trans	-73.4	-42.6	175.1	-160.4	89.6	0	0	0	110.3	N527 N532 A537 K538 L539	N527-L535 HydrophobicContact CB-CD2 4.45Å; N527-L535 VanDerWaalsContact CG-CD2 3.5Å; N527-L535 WeakPolarHBondContact OD1-CD2 3.4Å; N532-L535 PolarHBondContact O-N 3.48Å; N532-L535 VanDerWaalsContact O-N 3.17Å; L535-A537 VanDerWaalsContact C-N 3.32Å; L535-A537 PolarHBondContact O-N 3.43Å; L535-K538 PolarHBondContact O-N 3.35Å; L535-L539 HydrophobicContact CD2-CD1 4.15Å; L535-L539 HydrophobicContact CG-CD1 4.31Å; L535-L539 PolarHBondContact O-N 3.03Å; L535-L539 VanDerWaalsContact O-N 3.07Å
536	A	88.5	Confident	85.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-56.8	-44.7	176.5	0	0	0	0	0	111.9	A524 N527 F528 N532 Y533 K538 L539 F540 F554	A524-A536 WeakPolarHBondContact O-CB 3.22Å; N527-A536 HydrophobicContact CB-CB 4.01Å; F528-A536 HydrophobicContact CB-CB 3.97Å; F528-A536 HydrophobicContact CD2-CB 4.42Å; N532-A536 PolarHBondContact O-N 3.38Å; N532-A536 VanDerWaalsContact O-N 3.08Å; Y533-A536 PolarHBondContact O-N 3.47Å; A536-K538 VanDerWaalsContact C-N 3.34Å; A536-K538 PolarHBondContact O-N 2.95Å; A536-L539 PolarHBondContact O-N 2.93Å; A536-F540 HydrophobicContact CB-CD2 4.29Å; A536-F540 HydrophobicContact CB-CE2 4.24Å; A536-F540 WeakPolarHBondContact O-CB 3.44Å; A536-F540 WeakPolarHBondContact O-CD2 3.39Å; A536-F540 PolarHBondContact O-N 3.43Å; A536-F554 HydrophobicContact CB-CZ 4.36Å
537	A	85.7	Confident	84.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.4	-42.1	177.5	0	0	0	0	0	112.6	Y533 L535 A541 F554 I645 F646	Y533-A537 VanDerWaalsContact O-CB 3.23Å; Y533-A537 WeakPolarHBondContact O-CB 3.18Å; Y533-A537 PolarHBondContact O-N 3.3Å; L535-A537 VanDerWaalsContact C-N 3.32Å; L535-A537 PolarHBondContact O-N 3.43Å; A537-A541 WeakPolarHBondContact O-CB 3.49Å; A537-A541 PolarHBondContact O-N 2.92Å; A537-A541 VanDerWaalsContact O-N 3.11Å; A537-F554 HydrophobicContact CB-CE1 4.22Å; A537-F554 HydrophobicContact CB-CE2 4.16Å; A537-F554 HydrophobicContact CB-CZ 3.73Å; A537-I645 HydrophobicContact CB-CB 4.14Å; A537-I645 HydrophobicContact CB-CG2 3.82Å; A537-F646 HydrophobicContact CB-CB 3.87Å
538	K	87	Confident	84	Confident	118 Å²	118	55.7 Å²	55.7	51%	0.513	30%	0.296	S	S	.	.	H	α-helix	trans	-65.9	-39.9	177.2	-70.6	175.9	179.4	-177.9	0	112.5	G534 L535 A536 I645	G534-K538 WeakPolarHBondContact O-CG 3.31Å; G534-K538 PolarHBondContact O-N 2.99Å; L535-K538 PolarHBondContact O-N 3.35Å; A536-K538 VanDerWaalsContact C-N 3.34Å; A536-K538 PolarHBondContact O-N 2.95Å; K538-I645 HydrophobicContact CG-CG2 3.93Å
539	L	87.3	Confident	83.5	Confident	20 Å²	20	58.7 Å²	58.7	11%	0.105	31%	0.31	C	S	.	.	H	α-helix	trans	-73.3	-44.8	179.5	-68.5	168.6	0	0	0	111.7	E523 A524 L535 A536 A541 R542 S543	E523-L539 HydrophobicContact CB-CD1 4.01Å; E523-L539 HydrophobicContact CG-CD1 3.55Å; A524-L539 HydrophobicContact CB-CB 3.63Å; L535-L539 HydrophobicContact CD2-CD1 4.15Å; L535-L539 HydrophobicContact CG-CD1 4.31Å; L535-L539 PolarHBondContact O-N 3.03Å; L535-L539 VanDerWaalsContact O-N 3.07Å; A536-L539 PolarHBondContact O-N 2.93Å; L539-A541 VanDerWaalsContact C-N 3.25Å; L539-A541 PolarHBondContact O-N 3.42Å; L539-R542 PolarHBondContact O-N 3.22Å; L539-S543 PolarHBondContact O-N 3.45Å
540	F	87.8	Confident	83.3	Confident	1 Å²	1	52.5 Å²	52.5	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-60.4	-34.1	175.6	-81.9	-52.1	0	0	0	112.8	A524 E525 F528 A536 R542 S543 I545 I550 F554 F646	A524-F540 HydrophobicContact CB-CB 4.49Å; A524-F540 HydrophobicContact CB-CD1 3.57Å; A524-F540 HydrophobicContact CB-CD2 3.79Å; A524-F540 HydrophobicContact CB-CE1 3.55Å; A524-F540 HydrophobicContact CB-CE2 3.77Å; A524-F540 HydrophobicContact CB-CG 3.67Å; A524-F540 HydrophobicContact CB-CZ 3.65Å; E525-F540 HydrophobicContact CG-CE1 4.14Å; E525-F540 HydrophobicContact CG-CZ 3.91Å; F528-F540 HydrophobicContact CB-CE2 4.07Å; F528-F540 AromaticContact CD2-CE2 3.99Å; F528-F540 HydrophobicContact CD2-CE2 3.99Å; F528-F540 HydrophobicContact CG-CE2 4.29Å; A536-F540 HydrophobicContact CB-CD2 4.29Å; A536-F540 HydrophobicContact CB-CE2 4.24Å; A536-F540 WeakPolarHBondContact O-CB 3.44Å; A536-F540 WeakPolarHBondContact O-CD2 3.39Å; A536-F540 PolarHBondContact O-N 3.43Å; F540-R542 PolarHBondContact O-N 3.25Å; F540-S543 WeakPolarHBondContact O-CB 3.23Å; F540-S543 PolarHBondContact O-N 3.48Å; F540-S543 PolarHBondContact O-OG 3.25Å; F540-I545 HydrophobicContact CD1-CD1 4.03Å; F540-I545 HydrophobicContact CE1-CD1 3.82Å; F540-I550 HydrophobicContact CB-CD1 3.87Å; F540-I550 HydrophobicContact CB-CG1 4.43Å; F540-I550 HydrophobicContact CB-CG2 3.93Å; F540-I550 HydrophobicContact CD1-CD1 3.81Å; F540-I550 HydrophobicContact CD1-CG1 4.06Å; F540-I550 HydrophobicContact CD2-CG2 4.23Å; F540-I550 HydrophobicContact CG-CD1 4.06Å; F540-I550 HydrophobicContact CG-CG1 4.26Å; F540-I550 HydrophobicContact CG-CG2 4.06Å; F540-F554 AromaticContact CD2-CE2 3.93Å; F540-F554 HydrophobicContact CD2-CE2 3.93Å; F540-F554 AromaticContact CD2-CZ 3.93Å; F540-F554 HydrophobicContact CD2-CZ 3.93Å; F540-F554 HydrophobicContact CE2-CZ 4.47Å; F540-F646 HydrophobicContact CB-CD2 4.2Å; F540-F646 HydrophobicContact CB-CE2 3.99Å
541	A	84.4	Confident	82.8	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.8	-34.7	175.7	0	0	0	0	0	112.8	A537 L539 S543 F646 K650	A537-A541 WeakPolarHBondContact O-CB 3.49Å; A537-A541 PolarHBondContact O-N 2.92Å; A537-A541 VanDerWaalsContact O-N 3.11Å; L539-A541 VanDerWaalsContact C-N 3.25Å; L539-A541 PolarHBondContact O-N 3.42Å; A541-S543 VanDerWaalsContact C-N 3.34Å; A541-F646 HydrophobicContact CB-CD2 4.31Å; A541-F646 HydrophobicContact CB-CE2 4.44Å; A541-K650 HydrophobicContact CB-CB 4.11Å; A541-K650 HydrophobicContact CB-CD 4.38Å; A541-K650 WeakPolarHBondContact O-CD 3.32Å; A541-K650 PolarHBondContact O-NZ 3.36Å
542	R	83.2	Confident	82.5	Confident	128 Å²	128	50.2 Å²	50.2	48%	0.483	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-1	178.8	-64.3	-179.1	167.1	166.9	-5.1	113.7	L539 F540 Y653	L539-R542 PolarHBondContact O-N 3.22Å; F540-R542 PolarHBondContact O-N 3.25Å; R542-Y653 HydrophobicContact CB-CD2 4.31Å; R542-Y653 HydrophobicContact CB-CE2 4.23Å; R542-Y653 HydrophobicContact CG-CD2 3.77Å; R542-Y653 HydrophobicContact CG-CE2 4.12Å; R542-Y653 HydrophobicContact CG-CG 4.3Å
543	S	84.1	Confident	82.3	Confident	5 Å²	5	50 Å²	50	4%	0.035	25%	0.251	C	S	.	.	S	Bend	trans	-89.4	159	-176.4	73.8	0	0	0	0	113.7	D517 L539 F540 A541 I545	D517-S543 WeakPolarHBondContact OD1-CA 3.26Å; L539-S543 PolarHBondContact O-N 3.45Å; F540-S543 WeakPolarHBondContact O-CB 3.23Å; F540-S543 PolarHBondContact O-N 3.48Å; F540-S543 PolarHBondContact O-OG 3.25Å; A541-S543 VanDerWaalsContact C-N 3.34Å; S543-I545 VanDerWaalsContact C-N 3.29Å
544	S	81.7	Confident	82	Confident	86 Å²	86	46.1 Å²	46.1	60%	0.601	24%	0.236	S	C	*	.			trans	-79	-2	173.8	69.6	0	0	0	0	114.9	D517	D517-S544 PolarHBondContact OD1-N 3.44Å; D517-S544 WeakPolarHBondContact OD2-CB 3.42Å; D517-S544 PolarHBondContact OD2-OG 2.94Å
545	I	81	Confident	81.4	Confident	29 Å²	29	49 Å²	49	15%	0.149	24%	0.24	C	C	.	.	S	Bend	trans	-63.6	140.2	179.3	-64.4	172.1	0	0	0	110	I521 F540 S543 F547 Q549 I550	I521-I545 HydrophobicContact CB-CD1 4.3Å; I521-I545 HydrophobicContact CD1-CD1 4.2Å; I521-I545 HydrophobicContact CD1-CG1 3.88Å; I521-I545 HydrophobicContact CG1-CD1 3.8Å; I521-I545 HydrophobicContact CG1-CG1 3.96Å; I521-I545 HydrophobicContact CG2-CD1 3.72Å; F540-I545 HydrophobicContact CD1-CD1 4.03Å; F540-I545 HydrophobicContact CE1-CD1 3.82Å; S543-I545 VanDerWaalsContact C-N 3.29Å; I545-F547 PolarHBondContact O-N 2.84Å; I545-Q549 HydrophobicContact CG2-CB 4.44Å; I545-I550 HydrophobicContact CB-CD1 3.64Å; I545-I550 HydrophobicContact CB-CG1 4.27Å; I545-I550 HydrophobicContact CG2-CD1 3.64Å; I545-I550 HydrophobicContact CG2-CG1 3.7Å
546	P	81.2	Confident	81	Confident	74 Å²	74	52.9 Å²	52.9	48%	0.481	25%	0.249	S	C	.	.			trans	-50.5	127.6	175.6	-28	35.3	0	0	0	112.2	E548 Q549 I550	P546-E548 VanDerWaalsContact C-N 3.26Å; P546-E548 PolarHBondContact O-N 3.44Å; P546-Q549 HydrophobicContact CB-CB 4.37Å; P546-Q549 WeakPolarHBondContact O-CB 3.25Å; P546-Q549 PolarHBondContact O-N 3.33Å; P546-Q549 VanDerWaalsContact O-N 3.12Å; P546-I550 PolarHBondContact O-N 3.3Å
547	F	79.3	Confident	80.2	Confident	32 Å²	32	55.1 Å²	55.1	14%	0.14	26%	0.261	C	S	.	.	H	α-helix	trans	-58.2	-39.8	-172.7	163.5	-99.8	0	0	0	112.2	I545 Q549 I550 A551 F646 L647 K650 L680 W683	I545-F547 PolarHBondContact O-N 2.84Å; F547-Q549 VanDerWaalsContact C-N 3.29Å; F547-Q549 PolarHBondContact O-N 3.36Å; F547-I550 PolarHBondContact O-N 3.31Å; F547-A551 HydrophobicContact CZ-CB 4.37Å; F547-A551 WeakPolarHBondContact O-CB 3.27Å; F547-A551 PolarHBondContact O-N 2.94Å; F547-F646 AromaticContact CD2-CE1 3.56Å; F547-F646 HydrophobicContact CD2-CE1 3.56Å; F547-F646 AromaticContact CD2-CZ 3.66Å; F547-F646 HydrophobicContact CD2-CZ 3.66Å; F547-F646 HydrophobicContact CE2-CD1 4.29Å; F547-F646 AromaticContact CE2-CE1 3.4Å; F547-F646 HydrophobicContact CE2-CE1 3.4Å; F547-F646 VanDerWaalsContact CE2-CE1 3.4Å; F547-F646 AromaticContact CE2-CZ 3.99Å; F547-F646 HydrophobicContact CE2-CZ 3.99Å; F547-F646 HydrophobicContact CZ-CE1 4.44Å; F547-L647 HydrophobicContact CE2-CD2 3.84Å; F547-L647 HydrophobicContact CZ-CD2 3.73Å; F547-K650 HydrophobicContact CD2-CG 4.45Å; F547-L680 HydrophobicContact CD2-CD2 4.36Å; F547-L680 HydrophobicContact CE1-CD2 4.18Å; F547-L680 HydrophobicContact CE2-CD2 3.46Å; F547-L680 VanDerWaalsContact CE2-CD2 3.46Å; F547-L680 HydrophobicContact CZ-CD2 3.35Å; F547-W683 HydrophobicContact CE1-CE3 4.17Å; F547-W683 AromaticContact CE1-CH2 3.98Å; F547-W683 HydrophobicContact CE1-CH2 3.98Å; F547-W683 AromaticContact CE1-CZ3 3.36Å; F547-W683 HydrophobicContact CE1-CZ3 3.36Å; F547-W683 HydrophobicContact CZ-CE3 4.01Å; F547-W683 AromaticContact CZ-CZ3 3.62Å; F547-W683 HydrophobicContact CZ-CZ3 3.62Å
548	E	69.9	Low	78.9	Confident	100 Å²	100	56.2 Å²	56.2	47%	0.467	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-38.7	-179	-54.3	74.1	-161.8	0	0	111.2	P546 I550 L552 I581	P546-E548 VanDerWaalsContact C-N 3.26Å; P546-E548 PolarHBondContact O-N 3.44Å; E548-I550 VanDerWaalsContact C-N 3.35Å; E548-I550 PolarHBondContact O-N 3.11Å; E548-L552 WeakPolarHBondContact O-CB 3.26Å; E548-L552 VanDerWaalsContact O-CG 3.28Å; E548-L552 WeakPolarHBondContact O-CG 3.29Å; E548-L552 PolarHBondContact O-N 3.41Å; E548-I581 HydrophobicContact CB-CG2 4.26Å
549	Q	77.4	Confident	77.4	Confident	95 Å²	95	54.5 Å²	54.5	44%	0.444	27%	0.271	S	S	.	.	H	α-helix	trans	-64.7	-41.5	-179.6	-172.9	178.7	2.7	0	0	111.2	I545 P546 F547 R553	I545-Q549 HydrophobicContact CG2-CB 4.44Å; P546-Q549 HydrophobicContact CB-CB 4.37Å; P546-Q549 WeakPolarHBondContact O-CB 3.25Å; P546-Q549 PolarHBondContact O-N 3.33Å; P546-Q549 VanDerWaalsContact O-N 3.12Å; F547-Q549 VanDerWaalsContact C-N 3.29Å; F547-Q549 PolarHBondContact O-N 3.36Å; Q549-R553 WeakPolarHBondContact O-CG 3.49Å; Q549-R553 PolarHBondContact O-N 3.36Å
550	I	82.2	Confident	75.7	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-75.5	-43.2	179.2	-64.4	159.8	0	0	0	111	F540 I545 P546 F547 E548 L552 R553 F554 F646	F540-I550 HydrophobicContact CB-CD1 3.87Å; F540-I550 HydrophobicContact CB-CG1 4.43Å; F540-I550 HydrophobicContact CB-CG2 3.93Å; F540-I550 HydrophobicContact CD1-CD1 3.81Å; F540-I550 HydrophobicContact CD1-CG1 4.06Å; F540-I550 HydrophobicContact CD2-CG2 4.23Å; F540-I550 HydrophobicContact CG-CD1 4.06Å; F540-I550 HydrophobicContact CG-CG1 4.26Å; F540-I550 HydrophobicContact CG-CG2 4.06Å; I545-I550 HydrophobicContact CB-CD1 3.64Å; I545-I550 HydrophobicContact CB-CG1 4.27Å; I545-I550 HydrophobicContact CG2-CD1 3.64Å; I545-I550 HydrophobicContact CG2-CG1 3.7Å; P546-I550 PolarHBondContact O-N 3.3Å; F547-I550 PolarHBondContact O-N 3.31Å; E548-I550 VanDerWaalsContact C-N 3.35Å; E548-I550 PolarHBondContact O-N 3.11Å; I550-L552 VanDerWaalsContact C-N 3.29Å; I550-L552 PolarHBondContact O-N 3.43Å; I550-R553 WeakPolarHBondContact O-CB 3.44Å; I550-R553 PolarHBondContact O-N 3.14Å; I550-F554 HydrophobicContact CG2-CD2 3.6Å; I550-F554 HydrophobicContact CG2-CE2 3.47Å; I550-F554 VanDerWaalsContact CG2-CE2 3.47Å; I550-F554 WeakPolarHBondContact O-CD2 3.37Å; I550-F554 PolarHBondContact O-N 3.33Å; I550-F646 HydrophobicContact CB-CE1 4.3Å; I550-F646 HydrophobicContact CB-CE2 4.11Å; I550-F646 HydrophobicContact CB-CZ 3.74Å; I550-F646 HydrophobicContact CD1-CE2 4.25Å; I550-F646 HydrophobicContact CD1-CZ 4.29Å; I550-F646 HydrophobicContact CG2-CD1 4.36Å; I550-F646 HydrophobicContact CG2-CD2 3.87Å; I550-F646 HydrophobicContact CG2-CE1 3.95Å; I550-F646 HydrophobicContact CG2-CE2 3.43Å; I550-F646 VanDerWaalsContact CG2-CE2 3.43Å; I550-F646 HydrophobicContact CG2-CG 4.31Å; I550-F646 HydrophobicContact CG2-CZ 3.47Å; I550-F646 VanDerWaalsContact CG2-CZ 3.47Å
551	A	75.5	Confident	73.7	Confident	16 Å²	16	60.4 Å²	60.4	13%	0.132	31%	0.314	C	S	.	.	H	α-helix	trans	-57.2	-43.8	177.8	0	0	0	0	0	111.2	F547 R553 F554 F555 F646	F547-A551 HydrophobicContact CZ-CB 4.37Å; F547-A551 WeakPolarHBondContact O-CB 3.27Å; F547-A551 PolarHBondContact O-N 2.94Å; A551-R553 VanDerWaalsContact C-N 3.35Å; A551-R553 PolarHBondContact O-N 2.8Å; A551-F554 PolarHBondContact O-N 2.88Å; A551-F555 VanDerWaalsContact O-CB 3.27Å; A551-F555 WeakPolarHBondContact O-CB 3.27Å; A551-F555 PolarHBondContact O-N 3.45Å; A551-F646 HydrophobicContact CB-CE1 4.31Å
552	L	76.6	Confident	71.3	Confident	58 Å²	58	65 Å²	65	30%	0.304	35%	0.347	S	S	.	.	H	α-helix	trans	-63.6	-35.3	174.4	-75.7	174.8	0	0	0	113.3	E548 I550 R556 I581	E548-L552 WeakPolarHBondContact O-CB 3.26Å; E548-L552 VanDerWaalsContact O-CG 3.28Å; E548-L552 WeakPolarHBondContact O-CG 3.29Å; E548-L552 PolarHBondContact O-N 3.41Å; I550-L552 VanDerWaalsContact C-N 3.29Å; I550-L552 PolarHBondContact O-N 3.43Å; L552-R556 VanDerWaalsContact O-CG 3.3Å; L552-R556 WeakPolarHBondContact O-CG 3.37Å; L552-R556 PolarHBondContact O-N 3.12Å; L552-I581 HydrophobicContact CD1-CD1 4.28Å; L552-I581 HydrophobicContact CD1-CG2 4.01Å; L552-I581 HydrophobicContact CD2-CD1 4.33Å
553	R	81.4	Confident	68.9	Low	90 Å²	90	64.4 Å²	64.4	34%	0.34	36%	0.359	S	S	.	.	H	α-helix	trans	-65	-48.8	176.4	-79.3	-178.2	172.8	-172.6	-0.3	111.3	E525 F528 Q549 I550 A551 F555 R556 L557	E525-R553 IonicContact OE1-NH1 3.85Å; F528-R553 HydrophobicContact CE2-CB 4.28Å; F528-R553 HydrophobicContact CZ-CB 4Å; Q549-R553 WeakPolarHBondContact O-CG 3.49Å; Q549-R553 PolarHBondContact O-N 3.36Å; I550-R553 WeakPolarHBondContact O-CB 3.44Å; I550-R553 PolarHBondContact O-N 3.14Å; A551-R553 VanDerWaalsContact C-N 3.35Å; A551-R553 PolarHBondContact O-N 2.8Å; R553-F555 VanDerWaalsContact C-N 3.32Å; R553-F555 PolarHBondContact O-N 2.72Å; R553-R556 PolarHBondContact O-N 3.33Å; R553-L557 PolarHBondContact O-N 2.99Å
554	F	80.6	Confident	66.3	Low	1 Å²	1	70 Å²	70	0%	0.004	40%	0.399	C	S	.	.	H	α-helix	trans	-66.8	-32.7	177	-74.7	-64	0	0	0	112.7	F528 A536 A537 F540 I550 A551 L557 S558 P642 L643 F646	F528-F554 HydrophobicContact CD2-CD1 4.48Å; F528-F554 AromaticContact CD2-CE1 3.8Å; F528-F554 HydrophobicContact CD2-CE1 3.8Å; F528-F554 AromaticContact CD2-CZ 3.97Å; F528-F554 HydrophobicContact CD2-CZ 3.97Å; F528-F554 AromaticContact CE2-CD1 3.92Å; F528-F554 HydrophobicContact CE2-CD1 3.92Å; F528-F554 AromaticContact CE2-CE1 3.7Å; F528-F554 HydrophobicContact CE2-CE1 3.7Å; F528-F554 HydrophobicContact CE2-CZ 4.1Å; A536-F554 HydrophobicContact CB-CZ 4.36Å; A537-F554 HydrophobicContact CB-CE1 4.22Å; A537-F554 HydrophobicContact CB-CE2 4.16Å; A537-F554 HydrophobicContact CB-CZ 3.73Å; F540-F554 AromaticContact CD2-CE2 3.93Å; F540-F554 HydrophobicContact CD2-CE2 3.93Å; F540-F554 AromaticContact CD2-CZ 3.93Å; F540-F554 HydrophobicContact CD2-CZ 3.93Å; F540-F554 HydrophobicContact CE2-CZ 4.47Å; I550-F554 HydrophobicContact CG2-CD2 3.6Å; I550-F554 HydrophobicContact CG2-CE2 3.47Å; I550-F554 VanDerWaalsContact CG2-CE2 3.47Å; I550-F554 WeakPolarHBondContact O-CD2 3.37Å; I550-F554 PolarHBondContact O-N 3.33Å; A551-F554 PolarHBondContact O-N 2.88Å; F554-L557 HydrophobicContact CD1-CD1 4.16Å; F554-L557 PolarHBondContact O-N 3.48Å; F554-S558 PolarHBondContact O-N 3.24Å; F554-P642 HydrophobicContact CD1-CB 3.46Å; F554-P642 VanDerWaalsContact CD1-CB 3.46Å; F554-P642 HydrophobicContact CE1-CB 3.84Å; F554-P642 HydrophobicContact CG-CB 4.34Å; F554-L643 HydrophobicContact CB-CB 4.25Å; F554-L643 HydrophobicContact CB-CD1 4.2Å; F554-F646 HydrophobicContact CD2-CB 4.1Å; F554-F646 HydrophobicContact CD2-CD1 4.45Å; F554-F646 HydrophobicContact CD2-CG 4.12Å; F554-F646 HydrophobicContact CE2-CB 4.14Å; F554-F646 HydrophobicContact CE2-CD2 4.17Å; F554-F646 HydrophobicContact CE2-CG 4.16Å
555	F	71	Confident	63.9	Low	89 Å²	89	72.1 Å²	72.1	39%	0.39	41%	0.408	S	S	.	.	H	α-helix	trans	-69	-34.7	174.4	-175.8	-93.6	0	0	0	113.6	A551 R553 L557 S558 S559 L623	A551-F555 VanDerWaalsContact O-CB 3.27Å; A551-F555 WeakPolarHBondContact O-CB 3.27Å; A551-F555 PolarHBondContact O-N 3.45Å; R553-F555 VanDerWaalsContact C-N 3.32Å; R553-F555 PolarHBondContact O-N 2.72Å; F555-L557 VanDerWaalsContact C-N 3.3Å; F555-L557 PolarHBondContact O-N 3.46Å; F555-S558 PolarHBondContact O-N 2.83Å; F555-S558 PolarHBondContact O-OG 3.48Å; F555-S559 PolarHBondContact O-N 3.27Å; F555-S559 PolarHBondContact O-OG 3.16Å; F555-L623 HydrophobicContact CE2-CD2 4.33Å; F555-L623 HydrophobicContact CZ-CD2 3.61Å
556	R	75.3	Confident	61.3	Low	166 Å²	166	76.6 Å²	76.6	63%	0.626	44%	0.437	S	S	*	.	H	α-helix	trans	-69.3	-30	174.5	-74.7	174.4	-175	176.8	3.1	112.6	L552 R553 S558 S559 S560	L552-R556 VanDerWaalsContact O-CG 3.3Å; L552-R556 WeakPolarHBondContact O-CG 3.37Å; L552-R556 PolarHBondContact O-N 3.12Å; R553-R556 PolarHBondContact O-N 3.33Å; R556-S558 VanDerWaalsContact C-N 3.32Å; R556-S559 WeakPolarHBondContact CA-OG 3.47Å; R556-S559 PolarHBondContact O-N 3.16Å; R556-S559 PolarHBondContact O-OG 3.42Å; R556-S560 WeakPolarHBondContact O-CB 3.43Å; R556-S560 PolarHBondContact O-N 3.05Å; R556-S560 PolarHBondContact O-OG 3.07Å
557	L	70.6	Confident	58.9	Low	47 Å²	47	81.6 Å²	81.6	25%	0.246	45%	0.454	C	S	.	.	H	α-helix	trans	-66.8	-34.9	172.8	-69.8	173.1	0	0	0	111.8	F528 Y533 R553 F554 F555 S559	F528-L557 HydrophobicContact CD2-CD1 4.42Å; F528-L557 HydrophobicContact CE1-CD1 4.29Å; F528-L557 HydrophobicContact CE2-CD1 3.47Å; F528-L557 VanDerWaalsContact CE2-CD1 3.47Å; F528-L557 HydrophobicContact CZ-CD1 3.39Å; F528-L557 HydrophobicContact CZ-CD2 4.47Å; F528-L557 HydrophobicContact CZ-CG 4.01Å; Y533-L557 HydrophobicContact CD1-CD1 3.5Å; Y533-L557 HydrophobicContact CE1-CD1 3.37Å; Y533-L557 HydrophobicContact CE1-CD2 4.08Å; Y533-L557 HydrophobicContact CE1-CG 4.38Å; Y533-L557 HydrophobicContact CG-CD1 4.2Å; R553-L557 PolarHBondContact O-N 2.99Å; F554-L557 HydrophobicContact CD1-CD1 4.16Å; F554-L557 PolarHBondContact O-N 3.48Å; F555-L557 VanDerWaalsContact C-N 3.3Å; F555-L557 PolarHBondContact O-N 3.46Å; L557-S559 VanDerWaalsContact C-N 3.28Å; L557-S559 PolarHBondContact O-N 2.89Å
558	S	59.8	Low	56.3	Low	24 Å²	24	86.4 Å²	86.4	17%	0.168	49%	0.486	C	S	.	.	H	α-helix	trans	-71.3	-23.2	179.2	66.9	0	0	0	0	113.4	F554 F555 R556 T639	F554-S558 PolarHBondContact O-N 3.24Å; F555-S558 PolarHBondContact O-N 2.83Å; F555-S558 PolarHBondContact O-OG 3.48Å; R556-S558 VanDerWaalsContact C-N 3.32Å; S558-T639 WeakPolarHBondContact CB-O 3.39Å
559	S	54.5	Low	54.6	Low	81 Å²	81	88.4 Å²	88.4	57%	0.566	50%	0.498	S	S	*	.	H	α-helix	trans	-97	-15.3	-178	39.9	0	0	0	0	115.1	F555 R556 L557	F555-S559 PolarHBondContact O-N 3.27Å; F555-S559 PolarHBondContact O-OG 3.16Å; R556-S559 WeakPolarHBondContact CA-OG 3.47Å; R556-S559 PolarHBondContact O-N 3.16Å; R556-S559 PolarHBondContact O-OG 3.42Å; L557-S559 VanDerWaalsContact C-N 3.28Å; L557-S559 PolarHBondContact O-N 2.89Å
560	S	53	Low	52.1	Low	79 Å²	79	91.3 Å²	91.3	55%	0.552	52%	0.516	S	S	*	.			trans	-97	2.2	-171.3	49	0	0	0	0	115.7	R556 S562	R556-S560 WeakPolarHBondContact O-CB 3.43Å; R556-S560 PolarHBondContact O-N 3.05Å; R556-S560 PolarHBondContact O-OG 3.07Å; S560-S562 VanDerWaalsContact C-N 3.31Å; S560-S562 PolarHBondContact O-N 3Å
561	S	43.9	Very low	49.5	Very low	66 Å²	66	100.3 Å²	100.3	46%	0.462	56%	0.556	S	S	.	*			trans	-82.1	69.7	175.4	54.2	0	0	0	0	112.5	T639	S561-T639 WeakPolarHBondContact OG-CG2 3.25Å
562	S	34	Very low	47.2	Very low	97 Å²	97	104 Å²	104	68%	0.678	58%	0.579	S	S	*	*			trans	-125.9	133.3	161.9	62.6	0	0	0	0	109.9	S560	S560-S562 VanDerWaalsContact C-N 3.31Å; S560-S562 PolarHBondContact O-N 3Å
563	P	34.1	Very low	44.7	Very low	115 Å²	115	106.6 Å²	106.6	75%	0.747	60%	0.602	S	S	*	*			trans	-74.4	130.7	178.4	29.5	-30.5	0	0	0	109.7	T565	P563-T565 PolarHBondContact O-N 3.27Å
564	S	28.6	Very low	42.1	Very low	123 Å²	123	108.3 Å²	108.3	86%	0.86	62%	0.622	S	S	*	*			trans	-39.4	106.4	168.8	51.8	0	0	0	0	112.9
565	T	31.2	Very low	39.5	Very low	130 Å²	130	115 Å²	115	80%	0.798	66%	0.656	S	S	*	*			trans	-136.8	108.8	149.6	-18.6	0	0	0	0	108.1	P563 H567	P563-T565 PolarHBondContact O-N 3.27Å; T565-H567 PolarHBondContact O-N 2.87Å
566	T	26	Very low	37.4	Very low	124 Å²	124	117.3 Å²	117.3	76%	0.761	67%	0.672	S	S	*	*			trans	-51.6	116.4	174.8	42.6	0	0	0	0	112
567	H	30.8	Very low	35	Very low	179 Å²	179	113.1 Å²	113.1	83%	0.829	67%	0.666	S	S	*	*			trans	-154	115.7	140.6	-91.2	-64.5	0	0	0	109.7	T565 I569	T565-H567 PolarHBondContact O-N 2.87Å; H567-I569 PolarHBondContact O-N 3.48Å
568	T	26.2	Very low	33.1	Very low	133 Å²	133	113.7 Å²	113.7	82%	0.816	67%	0.674	S	S	*	*			trans	-56.2	113.7	172.4	45.5	0	0	0	0	111.3
569	I	32.7	Very low	31.7	Very low	142 Å²	142	116.8 Å²	116.8	73%	0.728	69%	0.692	S	S	*	*			trans	-135.5	112.3	156.1	-59.3	-178.8	0	0	0	107	H567 F571	H567-I569 PolarHBondContact O-N 3.48Å; I569-F571 HydrophobicContact CG2-CD2 4.03Å; I569-F571 HydrophobicContact CG2-CE2 4.07Å; I569-F571 PolarHBondContact O-N 3.25Å
570	D	25.3	Very low	30.5	Very low	155 Å²	155	118 Å²	118	83%	0.829	69%	0.691	S	S	*	*			trans	-61.7	120.2	175.1	-67.4	-50	0	0	0	111.2
571	F	28.2	Very low	29.5	Very low	192 Å²	192	119.2 Å²	119.2	84%	0.842	69%	0.691	S	S	*	*			trans	-141.7	144.6	155.8	-89.2	-78.3	0	0	0	110.5	I569	I569-F571 HydrophobicContact CG2-CD2 4.03Å; I569-F571 HydrophobicContact CG2-CE2 4.07Å; I569-F571 PolarHBondContact O-N 3.25Å
572	P	26.3	Very low	28.8	Very low	93 Å²	93	122.8 Å²	122.8	60%	0.604	70%	0.7	S	S	*	*			trans	-83.2	148.8	-140.7	31.4	-35.8	0	0	0	114.3	T574	P572-T574 PolarHBondContact O-N 2.93Å; P572-T574 PolarHBondContact O-OG1 3.03Å
573	S	24.7	Very low	28.5	Very low	113 Å²	113	123.8 Å²	123.8	79%	0.79	69%	0.694	S	S	*	*			trans	-26.2	96.3	155	52.8	0	0	0	0	113.5
574	T	26.2	Very low	28.3	Very low	126 Å²	126	122.2 Å²	122.2	77%	0.773	70%	0.699	S	S	*	*			trans	-118	92.8	162.7	-41.4	0	0	0	0	107.2	P572 I576	P572-T574 PolarHBondContact O-N 2.93Å; P572-T574 PolarHBondContact O-OG1 3.03Å; T574-I576 PolarHBondContact O-N 3.17Å; T574-I576 VanDerWaalsContact O-N 3.16Å
575	I	25.9	Very low	28.5	Very low	140 Å²	140	124.4 Å²	124.4	72%	0.718	69%	0.689	S	S	*	*			trans	-44.6	112.2	169.8	-63.4	155.2	0	0	0	107.9	P577	I575-P577 WeakPolarHBondContact O-CD 3.39Å
576	I	26.9	Very low	28.8	Very low	139 Å²	139	125.1 Å²	125.1	71%	0.713	68%	0.683	S	S	*	*			trans	-69.2	112.2	156.7	-61.8	173.7	0	0	0	104.3	T574 S578	T574-I576 PolarHBondContact O-N 3.17Å; T574-I576 VanDerWaalsContact O-N 3.16Å; I576-S578 PolarHBondContact O-N 2.61Å; I576-S578 VanDerWaalsContact O-N 3.12Å
577	P	25.8	Very low	29.3	Very low	77 Å²	77	121.9 Å²	121.9	50%	0.5	66%	0.661	S	S	.	*			trans	-62	122.2	-179.9	-18.7	32.9	0	0	0	108.2	I575 T579	I575-P577 WeakPolarHBondContact O-CD 3.39Å; P577-T579 HydrophobicContact CB-CG2 4.1Å; P577-T579 PolarHBondContact O-N 2.95Å
578	S	30	Very low	29.7	Very low	60 Å²	60	117.7 Å²	117.7	42%	0.42	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.2	22.4	173.9	47.6	0	0	0	0	113.4	I576 Q582	I576-S578 PolarHBondContact O-N 2.61Å; I576-S578 VanDerWaalsContact O-N 3.12Å; S578-Q582 WeakPolarHBondContact O-CB 3.38Å; S578-Q582 WeakPolarHBondContact O-CG 3.47Å; S578-Q582 PolarHBondContact O-N 3.47Å; S578-Q582 VanDerWaalsContact O-N 3.14Å; S578-Q582 PolarHBondContact O-OE1 3.18Å; S578-Q582 PolarHBondContact OG-OE1 3.5Å
579	T	30.6	Very low	30.4	Very low	89 Å²	89	117 Å²	117	55%	0.546	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.1	-13.4	-162.3	45.9	0	0	0	0	116	P577	P577-T579 HydrophobicContact CB-CG2 4.1Å; P577-T579 PolarHBondContact O-N 2.95Å
580	L	29.4	Very low	30.9	Very low	105 Å²	105	111.6 Å²	111.6	55%	0.55	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.7	-16.9	171.2	-98.6	111.8	0	0	0	115	I612	L580-I612 HydrophobicContact CD1-CB 4.19Å; L580-I612 HydrophobicContact CD1-CD1 3.82Å; L580-I612 HydrophobicContact CD1-CG1 3.73Å; L580-I612 HydrophobicContact CD1-CG2 3.37Å; L580-I612 HydrophobicContact CD2-CG2 3.47Å; L580-I612 VanDerWaalsContact CD2-CG2 3.47Å; L580-I612 HydrophobicContact CG-CD1 4.49Å; L580-I612 HydrophobicContact CG-CG2 4.01Å
581	I	31.5	Very low	31.8	Very low	106 Å²	106	110.7 Å²	110.7	54%	0.544	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.2	-11.5	179	-57.3	174	0	0	0	110.8	E548 L552	E548-I581 HydrophobicContact CB-CG2 4.26Å; L552-I581 HydrophobicContact CD1-CD1 4.28Å; L552-I581 HydrophobicContact CD1-CG2 4.01Å; L552-I581 HydrophobicContact CD2-CD1 4.33Å
582	Q	29.5	Very low	32.6	Very low	141 Å²	141	106.9 Å²	106.9	66%	0.659	59%	0.588	S	S	*	*	S	Bend	trans	-95.4	-5.7	175	-75.2	179.5	-37.8	0	0	115.2	S578	S578-Q582 WeakPolarHBondContact O-CB 3.38Å; S578-Q582 WeakPolarHBondContact O-CG 3.47Å; S578-Q582 PolarHBondContact O-N 3.47Å; S578-Q582 VanDerWaalsContact O-N 3.14Å; S578-Q582 PolarHBondContact O-OE1 3.18Å; S578-Q582 PolarHBondContact OG-OE1 3.5Å
583	Q	29.4	Very low	33.7	Very low	118 Å²	118	105.3 Å²	105.3	55%	0.551	57%	0.573	S	S	*	*	S	Bend	trans	-104	94.6	170.1	-65.5	-173	-34.6	0	0	107.5	Y585	Q583-Y585 HydrophobicContact CB-CD2 3.61Å; Q583-Y585 HydrophobicContact CB-CE2 3.42Å; Q583-Y585 VanDerWaalsContact CB-CE2 3.42Å; Q583-Y585 HydrophobicContact CG-CE2 4.21Å; Q583-Y585 PolarHBondContact O-N 3.09Å
584	G	29	Very low	34.6	Very low	82 Å²	82	102.4 Å²	102.4	85%	0.845	55%	0.548	S	S	*	.			trans	-63.8	71.5	173.7	0	0	0	0	0	111.1	E586	G584-E586 VanDerWaalsContact C-N 3.34Å; G584-E586 PolarHBondContact O-N 3.38Å; G584-E586 VanDerWaalsContact O-N 3.14Å
585	Y	33.3	Very low	35.4	Very low	168 Å²	168	100.9 Å²	100.9	66%	0.659	53%	0.532	S	S	*	.			trans	-77.6	94.7	166.1	-72.9	-74.4	0	0	0	106.5	Q583 I587	Q583-Y585 HydrophobicContact CB-CD2 3.61Å; Q583-Y585 HydrophobicContact CB-CE2 3.42Å; Q583-Y585 VanDerWaalsContact CB-CE2 3.42Å; Q583-Y585 HydrophobicContact CG-CE2 4.21Å; Q583-Y585 PolarHBondContact O-N 3.09Å; Y585-I587 PolarHBondContact O-N 3.05Å
586	E	36.1	Very low	36.4	Very low	145 Å²	145	95.6 Å²	95.6	68%	0.678	51%	0.509	S	S	*	.			trans	-44	114.1	143.5	-68.8	177.5	158.6	0	0	106.1	G584 N588	G584-E586 VanDerWaalsContact C-N 3.34Å; G584-E586 PolarHBondContact O-N 3.38Å; G584-E586 VanDerWaalsContact O-N 3.14Å; E586-N588 VanDerWaalsContact CB-CG 3.47Å; E586-N588 VanDerWaalsContact CB-ND2 3.31Å; E586-N588 WeakPolarHBondContact CB-ND2 3.23Å; E586-N588 WeakPolarHBondContact CB-OD1 3.28Å; E586-N588 PolarHBondContact O-N 3.36Å; E586-N588 PolarHBondContact OE2-ND2 3.35Å
587	I	38.2	Very low	37.3	Very low	57 Å²	57	92.4 Å²	92.4	29%	0.292	49%	0.493	S	S	.	.			trans	-67.2	84.5	171.5	-58.3	167	0	0	0	104.7	Y585 I593	Y585-I587 PolarHBondContact O-N 3.05Å; I587-I593 HydrophobicContact CB-CD1 4.16Å; I587-I593 HydrophobicContact CD1-CD1 3.36Å; I587-I593 HydrophobicContact CG1-CD1 3.59Å; I587-I593 HydrophobicContact CG2-CD1 3.47Å; I587-I593 VanDerWaalsContact CG2-CD1 3.47Å; I587-I593 HydrophobicContact CG2-CG1 4.23Å
588	N	38.9	Very low	38.1	Very low	91 Å²	91	93.1 Å²	93.1	49%	0.487	49%	0.492	S	S	.	.			trans	-91.7	-12.8	-173.1	-82	-23.8	0	0	0	112.1	E586	E586-N588 VanDerWaalsContact CB-CG 3.47Å; E586-N588 VanDerWaalsContact CB-ND2 3.31Å; E586-N588 WeakPolarHBondContact CB-ND2 3.23Å; E586-N588 WeakPolarHBondContact CB-OD1 3.28Å; E586-N588 PolarHBondContact O-N 3.36Å; E586-N588 PolarHBondContact OE2-ND2 3.35Å
589	D	39.6	Very low	38.5	Very low	117 Å²	117	92.4 Å²	92.4	63%	0.626	49%	0.487	S	S	*	.			trans	-135.1	108	176.9	-75.4	-47.7	0	0	0	109.7	H591 D592	D589-H591 PolarHBondContact O-N 3.45Å; D589-D592 PolarHBondContact O-N 3.18Å
590	D	43.6	Very low	38.9	Very low	29 Å²	29	96 Å²	96	16%	0.155	50%	0.498	C	S	.	.	H	α-helix	trans	-57	-14.5	175.8	-66.4	-66.8	0	0	0	113.7	M594 V671 N672	D590-M594 WeakPolarHBondContact O-CB 3.34Å; D590-M594 WeakPolarHBondContact O-CG 3.49Å; D590-M594 PolarHBondContact O-N 3.45Å; D590-V671 HydrophobicContact CB-CG1 3.65Å; D590-V671 VanDerWaalsContact CG-C 3.44Å; D590-V671 VanDerWaalsContact OD1-C 3.3Å; D590-V671 WeakPolarHBondContact OD2-CA 3.48Å; D590-V671 WeakPolarHBondContact OD2-CB 3.46Å; D590-V671 WeakPolarHBondContact OD2-CG1 3.34Å; D590-N672 WeakPolarHBondContact OD1-CA 3.44Å; D590-N672 PolarHBondContact OD1-N 3.24Å; D590-N672 PolarHBondContact OD2-N 3.17Å; D590-N672 PolarHBondContact OD2-OD1 3.5Å
591	H	45.8	Very low	39.1	Very low	137 Å²	137	96.3 Å²	96.3	63%	0.634	51%	0.509	S	S	*	.	H	α-helix	trans	-67.6	-40.9	-178.9	-135.7	8.2	0	0	0	112.3	D589 I593 E595	D589-H591 PolarHBondContact O-N 3.45Å; H591-I593 PolarHBondContact O-N 3.05Å; H591-E595 WeakPolarHBondContact O-CB 3.32Å; H591-E595 PolarHBondContact O-N 2.97Å
592	D	45	Very low	39	Very low	112 Å²	112	98.4 Å²	98.4	60%	0.599	52%	0.516	S	S	*	.	H	α-helix	trans	-74	-32.3	-170.4	-73.4	-12.1	0	0	0	113.6	D589 A596	D589-D592 PolarHBondContact O-N 3.18Å; D592-A596 VanDerWaalsContact O-CB 3.25Å; D592-A596 WeakPolarHBondContact O-CB 3.23Å; D592-A596 PolarHBondContact O-N 3.25Å
593	I	48.3	Very low	39	Very low	59 Å²	59	101.1 Å²	101.1	30%	0.303	52%	0.522	S	S	.	.	H	α-helix	trans	-83.5	-39.3	177.8	-63.3	-174.3	0	0	0	110.8	I587 H591 A596 L597	I587-I593 HydrophobicContact CB-CD1 4.16Å; I587-I593 HydrophobicContact CD1-CD1 3.36Å; I587-I593 HydrophobicContact CG1-CD1 3.59Å; I587-I593 HydrophobicContact CG2-CD1 3.47Å; I587-I593 VanDerWaalsContact CG2-CD1 3.47Å; I587-I593 HydrophobicContact CG2-CG1 4.23Å; H591-I593 PolarHBondContact O-N 3.05Å; I593-A596 PolarHBondContact O-N 3.38Å; I593-L597 HydrophobicContact CG2-CD1 3.82Å; I593-L597 WeakPolarHBondContact O-CB 3.37Å; I593-L597 WeakPolarHBondContact O-CG 3.27Å; I593-L597 PolarHBondContact O-N 3.1Å; I593-L597 VanDerWaalsContact O-N 3.07Å
594	M	43.6	Very low	39	Very low	53 Å²	53	105 Å²	105	26%	0.261	54%	0.54	S	S	.	.	H	α-helix	trans	-66.7	-41.3	176.3	-67.2	-78.5	-82	0	0	110.9	D590 L597 I598 E764	D590-M594 WeakPolarHBondContact O-CB 3.34Å; D590-M594 WeakPolarHBondContact O-CG 3.49Å; D590-M594 PolarHBondContact O-N 3.45Å; M594-L597 PolarHBondContact O-N 3.37Å; M594-I598 HydrophobicContact CB-CD1 4.21Å; M594-I598 HydrophobicContact CE-CD1 4.11Å; M594-I598 WeakPolarHBondContact O-CB 3.34Å; M594-I598 WeakPolarHBondContact O-CD1 3.43Å; M594-I598 WeakPolarHBondContact O-CG1 3.43Å; M594-I598 PolarHBondContact O-N 2.85Å; M594-I598 HydrophobicContact SD-CD1 4.35Å; M594-E764 WeakPolarHBondContact CE-OE2 3.38Å
595	E	43.9	Very low	39	Very low	94 Å²	94	106.5 Å²	106.5	44%	0.439	53%	0.533	S	S	.	.	H	α-helix	trans	-69.1	-36.8	178.3	-161.8	169.7	-147.6	0	0	111.4	H591 S599	H591-E595 WeakPolarHBondContact O-CB 3.32Å; H591-E595 PolarHBondContact O-N 2.97Å; E595-S599 WeakPolarHBondContact O-CB 3.46Å; E595-S599 PolarHBondContact O-N 2.92Å; E595-S599 VanDerWaalsContact O-N 3.11Å; E595-S599 PolarHBondContact O-OG 3.05Å
596	A	47.2	Very low	38.9	Very low	29 Å²	29	104 Å²	104	24%	0.24	53%	0.53	C	S	.	.	H	α-helix	trans	-70.1	-29.9	175.9	0	0	0	0	0	114.4	D592 I593	D592-A596 VanDerWaalsContact O-CB 3.25Å; D592-A596 WeakPolarHBondContact O-CB 3.23Å; D592-A596 PolarHBondContact O-N 3.25Å; I593-A596 PolarHBondContact O-N 3.38Å
597	L	44	Very low	38.8	Very low	72 Å²	72	106 Å²	106	38%	0.377	54%	0.54	S	S	.	.	H	α-helix	trans	-85.9	-31.2	178.1	-72.1	169.4	0	0	0	113	I593 M594	I593-L597 HydrophobicContact CG2-CD1 3.82Å; I593-L597 WeakPolarHBondContact O-CB 3.37Å; I593-L597 WeakPolarHBondContact O-CG 3.27Å; I593-L597 PolarHBondContact O-N 3.1Å; I593-L597 VanDerWaalsContact O-N 3.07Å; M594-L597 PolarHBondContact O-N 3.37Å
598	I	43.6	Very low	38.7	Very low	92 Å²	92	111.3 Å²	111.3	47%	0.472	56%	0.561	S	S	.	*	H	α-helix	trans	-95.7	-24	-171.4	-61.5	169.6	0	0	0	112.4	M594 E764	M594-I598 HydrophobicContact CB-CD1 4.21Å; M594-I598 HydrophobicContact CE-CD1 4.11Å; M594-I598 WeakPolarHBondContact O-CB 3.34Å; M594-I598 WeakPolarHBondContact O-CD1 3.43Å; M594-I598 WeakPolarHBondContact O-CG1 3.43Å; M594-I598 PolarHBondContact O-N 2.85Å; M594-I598 HydrophobicContact SD-CD1 4.35Å; I598-E764 HydrophobicContact CD1-CB 4.38Å
599	S	38.3	Very low	38.4	Very low	45 Å²	45	111.2 Å²	111.2	32%	0.315	56%	0.56	S	S	.	*			trans	-114.2	47.3	-170.6	75.5	0	0	0	0	115.3	E595 S601	E595-S599 WeakPolarHBondContact O-CB 3.46Å; E595-S599 PolarHBondContact O-N 2.92Å; E595-S599 VanDerWaalsContact O-N 3.11Å; E595-S599 PolarHBondContact O-OG 3.05Å; S599-S601 PolarHBondContact O-N 3.16Å
600	Q	38.8	Very low	38.3	Very low	165 Å²	165	109.5 Å²	109.5	77%	0.771	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-8.4	174.5	-75.4	-167.8	-2.4	0	0	114.9
601	S	34.3	Very low	38	Very low	111 Å²	111	110 Å²	110	78%	0.776	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	-9.5	-172.1	55.1	0	0	0	0	116.5	S599	S599-S601 PolarHBondContact O-N 3.16Å
602	Q	29	Very low	37.5	Very low	149 Å²	149	105.9 Å²	105.9	70%	0.696	55%	0.548	S	S	*	.	S	Bend	trans	-153.4	93.3	-177.6	-67.9	-173.3	-10	0	0	110.4
603	Y	29.9	Very low	37.1	Very low	198 Å²	198	103.3 Å²	103.3	78%	0.776	53%	0.534	S	S	*	.			trans	170	121.9	141.2	-94.1	-71.3	0	0	0	109.7	T605	Y603-T605 VanDerWaalsContact C-N 3.25Å; Y603-T605 PolarHBondContact O-N 3.17Å
604	Q	29.2	Very low	36.7	Very low	200 Å²	200	104.2 Å²	104.2	94%	0.935	54%	0.539	S	S	*	.			trans	-73.1	72	172.2	-76	178.5	-28.2	0	0	110.4
605	T	27.8	Very low	36.6	Very low	114 Å²	114	103.9 Å²	103.9	70%	0.699	54%	0.542	S	S	*	.			trans	-156	124.1	167.9	36.5	0	0	0	0	110.7	Y603	Y603-T605 VanDerWaalsContact C-N 3.25Å; Y603-T605 PolarHBondContact O-N 3.17Å
606	N	31.3	Very low	36.3	Very low	114 Å²	114	101.9 Å²	101.9	61%	0.61	54%	0.539	S	S	*	.			trans	79	66	176.6	-65.3	-20.3	0	0	0	118.6	K608 L609	N606-K608 PolarHBondContact O-N 3.03Å; N606-L609 PolarHBondContact O-N 3.1Å
607	E	34.2	Very low	36	Very low	189 Å²	189	103.3 Å²	103.3	88%	0.883	54%	0.541	S	S	*	.	H	α-helix	trans	-48.7	-12	160.8	-69.6	-178	151.7	0	0	115
608	K	36.7	Very low	36.2	Very low	167 Å²	167	106 Å²	106	73%	0.726	55%	0.55	S	S	*	.	H	α-helix	trans	-76.6	-42.6	177.5	-76.8	179.5	175.6	177.4	0	113.4	N606 I612	N606-K608 PolarHBondContact O-N 3.03Å; K608-I612 WeakPolarHBondContact O-CB 3.45Å; K608-I612 WeakPolarHBondContact O-CD1 3.47Å; K608-I612 WeakPolarHBondContact O-CG1 3.19Å; K608-I612 PolarHBondContact O-N 3.35Å
609	L	32.9	Very low	36	Very low	90 Å²	90	106.4 Å²	106.4	47%	0.471	55%	0.55	S	S	.	.	H	α-helix	trans	-78	-39	-172.5	-103.1	123.2	0	0	0	112.9	N606 I612 I613	N606-L609 PolarHBondContact O-N 3.1Å; L609-I612 WeakPolarHBondContact O-CB 3.13Å; L609-I612 PolarHBondContact O-N 3.21Å; L609-I613 WeakPolarHBondContact O-CG1 3.18Å; L609-I613 PolarHBondContact O-N 3.35Å; L609-I613 VanDerWaalsContact O-N 3.08Å
610	T	36.3	Very low	36	Very low	81 Å²	81	107.4 Å²	107.4	50%	0.497	56%	0.556	S	S	.	*	H	α-helix	trans	-67.5	-39.3	173.7	52.8	0	0	0	0	111.5	I612 I613 D614	T610-I612 VanDerWaalsContact C-N 3.29Å; T610-I612 PolarHBondContact O-N 3.43Å; T610-I613 PolarHBondContact O-N 2.96Å; T610-D614 VanDerWaalsContact O-CB 3.27Å; T610-D614 WeakPolarHBondContact O-CB 3.45Å; T610-D614 PolarHBondContact O-N 3.42Å
611	G	37.5	Very low	36.2	Very low	39 Å²	39	104.8 Å²	104.8	40%	0.402	54%	0.542	S	S	.	.	H	α-helix	trans	-64.1	-32.3	172.2	0	0	0	0	0	113.3	S615	G611-S615 WeakPolarHBondContact O-CB 3.09Å; G611-S615 PolarHBondContact O-N 2.91Å; G611-S615 PolarHBondContact O-OG 3.4Å
612	I	36	Very low	36.8	Very low	50 Å²	50	103 Å²	103	26%	0.256	53%	0.53	S	S	.	.	H	α-helix	trans	-68.5	-52.2	176.1	-76.2	161.2	0	0	0	110.7	L580 K608 L609 T610 D614 S615 S616	L580-I612 HydrophobicContact CD1-CB 4.19Å; L580-I612 HydrophobicContact CD1-CD1 3.82Å; L580-I612 HydrophobicContact CD1-CG1 3.73Å; L580-I612 HydrophobicContact CD1-CG2 3.37Å; L580-I612 HydrophobicContact CD2-CG2 3.47Å; L580-I612 VanDerWaalsContact CD2-CG2 3.47Å; L580-I612 HydrophobicContact CG-CD1 4.49Å; L580-I612 HydrophobicContact CG-CG2 4.01Å; K608-I612 WeakPolarHBondContact O-CB 3.45Å; K608-I612 WeakPolarHBondContact O-CD1 3.47Å; K608-I612 WeakPolarHBondContact O-CG1 3.19Å; K608-I612 PolarHBondContact O-N 3.35Å; L609-I612 WeakPolarHBondContact O-CB 3.13Å; L609-I612 PolarHBondContact O-N 3.21Å; T610-I612 VanDerWaalsContact C-N 3.29Å; T610-I612 PolarHBondContact O-N 3.43Å; I612-D614 VanDerWaalsContact C-N 3.3Å; I612-D614 PolarHBondContact O-N 3.12Å; I612-S615 CarbonylContact O-C 3.51Å; I612-S615 PolarHBondContact O-N 2.9Å; I612-S615 VanDerWaalsContact O-N 3.13Å; I612-S615 PolarHBondContact O-OG 3.3Å; I612-S616 WeakPolarHBondContact O-CB 3.33Å; I612-S616 PolarHBondContact O-N 2.89Å; I612-S616 PolarHBondContact O-OG 2.92Å
613	I	35.6	Very low	37.3	Very low	59 Å²	59	99.7 Å²	99.7	30%	0.303	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-44.4	179.3	-65.1	165.7	0	0	0	110.2	L609 T610 S615 S616 I617	L609-I613 WeakPolarHBondContact O-CG1 3.18Å; L609-I613 PolarHBondContact O-N 3.35Å; L609-I613 VanDerWaalsContact O-N 3.08Å; T610-I613 PolarHBondContact O-N 2.96Å; I613-S615 VanDerWaalsContact C-N 3.33Å; I613-S615 PolarHBondContact O-N 3.41Å; I613-S616 PolarHBondContact O-N 3.19Å; I613-I617 HydrophobicContact CG2-CD1 3.75Å; I613-I617 HydrophobicContact CG2-CG1 4.48Å; I613-I617 WeakPolarHBondContact O-CB 3.23Å; I613-I617 VanDerWaalsContact O-CG1 3.22Å; I613-I617 WeakPolarHBondContact O-CG1 3.44Å; I613-I617 PolarHBondContact O-N 3.38Å
614	D	40.6	Very low	38	Very low	77 Å²	77	92.6 Å²	92.6	41%	0.412	49%	0.492	S	S	.	.	H	α-helix	trans	-69.8	-30.8	179.3	-153.7	43.8	0	0	0	112.2	T610 I612 K618	T610-D614 VanDerWaalsContact O-CB 3.27Å; T610-D614 WeakPolarHBondContact O-CB 3.45Å; T610-D614 PolarHBondContact O-N 3.42Å; I612-D614 VanDerWaalsContact C-N 3.3Å; I612-D614 PolarHBondContact O-N 3.12Å; D614-K618 VanDerWaalsContact O-CB 3.29Å; D614-K618 WeakPolarHBondContact O-CB 3.47Å; D614-K618 WeakPolarHBondContact O-CD 3.41Å; D614-K618 VanDerWaalsContact O-CG 3.23Å; D614-K618 WeakPolarHBondContact O-CG 3.36Å; D614-K618 PolarHBondContact O-N 3.33Å; D614-K618 IonicContact OD2-NZ 3.49Å; D614-K618 PolarHBondContact OD2-NZ 3.46Å
615	S	41.5	Very low	38.8	Very low	46 Å²	46	87.7 Å²	87.7	32%	0.322	48%	0.475	S	S	.	.	H	α-helix	trans	-72.3	-37	171.1	81.9	0	0	0	0	112.7	G611 I612 I613 K618 Q619	G611-S615 WeakPolarHBondContact O-CB 3.09Å; G611-S615 PolarHBondContact O-N 2.91Å; G611-S615 PolarHBondContact O-OG 3.4Å; I612-S615 CarbonylContact O-C 3.51Å; I612-S615 PolarHBondContact O-N 2.9Å; I612-S615 VanDerWaalsContact O-N 3.13Å; I612-S615 PolarHBondContact O-OG 3.3Å; I613-S615 VanDerWaalsContact C-N 3.33Å; I613-S615 PolarHBondContact O-N 3.41Å; S615-K618 PolarHBondContact O-N 2.89Å; S615-Q619 VanDerWaalsContact O-CB 3.26Å; S615-Q619 WeakPolarHBondContact O-CB 3.35Å; S615-Q619 VanDerWaalsContact O-CG 3.25Å; S615-Q619 WeakPolarHBondContact O-CG 3.44Å; S615-Q619 PolarHBondContact O-N 3.46Å
616	S	38.8	Very low	39.7	Very low	53 Å²	53	85.2 Å²	85.2	37%	0.371	46%	0.462	S	S	.	.	H	α-helix	trans	-68.6	-41.6	176.8	-60.3	0	0	0	0	110.5	I612 I613 Q619 C620	I612-S616 WeakPolarHBondContact O-CB 3.33Å; I612-S616 PolarHBondContact O-N 2.89Å; I612-S616 PolarHBondContact O-OG 2.92Å; I613-S616 PolarHBondContact O-N 3.19Å; S616-Q619 PolarHBondContact O-N 3.03Å; S616-C620 WeakPolarHBondContact O-CB 3.3Å; S616-C620 PolarHBondContact O-N 3.15Å
617	I	40.5	Very low	40.3	Very low	58 Å²	58	83.5 Å²	83.5	30%	0.297	45%	0.453	S	S	.	.	H	α-helix	trans	-64.4	-43	172.7	-67.4	166	0	0	0	110.7	I613 C620 K621	I613-I617 HydrophobicContact CG2-CD1 3.75Å; I613-I617 HydrophobicContact CG2-CG1 4.48Å; I613-I617 WeakPolarHBondContact O-CB 3.23Å; I613-I617 VanDerWaalsContact O-CG1 3.22Å; I613-I617 WeakPolarHBondContact O-CG1 3.44Å; I613-I617 PolarHBondContact O-N 3.38Å; I617-C620 PolarHBondContact O-N 3.19Å; I617-K621 HydrophobicContact CG2-CD 4.13Å; I617-K621 WeakPolarHBondContact O-CB 3.32Å; I617-K621 VanDerWaalsContact O-CG 3.3Å; I617-K621 WeakPolarHBondContact O-CG 3.17Å; I617-K621 PolarHBondContact O-N 3.04Å
618	K	47.3	Very low	40.6	Very low	128 Å²	128	79.4 Å²	79.4	56%	0.557	43%	0.433	S	S	*	.	H	α-helix	trans	-67	-36.1	175.4	-78.8	167.7	179.9	149.2	0	112.9	D614 S615 S622	D614-K618 VanDerWaalsContact O-CB 3.29Å; D614-K618 WeakPolarHBondContact O-CB 3.47Å; D614-K618 WeakPolarHBondContact O-CD 3.41Å; D614-K618 VanDerWaalsContact O-CG 3.23Å; D614-K618 WeakPolarHBondContact O-CG 3.36Å; D614-K618 PolarHBondContact O-N 3.33Å; D614-K618 IonicContact OD2-NZ 3.49Å; D614-K618 PolarHBondContact OD2-NZ 3.46Å; S615-K618 PolarHBondContact O-N 2.89Å; K618-S622 VanDerWaalsContact O-CB 3.26Å; K618-S622 WeakPolarHBondContact O-CB 3.37Å; K618-S622 PolarHBondContact O-N 3.3Å
619	Q	39.1	Very low	41	Very low	101 Å²	101	75.4 Å²	75.4	47%	0.472	43%	0.427	S	S	.	.	H	α-helix	trans	-70.4	-42	175.3	-79.4	177.7	0.6	0	0	111.6	S615 S616 S622 L623	S615-Q619 VanDerWaalsContact O-CB 3.26Å; S615-Q619 WeakPolarHBondContact O-CB 3.35Å; S615-Q619 VanDerWaalsContact O-CG 3.25Å; S615-Q619 WeakPolarHBondContact O-CG 3.44Å; S615-Q619 PolarHBondContact O-N 3.46Å; S616-Q619 PolarHBondContact O-N 3.03Å; Q619-S622 WeakPolarHBondContact O-CB 3.48Å; Q619-S622 PolarHBondContact O-N 3.3Å; Q619-L623 WeakPolarHBondContact O-CB 3.38Å; Q619-L623 PolarHBondContact O-N 3.36Å
620	C	39.3	Very low	41.3	Very low	66 Å²	66	80.2 Å²	80.2	45%	0.446	44%	0.44	S	S	.	.	H	α-helix	trans	-61.5	-45.4	170.6	-90.4	0	0	0	0	111.5	S616 I617 S622 L623 I624	S616-C620 WeakPolarHBondContact O-CB 3.3Å; S616-C620 PolarHBondContact O-N 3.15Å; I617-C620 PolarHBondContact O-N 3.19Å; C620-S622 PolarHBondContact O-N 2.94Å; C620-L623 PolarHBondContact O-N 2.65Å; C620-I624 WeakPolarHBondContact O-CB 3.37Å; C620-I624 WeakPolarHBondContact O-CD1 3.34Å; C620-I624 WeakPolarHBondContact O-CG1 3.5Å; C620-I624 PolarHBondContact O-N 3.48Å
621	K	42.9	Very low	41.1	Very low	111 Å²	111	83.8 Å²	83.8	48%	0.483	46%	0.456	S	S	.	.	H	α-helix	trans	-59.6	-44.6	174.9	-79.3	176.4	172.8	177.7	0	112.1	I617 T625	I617-K621 HydrophobicContact CG2-CD 4.13Å; I617-K621 WeakPolarHBondContact O-CB 3.32Å; I617-K621 VanDerWaalsContact O-CG 3.3Å; I617-K621 WeakPolarHBondContact O-CG 3.17Å; I617-K621 PolarHBondContact O-N 3.04Å; K621-T625 WeakPolarHBondContact O-CB 3.13Å; K621-T625 PolarHBondContact O-N 3.48Å; K621-T625 PolarHBondContact O-OG1 2.9Å
622	S	46.5	Very low	41.2	Very low	74 Å²	74	87.7 Å²	87.7	52%	0.517	47%	0.468	S	S	.	.	H	α-helix	trans	-60.1	-43.6	172.7	171.1	0	0	0	0	113	K618 Q619 C620 T625 S626	K618-S622 VanDerWaalsContact O-CB 3.26Å; K618-S622 WeakPolarHBondContact O-CB 3.37Å; K618-S622 PolarHBondContact O-N 3.3Å; Q619-S622 WeakPolarHBondContact O-CB 3.48Å; Q619-S622 PolarHBondContact O-N 3.3Å; C620-S622 PolarHBondContact O-N 2.94Å; S622-T625 PolarHBondContact O-N 3.05Å; S622-S626 PolarHBondContact O-N 3.49Å; S622-S626 PolarHBondContact O-OG 3.25Å
623	L	40.4	Very low	41.5	Very low	78 Å²	78	88.3 Å²	88.3	41%	0.408	48%	0.476	S	S	.	.	H	α-helix	trans	-65.7	-43	178.5	-117.5	98.4	0	0	0	112.4	F555 Q619 C620 T625 S626 I627	F555-L623 HydrophobicContact CE2-CD2 4.33Å; F555-L623 HydrophobicContact CZ-CD2 3.61Å; Q619-L623 WeakPolarHBondContact O-CB 3.38Å; Q619-L623 PolarHBondContact O-N 3.36Å; C620-L623 PolarHBondContact O-N 2.65Å; L623-T625 VanDerWaalsContact C-N 3.31Å; L623-T625 PolarHBondContact O-N 3.21Å; L623-S626 WeakPolarHBondContact CA-OG 3.45Å; L623-S626 PolarHBondContact O-N 3.43Å; L623-S626 PolarHBondContact O-OG 2.91Å; L623-I627 WeakPolarHBondContact O-CG1 3.18Å; L623-I627 PolarHBondContact O-N 3.41Å
624	I	44	Very low	41.9	Very low	50 Å²	50	90.4 Å²	90.4	26%	0.256	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-41.9	177.1	-69	166	0	0	0	109.2	C620 S626 I627 H628 T690	C620-I624 WeakPolarHBondContact O-CB 3.37Å; C620-I624 WeakPolarHBondContact O-CD1 3.34Å; C620-I624 WeakPolarHBondContact O-CG1 3.5Å; C620-I624 PolarHBondContact O-N 3.48Å; I624-S626 VanDerWaalsContact C-N 3.26Å; I624-S626 PolarHBondContact O-N 3.4Å; I624-I627 PolarHBondContact O-N 2.86Å; I624-I627 VanDerWaalsContact O-N 3.13Å; I624-H628 WeakPolarHBondContact CG2-NE2 3.3Å; I624-H628 PolarHBondContact O-CD2 3.39Å; I624-H628 PolarHBondContact O-N 3.41Å; I624-T690 HydrophobicContact CD1-CG2 4.38Å; I624-T690 HydrophobicContact CG1-CG2 4.43Å; I624-T690 HydrophobicContact CG2-CG2 4.27Å
625	T	46.1	Very low	42.1	Very low	96 Å²	96	90.1 Å²	90.1	59%	0.589	49%	0.494	S	S	*	.	H	α-helix	trans	-63.5	-29.2	176.4	-47.5	0	0	0	0	112.7	K621 S622 L623	K621-T625 WeakPolarHBondContact O-CB 3.13Å; K621-T625 PolarHBondContact O-N 3.48Å; K621-T625 PolarHBondContact O-OG1 2.9Å; S622-T625 PolarHBondContact O-N 3.05Å; L623-T625 VanDerWaalsContact C-N 3.31Å; L623-T625 PolarHBondContact O-N 3.21Å
626	S	45.8	Very low	42.2	Very low	62 Å²	62	90.4 Å²	90.4	43%	0.434	49%	0.491	S	S	.	.	H	α-helix	trans	-84	-21.9	175.7	30.6	0	0	0	0	113.6	S622 L623 I624 S629	S622-S626 PolarHBondContact O-N 3.49Å; S622-S626 PolarHBondContact O-OG 3.25Å; L623-S626 WeakPolarHBondContact CA-OG 3.45Å; L623-S626 PolarHBondContact O-N 3.43Å; L623-S626 PolarHBondContact O-OG 2.91Å; I624-S626 VanDerWaalsContact C-N 3.26Å; I624-S626 PolarHBondContact O-N 3.4Å; S626-S629 PolarHBondContact O-OG 2.85Å
627	I	44.4	Very low	42.6	Very low	79 Å²	79	91.4 Å²	91.4	41%	0.405	50%	0.498	S	S	.	.	H	α-helix	trans	-71.7	-33.5	165.5	-65.3	166.2	0	0	0	110.4	L623 I624 S629 Y630	L623-I627 WeakPolarHBondContact O-CG1 3.18Å; L623-I627 PolarHBondContact O-N 3.41Å; I624-I627 PolarHBondContact O-N 2.86Å; I624-I627 VanDerWaalsContact O-N 3.13Å; I627-S629 VanDerWaalsContact C-N 3.27Å; I627-S629 PolarHBondContact O-N 3.35Å; I627-Y630 PolarHBondContact O-N 3.33Å
628	H	40.4	Very low	43.1	Very low	102 Å²	102	91.9 Å²	91.9	47%	0.472	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.5	178.6	-77	-69.2	0	0	0	115.4	I624	I624-H628 WeakPolarHBondContact CG2-NE2 3.3Å; I624-H628 PolarHBondContact O-CD2 3.39Å; I624-H628 PolarHBondContact O-N 3.41Å
629	S	45	Very low	43.4	Very low	84 Å²	84	86.9 Å²	86.9	59%	0.587	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-8.5	-179.4	68.4	0	0	0	0	114.8	S626 I627	S626-S629 PolarHBondContact O-OG 2.85Å; I627-S629 VanDerWaalsContact C-N 3.27Å; I627-S629 PolarHBondContact O-N 3.35Å
630	Y	40.2	Very low	44.6	Very low	190 Å²	190	84.6 Å²	84.6	75%	0.745	48%	0.478	S	S	*	.			trans	-99.8	93.7	-179.9	-84.2	-86.7	0	0	0	111.8	I627 N632	I627-Y630 PolarHBondContact O-N 3.33Å; Y630-N632 PolarHBondContact O-N 3.23Å
631	N	31.2	Very low	46	Very low	156 Å²	156	83.7 Å²	83.7	83%	0.834	47%	0.47	S	S	*	.			trans	-68.6	66.6	172.3	-85	-23.8	0	0	0	112.7
632	N	38.9	Very low	47.4	Very low	122 Å²	122	79 Å²	79	65%	0.652	45%	0.451	S	S	*	.			trans	-143.2	105.6	163.2	-95.6	-28.6	0	0	0	111.4	Y630	Y630-N632 PolarHBondContact O-N 3.23Å
633	S	43.3	Very low	49	Very low	63 Å²	63	76.6 Å²	76.6	44%	0.441	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	9.5	-147.8	60.2	0	0	0	0	114.6	R698	S633-R698 VanDerWaalsContact CB-CZ 3.49Å; S633-R698 PolarHBondContact O-NH1 3.49Å; S633-R698 PolarHBondContact OG-NH2 3.4Å; S633-R698 VanDerWaalsContact OG-NH2 3.17Å
634	S	44.6	Very low	50.8	Low	102 Å²	102	73.7 Å²	73.7	71%	0.713	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-14.1	173.4	56.1	0	0	0	0	113.8
635	I	44.6	Very low	52.5	Low	72 Å²	72	73.7 Å²	73.7	37%	0.369	42%	0.416	S	S	.	.	S	Bend	trans	-97	-29	-169.2	-60.2	170.9	0	0	0	112.1	S637 S638 T639	I635-S637 VanDerWaalsContact C-N 3.33Å; I635-S637 PolarHBondContact O-N 2.96Å; I635-S638 PolarHBondContact O-N 3.39Å; I635-S638 PolarHBondContact O-OG 2.82Å; I635-T639 HydrophobicContact CG2-CG2 3.95Å; I635-T639 WeakPolarHBondContact O-CG2 3.42Å; I635-T639 PolarHBondContact O-N 3.06Å; I635-T639 PolarHBondContact O-OG1 3.18Å
636	I	43.7	Very low	54.3	Low	51 Å²	51	69.2 Å²	69.2	26%	0.262	39%	0.389	S	S	.	.	H	α-helix	trans	-72.4	-25.2	-170.2	-57.3	168	0	0	0	112.5	T639 I694	I636-T639 PolarHBondContact O-OG1 2.76Å; I636-I694 HydrophobicContact CG2-CD1 4.48Å
637	S	46.8	Very low	56	Low	74 Å²	74	66.6 Å²	66.6	52%	0.517	37%	0.37	S	S	.	.	H	α-helix	trans	-80	-18.9	177	127.1	0	0	0	0	113.4	I635 T641	I635-S637 VanDerWaalsContact C-N 3.33Å; I635-S637 PolarHBondContact O-N 2.96Å; S637-T641 WeakPolarHBondContact O-CG2 3.38Å
638	S	51.4	Low	57.7	Low	69 Å²	69	64.8 Å²	64.8	48%	0.483	36%	0.364	S	S	.	.	H	α-helix	trans	-88.9	-30	176.7	49.3	0	0	0	0	112.7	I635 T641	I635-S638 PolarHBondContact O-N 3.39Å; I635-S638 PolarHBondContact O-OG 2.82Å; S638-T641 PolarHBondContact O-OG1 3.13Å
639	T	54	Low	59.7	Low	23 Å²	23	61 Å²	61	14%	0.141	35%	0.349	C	S	.	.	H	α-helix	trans	-76.9	-31.5	-167.4	49.2	0	0	0	0	114.4	S558 S561 I635 I636	S558-T639 WeakPolarHBondContact CB-O 3.39Å; S561-T639 WeakPolarHBondContact OG-CG2 3.25Å; I635-T639 HydrophobicContact CG2-CG2 3.95Å; I635-T639 WeakPolarHBondContact O-CG2 3.42Å; I635-T639 PolarHBondContact O-N 3.06Å; I635-T639 PolarHBondContact O-OG1 3.18Å; I636-T639 PolarHBondContact O-OG1 2.76Å
640	L	62.7	Low	61.5	Low	52 Å²	52	58.3 Å²	58.3	27%	0.272	33%	0.327	S	S	.	.	S	Bend	trans	-88.4	-11.6	179.6	-97.2	81.6	0	0	0	114.6	P642 L643 K644 L687	L640-P642 VanDerWaalsContact C-CD 3.5Å; L640-L643 PolarHBondContact O-N 2.93Å; L640-K644 PolarHBondContact O-N 3.28Å; L640-L687 HydrophobicContact CD2-CD1 3.34Å; L640-L687 HydrophobicContact CD2-CD2 4.49Å; L640-L687 HydrophobicContact CD2-CG 3.91Å; L640-L687 HydrophobicContact CG-CD1 4.37Å
641	T	68.8	Low	63.4	Low	48 Å²	48	49.4 Å²	49.4	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-60.3	-38.8	-173.2	60.4	0	0	0	0	114.4	S637 S638 K644 I645	S637-T641 WeakPolarHBondContact O-CG2 3.38Å; S638-T641 PolarHBondContact O-OG1 3.13Å; T641-K644 PolarHBondContact O-N 3.02Å; T641-I645 WeakPolarHBondContact O-CD1 3.16Å; T641-I645 VanDerWaalsContact O-CG1 3.23Å; T641-I645 WeakPolarHBondContact O-CG1 3.42Å; T641-I645 PolarHBondContact O-N 3.05Å
642	P	73.6	Confident	65.9	Low	11 Å²	11	45.9 Å²	45.9	7%	0.071	27%	0.273	C	S	.	.	H	α-helix	trans	-69.6	-39.7	-178.4	-22.4	37.5	0	0	0	113.2	Y533 F554 L640 K644 I645 F646	Y533-P642 HydrophobicContact CG-CG 4.4Å; F554-P642 HydrophobicContact CD1-CB 3.46Å; F554-P642 VanDerWaalsContact CD1-CB 3.46Å; F554-P642 HydrophobicContact CE1-CB 3.84Å; F554-P642 HydrophobicContact CG-CB 4.34Å; L640-P642 VanDerWaalsContact C-CD 3.5Å; P642-K644 VanDerWaalsContact C-N 3.35Å; P642-I645 PolarHBondContact O-N 3.49Å; P642-F646 WeakPolarHBondContact O-CB 3.04Å; P642-F646 PolarHBondContact O-N 2.86Å
643	L	79.5	Confident	67.9	Low	25 Å²	25	42.8 Å²	42.8	13%	0.131	25%	0.253	C	S	.	.	H	α-helix	trans	-64.8	-42.9	178.1	-178.7	63.5	0	0	0	110.6	F554 L640 F646 L647	F554-L643 HydrophobicContact CB-CB 4.25Å; F554-L643 HydrophobicContact CB-CD1 4.2Å; L640-L643 PolarHBondContact O-N 2.93Å; L643-F646 HydrophobicContact CD1-CD1 4.48Å; L643-F646 WeakPolarHBondContact O-CB 3.33Å; L643-F646 PolarHBondContact O-N 3.21Å; L643-L647 HydrophobicContact CD1-CG 4.44Å; L643-L647 HydrophobicContact CG-CD1 4.22Å; L643-L647 WeakPolarHBondContact O-CG 3.32Å; L643-L647 PolarHBondContact O-N 2.86Å
644	K	77.6	Confident	69.5	Low	16 Å²	16	40.1 Å²	40.1	7%	0.07	23%	0.234	C	C	.	.	H	α-helix	trans	-59.5	-47.7	175.4	-177.1	177.3	179.4	176.4	0	112.2	L640 T641 P642 F646 L647 S648 L684 L687 L688 E691 E748	L640-K644 PolarHBondContact O-N 3.28Å; T641-K644 PolarHBondContact O-N 3.02Å; P642-K644 VanDerWaalsContact C-N 3.35Å; K644-F646 VanDerWaalsContact C-N 3.28Å; K644-F646 PolarHBondContact O-N 3.03Å; K644-L647 PolarHBondContact O-N 3.03Å; K644-S648 WeakPolarHBondContact O-CB 3.35Å; K644-S648 PolarHBondContact O-N 2.76Å; K644-S648 PolarHBondContact O-OG 2.88Å; K644-L684 HydrophobicContact CG-CD1 4.22Å; K644-L687 HydrophobicContact CB-CD2 3.95Å; K644-L687 HydrophobicContact CG-CD2 4.41Å; K644-L688 HydrophobicContact CD-CD2 4.48Å; K644-L688 VanDerWaalsContact CE-CD2 3.44Å; K644-L688 VanDerWaalsContact NZ-CD2 3.3Å; K644-E691 IonicContact NZ-OE2 2.62Å; K644-E691 PolarHBondContact NZ-OE2 3.21Å; K644-E748 WeakPolarHBondContact CE-OE2 3.1Å; K644-E748 IonicContact NZ-OE2 2.84Å; K644-E748 PolarHBondContact NZ-OE2 3.18Å
645	I	80.3	Confident	71.2	Confident	51 Å²	51	36.1 Å²	36.1	26%	0.262	20%	0.204	S	C	.	.	H	α-helix	trans	-61.8	-38.6	176.8	-66.8	165.1	0	0	0	110.8	A537 K538 T641 P642 S648 S649	A537-I645 HydrophobicContact CB-CB 4.14Å; A537-I645 HydrophobicContact CB-CG2 3.82Å; K538-I645 HydrophobicContact CG-CG2 3.93Å; T641-I645 WeakPolarHBondContact O-CD1 3.16Å; T641-I645 VanDerWaalsContact O-CG1 3.23Å; T641-I645 WeakPolarHBondContact O-CG1 3.42Å; T641-I645 PolarHBondContact O-N 3.05Å; P642-I645 PolarHBondContact O-N 3.49Å; I645-S648 PolarHBondContact O-OG 3.35Å; I645-S648 VanDerWaalsContact O-OG 3.06Å; I645-S649 WeakPolarHBondContact O-CB 3.47Å; I645-S649 PolarHBondContact O-N 3Å; I645-S649 PolarHBondContact O-OG 3.44Å
646	F	84	Confident	72.8	Confident	1 Å²	1	37.1 Å²	37.1	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-64.7	-51	177.7	172.8	-111.9	0	0	0	111.4	A537 F540 A541 F547 I550 A551 F554 P642 L643 K644 S648 S649 K650	A537-F646 HydrophobicContact CB-CB 3.87Å; F540-F646 HydrophobicContact CB-CD2 4.2Å; F540-F646 HydrophobicContact CB-CE2 3.99Å; A541-F646 HydrophobicContact CB-CD2 4.31Å; A541-F646 HydrophobicContact CB-CE2 4.44Å; F547-F646 AromaticContact CD2-CE1 3.56Å; F547-F646 HydrophobicContact CD2-CE1 3.56Å; F547-F646 AromaticContact CD2-CZ 3.66Å; F547-F646 HydrophobicContact CD2-CZ 3.66Å; F547-F646 HydrophobicContact CE2-CD1 4.29Å; F547-F646 AromaticContact CE2-CE1 3.4Å; F547-F646 HydrophobicContact CE2-CE1 3.4Å; F547-F646 VanDerWaalsContact CE2-CE1 3.4Å; F547-F646 AromaticContact CE2-CZ 3.99Å; F547-F646 HydrophobicContact CE2-CZ 3.99Å; F547-F646 HydrophobicContact CZ-CE1 4.44Å; I550-F646 HydrophobicContact CB-CE1 4.3Å; I550-F646 HydrophobicContact CB-CE2 4.11Å; I550-F646 HydrophobicContact CB-CZ 3.74Å; I550-F646 HydrophobicContact CD1-CE2 4.25Å; I550-F646 HydrophobicContact CD1-CZ 4.29Å; I550-F646 HydrophobicContact CG2-CD1 4.36Å; I550-F646 HydrophobicContact CG2-CD2 3.87Å; I550-F646 HydrophobicContact CG2-CE1 3.95Å; I550-F646 HydrophobicContact CG2-CE2 3.43Å; I550-F646 VanDerWaalsContact CG2-CE2 3.43Å; I550-F646 HydrophobicContact CG2-CG 4.31Å; I550-F646 HydrophobicContact CG2-CZ 3.47Å; I550-F646 VanDerWaalsContact CG2-CZ 3.47Å; A551-F646 HydrophobicContact CB-CE1 4.31Å; F554-F646 HydrophobicContact CD2-CB 4.1Å; F554-F646 HydrophobicContact CD2-CD1 4.45Å; F554-F646 HydrophobicContact CD2-CG 4.12Å; F554-F646 HydrophobicContact CE2-CB 4.14Å; F554-F646 HydrophobicContact CE2-CD2 4.17Å; F554-F646 HydrophobicContact CE2-CG 4.16Å; P642-F646 WeakPolarHBondContact O-CB 3.04Å; P642-F646 PolarHBondContact O-N 2.86Å; L643-F646 HydrophobicContact CD1-CD1 4.48Å; L643-F646 WeakPolarHBondContact O-CB 3.33Å; L643-F646 PolarHBondContact O-N 3.21Å; K644-F646 VanDerWaalsContact C-N 3.28Å; K644-F646 PolarHBondContact O-N 3.03Å; F646-S648 PolarHBondContact O-N 3.46Å; F646-S649 PolarHBondContact O-N 3.35Å; F646-K650 WeakPolarHBondContact O-CB 3.34Å; F646-K650 PolarHBondContact O-N 3.25Å
647	L	81.6	Confident	74.3	Confident	8 Å²	8	37.5 Å²	37.5	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-46.4	178.6	-69.1	174.2	0	0	0	111.7	F547 L643 K644 S649 K650 L651 L680 W683 L684 L687	F547-L647 HydrophobicContact CE2-CD2 3.84Å; F547-L647 HydrophobicContact CZ-CD2 3.73Å; L643-L647 HydrophobicContact CD1-CG 4.44Å; L643-L647 HydrophobicContact CG-CD1 4.22Å; L643-L647 WeakPolarHBondContact O-CG 3.32Å; L643-L647 PolarHBondContact O-N 2.86Å; K644-L647 PolarHBondContact O-N 3.03Å; L647-S649 PolarHBondContact O-N 3.36Å; L647-K650 PolarHBondContact O-N 3.44Å; L647-L651 WeakPolarHBondContact O-CB 3.33Å; L647-L651 PolarHBondContact O-N 3.39Å; L647-L680 HydrophobicContact CD2-CD2 3.74Å; L647-W683 HydrophobicContact CD2-CE3 4.48Å; L647-L684 HydrophobicContact CB-CD1 4.07Å; L647-L684 HydrophobicContact CD1-CD1 4.48Å; L647-L687 HydrophobicContact CD1-CD2 4.35Å
648	S	80.3	Confident	75.4	Confident	40 Å²	40	35.2 Å²	35.2	28%	0.28	19%	0.188	S	C	.	.	H	α-helix	trans	-64.5	-40.1	178.4	68.5	0	0	0	0	112.3	K644 I645 F646 N652	K644-S648 WeakPolarHBondContact O-CB 3.35Å; K644-S648 PolarHBondContact O-N 2.76Å; K644-S648 PolarHBondContact O-OG 2.88Å; I645-S648 PolarHBondContact O-OG 3.35Å; I645-S648 VanDerWaalsContact O-OG 3.06Å; F646-S648 PolarHBondContact O-N 3.46Å; S648-N652 PolarHBondContact O-N 3.4Å; S648-N652 VanDerWaalsContact O-N 3.1Å; S648-N652 PolarHBondContact O-ND2 3.36Å
649	S	81.4	Confident	76.5	Confident	23 Å²	23	36 Å²	36	16%	0.161	19%	0.187	C	C	.	.	H	α-helix	trans	-69.7	-35.5	178.7	-57.1	0	0	0	0	111.6	I645 F646 L647 Y653	I645-S649 WeakPolarHBondContact O-CB 3.47Å; I645-S649 PolarHBondContact O-N 3Å; I645-S649 PolarHBondContact O-OG 3.44Å; F646-S649 PolarHBondContact O-N 3.35Å; L647-S649 PolarHBondContact O-N 3.36Å; S649-Y653 WeakPolarHBondContact O-CB 3.32Å; S649-Y653 PolarHBondContact O-N 3.45Å
650	K	82.5	Confident	77.2	Confident	27 Å²	27	41.4 Å²	41.4	12%	0.117	21%	0.211	C	C	.	.	H	α-helix	trans	-69.1	-42	176.6	-169.8	68	176.5	-173.6	0	111.2	A541 F547 F646 L647 Y653 L654 L680	A541-K650 HydrophobicContact CB-CB 4.11Å; A541-K650 HydrophobicContact CB-CD 4.38Å; A541-K650 WeakPolarHBondContact O-CD 3.32Å; A541-K650 PolarHBondContact O-NZ 3.36Å; F547-K650 HydrophobicContact CD2-CG 4.45Å; F646-K650 WeakPolarHBondContact O-CB 3.34Å; F646-K650 PolarHBondContact O-N 3.25Å; L647-K650 PolarHBondContact O-N 3.44Å; K650-Y653 PolarHBondContact O-N 2.99Å; K650-L654 WeakPolarHBondContact O-CG 3.34Å; K650-L654 PolarHBondContact O-N 3.46Å; K650-L680 HydrophobicContact CB-CD1 4.39Å; K650-L680 HydrophobicContact CG-CD1 3.85Å
651	L	81.5	Confident	77.3	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-57.4	-50.9	174.5	-176.4	65.5	0	0	0	111.1	L647 Y653 L654 I655 I677 L680 L684 L755	L647-L651 WeakPolarHBondContact O-CB 3.33Å; L647-L651 PolarHBondContact O-N 3.39Å; L651-Y653 VanDerWaalsContact C-N 3.33Å; L651-Y653 PolarHBondContact O-N 2.96Å; L651-L654 PolarHBondContact O-N 3.27Å; L651-I655 HydrophobicContact CD1-CD1 4.46Å; L651-I655 HydrophobicContact CG-CD1 4.1Å; L651-I655 WeakPolarHBondContact O-CG1 3.33Å; L651-I655 PolarHBondContact O-N 2.93Å; L651-I677 HydrophobicContact CD1-CB 4.37Å; L651-I677 HydrophobicContact CD1-CG2 3.83Å; L651-L680 HydrophobicContact CD1-CB 4.39Å; L651-L684 HydrophobicContact CD2-CD2 4.31Å; L651-L755 HydrophobicContact CD2-CD1 3.86Å
652	N	82.2	Confident	76.9	Confident	82 Å²	82	44.1 Å²	44.1	44%	0.439	22%	0.223	S	C	.	.	H	α-helix	trans	-60.4	-40.5	177.8	-71.1	-19.7	0	0	0	112.5	S648 I655 E656	S648-N652 PolarHBondContact O-N 3.4Å; S648-N652 VanDerWaalsContact O-N 3.1Å; S648-N652 PolarHBondContact O-ND2 3.36Å; N652-I655 PolarHBondContact O-N 3.09Å; N652-E656 WeakPolarHBondContact O-CG 3.42Å; N652-E656 PolarHBondContact O-N 3.4Å
653	Y	81.7	Confident	76.1	Confident	58 Å²	58	50 Å²	50	23%	0.227	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-41.3	177.5	177.8	-106.4	0	0	0	112.9	R542 S649 K650 L651 I655 E656 Q657	R542-Y653 HydrophobicContact CB-CD2 4.31Å; R542-Y653 HydrophobicContact CB-CE2 4.23Å; R542-Y653 HydrophobicContact CG-CD2 3.77Å; R542-Y653 HydrophobicContact CG-CE2 4.12Å; R542-Y653 HydrophobicContact CG-CG 4.3Å; S649-Y653 WeakPolarHBondContact O-CB 3.32Å; S649-Y653 PolarHBondContact O-N 3.45Å; K650-Y653 PolarHBondContact O-N 2.99Å; L651-Y653 VanDerWaalsContact C-N 3.33Å; L651-Y653 PolarHBondContact O-N 2.96Å; Y653-I655 VanDerWaalsContact C-N 3.34Å; Y653-E656 PolarHBondContact O-N 3.24Å; Y653-Q657 HydrophobicContact CE1-CG 4.17Å; Y653-Q657 HydrophobicContact CE2-CG 4.47Å; Y653-Q657 PolarHBondContact O-N 2.9Å; Y653-Q657 PolarHBondContact OH-NE2 2.97Å
654	L	77.6	Confident	75	Confident	7 Å²	7	55.7 Å²	55.7	4%	0.037	28%	0.28	C	S	.	.	H	α-helix	trans	-67.6	-35.9	176.3	-69.5	175	0	0	0	112	K650 L651 Q657 K658 I673 Q676 I677 L680	K650-L654 WeakPolarHBondContact O-CG 3.34Å; K650-L654 PolarHBondContact O-N 3.46Å; L651-L654 PolarHBondContact O-N 3.27Å; L654-Q657 PolarHBondContact O-N 3.39Å; L654-K658 WeakPolarHBondContact O-CB 3.27Å; L654-K658 PolarHBondContact O-N 3.46Å; L654-I673 HydrophobicContact CB-CG2 4.41Å; L654-Q676 HydrophobicContact CD1-CB 3.94Å; L654-I677 HydrophobicContact CB-CD1 4.18Å; L654-I677 HydrophobicContact CB-CG1 3.76Å; L654-I677 HydrophobicContact CD1-CG1 4.3Å; L654-L680 HydrophobicContact CD1-CD1 3.5Å
655	I	78.6	Confident	73.2	Confident	18 Å²	18	61.9 Å²	61.9	9%	0.092	32%	0.319	C	S	.	.	H	α-helix	trans	-63	-45.6	172.7	-67.7	166.6	0	0	0	110.5	L651 N652 Y653 Q657 K658 N659 I677 L755 E757	L651-I655 HydrophobicContact CD1-CD1 4.46Å; L651-I655 HydrophobicContact CG-CD1 4.1Å; L651-I655 WeakPolarHBondContact O-CG1 3.33Å; L651-I655 PolarHBondContact O-N 2.93Å; N652-I655 PolarHBondContact O-N 3.09Å; Y653-I655 VanDerWaalsContact C-N 3.34Å; I655-Q657 PolarHBondContact O-N 3.43Å; I655-K658 PolarHBondContact O-N 2.97Å; I655-N659 PolarHBondContact O-N 3Å; I655-N659 PolarHBondContact O-ND2 2.82Å; I655-I677 HydrophobicContact CG1-CD1 4.23Å; I655-L755 HydrophobicContact CD1-CD1 4.17Å; I655-E757 HydrophobicContact CG1-CG 4.17Å; I655-E757 HydrophobicContact CG2-CG 4.49Å; I655-E757 WeakPolarHBondContact CG2-OE1 3.43Å
656	E	79.1	Confident	71.9	Confident	93 Å²	93	64.6 Å²	64.6	44%	0.435	33%	0.334	S	S	.	.	H	α-helix	trans	-59	-45.1	175	-75.1	174.4	-174.6	0	0	112	N652 Y653 N659 Q660	N652-E656 WeakPolarHBondContact O-CG 3.42Å; N652-E656 PolarHBondContact O-N 3.4Å; Y653-E656 PolarHBondContact O-N 3.24Å; E656-N659 PolarHBondContact O-N 2.64Å; E656-Q660 WeakPolarHBondContact O-CG 3.45Å; E656-Q660 PolarHBondContact O-N 3.17Å; E656-Q660 VanDerWaalsContact O-N 3.16Å
657	Q	74.8	Confident	70.5	Confident	58 Å²	58	73.5 Å²	73.5	27%	0.271	37%	0.373	S	S	.	.	H	α-helix	trans	-63.8	-42.8	176.5	-76.1	-163.6	-4.5	0	0	112.6	Y653 L654 I655 N659 Q660 L661	Y653-Q657 HydrophobicContact CE1-CG 4.17Å; Y653-Q657 HydrophobicContact CE2-CG 4.47Å; Y653-Q657 PolarHBondContact O-N 2.9Å; Y653-Q657 PolarHBondContact OH-NE2 2.97Å; L654-Q657 PolarHBondContact O-N 3.39Å; I655-Q657 PolarHBondContact O-N 3.43Å; Q657-N659 VanDerWaalsContact C-N 3.31Å; Q657-N659 PolarHBondContact O-N 3.24Å; Q657-Q660 PolarHBondContact O-N 2.6Å; Q657-L661 PolarHBondContact O-N 2.93Å
658	K	71.4	Confident	69.2	Low	26 Å²	26	77.5 Å²	77.5	11%	0.113	40%	0.402	C	S	.	.	H	α-helix	trans	-59	-44.8	177.2	-176.9	172.3	174.7	168.1	0	110.9	L654 I655 Q660 L661 L662 I673 S674 I677	L654-K658 WeakPolarHBondContact O-CB 3.27Å; L654-K658 PolarHBondContact O-N 3.46Å; I655-K658 PolarHBondContact O-N 2.97Å; K658-Q660 VanDerWaalsContact C-N 3.3Å; K658-Q660 PolarHBondContact O-N 3Å; K658-L661 PolarHBondContact O-N 3.45Å; K658-L662 HydrophobicContact CG-CD1 4.11Å; K658-L662 WeakPolarHBondContact O-CD1 3.29Å; K658-L662 PolarHBondContact O-N 3.05Å; K658-I673 HydrophobicContact CB-CG2 4.06Å; K658-S674 PolarHBondContact NZ-OG 2.98Å; K658-I677 HydrophobicContact CD-CD1 4.03Å
659	N	73	Confident	68.2	Low	85 Å²	85	77.4 Å²	77.4	46%	0.455	40%	0.401	S	S	.	.	H	α-helix	trans	-63.9	-32.7	178.1	-72.2	-25.8	0	0	0	112.9	I655 E656 Q657	I655-N659 PolarHBondContact O-N 3Å; I655-N659 PolarHBondContact O-ND2 2.82Å; E656-N659 PolarHBondContact O-N 2.64Å; Q657-N659 VanDerWaalsContact C-N 3.31Å; Q657-N659 PolarHBondContact O-N 3.24Å
660	Q	68.9	Low	67.1	Low	137 Å²	137	78.6 Å²	78.6	64%	0.64	41%	0.405	S	S	*	.	H	α-helix	trans	-72.7	-39.1	173.4	-69.1	176.3	7.5	0	0	112.4	E656 Q657 K658 N663	E656-Q660 WeakPolarHBondContact O-CG 3.45Å; E656-Q660 PolarHBondContact O-N 3.17Å; E656-Q660 VanDerWaalsContact O-N 3.16Å; Q657-Q660 PolarHBondContact O-N 2.6Å; K658-Q660 VanDerWaalsContact C-N 3.3Å; K658-Q660 PolarHBondContact O-N 3Å; Q660-N663 PolarHBondContact O-N 3.24Å
661	L	64.5	Low	66	Low	50 Å²	50	80.8 Å²	80.8	26%	0.262	42%	0.42	S	S	.	.	H	α-helix	trans	-71.9	-26.4	179.1	-78.3	157.7	0	0	0	113.2	Q657 K658 N663 H664 L670 I673	Q657-L661 PolarHBondContact O-N 2.93Å; K658-L661 PolarHBondContact O-N 3.45Å; L661-N663 PolarHBondContact O-N 3.49Å; L661-N663 VanDerWaalsContact O-N 3.08Å; L661-H664 CarbonylContact O-C 3.53Å; L661-H664 PolarHBondContact O-N 2.78Å; L661-L670 HydrophobicContact CB-CD1 3.82Å; L661-I673 HydrophobicContact CD1-CD1 3.23Å
662	L	61	Low	65.1	Low	108 Å²	108	82.5 Å²	82.5	57%	0.565	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-20.4	172.6	-99.4	134.3	0	0	0	113.4	K658	K658-L662 HydrophobicContact CG-CD1 4.11Å; K658-L662 WeakPolarHBondContact O-CD1 3.29Å; K658-L662 PolarHBondContact O-N 3.05Å
663	N	57.1	Low	64.5	Low	134 Å²	134	79.3 Å²	79.3	72%	0.717	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-10.7	175.5	-66	-28.1	0	0	0	114.2	Q660 L661	Q660-N663 PolarHBondContact O-N 3.24Å; L661-N663 PolarHBondContact O-N 3.49Å; L661-N663 VanDerWaalsContact O-N 3.08Å
664	H	55.1	Low	63.7	Low	144 Å²	144	77.1 Å²	77.1	67%	0.667	41%	0.406	S	S	*	.	S	Bend	trans	-127.7	122.2	-178.8	-72	-63.5	0	0	0	110.7	L661 N666	L661-H664 CarbonylContact O-C 3.53Å; L661-H664 PolarHBondContact O-N 2.78Å; H664-N666 VanDerWaalsContact C-N 3.31Å; H664-N666 PolarHBondContact O-N 3.23Å
665	T	41.8	Very low	63.1	Low	146 Å²	146	77.7 Å²	77.7	90%	0.896	41%	0.414	S	S	*	.			trans	-68.7	67.7	-167.5	53.3	0	0	0	0	114.8
666	N	51.4	Low	62.7	Low	108 Å²	108	80.5 Å²	80.5	58%	0.578	43%	0.426	S	S	*	.			trans	-122.5	98.5	168.2	-90.3	-12	0	0	0	110.4	H664 S669	H664-N666 VanDerWaalsContact C-N 3.31Å; H664-N666 PolarHBondContact O-N 3.23Å; N666-S669 PolarHBondContact O-OG 3Å
667	K	55.8	Low	62.4	Low	188 Å²	188	76.1 Å²	76.1	82%	0.817	41%	0.406	S	S	*	.	H	α-helix	trans	-66.7	-35.6	-177.8	-76.7	-178.4	175.2	-179.2	0	113.3	L670 V671	K667-L670 WeakPolarHBondContact O-CB 3.15Å; K667-L670 PolarHBondContact O-N 3.48Å; K667-V671 WeakPolarHBondContact O-CG2 3.18Å
668	S	54.3	Low	62.1	Low	93 Å²	93	74.5 Å²	74.5	65%	0.65	40%	0.399	S	S	*	.	H	α-helix	trans	-67.5	-43.9	-174.1	53.7	0	0	0	0	113.6	L670 V671	S668-L670 PolarHBondContact O-N 2.98Å; S668-V671 PolarHBondContact O-N 3.43Å
669	S	58.2	Low	62	Low	38 Å²	38	76 Å²	76	27%	0.266	41%	0.408	S	S	.	.	H	α-helix	trans	-66	-24.6	177.5	49.9	0	0	0	0	113.2	N666 I673	N666-S669 PolarHBondContact O-OG 3Å; S669-I673 WeakPolarHBondContact O-CD1 3.18Å; S669-I673 WeakPolarHBondContact O-CG1 3.44Å; S669-I673 PolarHBondContact O-N 3.41Å
670	L	58.7	Low	62.1	Low	47 Å²	47	72.4 Å²	72.4	25%	0.246	39%	0.389	C	S	.	.	H	α-helix	trans	-73.9	-30	-177.1	-146.9	88.1	0	0	0	112.6	L661 K667 S668 S674	L661-L670 HydrophobicContact CB-CD1 3.82Å; K667-L670 WeakPolarHBondContact O-CB 3.15Å; K667-L670 PolarHBondContact O-N 3.48Å; S668-L670 PolarHBondContact O-N 2.98Å; L670-S674 PolarHBondContact O-N 3.4Å; L670-S674 PolarHBondContact O-OG 3.4Å
671	V	58.6	Low	62.4	Low	73 Å²	73	66 Å²	66	44%	0.442	36%	0.359	S	S	.	.	H	α-helix	trans	-76.6	-47.9	-177.5	-161.3	0	0	0	0	109.7	D590 K667 S668 I673 S674 G675	D590-V671 HydrophobicContact CB-CG1 3.65Å; D590-V671 VanDerWaalsContact CG-C 3.44Å; D590-V671 VanDerWaalsContact OD1-C 3.3Å; D590-V671 WeakPolarHBondContact OD2-CA 3.48Å; D590-V671 WeakPolarHBondContact OD2-CB 3.46Å; D590-V671 WeakPolarHBondContact OD2-CG1 3.34Å; K667-V671 WeakPolarHBondContact O-CG2 3.18Å; S668-V671 PolarHBondContact O-N 3.43Å; V671-I673 VanDerWaalsContact C-N 3.31Å; V671-I673 PolarHBondContact O-N 3.29Å; V671-S674 WeakPolarHBondContact O-CA 3.39Å; V671-S674 VanDerWaalsContact O-CB 3.29Å; V671-S674 WeakPolarHBondContact O-CB 3.43Å; V671-S674 PolarHBondContact O-N 3.09Å; V671-G675 PolarHBondContact O-N 3.44Å; V671-G675 VanDerWaalsContact O-N 3.07Å
672	N	63.6	Low	62.8	Low	40 Å²	40	64.8 Å²	64.8	21%	0.214	35%	0.352	C	S	.	.	H	α-helix	trans	-53.9	-42.8	174.6	-73.9	1.9	0	0	0	113.4	D590 S674 G675 Q676	D590-N672 WeakPolarHBondContact OD1-CA 3.44Å; D590-N672 PolarHBondContact OD1-N 3.24Å; D590-N672 PolarHBondContact OD2-N 3.17Å; D590-N672 PolarHBondContact OD2-OD1 3.5Å; N672-S674 VanDerWaalsContact C-N 3.26Å; N672-S674 PolarHBondContact O-N 3.25Å; N672-G675 PolarHBondContact O-N 3.43Å; N672-Q676 WeakPolarHBondContact O-CG 3.42Å; N672-Q676 PolarHBondContact O-N 3Å
673	I	68.5	Low	63.4	Low	15 Å²	15	65 Å²	65	8%	0.077	35%	0.346	C	S	.	.	H	α-helix	trans	-64.8	-35.8	178.1	-67.3	167.9	0	0	0	110.7	L654 K658 L661 S669 V671 Q676 I677	L654-I673 HydrophobicContact CB-CG2 4.41Å; K658-I673 HydrophobicContact CB-CG2 4.06Å; L661-I673 HydrophobicContact CD1-CD1 3.23Å; S669-I673 WeakPolarHBondContact O-CD1 3.18Å; S669-I673 WeakPolarHBondContact O-CG1 3.44Å; S669-I673 PolarHBondContact O-N 3.41Å; V671-I673 VanDerWaalsContact C-N 3.31Å; V671-I673 PolarHBondContact O-N 3.29Å; I673-Q676 PolarHBondContact O-N 3.27Å; I673-I677 HydrophobicContact CG2-CD1 3.88Å; I673-I677 HydrophobicContact CG2-CG1 4.46Å; I673-I677 VanDerWaalsContact O-CG1 3.27Å; I673-I677 WeakPolarHBondContact O-CG1 3.44Å; I673-I677 PolarHBondContact O-N 3.49Å; I673-I677 VanDerWaalsContact O-N 3.08Å
674	S	66.1	Low	64.4	Low	11 Å²	11	58.6 Å²	58.6	8%	0.077	31%	0.312	C	S	.	.	H	α-helix	trans	-68.7	-42.3	179.5	-60.4	0	0	0	0	111.8	K658 L670 V671 N672 Q676 I677 I678 F761	K658-S674 PolarHBondContact NZ-OG 2.98Å; L670-S674 PolarHBondContact O-N 3.4Å; L670-S674 PolarHBondContact O-OG 3.4Å; V671-S674 WeakPolarHBondContact O-CA 3.39Å; V671-S674 VanDerWaalsContact O-CB 3.29Å; V671-S674 WeakPolarHBondContact O-CB 3.43Å; V671-S674 PolarHBondContact O-N 3.09Å; N672-S674 VanDerWaalsContact C-N 3.26Å; N672-S674 PolarHBondContact O-N 3.25Å; S674-Q676 VanDerWaalsContact C-N 3.33Å; S674-Q676 PolarHBondContact O-N 2.86Å; S674-I677 PolarHBondContact O-N 2.83Å; S674-I678 VanDerWaalsContact O-CG1 3.32Å; S674-I678 WeakPolarHBondContact O-CG1 3.02Å; S674-I678 PolarHBondContact O-N 3.37Å; S674-F761 VanDerWaalsContact CB-CZ 3.49Å
675	G	65.6	Low	65.4	Low	20 Å²	20	51.9 Å²	51.9	21%	0.206	28%	0.281	C	S	.	.	H	α-helix	trans	-58.7	-41.3	173.4	0	0	0	0	0	113.1	V671 N672 I678 L679	V671-G675 PolarHBondContact O-N 3.44Å; V671-G675 VanDerWaalsContact O-N 3.07Å; N672-G675 PolarHBondContact O-N 3.43Å; G675-I678 PolarHBondContact O-N 2.78Å; G675-L679 PolarHBondContact O-N 2.96Å
676	Q	70.2	Confident	66.9	Low	76 Å²	76	47.5 Å²	47.5	36%	0.355	25%	0.25	S	S	.	.	H	α-helix	trans	-65.1	-40.3	176.5	-68.8	177.6	18.1	0	0	113	L654 N672 I673 S674 I678 L679 L680	L654-Q676 HydrophobicContact CD1-CB 3.94Å; N672-Q676 WeakPolarHBondContact O-CG 3.42Å; N672-Q676 PolarHBondContact O-N 3Å; I673-Q676 PolarHBondContact O-N 3.27Å; S674-Q676 VanDerWaalsContact C-N 3.33Å; S674-Q676 PolarHBondContact O-N 2.86Å; Q676-I678 VanDerWaalsContact C-N 3.31Å; Q676-I678 PolarHBondContact O-N 3.4Å; Q676-L679 PolarHBondContact O-N 2.87Å; Q676-L680 WeakPolarHBondContact O-CB 3.39Å; Q676-L680 WeakPolarHBondContact O-CG 3.45Å; Q676-L680 PolarHBondContact O-N 2.74Å; Q676-L680 VanDerWaalsContact O-N 3.1Å
677	I	71.7	Confident	68.1	Low	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-59.6	-43.2	176.7	-73.5	167.9	0	0	0	110.6	L651 L654 I655 K658 I673 S674 A681 E757	L651-I677 HydrophobicContact CD1-CB 4.37Å; L651-I677 HydrophobicContact CD1-CG2 3.83Å; L654-I677 HydrophobicContact CB-CD1 4.18Å; L654-I677 HydrophobicContact CB-CG1 3.76Å; L654-I677 HydrophobicContact CD1-CG1 4.3Å; I655-I677 HydrophobicContact CG1-CD1 4.23Å; K658-I677 HydrophobicContact CD-CD1 4.03Å; I673-I677 HydrophobicContact CG2-CD1 3.88Å; I673-I677 HydrophobicContact CG2-CG1 4.46Å; I673-I677 VanDerWaalsContact O-CG1 3.27Å; I673-I677 WeakPolarHBondContact O-CG1 3.44Å; I673-I677 PolarHBondContact O-N 3.49Å; I673-I677 VanDerWaalsContact O-N 3.08Å; S674-I677 PolarHBondContact O-N 2.83Å; I677-A681 VanDerWaalsContact O-CB 3.3Å; I677-A681 WeakPolarHBondContact O-CB 3.26Å; I677-A681 PolarHBondContact O-N 3.29Å; I677-E757 HydrophobicContact CG2-CB 4.21Å
678	I	68.6	Low	69	Low	25 Å²	25	34.9 Å²	34.9	13%	0.128	19%	0.191	C	C	.	.	H	α-helix	trans	-64.4	-49.1	-179.7	-61.1	161.8	0	0	0	110.9	S674 G675 Q676 L680 A681 I682 F761	S674-I678 VanDerWaalsContact O-CG1 3.32Å; S674-I678 WeakPolarHBondContact O-CG1 3.02Å; S674-I678 PolarHBondContact O-N 3.37Å; G675-I678 PolarHBondContact O-N 2.78Å; Q676-I678 VanDerWaalsContact C-N 3.31Å; Q676-I678 PolarHBondContact O-N 3.4Å; I678-L680 VanDerWaalsContact C-N 3.33Å; I678-L680 PolarHBondContact O-N 2.92Å; I678-A681 PolarHBondContact O-N 3.29Å; I678-I682 HydrophobicContact CG2-CD1 3.84Å; I678-I682 HydrophobicContact CG2-CG1 4.47Å; I678-I682 WeakPolarHBondContact O-CG1 3.01Å; I678-I682 PolarHBondContact O-N 2.97Å; I678-F761 HydrophobicContact CD1-CB 3.87Å; I678-F761 HydrophobicContact CD1-CD1 3.22Å; I678-F761 HydrophobicContact CD1-CD2 3.72Å; I678-F761 HydrophobicContact CD1-CE1 3.62Å; I678-F761 HydrophobicContact CD1-CE2 4.11Å; I678-F761 HydrophobicContact CD1-CG 3.31Å; I678-F761 HydrophobicContact CD1-CZ 4.08Å; I678-F761 HydrophobicContact CG1-CB 3.74Å; I678-F761 HydrophobicContact CG1-CD1 3.95Å; I678-F761 HydrophobicContact CG1-CD2 3.53Å; I678-F761 HydrophobicContact CG1-CE1 4.5Å; I678-F761 HydrophobicContact CG1-CE2 4.17Å; I678-F761 HydrophobicContact CG1-CG 3.45Å; I678-F761 VanDerWaalsContact CG1-CG 3.45Å
679	L	70.2	Confident	70	Confident	58 Å²	58	30.5 Å²	30.5	30%	0.304	16%	0.16	S	C	.	.	H	α-helix	trans	-59.4	-45.7	-179	-166.8	98	0	0	0	111.3	G675 Q676 I682 W683	G675-L679 PolarHBondContact O-N 2.96Å; Q676-L679 PolarHBondContact O-N 2.87Å; L679-I682 PolarHBondContact O-N 3.47Å; L679-W683 HydrophobicContact CD2-CH2 4.23Å; L679-W683 HydrophobicContact CD2-CZ2 3.82Å; L679-W683 HydrophobicContact CG-CZ2 4.34Å; L679-W683 PolarHBondContact O-N 3.14Å; L679-W683 VanDerWaalsContact O-N 3.09Å
680	L	75.2	Confident	70.7	Confident	9 Å²	9	29.7 Å²	29.7	5%	0.047	15%	0.154	C	C	.	.	H	α-helix	trans	-65.6	-37.8	178	-71.8	171.2	0	0	0	112.4	F547 L647 K650 L651 L654 Q676 I678 L684	F547-L680 HydrophobicContact CD2-CD2 4.36Å; F547-L680 HydrophobicContact CE1-CD2 4.18Å; F547-L680 HydrophobicContact CE2-CD2 3.46Å; F547-L680 VanDerWaalsContact CE2-CD2 3.46Å; F547-L680 HydrophobicContact CZ-CD2 3.35Å; L647-L680 HydrophobicContact CD2-CD2 3.74Å; K650-L680 HydrophobicContact CB-CD1 4.39Å; K650-L680 HydrophobicContact CG-CD1 3.85Å; L651-L680 HydrophobicContact CD1-CB 4.39Å; L654-L680 HydrophobicContact CD1-CD1 3.5Å; Q676-L680 WeakPolarHBondContact O-CB 3.39Å; Q676-L680 WeakPolarHBondContact O-CG 3.45Å; Q676-L680 PolarHBondContact O-N 2.74Å; Q676-L680 VanDerWaalsContact O-N 3.1Å; I678-L680 VanDerWaalsContact C-N 3.33Å; I678-L680 PolarHBondContact O-N 2.92Å; L680-L684 WeakPolarHBondContact O-CB 3.18Å; L680-L684 PolarHBondContact O-N 3.34Å
681	A	73.2	Confident	71.4	Confident	3 Å²	3	28.8 Å²	28.8	3%	0.025	15%	0.149	C	C	.	.	H	α-helix	trans	-64.6	-44.7	176.3	0	0	0	0	0	111.5	I677 I678 W683 L684 I685 V758	I677-A681 VanDerWaalsContact O-CB 3.3Å; I677-A681 WeakPolarHBondContact O-CB 3.26Å; I677-A681 PolarHBondContact O-N 3.29Å; I678-A681 PolarHBondContact O-N 3.29Å; A681-W683 PolarHBondContact O-N 3.41Å; A681-L684 PolarHBondContact O-N 3.33Å; A681-I685 WeakPolarHBondContact O-CB 3.06Å; A681-I685 WeakPolarHBondContact O-CD1 3.37Å; A681-I685 VanDerWaalsContact O-CG1 3.23Å; A681-I685 WeakPolarHBondContact O-CG1 3.28Å; A681-I685 PolarHBondContact O-N 3.15Å; A681-V758 HydrophobicContact CB-CG1 4.46Å; A681-V758 HydrophobicContact CB-CG2 3.86Å
682	I	74.2	Confident	72.2	Confident	23 Å²	23	25.5 Å²	25.5	12%	0.118	13%	0.128	C	C	.	.	H	α-helix	trans	-60.9	-46.7	177.3	-67.4	168.9	0	0	0	110.7	I678 L679 L684 I685 E686 L768	I678-I682 HydrophobicContact CG2-CD1 3.84Å; I678-I682 HydrophobicContact CG2-CG1 4.47Å; I678-I682 WeakPolarHBondContact O-CG1 3.01Å; I678-I682 PolarHBondContact O-N 2.97Å; L679-I682 PolarHBondContact O-N 3.47Å; I682-L684 VanDerWaalsContact C-N 3.31Å; I682-L684 PolarHBondContact O-N 3.47Å; I682-I685 WeakPolarHBondContact O-CB 3.44Å; I682-I685 PolarHBondContact O-N 3.38Å; I682-E686 PolarHBondContact O-N 3.44Å; I682-L768 HydrophobicContact CG2-CD2 4.19Å
683	W	74.2	Confident	72.7	Confident	112 Å²	112	25 Å²	25	42%	0.424	13%	0.126	S	C	.	.	H	α-helix	trans	-62.5	-38.6	178.2	-71.7	5.5	0	0	0	112.7	F547 L647 L679 A681 L687	F547-W683 HydrophobicContact CE1-CE3 4.17Å; F547-W683 AromaticContact CE1-CH2 3.98Å; F547-W683 HydrophobicContact CE1-CH2 3.98Å; F547-W683 AromaticContact CE1-CZ3 3.36Å; F547-W683 HydrophobicContact CE1-CZ3 3.36Å; F547-W683 HydrophobicContact CZ-CE3 4.01Å; F547-W683 AromaticContact CZ-CZ3 3.62Å; F547-W683 HydrophobicContact CZ-CZ3 3.62Å; L647-W683 HydrophobicContact CD2-CE3 4.48Å; L679-W683 HydrophobicContact CD2-CH2 4.23Å; L679-W683 HydrophobicContact CD2-CZ2 3.82Å; L679-W683 HydrophobicContact CG-CZ2 4.34Å; L679-W683 PolarHBondContact O-N 3.14Å; L679-W683 VanDerWaalsContact O-N 3.09Å; A681-W683 PolarHBondContact O-N 3.41Å; W683-L687 WeakPolarHBondContact O-CB 3.12Å; W683-L687 PolarHBondContact O-N 3.33Å; W683-L687 VanDerWaalsContact O-N 3.09Å
684	L	76.9	Confident	72.9	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-69.3	-37.4	177.5	-169.7	61	0	0	0	111.8	K644 L647 L651 L680 A681 I682 L687 L688 I752	K644-L684 HydrophobicContact CG-CD1 4.22Å; L647-L684 HydrophobicContact CB-CD1 4.07Å; L647-L684 HydrophobicContact CD1-CD1 4.48Å; L651-L684 HydrophobicContact CD2-CD2 4.31Å; L680-L684 WeakPolarHBondContact O-CB 3.18Å; L680-L684 PolarHBondContact O-N 3.34Å; A681-L684 PolarHBondContact O-N 3.33Å; I682-L684 VanDerWaalsContact C-N 3.31Å; I682-L684 PolarHBondContact O-N 3.47Å; L684-L687 PolarHBondContact O-N 3.25Å; L684-L688 HydrophobicContact CG-CD1 4.15Å; L684-L688 WeakPolarHBondContact O-CB 3.07Å; L684-L688 WeakPolarHBondContact O-CD1 3.12Å; L684-L688 VanDerWaalsContact O-CG 3.22Å; L684-L688 WeakPolarHBondContact O-CG 3.46Å; L684-L688 PolarHBondContact O-N 3.25Å; L684-I752 HydrophobicContact CD2-CD1 3.31Å; L684-I752 HydrophobicContact CD2-CG1 3.93Å; L684-I752 HydrophobicContact CD2-CG2 4.44Å; L684-I752 HydrophobicContact CG-CD1 3.69Å
685	I	75.7	Confident	73.2	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-60.5	-50.3	173.6	-76.4	166.3	0	0	0	110.6	A681 I682 L687 L688 L689 F749 I752 L753 I769	A681-I685 WeakPolarHBondContact O-CB 3.06Å; A681-I685 WeakPolarHBondContact O-CD1 3.37Å; A681-I685 VanDerWaalsContact O-CG1 3.23Å; A681-I685 WeakPolarHBondContact O-CG1 3.28Å; A681-I685 PolarHBondContact O-N 3.15Å; I682-I685 WeakPolarHBondContact O-CB 3.44Å; I682-I685 PolarHBondContact O-N 3.38Å; I685-L687 VanDerWaalsContact C-N 3.32Å; I685-L687 PolarHBondContact O-N 3.47Å; I685-L688 PolarHBondContact O-N 3.49Å; I685-L689 HydrophobicContact CG2-CD1 3.97Å; I685-L689 WeakPolarHBondContact O-CG 3.47Å; I685-L689 PolarHBondContact O-N 3.1Å; I685-F749 HydrophobicContact CG1-CE2 4.48Å; I685-F749 HydrophobicContact CG2-CE2 4.03Å; I685-I752 HydrophobicContact CG1-CG2 4.45Å; I685-L753 HydrophobicContact CD1-CD2 3.74Å; I685-L753 HydrophobicContact CG1-CD2 4.36Å; I685-I769 HydrophobicContact CD1-CD1 4.5Å
686	E	73.6	Confident	73.6	Confident	55 Å²	55	27 Å²	27	26%	0.257	13%	0.131	S	C	.	.	H	α-helix	trans	-60.5	-41.1	177.8	-72.5	-173.6	174.8	0	0	112.3	I682 L688 L689 T690 L772	I682-E686 PolarHBondContact O-N 3.44Å; E686-L688 VanDerWaalsContact C-N 3.34Å; E686-L688 PolarHBondContact O-N 3.27Å; E686-L689 PolarHBondContact O-N 2.84Å; E686-T690 PolarHBondContact O-N 3.39Å; E686-T690 PolarHBondContact O-OG1 2.98Å; E686-L772 HydrophobicContact CG-CD1 3.87Å; E686-L772 HydrophobicContact CG-CD2 4.23Å
687	L	76.1	Confident	73.8	Confident	30 Å²	30	27.2 Å²	27.2	16%	0.157	13%	0.134	C	C	.	.	H	α-helix	trans	-62.3	-42.9	177.5	-162.1	73	0	0	0	111.7	L640 K644 L647 W683 L684 I685 T690 E691	L640-L687 HydrophobicContact CD2-CD1 3.34Å; L640-L687 HydrophobicContact CD2-CD2 4.49Å; L640-L687 HydrophobicContact CD2-CG 3.91Å; L640-L687 HydrophobicContact CG-CD1 4.37Å; K644-L687 HydrophobicContact CB-CD2 3.95Å; K644-L687 HydrophobicContact CG-CD2 4.41Å; L647-L687 HydrophobicContact CD1-CD2 4.35Å; W683-L687 WeakPolarHBondContact O-CB 3.12Å; W683-L687 PolarHBondContact O-N 3.33Å; W683-L687 VanDerWaalsContact O-N 3.09Å; L684-L687 PolarHBondContact O-N 3.25Å; I685-L687 VanDerWaalsContact C-N 3.32Å; I685-L687 PolarHBondContact O-N 3.47Å; L687-T690 PolarHBondContact O-N 3.3Å; L687-E691 PolarHBondContact O-N 3.04Å
688	L	75.9	Confident	73.8	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-70.8	-40.7	179.8	-75.1	168.5	0	0	0	112.5	K644 L684 I685 E686 T690 E691 L692 V745 E748 F749 I752	K644-L688 HydrophobicContact CD-CD2 4.48Å; K644-L688 VanDerWaalsContact CE-CD2 3.44Å; K644-L688 VanDerWaalsContact NZ-CD2 3.3Å; L684-L688 HydrophobicContact CG-CD1 4.15Å; L684-L688 WeakPolarHBondContact O-CB 3.07Å; L684-L688 WeakPolarHBondContact O-CD1 3.12Å; L684-L688 VanDerWaalsContact O-CG 3.22Å; L684-L688 WeakPolarHBondContact O-CG 3.46Å; L684-L688 PolarHBondContact O-N 3.25Å; I685-L688 PolarHBondContact O-N 3.49Å; E686-L688 VanDerWaalsContact C-N 3.34Å; E686-L688 PolarHBondContact O-N 3.27Å; L688-T690 VanDerWaalsContact C-N 3.27Å; L688-T690 PolarHBondContact O-N 3.39Å; L688-E691 PolarHBondContact O-N 2.96Å; L688-L692 WeakPolarHBondContact O-CB 3.38Å; L688-L692 WeakPolarHBondContact O-CG 3.24Å; L688-L692 PolarHBondContact O-N 3.39Å; L688-V745 HydrophobicContact CD2-CG1 3.85Å; L688-E748 HydrophobicContact CD2-CB 4.45Å; L688-F749 HydrophobicContact CB-CD2 4.03Å; L688-F749 HydrophobicContact CD1-CB 4.31Å; L688-F749 HydrophobicContact CD1-CD2 4.44Å; L688-I752 HydrophobicContact CD1-CD1 3.28Å
689	L	74.3	Confident	74.1	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.8	-38.2	174.6	-72.1	173.4	0	0	0	111.6	I685 E686 L692 N693 F749 L772 L773	I685-L689 HydrophobicContact CG2-CD1 3.97Å; I685-L689 WeakPolarHBondContact O-CG 3.47Å; I685-L689 PolarHBondContact O-N 3.1Å; E686-L689 PolarHBondContact O-N 2.84Å; L689-L692 HydrophobicContact CD2-CD1 4.45Å; L689-L692 PolarHBondContact O-N 3.47Å; L689-N693 PolarHBondContact O-N 2.95Å; L689-N693 PolarHBondContact O-OD1 2.9Å; L689-F749 HydrophobicContact CD1-CE2 4.39Å; L689-F749 HydrophobicContact CD2-CD2 4.43Å; L689-F749 HydrophobicContact CD2-CE2 3.7Å; L689-F749 HydrophobicContact CD2-CZ 3.86Å; L689-F749 HydrophobicContact CG-CE2 3.81Å; L689-F749 HydrophobicContact CG-CZ 4.38Å; L689-L772 HydrophobicContact CD1-CB 4.43Å; L689-L773 HydrophobicContact CD1-CD2 4.03Å; L689-L773 HydrophobicContact CD2-CD2 3.59Å; L689-L773 HydrophobicContact CG-CD2 4.46Å
690	T	73.4	Confident	74.3	Confident	21 Å²	21	32.9 Å²	32.9	13%	0.129	15%	0.154	C	C	.	.	H	α-helix	trans	-65.6	-43.8	174.1	-52.7	0	0	0	0	111.5	I624 E686 L687 L688 L692 N693 I694	I624-T690 HydrophobicContact CD1-CG2 4.38Å; I624-T690 HydrophobicContact CG1-CG2 4.43Å; I624-T690 HydrophobicContact CG2-CG2 4.27Å; E686-T690 PolarHBondContact O-N 3.39Å; E686-T690 PolarHBondContact O-OG1 2.98Å; L687-T690 PolarHBondContact O-N 3.3Å; L688-T690 VanDerWaalsContact C-N 3.27Å; L688-T690 PolarHBondContact O-N 3.39Å; T690-L692 VanDerWaalsContact C-N 3.34Å; T690-L692 PolarHBondContact O-N 3.18Å; T690-N693 PolarHBondContact O-N 3.39Å; T690-I694 HydrophobicContact CG2-CD1 4.11Å; T690-I694 WeakPolarHBondContact O-CD1 3.21Å; T690-I694 VanDerWaalsContact O-CG1 3.26Å; T690-I694 WeakPolarHBondContact O-CG1 3.39Å; T690-I694 PolarHBondContact O-N 3.02Å; T690-I694 VanDerWaalsContact O-N 3.16Å
691	E	73.6	Confident	74.2	Confident	29 Å²	29	37.7 Å²	37.7	14%	0.136	18%	0.178	C	C	.	.	H	α-helix	trans	-61.8	-41.2	175.5	-169.9	178.4	-174.8	0	0	111.4	K644 L687 L688 I694 I695 R741 V745	K644-E691 IonicContact NZ-OE2 2.62Å; K644-E691 PolarHBondContact NZ-OE2 3.21Å; L687-E691 PolarHBondContact O-N 3.04Å; L688-E691 PolarHBondContact O-N 2.96Å; E691-I694 PolarHBondContact O-N 3.03Å; E691-I695 HydrophobicContact CG-CD1 3.98Å; E691-I695 WeakPolarHBondContact O-CD1 3.43Å; E691-I695 VanDerWaalsContact O-CG1 3.27Å; E691-I695 WeakPolarHBondContact O-CG1 3.29Å; E691-I695 PolarHBondContact O-N 3.38Å; E691-I695 VanDerWaalsContact O-N 3.12Å; E691-R741 IonicContact OE1-CZ 2.79Å; E691-R741 IonicContact OE1-NE 2.8Å; E691-R741 PolarHBondContact OE1-NE 3.2Å; E691-R741 IonicContact OE1-NH2 3.29Å; E691-R741 PolarHBondContact OE1-NH2 3.1Å; E691-V745 HydrophobicContact CB-CG1 4.25Å; E691-V745 VanDerWaalsContact CD-CG2 3.48Å; E691-V745 HydrophobicContact CG-CG1 4.2Å; E691-V745 HydrophobicContact CG-CG2 4.07Å; E691-V745 WeakPolarHBondContact OE1-CG2 3.5Å
692	L	75.1	Confident	74	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-50.6	176.9	-75	170.8	0	0	0	112	L688 L689 T690 I694 I695 N696 V745 R746 F749 E781	L688-L692 WeakPolarHBondContact O-CB 3.38Å; L688-L692 WeakPolarHBondContact O-CG 3.24Å; L688-L692 PolarHBondContact O-N 3.39Å; L689-L692 HydrophobicContact CD2-CD1 4.45Å; L689-L692 PolarHBondContact O-N 3.47Å; T690-L692 VanDerWaalsContact C-N 3.34Å; T690-L692 PolarHBondContact O-N 3.18Å; L692-I694 VanDerWaalsContact C-N 3.3Å; L692-I694 PolarHBondContact O-N 3.41Å; L692-I695 PolarHBondContact O-N 3.28Å; L692-I695 VanDerWaalsContact O-N 3.16Å; L692-N696 WeakPolarHBondContact O-CB 3.34Å; L692-N696 PolarHBondContact O-N 3.4Å; L692-V745 HydrophobicContact CD2-CB 3.99Å; L692-V745 HydrophobicContact CD2-CG1 3.66Å; L692-V745 HydrophobicContact CG-CG1 3.71Å; L692-R746 HydrophobicContact CD2-CG 3.59Å; L692-F749 HydrophobicContact CD1-CB 4.47Å; L692-F749 HydrophobicContact CD1-CG 4.41Å; L692-E781 HydrophobicContact CD1-CG 4.35Å
693	N	73.4	Confident	73.4	Confident	31 Å²	31	40.4 Å²	40.4	17%	0.166	19%	0.194	C	C	.	.	H	α-helix	trans	-57.3	-44.1	179.2	-81.7	22.1	0	0	0	111.7	L689 T690 I695 N696 D697 H776 E778	L689-N693 PolarHBondContact O-N 2.95Å; L689-N693 PolarHBondContact O-OD1 2.9Å; T690-N693 PolarHBondContact O-N 3.39Å; N693-I695 PolarHBondContact O-N 2.96Å; N693-N696 PolarHBondContact O-N 3.5Å; N693-D697 WeakPolarHBondContact O-CB 3.24Å; N693-D697 PolarHBondContact O-N 3.09Å; N693-H776 PolarHBondContact ND2-ND1 3.23Å; N693-H776 PolarHBondContact ND2-O 3.41Å; N693-E778 VanDerWaalsContact OD1-CG 3.27Å; N693-E778 WeakPolarHBondContact OD1-CG 3.32Å
694	I	73	Confident	72.7	Confident	44 Å²	44	41.5 Å²	41.5	23%	0.226	20%	0.202	C	C	.	.	H	α-helix	trans	-62.3	-42.8	178.9	-67.4	166.6	0	0	0	111.3	I636 T690 E691 L692 R698	I636-I694 HydrophobicContact CG2-CD1 4.48Å; T690-I694 HydrophobicContact CG2-CD1 4.11Å; T690-I694 WeakPolarHBondContact O-CD1 3.21Å; T690-I694 VanDerWaalsContact O-CG1 3.26Å; T690-I694 WeakPolarHBondContact O-CG1 3.39Å; T690-I694 PolarHBondContact O-N 3.02Å; T690-I694 VanDerWaalsContact O-N 3.16Å; E691-I694 PolarHBondContact O-N 3.03Å; L692-I694 VanDerWaalsContact C-N 3.3Å; L692-I694 PolarHBondContact O-N 3.41Å; I694-R698 WeakPolarHBondContact O-CG 3.43Å; I694-R698 PolarHBondContact O-N 3.29Å
695	I	72.7	Confident	71.5	Confident	13 Å²	13	47.5 Å²	47.5	7%	0.067	23%	0.23	C	C	.	.	H	α-helix	trans	-69	-41	179.4	-63.7	164.1	0	0	0	110.6	E691 L692 N693 R698 L699 R741 L742 V745	E691-I695 HydrophobicContact CG-CD1 3.98Å; E691-I695 WeakPolarHBondContact O-CD1 3.43Å; E691-I695 VanDerWaalsContact O-CG1 3.27Å; E691-I695 WeakPolarHBondContact O-CG1 3.29Å; E691-I695 PolarHBondContact O-N 3.38Å; E691-I695 VanDerWaalsContact O-N 3.12Å; L692-I695 PolarHBondContact O-N 3.28Å; L692-I695 VanDerWaalsContact O-N 3.16Å; N693-I695 PolarHBondContact O-N 2.96Å; I695-R698 PolarHBondContact O-N 3.34Å; I695-L699 HydrophobicContact CG2-CD1 4.24Å; I695-L699 PolarHBondContact O-N 2.75Å; I695-R741 HydrophobicContact CD1-CG 3.84Å; I695-L742 HydrophobicContact CG2-CB 3.81Å; I695-L742 HydrophobicContact CG2-CD1 4.25Å; I695-L742 HydrophobicContact CG2-CG 4.41Å; I695-V745 HydrophobicContact CD1-CG2 4Å
696	N	74.8	Confident	70.2	Confident	31 Å²	31	51.1 Å²	51.1	17%	0.166	25%	0.249	C	C	.	.	H	α-helix	trans	-67.9	-42	-178.2	-157.5	7.3	0	0	0	111.9	L692 N693 R698 L699 K700 E778	L692-N696 WeakPolarHBondContact O-CB 3.34Å; L692-N696 PolarHBondContact O-N 3.4Å; N693-N696 PolarHBondContact O-N 3.5Å; N696-R698 VanDerWaalsContact C-N 3.28Å; N696-R698 PolarHBondContact O-N 3.3Å; N696-L699 PolarHBondContact O-N 2.98Å; N696-K700 WeakPolarHBondContact O-CG 3.45Å; N696-K700 PolarHBondContact O-N 3.02Å; N696-E778 PolarHBondContact ND2-OE1 3.2Å; N696-E778 PolarHBondContact ND2-OE2 3.38Å
697	D	75	Confident	68.8	Low	80 Å²	80	55.4 Å²	55.4	43%	0.428	27%	0.269	S	S	.	.	H	α-helix	trans	-60.3	-38.2	174.5	-76.8	-16.9	0	0	0	111.9	N693 K700 M701	N693-D697 WeakPolarHBondContact O-CB 3.24Å; N693-D697 PolarHBondContact O-N 3.09Å; D697-K700 PolarHBondContact O-N 2.99Å; D697-M701 WeakPolarHBondContact O-CG 3.3Å; D697-M701 PolarHBondContact O-N 3.18Å; D697-M701 VanDerWaalsContact O-N 3.1Å
698	R	71.1	Confident	67.4	Low	82 Å²	82	60.4 Å²	60.4	31%	0.309	30%	0.296	S	S	.	.	H	α-helix	trans	-67.6	-40.8	175	-72	-174.5	73.2	177.3	7.4	113	S633 I694 I695 N696 K700 M701 I702 L738	S633-R698 VanDerWaalsContact CB-CZ 3.49Å; S633-R698 PolarHBondContact O-NH1 3.49Å; S633-R698 PolarHBondContact OG-NH2 3.4Å; S633-R698 VanDerWaalsContact OG-NH2 3.17Å; I694-R698 WeakPolarHBondContact O-CG 3.43Å; I694-R698 PolarHBondContact O-N 3.29Å; I695-R698 PolarHBondContact O-N 3.34Å; N696-R698 VanDerWaalsContact C-N 3.28Å; N696-R698 PolarHBondContact O-N 3.3Å; R698-K700 VanDerWaalsContact C-N 3.32Å; R698-K700 PolarHBondContact O-N 2.76Å; R698-M701 PolarHBondContact O-N 2.96Å; R698-I702 WeakPolarHBondContact O-CG1 3.49Å; R698-I702 PolarHBondContact O-N 2.79Å; R698-I702 VanDerWaalsContact O-N 3.12Å; R698-L738 HydrophobicContact CB-CD1 4.44Å
699	L	74.8	Confident	65.8	Low	22 Å²	22	67 Å²	67	12%	0.115	33%	0.331	C	S	.	.	H	α-helix	trans	-63.1	-40.1	175.6	-78.6	165.9	0	0	0	111.4	I695 N696 M701 I702 T703 L738 Q739 L742	I695-L699 HydrophobicContact CG2-CD1 4.24Å; I695-L699 PolarHBondContact O-N 2.75Å; N696-L699 PolarHBondContact O-N 2.98Å; L699-M701 VanDerWaalsContact C-N 3.29Å; L699-M701 PolarHBondContact O-N 3.33Å; L699-I702 PolarHBondContact O-N 3.24Å; L699-T703 PolarHBondContact O-N 2.78Å; L699-T703 VanDerWaalsContact O-N 3.07Å; L699-T703 PolarHBondContact O-OG1 3.13Å; L699-T703 VanDerWaalsContact O-OG1 3.13Å; L699-L738 HydrophobicContact CD2-CB 4.09Å; L699-L738 HydrophobicContact CG-CB 4.38Å; L699-Q739 HydrophobicContact CD2-CG 4Å; L699-L742 HydrophobicContact CD1-CB 4.5Å; L699-L742 HydrophobicContact CD1-CD1 3.38Å
700	K	74.7	Confident	64.3	Low	98 Å²	98	74.6 Å²	74.6	43%	0.426	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-30.2	174.1	-70.9	173.2	-172.4	165.9	0	113.2	N696 D697 R698 T703 K704	N696-K700 WeakPolarHBondContact O-CG 3.45Å; N696-K700 PolarHBondContact O-N 3.02Å; D697-K700 PolarHBondContact O-N 2.99Å; R698-K700 VanDerWaalsContact C-N 3.32Å; R698-K700 PolarHBondContact O-N 2.76Å; K700-T703 PolarHBondContact O-OG1 3.39Å; K700-K704 VanDerWaalsContact O-CG 3.32Å; K700-K704 WeakPolarHBondContact O-CG 3.38Å; K700-K704 PolarHBondContact O-N 3.44Å
701	M	73.2	Confident	62.7	Low	111 Å²	111	80.6 Å²	80.6	55%	0.547	40%	0.399	S	S	.	.	H	α-helix	trans	-73	-41	175.1	-70.6	-62.4	101.2	0	0	112	D697 R698 L699 K704	D697-M701 WeakPolarHBondContact O-CG 3.3Å; D697-M701 PolarHBondContact O-N 3.18Å; D697-M701 VanDerWaalsContact O-N 3.1Å; R698-M701 PolarHBondContact O-N 2.96Å; L699-M701 VanDerWaalsContact C-N 3.29Å; L699-M701 PolarHBondContact O-N 3.33Å; M701-K704 HydrophobicContact CE-CD 4.2Å; M701-K704 PolarHBondContact O-N 2.88Å
702	I	68	Low	61.1	Low	23 Å²	23	88.2 Å²	88.2	12%	0.118	44%	0.435	C	S	.	.	H	α-helix	trans	-66.7	-43.4	178.9	-64.3	168.1	0	0	0	110.6	R698 L699 K704 Q705 D706 V734 K735 L738	R698-I702 WeakPolarHBondContact O-CG1 3.49Å; R698-I702 PolarHBondContact O-N 2.79Å; R698-I702 VanDerWaalsContact O-N 3.12Å; L699-I702 PolarHBondContact O-N 3.24Å; I702-K704 VanDerWaalsContact C-N 3.28Å; I702-K704 PolarHBondContact O-N 3.02Å; I702-Q705 PolarHBondContact O-N 3.08Å; I702-Q705 VanDerWaalsContact O-N 3.16Å; I702-D706 PolarHBondContact O-N 3.43Å; I702-V734 HydrophobicContact CD1-CG1 4.41Å; I702-K735 HydrophobicContact CG2-CD 4.48Å; I702-L738 HydrophobicContact CD1-CD1 3.59Å
703	T	62.2	Low	59.3	Low	60 Å²	60	96.1 Å²	96.1	37%	0.368	48%	0.476	S	S	.	.	H	α-helix	trans	-69.7	-21.4	-179.9	52.5	0	0	0	0	114.4	L699 K700	L699-T703 PolarHBondContact O-N 2.78Å; L699-T703 VanDerWaalsContact O-N 3.07Å; L699-T703 PolarHBondContact O-OG1 3.13Å; L699-T703 VanDerWaalsContact O-OG1 3.13Å; K700-T703 PolarHBondContact O-OG1 3.39Å
704	K	59.8	Low	57.5	Low	135 Å²	135	98.2 Å²	98.2	59%	0.587	51%	0.505	S	S	*	.	H	α-helix	trans	-78.7	-18.9	173.3	-77.8	179.7	-180	-176.3	0	113.4	K700 M701 I702 N708	K700-K704 VanDerWaalsContact O-CG 3.32Å; K700-K704 WeakPolarHBondContact O-CG 3.38Å; K700-K704 PolarHBondContact O-N 3.44Å; M701-K704 HydrophobicContact CE-CD 4.2Å; M701-K704 PolarHBondContact O-N 2.88Å; I702-K704 VanDerWaalsContact C-N 3.28Å; I702-K704 PolarHBondContact O-N 3.02Å; K704-N708 PolarHBondContact O-ND2 3.48Å
705	Q	51.3	Low	55.7	Low	127 Å²	127	103.3 Å²	103.3	59%	0.593	53%	0.532	S	S	*	.	H	α-helix	trans	-79.9	-40.3	174.6	-72.1	-179.1	-58	0	0	111	I702 H707 N708	I702-Q705 PolarHBondContact O-N 3.08Å; I702-Q705 VanDerWaalsContact O-N 3.16Å; Q705-H707 VanDerWaalsContact C-N 3.26Å; Q705-H707 PolarHBondContact O-N 3.35Å; Q705-N708 PolarHBondContact O-N 3.03Å
706	D	47.7	Very low	54.1	Low	78 Å²	78	110 Å²	110	42%	0.417	57%	0.568	S	S	.	*	H	α-helix	trans	-63.7	-25.9	178.9	-64.9	-18.9	0	0	0	113.8	I702 K735	I702-D706 PolarHBondContact O-N 3.43Å; D706-K735 IonicContact OD2-NZ 3.23Å; D706-K735 PolarHBondContact OD2-NZ 3.39Å
707	H	45.5	Very low	52.2	Low	145 Å²	145	112 Å²	112	67%	0.671	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-10.8	-176.8	-98	-55.7	0	0	0	115.3	Q705	Q705-H707 VanDerWaalsContact C-N 3.26Å; Q705-H707 PolarHBondContact O-N 3.35Å
708	N	45.1	Very low	50.2	Low	134 Å²	134	115.6 Å²	115.6	72%	0.717	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-15.2	179	-73.8	-27.5	0	0	0	113.5	K704 Q705	K704-N708 PolarHBondContact O-ND2 3.48Å; Q705-N708 PolarHBondContact O-N 3.03Å
709	D	43.9	Very low	48.6	Very low	139 Å²	139	123.2 Å²	123.2	74%	0.743	65%	0.645	S	S	*	*	S	Bend	trans	-96.5	2.2	-173.7	-70.4	-20.3	0	0	0	114.3
710	M	41	Very low	46.6	Very low	160 Å²	160	128.5 Å²	128.5	79%	0.788	68%	0.678	S	S	*	*	S	Bend	trans	-113.1	1	-174.3	-77.1	-70.1	-119.1	0	0	115.9
711	D	40	Very low	44.7	Very low	147 Å²	147	130.1 Å²	130.1	79%	0.786	70%	0.696	S	S	*	*	S	Bend	trans	-109.5	12.3	-176.1	-78.2	-24.1	0	0	0	115.5
712	E	41.3	Very low	42.7	Very low	189 Å²	189	128.5 Å²	128.5	88%	0.883	71%	0.708	S	S	*	*			trans	-134.1	66.4	173.3	-75.4	-167	162.5	0	0	113.5
713	I	37.3	Very low	41.2	Very low	170 Å²	170	134 Å²	134	87%	0.872	74%	0.735	S	S	*	*			trans	-134	98.6	158.8	-57.8	-179.5	0	0	0	109.6
714	G	35.3	Very low	39.9	Very low	75 Å²	75	137.7 Å²	137.7	77%	0.773	75%	0.753	S	S	*	*			trans	-133.5	109.9	166.6	0	0	0	0	0	110.4
715	N	35.7	Very low	38.6	Very low	150 Å²	150	138.4 Å²	138.4	80%	0.802	76%	0.763	S	S	*	*			trans	70.8	130.2	162.3	-93.5	1.6	0	0	0	121.9
716	D	37.9	Very low	38.2	Very low	154 Å²	154	138.3 Å²	138.3	82%	0.824	77%	0.767	S	S	*	*			trans	86.7	111.2	150	-61.9	-20.1	0	0	0	120.9
717	G	35.9	Very low	37.9	Very low	74 Å²	74	140.8 Å²	140.8	76%	0.763	78%	0.78	S	S	*	*				113.3	70.1	127.6	0	0	0	0	0	119.2
718	D	33.5	Very low	37.7	Very low	155 Å²	155	139.6 Å²	139.6	83%	0.829	78%	0.779	S	S	*	*				46.8	101.1	128.4	-143.1	16.1	0	0	0	119.2
719	R	36.7	Very low	37.8	Very low	242 Å²	242	138.8 Å²	138.8	91%	0.913	78%	0.775	S	S	*	*			trans	-179.9	116.3	133.2	-98.4	165.1	-167.2	-164.6	5.1	112.3
720	T	33.2	Very low	38.4	Very low	133 Å²	133	137.8 Å²	137.8	82%	0.816	77%	0.769	S	S	*	*			trans	-60.4	125.1	171.7	50.5	0	0	0	0	113.8
721	V	35	Very low	39.1	Very low	132 Å²	132	135.4 Å²	135.4	80%	0.8	76%	0.756	S	S	*	*			trans	-149.9	118.2	143.5	-178.3	0	0	0	0	107.6
722	G	29.8	Very low	40.2	Very low	77 Å²	77	133.1 Å²	133.1	79%	0.794	74%	0.744	S	S	*	*			trans	-75.4	132.6	-179.4	0	0	0	0	0	112.9
723	I	37.7	Very low	41.5	Very low	137 Å²	137	130 Å²	130	70%	0.703	73%	0.729	S	S	*	*			trans	-145.6	110.2	168.9	-58.9	-176.9	0	0	0	108.5
724	N	34	Very low	43.1	Very low	139 Å²	139	125 Å²	125	74%	0.743	71%	0.706	S	S	*	*			trans	55.5	116.2	149.4	-51.7	-13.6	0	0	0	120.7
725	N	33.2	Very low	45	Very low	149 Å²	149	123.6 Å²	123.6	80%	0.797	68%	0.679	S	S	*	*			trans	-100.9	22.8	179.5	-110.3	5.7	0	0	0	114.1
726	D	42.1	Very low	46.9	Very low	126 Å²	126	120.9 Å²	120.9	67%	0.674	66%	0.663	S	S	*	*			trans	-96.9	-3.4	-169	-68.8	-19.6	0	0	0	115.6
727	N	41.2	Very low	48.6	Very low	130 Å²	130	117 Å²	117	70%	0.695	65%	0.645	S	S	*	*	S	Bend	trans	-97.6	-9.7	-171.8	-71	-16.9	0	0	0	115.6
728	N	42.5	Very low	50.4	Low	120 Å²	120	114.4 Å²	114.4	64%	0.642	61%	0.614	S	S	*	*	H	α-helix	trans	-83.2	-25.1	-179.9	-73.2	-14.3	0	0	0	112.8	D730	N728-D730 PolarHBondContact O-N 3.16Å
729	D	46.9	Very low	52.5	Low	117 Å²	117	111.3 Å²	111.3	63%	0.626	60%	0.595	S	S	*	*	H	α-helix	trans	-69.5	-31.5	-177.8	-71.9	-18.2	0	0	0	113.1	H733	D729-H733 WeakPolarHBondContact O-CB 3.43Å; D729-H733 PolarHBondContact O-N 3.31Å
730	D	55.8	Low	54.5	Low	117 Å²	117	104.7 Å²	104.7	63%	0.626	58%	0.577	S	S	*	*	H	α-helix	trans	-70.4	-37.8	-178.7	-85.8	-15.1	0	0	0	112.5	N728 V734	N728-D730 PolarHBondContact O-N 3.16Å; D730-V734 VanDerWaalsContact O-CG2 3.28Å; D730-V734 WeakPolarHBondContact O-CG2 3.35Å; D730-V734 PolarHBondContact O-N 3.32Å; D730-V734 VanDerWaalsContact O-N 3.1Å
731	H	56.2	Low	56.5	Low	110 Å²	110	102 Å²	102	51%	0.509	55%	0.552	S	S	.	*	H	α-helix	trans	-70.2	-41.1	178.5	-88.9	-52.1	0	0	0	112.1	V734 K735	H731-V734 PolarHBondContact O-N 2.66Å; H731-K735 WeakPolarHBondContact O-CB 3.47Å; H731-K735 PolarHBondContact O-N 3.41Å
732	D	63.9	Low	58.6	Low	100 Å²	100	96.8 Å²	96.8	54%	0.535	52%	0.519	S	S	.	.	H	α-helix	trans	-66.4	-38.8	175.7	-83.3	-21.3	0	0	0	112	K735 L736	D732-K735 PolarHBondContact O-N 3.05Å; D732-L736 VanDerWaalsContact O-CB 3.31Å; D732-L736 WeakPolarHBondContact O-CB 3.46Å; D732-L736 PolarHBondContact O-N 3.08Å
733	H	67.7	Low	61.1	Low	124 Å²	124	95.2 Å²	95.2	57%	0.574	50%	0.499	S	S	*	.	H	α-helix	trans	-64.2	-42.2	175.6	-172.1	-75.3	0	0	0	112.4	D729 L736 T737	D729-H733 WeakPolarHBondContact O-CB 3.43Å; D729-H733 PolarHBondContact O-N 3.31Å; H733-L736 PolarHBondContact O-N 3.2Å; H733-T737 WeakPolarHBondContact O-CB 3.36Å; H733-T737 PolarHBondContact O-N 3.34Å; H733-T737 PolarHBondContact O-OG1 3.31Å
734	V	71.1	Confident	63.1	Low	64 Å²	64	90.4 Å²	90.4	39%	0.388	48%	0.478	S	S	.	.	H	α-helix	trans	-65.6	-43.2	176.9	172.3	0	0	0	0	111.1	I702 D730 H731 T737 L738	I702-V734 HydrophobicContact CD1-CG1 4.41Å; D730-V734 VanDerWaalsContact O-CG2 3.28Å; D730-V734 WeakPolarHBondContact O-CG2 3.35Å; D730-V734 PolarHBondContact O-N 3.32Å; D730-V734 VanDerWaalsContact O-N 3.1Å; H731-V734 PolarHBondContact O-N 2.66Å; V734-T737 PolarHBondContact O-N 3.11Å; V734-L738 HydrophobicContact CG1-CD1 4.12Å; V734-L738 WeakPolarHBondContact O-CG 3.17Å; V734-L738 PolarHBondContact O-N 3.2Å
735	K	75	Confident	65.1	Low	46 Å²	46	83.8 Å²	83.8	20%	0.2	44%	0.442	C	S	.	.	H	α-helix	trans	-60.5	-47.1	176	-173.8	175.8	-176.4	172.6	0	111.4	I702 D706 H731 D732 T737 L738 Q739	I702-K735 HydrophobicContact CG2-CD 4.48Å; D706-K735 IonicContact OD2-NZ 3.23Å; D706-K735 PolarHBondContact OD2-NZ 3.39Å; H731-K735 WeakPolarHBondContact O-CB 3.47Å; H731-K735 PolarHBondContact O-N 3.41Å; D732-K735 PolarHBondContact O-N 3.05Å; K735-T737 VanDerWaalsContact C-N 3.35Å; K735-T737 PolarHBondContact O-N 3.47Å; K735-L738 PolarHBondContact O-N 3.32Å; K735-Q739 WeakPolarHBondContact O-CB 3.37Å; K735-Q739 VanDerWaalsContact O-CG 3.31Å; K735-Q739 WeakPolarHBondContact O-CG 3.48Å; K735-Q739 PolarHBondContact O-N 3.06Å
736	L	75	Confident	67.4	Low	92 Å²	92	79.4 Å²	79.4	48%	0.482	42%	0.415	S	S	.	.	H	α-helix	trans	-62.2	-40.7	176.8	-174.7	65.1	0	0	0	112	D732 H733 Q739 N740	D732-L736 VanDerWaalsContact O-CB 3.31Å; D732-L736 WeakPolarHBondContact O-CB 3.46Å; D732-L736 PolarHBondContact O-N 3.08Å; H733-L736 PolarHBondContact O-N 3.2Å; L736-Q739 PolarHBondContact O-N 2.86Å; L736-N740 WeakPolarHBondContact O-CB 3.21Å; L736-N740 VanDerWaalsContact O-CG 3.24Å; L736-N740 PolarHBondContact O-N 3.09Å; L736-N740 PolarHBondContact O-ND2 2.65Å
737	T	74.3	Confident	69.4	Low	72 Å²	72	80.9 Å²	80.9	44%	0.442	41%	0.411	S	S	.	.	H	α-helix	trans	-63.1	-43.8	177.2	-56.8	0	0	0	0	111.5	H733 V734 K735 N740 R741	H733-T737 WeakPolarHBondContact O-CB 3.36Å; H733-T737 PolarHBondContact O-N 3.34Å; H733-T737 PolarHBondContact O-OG1 3.31Å; V734-T737 PolarHBondContact O-N 3.11Å; K735-T737 VanDerWaalsContact C-N 3.35Å; K735-T737 PolarHBondContact O-N 3.47Å; T737-N740 PolarHBondContact O-N 3.17Å; T737-R741 WeakPolarHBondContact O-CB 3.32Å; T737-R741 PolarHBondContact O-N 2.96Å
738	L	74	Confident	71.2	Confident	21 Å²	21	77.7 Å²	77.7	11%	0.11	39%	0.392	C	S	.	.	H	α-helix	trans	-67.3	-40.2	176.5	-72.6	171.3	0	0	0	112.1	R698 L699 I702 V734 K735 R741 L742	R698-L738 HydrophobicContact CB-CD1 4.44Å; L699-L738 HydrophobicContact CD2-CB 4.09Å; L699-L738 HydrophobicContact CG-CB 4.38Å; I702-L738 HydrophobicContact CD1-CD1 3.59Å; V734-L738 HydrophobicContact CG1-CD1 4.12Å; V734-L738 WeakPolarHBondContact O-CG 3.17Å; V734-L738 PolarHBondContact O-N 3.2Å; K735-L738 PolarHBondContact O-N 3.32Å; L738-R741 PolarHBondContact O-N 3.06Å; L738-L742 WeakPolarHBondContact O-CB 3.42Å; L738-L742 PolarHBondContact O-N 2.9Å
739	Q	78.2	Confident	73.1	Confident	90 Å²	90	72 Å²	72	42%	0.421	36%	0.361	S	S	.	.	H	α-helix	trans	-62.9	-43.2	174.9	-75.1	175.9	-15.1	0	0	112	L699 K735 L736 R741 L742 A743	L699-Q739 HydrophobicContact CD2-CG 4Å; K735-Q739 WeakPolarHBondContact O-CB 3.37Å; K735-Q739 VanDerWaalsContact O-CG 3.31Å; K735-Q739 WeakPolarHBondContact O-CG 3.48Å; K735-Q739 PolarHBondContact O-N 3.06Å; L736-Q739 PolarHBondContact O-N 2.86Å; Q739-R741 VanDerWaalsContact C-N 3.33Å; Q739-R741 PolarHBondContact O-N 3.46Å; Q739-L742 PolarHBondContact O-N 3.49Å; Q739-A743 PolarHBondContact O-N 3.21Å
740	N	77.3	Confident	74.8	Confident	102 Å²	102	70.7 Å²	70.7	55%	0.545	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-41.1	174.8	-74.6	-25.2	0	0	0	111.7	L736 T737 A743 S744	L736-N740 WeakPolarHBondContact O-CB 3.21Å; L736-N740 VanDerWaalsContact O-CG 3.24Å; L736-N740 PolarHBondContact O-N 3.09Å; L736-N740 PolarHBondContact O-ND2 2.65Å; T737-N740 PolarHBondContact O-N 3.17Å; N740-A743 PolarHBondContact O-N 3.08Å; N740-S744 PolarHBondContact O-N 3.46Å
741	R	76.7	Confident	76	Confident	78 Å²	78	69 Å²	69	29%	0.294	34%	0.342	S	S	.	.	H	α-helix	trans	-65.5	-44.8	176.2	-172.6	64.2	-178.5	179.6	1	111.5	E691 I695 T737 L738 Q739 A743 S744 V745	E691-R741 IonicContact OE1-CZ 2.79Å; E691-R741 IonicContact OE1-NE 2.8Å; E691-R741 PolarHBondContact OE1-NE 3.2Å; E691-R741 IonicContact OE1-NH2 3.29Å; E691-R741 PolarHBondContact OE1-NH2 3.1Å; I695-R741 HydrophobicContact CD1-CG 3.84Å; T737-R741 WeakPolarHBondContact O-CB 3.32Å; T737-R741 PolarHBondContact O-N 2.96Å; L738-R741 PolarHBondContact O-N 3.06Å; Q739-R741 VanDerWaalsContact C-N 3.33Å; Q739-R741 PolarHBondContact O-N 3.46Å; R741-A743 VanDerWaalsContact C-N 3.33Å; R741-A743 PolarHBondContact O-N 3.16Å; R741-S744 WeakPolarHBondContact O-CB 3.33Å; R741-S744 PolarHBondContact O-N 2.89Å; R741-S744 VanDerWaalsContact O-N 3.12Å; R741-V745 HydrophobicContact CG-CG2 4.42Å; R741-V745 WeakPolarHBondContact O-CG2 2.88Å; R741-V745 PolarHBondContact O-N 3.31Å
742	L	79	Confident	76.9	Confident	21 Å²	21	64.7 Å²	64.7	11%	0.11	32%	0.322	C	S	.	.	H	α-helix	trans	-55.7	-48.7	174.9	-177.2	157.1	0	0	0	110.6	I695 L699 L738 Q739 S744 V745 R746	I695-L742 HydrophobicContact CG2-CB 3.81Å; I695-L742 HydrophobicContact CG2-CD1 4.25Å; I695-L742 HydrophobicContact CG2-CG 4.41Å; L699-L742 HydrophobicContact CD1-CB 4.5Å; L699-L742 HydrophobicContact CD1-CD1 3.38Å; L738-L742 WeakPolarHBondContact O-CB 3.42Å; L738-L742 PolarHBondContact O-N 2.9Å; Q739-L742 PolarHBondContact O-N 3.49Å; L742-S744 VanDerWaalsContact C-N 3.28Å; L742-S744 PolarHBondContact O-N 3.42Å; L742-V745 PolarHBondContact O-N 3.35Å; L742-R746 VanDerWaalsContact CD2-CD 3.49Å; L742-R746 HydrophobicContact CD2-CG 3.98Å; L742-R746 WeakPolarHBondContact O-CB 2.9Å; L742-R746 WeakPolarHBondContact O-CG 3.4Å; L742-R746 PolarHBondContact O-N 2.97Å
743	A	81	Confident	77.5	Confident	45 Å²	45	60 Å²	60	37%	0.372	30%	0.297	S	S	.	.	H	α-helix	trans	-61.5	-36	177.9	0	0	0	0	0	112.7	Q739 N740 R741 R747	Q739-A743 PolarHBondContact O-N 3.21Å; N740-A743 PolarHBondContact O-N 3.08Å; R741-A743 VanDerWaalsContact C-N 3.33Å; R741-A743 PolarHBondContact O-N 3.16Å; A743-R747 WeakPolarHBondContact O-CB 3.39Å; A743-R747 PolarHBondContact O-N 2.92Å; A743-R747 VanDerWaalsContact O-N 3.1Å
744	S	79.5	Confident	78.1	Confident	36 Å²	36	56.1 Å²	56.1	25%	0.252	29%	0.287	S	S	.	.	H	α-helix	trans	-65.6	-50	174.6	-165.7	0	0	0	0	112	N740 R741 L742 R747 E748	N740-S744 PolarHBondContact O-N 3.46Å; R741-S744 WeakPolarHBondContact O-CB 3.33Å; R741-S744 PolarHBondContact O-N 2.89Å; R741-S744 VanDerWaalsContact O-N 3.12Å; L742-S744 VanDerWaalsContact C-N 3.28Å; L742-S744 PolarHBondContact O-N 3.42Å; S744-R747 WeakPolarHBondContact O-CB 3.44Å; S744-R747 PolarHBondContact O-N 3.2Å; S744-E748 WeakPolarHBondContact O-CG 3.02Å; S744-E748 PolarHBondContact O-N 3.4Å
745	V	77.3	Confident	78.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.1	-41.4	-177.9	179.8	0	0	0	0	110.8	L688 E691 L692 I695 R741 L742 R747 E748 F749	L688-V745 HydrophobicContact CD2-CG1 3.85Å; E691-V745 HydrophobicContact CB-CG1 4.25Å; E691-V745 VanDerWaalsContact CD-CG2 3.48Å; E691-V745 HydrophobicContact CG-CG1 4.2Å; E691-V745 HydrophobicContact CG-CG2 4.07Å; E691-V745 WeakPolarHBondContact OE1-CG2 3.5Å; L692-V745 HydrophobicContact CD2-CB 3.99Å; L692-V745 HydrophobicContact CD2-CG1 3.66Å; L692-V745 HydrophobicContact CG-CG1 3.71Å; I695-V745 HydrophobicContact CD1-CG2 4Å; R741-V745 HydrophobicContact CG-CG2 4.42Å; R741-V745 WeakPolarHBondContact O-CG2 2.88Å; R741-V745 PolarHBondContact O-N 3.31Å; L742-V745 PolarHBondContact O-N 3.35Å; V745-R747 VanDerWaalsContact C-N 3.33Å; V745-R747 PolarHBondContact O-N 2.96Å; V745-E748 PolarHBondContact O-N 3.1Å; V745-F749 WeakPolarHBondContact O-CB 3.47Å; V745-F749 PolarHBondContact O-N 2.88Å
746	R	81.7	Confident	78	Confident	56 Å²	56	56.3 Å²	56.3	21%	0.211	29%	0.292	C	S	.	.	H	α-helix	trans	-58	-44.5	172.4	-75.2	-169	172.5	171.1	-13.1	111.5	L692 L742 E748 F749 R750 D780 E781	L692-R746 HydrophobicContact CD2-CG 3.59Å; L742-R746 VanDerWaalsContact CD2-CD 3.49Å; L742-R746 HydrophobicContact CD2-CG 3.98Å; L742-R746 WeakPolarHBondContact O-CB 2.9Å; L742-R746 WeakPolarHBondContact O-CG 3.4Å; L742-R746 PolarHBondContact O-N 2.97Å; R746-E748 PolarHBondContact O-N 3.49Å; R746-F749 PolarHBondContact O-N 2.94Å; R746-R750 WeakPolarHBondContact O-CB 3.41Å; R746-R750 WeakPolarHBondContact O-CG 3.37Å; R746-R750 PolarHBondContact O-N 3.23Å; R746-D780 IonicContact CZ-OD2 3.82Å; R746-D780 IonicContact NH1-OD2 2.8Å; R746-D780 IonicContact NH2-OD2 3.95Å; R746-D780 PolarHBondContact NH2-OD2 3.05Å; R746-D780 VanDerWaalsContact NH2-OD2 3.09Å; R746-E781 VanDerWaalsContact CD-OE1 3.24Å; R746-E781 WeakPolarHBondContact CD-OE1 3.47Å; R746-E781 WeakPolarHBondContact CG-OE1 3.46Å; R746-E781 IonicContact NE-OE1 3.7Å; R746-E781 PolarHBondContact NE-OE1 3.49Å
747	R	83.1	Confident	77.6	Confident	158 Å²	158	53 Å²	53	60%	0.596	27%	0.274	S	S	*	.	H	α-helix	trans	-61.5	-43.5	177.2	-173.2	-176.4	-65.6	100.3	-0.8	111.8	A743 S744 V745 R750 T751	A743-R747 WeakPolarHBondContact O-CB 3.39Å; A743-R747 PolarHBondContact O-N 2.92Å; A743-R747 VanDerWaalsContact O-N 3.1Å; S744-R747 WeakPolarHBondContact O-CB 3.44Å; S744-R747 PolarHBondContact O-N 3.2Å; V745-R747 VanDerWaalsContact C-N 3.33Å; V745-R747 PolarHBondContact O-N 2.96Å; R747-R750 PolarHBondContact O-N 3.45Å; R747-T751 WeakPolarHBondContact O-CB 3.27Å; R747-T751 PolarHBondContact O-N 3.29Å; R747-T751 PolarHBondContact O-OG1 3.48Å
748	E	79.7	Confident	77.2	Confident	63 Å²	63	50 Å²	50	29%	0.294	26%	0.255	S	S	.	.	H	α-helix	trans	-63.6	-47.3	178.2	-70.9	171.3	-154.7	0	0	111.8	K644 L688 S744 V745 R746 R750 T751 I752	K644-E748 WeakPolarHBondContact CE-OE2 3.1Å; K644-E748 IonicContact NZ-OE2 2.84Å; K644-E748 PolarHBondContact NZ-OE2 3.18Å; L688-E748 HydrophobicContact CD2-CB 4.45Å; S744-E748 WeakPolarHBondContact O-CG 3.02Å; S744-E748 PolarHBondContact O-N 3.4Å; V745-E748 PolarHBondContact O-N 3.1Å; R746-E748 PolarHBondContact O-N 3.49Å; E748-R750 PolarHBondContact O-N 3.36Å; E748-T751 PolarHBondContact O-N 3.5Å; E748-T751 VanDerWaalsContact O-N 3.17Å; E748-I752 WeakPolarHBondContact O-CD1 3.48Å; E748-I752 WeakPolarHBondContact O-CG1 3.21Å; E748-I752 PolarHBondContact O-N 3.45Å
749	F	81.1	Confident	77	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-54.1	-50.5	174.3	179.4	-100.8	0	0	0	112	I685 L688 L689 L692 V745 R746 T751 I752 L753 L773 E781	I685-F749 HydrophobicContact CG1-CE2 4.48Å; I685-F749 HydrophobicContact CG2-CE2 4.03Å; L688-F749 HydrophobicContact CB-CD2 4.03Å; L688-F749 HydrophobicContact CD1-CB 4.31Å; L688-F749 HydrophobicContact CD1-CD2 4.44Å; L689-F749 HydrophobicContact CD1-CE2 4.39Å; L689-F749 HydrophobicContact CD2-CD2 4.43Å; L689-F749 HydrophobicContact CD2-CE2 3.7Å; L689-F749 HydrophobicContact CD2-CZ 3.86Å; L689-F749 HydrophobicContact CG-CE2 3.81Å; L689-F749 HydrophobicContact CG-CZ 4.38Å; L692-F749 HydrophobicContact CD1-CB 4.47Å; L692-F749 HydrophobicContact CD1-CG 4.41Å; V745-F749 WeakPolarHBondContact O-CB 3.47Å; V745-F749 PolarHBondContact O-N 2.88Å; R746-F749 PolarHBondContact O-N 2.94Å; F749-T751 VanDerWaalsContact C-N 3.32Å; F749-T751 PolarHBondContact O-N 2.99Å; F749-I752 PolarHBondContact O-N 3.11Å; F749-L753 HydrophobicContact CD1-CD1 3.86Å; F749-L753 HydrophobicContact CE1-CD1 3.27Å; F749-L753 HydrophobicContact CE1-CG 4.33Å; F749-L753 HydrophobicContact CE2-CD1 4.3Å; F749-L753 HydrophobicContact CZ-CD1 3.53Å; F749-L753 HydrophobicContact CZ-CG 4.33Å; F749-L753 PolarHBondContact O-N 3.46Å; F749-L753 VanDerWaalsContact O-N 3.1Å; F749-L773 HydrophobicContact CZ-CD2 4.12Å; F749-E781 HydrophobicContact CD1-CG 4.45Å; F749-E781 HydrophobicContact CE1-CB 3.97Å; F749-E781 HydrophobicContact CE1-CG 4.3Å
750	R	82.5	Confident	76.6	Confident	90 Å²	90	53.1 Å²	53.1	34%	0.34	28%	0.275	S	S	.	.	H	α-helix	trans	-63.8	-35.3	178.2	-69	-175.3	-177.2	-170.2	-0.5	113.1	R746 R747 E748 A754 E781 Y784	R746-R750 WeakPolarHBondContact O-CB 3.41Å; R746-R750 WeakPolarHBondContact O-CG 3.37Å; R746-R750 PolarHBondContact O-N 3.23Å; R747-R750 PolarHBondContact O-N 3.45Å; E748-R750 PolarHBondContact O-N 3.36Å; R750-A754 VanDerWaalsContact O-CB 3.27Å; R750-A754 WeakPolarHBondContact O-CB 3.38Å; R750-A754 PolarHBondContact O-N 3.18Å; R750-E781 IonicContact NE-OE1 3.89Å; R750-E781 IonicContact NE-OE2 2.66Å; R750-E781 PolarHBondContact NE-OE2 3.42Å; R750-E781 IonicContact NH2-OE1 3.56Å; R750-E781 IonicContact NH2-OE2 2.87Å; R750-Y784 HydrophobicContact CB-CE1 3.83Å; R750-Y784 HydrophobicContact CB-CE2 4.44Å; R750-Y784 HydrophobicContact CG-CD1 3.84Å; R750-Y784 HydrophobicContact CG-CD2 4.36Å; R750-Y784 HydrophobicContact CG-CE1 3.49Å; R750-Y784 VanDerWaalsContact CG-CE1 3.49Å; R750-Y784 HydrophobicContact CG-CE2 4.02Å; R750-Y784 HydrophobicContact CG-CG 4.27Å; R750-Y784 PolarHBondContact O-OH 2.86Å
751	T	81.4	Confident	75.9	Confident	82 Å²	82	50 Å²	50	50%	0.503	26%	0.256	S	S	.	.	H	α-helix	trans	-67.5	-42.9	178	-55.6	0	0	0	0	111.1	R747 E748 F749 A754 L755	R747-T751 WeakPolarHBondContact O-CB 3.27Å; R747-T751 PolarHBondContact O-N 3.29Å; R747-T751 PolarHBondContact O-OG1 3.48Å; E748-T751 PolarHBondContact O-N 3.5Å; E748-T751 VanDerWaalsContact O-N 3.17Å; F749-T751 VanDerWaalsContact C-N 3.32Å; F749-T751 PolarHBondContact O-N 2.99Å; T751-A754 PolarHBondContact O-N 3.43Å; T751-L755 PolarHBondContact O-N 3.07Å
752	I	76	Confident	75.4	Confident	19 Å²	19	46.6 Å²	46.6	10%	0.097	24%	0.244	C	C	.	.	H	α-helix	trans	-66.2	-42.5	178.8	-68.7	153.1	0	0	0	111	L684 I685 L688 E748 F749 A754 L755	L684-I752 HydrophobicContact CD2-CD1 3.31Å; L684-I752 HydrophobicContact CD2-CG1 3.93Å; L684-I752 HydrophobicContact CD2-CG2 4.44Å; L684-I752 HydrophobicContact CG-CD1 3.69Å; I685-I752 HydrophobicContact CG1-CG2 4.45Å; L688-I752 HydrophobicContact CD1-CD1 3.28Å; E748-I752 WeakPolarHBondContact O-CD1 3.48Å; E748-I752 WeakPolarHBondContact O-CG1 3.21Å; E748-I752 PolarHBondContact O-N 3.45Å; F749-I752 PolarHBondContact O-N 3.11Å; I752-A754 VanDerWaalsContact C-N 3.25Å; I752-A754 PolarHBondContact O-N 2.94Å; I752-L755 WeakPolarHBondContact O-CB 3.48Å; I752-L755 PolarHBondContact O-N 3.43Å
753	L	76.6	Confident	74.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-32.5	175	-72.6	177.6	0	0	0	112.6	I685 F749 L755 L759 L762 Y784 F785 L788	I685-L753 HydrophobicContact CD1-CD2 3.74Å; I685-L753 HydrophobicContact CG1-CD2 4.36Å; F749-L753 HydrophobicContact CD1-CD1 3.86Å; F749-L753 HydrophobicContact CE1-CD1 3.27Å; F749-L753 HydrophobicContact CE1-CG 4.33Å; F749-L753 HydrophobicContact CE2-CD1 4.3Å; F749-L753 HydrophobicContact CZ-CD1 3.53Å; F749-L753 HydrophobicContact CZ-CG 4.33Å; F749-L753 PolarHBondContact O-N 3.46Å; F749-L753 VanDerWaalsContact O-N 3.1Å; L753-L755 VanDerWaalsContact C-N 3.31Å; L753-L755 PolarHBondContact O-N 3.05Å; L753-L759 WeakPolarHBondContact O-CG 3.38Å; L753-L762 HydrophobicContact CD2-CD1 4.48Å; L753-L762 HydrophobicContact CD2-CD2 4.44Å; L753-Y784 HydrophobicContact CD1-CD1 4.25Å; L753-Y784 HydrophobicContact CD1-CE1 4.14Å; L753-F785 HydrophobicContact CD1-CD2 4.09Å; L753-F785 HydrophobicContact CD2-CD2 4.04Å; L753-F785 HydrophobicContact CD2-CE2 4.06Å; L753-L788 HydrophobicContact CB-CD2 3.68Å
754	A	78.7	Confident	74	Confident	44 Å²	44	51.8 Å²	51.8	36%	0.364	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-1.6	179.2	0	0	0	0	0	114.5	R750 T751 I752 L759	R750-A754 VanDerWaalsContact O-CB 3.27Å; R750-A754 WeakPolarHBondContact O-CB 3.38Å; R750-A754 PolarHBondContact O-N 3.18Å; T751-A754 PolarHBondContact O-N 3.43Å; I752-A754 VanDerWaalsContact C-N 3.25Å; I752-A754 PolarHBondContact O-N 2.94Å; A754-L759 WeakPolarHBondContact O-CD1 3.48Å
755	L	74.4	Confident	73.2	Confident	37 Å²	37	51.1 Å²	51.1	19%	0.194	26%	0.263	C	S	.	.			trans	-64.1	131	176.4	-73.2	169.8	0	0	0	110.3	L651 I655 T751 I752 L753 E757 V758 L759	L651-L755 HydrophobicContact CD2-CD1 3.86Å; I655-L755 HydrophobicContact CD1-CD1 4.17Å; T751-L755 PolarHBondContact O-N 3.07Å; I752-L755 WeakPolarHBondContact O-CB 3.48Å; I752-L755 PolarHBondContact O-N 3.43Å; L753-L755 VanDerWaalsContact C-N 3.31Å; L753-L755 PolarHBondContact O-N 3.05Å; L755-E757 PolarHBondContact O-N 3.31Å; L755-V758 HydrophobicContact CB-CB 4.2Å; L755-V758 HydrophobicContact CB-CG2 3.95Å; L755-V758 HydrophobicContact CD1-CG2 4.33Å; L755-V758 PolarHBondContact O-N 3.35Å; L755-V758 VanDerWaalsContact O-N 3.08Å; L755-L759 WeakPolarHBondContact O-CG 3.47Å; L755-L759 PolarHBondContact O-N 3.44Å
756	P	69.8	Low	73	Confident	77 Å²	77	53.8 Å²	53.8	50%	0.5	28%	0.275	S	S	.	.	H	α-helix	trans	-55.5	-38	-177.6	-25.5	33.4	0	0	0	113.7	L759 N760	P756-L759 PolarHBondContact O-N 3.01Å; P756-N760 PolarHBondContact O-N 3.3Å; P756-N760 VanDerWaalsContact O-N 3.09Å; P756-N760 PolarHBondContact O-ND2 3.03Å
757	E	66.4	Low	72.4	Confident	22 Å²	22	54.4 Å²	54.4	10%	0.103	29%	0.288	C	S	.	.	H	α-helix	trans	-67.3	-42.3	-179.8	-59.5	77	-169.7	0	0	110.7	I655 I677 L755 N760 F761	I655-E757 HydrophobicContact CG1-CG 4.17Å; I655-E757 HydrophobicContact CG2-CG 4.49Å; I655-E757 WeakPolarHBondContact CG2-OE1 3.43Å; I677-E757 HydrophobicContact CG2-CB 4.21Å; L755-E757 PolarHBondContact O-N 3.31Å; E757-N760 PolarHBondContact O-N 2.61Å; E757-F761 WeakPolarHBondContact O-CD2 3.34Å
758	V	67.6	Low	71.9	Confident	9 Å²	9	49 Å²	49	6%	0.055	27%	0.271	C	S	.	.	H	α-helix	trans	-67.4	-48.3	176.8	-179.4	0	0	0	0	109	A681 L755 N760 F761 L762	A681-V758 HydrophobicContact CB-CG1 4.46Å; A681-V758 HydrophobicContact CB-CG2 3.86Å; L755-V758 HydrophobicContact CB-CB 4.2Å; L755-V758 HydrophobicContact CB-CG2 3.95Å; L755-V758 HydrophobicContact CD1-CG2 4.33Å; L755-V758 PolarHBondContact O-N 3.35Å; L755-V758 VanDerWaalsContact O-N 3.08Å; V758-N760 PolarHBondContact O-N 3.26Å; V758-N760 VanDerWaalsContact O-N 3.11Å; V758-F761 CarbonylContact O-C 3.55Å; V758-F761 PolarHBondContact O-N 2.96Å; V758-L762 HydrophobicContact CG1-CD1 4.14Å; V758-L762 HydrophobicContact CG1-CD2 3.87Å; V758-L762 HydrophobicContact CG1-CG 3.82Å; V758-L762 VanDerWaalsContact O-CG 3.28Å; V758-L762 WeakPolarHBondContact O-CG 3.49Å; V758-L762 PolarHBondContact O-N 3.2Å
759	L	69.5	Low	71.5	Confident	57 Å²	57	46.2 Å²	46.2	30%	0.298	26%	0.257	S	S	.	.	H	α-helix	trans	-52.1	-34.7	176.8	-74.8	168.8	0	0	0	113.8	L753 A754 L755 P756 L762 P763 L788	L753-L759 WeakPolarHBondContact O-CG 3.38Å; A754-L759 WeakPolarHBondContact O-CD1 3.48Å; L755-L759 WeakPolarHBondContact O-CG 3.47Å; L755-L759 PolarHBondContact O-N 3.44Å; P756-L759 PolarHBondContact O-N 3.01Å; L759-L762 HydrophobicContact CD2-CD1 4.08Å; L759-P763 WeakPolarHBondContact O-CD 3.34Å; L759-L788 HydrophobicContact CD2-CD1 4.01Å; L759-L788 HydrophobicContact CD2-CD2 3.91Å; L759-L788 HydrophobicContact CD2-CG 3.8Å
760	N	68.4	Low	71.2	Confident	119 Å²	119	46.2 Å²	46.2	64%	0.636	26%	0.257	S	S	*	.	H	α-helix	trans	-70.6	-30.4	177.3	-70.6	-23.7	0	0	0	113.3	P756 E757 V758 P763	P756-N760 PolarHBondContact O-N 3.3Å; P756-N760 VanDerWaalsContact O-N 3.09Å; P756-N760 PolarHBondContact O-ND2 3.03Å; E757-N760 PolarHBondContact O-N 2.61Å; V758-N760 PolarHBondContact O-N 3.26Å; V758-N760 VanDerWaalsContact O-N 3.11Å; N760-P763 WeakPolarHBondContact O-CD 3.44Å
761	F	63	Low	70.8	Confident	38 Å²	38	46.1 Å²	46.1	17%	0.167	26%	0.264	C	S	.	.	H	α-helix	trans	-97	-20.8	180	-70.1	-68.5	0	0	0	114	S674 I678 E757 V758 P763 E764 A765	S674-F761 VanDerWaalsContact CB-CZ 3.49Å; I678-F761 HydrophobicContact CD1-CB 3.87Å; I678-F761 HydrophobicContact CD1-CD1 3.22Å; I678-F761 HydrophobicContact CD1-CD2 3.72Å; I678-F761 HydrophobicContact CD1-CE1 3.62Å; I678-F761 HydrophobicContact CD1-CE2 4.11Å; I678-F761 HydrophobicContact CD1-CG 3.31Å; I678-F761 HydrophobicContact CD1-CZ 4.08Å; I678-F761 HydrophobicContact CG1-CB 3.74Å; I678-F761 HydrophobicContact CG1-CD1 3.95Å; I678-F761 HydrophobicContact CG1-CD2 3.53Å; I678-F761 HydrophobicContact CG1-CE1 4.5Å; I678-F761 HydrophobicContact CG1-CE2 4.17Å; I678-F761 HydrophobicContact CG1-CG 3.45Å; I678-F761 VanDerWaalsContact CG1-CG 3.45Å; E757-F761 WeakPolarHBondContact O-CD2 3.34Å; V758-F761 CarbonylContact O-C 3.55Å; V758-F761 PolarHBondContact O-N 2.96Å; F761-P763 VanDerWaalsContact O-N 3.13Å; F761-E764 PolarHBondContact O-N 3.12Å; F761-A765 PolarHBondContact O-N 2.84Å
762	L	65.7	Low	70.3	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.031	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-31	177.6	-75	179	0	0	0	114.7	L753 V758 L759 E764 K766 I769 F785 L788 M789	L753-L762 HydrophobicContact CD2-CD1 4.48Å; L753-L762 HydrophobicContact CD2-CD2 4.44Å; V758-L762 HydrophobicContact CG1-CD1 4.14Å; V758-L762 HydrophobicContact CG1-CD2 3.87Å; V758-L762 HydrophobicContact CG1-CG 3.82Å; V758-L762 VanDerWaalsContact O-CG 3.28Å; V758-L762 WeakPolarHBondContact O-CG 3.49Å; V758-L762 PolarHBondContact O-N 3.2Å; L759-L762 HydrophobicContact CD2-CD1 4.08Å; L762-E764 VanDerWaalsContact C-N 3.28Å; L762-E764 PolarHBondContact O-N 3.19Å; L762-K766 VanDerWaalsContact O-CA 3.32Å; L762-K766 WeakPolarHBondContact O-CA 3.38Å; L762-K766 WeakPolarHBondContact O-CB 3.37Å; L762-K766 PolarHBondContact O-N 2.85Å; L762-I769 HydrophobicContact CD2-CD1 3.23Å; L762-F785 HydrophobicContact CD1-CE2 4.06Å; L762-F785 HydrophobicContact CD2-CE2 3.92Å; L762-F785 HydrophobicContact CD2-CZ 4.27Å; L762-L788 HydrophobicContact CD1-CD2 4.43Å; L762-M789 HydrophobicContact CB-CE 3.77Å; L762-M789 HydrophobicContact CB-SD 3.45Å; L762-M789 WeakPolarHBondContact CB-SD 3.42Å; L762-M789 HydrophobicContact CD1-SD 3.85Å; L762-M789 HydrophobicContact CG-SD 4.25Å
763	P	66.3	Low	70.3	Confident	78 Å²	78	42.6 Å²	42.6	51%	0.506	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-34.6	174.7	-24.4	34.6	0	0	0	113.6	L759 N760 F761 K766 M789	L759-P763 WeakPolarHBondContact O-CD 3.34Å; N760-P763 WeakPolarHBondContact O-CD 3.44Å; F761-P763 VanDerWaalsContact O-N 3.13Å; P763-K766 WeakPolarHBondContact O-CB 3.39Å; P763-M789 HydrophobicContact CB-CE 4.43Å; P763-M789 HydrophobicContact CG-CE 4.13Å
764	E	64.6	Low	70.2	Confident	96 Å²	96	47.4 Å²	47.4	45%	0.449	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-38	-177	-63.8	177.1	170.5	0	0	111.8	M594 I598 F761 L762 K766	M594-E764 WeakPolarHBondContact CE-OE2 3.38Å; I598-E764 HydrophobicContact CD1-CB 4.38Å; F761-E764 PolarHBondContact O-N 3.12Å; L762-E764 VanDerWaalsContact C-N 3.28Å; L762-E764 PolarHBondContact O-N 3.19Å; E764-K766 VanDerWaalsContact C-N 3.32Å
765	A	63.7	Low	69.8	Low	22 Å²	22	50.5 Å²	50.5	18%	0.182	28%	0.275	C	S	.	.	S	Bend	trans	-91.6	10.9	177.3	0	0	0	0	0	113.8	F761 S767 L768 I769	F761-A765 PolarHBondContact O-N 2.84Å; A765-S767 VanDerWaalsContact C-N 3.35Å; A765-S767 PolarHBondContact O-N 3.41Å; A765-L768 PolarHBondContact O-N 3.44Å; A765-I769 PolarHBondContact O-N 3.35Å
766	K	72.8	Confident	69.4	Low	57 Å²	57	50.9 Å²	50.9	25%	0.248	28%	0.276	C	S	.	.	H	α-helix	trans	-54.7	-45.2	-171.1	-179.5	173.7	174.1	-177.2	0	113	L762 P763 E764 Y770 M789 D791	L762-K766 VanDerWaalsContact O-CA 3.32Å; L762-K766 WeakPolarHBondContact O-CA 3.38Å; L762-K766 WeakPolarHBondContact O-CB 3.37Å; L762-K766 PolarHBondContact O-N 2.85Å; P763-K766 WeakPolarHBondContact O-CB 3.39Å; E764-K766 VanDerWaalsContact C-N 3.32Å; K766-Y770 HydrophobicContact CD-CE2 4.02Å; K766-Y770 VanDerWaalsContact CE-CE2 3.44Å; K766-Y770 HydrophobicContact CG-CD2 3.75Å; K766-Y770 HydrophobicContact CG-CE2 3.34Å; K766-Y770 WeakPolarHBondContact O-CD2 3.46Å; K766-Y770 PolarHBondContact O-N 3.36Å; K766-M789 HydrophobicContact CD-CE 4.32Å; K766-D791 WeakPolarHBondContact CE-OD2 3.43Å; K766-D791 VanDerWaalsContact NZ-CG 3.27Å; K766-D791 IonicContact NZ-OD2 3.46Å; K766-D791 PolarHBondContact NZ-OD2 3.21Å
767	S	69.9	Low	69.1	Low	68 Å²	68	49.8 Å²	49.8	48%	0.476	28%	0.278	S	S	.	.	H	α-helix	trans	-61.4	-47	179.7	49	0	0	0	0	112.2	A765 I769 Y770 D771	A765-S767 VanDerWaalsContact C-N 3.35Å; A765-S767 PolarHBondContact O-N 3.41Å; S767-I769 PolarHBondContact O-N 3.14Å; S767-Y770 PolarHBondContact O-N 3.47Å; S767-D771 VanDerWaalsContact O-CG 3.26Å; S767-D771 PolarHBondContact O-N 2.84Å
768	L	71.1	Confident	69.1	Low	46 Å²	46	49.3 Å²	49.3	24%	0.241	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-40.9	-176.6	-171.6	128	0	0	0	112	I682 A765 D771 L772	I682-L768 HydrophobicContact CG2-CD2 4.19Å; A765-L768 PolarHBondContact O-N 3.44Å; L768-D771 PolarHBondContact O-N 3.31Å; L768-L772 HydrophobicContact CD2-CD1 3.85Å; L768-L772 VanDerWaalsContact O-CG 3.31Å; L768-L772 WeakPolarHBondContact O-CG 3.25Å; L768-L772 PolarHBondContact O-N 3.45Å
769	I	71.7	Confident	69.2	Low	3 Å²	3	52.4 Å²	52.4	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-71	-37.5	178.2	-63.2	169.4	0	0	0	111.2	I685 L762 A765 S767 D771 L772 L773 F785	I685-I769 HydrophobicContact CD1-CD1 4.5Å; L762-I769 HydrophobicContact CD2-CD1 3.23Å; A765-I769 PolarHBondContact O-N 3.35Å; S767-I769 PolarHBondContact O-N 3.14Å; I769-D771 VanDerWaalsContact C-N 3.35Å; I769-L772 PolarHBondContact O-N 3.46Å; I769-L773 HydrophobicContact CG2-CD1 3.81Å; I769-L773 HydrophobicContact CG2-CG 4.28Å; I769-L773 WeakPolarHBondContact O-CB 3.48Å; I769-L773 VanDerWaalsContact O-CG 3.3Å; I769-L773 WeakPolarHBondContact O-CG 3.18Å; I769-L773 PolarHBondContact O-N 2.96Å; I769-F785 HydrophobicContact CB-CE1 3.98Å; I769-F785 HydrophobicContact CB-CE2 4.38Å; I769-F785 HydrophobicContact CB-CZ 3.75Å; I769-F785 HydrophobicContact CD1-CE2 4.2Å; I769-F785 HydrophobicContact CD1-CZ 3.99Å; I769-F785 HydrophobicContact CG1-CZ 4.49Å; I769-F785 HydrophobicContact CG2-CD1 4.04Å; I769-F785 HydrophobicContact CG2-CD2 4.09Å; I769-F785 HydrophobicContact CG2-CE1 3.64Å; I769-F785 HydrophobicContact CG2-CE2 3.69Å; I769-F785 HydrophobicContact CG2-CG 4.26Å; I769-F785 HydrophobicContact CG2-CZ 3.46Å; I769-F785 VanDerWaalsContact CG2-CZ 3.46Å
770	Y	75.5	Confident	69.4	Low	0 Å²	0	54 Å²	54	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.7	-45.6	171.8	-78	-55.4	0	0	0	111.9	K766 S767 L772 L773 E774 L782 F785 M786 D791	K766-Y770 HydrophobicContact CD-CE2 4.02Å; K766-Y770 VanDerWaalsContact CE-CE2 3.44Å; K766-Y770 HydrophobicContact CG-CD2 3.75Å; K766-Y770 HydrophobicContact CG-CE2 3.34Å; K766-Y770 WeakPolarHBondContact O-CD2 3.46Å; K766-Y770 PolarHBondContact O-N 3.36Å; S767-Y770 PolarHBondContact O-N 3.47Å; Y770-L772 VanDerWaalsContact C-N 3.3Å; Y770-L772 PolarHBondContact O-N 3.13Å; Y770-L773 PolarHBondContact O-N 3.25Å; Y770-E774 WeakPolarHBondContact O-CB 3.48Å; Y770-E774 WeakPolarHBondContact O-CG 3.33Å; Y770-E774 PolarHBondContact O-N 2.79Å; Y770-L782 HydrophobicContact CD1-CD1 3.75Å; Y770-L782 HydrophobicContact CE1-CD1 4.24Å; Y770-F785 AromaticContact CD1-CD1 3.9Å; Y770-F785 HydrophobicContact CD1-CD1 3.9Å; Y770-F785 HydrophobicContact CD1-CE1 4.1Å; Y770-F785 HydrophobicContact CD2-CE1 4.35Å; Y770-F785 AromaticContact CE1-CD1 3.49Å; Y770-F785 HydrophobicContact CE1-CD1 3.49Å; Y770-F785 VanDerWaalsContact CE1-CD1 3.49Å; Y770-F785 AromaticContact CE1-CE1 3.82Å; Y770-F785 HydrophobicContact CE1-CE1 3.82Å; Y770-F785 HydrophobicContact CE2-CE1 4.15Å; Y770-F785 HydrophobicContact CG-CE1 4.33Å; Y770-F785 AromaticContact CZ-CD1 3.89Å; Y770-F785 AromaticContact CZ-CE1 3.84Å; Y770-M786 HydrophobicContact CD1-CE 4.24Å; Y770-M786 HydrophobicContact CE1-CE 3.92Å; Y770-M786 HydrophobicContact CE1-CG 3.56Å; Y770-D791 WeakPolarHBondContact OH-CB 3.36Å
771	D	73.3	Confident	69.7	Low	88 Å²	88	48.4 Å²	48.4	47%	0.471	27%	0.271	S	S	.	.	H	α-helix	trans	-62.3	-39.9	178.4	-65.5	-16.2	0	0	0	111	S767 L768 I769 N775	S767-D771 VanDerWaalsContact O-CG 3.26Å; S767-D771 PolarHBondContact O-N 2.84Å; L768-D771 PolarHBondContact O-N 3.31Å; I769-D771 VanDerWaalsContact C-N 3.35Å; D771-N775 VanDerWaalsContact O-CB 3.28Å; D771-N775 WeakPolarHBondContact O-CB 3.31Å; D771-N775 PolarHBondContact O-N 3.25Å; D771-N775 PolarHBondContact O-ND2 2.78Å
772	L	72.2	Confident	70.5	Confident	27 Å²	27	46.8 Å²	46.8	14%	0.141	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-49	174.3	-73.9	171.1	0	0	0	111.7	E686 L689 L768 I769 Y770 N775 H776	E686-L772 HydrophobicContact CG-CD1 3.87Å; E686-L772 HydrophobicContact CG-CD2 4.23Å; L689-L772 HydrophobicContact CD1-CB 4.43Å; L768-L772 HydrophobicContact CD2-CD1 3.85Å; L768-L772 VanDerWaalsContact O-CG 3.31Å; L768-L772 WeakPolarHBondContact O-CG 3.25Å; L768-L772 PolarHBondContact O-N 3.45Å; I769-L772 PolarHBondContact O-N 3.46Å; Y770-L772 VanDerWaalsContact C-N 3.3Å; Y770-L772 PolarHBondContact O-N 3.13Å; L772-N775 PolarHBondContact O-N 3.13Å; L772-H776 PolarHBondContact O-CD2 2.96Å; L772-H776 PolarHBondContact O-N 2.9Å
773	L	74.3	Confident	71.2	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-64.7	-41.8	-179.7	-71.8	168.6	0	0	0	112.4	L689 F749 I769 Y770 N775 H776 G777 E781 L782 F785	L689-L773 HydrophobicContact CD1-CD2 4.03Å; L689-L773 HydrophobicContact CD2-CD2 3.59Å; L689-L773 HydrophobicContact CG-CD2 4.46Å; F749-L773 HydrophobicContact CZ-CD2 4.12Å; I769-L773 HydrophobicContact CG2-CD1 3.81Å; I769-L773 HydrophobicContact CG2-CG 4.28Å; I769-L773 WeakPolarHBondContact O-CB 3.48Å; I769-L773 VanDerWaalsContact O-CG 3.3Å; I769-L773 WeakPolarHBondContact O-CG 3.18Å; I769-L773 PolarHBondContact O-N 2.96Å; Y770-L773 PolarHBondContact O-N 3.25Å; L773-N775 VanDerWaalsContact C-N 3.32Å; L773-N775 PolarHBondContact O-N 2.72Å; L773-H776 PolarHBondContact O-N 2.95Å; L773-G777 PolarHBondContact O-N 2.93Å; L773-E781 HydrophobicContact CD2-CB 4.28Å; L773-L782 HydrophobicContact CB-CB 4.46Å; L773-L782 HydrophobicContact CB-CD1 3.75Å; L773-L782 HydrophobicContact CD1-CD1 4.19Å; L773-F785 HydrophobicContact CD1-CB 3.63Å; L773-F785 HydrophobicContact CD1-CD1 3.75Å; L773-F785 HydrophobicContact CD1-CG 3.73Å
774	E	74.5	Confident	71.9	Confident	100 Å²	100	46.2 Å²	46.2	47%	0.467	25%	0.254	S	S	.	.	H	α-helix	trans	-63.5	-37.9	175.2	-74.5	-172.5	179.7	0	0	111.6	Y770 L782	Y770-E774 WeakPolarHBondContact O-CB 3.48Å; Y770-E774 WeakPolarHBondContact O-CG 3.33Å; Y770-E774 PolarHBondContact O-N 2.79Å; E774-L782 HydrophobicContact CG-CD1 4.46Å; E774-L782 HydrophobicContact CG-CD2 4.33Å
775	N	71.9	Confident	72.6	Confident	110 Å²	110	41.6 Å²	41.6	59%	0.588	23%	0.233	S	C	*	.	H	α-helix	trans	-67.7	-32.3	175.8	-77.2	-46.2	0	0	0	113.3	D771 L772 L773	D771-N775 VanDerWaalsContact O-CB 3.28Å; D771-N775 WeakPolarHBondContact O-CB 3.31Å; D771-N775 PolarHBondContact O-N 3.25Å; D771-N775 PolarHBondContact O-ND2 2.78Å; L772-N775 PolarHBondContact O-N 3.13Å; L773-N775 VanDerWaalsContact C-N 3.32Å; L773-N775 PolarHBondContact O-N 2.72Å
776	H	65.6	Low	73.4	Confident	45 Å²	45	40.7 Å²	40.7	21%	0.208	23%	0.225	C	C	.	.	H	α-helix	trans	-81.5	-17.9	-179.2	-83.1	-78	0	0	0	113.6	N693 L772 L773 E778	N693-H776 PolarHBondContact ND2-ND1 3.23Å; N693-H776 PolarHBondContact ND2-O 3.41Å; L772-H776 PolarHBondContact O-CD2 2.96Å; L772-H776 PolarHBondContact O-N 2.9Å; L773-H776 PolarHBondContact O-N 2.95Å; H776-E778 VanDerWaalsContact C-N 3.31Å; H776-E778 PolarHBondContact O-N 3.32Å
777	G	63.9	Low	73.8	Confident	54 Å²	54	42.4 Å²	42.4	56%	0.557	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.2	13.8	175.5	0	0	0	0	0	115.1	L773 N779	L773-G777 PolarHBondContact O-N 2.93Å; G777-N779 PolarHBondContact O-N 3.29Å
778	E	64.8	Low	74.1	Confident	11 Å²	11	41.4 Å²	41.4	5%	0.051	22%	0.223	C	C	.	.			trans	-88.8	86	179.7	-72.1	-77.3	162.5	0	0	110.4	N693 N696 H776 D780 E781 L782	N693-E778 VanDerWaalsContact OD1-CG 3.27Å; N693-E778 WeakPolarHBondContact OD1-CG 3.32Å; N696-E778 PolarHBondContact ND2-OE1 3.2Å; N696-E778 PolarHBondContact ND2-OE2 3.38Å; H776-E778 VanDerWaalsContact C-N 3.31Å; H776-E778 PolarHBondContact O-N 3.32Å; E778-D780 VanDerWaalsContact C-N 3.27Å; E778-D780 PolarHBondContact O-N 3.33Å; E778-E781 HydrophobicContact CB-CB 4.45Å; E778-E781 PolarHBondContact O-N 3.26Å; E778-L782 PolarHBondContact O-N 3.05Å; E778-L782 VanDerWaalsContact O-N 3.11Å
779	N	69.9	Low	74.3	Confident	74 Å²	74	40.8 Å²	40.8	40%	0.396	22%	0.219	S	C	.	.	H	α-helix	trans	-58.2	-36.2	-179.1	-68.4	-35.7	0	0	0	113.1	G777 L782 V783 Q802	G777-N779 PolarHBondContact O-N 3.29Å; N779-L782 PolarHBondContact O-N 3.02Å; N779-V783 VanDerWaalsContact O-CG2 3.3Å; N779-V783 WeakPolarHBondContact O-CG2 3.4Å; N779-V783 PolarHBondContact O-N 2.94Å; N779-Q802 VanDerWaalsContact CG-NE2 3.25Å; N779-Q802 PolarHBondContact ND2-NE2 3.13Å; N779-Q802 PolarHBondContact OD1-NE2 2.98Å
780	D	75.1	Confident	74.4	Confident	92 Å²	92	47.7 Å²	47.7	49%	0.492	25%	0.249	S	C	.	.	H	α-helix	trans	-63.7	-43.9	-178.5	-66.1	-14.3	0	0	0	112.1	R746 E778 Y784	R746-D780 IonicContact CZ-OD2 3.82Å; R746-D780 IonicContact NH1-OD2 2.8Å; R746-D780 IonicContact NH2-OD2 3.95Å; R746-D780 PolarHBondContact NH2-OD2 3.05Å; R746-D780 VanDerWaalsContact NH2-OD2 3.09Å; E778-D780 VanDerWaalsContact C-N 3.27Å; E778-D780 PolarHBondContact O-N 3.33Å; D780-Y784 PolarHBondContact O-N 2.87Å
781	E	74.8	Confident	74.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-78.7	-28.1	-179	-58.4	-54.4	155.3	0	0	111.4	L692 R746 F749 R750 L773 E778 Y784 F785	L692-E781 HydrophobicContact CD1-CG 4.35Å; R746-E781 VanDerWaalsContact CD-OE1 3.24Å; R746-E781 WeakPolarHBondContact CD-OE1 3.47Å; R746-E781 WeakPolarHBondContact CG-OE1 3.46Å; R746-E781 IonicContact NE-OE1 3.7Å; R746-E781 PolarHBondContact NE-OE1 3.49Å; F749-E781 HydrophobicContact CD1-CG 4.45Å; F749-E781 HydrophobicContact CE1-CB 3.97Å; F749-E781 HydrophobicContact CE1-CG 4.3Å; R750-E781 IonicContact NE-OE1 3.89Å; R750-E781 IonicContact NE-OE2 2.66Å; R750-E781 PolarHBondContact NE-OE2 3.42Å; R750-E781 IonicContact NH2-OE1 3.56Å; R750-E781 IonicContact NH2-OE2 2.87Å; L773-E781 HydrophobicContact CD2-CB 4.28Å; E778-E781 HydrophobicContact CB-CB 4.45Å; E778-E781 PolarHBondContact O-N 3.26Å; E781-Y784 PolarHBondContact O-N 2.93Å; E781-F785 WeakPolarHBondContact O-CB 3.39Å; E781-F785 PolarHBondContact O-N 2.82Å
782	L	79.4	Confident	74.8	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-47.1	168.9	-176.5	67.6	0	0	0	111.4	Y770 L773 E774 E778 N779 F785 M786	Y770-L782 HydrophobicContact CD1-CD1 3.75Å; Y770-L782 HydrophobicContact CE1-CD1 4.24Å; L773-L782 HydrophobicContact CB-CB 4.46Å; L773-L782 HydrophobicContact CB-CD1 3.75Å; L773-L782 HydrophobicContact CD1-CD1 4.19Å; E774-L782 HydrophobicContact CG-CD1 4.46Å; E774-L782 HydrophobicContact CG-CD2 4.33Å; E778-L782 PolarHBondContact O-N 3.05Å; E778-L782 VanDerWaalsContact O-N 3.11Å; N779-L782 PolarHBondContact O-N 3.02Å; L782-F785 PolarHBondContact O-N 3.36Å; L782-M786 HydrophobicContact CD1-CE 3.76Å; L782-M786 HydrophobicContact CD2-CE 3.96Å; L782-M786 HydrophobicContact CG-CE 3.66Å; L782-M786 HydrophobicContact CG-SD 4.39Å; L782-M786 VanDerWaalsContact O-CG 3.27Å; L782-M786 WeakPolarHBondContact O-CG 3.47Å; L782-M786 PolarHBondContact O-N 3.4Å
783	V	81	Confident	75.1	Confident	22 Å²	22	45.7 Å²	45.7	13%	0.133	24%	0.239	C	C	.	.	H	α-helix	trans	-60.2	-47.4	174.7	168.1	0	0	0	0	110.4	N779 F785 M786 E787 L795 Y799	N779-V783 VanDerWaalsContact O-CG2 3.3Å; N779-V783 WeakPolarHBondContact O-CG2 3.4Å; N779-V783 PolarHBondContact O-N 2.94Å; V783-F785 VanDerWaalsContact C-N 3.34Å; V783-F785 PolarHBondContact O-N 2.9Å; V783-M786 PolarHBondContact O-N 3.26Å; V783-E787 HydrophobicContact CG1-CG 4.4Å; V783-E787 WeakPolarHBondContact O-CG 3.42Å; V783-E787 PolarHBondContact O-N 3.38Å; V783-L795 HydrophobicContact CB-CD1 4.33Å; V783-L795 HydrophobicContact CG1-CD1 4.05Å; V783-L795 HydrophobicContact CG2-CD1 4.01Å; V783-Y799 WeakPolarHBondContact CG1-OH 3.49Å; V783-Y799 HydrophobicContact CG2-CE1 4.06Å
784	Y	80.4	Confident	75.3	Confident	50 Å²	50	50.4 Å²	50.4	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-58.2	-43.6	176.7	178.1	-96.6	0	0	0	112.6	R750 L753 D780 E781 E787 L788	R750-Y784 HydrophobicContact CB-CE1 3.83Å; R750-Y784 HydrophobicContact CB-CE2 4.44Å; R750-Y784 HydrophobicContact CG-CD1 3.84Å; R750-Y784 HydrophobicContact CG-CD2 4.36Å; R750-Y784 HydrophobicContact CG-CE1 3.49Å; R750-Y784 VanDerWaalsContact CG-CE1 3.49Å; R750-Y784 HydrophobicContact CG-CE2 4.02Å; R750-Y784 HydrophobicContact CG-CG 4.27Å; R750-Y784 PolarHBondContact O-OH 2.86Å; L753-Y784 HydrophobicContact CD1-CD1 4.25Å; L753-Y784 HydrophobicContact CD1-CE1 4.14Å; D780-Y784 PolarHBondContact O-N 2.87Å; E781-Y784 PolarHBondContact O-N 2.93Å; Y784-E787 PolarHBondContact O-N 2.85Å; Y784-L788 HydrophobicContact CE1-CD2 4.39Å; Y784-L788 WeakPolarHBondContact O-CB 3.46Å; Y784-L788 PolarHBondContact O-N 3.18Å
785	F	78.3	Confident	75.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.9	-38.8	177.6	-175.4	-108.2	0	0	0	112.2	L753 L762 I769 Y770 L773 E781 L782 V783 L788 M789	L753-F785 HydrophobicContact CD1-CD2 4.09Å; L753-F785 HydrophobicContact CD2-CD2 4.04Å; L753-F785 HydrophobicContact CD2-CE2 4.06Å; L762-F785 HydrophobicContact CD1-CE2 4.06Å; L762-F785 HydrophobicContact CD2-CE2 3.92Å; L762-F785 HydrophobicContact CD2-CZ 4.27Å; I769-F785 HydrophobicContact CB-CE1 3.98Å; I769-F785 HydrophobicContact CB-CE2 4.38Å; I769-F785 HydrophobicContact CB-CZ 3.75Å; I769-F785 HydrophobicContact CD1-CE2 4.2Å; I769-F785 HydrophobicContact CD1-CZ 3.99Å; I769-F785 HydrophobicContact CG1-CZ 4.49Å; I769-F785 HydrophobicContact CG2-CD1 4.04Å; I769-F785 HydrophobicContact CG2-CD2 4.09Å; I769-F785 HydrophobicContact CG2-CE1 3.64Å; I769-F785 HydrophobicContact CG2-CE2 3.69Å; I769-F785 HydrophobicContact CG2-CG 4.26Å; I769-F785 HydrophobicContact CG2-CZ 3.46Å; I769-F785 VanDerWaalsContact CG2-CZ 3.46Å; Y770-F785 AromaticContact CD1-CD1 3.9Å; Y770-F785 HydrophobicContact CD1-CD1 3.9Å; Y770-F785 HydrophobicContact CD1-CE1 4.1Å; Y770-F785 HydrophobicContact CD2-CE1 4.35Å; Y770-F785 AromaticContact CE1-CD1 3.49Å; Y770-F785 HydrophobicContact CE1-CD1 3.49Å; Y770-F785 VanDerWaalsContact CE1-CD1 3.49Å; Y770-F785 AromaticContact CE1-CE1 3.82Å; Y770-F785 HydrophobicContact CE1-CE1 3.82Å; Y770-F785 HydrophobicContact CE2-CE1 4.15Å; Y770-F785 HydrophobicContact CG-CE1 4.33Å; Y770-F785 AromaticContact CZ-CD1 3.89Å; Y770-F785 AromaticContact CZ-CE1 3.84Å; L773-F785 HydrophobicContact CD1-CB 3.63Å; L773-F785 HydrophobicContact CD1-CD1 3.75Å; L773-F785 HydrophobicContact CD1-CG 3.73Å; E781-F785 WeakPolarHBondContact O-CB 3.39Å; E781-F785 PolarHBondContact O-N 2.82Å; L782-F785 PolarHBondContact O-N 3.36Å; V783-F785 VanDerWaalsContact C-N 3.34Å; V783-F785 PolarHBondContact O-N 2.9Å; F785-L788 PolarHBondContact O-N 3.11Å; F785-M789 HydrophobicContact CD1-CG 4.39Å; F785-M789 HydrophobicContact CD2-CG 4.37Å; F785-M789 HydrophobicContact CE1-CG 3.98Å; F785-M789 HydrophobicContact CE2-CG 3.96Å; F785-M789 HydrophobicContact CE2-SD 4.37Å; F785-M789 HydrophobicContact CZ-CG 3.74Å; F785-M789 HydrophobicContact CZ-SD 4.3Å; F785-M789 WeakPolarHBondContact O-CB 3.26Å; F785-M789 WeakPolarHBondContact O-CG 3.17Å; F785-M789 PolarHBondContact O-N 3.36Å
786	M	81.1	Confident	76.1	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.015	21%	0.206	C	C	.	.	H	α-helix	trans	-63.2	-42.8	173.6	-70.9	177.3	-179.6	0	0	112.3	Y770 L782 V783 K790 D791 R794 L795 H798	Y770-M786 HydrophobicContact CD1-CE 4.24Å; Y770-M786 HydrophobicContact CE1-CE 3.92Å; Y770-M786 HydrophobicContact CE1-CG 3.56Å; L782-M786 HydrophobicContact CD1-CE 3.76Å; L782-M786 HydrophobicContact CD2-CE 3.96Å; L782-M786 HydrophobicContact CG-CE 3.66Å; L782-M786 HydrophobicContact CG-SD 4.39Å; L782-M786 VanDerWaalsContact O-CG 3.27Å; L782-M786 WeakPolarHBondContact O-CG 3.47Å; L782-M786 PolarHBondContact O-N 3.4Å; V783-M786 PolarHBondContact O-N 3.26Å; M786-K790 PolarHBondContact O-N 3.07Å; M786-D791 PolarHBondContact O-N 3.08Å; M786-R794 HydrophobicContact CE-CB 4.22Å; M786-R794 HydrophobicContact SD-CB 4.36Å; M786-L795 HydrophobicContact CB-CB 4.1Å; M786-L795 HydrophobicContact CB-CD1 4.2Å; M786-L795 HydrophobicContact CB-CD2 4.37Å; M786-L795 HydrophobicContact CB-CG 4.46Å; M786-L795 HydrophobicContact SD-CB 4.07Å; M786-L795 HydrophobicContact SD-CD1 3.94Å; M786-H798 HydrophobicContact CE-CB 4.46Å; M786-H798 HydrophobicContact SD-CB 4.33Å
787	E	80.3	Confident	76.9	Confident	93 Å²	93	39.8 Å²	39.8	44%	0.435	20%	0.204	S	C	.	.	H	α-helix	trans	-63	-43.2	175	-73	179.1	172.6	0	0	111.6	V783 Y784 K790 L795	V783-E787 HydrophobicContact CG1-CG 4.4Å; V783-E787 WeakPolarHBondContact O-CG 3.42Å; V783-E787 PolarHBondContact O-N 3.38Å; Y784-E787 PolarHBondContact O-N 2.85Å; E787-K790 PolarHBondContact O-N 3.41Å; E787-K790 VanDerWaalsContact O-N 3.16Å; E787-L795 HydrophobicContact CG-CD2 3.74Å
788	L	77.6	Confident	77.7	Confident	46 Å²	46	37.8 Å²	37.8	24%	0.241	18%	0.181	C	C	.	.	H	α-helix	trans	-64.4	-45	179.2	-172.4	70.7	0	0	0	112.4	L753 L759 L762 Y784 F785 K790	L753-L788 HydrophobicContact CB-CD2 3.68Å; L759-L788 HydrophobicContact CD2-CD1 4.01Å; L759-L788 HydrophobicContact CD2-CD2 3.91Å; L759-L788 HydrophobicContact CD2-CG 3.8Å; L762-L788 HydrophobicContact CD1-CD2 4.43Å; Y784-L788 HydrophobicContact CE1-CD2 4.39Å; Y784-L788 WeakPolarHBondContact O-CB 3.46Å; Y784-L788 PolarHBondContact O-N 3.18Å; F785-L788 PolarHBondContact O-N 3.11Å; L788-K790 PolarHBondContact O-N 3.3Å
789	M	74.5	Confident	78.6	Confident	33 Å²	33	38.7 Å²	38.7	16%	0.163	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-5.6	177	-69.4	-54.9	-68.3	0	0	113.3	L762 P763 K766 F785 D791	L762-M789 HydrophobicContact CB-CE 3.77Å; L762-M789 HydrophobicContact CB-SD 3.45Å; L762-M789 WeakPolarHBondContact CB-SD 3.42Å; L762-M789 HydrophobicContact CD1-SD 3.85Å; L762-M789 HydrophobicContact CG-SD 4.25Å; P763-M789 HydrophobicContact CB-CE 4.43Å; P763-M789 HydrophobicContact CG-CE 4.13Å; K766-M789 HydrophobicContact CD-CE 4.32Å; F785-M789 HydrophobicContact CD1-CG 4.39Å; F785-M789 HydrophobicContact CD2-CG 4.37Å; F785-M789 HydrophobicContact CE1-CG 3.98Å; F785-M789 HydrophobicContact CE2-CG 3.96Å; F785-M789 HydrophobicContact CE2-SD 4.37Å; F785-M789 HydrophobicContact CZ-CG 3.74Å; F785-M789 HydrophobicContact CZ-SD 4.3Å; F785-M789 WeakPolarHBondContact O-CB 3.26Å; F785-M789 WeakPolarHBondContact O-CG 3.17Å; F785-M789 PolarHBondContact O-N 3.36Å; M789-D791 HydrophobicContact CB-CB 4.43Å; M789-D791 PolarHBondContact O-N 3.25Å; M789-D791 VanDerWaalsContact O-N 3.15Å
790	K	74.6	Confident	79.3	Confident	149 Å²	149	36.3 Å²	36.3	65%	0.648	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	29	-172.3	-56.5	-178.9	-179.7	177.4	0	112	M786 E787 L788 Y792	M786-K790 PolarHBondContact O-N 3.07Å; E787-K790 PolarHBondContact O-N 3.41Å; E787-K790 VanDerWaalsContact O-N 3.16Å; L788-K790 PolarHBondContact O-N 3.3Å; K790-Y792 HydrophobicContact CB-CD2 4.36Å; K790-Y792 HydrophobicContact CB-CE2 3.68Å; K790-Y792 HydrophobicContact CG-CE2 4.27Å; K790-Y792 VanDerWaalsContact O-CD2 3.27Å; K790-Y792 WeakPolarHBondContact O-CD2 3.34Å; K790-Y792 PolarHBondContact O-N 3.41Å
791	D	76.7	Confident	79.6	Confident	16 Å²	16	39.5 Å²	39.5	9%	0.086	18%	0.176	C	C	.	.			trans	-86.1	61.8	175.1	-166	-5.1	0	0	0	110	K766 Y770 M786 M789 P793 R794 L795	K766-D791 WeakPolarHBondContact CE-OD2 3.43Å; K766-D791 VanDerWaalsContact NZ-CG 3.27Å; K766-D791 IonicContact NZ-OD2 3.46Å; K766-D791 PolarHBondContact NZ-OD2 3.21Å; Y770-D791 WeakPolarHBondContact OH-CB 3.36Å; M786-D791 PolarHBondContact O-N 3.08Å; M789-D791 HydrophobicContact CB-CB 4.43Å; M789-D791 PolarHBondContact O-N 3.25Å; M789-D791 VanDerWaalsContact O-N 3.15Å; D791-P793 VanDerWaalsContact C-N 3.29Å; D791-P793 WeakPolarHBondContact OD1-CD 3.48Å; D791-R794 PolarHBondContact O-N 3.45Å; D791-R794 PolarHBondContact OD1-N 3.43Å; D791-R794 VanDerWaalsContact OD2-CD 3.25Å; D791-R794 WeakPolarHBondContact OD2-CD 3.49Å; D791-R794 WeakPolarHBondContact OD2-CG 3.36Å; D791-R794 IonicContact OD2-NE 3.22Å; D791-L795 PolarHBondContact O-N 3.11Å
792	Y	79.4	Confident	79.9	Confident	21 Å²	21	43.2 Å²	43.2	8%	0.082	19%	0.193	C	C	.	.	H	α-helix	trans	-57.5	-34	177.1	-53.5	-64.3	0	0	0	113.2	K790 R794 L795 V796 I811 Y815 C818	K790-Y792 HydrophobicContact CB-CD2 4.36Å; K790-Y792 HydrophobicContact CB-CE2 3.68Å; K790-Y792 HydrophobicContact CG-CE2 4.27Å; K790-Y792 VanDerWaalsContact O-CD2 3.27Å; K790-Y792 WeakPolarHBondContact O-CD2 3.34Å; K790-Y792 PolarHBondContact O-N 3.41Å; Y792-R794 PolarHBondContact O-N 3.07Å; Y792-L795 WeakPolarHBondContact O-CB 3.37Å; Y792-L795 PolarHBondContact O-N 2.92Å; Y792-V796 WeakPolarHBondContact O-CG2 3.43Å; Y792-V796 PolarHBondContact O-N 3.3Å; Y792-I811 HydrophobicContact CD1-CG2 4.31Å; Y792-Y815 HydrophobicContact CD1-CD1 4.5Å; Y792-Y815 AromaticContact CD1-CD2 3.54Å; Y792-Y815 HydrophobicContact CD1-CD2 3.54Å; Y792-Y815 AromaticContact CD1-CE2 3.74Å; Y792-Y815 HydrophobicContact CD1-CE2 3.74Å; Y792-Y815 AromaticContact CD1-CG 3.93Å; Y792-Y815 HydrophobicContact CD1-CG 3.93Å; Y792-Y815 HydrophobicContact CD2-CD1 4.06Å; Y792-Y815 HydrophobicContact CD2-CD2 4.27Å; Y792-Y815 AromaticContact CD2-CG 3.79Å; Y792-Y815 HydrophobicContact CD2-CG 3.79Å; Y792-Y815 AromaticContact CE1-CD1 3.98Å; Y792-Y815 HydrophobicContact CE1-CD1 3.98Å; Y792-Y815 AromaticContact CE1-CD2 3.51Å; Y792-Y815 HydrophobicContact CE1-CD2 3.51Å; Y792-Y815 AromaticContact CE1-CE1 3.79Å; Y792-Y815 HydrophobicContact CE1-CE1 3.79Å; Y792-Y815 AromaticContact CE1-CE2 3.28Å; Y792-Y815 HydrophobicContact CE1-CE2 3.28Å; Y792-Y815 AromaticContact CE1-CG 3.83Å; Y792-Y815 HydrophobicContact CE1-CG 3.83Å; Y792-Y815 AromaticContact CE1-CZ 3.41Å; Y792-Y815 VanDerWaalsContact CE1-CZ 3.41Å; Y792-Y815 AromaticContact CE2-CD1 3.45Å; Y792-Y815 HydrophobicContact CE2-CD1 3.45Å; Y792-Y815 VanDerWaalsContact CE2-CD1 3.45Å; Y792-Y815 HydrophobicContact CE2-CD2 4.23Å; Y792-Y815 AromaticContact CE2-CE1 3.82Å; Y792-Y815 HydrophobicContact CE2-CE1 3.82Å; Y792-Y815 AromaticContact CE2-CG 3.67Å; Y792-Y815 HydrophobicContact CE2-CG 3.67Å; Y792-Y815 AromaticContact CG-CD2 3.95Å; Y792-Y815 HydrophobicContact CG-CD2 3.95Å; Y792-Y815 AromaticContact CG-CG 3.92Å; Y792-Y815 HydrophobicContact CG-CG 3.92Å; Y792-Y815 AromaticContact CZ-CD1 3.41Å; Y792-Y815 VanDerWaalsContact CZ-CD1 3.41Å; Y792-Y815 AromaticContact CZ-CD2 3.87Å; Y792-Y815 AromaticContact CZ-CE1 3.27Å; Y792-Y815 AromaticContact CZ-CE2 3.73Å; Y792-Y815 AromaticContact CZ-CG 3.69Å; Y792-Y815 AromaticContact CZ-CZ 3.42Å; Y792-Y815 VanDerWaalsContact CZ-CZ 3.42Å; Y792-Y815 WeakPolarHBondContact OH-CE1 3.43Å; Y792-Y815 VanDerWaalsContact OH-CZ 3.28Å; Y792-C818 WeakPolarHBondContact CB-SG 3.47Å
793	P	79.3	Confident	80	Confident	36 Å²	36	46.9 Å²	46.9	23%	0.234	22%	0.218	C	C	.	.	H	α-helix	trans	-54.9	-49.6	173.2	-29.2	36.9	0	0	0	114	D791 L795 V796 D797 R821	D791-P793 VanDerWaalsContact C-N 3.29Å; D791-P793 WeakPolarHBondContact OD1-CD 3.48Å; P793-L795 VanDerWaalsContact C-N 3.3Å; P793-L795 PolarHBondContact O-N 3.15Å; P793-V796 PolarHBondContact O-N 3.48Å; P793-D797 PolarHBondContact O-N 3.26Å; P793-D797 VanDerWaalsContact O-N 3.14Å; P793-R821 HydrophobicContact CB-CG 4.03Å
794	R	77.4	Confident	80.1	Confident	99 Å²	99	49 Å²	49	37%	0.374	23%	0.227	S	C	.	.	H	α-helix	trans	-66.2	-34.3	177.2	-76.5	-169	179.3	-155.2	-3.1	112.5	M786 D791 Y792 D797 H798	M786-R794 HydrophobicContact CE-CB 4.22Å; M786-R794 HydrophobicContact SD-CB 4.36Å; D791-R794 PolarHBondContact O-N 3.45Å; D791-R794 PolarHBondContact OD1-N 3.43Å; D791-R794 VanDerWaalsContact OD2-CD 3.25Å; D791-R794 WeakPolarHBondContact OD2-CD 3.49Å; D791-R794 WeakPolarHBondContact OD2-CG 3.36Å; D791-R794 IonicContact OD2-NE 3.22Å; Y792-R794 PolarHBondContact O-N 3.07Å; R794-D797 PolarHBondContact O-N 3.37Å; R794-H798 WeakPolarHBondContact O-CB 3.47Å; R794-H798 PolarHBondContact O-N 3.14Å
795	L	82	Confident	80.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-41.2	178.3	-173.1	52.4	0	0	0	112	V783 M786 E787 D791 Y792 P793 H798 Y799 I811	V783-L795 HydrophobicContact CB-CD1 4.33Å; V783-L795 HydrophobicContact CG1-CD1 4.05Å; V783-L795 HydrophobicContact CG2-CD1 4.01Å; M786-L795 HydrophobicContact CB-CB 4.1Å; M786-L795 HydrophobicContact CB-CD1 4.2Å; M786-L795 HydrophobicContact CB-CD2 4.37Å; M786-L795 HydrophobicContact CB-CG 4.46Å; M786-L795 HydrophobicContact SD-CB 4.07Å; M786-L795 HydrophobicContact SD-CD1 3.94Å; E787-L795 HydrophobicContact CG-CD2 3.74Å; D791-L795 PolarHBondContact O-N 3.11Å; Y792-L795 WeakPolarHBondContact O-CB 3.37Å; Y792-L795 PolarHBondContact O-N 2.92Å; P793-L795 VanDerWaalsContact C-N 3.3Å; P793-L795 PolarHBondContact O-N 3.15Å; L795-H798 PolarHBondContact O-N 2.87Å; L795-Y799 HydrophobicContact CD1-CD2 4.45Å; L795-Y799 HydrophobicContact CD1-CE1 4.21Å; L795-Y799 HydrophobicContact CD1-CE2 4.06Å; L795-Y799 HydrophobicContact CG-CD2 4.41Å; L795-Y799 HydrophobicContact CG-CE2 4.12Å; L795-Y799 PolarHBondContact O-N 2.84Å; L795-I811 HydrophobicContact CB-CD1 4.42Å; L795-I811 HydrophobicContact CD1-CD1 4.48Å; L795-I811 HydrophobicContact CD2-CD1 3.29Å; L795-I811 HydrophobicContact CG-CD1 3.45Å; L795-I811 VanDerWaalsContact CG-CD1 3.45Å
796	V	81.2	Confident	80.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-46.4	172.7	172.3	0	0	0	0	110.5	Y792 P793 H798 Y799 I800 I811 L812	Y792-V796 WeakPolarHBondContact O-CG2 3.43Å; Y792-V796 PolarHBondContact O-N 3.3Å; P793-V796 PolarHBondContact O-N 3.48Å; V796-H798 PolarHBondContact O-N 2.91Å; V796-Y799 PolarHBondContact O-N 3.47Å; V796-I800 HydrophobicContact CG1-CD1 3.68Å; V796-I800 HydrophobicContact CG1-CG1 4.35Å; V796-I800 WeakPolarHBondContact O-CB 3.37Å; V796-I800 VanDerWaalsContact O-CG1 3.26Å; V796-I800 WeakPolarHBondContact O-CG1 3.46Å; V796-I800 PolarHBondContact O-N 3.49Å; V796-I811 HydrophobicContact CG2-CB 4.43Å; V796-I811 HydrophobicContact CG2-CG2 3.83Å; V796-L812 HydrophobicContact CG1-CD1 4.3Å; V796-L812 HydrophobicContact CG1-CD2 4.28Å; V796-L812 HydrophobicContact CG1-CG 4.36Å; V796-L812 HydrophobicContact CG2-CD2 3.91Å; V796-L812 HydrophobicContact CG2-CG 4.04Å
797	D	82.9	Confident	80.3	Confident	32 Å²	32	52.3 Å²	52.3	17%	0.171	25%	0.249	C	C	.	.	H	α-helix	trans	-60.9	-33.6	176.7	-69.2	-29.5	0	0	0	112.3	P793 R794 R801 R821 H825	P793-D797 PolarHBondContact O-N 3.26Å; P793-D797 VanDerWaalsContact O-N 3.14Å; R794-D797 PolarHBondContact O-N 3.37Å; D797-R801 WeakPolarHBondContact O-CB 3.5Å; D797-R801 WeakPolarHBondContact O-CG 3.41Å; D797-R801 PolarHBondContact O-N 2.91Å; D797-R801 PolarHBondContact O-NE 3.12Å; D797-R821 IonicContact OD1-NE 3.28Å; D797-R821 IonicContact OD2-NE 2.64Å; D797-R821 PolarHBondContact OD2-NE 3.26Å; D797-H825 IonicContact OD1-CD2 3.47Å; D797-H825 IonicContact OD1-CE1 2.71Å; D797-H825 IonicContact OD1-NE2 3.68Å; D797-H825 PolarHBondContact OD1-NE2 2.87Å
798	H	81.2	Confident	80.4	Confident	13 Å²	13	47.9 Å²	47.9	6%	0.06	23%	0.228	C	C	.	.	H	α-helix	trans	-72.3	-46.5	176.8	-172.5	81.5	0	0	0	112	M786 R794 L795 V796 I800 R801 Q802	M786-H798 HydrophobicContact CE-CB 4.46Å; M786-H798 HydrophobicContact SD-CB 4.33Å; R794-H798 WeakPolarHBondContact O-CB 3.47Å; R794-H798 PolarHBondContact O-N 3.14Å; L795-H798 PolarHBondContact O-N 2.87Å; V796-H798 PolarHBondContact O-N 2.91Å; H798-I800 VanDerWaalsContact C-N 3.35Å; H798-I800 PolarHBondContact O-N 3.21Å; H798-R801 WeakPolarHBondContact O-CB 3.38Å; H798-R801 PolarHBondContact O-N 2.75Å; H798-Q802 PolarHBondContact CE1-NE2 3.26Å; H798-Q802 PolarHBondContact NE2-NE2 2.89Å; H798-Q802 PolarHBondContact O-N 2.69Å
799	Y	83.7	Confident	80.6	Confident	29 Å²	29	45.9 Å²	45.9	11%	0.114	22%	0.218	C	C	.	.	H	α-helix	trans	-64.8	-35.8	175.9	-74.1	-24.7	0	0	0	113.2	V783 L795 V796 Q802 C803 M804 D807 I811	V783-Y799 WeakPolarHBondContact CG1-OH 3.49Å; V783-Y799 HydrophobicContact CG2-CE1 4.06Å; L795-Y799 HydrophobicContact CD1-CD2 4.45Å; L795-Y799 HydrophobicContact CD1-CE1 4.21Å; L795-Y799 HydrophobicContact CD1-CE2 4.06Å; L795-Y799 HydrophobicContact CG-CD2 4.41Å; L795-Y799 HydrophobicContact CG-CE2 4.12Å; L795-Y799 PolarHBondContact O-N 2.84Å; V796-Y799 PolarHBondContact O-N 3.47Å; Y799-Q802 PolarHBondContact O-N 2.73Å; Y799-C803 PolarHBondContact O-N 3.17Å; Y799-M804 HydrophobicContact CD1-CB 4.37Å; Y799-M804 HydrophobicContact CD1-SD 4.33Å; Y799-M804 HydrophobicContact CE1-CE 4.5Å; Y799-M804 PolarHBondContact O-N 3.34Å; Y799-D807 HydrophobicContact CD2-CB 3.99Å; Y799-D807 HydrophobicContact CE2-CB 3.88Å; Y799-D807 HydrophobicContact CG-CB 4.49Å; Y799-I811 HydrophobicContact CD2-CD1 3.73Å; Y799-I811 HydrophobicContact CE2-CD1 3.26Å; Y799-I811 HydrophobicContact CE2-CG1 4.16Å
800	I	83.6	Confident	80.9	Confident	24 Å²	24	50.2 Å²	50.2	12%	0.123	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-40.8	173.6	-68.7	172.7	0	0	0	110.7	V796 H798 C803 A808 H825	V796-I800 HydrophobicContact CG1-CD1 3.68Å; V796-I800 HydrophobicContact CG1-CG1 4.35Å; V796-I800 WeakPolarHBondContact O-CB 3.37Å; V796-I800 VanDerWaalsContact O-CG1 3.26Å; V796-I800 WeakPolarHBondContact O-CG1 3.46Å; V796-I800 PolarHBondContact O-N 3.49Å; H798-I800 VanDerWaalsContact C-N 3.35Å; H798-I800 PolarHBondContact O-N 3.21Å; I800-C803 PolarHBondContact O-N 3.11Å; I800-A808 HydrophobicContact CG1-CB 4.19Å; I800-H825 HydrophobicContact CD1-CB 3.69Å; I800-H825 VanDerWaalsContact CD1-CD2 3.41Å; I800-H825 WeakPolarHBondContact CD1-CD2 3.48Å
801	R	83.2	Confident	81.1	Confident	160 Å²	160	43.9 Å²	43.9	60%	0.604	21%	0.209	S	C	*	.	H	α-helix	trans	-64.6	-37.1	174.3	-83.2	179.7	-89.3	158	-12.1	113.2	D797 H798 C803	D797-R801 WeakPolarHBondContact O-CB 3.5Å; D797-R801 WeakPolarHBondContact O-CG 3.41Å; D797-R801 PolarHBondContact O-N 2.91Å; D797-R801 PolarHBondContact O-NE 3.12Å; H798-R801 WeakPolarHBondContact O-CB 3.38Å; H798-R801 PolarHBondContact O-N 2.75Å; R801-C803 PolarHBondContact O-N 3.21Å
802	Q	80.4	Confident	81.1	Confident	77 Å²	77	43.3 Å²	43.3	36%	0.36	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	4.3	175.5	-66	-150.2	14.3	0	0	114	N779 H798 Y799 M804	N779-Q802 VanDerWaalsContact CG-NE2 3.25Å; N779-Q802 PolarHBondContact ND2-NE2 3.13Å; N779-Q802 PolarHBondContact OD1-NE2 2.98Å; H798-Q802 PolarHBondContact CE1-NE2 3.26Å; H798-Q802 PolarHBondContact NE2-NE2 2.89Å; H798-Q802 PolarHBondContact O-N 2.69Å; Y799-Q802 PolarHBondContact O-N 2.73Å; Q802-M804 HydrophobicContact CB-CG 4.14Å; Q802-M804 HydrophobicContact CB-SD 4.28Å; Q802-M804 PolarHBondContact O-N 3.47Å
803	C	80.8	Confident	80.9	Confident	81 Å²	81	43.4 Å²	43.4	55%	0.547	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	19.5	-174.6	-60.1	0	0	0	0	114.7	Y799 I800 R801 Y805	Y799-C803 PolarHBondContact O-N 3.17Å; I800-C803 PolarHBondContact O-N 3.11Å; R801-C803 PolarHBondContact O-N 3.21Å; C803-Y805 HydrophobicContact CB-CE2 4.06Å; C803-Y805 WeakPolarHBondContact O-CD2 3.04Å; C803-Y805 PolarHBondContact O-N 3.33Å; C803-Y805 VanDerWaalsContact O-N 3.07Å
804	M	82.7	Confident	80.8	Confident	66 Å²	66	46 Å²	46	33%	0.325	23%	0.226	S	C	.	.			trans	-86.3	61.1	176.3	-64.7	179.8	65.1	0	0	110.4	Y799 Q802 S806 D807 A808	Y799-M804 HydrophobicContact CD1-CB 4.37Å; Y799-M804 HydrophobicContact CD1-SD 4.33Å; Y799-M804 HydrophobicContact CE1-CE 4.5Å; Y799-M804 PolarHBondContact O-N 3.34Å; Q802-M804 HydrophobicContact CB-CG 4.14Å; Q802-M804 HydrophobicContact CB-SD 4.28Å; Q802-M804 PolarHBondContact O-N 3.47Å; M804-S806 VanDerWaalsContact C-N 3.26Å; M804-S806 PolarHBondContact O-N 3.21Å; M804-D807 HydrophobicContact CE-CB 4.44Å; M804-D807 WeakPolarHBondContact CE-OD2 3.32Å; M804-D807 PolarHBondContact O-N 3.42Å; M804-A808 PolarHBondContact O-N 2.8Å; M804-A808 VanDerWaalsContact O-N 3.12Å
805	Y	83.1	Confident	80.6	Confident	45 Å²	45	45.4 Å²	45.4	18%	0.176	22%	0.224	C	C	.	.	H	α-helix	trans	-60.6	-33.6	-174.7	-54.5	-65.6	0	0	0	113.1	C803 L809 L829	C803-Y805 HydrophobicContact CB-CE2 4.06Å; C803-Y805 WeakPolarHBondContact O-CD2 3.04Å; C803-Y805 PolarHBondContact O-N 3.33Å; C803-Y805 VanDerWaalsContact O-N 3.07Å; Y805-L809 WeakPolarHBondContact O-CB 3.14Å; Y805-L809 VanDerWaalsContact O-CG 3.29Å; Y805-L809 WeakPolarHBondContact O-CG 3.48Å; Y805-L809 PolarHBondContact O-N 3.05Å; Y805-L829 HydrophobicContact CD1-CD2 4.14Å
806	S	81.5	Confident	79.7	Confident	39 Å²	39	47.1 Å²	47.1	27%	0.273	24%	0.236	S	C	.	.	H	α-helix	trans	-64.9	-40.1	178.4	48.3	0	0	0	0	112.5	M804 L809 K810	M804-S806 VanDerWaalsContact C-N 3.26Å; M804-S806 PolarHBondContact O-N 3.21Å; S806-L809 PolarHBondContact O-N 3.4Å; S806-K810 VanDerWaalsContact O-CG 3.31Å; S806-K810 WeakPolarHBondContact O-CG 3.36Å; S806-K810 PolarHBondContact O-N 3.38Å
807	D	81.1	Confident	79	Confident	40 Å²	40	54 Å²	54	21%	0.214	27%	0.272	C	S	.	.	H	α-helix	trans	-79.5	-32.8	-179.1	-59.1	-46.5	0	0	0	111.2	Y799 M804 K810 I811	Y799-D807 HydrophobicContact CD2-CB 3.99Å; Y799-D807 HydrophobicContact CE2-CB 3.88Å; Y799-D807 HydrophobicContact CG-CB 4.49Å; M804-D807 HydrophobicContact CE-CB 4.44Å; M804-D807 WeakPolarHBondContact CE-OD2 3.32Å; M804-D807 PolarHBondContact O-N 3.42Å; D807-K810 PolarHBondContact O-N 3.05Å; D807-K810 IonicContact OD1-NZ 3.95Å; D807-K810 PolarHBondContact OD1-NZ 2.66Å; D807-I811 WeakPolarHBondContact O-CG1 3.45Å; D807-I811 PolarHBondContact O-N 3.14Å
808	A	82.1	Confident	78.2	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58	-47	166.7	0	0	0	0	0	111.7	I800 M804 K810 I811 L812	I800-A808 HydrophobicContact CG1-CB 4.19Å; M804-A808 PolarHBondContact O-N 2.8Å; M804-A808 VanDerWaalsContact O-N 3.12Å; A808-K810 PolarHBondContact O-N 3.33Å; A808-I811 PolarHBondContact O-N 3.28Å; A808-L812 WeakPolarHBondContact O-CB 3.18Å; A808-L812 VanDerWaalsContact O-CG 3.26Å; A808-L812 WeakPolarHBondContact O-CG 3.34Å; A808-L812 PolarHBondContact O-N 3.47Å
809	L	80.8	Confident	77.6	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-36.1	177.3	-77.1	174.2	0	0	0	112.6	Y805 S806 A813 L829 E836 F837 V840	Y805-L809 WeakPolarHBondContact O-CB 3.14Å; Y805-L809 VanDerWaalsContact O-CG 3.29Å; Y805-L809 WeakPolarHBondContact O-CG 3.48Å; Y805-L809 PolarHBondContact O-N 3.05Å; S806-L809 PolarHBondContact O-N 3.4Å; L809-A813 WeakPolarHBondContact O-CB 3.28Å; L809-A813 PolarHBondContact O-N 3.02Å; L809-L829 HydrophobicContact CD2-CD1 4.22Å; L809-L829 HydrophobicContact CD2-CD2 4.49Å; L809-L829 HydrophobicContact CG-CD2 4.46Å; L809-E836 HydrophobicContact CD1-CB 3.55Å; L809-F837 HydrophobicContact CD2-CD2 4.32Å; L809-V840 HydrophobicContact CB-CG2 3.96Å; L809-V840 HydrophobicContact CD2-CB 4.27Å; L809-V840 HydrophobicContact CD2-CG2 4.05Å
810	K	81.3	Confident	77.1	Confident	124 Å²	124	57.5 Å²	57.5	54%	0.539	29%	0.293	S	S	.	.	H	α-helix	trans	-63.6	-44	172.8	-72.8	171.4	-163.9	162.3	0	112.3	S806 D807 A808 A813 T814	S806-K810 VanDerWaalsContact O-CG 3.31Å; S806-K810 WeakPolarHBondContact O-CG 3.36Å; S806-K810 PolarHBondContact O-N 3.38Å; D807-K810 PolarHBondContact O-N 3.05Å; D807-K810 IonicContact OD1-NZ 3.95Å; D807-K810 PolarHBondContact OD1-NZ 2.66Å; A808-K810 PolarHBondContact O-N 3.33Å; K810-A813 PolarHBondContact O-N 3.11Å; K810-T814 WeakPolarHBondContact O-CB 3.47Å; K810-T814 PolarHBondContact O-N 2.96Å; K810-T814 VanDerWaalsContact O-N 3.13Å; K810-T814 PolarHBondContact O-OG1 3.01Å
811	I	78.3	Confident	76.5	Confident	16 Å²	16	60.9 Å²	60.9	8%	0.082	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-46.6	176.8	-71	-173.6	0	0	0	110.7	Y792 L795 V796 Y799 D807 A808 A813 T814 Y815	Y792-I811 HydrophobicContact CD1-CG2 4.31Å; L795-I811 HydrophobicContact CB-CD1 4.42Å; L795-I811 HydrophobicContact CD1-CD1 4.48Å; L795-I811 HydrophobicContact CD2-CD1 3.29Å; L795-I811 HydrophobicContact CG-CD1 3.45Å; L795-I811 VanDerWaalsContact CG-CD1 3.45Å; V796-I811 HydrophobicContact CG2-CB 4.43Å; V796-I811 HydrophobicContact CG2-CG2 3.83Å; Y799-I811 HydrophobicContact CD2-CD1 3.73Å; Y799-I811 HydrophobicContact CE2-CD1 3.26Å; Y799-I811 HydrophobicContact CE2-CG1 4.16Å; D807-I811 WeakPolarHBondContact O-CG1 3.45Å; D807-I811 PolarHBondContact O-N 3.14Å; A808-I811 PolarHBondContact O-N 3.28Å; I811-A813 VanDerWaalsContact C-N 3.26Å; I811-A813 PolarHBondContact O-N 3.32Å; I811-T814 PolarHBondContact O-N 3.14Å; I811-Y815 HydrophobicContact CG2-CD2 4.03Å; I811-Y815 PolarHBondContact O-N 3.47Å
812	L	76.7	Confident	76.1	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-58.6	-39.1	177.4	-72.1	170.7	0	0	0	111.6	V796 A808 T814 C818 L822 L829 V840 L844	V796-L812 HydrophobicContact CG1-CD1 4.3Å; V796-L812 HydrophobicContact CG1-CD2 4.28Å; V796-L812 HydrophobicContact CG1-CG 4.36Å; V796-L812 HydrophobicContact CG2-CD2 3.91Å; V796-L812 HydrophobicContact CG2-CG 4.04Å; A808-L812 WeakPolarHBondContact O-CB 3.18Å; A808-L812 VanDerWaalsContact O-CG 3.26Å; A808-L812 WeakPolarHBondContact O-CG 3.34Å; A808-L812 PolarHBondContact O-N 3.47Å; L812-T814 VanDerWaalsContact C-N 3.31Å; L812-T814 PolarHBondContact O-N 2.66Å; L812-C818 HydrophobicContact CD2-CB 3.7Å; L812-L822 HydrophobicContact CB-CD1 4.38Å; L812-L822 HydrophobicContact CD1-CD1 4.32Å; L812-L822 HydrophobicContact CD2-CB 4.23Å; L812-L822 HydrophobicContact CD2-CD1 4.46Å; L812-L829 HydrophobicContact CD1-CD1 3.99Å; L812-V840 HydrophobicContact CB-CG1 4.43Å; L812-L844 WeakPolarHBondContact O-CD1 3.3Å
813	A	75.4	Confident	76	Confident	23 Å²	23	51.5 Å²	51.5	19%	0.19	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-27.8	175.5	0	0	0	0	0	113.9	L809 K810 I811 V840	L809-A813 WeakPolarHBondContact O-CB 3.28Å; L809-A813 PolarHBondContact O-N 3.02Å; K810-A813 PolarHBondContact O-N 3.11Å; I811-A813 VanDerWaalsContact C-N 3.26Å; I811-A813 PolarHBondContact O-N 3.32Å; A813-V840 HydrophobicContact CB-CG1 4.02Å; A813-V840 HydrophobicContact CB-CG2 4.13Å
814	T	77.9	Confident	76	Confident	89 Å²	89	52 Å²	52	55%	0.546	26%	0.264	S	S	.	.	H	α-helix	trans	-91.4	-37	-173.1	-50.8	0	0	0	0	112.2	K810 I811 L812	K810-T814 WeakPolarHBondContact O-CB 3.47Å; K810-T814 PolarHBondContact O-N 2.96Å; K810-T814 VanDerWaalsContact O-N 3.13Å; K810-T814 PolarHBondContact O-OG1 3.01Å; I811-T814 PolarHBondContact O-N 3.14Å; L812-T814 VanDerWaalsContact C-N 3.31Å; L812-T814 PolarHBondContact O-N 2.66Å
815	Y	72	Confident	75.9	Confident	87 Å²	87	50.8 Å²	50.8	34%	0.341	26%	0.257	S	S	.	.			trans	-116.9	106.9	-172	-59.6	-71.9	0	0	0	112.1	Y792 I811 N817	Y792-Y815 HydrophobicContact CD1-CD1 4.5Å; Y792-Y815 AromaticContact CD1-CD2 3.54Å; Y792-Y815 HydrophobicContact CD1-CD2 3.54Å; Y792-Y815 AromaticContact CD1-CE2 3.74Å; Y792-Y815 HydrophobicContact CD1-CE2 3.74Å; Y792-Y815 AromaticContact CD1-CG 3.93Å; Y792-Y815 HydrophobicContact CD1-CG 3.93Å; Y792-Y815 HydrophobicContact CD2-CD1 4.06Å; Y792-Y815 HydrophobicContact CD2-CD2 4.27Å; Y792-Y815 AromaticContact CD2-CG 3.79Å; Y792-Y815 HydrophobicContact CD2-CG 3.79Å; Y792-Y815 AromaticContact CE1-CD1 3.98Å; Y792-Y815 HydrophobicContact CE1-CD1 3.98Å; Y792-Y815 AromaticContact CE1-CD2 3.51Å; Y792-Y815 HydrophobicContact CE1-CD2 3.51Å; Y792-Y815 AromaticContact CE1-CE1 3.79Å; Y792-Y815 HydrophobicContact CE1-CE1 3.79Å; Y792-Y815 AromaticContact CE1-CE2 3.28Å; Y792-Y815 HydrophobicContact CE1-CE2 3.28Å; Y792-Y815 AromaticContact CE1-CG 3.83Å; Y792-Y815 HydrophobicContact CE1-CG 3.83Å; Y792-Y815 AromaticContact CE1-CZ 3.41Å; Y792-Y815 VanDerWaalsContact CE1-CZ 3.41Å; Y792-Y815 AromaticContact CE2-CD1 3.45Å; Y792-Y815 HydrophobicContact CE2-CD1 3.45Å; Y792-Y815 VanDerWaalsContact CE2-CD1 3.45Å; Y792-Y815 HydrophobicContact CE2-CD2 4.23Å; Y792-Y815 AromaticContact CE2-CE1 3.82Å; Y792-Y815 HydrophobicContact CE2-CE1 3.82Å; Y792-Y815 AromaticContact CE2-CG 3.67Å; Y792-Y815 HydrophobicContact CE2-CG 3.67Å; Y792-Y815 AromaticContact CG-CD2 3.95Å; Y792-Y815 HydrophobicContact CG-CD2 3.95Å; Y792-Y815 AromaticContact CG-CG 3.92Å; Y792-Y815 HydrophobicContact CG-CG 3.92Å; Y792-Y815 AromaticContact CZ-CD1 3.41Å; Y792-Y815 VanDerWaalsContact CZ-CD1 3.41Å; Y792-Y815 AromaticContact CZ-CD2 3.87Å; Y792-Y815 AromaticContact CZ-CE1 3.27Å; Y792-Y815 AromaticContact CZ-CE2 3.73Å; Y792-Y815 AromaticContact CZ-CG 3.69Å; Y792-Y815 AromaticContact CZ-CZ 3.42Å; Y792-Y815 VanDerWaalsContact CZ-CZ 3.42Å; Y792-Y815 WeakPolarHBondContact OH-CE1 3.43Å; Y792-Y815 VanDerWaalsContact OH-CZ 3.28Å; I811-Y815 HydrophobicContact CG2-CD2 4.03Å; I811-Y815 PolarHBondContact O-N 3.47Å; Y815-N817 PolarHBondContact O-N 3.42Å; Y815-N817 VanDerWaalsContact O-N 3.13Å
816	P	64.9	Low	75.7	Confident	37 Å²	37	48.6 Å²	48.6	24%	0.24	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-65.7	-14.3	-179	-19.6	30	0	0	0	115.1	C818 L819 K847	P816-C818 PolarHBondContact O-N 2.96Å; P816-L819 WeakPolarHBondContact O-CD1 3.49Å; P816-L819 WeakPolarHBondContact O-CG 3.42Å; P816-K847 HydrophobicContact CB-CD 3.67Å; P816-K847 HydrophobicContact CG-CD 3.94Å
817	N	66.2	Low	75.6	Confident	143 Å²	143	49.7 Å²	49.7	77%	0.765	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-75	-2.7	-175.9	-62.8	-3.4	0	0	0	113.1	Y815	Y815-N817 PolarHBondContact O-N 3.42Å; Y815-N817 VanDerWaalsContact O-N 3.13Å
818	C	65	Low	75.7	Confident	4 Å²	4	50 Å²	50	3%	0.027	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-100	12.5	-179.4	-66.2	0	0	0	0	114.3	Y792 L812 P816 D820 R821 L822	Y792-C818 WeakPolarHBondContact CB-SG 3.47Å; L812-C818 HydrophobicContact CD2-CB 3.7Å; P816-C818 PolarHBondContact O-N 2.96Å; C818-D820 PolarHBondContact O-N 3.16Å; C818-R821 PolarHBondContact O-N 3.4Å; C818-R821 VanDerWaalsContact O-N 3.1Å; C818-L822 PolarHBondContact O-N 3.34Å; C818-L822 VanDerWaalsContact O-N 3.07Å
819	L	69.5	Low	75.7	Confident	39 Å²	39	50.1 Å²	50.1	20%	0.204	26%	0.261	C	S	.	.	H	α-helix	trans	-53.6	-39.8	-176.4	-74.1	157	0	0	0	112.6	P816 R821 L822 Y823 K847 L848	P816-L819 WeakPolarHBondContact O-CD1 3.49Å; P816-L819 WeakPolarHBondContact O-CG 3.42Å; L819-R821 PolarHBondContact O-N 3.02Å; L819-L822 WeakPolarHBondContact O-CB 3.42Å; L819-L822 PolarHBondContact O-N 3.31Å; L819-Y823 HydrophobicContact CB-CE2 4.43Å; L819-Y823 WeakPolarHBondContact O-CD2 3.49Å; L819-Y823 WeakPolarHBondContact O-CE2 3.25Å; L819-Y823 PolarHBondContact O-N 3.43Å; L819-K847 HydrophobicContact CD1-CB 4.28Å; L819-K847 WeakPolarHBondContact CD1-O 3.4Å; L819-L848 HydrophobicContact CD2-CD2 3.34Å; L819-L848 HydrophobicContact CD2-CG 3.91Å
820	D	73	Confident	75.7	Confident	105 Å²	105	50.1 Å²	50.1	56%	0.561	26%	0.262	S	S	*	.	H	α-helix	trans	-62.8	-42.7	179	-69.1	-35.6	0	0	0	112.9	C818 L822 Y823 D824 R852	C818-D820 PolarHBondContact O-N 3.16Å; D820-L822 VanDerWaalsContact C-N 3.29Å; D820-L822 PolarHBondContact O-N 2.91Å; D820-Y823 PolarHBondContact O-N 3.1Å; D820-D824 PolarHBondContact O-N 2.59Å; D820-R852 IonicContact OD1-NH1 2.66Å
821	R	71.4	Confident	75.6	Confident	95 Å²	95	48.6 Å²	48.6	36%	0.358	27%	0.267	S	S	.	.	H	α-helix	trans	-70.2	-26.5	176.4	-72.6	-69.6	-177.7	-107.2	-6.8	112.7	P793 D797 C818 L819 Y823 D824 H825	P793-R821 HydrophobicContact CB-CG 4.03Å; D797-R821 IonicContact OD1-NE 3.28Å; D797-R821 IonicContact OD2-NE 2.64Å; D797-R821 PolarHBondContact OD2-NE 3.26Å; C818-R821 PolarHBondContact O-N 3.4Å; C818-R821 VanDerWaalsContact O-N 3.1Å; L819-R821 PolarHBondContact O-N 3.02Å; R821-Y823 VanDerWaalsContact C-N 3.35Å; R821-D824 IonicContact CZ-OD2 3.11Å; R821-D824 IonicContact NH1-OD2 3.42Å; R821-D824 PolarHBondContact NH1-OD2 2.8Å; R821-D824 PolarHBondContact O-N 2.96Å; R821-H825 PolarHBondContact O-CD2 3.39Å; R821-H825 VanDerWaalsContact O-CD2 3.26Å; R821-H825 PolarHBondContact O-N 3.2Å; R821-H825 VanDerWaalsContact O-N 3.09Å
822	L	74.9	Confident	75.7	Confident	2 Å²	2	54 Å²	54	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-64.1	-42.4	171.6	-173.2	142.1	0	0	0	110.2	L812 C818 L819 D820 H825 A826 L844 L848 L853	L812-L822 HydrophobicContact CB-CD1 4.38Å; L812-L822 HydrophobicContact CD1-CD1 4.32Å; L812-L822 HydrophobicContact CD2-CB 4.23Å; L812-L822 HydrophobicContact CD2-CD1 4.46Å; C818-L822 PolarHBondContact O-N 3.34Å; C818-L822 VanDerWaalsContact O-N 3.07Å; L819-L822 WeakPolarHBondContact O-CB 3.42Å; L819-L822 PolarHBondContact O-N 3.31Å; D820-L822 VanDerWaalsContact C-N 3.29Å; D820-L822 PolarHBondContact O-N 2.91Å; L822-H825 PolarHBondContact O-N 2.85Å; L822-A826 VanDerWaalsContact O-CA 3.29Å; L822-A826 WeakPolarHBondContact O-CA 3.27Å; L822-A826 WeakPolarHBondContact O-CB 3.1Å; L822-A826 PolarHBondContact O-N 3.39Å; L822-L844 HydrophobicContact CD1-CD1 4.06Å; L822-L848 HydrophobicContact CD2-CD2 3.82Å; L822-L853 HydrophobicContact CD2-CD2 3.85Å
823	Y	78.3	Confident	75.9	Confident	38 Å²	38	58.9 Å²	58.9	15%	0.149	31%	0.308	C	S	.	.	H	α-helix	trans	-64.9	-40.4	175.1	-57.1	-60.1	0	0	0	112.5	L819 D820 R821 H825 D849 R852 L853	L819-Y823 HydrophobicContact CB-CE2 4.43Å; L819-Y823 WeakPolarHBondContact O-CD2 3.49Å; L819-Y823 WeakPolarHBondContact O-CE2 3.25Å; L819-Y823 PolarHBondContact O-N 3.43Å; D820-Y823 PolarHBondContact O-N 3.1Å; R821-Y823 VanDerWaalsContact C-N 3.35Å; Y823-H825 PolarHBondContact O-N 3.35Å; Y823-D849 WeakPolarHBondContact OH-CB 3.24Å; Y823-D849 PolarHBondContact OH-N 2.92Å; Y823-R852 HydrophobicContact CD1-CB 3.56Å; Y823-R852 HydrophobicContact CE1-CB 3.43Å; Y823-R852 VanDerWaalsContact CE1-CB 3.43Å; Y823-R852 HydrophobicContact CE1-CG 4.42Å; Y823-R852 HydrophobicContact CG-CB 4.19Å; Y823-L853 HydrophobicContact CD1-CD2 4.17Å; Y823-L853 HydrophobicContact CD1-CG 4.17Å; Y823-L853 HydrophobicContact CE1-CD2 4.35Å; Y823-L853 HydrophobicContact CE1-CG 3.92Å
824	D	80.9	Confident	76.1	Confident	92 Å²	92	59.5 Å²	59.5	49%	0.492	31%	0.31	S	S	.	.	H	α-helix	trans	-59.8	-44.2	178.2	-68.2	-23.3	0	0	0	112	D820 R821	D820-D824 PolarHBondContact O-N 2.59Å; R821-D824 IonicContact CZ-OD2 3.11Å; R821-D824 IonicContact NH1-OD2 3.42Å; R821-D824 PolarHBondContact NH1-OD2 2.8Å; R821-D824 PolarHBondContact O-N 2.96Å
825	H	79	Confident	76.3	Confident	40 Å²	40	61.3 Å²	61.3	19%	0.185	31%	0.312	C	S	.	.	H	α-helix	trans	-98.5	-0	-175.6	-63.4	-66.8	0	0	0	114.2	D797 I800 R821 L822 Y823 S827 C828 L829	D797-H825 IonicContact OD1-CD2 3.47Å; D797-H825 IonicContact OD1-CE1 2.71Å; D797-H825 IonicContact OD1-NE2 3.68Å; D797-H825 PolarHBondContact OD1-NE2 2.87Å; I800-H825 HydrophobicContact CD1-CB 3.69Å; I800-H825 VanDerWaalsContact CD1-CD2 3.41Å; I800-H825 WeakPolarHBondContact CD1-CD2 3.48Å; R821-H825 PolarHBondContact O-CD2 3.39Å; R821-H825 VanDerWaalsContact O-CD2 3.26Å; R821-H825 PolarHBondContact O-N 3.2Å; R821-H825 VanDerWaalsContact O-N 3.09Å; L822-H825 PolarHBondContact O-N 2.85Å; Y823-H825 PolarHBondContact O-N 3.35Å; H825-S827 VanDerWaalsContact C-N 3.31Å; H825-S827 PolarHBondContact O-N 3.19Å; H825-C828 WeakPolarHBondContact O-CB 3.26Å; H825-C828 PolarHBondContact O-N 3.4Å; H825-L829 HydrophobicContact CB-CD1 4.26Å; H825-L829 WeakPolarHBondContact O-CG 3.46Å; H825-L829 PolarHBondContact O-N 3.04Å
826	A	78.7	Confident	76.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-57.7	-40.7	-175	0	0	0	0	0	112.5	L822 C828 L829 S830 F837 L853 S856	L822-A826 VanDerWaalsContact O-CA 3.29Å; L822-A826 WeakPolarHBondContact O-CA 3.27Å; L822-A826 WeakPolarHBondContact O-CB 3.1Å; L822-A826 PolarHBondContact O-N 3.39Å; A826-C828 VanDerWaalsContact C-N 3.33Å; A826-C828 PolarHBondContact O-N 2.86Å; A826-L829 PolarHBondContact O-N 3.41Å; A826-S830 VanDerWaalsContact O-CB 3.23Å; A826-S830 WeakPolarHBondContact O-CB 3.45Å; A826-S830 PolarHBondContact O-N 2.7Å; A826-S830 PolarHBondContact O-OG 2.98Å; A826-S830 VanDerWaalsContact O-OG 3.14Å; A826-F837 HydrophobicContact CB-CE2 4.3Å; A826-F837 HydrophobicContact CB-CZ 4.03Å; A826-L853 HydrophobicContact CB-CD2 4.11Å; A826-S856 WeakPolarHBondContact CB-OG 3.38Å
827	S	80	Confident	77.6	Confident	62 Å²	62	58.8 Å²	58.8	43%	0.434	30%	0.3	S	S	.	.	H	α-helix	trans	-65	-33.7	177.4	60.4	0	0	0	0	113.5	H825 S830 S831	H825-S827 VanDerWaalsContact C-N 3.31Å; H825-S827 PolarHBondContact O-N 3.19Å; S827-S830 PolarHBondContact O-OG 3.48Å; S827-S830 VanDerWaalsContact O-OG 3.14Å; S827-S831 PolarHBondContact O-N 3.21Å
828	C	83	Confident	78.4	Confident	47 Å²	47	52 Å²	52	32%	0.318	26%	0.264	S	S	.	.	H	α-helix	trans	-75.3	-45.3	177.5	-176.2	0	0	0	0	111	H825 A826 S831 K832	H825-C828 WeakPolarHBondContact O-CB 3.26Å; H825-C828 PolarHBondContact O-N 3.4Å; A826-C828 VanDerWaalsContact C-N 3.33Å; A826-C828 PolarHBondContact O-N 2.86Å; C828-S831 PolarHBondContact O-N 3.18Å; C828-K832 WeakPolarHBondContact O-CG 3.28Å; C828-K832 PolarHBondContact O-N 3.42Å
829	L	82.4	Confident	79.2	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-67.4	-39.8	179.9	-67.8	170.6	0	0	0	111.8	Y805 L809 L812 H825 A826 S831 K832 R833 F837	Y805-L829 HydrophobicContact CD1-CD2 4.14Å; L809-L829 HydrophobicContact CD2-CD1 4.22Å; L809-L829 HydrophobicContact CD2-CD2 4.49Å; L809-L829 HydrophobicContact CG-CD2 4.46Å; L812-L829 HydrophobicContact CD1-CD1 3.99Å; H825-L829 HydrophobicContact CB-CD1 4.26Å; H825-L829 WeakPolarHBondContact O-CG 3.46Å; H825-L829 PolarHBondContact O-N 3.04Å; A826-L829 PolarHBondContact O-N 3.41Å; L829-S831 VanDerWaalsContact C-N 3.31Å; L829-S831 PolarHBondContact O-N 3.25Å; L829-K832 PolarHBondContact O-N 3.07Å; L829-R833 CarbonylContact O-C 3.57Å; L829-R833 PolarHBondContact O-N 2.88Å; L829-F837 HydrophobicContact CB-CD2 3.74Å; L829-F837 HydrophobicContact CB-CE2 4.23Å; L829-F837 HydrophobicContact CB-CG 4.39Å; L829-F837 HydrophobicContact CD1-CD2 4.41Å
830	S	80.5	Confident	79.6	Confident	4 Å²	4	53 Å²	53	3%	0.028	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-35.6	177.4	70	0	0	0	0	112.5	A826 S827	A826-S830 VanDerWaalsContact O-CB 3.23Å; A826-S830 WeakPolarHBondContact O-CB 3.45Å; A826-S830 PolarHBondContact O-N 2.7Å; A826-S830 PolarHBondContact O-OG 2.98Å; A826-S830 VanDerWaalsContact O-OG 3.14Å; S827-S830 PolarHBondContact O-OG 3.48Å; S827-S830 VanDerWaalsContact O-OG 3.14Å
831	S	80.4	Confident	79.8	Confident	92 Å²	92	48 Å²	48	64%	0.643	24%	0.243	S	C	*	.	H	α-helix	trans	-75.6	-36.2	178.6	180	0	0	0	0	113.6	S827 C828 L829	S827-S831 PolarHBondContact O-N 3.21Å; C828-S831 PolarHBondContact O-N 3.18Å; L829-S831 VanDerWaalsContact C-N 3.31Å; L829-S831 PolarHBondContact O-N 3.25Å
832	K	80.2	Confident	80.1	Confident	131 Å²	131	44.7 Å²	44.7	57%	0.57	23%	0.232	S	C	*	.	H	α-helix	trans	-89.8	-40.7	-173.9	-65.3	-65.2	-177	-177.5	0	114.1	C828 L829	C828-K832 WeakPolarHBondContact O-CG 3.28Å; C828-K832 PolarHBondContact O-N 3.42Å; L829-K832 PolarHBondContact O-N 3.07Å
833	R	79.8	Confident	80.2	Confident	106 Å²	106	53.4 Å²	53.4	40%	0.4	27%	0.265	S	S	.	.			trans	-140.9	69.9	-174.5	-73.5	-84.8	178.6	112.7	2.9	110.4	L829 E835 E836 F837	L829-R833 CarbonylContact O-C 3.57Å; L829-R833 PolarHBondContact O-N 2.88Å; R833-E835 PolarHBondContact O-N 3.44Å; R833-E836 HydrophobicContact CB-CB 4.44Å; R833-E836 IonicContact CZ-OE1 2.74Å; R833-E836 IonicContact NH1-OE1 3.97Å; R833-E836 PolarHBondContact NH1-OE1 3.03Å; R833-E836 IonicContact NH1-OE2 2.78Å; R833-E836 PolarHBondContact NH1-OE2 2.94Å; R833-F837 VanDerWaalsContact O-CB 3.26Å; R833-F837 WeakPolarHBondContact O-CB 3.14Å; R833-F837 PolarHBondContact O-N 2.89Å
834	P	79.9	Confident	79.8	Confident	36 Å²	36	52.3 Å²	52.3	23%	0.234	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-39.3	-173.1	22.6	-33.1	0	0	0	113.6	V838 L860	P834-V838 WeakPolarHBondContact O-CB 3.3Å; P834-V838 WeakPolarHBondContact O-CG2 3.24Å; P834-V838 PolarHBondContact O-N 2.99Å; P834-L860 HydrophobicContact CB-CD2 3.92Å
835	E	81.4	Confident	79	Confident	126 Å²	126	48 Å²	48	59%	0.589	24%	0.238	S	C	*	.	H	α-helix	trans	-69.1	-47.2	-177.6	-64.7	-178.2	173.8	0	0	112.8	R833 F837 V838 N839	R833-E835 PolarHBondContact O-N 3.44Å; E835-F837 VanDerWaalsContact C-N 3.34Å; E835-V838 PolarHBondContact O-N 3.4Å; E835-N839 WeakPolarHBondContact O-CB 3.31Å; E835-N839 PolarHBondContact O-N 3.14Å; E835-N839 PolarHBondContact O-ND2 3.26Å
836	E	80.7	Confident	78.3	Confident	68 Å²	68	51.8 Å²	51.8	32%	0.318	26%	0.26	S	S	.	.	H	α-helix	trans	-66.3	-39	177.8	-66.6	176.5	-156.7	0	0	111.1	L809 R833 N839 V840	L809-E836 HydrophobicContact CD1-CB 3.55Å; R833-E836 HydrophobicContact CB-CB 4.44Å; R833-E836 IonicContact CZ-OE1 2.74Å; R833-E836 IonicContact NH1-OE1 3.97Å; R833-E836 PolarHBondContact NH1-OE1 3.03Å; R833-E836 IonicContact NH1-OE2 2.78Å; R833-E836 PolarHBondContact NH1-OE2 2.94Å; E836-N839 PolarHBondContact O-N 2.73Å; E836-V840 WeakPolarHBondContact O-CG2 3.35Å; E836-V840 PolarHBondContact O-N 3.03Å
837	F	84.6	Confident	77.5	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.018	29%	0.286	C	S	.	.	H	α-helix	trans	-59.7	-50.3	175	176	-105.1	0	0	0	111.5	L809 A826 L829 R833 E835 N839 V840 C841 L853 L860	L809-F837 HydrophobicContact CD2-CD2 4.32Å; A826-F837 HydrophobicContact CB-CE2 4.3Å; A826-F837 HydrophobicContact CB-CZ 4.03Å; L829-F837 HydrophobicContact CB-CD2 3.74Å; L829-F837 HydrophobicContact CB-CE2 4.23Å; L829-F837 HydrophobicContact CB-CG 4.39Å; L829-F837 HydrophobicContact CD1-CD2 4.41Å; R833-F837 VanDerWaalsContact O-CB 3.26Å; R833-F837 WeakPolarHBondContact O-CB 3.14Å; R833-F837 PolarHBondContact O-N 2.89Å; E835-F837 VanDerWaalsContact C-N 3.34Å; F837-N839 VanDerWaalsContact C-N 3.33Å; F837-N839 PolarHBondContact O-N 2.85Å; F837-V840 PolarHBondContact O-N 3.31Å; F837-V840 VanDerWaalsContact O-N 3.12Å; F837-C841 VanDerWaalsContact CZ-SG 3.57Å; F837-C841 PolarHBondContact O-N 3.26Å; F837-C841 PolarHBondContact O-SG 2.99Å; F837-L853 HydrophobicContact CZ-CD2 4.16Å; F837-L860 HydrophobicContact CD1-CD2 4.38Å
838	V	82.1	Confident	77	Confident	1 Å²	1	55 Å²	55	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-42.9	177.1	170.9	0	0	0	0	110.6	P834 E835 V840 C841 L842 L860 Q864	P834-V838 WeakPolarHBondContact O-CB 3.3Å; P834-V838 WeakPolarHBondContact O-CG2 3.24Å; P834-V838 PolarHBondContact O-N 2.99Å; E835-V838 PolarHBondContact O-N 3.4Å; V838-V840 VanDerWaalsContact C-N 3.28Å; V838-V840 PolarHBondContact O-N 3.36Å; V838-C841 PolarHBondContact O-N 3.03Å; V838-L842 HydrophobicContact CG1-CD1 3.76Å; V838-L842 HydrophobicContact CG1-CG 4.04Å; V838-L842 WeakPolarHBondContact O-CB 3.38Å; V838-L842 WeakPolarHBondContact O-CG 3.28Å; V838-L842 PolarHBondContact O-N 2.73Å; V838-L860 HydrophobicContact CG2-CD1 3.89Å; V838-L860 HydrophobicContact CG2-CD2 4.37Å; V838-Q864 HydrophobicContact CG2-CB 4.17Å
839	N	82.3	Confident	76.3	Confident	56 Å²	56	56.9 Å²	56.9	30%	0.299	27%	0.273	S	S	.	.	H	α-helix	trans	-58.7	-37.8	175.1	-70.8	-21.8	0	0	0	112.9	E835 E836 F837 R843 R867	E835-N839 WeakPolarHBondContact O-CB 3.31Å; E835-N839 PolarHBondContact O-N 3.14Å; E835-N839 PolarHBondContact O-ND2 3.26Å; E836-N839 PolarHBondContact O-N 2.73Å; F837-N839 VanDerWaalsContact C-N 3.33Å; F837-N839 PolarHBondContact O-N 2.85Å; N839-R843 WeakPolarHBondContact O-CG 3.46Å; N839-R843 PolarHBondContact O-N 3.1Å; N839-R867 PolarHBondContact OD1-NH2 3.23Å
840	V	77.6	Confident	75.6	Confident	6 Å²	6	57.2 Å²	57.2	4%	0.036	28%	0.276	C	S	.	.	H	α-helix	trans	-70.4	-44.6	174.8	171.2	0	0	0	0	111.2	L809 L812 A813 E836 F837 V838 L842 R843 L844	L809-V840 HydrophobicContact CB-CG2 3.96Å; L809-V840 HydrophobicContact CD2-CB 4.27Å; L809-V840 HydrophobicContact CD2-CG2 4.05Å; L812-V840 HydrophobicContact CB-CG1 4.43Å; A813-V840 HydrophobicContact CB-CG1 4.02Å; A813-V840 HydrophobicContact CB-CG2 4.13Å; E836-V840 WeakPolarHBondContact O-CG2 3.35Å; E836-V840 PolarHBondContact O-N 3.03Å; F837-V840 PolarHBondContact O-N 3.31Å; F837-V840 VanDerWaalsContact O-N 3.12Å; V838-V840 VanDerWaalsContact C-N 3.28Å; V838-V840 PolarHBondContact O-N 3.36Å; V840-L842 VanDerWaalsContact C-N 3.33Å; V840-L842 PolarHBondContact O-N 3.22Å; V840-R843 PolarHBondContact O-N 3.46Å; V840-R843 VanDerWaalsContact O-N 3.14Å; V840-L844 HydrophobicContact CG1-CD1 3.65Å; V840-L844 HydrophobicContact CG1-CG 4.31Å; V840-L844 WeakPolarHBondContact O-CG 3.5Å; V840-L844 PolarHBondContact O-N 3.32Å
841	C	78.4	Confident	75.1	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.014	29%	0.293	C	S	.	.	H	α-helix	trans	-60.6	-40.6	176.1	-65.5	0	0	0	0	112	F837 V838 R843 L844 N845 L848 Y868	F837-C841 VanDerWaalsContact CZ-SG 3.57Å; F837-C841 PolarHBondContact O-N 3.26Å; F837-C841 PolarHBondContact O-SG 2.99Å; V838-C841 PolarHBondContact O-N 3.03Å; C841-R843 VanDerWaalsContact C-N 3.3Å; C841-R843 PolarHBondContact O-N 3.37Å; C841-L844 CarbonylContact O-C 3.05Å; C841-L844 PolarHBondContact O-N 3.08Å; C841-N845 WeakPolarHBondContact O-CA 3.43Å; C841-N845 PolarHBondContact O-N 3.41Å; C841-L848 HydrophobicContact CB-CD1 4.22Å; C841-Y868 HydrophobicContact CB-CD2 3.85Å; C841-Y868 HydrophobicContact CB-CE2 3.39Å
842	L	77.7	Confident	74.8	Confident	24 Å²	24	62.8 Å²	62.8	13%	0.126	29%	0.288	C	S	.	.	H	α-helix	trans	-63.2	-31.7	175.1	-69.4	171.1	0	0	0	113	V838 V840 N845 Y868 D871 K875	V838-L842 HydrophobicContact CG1-CD1 3.76Å; V838-L842 HydrophobicContact CG1-CG 4.04Å; V838-L842 WeakPolarHBondContact O-CB 3.38Å; V838-L842 WeakPolarHBondContact O-CG 3.28Å; V838-L842 PolarHBondContact O-N 2.73Å; V840-L842 VanDerWaalsContact C-N 3.33Å; V840-L842 PolarHBondContact O-N 3.22Å; L842-N845 WeakPolarHBondContact O-CB 3.28Å; L842-Y868 HydrophobicContact CD2-CD2 4.19Å; L842-Y868 HydrophobicContact CG-CD2 4.44Å; L842-D871 HydrophobicContact CD2-CB 3.25Å; L842-D871 WeakPolarHBondContact CD2-OD2 3.47Å; L842-K875 PolarHBondContact O-NZ 3.11Å
843	R	75.4	Confident	74.6	Confident	185 Å²	185	56.6 Å²	56.6	70%	0.698	26%	0.261	S	S	*	.	H	α-helix	trans	-77.2	-39.3	174.6	-72.5	176.9	-161	172.1	4.9	112.7	N839 V840 C841 N845	N839-R843 WeakPolarHBondContact O-CG 3.46Å; N839-R843 PolarHBondContact O-N 3.1Å; V840-R843 PolarHBondContact O-N 3.46Å; V840-R843 VanDerWaalsContact O-N 3.14Å; C841-R843 VanDerWaalsContact C-N 3.3Å; C841-R843 PolarHBondContact O-N 3.37Å; R843-N845 PolarHBondContact O-N 3.1Å
844	L	70.8	Confident	74.4	Confident	15 Å²	15	53.1 Å²	53.1	8%	0.079	25%	0.25	C	C	.	.	S	Bend	trans	-83.7	1.2	-179.8	-67.9	172.9	0	0	0	113	L812 L822 V840 C841 N846 K847 L848	L812-L844 WeakPolarHBondContact O-CD1 3.3Å; L822-L844 HydrophobicContact CD1-CD1 4.06Å; V840-L844 HydrophobicContact CG1-CD1 3.65Å; V840-L844 HydrophobicContact CG1-CG 4.31Å; V840-L844 WeakPolarHBondContact O-CG 3.5Å; V840-L844 PolarHBondContact O-N 3.32Å; C841-L844 CarbonylContact O-C 3.05Å; C841-L844 PolarHBondContact O-N 3.08Å; L844-N846 PolarHBondContact O-N 2.66Å; L844-K847 PolarHBondContact O-N 2.74Å; L844-L848 HydrophobicContact CB-CD1 3.56Å; L844-L848 HydrophobicContact CB-CG 4.04Å
845	N	65	Low	74.2	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-48.2	-42.6	-163.3	-155.3	-1.3	0	0	0	112.7	C841 L842 R843 K847 L848 D871 T872 K875 Y876	C841-N845 WeakPolarHBondContact O-CA 3.43Å; C841-N845 PolarHBondContact O-N 3.41Å; L842-N845 WeakPolarHBondContact O-CB 3.28Å; R843-N845 PolarHBondContact O-N 3.1Å; N845-K847 PolarHBondContact O-N 3.37Å; N845-L848 PolarHBondContact O-N 2.81Å; N845-D871 PolarHBondContact ND2-OD2 3.04Å; N845-T872 WeakPolarHBondContact ND2-CA 3.36Å; N845-T872 WeakPolarHBondContact OD1-CG2 3.47Å; N845-K875 HydrophobicContact CB-CD 4.4Å; N845-Y876 WeakPolarHBondContact O-CE2 3.45Å; N845-Y876 PolarHBondContact O-OH 3.48Å
846	N	62.9	Low	73.9	Confident	121 Å²	121	50 Å²	50	65%	0.647	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-65	-4.8	179.9	-66.8	7.5	0	0	0	116.1	L844 Y876	L844-N846 PolarHBondContact O-N 2.66Å; N846-Y876 WeakPolarHBondContact CA-OH 3.47Å
847	K	63.5	Low	73.8	Confident	122 Å²	122	47 Å²	47	53%	0.53	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-128.7	-2.3	-175.5	-61.7	-173.6	-179.5	179.4	0	114.3	P816 L819 L844 N845	P816-K847 HydrophobicContact CB-CD 3.67Å; P816-K847 HydrophobicContact CG-CD 3.94Å; L819-K847 HydrophobicContact CD1-CB 4.28Å; L819-K847 WeakPolarHBondContact CD1-O 3.4Å; L844-K847 PolarHBondContact O-N 2.74Å; N845-K847 PolarHBondContact O-N 3.37Å
848	L	67.7	Low	73.5	Confident	6 Å²	6	54 Å²	54	3%	0.031	26%	0.262	C	S	.	.	S	Bend	trans	-95.4	134.2	-176.6	-74.1	162.5	0	0	0	110.4	L819 L822 C841 L844 N845 S850 L853	L819-L848 HydrophobicContact CD2-CD2 3.34Å; L819-L848 HydrophobicContact CD2-CG 3.91Å; L822-L848 HydrophobicContact CD2-CD2 3.82Å; C841-L848 HydrophobicContact CB-CD1 4.22Å; L844-L848 HydrophobicContact CB-CD1 3.56Å; L844-L848 HydrophobicContact CB-CG 4.04Å; N845-L848 PolarHBondContact O-N 2.81Å; L848-S850 PolarHBondContact O-N 3.31Å; L848-L853 HydrophobicContact CB-CD1 4.22Å; L848-L853 HydrophobicContact CD1-CD1 4.19Å; L848-L853 HydrophobicContact CD2-CD1 4.11Å; L848-L853 HydrophobicContact CG-CD1 4.42Å
849	D	68.4	Low	73.4	Confident	87 Å²	87	59.3 Å²	59.3	47%	0.465	29%	0.29	S	S	.	.			trans	-74.7	94.9	166.4	-74	-27.2	0	0	0	107.9	Y823 N851 R852 L853	Y823-D849 WeakPolarHBondContact OH-CB 3.24Å; Y823-D849 PolarHBondContact OH-N 2.92Å; D849-N851 PolarHBondContact O-N 3.19Å; D849-R852 HydrophobicContact CB-CB 4.27Å; D849-R852 HydrophobicContact CB-CG 4.04Å; D849-R852 PolarHBondContact O-N 3.16Å; D849-R852 IonicContact OD2-CZ 3.94Å; D849-R852 IonicContact OD2-NE 3.35Å; D849-L853 PolarHBondContact O-N 3.03Å
850	S	67.5	Low	73.2	Confident	9 Å²	9	57.2 Å²	57.2	6%	0.063	28%	0.278	C	S	.	.	H	α-helix	trans	-51.7	-31.1	178.7	-63.1	0	0	0	0	113	L848 R852 L853 L854	L848-S850 PolarHBondContact O-N 3.31Å; S850-R852 PolarHBondContact O-N 3.48Å; S850-L853 PolarHBondContact O-N 3.28Å; S850-L854 PolarHBondContact O-N 3.43Å
851	N	70.8	Confident	73.4	Confident	71 Å²	71	59.7 Å²	59.7	38%	0.38	30%	0.295	S	S	.	.	H	α-helix	trans	-65.1	-34.4	176.7	-69.1	-27.4	0	0	0	113.9	D849 L853 L854 N882	D849-N851 PolarHBondContact O-N 3.19Å; N851-L853 VanDerWaalsContact C-N 3.33Å; N851-L854 HydrophobicContact CB-CD1 4.48Å; N851-N882 PolarHBondContact ND2-OD1 3.39Å
852	R	73.7	Confident	73.6	Confident	142 Å²	142	63.7 Å²	63.7	54%	0.536	32%	0.316	S	S	.	.	H	α-helix	trans	-77	-23.1	178.7	-69.2	-174.5	-178.4	-163.4	2.8	112.4	D820 Y823 D849 S850 P855	D820-R852 IonicContact OD1-NH1 2.66Å; Y823-R852 HydrophobicContact CD1-CB 3.56Å; Y823-R852 HydrophobicContact CE1-CB 3.43Å; Y823-R852 VanDerWaalsContact CE1-CB 3.43Å; Y823-R852 HydrophobicContact CE1-CG 4.42Å; Y823-R852 HydrophobicContact CG-CB 4.19Å; D849-R852 HydrophobicContact CB-CB 4.27Å; D849-R852 HydrophobicContact CB-CG 4.04Å; D849-R852 PolarHBondContact O-N 3.16Å; D849-R852 IonicContact OD2-CZ 3.94Å; D849-R852 IonicContact OD2-NE 3.35Å; S850-R852 PolarHBondContact O-N 3.48Å; R852-P855 WeakPolarHBondContact O-CD 3.33Å
853	L	76.6	Confident	73.8	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-83.2	-17	175.4	-75.9	169.1	0	0	0	113.6	L822 Y823 A826 F837 L848 D849 S850 N851 P855 S856 I857 Y868	L822-L853 HydrophobicContact CD2-CD2 3.85Å; Y823-L853 HydrophobicContact CD1-CD2 4.17Å; Y823-L853 HydrophobicContact CD1-CG 4.17Å; Y823-L853 HydrophobicContact CE1-CD2 4.35Å; Y823-L853 HydrophobicContact CE1-CG 3.92Å; A826-L853 HydrophobicContact CB-CD2 4.11Å; F837-L853 HydrophobicContact CZ-CD2 4.16Å; L848-L853 HydrophobicContact CB-CD1 4.22Å; L848-L853 HydrophobicContact CD1-CD1 4.19Å; L848-L853 HydrophobicContact CD2-CD1 4.11Å; L848-L853 HydrophobicContact CG-CD1 4.42Å; D849-L853 PolarHBondContact O-N 3.03Å; S850-L853 PolarHBondContact O-N 3.28Å; N851-L853 VanDerWaalsContact C-N 3.33Å; L853-P855 VanDerWaalsContact C-CD 3.46Å; L853-P855 VanDerWaalsContact C-N 3.34Å; L853-S856 CarbonylContact O-C 3.54Å; L853-S856 WeakPolarHBondContact O-CA 3.38Å; L853-S856 WeakPolarHBondContact O-CB 3.23Å; L853-S856 PolarHBondContact O-N 2.93Å; L853-I857 HydrophobicContact CB-CD1 3.84Å; L853-I857 HydrophobicContact CB-CG1 4.25Å; L853-I857 WeakPolarHBondContact O-CG1 3.35Å; L853-I857 PolarHBondContact O-N 3.39Å; L853-Y868 WeakPolarHBondContact CD1-OH 3.27Å
854	L	74.9	Confident	74.1	Confident	32 Å²	32	60 Å²	60	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-45.6	-48.4	-179	-72.8	171.1	0	0	0	113.3	S850 N851 S856 I857 M858 A884 M888	S850-L854 PolarHBondContact O-N 3.43Å; N851-L854 HydrophobicContact CB-CD1 4.48Å; L854-S856 VanDerWaalsContact C-N 3.29Å; L854-S856 PolarHBondContact O-N 3.43Å; L854-I857 PolarHBondContact O-N 3.02Å; L854-M858 WeakPolarHBondContact O-CG 3.4Å; L854-M858 PolarHBondContact O-N 3Å; L854-M858 VanDerWaalsContact O-N 3.09Å; L854-A884 HydrophobicContact CD1-CB 3.84Å; L854-M888 HydrophobicContact CD2-CE 3.23Å; L854-M888 HydrophobicContact CD2-SD 3.87Å
855	P	76	Confident	74.7	Confident	86 Å²	86	59.5 Å²	59.5	56%	0.558	31%	0.307	S	S	*	.	H	α-helix	trans	-63	-33.2	178.3	-21.9	34.3	0	0	0	113.8	R852 L853	R852-P855 WeakPolarHBondContact O-CD 3.33Å; L853-P855 VanDerWaalsContact C-CD 3.46Å; L853-P855 VanDerWaalsContact C-N 3.34Å
856	S	74.9	Confident	75.6	Confident	12 Å²	12	59.7 Å²	59.7	8%	0.084	31%	0.308	C	S	.	.	H	α-helix	trans	-78.7	-31	178.9	-60.4	0	0	0	0	111.8	A826 L853 L854 L859	A826-S856 WeakPolarHBondContact CB-OG 3.38Å; L853-S856 CarbonylContact O-C 3.54Å; L853-S856 WeakPolarHBondContact O-CA 3.38Å; L853-S856 WeakPolarHBondContact O-CB 3.23Å; L853-S856 PolarHBondContact O-N 2.93Å; L854-S856 VanDerWaalsContact C-N 3.29Å; L854-S856 PolarHBondContact O-N 3.43Å; S856-L859 PolarHBondContact O-N 3.32Å
857	I	79.9	Confident	76.5	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-69.3	-36.2	175.8	-62.8	160.6	0	0	0	110.7	L853 L854 L859 L860 A865 Y868 M888	L853-I857 HydrophobicContact CB-CD1 3.84Å; L853-I857 HydrophobicContact CB-CG1 4.25Å; L853-I857 WeakPolarHBondContact O-CG1 3.35Å; L853-I857 PolarHBondContact O-N 3.39Å; L854-I857 PolarHBondContact O-N 3.02Å; I857-L859 PolarHBondContact O-N 2.9Å; I857-L859 VanDerWaalsContact O-N 3.15Å; I857-L860 HydrophobicContact CG1-CD1 4.48Å; I857-L860 HydrophobicContact CG2-CD1 4.45Å; I857-L860 WeakPolarHBondContact O-CB 3.38Å; I857-L860 PolarHBondContact O-N 2.64Å; I857-A865 HydrophobicContact CG2-CB 3.87Å; I857-Y868 HydrophobicContact CD1-CD1 3.64Å; I857-Y868 HydrophobicContact CD1-CE1 3.44Å; I857-Y868 VanDerWaalsContact CD1-CE1 3.44Å; I857-Y868 HydrophobicContact CG1-CD1 4.09Å; I857-Y868 HydrophobicContact CG1-CE1 4.2Å; I857-M888 HydrophobicContact CB-CE 3.86Å; I857-M888 HydrophobicContact CD1-CE 4.23Å; I857-M888 HydrophobicContact CG2-CE 3.48Å; I857-M888 VanDerWaalsContact CG2-CE 3.48Å
858	M	77	Confident	77.3	Confident	150 Å²	150	52.9 Å²	52.9	74%	0.739	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.1	174	-70.1	-175.6	73.8	0	0	113.7	L854 M888	L854-M858 WeakPolarHBondContact O-CG 3.4Å; L854-M858 PolarHBondContact O-N 3Å; L854-M858 VanDerWaalsContact O-N 3.09Å; M858-M888 HydrophobicContact CG-SD 3.95Å
859	L	80	Confident	77.9	Confident	113 Å²	113	52.7 Å²	52.7	59%	0.592	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-9.5	175.9	-64.5	171	0	0	0	113.1	S856 I857	S856-L859 PolarHBondContact O-N 3.32Å; I857-L859 PolarHBondContact O-N 2.9Å; I857-L859 VanDerWaalsContact O-N 3.15Å
860	L	79.6	Confident	78.5	Confident	11 Å²	11	52.2 Å²	52.2	6%	0.058	26%	0.264	C	S	.	.	S	Bend	trans	-77.5	154.8	178.6	-69.3	171.7	0	0	0	111.3	P834 F837 V838 I857 A865	P834-L860 HydrophobicContact CB-CD2 3.92Å; F837-L860 HydrophobicContact CD1-CD2 4.38Å; V838-L860 HydrophobicContact CG2-CD1 3.89Å; V838-L860 HydrophobicContact CG2-CD2 4.37Å; I857-L860 HydrophobicContact CG1-CD1 4.48Å; I857-L860 HydrophobicContact CG2-CD1 4.45Å; I857-L860 WeakPolarHBondContact O-CB 3.38Å; I857-L860 PolarHBondContact O-N 2.64Å; L860-A865 HydrophobicContact CB-CB 4.33Å
861	P	81.4	Confident	79	Confident	59 Å²	59	53.4 Å²	53.4	38%	0.383	27%	0.27	S	S	.	.			trans	-56.7	138.9	165.9	-20.7	31.8	0	0	0	111.4	N863 Q864 A865	P861-N863 VanDerWaalsContact CB-OD1 3.32Å; P861-N863 WeakPolarHBondContact CB-OD1 3.41Å; P861-N863 PolarHBondContact O-N 3.33Å; P861-N863 VanDerWaalsContact O-N 3.09Å; P861-Q864 PolarHBondContact O-N 2.96Å; P861-A865 PolarHBondContact O-N 3.36Å
862	N	81	Confident	79.2	Confident	85 Å²	85	50.2 Å²	50.2	46%	0.455	25%	0.253	S	S	.	.	H	α-helix	trans	-47.3	-44.5	-175.6	-70	-3.7	0	0	0	113.2	Q864 A865 I866	N862-Q864 PolarHBondContact O-N 3.19Å; N862-A865 PolarHBondContact O-N 3.08Å; N862-I866 WeakPolarHBondContact O-CB 3.27Å; N862-I866 VanDerWaalsContact O-CG1 3.22Å; N862-I866 WeakPolarHBondContact O-CG1 3.5Å; N862-I866 PolarHBondContact O-N 2.93Å
863	N	82.2	Confident	79.2	Confident	110 Å²	110	44.8 Å²	44.8	59%	0.588	23%	0.234	S	C	*	.	H	α-helix	trans	-62.3	-36.5	178.5	42.3	-40.5	0	0	0	113.8	P861 R867	P861-N863 VanDerWaalsContact CB-OD1 3.32Å; P861-N863 WeakPolarHBondContact CB-OD1 3.41Å; P861-N863 PolarHBondContact O-N 3.33Å; P861-N863 VanDerWaalsContact O-N 3.09Å; N863-R867 WeakPolarHBondContact O-CB 3.31Å; N863-R867 PolarHBondContact O-N 3.35Å
864	Q	83	Confident	79	Confident	22 Å²	22	50 Å²	50	10%	0.103	26%	0.259	C	S	.	.	H	α-helix	trans	-80.9	-32.2	175.5	-66	-59.9	-20.8	0	0	112	V838 P861 N862 R867 Y868	V838-Q864 HydrophobicContact CG2-CB 4.17Å; P861-Q864 PolarHBondContact O-N 2.96Å; N862-Q864 PolarHBondContact O-N 3.19Å; Q864-R867 VanDerWaalsContact OE1-NH1 3.07Å; Q864-Y868 PolarHBondContact O-N 2.96Å
865	A	82.7	Confident	78.5	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.033	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-47.1	173.3	0	0	0	0	0	111.6	I857 L860 P861 N862 Y868 L869 L892	I857-A865 HydrophobicContact CG2-CB 3.87Å; L860-A865 HydrophobicContact CB-CB 4.33Å; P861-A865 PolarHBondContact O-N 3.36Å; N862-A865 PolarHBondContact O-N 3.08Å; A865-Y868 PolarHBondContact O-N 2.98Å; A865-L869 WeakPolarHBondContact O-CB 3.39Å; A865-L869 WeakPolarHBondContact O-CG 3.26Å; A865-L869 PolarHBondContact O-N 3.4Å; A865-L892 HydrophobicContact CB-CD1 4.05Å
866	I	83.3	Confident	77.7	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.026	26%	0.258	C	S	.	.	H	α-helix	trans	-57.8	-50.7	175.2	-70.2	165.2	0	0	0	109.9	N862 Y868 L869 E870 L889 L892 Y893 E896	N862-I866 WeakPolarHBondContact O-CB 3.27Å; N862-I866 VanDerWaalsContact O-CG1 3.22Å; N862-I866 WeakPolarHBondContact O-CG1 3.5Å; N862-I866 PolarHBondContact O-N 2.93Å; I866-Y868 VanDerWaalsContact C-N 3.32Å; I866-Y868 PolarHBondContact O-N 3.27Å; I866-L869 PolarHBondContact O-N 3.07Å; I866-L869 VanDerWaalsContact O-N 3.1Å; I866-E870 HydrophobicContact CG2-CG 4.06Å; I866-E870 WeakPolarHBondContact O-CB 3.46Å; I866-E870 WeakPolarHBondContact O-CG 3.14Å; I866-E870 PolarHBondContact O-N 2.96Å; I866-L889 HydrophobicContact CG1-CD1 4.45Å; I866-L889 HydrophobicContact CG2-CD1 4.39Å; I866-L892 HydrophobicContact CG1-CB 4.16Å; I866-L892 HydrophobicContact CG1-CD1 4.2Å; I866-Y893 HydrophobicContact CG2-CE1 3.9Å; I866-E896 VanDerWaalsContact CD1-CD 3.43Å; I866-E896 HydrophobicContact CD1-CG 4.29Å; I866-E896 WeakPolarHBondContact CD1-OE1 3.41Å
867	R	82.4	Confident	76.7	Confident	97 Å²	97	55.7 Å²	55.7	37%	0.366	28%	0.276	S	S	.	.	H	α-helix	trans	-57.2	-41.2	179.2	-179.6	179.2	164.7	-138.4	-3.9	113.4	N839 N863 Q864 D871	N839-R867 PolarHBondContact OD1-NH2 3.23Å; N863-R867 WeakPolarHBondContact O-CB 3.31Å; N863-R867 PolarHBondContact O-N 3.35Å; Q864-R867 VanDerWaalsContact OE1-NH1 3.07Å; R867-D871 PolarHBondContact O-N 2.84Å
868	Y	81.2	Confident	75.4	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-67.6	-45.7	175.2	178.8	-103.5	0	0	0	111.7	C841 L842 L853 I857 Q864 A865 I866 D871 T872	C841-Y868 HydrophobicContact CB-CD2 3.85Å; C841-Y868 HydrophobicContact CB-CE2 3.39Å; L842-Y868 HydrophobicContact CD2-CD2 4.19Å; L842-Y868 HydrophobicContact CG-CD2 4.44Å; L853-Y868 WeakPolarHBondContact CD1-OH 3.27Å; I857-Y868 HydrophobicContact CD1-CD1 3.64Å; I857-Y868 HydrophobicContact CD1-CE1 3.44Å; I857-Y868 VanDerWaalsContact CD1-CE1 3.44Å; I857-Y868 HydrophobicContact CG1-CD1 4.09Å; I857-Y868 HydrophobicContact CG1-CE1 4.2Å; Q864-Y868 PolarHBondContact O-N 2.96Å; A865-Y868 PolarHBondContact O-N 2.98Å; I866-Y868 VanDerWaalsContact C-N 3.32Å; I866-Y868 PolarHBondContact O-N 3.27Å; Y868-D871 PolarHBondContact O-N 3.27Å; Y868-T872 HydrophobicContact CD1-CG2 3.98Å; Y868-T872 HydrophobicContact CD2-CG2 4.26Å; Y868-T872 HydrophobicContact CE1-CG2 3.54Å; Y868-T872 HydrophobicContact CE2-CG2 3.84Å; Y868-T872 HydrophobicContact CG-CG2 4.33Å; Y868-T872 VanDerWaalsContact CZ-CG2 3.49Å; Y868-T872 WeakPolarHBondContact O-CG2 3.28Å; Y868-T872 PolarHBondContact O-N 3.28Å; Y868-T872 PolarHBondContact O-OG1 3.36Å
869	L	79.7	Confident	74.2	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-66.7	-42	-177.7	-68.5	169.4	0	0	0	112.3	A865 I866 T872 I873 I885 M888 L889 L892	A865-L869 WeakPolarHBondContact O-CB 3.39Å; A865-L869 WeakPolarHBondContact O-CG 3.26Å; A865-L869 PolarHBondContact O-N 3.4Å; I866-L869 PolarHBondContact O-N 3.07Å; I866-L869 VanDerWaalsContact O-N 3.1Å; L869-T872 WeakPolarHBondContact CA-OG1 3.38Å; L869-T872 PolarHBondContact O-N 3.29Å; L869-T872 PolarHBondContact O-OG1 2.88Å; L869-I873 WeakPolarHBondContact O-CD1 3.45Å; L869-I873 WeakPolarHBondContact O-CG1 3.44Å; L869-I873 PolarHBondContact O-N 3.24Å; L869-I885 HydrophobicContact CD2-CG2 3.7Å; L869-M888 HydrophobicContact CD1-CE 3.97Å; L869-M888 HydrophobicContact CD1-CG 4.27Å; L869-M888 HydrophobicContact CD2-CE 3.83Å; L869-M888 HydrophobicContact CG-CE 4.41Å; L869-L889 HydrophobicContact CB-CB 4.33Å; L869-L889 HydrophobicContact CB-CD1 3.97Å; L869-L889 HydrophobicContact CB-CD2 4.5Å; L869-L889 HydrophobicContact CB-CG 4.5Å; L869-L889 HydrophobicContact CD1-CB 4.2Å; L869-L889 HydrophobicContact CD1-CD1 4.26Å; L869-L892 HydrophobicContact CD1-CD1 3.61Å
870	E	81	Confident	73	Confident	77 Å²	77	57.1 Å²	57.1	36%	0.36	29%	0.287	S	S	.	.	H	α-helix	trans	-57.4	-49.4	174.6	-75	177.8	137.1	0	0	111.3	I866 T872 I873 E874 L889 Y893	I866-E870 HydrophobicContact CG2-CG 4.06Å; I866-E870 WeakPolarHBondContact O-CB 3.46Å; I866-E870 WeakPolarHBondContact O-CG 3.14Å; I866-E870 PolarHBondContact O-N 2.96Å; E870-T872 PolarHBondContact O-N 3.49Å; E870-I873 PolarHBondContact O-N 2.91Å; E870-I873 VanDerWaalsContact O-N 3.11Å; E870-E874 WeakPolarHBondContact O-CG 3.4Å; E870-E874 PolarHBondContact O-N 3.26Å; E870-L889 HydrophobicContact CG-CD2 4.49Å; E870-Y893 VanDerWaalsContact CD-OH 3.29Å; E870-Y893 VanDerWaalsContact CG-OH 3.23Å; E870-Y893 WeakPolarHBondContact CG-OH 3.43Å; E870-Y893 PolarHBondContact OE1-OH 3.35Å
871	D	77.6	Confident	72	Confident	33 Å²	33	60.8 Å²	60.8	18%	0.176	31%	0.313	C	S	.	.	H	α-helix	trans	-65.5	-37.4	178	-176.3	85.1	0	0	0	112.4	L842 N845 R867 Y868 I873 E874 K875	L842-D871 HydrophobicContact CD2-CB 3.25Å; L842-D871 WeakPolarHBondContact CD2-OD2 3.47Å; N845-D871 PolarHBondContact ND2-OD2 3.04Å; R867-D871 PolarHBondContact O-N 2.84Å; Y868-D871 PolarHBondContact O-N 3.27Å; D871-I873 VanDerWaalsContact C-N 3.26Å; D871-I873 PolarHBondContact O-N 3.33Å; D871-E874 PolarHBondContact O-N 3.23Å; D871-K875 WeakPolarHBondContact O-CB 3.33Å; D871-K875 PolarHBondContact O-N 3.02Å; D871-K875 WeakPolarHBondContact OD1-CE 3.27Å; D871-K875 IonicContact OD1-NZ 2.59Å; D871-K875 PolarHBondContact OD1-NZ 3.24Å; D871-K875 WeakPolarHBondContact OD2-CD 3.4Å; D871-K875 WeakPolarHBondContact OD2-CE 3.11Å; D871-K875 IonicContact OD2-NZ 3.36Å; D871-K875 PolarHBondContact OD2-NZ 2.82Å
872	T	74.8	Confident	71.4	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-62.6	-34.7	173.3	64.2	0	0	0	0	111.9	N845 Y868 L869 E870 Y876	N845-T872 WeakPolarHBondContact ND2-CA 3.36Å; N845-T872 WeakPolarHBondContact OD1-CG2 3.47Å; Y868-T872 HydrophobicContact CD1-CG2 3.98Å; Y868-T872 HydrophobicContact CD2-CG2 4.26Å; Y868-T872 HydrophobicContact CE1-CG2 3.54Å; Y868-T872 HydrophobicContact CE2-CG2 3.84Å; Y868-T872 HydrophobicContact CG-CG2 4.33Å; Y868-T872 VanDerWaalsContact CZ-CG2 3.49Å; Y868-T872 WeakPolarHBondContact O-CG2 3.28Å; Y868-T872 PolarHBondContact O-N 3.28Å; Y868-T872 PolarHBondContact O-OG1 3.36Å; L869-T872 WeakPolarHBondContact CA-OG1 3.38Å; L869-T872 PolarHBondContact O-N 3.29Å; L869-T872 PolarHBondContact O-OG1 2.88Å; E870-T872 PolarHBondContact O-N 3.49Å; T872-Y876 WeakPolarHBondContact O-CB 3.38Å; T872-Y876 VanDerWaalsContact O-CD2 3.26Å; T872-Y876 WeakPolarHBondContact O-CD2 3.46Å; T872-Y876 PolarHBondContact O-N 2.52Å
873	I	75.1	Confident	71.3	Confident	27 Å²	27	61.1 Å²	61.1	14%	0.138	31%	0.309	C	S	.	.	H	α-helix	trans	-80.4	-36.8	179.8	-70.8	155.4	0	0	0	111.2	L869 E870 D871 I885 L889 Y909	L869-I873 WeakPolarHBondContact O-CD1 3.45Å; L869-I873 WeakPolarHBondContact O-CG1 3.44Å; L869-I873 PolarHBondContact O-N 3.24Å; E870-I873 PolarHBondContact O-N 2.91Å; E870-I873 VanDerWaalsContact O-N 3.11Å; D871-I873 VanDerWaalsContact C-N 3.26Å; D871-I873 PolarHBondContact O-N 3.33Å; I873-I885 HydrophobicContact CD1-CG2 4.17Å; I873-I885 HydrophobicContact CG1-CG2 4.21Å; I873-L889 HydrophobicContact CD1-CB 4.3Å; I873-L889 HydrophobicContact CD1-CD2 3.33Å; I873-L889 HydrophobicContact CD1-CG 4.44Å; I873-Y909 HydrophobicContact CD1-CE2 4.07Å; I873-Y909 WeakPolarHBondContact CD1-OH 3.26Å; I873-Y909 HydrophobicContact CG2-CE2 4.16Å
874	E	72.1	Confident	71.2	Confident	112 Å²	112	58 Å²	58	52%	0.523	30%	0.298	S	S	.	.	H	α-helix	trans	-69.9	-33.1	178.7	-75.4	-171.8	156.2	0	0	113.7	E870 D871 K912	E870-E874 WeakPolarHBondContact O-CG 3.4Å; E870-E874 PolarHBondContact O-N 3.26Å; D871-E874 PolarHBondContact O-N 3.23Å; E874-K912 IonicContact OE1-NZ 3.82Å; E874-K912 PolarHBondContact OE1-NZ 3.36Å
875	K	63.9	Low	71	Confident	100 Å²	100	57.6 Å²	57.6	44%	0.435	30%	0.297	S	S	.	.	H	α-helix	trans	-83.6	-28.4	178.4	-72.6	176.4	179.9	152.7	0	113.9	L842 N845 D871	L842-K875 PolarHBondContact O-NZ 3.11Å; N845-K875 HydrophobicContact CB-CD 4.4Å; D871-K875 WeakPolarHBondContact O-CB 3.33Å; D871-K875 PolarHBondContact O-N 3.02Å; D871-K875 WeakPolarHBondContact OD1-CE 3.27Å; D871-K875 IonicContact OD1-NZ 2.59Å; D871-K875 PolarHBondContact OD1-NZ 3.24Å; D871-K875 WeakPolarHBondContact OD2-CD 3.4Å; D871-K875 WeakPolarHBondContact OD2-CE 3.11Å; D871-K875 IonicContact OD2-NZ 3.36Å; D871-K875 PolarHBondContact OD2-NZ 2.82Å
876	Y	59	Low	71	Confident	72 Å²	72	58.4 Å²	58.4	28%	0.282	30%	0.3	S	S	.	.			trans	-100.6	37	-176.5	-75.3	-84.1	0	0	0	113.9	N845 N846 T872 N878 D879	N845-Y876 WeakPolarHBondContact O-CE2 3.45Å; N845-Y876 PolarHBondContact O-OH 3.48Å; N846-Y876 WeakPolarHBondContact CA-OH 3.47Å; T872-Y876 WeakPolarHBondContact O-CB 3.38Å; T872-Y876 VanDerWaalsContact O-CD2 3.26Å; T872-Y876 WeakPolarHBondContact O-CD2 3.46Å; T872-Y876 PolarHBondContact O-N 2.52Å; Y876-N878 PolarHBondContact O-N 2.84Å; Y876-D879 PolarHBondContact O-N 3.11Å
877	T	54.4	Low	71.2	Confident	76 Å²	76	59.5 Å²	59.5	47%	0.466	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-9	175.2	54.3	0	0	0	0	114.4
878	N	51.2	Low	71.3	Confident	126 Å²	126	56.1 Å²	56.1	67%	0.674	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-7.4	-173.7	-67.4	-13.7	0	0	0	115.4	Y876 K973	Y876-N878 PolarHBondContact O-N 2.84Å; N878-K973 PolarHBondContact O-NZ 3.07Å
879	D	52.3	Low	71.4	Confident	92 Å²	92	55.9 Å²	55.9	49%	0.492	29%	0.293	S	S	.	.			trans	-131.6	92.6	176.3	-80.2	-25.3	0	0	0	111.3	Y876 S881 K973	Y876-D879 PolarHBondContact O-N 3.11Å; D879-S881 PolarHBondContact O-N 3.44Å; D879-K973 IonicContact OD1-NZ 3.5Å; D879-K973 PolarHBondContact OD1-NZ 2.85Å
880	I	54.4	Low	71.7	Confident	81 Å²	81	55.8 Å²	55.8	42%	0.415	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	15.3	-176	-60.5	158.7	0	0	0	112.8	P991	I880-P991 HydrophobicContact CG2-CB 4.19Å
881	S	58.6	Low	71.9	Confident	87 Å²	87	53.5 Å²	53.5	61%	0.608	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-18.3	-156.7	60.5	0	0	0	0	116.9	D879 Q883	D879-S881 PolarHBondContact O-N 3.44Å; S881-Q883 PolarHBondContact O-N 3.43Å
882	N	69.3	Low	72.3	Confident	56 Å²	56	53.1 Å²	53.1	30%	0.299	28%	0.282	S	S	.	.			trans	-102.2	76.3	-170.8	-78.7	-35.8	0	0	0	114.3	N851 A884 I885 H886	N851-N882 PolarHBondContact ND2-OD1 3.39Å; N882-A884 PolarHBondContact O-N 3.16Å; N882-I885 HydrophobicContact CB-CD1 3.59Å; N882-I885 HydrophobicContact CB-CG1 4.04Å; N882-I885 PolarHBondContact O-N 2.95Å; N882-I885 VanDerWaalsContact O-N 3.11Å; N882-H886 PolarHBondContact O-CD2 2.85Å
883	Q	78.6	Confident	72.8	Confident	96 Å²	96	53.3 Å²	53.3	45%	0.449	28%	0.282	S	S	.	.	H	α-helix	trans	-47.6	-36.2	175.6	-176.2	-179	-28.8	0	0	114.5	S881 I885 H886 H887 P991	S881-Q883 PolarHBondContact O-N 3.43Å; Q883-I885 PolarHBondContact O-N 3.3Å; Q883-H886 PolarHBondContact O-N 2.94Å; Q883-H887 PolarHBondContact NE2-CE1 3.36Å; Q883-H887 WeakPolarHBondContact O-CB 3.41Å; Q883-H887 VanDerWaalsContact O-CG 3.29Å; Q883-H887 PolarHBondContact O-N 2.96Å; Q883-P991 WeakPolarHBondContact CA-O 3.39Å
884	A	79.7	Confident	73.2	Confident	44 Å²	44	52 Å²	52	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-64.2	-35.6	-178	0	0	0	0	0	113.8	L854 N882 H887 M888	L854-A884 HydrophobicContact CD1-CB 3.84Å; N882-A884 PolarHBondContact O-N 3.16Å; A884-H887 PolarHBondContact O-N 2.92Å; A884-M888 WeakPolarHBondContact O-CB 3.44Å; A884-M888 PolarHBondContact O-N 3.27Å
885	I	79.9	Confident	73.7	Confident	13 Å²	13	51.1 Å²	51.1	7%	0.067	28%	0.275	C	S	.	.	H	α-helix	trans	-68.7	-46.4	179.3	-60.1	172.1	0	0	0	109.5	L869 I873 N882 Q883 H887 M888 L889	L869-I885 HydrophobicContact CD2-CG2 3.7Å; I873-I885 HydrophobicContact CD1-CG2 4.17Å; I873-I885 HydrophobicContact CG1-CG2 4.21Å; N882-I885 HydrophobicContact CB-CD1 3.59Å; N882-I885 HydrophobicContact CB-CG1 4.04Å; N882-I885 PolarHBondContact O-N 2.95Å; N882-I885 VanDerWaalsContact O-N 3.11Å; Q883-I885 PolarHBondContact O-N 3.3Å; I885-H887 VanDerWaalsContact C-N 3.35Å; I885-H887 PolarHBondContact O-N 2.84Å; I885-M888 PolarHBondContact O-N 2.87Å; I885-L889 PolarHBondContact O-N 3.19Å
886	H	82.7	Confident	74.5	Confident	21 Å²	21	48.1 Å²	48.1	10%	0.097	26%	0.262	C	S	.	.	H	α-helix	trans	-60.6	-45.4	175.9	-68.1	-81.4	0	0	0	110.9	N882 Q883 M888 L889 I890 Y909 P991	N882-H886 PolarHBondContact O-CD2 2.85Å; Q883-H886 PolarHBondContact O-N 2.94Å; H886-M888 VanDerWaalsContact C-N 3.35Å; H886-M888 PolarHBondContact O-N 3.07Å; H886-L889 PolarHBondContact O-N 2.94Å; H886-I890 VanDerWaalsContact O-CB 3.3Å; H886-I890 WeakPolarHBondContact O-CB 3.18Å; H886-I890 WeakPolarHBondContact O-CD1 3.43Å; H886-I890 WeakPolarHBondContact O-CG1 3.46Å; H886-I890 PolarHBondContact O-N 3.33Å; H886-Y909 PolarHBondContact CE1-OH 3.36Å; H886-Y909 AromaticContact ND1-CZ 3.92Å; H886-Y909 PolarHBondContact ND1-OH 2.85Å; H886-P991 PolarHBondContact CD2-O 3.17Å; H886-P991 WeakPolarHBondContact NE2-CB 3.27Å
887	H	87.1	Confident	75.5	Confident	28 Å²	28	46.2 Å²	46.2	13%	0.13	26%	0.255	C	S	.	.	H	α-helix	trans	-60.3	-42.1	176.1	-73.2	-171.9	0	0	0	112.6	Q883 A884 I885 I890 S891 D993 Y996	Q883-H887 PolarHBondContact NE2-CE1 3.36Å; Q883-H887 WeakPolarHBondContact O-CB 3.41Å; Q883-H887 VanDerWaalsContact O-CG 3.29Å; Q883-H887 PolarHBondContact O-N 2.96Å; A884-H887 PolarHBondContact O-N 2.92Å; I885-H887 VanDerWaalsContact C-N 3.35Å; I885-H887 PolarHBondContact O-N 2.84Å; H887-I890 PolarHBondContact O-N 3.07Å; H887-S891 WeakPolarHBondContact O-CB 3.42Å; H887-S891 PolarHBondContact O-N 3.31Å; H887-S891 PolarHBondContact O-OG 2.56Å; H887-D993 PolarHBondContact NE2-N 3.16Å; H887-D993 VanDerWaalsContact NE2-N 3.17Å; H887-Y996 HydrophobicContact CB-CD1 4.25Å; H887-Y996 HydrophobicContact CB-CE1 3.85Å; H887-Y996 AromaticContact CD2-CD1 3.49Å; H887-Y996 VanDerWaalsContact CD2-CD1 3.49Å; H887-Y996 WeakPolarHBondContact CD2-CD1 3.31Å; H887-Y996 AromaticContact CD2-CE1 3.96Å; H887-Y996 AromaticContact CE1-CD1 3.74Å; H887-Y996 AromaticContact CE1-CG 3.71Å; H887-Y996 AromaticContact CG-CD1 3.7Å; H887-Y996 AromaticContact CG-CE1 3.83Å; H887-Y996 AromaticContact ND1-CD1 3.9Å; H887-Y996 AromaticContact NE2-CD1 3.52Å; H887-Y996 AromaticContact NE2-CG 3.86Å
888	M	84.3	Confident	76.6	Confident	26 Å²	26	48.5 Å²	48.5	13%	0.128	26%	0.26	C	S	.	.	H	α-helix	trans	-65.3	-45.5	177.5	-166.1	157.5	74.2	0	0	112.1	L854 I857 M858 L869 A884 I885 H886 S891 L892	L854-M888 HydrophobicContact CD2-CE 3.23Å; L854-M888 HydrophobicContact CD2-SD 3.87Å; I857-M888 HydrophobicContact CB-CE 3.86Å; I857-M888 HydrophobicContact CD1-CE 4.23Å; I857-M888 HydrophobicContact CG2-CE 3.48Å; I857-M888 VanDerWaalsContact CG2-CE 3.48Å; M858-M888 HydrophobicContact CG-SD 3.95Å; L869-M888 HydrophobicContact CD1-CE 3.97Å; L869-M888 HydrophobicContact CD1-CG 4.27Å; L869-M888 HydrophobicContact CD2-CE 3.83Å; L869-M888 HydrophobicContact CG-CE 4.41Å; A884-M888 WeakPolarHBondContact O-CB 3.44Å; A884-M888 PolarHBondContact O-N 3.27Å; I885-M888 PolarHBondContact O-N 2.87Å; H886-M888 VanDerWaalsContact C-N 3.35Å; H886-M888 PolarHBondContact O-N 3.07Å; M888-S891 PolarHBondContact O-N 3.2Å; M888-S891 PolarHBondContact O-OG 3.41Å; M888-L892 HydrophobicContact CG-CD1 4.47Å; M888-L892 WeakPolarHBondContact O-CG 3.21Å; M888-L892 PolarHBondContact O-N 3.17Å
889	L	84.7	Confident	77.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.4	-44	176.9	-175.8	60.7	0	0	0	111.9	I866 L869 E870 I873 I885 H886 S891 L892 Y893 Y909	I866-L889 HydrophobicContact CG1-CD1 4.45Å; I866-L889 HydrophobicContact CG2-CD1 4.39Å; L869-L889 HydrophobicContact CB-CB 4.33Å; L869-L889 HydrophobicContact CB-CD1 3.97Å; L869-L889 HydrophobicContact CB-CD2 4.5Å; L869-L889 HydrophobicContact CB-CG 4.5Å; L869-L889 HydrophobicContact CD1-CB 4.2Å; L869-L889 HydrophobicContact CD1-CD1 4.26Å; E870-L889 HydrophobicContact CG-CD2 4.49Å; I873-L889 HydrophobicContact CD1-CB 4.3Å; I873-L889 HydrophobicContact CD1-CD2 3.33Å; I873-L889 HydrophobicContact CD1-CG 4.44Å; I885-L889 PolarHBondContact O-N 3.19Å; H886-L889 PolarHBondContact O-N 2.94Å; L889-S891 VanDerWaalsContact C-N 3.31Å; L889-S891 PolarHBondContact O-N 3.11Å; L889-L892 PolarHBondContact O-N 2.94Å; L889-Y893 HydrophobicContact CD1-CD2 4.32Å; L889-Y893 HydrophobicContact CD1-CE1 3.97Å; L889-Y893 HydrophobicContact CD1-CE2 3.78Å; L889-Y893 HydrophobicContact CD2-CE2 3.81Å; L889-Y893 HydrophobicContact CG-CD2 4Å; L889-Y893 HydrophobicContact CG-CE2 3.54Å; L889-Y893 PolarHBondContact O-N 2.75Å; L889-Y909 HydrophobicContact CD2-CD2 3.98Å; L889-Y909 HydrophobicContact CD2-CE1 4.37Å; L889-Y909 HydrophobicContact CD2-CE2 3.43Å; L889-Y909 VanDerWaalsContact CD2-CE2 3.43Å
890	I	85.7	Confident	78.6	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.6	-41.4	177.4	-68.7	167.9	0	0	0	110.4	H886 H887 Y893 A894 L906 Y909 L910 Y992 V997 L1000	H886-I890 VanDerWaalsContact O-CB 3.3Å; H886-I890 WeakPolarHBondContact O-CB 3.18Å; H886-I890 WeakPolarHBondContact O-CD1 3.43Å; H886-I890 WeakPolarHBondContact O-CG1 3.46Å; H886-I890 PolarHBondContact O-N 3.33Å; H887-I890 PolarHBondContact O-N 3.07Å; I890-Y893 PolarHBondContact O-N 2.65Å; I890-A894 VanDerWaalsContact O-CB 3.27Å; I890-A894 WeakPolarHBondContact O-CB 3.31Å; I890-A894 PolarHBondContact O-N 2.72Å; I890-L906 HydrophobicContact CG2-CD1 3.95Å; I890-Y909 HydrophobicContact CD1-CE1 4.27Å; I890-Y909 HydrophobicContact CG1-CD1 4.08Å; I890-Y909 HydrophobicContact CG1-CE1 3.84Å; I890-L910 HydrophobicContact CD1-CD2 4.37Å; I890-Y992 HydrophobicContact CD1-CD1 4.15Å; I890-Y992 HydrophobicContact CD1-CG 4.01Å; I890-V997 HydrophobicContact CD1-CG2 3.8Å; I890-V997 HydrophobicContact CG2-CG2 4.34Å; I890-L1000 HydrophobicContact CG2-CD2 3.6Å
891	S	85.3	Confident	79.3	Confident	29 Å²	29	51 Å²	51	20%	0.203	27%	0.269	C	S	.	.	H	α-helix	trans	-66.7	-36.6	175.1	69.7	0	0	0	0	113.9	H887 M888 L889 A894 N895	H887-S891 WeakPolarHBondContact O-CB 3.42Å; H887-S891 PolarHBondContact O-N 3.31Å; H887-S891 PolarHBondContact O-OG 2.56Å; M888-S891 PolarHBondContact O-N 3.2Å; M888-S891 PolarHBondContact O-OG 3.41Å; L889-S891 VanDerWaalsContact C-N 3.31Å; L889-S891 PolarHBondContact O-N 3.11Å; S891-A894 PolarHBondContact O-N 3.08Å; S891-N895 WeakPolarHBondContact O-CB 3.41Å; S891-N895 PolarHBondContact O-N 2.7Å
892	L	84.9	Confident	79.6	Confident	24 Å²	24	54.6 Å²	54.6	13%	0.126	28%	0.282	C	S	.	.	H	α-helix	trans	-66	-43.3	174.2	-71.7	171.5	0	0	0	110.9	A865 I866 L869 M888 L889 N895 E896	A865-L892 HydrophobicContact CB-CD1 4.05Å; I866-L892 HydrophobicContact CG1-CB 4.16Å; I866-L892 HydrophobicContact CG1-CD1 4.2Å; L869-L892 HydrophobicContact CD1-CD1 3.61Å; M888-L892 HydrophobicContact CG-CD1 4.47Å; M888-L892 WeakPolarHBondContact O-CG 3.21Å; M888-L892 PolarHBondContact O-N 3.17Å; L889-L892 PolarHBondContact O-N 2.94Å; L892-N895 PolarHBondContact O-N 3.27Å; L892-E896 PolarHBondContact O-N 3.29Å
893	Y	85.3	Confident	79.5	Confident	9 Å²	9	53.6 Å²	53.6	4%	0.035	28%	0.277	C	S	.	.	H	α-helix	trans	-65.6	-38.8	173.6	-70.2	-28.9	0	0	0	113.3	I866 E870 L889 I890 N895 E896 Y897 R905 Y909	I866-Y893 HydrophobicContact CG2-CE1 3.9Å; E870-Y893 VanDerWaalsContact CD-OH 3.29Å; E870-Y893 VanDerWaalsContact CG-OH 3.23Å; E870-Y893 WeakPolarHBondContact CG-OH 3.43Å; E870-Y893 PolarHBondContact OE1-OH 3.35Å; L889-Y893 HydrophobicContact CD1-CD2 4.32Å; L889-Y893 HydrophobicContact CD1-CE1 3.97Å; L889-Y893 HydrophobicContact CD1-CE2 3.78Å; L889-Y893 HydrophobicContact CD2-CE2 3.81Å; L889-Y893 HydrophobicContact CG-CD2 4Å; L889-Y893 HydrophobicContact CG-CE2 3.54Å; L889-Y893 PolarHBondContact O-N 2.75Å; I890-Y893 PolarHBondContact O-N 2.65Å; Y893-N895 VanDerWaalsContact C-N 3.33Å; Y893-E896 PolarHBondContact O-N 3.19Å; Y893-Y897 WeakPolarHBondContact O-CB 3.23Å; Y893-Y897 PolarHBondContact O-N 3.46Å; Y893-R905 HydrophobicContact CD1-CB 4.23Å; Y893-R905 HydrophobicContact CE1-CB 4.34Å; Y893-Y909 HydrophobicContact CD2-CG 4.26Å; Y893-Y909 HydrophobicContact CE2-CD1 4.4Å; Y893-Y909 AromaticContact CE2-CD2 3.98Å; Y893-Y909 HydrophobicContact CE2-CD2 3.98Å; Y893-Y909 AromaticContact CE2-CG 3.79Å; Y893-Y909 HydrophobicContact CE2-CG 3.79Å
894	A	83.5	Confident	79.2	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.008	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-38.1	175.8	0	0	0	0	0	111.7	I890 S891 Y897 H898 L1000 V1004	I890-A894 VanDerWaalsContact O-CB 3.27Å; I890-A894 WeakPolarHBondContact O-CB 3.31Å; I890-A894 PolarHBondContact O-N 2.72Å; S891-A894 PolarHBondContact O-N 3.08Å; A894-Y897 PolarHBondContact O-N 3.38Å; A894-H898 WeakPolarHBondContact O-CB 3.44Å; A894-H898 PolarHBondContact O-N 3Å; A894-L1000 HydrophobicContact CB-CD1 4.26Å; A894-L1000 HydrophobicContact CB-CD2 3.51Å; A894-L1000 HydrophobicContact CB-CG 3.81Å; A894-V1004 HydrophobicContact CB-CG2 4.2Å
895	N	83	Confident	79.2	Confident	93 Å²	93	54.1 Å²	54.1	50%	0.497	27%	0.269	S	S	.	.	H	α-helix	trans	-66.5	-40.2	172.2	-80.2	-21.3	0	0	0	112.2	S891 L892 Y893 H898 L899	S891-N895 WeakPolarHBondContact O-CB 3.41Å; S891-N895 PolarHBondContact O-N 2.7Å; L892-N895 PolarHBondContact O-N 3.27Å; Y893-N895 VanDerWaalsContact C-N 3.33Å; N895-H898 PolarHBondContact O-N 3.16Å; N895-L899 WeakPolarHBondContact O-CD1 3.25Å; N895-L899 WeakPolarHBondContact O-CG 3.37Å; N895-L899 PolarHBondContact O-N 3.26Å; N895-L899 VanDerWaalsContact O-N 3.1Å
896	E	80.5	Confident	79.4	Confident	36 Å²	36	53.6 Å²	53.6	17%	0.168	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-40.6	173.1	-73.2	-162.1	153.2	0	0	111.8	I866 L892 Y893 L899 N900 R905	I866-E896 VanDerWaalsContact CD1-CD 3.43Å; I866-E896 HydrophobicContact CD1-CG 4.29Å; I866-E896 WeakPolarHBondContact CD1-OE1 3.41Å; L892-E896 PolarHBondContact O-N 3.29Å; Y893-E896 PolarHBondContact O-N 3.19Å; E896-L899 PolarHBondContact O-N 2.93Å; E896-N900 PolarHBondContact O-N 2.94Å; E896-R905 IonicContact OE1-NH1 3.09Å; E896-R905 IonicContact OE2-CZ 3.8Å; E896-R905 VanDerWaalsContact OE2-CZ 3.23Å; E896-R905 IonicContact OE2-NE 2.91Å; E896-R905 IonicContact OE2-NH1 3.18Å; E896-R905 PolarHBondContact OE2-NH1 3.31Å; E896-R905 IonicContact OE2-NH2 3.52Å
897	Y	80.4	Confident	79.4	Confident	33 Å²	33	53.2 Å²	53.2	13%	0.129	27%	0.265	C	S	.	.	H	α-helix	trans	-67.3	-39.1	175.9	-177	-87	0	0	0	112.4	Y893 A894 L899 N900 H901 V1004 H1006	Y893-Y897 WeakPolarHBondContact O-CB 3.23Å; Y893-Y897 PolarHBondContact O-N 3.46Å; A894-Y897 PolarHBondContact O-N 3.38Å; Y897-L899 PolarHBondContact O-N 3.2Å; Y897-N900 CarbonylContact O-C 3.5Å; Y897-N900 PolarHBondContact O-N 3.28Å; Y897-H901 AromaticContact CE1-ND1 3.5Å; Y897-H901 WeakPolarHBondContact CE1-ND1 3.38Å; Y897-H901 WeakPolarHBondContact CE2-O 3.35Å; Y897-H901 AromaticContact CZ-ND1 3.95Å; Y897-H901 WeakPolarHBondContact O-CA 3.32Å; Y897-H901 PolarHBondContact O-N 3.09Å; Y897-H901 VanDerWaalsContact O-N 3.13Å; Y897-V1004 HydrophobicContact CD1-CG1 3.48Å; Y897-V1004 VanDerWaalsContact CD1-CG1 3.48Å; Y897-V1004 HydrophobicContact CE1-CG1 4.14Å; Y897-V1004 HydrophobicContact CG-CG1 4.43Å; Y897-H1006 AromaticContact CD2-CD2 3.9Å; Y897-H1006 HydrophobicContact CE1-CB 4.25Å; Y897-H1006 AromaticContact CE1-CD2 3.86Å; Y897-H1006 AromaticContact CE2-CD2 3.63Å; Y897-H1006 AromaticContact CZ-CD2 3.59Å
898	H	77.9	Confident	79.1	Confident	123 Å²	123	58.8 Å²	58.8	57%	0.569	29%	0.289	S	S	*	.	H	α-helix	trans	-62.7	-32.5	174.3	-176.8	-68.4	0	0	0	111.7	A894 N895 V1004	A894-H898 WeakPolarHBondContact O-CB 3.44Å; A894-H898 PolarHBondContact O-N 3Å; N895-H898 PolarHBondContact O-N 3.16Å; H898-V1004 HydrophobicContact CB-CG1 4.2Å
899	L	73.8	Confident	79.1	Confident	128 Å²	128	58.3 Å²	58.3	67%	0.67	29%	0.286	S	S	*	.	H	α-helix	trans	-78.7	-37.8	174	-72	161.8	0	0	0	111.8	N895 E896 Y897	N895-L899 WeakPolarHBondContact O-CD1 3.25Å; N895-L899 WeakPolarHBondContact O-CG 3.37Å; N895-L899 PolarHBondContact O-N 3.26Å; N895-L899 VanDerWaalsContact O-N 3.1Å; E896-L899 PolarHBondContact O-N 2.93Å; Y897-L899 PolarHBondContact O-N 3.2Å
900	N	72.2	Confident	79	Confident	102 Å²	102	58.3 Å²	58.3	55%	0.545	29%	0.286	S	S	.	.			trans	-135.9	91.9	-175.4	-67.9	-30.7	0	0	0	110.8	E896 Y897 N902 D903	E896-N900 PolarHBondContact O-N 2.94Å; Y897-N900 CarbonylContact O-C 3.5Å; Y897-N900 PolarHBondContact O-N 3.28Å; N900-N902 PolarHBondContact O-N 3.21Å; N900-D903 PolarHBondContact O-N 3.3Å; N900-D903 VanDerWaalsContact O-N 3.07Å
901	H	67.9	Low	78.8	Confident	121 Å²	121	62.6 Å²	62.6	56%	0.56	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-5.9	178.3	-73.5	-61.2	0	0	0	115.9	Y897	Y897-H901 AromaticContact CE1-ND1 3.5Å; Y897-H901 WeakPolarHBondContact CE1-ND1 3.38Å; Y897-H901 WeakPolarHBondContact CE2-O 3.35Å; Y897-H901 AromaticContact CZ-ND1 3.95Å; Y897-H901 WeakPolarHBondContact O-CA 3.32Å; Y897-H901 PolarHBondContact O-N 3.09Å; Y897-H901 VanDerWaalsContact O-N 3.13Å
902	N	65.8	Low	78.4	Confident	163 Å²	163	66.6 Å²	66.6	87%	0.872	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-7	179.3	-68.3	-14.9	0	0	0	113.3	N900 D904	N900-N902 PolarHBondContact O-N 3.21Å; N902-D904 PolarHBondContact O-N 3.38Å
903	D	65.4	Low	78	Confident	36 Å²	36	66.5 Å²	66.5	19%	0.193	32%	0.32	C	S	.	.			trans	-94.1	87	-171.8	-145.5	-23.2	0	0	0	112.1	N900 R905	N900-D903 PolarHBondContact O-N 3.3Å; N900-D903 VanDerWaalsContact O-N 3.07Å; D903-R905 VanDerWaalsContact CG-NE 3.32Å; D903-R905 PolarHBondContact O-N 3.37Å; D903-R905 VanDerWaalsContact OD1-CG 3.27Å; D903-R905 WeakPolarHBondContact OD1-CG 3.31Å; D903-R905 IonicContact OD1-CZ 3.48Å; D903-R905 IonicContact OD1-NE 2.82Å; D903-R905 PolarHBondContact OD1-NE 3.34Å; D903-R905 IonicContact OD1-NH2 3.9Å; D903-R905 IonicContact OD2-CZ 2.65Å; D903-R905 IonicContact OD2-NE 3.68Å; D903-R905 PolarHBondContact OD2-NE 3.23Å; D903-R905 VanDerWaalsContact OD2-NE 3.09Å; D903-R905 IonicContact OD2-NH2 2.66Å; D903-R905 PolarHBondContact OD2-NH2 3.23Å
904	D	72.8	Confident	77.5	Confident	56 Å²	56	66.1 Å²	66.1	30%	0.299	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	18.3	178.6	-98.2	-12.3	0	0	0	113.3	N902 L906 M907 K908 K1008	N902-D904 PolarHBondContact O-N 3.38Å; D904-L906 PolarHBondContact O-N 3.41Å; D904-M907 PolarHBondContact O-N 2.9Å; D904-M907 VanDerWaalsContact O-N 3.15Å; D904-K908 WeakPolarHBondContact O-CG 3.4Å; D904-K908 PolarHBondContact O-N 3.12Å; D904-K1008 IonicContact OD2-NZ 3.35Å; D904-K1008 PolarHBondContact OD2-NZ 2.91Å
905	R	80.8	Confident	77	Confident	95 Å²	95	69.9 Å²	69.9	36%	0.358	34%	0.338	S	S	.	.	H	α-helix	trans	-55.5	-36.6	175.3	-88.9	-174.2	-105.9	171.5	0.1	112.7	Y893 E896 D903 Y909	Y893-R905 HydrophobicContact CD1-CB 4.23Å; Y893-R905 HydrophobicContact CE1-CB 4.34Å; E896-R905 IonicContact OE1-NH1 3.09Å; E896-R905 IonicContact OE2-CZ 3.8Å; E896-R905 VanDerWaalsContact OE2-CZ 3.23Å; E896-R905 IonicContact OE2-NE 2.91Å; E896-R905 IonicContact OE2-NH1 3.18Å; E896-R905 PolarHBondContact OE2-NH1 3.31Å; E896-R905 IonicContact OE2-NH2 3.52Å; D903-R905 VanDerWaalsContact CG-NE 3.32Å; D903-R905 PolarHBondContact O-N 3.37Å; D903-R905 VanDerWaalsContact OD1-CG 3.27Å; D903-R905 WeakPolarHBondContact OD1-CG 3.31Å; D903-R905 IonicContact OD1-CZ 3.48Å; D903-R905 IonicContact OD1-NE 2.82Å; D903-R905 PolarHBondContact OD1-NE 3.34Å; D903-R905 IonicContact OD1-NH2 3.9Å; D903-R905 IonicContact OD2-CZ 2.65Å; D903-R905 IonicContact OD2-NE 3.68Å; D903-R905 PolarHBondContact OD2-NE 3.23Å; D903-R905 VanDerWaalsContact OD2-NE 3.09Å; D903-R905 IonicContact OD2-NH2 2.66Å; D903-R905 PolarHBondContact OD2-NH2 3.23Å; R905-Y909 WeakPolarHBondContact O-CB 3.41Å; R905-Y909 PolarHBondContact O-N 2.76Å
906	L	83.7	Confident	76	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-60.1	-48.8	175.5	-179.9	62.2	0	0	0	111.7	I890 D904 Y909 L910	I890-L906 HydrophobicContact CG2-CD1 3.95Å; D904-L906 PolarHBondContact O-N 3.41Å; L906-Y909 PolarHBondContact O-N 2.89Å; L906-L910 HydrophobicContact CD1-CD1 4.28Å; L906-L910 HydrophobicContact CD1-CG 4.38Å; L906-L910 HydrophobicContact CG-CD1 4.2Å; L906-L910 VanDerWaalsContact O-CG 3.32Å; L906-L910 WeakPolarHBondContact O-CG 3.35Å; L906-L910 PolarHBondContact O-N 3.48Å
907	M	81.8	Confident	75.4	Confident	13 Å²	13	68.7 Å²	68.7	6%	0.064	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-46.9	178.5	-78.7	-57.5	-59	0	0	112.1	D904 Y909 L910 E911 H1006 K1008 G1009 Y1012	D904-M907 PolarHBondContact O-N 2.9Å; D904-M907 VanDerWaalsContact O-N 3.15Å; M907-Y909 PolarHBondContact O-N 3.32Å; M907-L910 PolarHBondContact O-N 2.84Å; M907-L910 VanDerWaalsContact O-N 3.17Å; M907-E911 HydrophobicContact CE-CG 4.48Å; M907-E911 WeakPolarHBondContact O-CB 3.39Å; M907-E911 WeakPolarHBondContact O-CG 3.35Å; M907-E911 PolarHBondContact O-N 3.05Å; M907-H1006 WeakPolarHBondContact CG-CE1 3.36Å; M907-H1006 PolarHBondContact SD-CE1 3.35Å; M907-K1008 HydrophobicContact CE-CB 4.25Å; M907-K1008 HydrophobicContact CG-CB 4.42Å; M907-K1008 HydrophobicContact SD-CB 4.04Å; M907-G1009 WeakPolarHBondContact SD-CA 3.44Å; M907-G1009 PolarHBondContact SD-N 3.23Å; M907-G1009 VanDerWaalsContact SD-N 3.41Å; M907-Y1012 HydrophobicContact CE-CG 4.26Å
908	K	82.3	Confident	74.8	Confident	144 Å²	144	68.6 Å²	68.6	63%	0.626	33%	0.331	S	S	*	.	H	α-helix	trans	-56.1	-39.9	176.9	-69.7	178.9	-178.6	-179.3	0	111.7	D904 K912	D904-K908 WeakPolarHBondContact O-CG 3.4Å; D904-K908 PolarHBondContact O-N 3.12Å; K908-K912 WeakPolarHBondContact O-CB 3.32Å; K908-K912 PolarHBondContact O-N 3.24Å
909	Y	83.1	Confident	74.2	Confident	17 Å²	17	67.1 Å²	67.1	7%	0.067	33%	0.325	C	S	.	.	H	α-helix	trans	-69.6	-46.8	177.3	-176.8	-99.6	0	0	0	112.5	I873 H886 L889 I890 Y893 R905 L906 M907 E911 K912 V913	I873-Y909 HydrophobicContact CD1-CE2 4.07Å; I873-Y909 WeakPolarHBondContact CD1-OH 3.26Å; I873-Y909 HydrophobicContact CG2-CE2 4.16Å; H886-Y909 PolarHBondContact CE1-OH 3.36Å; H886-Y909 AromaticContact ND1-CZ 3.92Å; H886-Y909 PolarHBondContact ND1-OH 2.85Å; L889-Y909 HydrophobicContact CD2-CD2 3.98Å; L889-Y909 HydrophobicContact CD2-CE1 4.37Å; L889-Y909 HydrophobicContact CD2-CE2 3.43Å; L889-Y909 VanDerWaalsContact CD2-CE2 3.43Å; I890-Y909 HydrophobicContact CD1-CE1 4.27Å; I890-Y909 HydrophobicContact CG1-CD1 4.08Å; I890-Y909 HydrophobicContact CG1-CE1 3.84Å; Y893-Y909 HydrophobicContact CD2-CG 4.26Å; Y893-Y909 HydrophobicContact CE2-CD1 4.4Å; Y893-Y909 AromaticContact CE2-CD2 3.98Å; Y893-Y909 HydrophobicContact CE2-CD2 3.98Å; Y893-Y909 AromaticContact CE2-CG 3.79Å; Y893-Y909 HydrophobicContact CE2-CG 3.79Å; R905-Y909 WeakPolarHBondContact O-CB 3.41Å; R905-Y909 PolarHBondContact O-N 2.76Å; L906-Y909 PolarHBondContact O-N 2.89Å; M907-Y909 PolarHBondContact O-N 3.32Å; Y909-E911 VanDerWaalsContact C-N 3.33Å; Y909-E911 PolarHBondContact O-N 3.22Å; Y909-K912 PolarHBondContact O-N 3.12Å; Y909-V913 HydrophobicContact CD1-CG2 4.26Å; Y909-V913 HydrophobicContact CD2-CG2 4.02Å; Y909-V913 HydrophobicContact CE1-CG2 3.88Å; Y909-V913 HydrophobicContact CE2-CG2 3.61Å; Y909-V913 HydrophobicContact CG-CG2 4.33Å; Y909-V913 WeakPolarHBondContact O-CB 3.1Å; Y909-V913 VanDerWaalsContact O-CG2 3.28Å; Y909-V913 WeakPolarHBondContact O-CG2 3.3Å; Y909-V913 PolarHBondContact O-N 2.77Å
910	L	82.8	Confident	73.7	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-59.9	-44.3	177.6	-70.4	174.9	0	0	0	111.3	I890 L906 M907 S914 Y992 V997 Y1012 I1013	I890-L910 HydrophobicContact CD1-CD2 4.37Å; L906-L910 HydrophobicContact CD1-CD1 4.28Å; L906-L910 HydrophobicContact CD1-CG 4.38Å; L906-L910 HydrophobicContact CG-CD1 4.2Å; L906-L910 VanDerWaalsContact O-CG 3.32Å; L906-L910 WeakPolarHBondContact O-CG 3.35Å; L906-L910 PolarHBondContact O-N 3.48Å; M907-L910 PolarHBondContact O-N 2.84Å; M907-L910 VanDerWaalsContact O-N 3.17Å; L910-S914 WeakPolarHBondContact O-CB 3.48Å; L910-S914 PolarHBondContact O-N 3.28Å; L910-S914 VanDerWaalsContact O-N 3.1Å; L910-S914 PolarHBondContact O-OG 3.13Å; L910-Y992 HydrophobicContact CD2-CE1 4.17Å; L910-Y992 HydrophobicContact CD2-CE2 4.33Å; L910-V997 HydrophobicContact CD1-CG1 4.13Å; L910-V997 HydrophobicContact CD2-CG1 3.9Å; L910-Y1012 HydrophobicContact CB-CD1 4.23Å; L910-Y1012 HydrophobicContact CB-CE1 4.19Å; L910-I1013 HydrophobicContact CD2-CD1 4.47Å
911	E	80.6	Confident	73.4	Confident	90 Å²	90	61 Å²	61	42%	0.421	29%	0.29	S	S	.	.	H	α-helix	trans	-60.2	-55.9	173.7	-72.6	171.6	-174.2	0	0	110.7	M907 Y909 V913 S914 I915 Y1012	M907-E911 HydrophobicContact CE-CG 4.48Å; M907-E911 WeakPolarHBondContact O-CB 3.39Å; M907-E911 WeakPolarHBondContact O-CG 3.35Å; M907-E911 PolarHBondContact O-N 3.05Å; Y909-E911 VanDerWaalsContact C-N 3.33Å; Y909-E911 PolarHBondContact O-N 3.22Å; E911-V913 VanDerWaalsContact C-N 3.28Å; E911-V913 PolarHBondContact O-N 3.04Å; E911-S914 PolarHBondContact O-N 3.42Å; E911-S914 PolarHBondContact O-OG 3.06Å; E911-I915 VanDerWaalsContact O-CG1 3.27Å; E911-I915 WeakPolarHBondContact O-CG1 3.38Å; E911-I915 PolarHBondContact O-N 3.32Å; E911-I915 VanDerWaalsContact O-N 3.16Å; E911-Y1012 HydrophobicContact CG-CE2 4.1Å
912	K	78.6	Confident	73.2	Confident	112 Å²	112	59.5 Å²	59.5	49%	0.487	28%	0.279	S	S	.	.	H	α-helix	trans	-50.9	-45.8	-179.9	-179.7	175.3	178.7	178	0	112.7	E874 K908 Y909	E874-K912 IonicContact OE1-NZ 3.82Å; E874-K912 PolarHBondContact OE1-NZ 3.36Å; K908-K912 WeakPolarHBondContact O-CB 3.32Å; K908-K912 PolarHBondContact O-N 3.24Å; Y909-K912 PolarHBondContact O-N 3.12Å
913	V	75.7	Confident	72.9	Confident	23 Å²	23	56.2 Å²	56.2	14%	0.139	26%	0.261	C	S	.	.	H	α-helix	trans	-81.1	-28.6	-172.6	175.9	0	0	0	0	112.8	Y909 E911 P991 Y992	Y909-V913 HydrophobicContact CD1-CG2 4.26Å; Y909-V913 HydrophobicContact CD2-CG2 4.02Å; Y909-V913 HydrophobicContact CE1-CG2 3.88Å; Y909-V913 HydrophobicContact CE2-CG2 3.61Å; Y909-V913 HydrophobicContact CG-CG2 4.33Å; Y909-V913 WeakPolarHBondContact O-CB 3.1Å; Y909-V913 VanDerWaalsContact O-CG2 3.28Å; Y909-V913 WeakPolarHBondContact O-CG2 3.3Å; Y909-V913 PolarHBondContact O-N 2.77Å; E911-V913 VanDerWaalsContact C-N 3.28Å; E911-V913 PolarHBondContact O-N 3.04Å; V913-P991 HydrophobicContact CG1-CG 3.15Å; V913-Y992 HydrophobicContact CB-CE1 4.43Å; V913-Y992 HydrophobicContact CG1-CD1 4.2Å; V913-Y992 HydrophobicContact CG1-CE1 3.94Å
914	S	75.3	Confident	72.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-88.3	-10.5	-179.8	56.3	0	0	0	0	114	L910 E911 Q916 A917 I918 Y1012	L910-S914 WeakPolarHBondContact O-CB 3.48Å; L910-S914 PolarHBondContact O-N 3.28Å; L910-S914 VanDerWaalsContact O-N 3.1Å; L910-S914 PolarHBondContact O-OG 3.13Å; E911-S914 PolarHBondContact O-N 3.42Å; E911-S914 PolarHBondContact O-OG 3.06Å; S914-Q916 VanDerWaalsContact C-N 3.26Å; S914-Q916 PolarHBondContact O-N 3.19Å; S914-A917 PolarHBondContact O-N 3.38Å; S914-A917 VanDerWaalsContact O-N 3.13Å; S914-I918 WeakPolarHBondContact O-CB 3.47Å; S914-I918 WeakPolarHBondContact O-CG1 3.32Å; S914-I918 PolarHBondContact O-N 2.86Å; S914-Y1012 VanDerWaalsContact OG-CE1 3.28Å; S914-Y1012 WeakPolarHBondContact OG-CE1 3.38Å; S914-Y1012 VanDerWaalsContact OG-CZ 3.29Å; S914-Y1012 PolarHBondContact OG-OH 3.26Å
915	I	72.1	Confident	72	Confident	81 Å²	81	60 Å²	60	42%	0.415	27%	0.274	S	S	.	.	H	α-helix	trans	-49.9	-43.6	173.6	-77.2	163.1	0	0	0	111.8	E911 I918 H919	E911-I915 VanDerWaalsContact O-CG1 3.27Å; E911-I915 WeakPolarHBondContact O-CG1 3.38Å; E911-I915 PolarHBondContact O-N 3.32Å; E911-I915 VanDerWaalsContact O-N 3.16Å; I915-I918 CarbonylContact O-C 3.6Å; I915-I918 WeakPolarHBondContact O-CB 3.37Å; I915-I918 PolarHBondContact O-N 3.03Å; I915-H919 VanDerWaalsContact CG2-CD2 3.49Å; I915-H919 WeakPolarHBondContact CG2-CD2 3.34Å; I915-H919 WeakPolarHBondContact O-CB 3.15Å; I915-H919 PolarHBondContact O-CD2 3.42Å; I915-H919 VanDerWaalsContact O-CD2 3.22Å; I915-H919 PolarHBondContact O-N 3.3Å
916	Q	63.2	Low	70.7	Confident	97 Å²	97	60.8 Å²	60.8	45%	0.453	28%	0.282	S	S	.	.	H	α-helix	trans	-65.3	-42.7	-179.7	-70.6	-177.4	-11.2	0	0	112.9	S914 I918 H919 M920	S914-Q916 VanDerWaalsContact C-N 3.26Å; S914-Q916 PolarHBondContact O-N 3.19Å; Q916-I918 VanDerWaalsContact C-N 3.28Å; Q916-I918 PolarHBondContact O-N 2.95Å; Q916-H919 PolarHBondContact O-N 3.39Å; Q916-M920 PolarHBondContact O-N 2.66Å
917	A	66.4	Low	69.2	Low	6 Å²	6	66.4 Å²	66.4	5%	0.05	31%	0.308	C	S	.	.	H	α-helix	trans	-63.8	-38.8	175.2	0	0	0	0	0	110.8	S914 K921 L989 L990	S914-A917 PolarHBondContact O-N 3.38Å; S914-A917 VanDerWaalsContact O-N 3.13Å; A917-K921 WeakPolarHBondContact O-CB 3.26Å; A917-K921 PolarHBondContact O-N 2.87Å; A917-L989 HydrophobicContact CB-CB 4.21Å; A917-L990 HydrophobicContact CB-CD2 3.92Å
918	I	68.5	Low	67.5	Low	31 Å²	31	73.7 Å²	73.7	16%	0.159	34%	0.341	C	S	.	.	H	α-helix	trans	-63.9	-43.8	174.7	-67.4	167.4	0	0	0	111.2	S914 I915 Q916 K921 R922 Y1012 L1016 F1044	S914-I918 WeakPolarHBondContact O-CB 3.47Å; S914-I918 WeakPolarHBondContact O-CG1 3.32Å; S914-I918 PolarHBondContact O-N 2.86Å; I915-I918 CarbonylContact O-C 3.6Å; I915-I918 WeakPolarHBondContact O-CB 3.37Å; I915-I918 PolarHBondContact O-N 3.03Å; Q916-I918 VanDerWaalsContact C-N 3.28Å; Q916-I918 PolarHBondContact O-N 2.95Å; I918-K921 WeakPolarHBondContact O-CB 3.39Å; I918-K921 PolarHBondContact O-N 3.47Å; I918-R922 PolarHBondContact O-N 2.88Å; I918-Y1012 WeakPolarHBondContact CD1-OH 3.39Å; I918-L1016 HydrophobicContact CD1-CD2 4.03Å; I918-L1016 HydrophobicContact CG1-CD2 3.81Å; I918-F1044 HydrophobicContact CG2-CD1 4.35Å; I918-F1044 HydrophobicContact CG2-CE1 3.27Å; I918-F1044 HydrophobicContact CG2-CE2 4.23Å; I918-F1044 HydrophobicContact CG2-CZ 3.21Å
919	H	65.2	Low	65.8	Low	93 Å²	93	74.3 Å²	74.3	43%	0.431	35%	0.347	S	S	.	.	H	α-helix	trans	-66.5	-43.3	177.5	-91	-90.5	0	0	0	112.7	I915 Q916 K921 R922 L923	I915-H919 VanDerWaalsContact CG2-CD2 3.49Å; I915-H919 WeakPolarHBondContact CG2-CD2 3.34Å; I915-H919 WeakPolarHBondContact O-CB 3.15Å; I915-H919 PolarHBondContact O-CD2 3.42Å; I915-H919 VanDerWaalsContact O-CD2 3.22Å; I915-H919 PolarHBondContact O-N 3.3Å; Q916-H919 PolarHBondContact O-N 3.39Å; H919-K921 PolarHBondContact O-N 2.96Å; H919-R922 WeakPolarHBondContact O-CB 3.42Å; H919-R922 PolarHBondContact O-N 2.9Å; H919-R922 VanDerWaalsContact O-N 3.11Å; H919-L923 PolarHBondContact O-N 3.43Å
920	M	63.8	Low	63.8	Low	69 Å²	69	80.2 Å²	80.2	34%	0.34	38%	0.375	S	S	.	.	H	α-helix	trans	-63.2	-35.3	174.4	-79.4	-158	-116.9	0	0	111.8	Q916 L923 K924 L989	Q916-M920 PolarHBondContact O-N 2.66Å; M920-L923 PolarHBondContact O-N 3.45Å; M920-K924 WeakPolarHBondContact O-CG 3.5Å; M920-K924 PolarHBondContact O-N 2.87Å; M920-L989 HydrophobicContact CB-CD2 3.76Å; M920-L989 HydrophobicContact CE-CD2 3.83Å; M920-L989 HydrophobicContact CG-CD2 4.19Å; M920-L989 HydrophobicContact SD-CD2 3.5Å; M920-L989 WeakPolarHBondContact SD-CD2 3.34Å
921	K	64.7	Low	61.5	Low	33 Å²	33	87.2 Å²	87.2	14%	0.143	41%	0.412	C	S	.	.	H	α-helix	trans	-63.9	-41.4	172.1	-164.2	177	179.8	176	0	111.5	A917 I918 H919 Q925 I986 D1018	A917-K921 WeakPolarHBondContact O-CB 3.26Å; A917-K921 PolarHBondContact O-N 2.87Å; I918-K921 WeakPolarHBondContact O-CB 3.39Å; I918-K921 PolarHBondContact O-N 3.47Å; H919-K921 PolarHBondContact O-N 2.96Å; K921-Q925 WeakPolarHBondContact O-CB 3.48Å; K921-Q925 WeakPolarHBondContact O-CG 3.43Å; K921-Q925 PolarHBondContact O-N 3.18Å; K921-Q925 VanDerWaalsContact O-N 3.1Å; K921-I986 HydrophobicContact CD-CD1 3.75Å; K921-D1018 WeakPolarHBondContact CE-OD2 3.41Å; K921-D1018 IonicContact NZ-OD1 3.51Å; K921-D1018 PolarHBondContact NZ-OD1 3.01Å; K921-D1018 IonicContact NZ-OD2 3.92Å; K921-D1018 PolarHBondContact NZ-OD2 2.93Å
922	R	64.1	Low	59.3	Low	89 Å²	89	89.9 Å²	89.9	34%	0.336	43%	0.428	S	S	.	.	H	α-helix	trans	-60	-46.5	172.3	-72.8	178.5	166.3	166	-8.8	112.1	I918 H919 Q925 Q926 E1043 F1044	I918-R922 PolarHBondContact O-N 2.88Å; H919-R922 WeakPolarHBondContact O-CB 3.42Å; H919-R922 PolarHBondContact O-N 2.9Å; H919-R922 VanDerWaalsContact O-N 3.11Å; R922-Q925 PolarHBondContact O-N 3.23Å; R922-Q926 WeakPolarHBondContact O-CG 3.29Å; R922-Q926 PolarHBondContact O-N 3.04Å; R922-E1043 IonicContact NH2-OE2 2.66Å; R922-E1043 PolarHBondContact NH2-OE2 3.38Å; R922-E1043 VanDerWaalsContact NH2-OE2 3.11Å; R922-F1044 HydrophobicContact CG-CD1 3.89Å; R922-F1044 HydrophobicContact CG-CE1 3.45Å; R922-F1044 VanDerWaalsContact CG-CE1 3.45Å
923	L	60.6	Low	57.3	Low	93 Å²	93	91.2 Å²	91.2	49%	0.487	45%	0.445	S	S	.	.	H	α-helix	trans	-63.6	-44.8	-179.9	-76.7	160.1	0	0	0	112.1	H919 M920 Q925 Q926 H927	H919-L923 PolarHBondContact O-N 3.43Å; M920-L923 PolarHBondContact O-N 3.45Å; L923-Q925 VanDerWaalsContact C-N 3.3Å; L923-Q925 PolarHBondContact O-N 3.42Å; L923-Q926 PolarHBondContact O-N 3.36Å; L923-H927 PolarHBondContact O-N 3.19Å
924	K	61.5	Low	55.3	Low	111 Å²	111	97.8 Å²	97.8	48%	0.483	48%	0.479	S	S	.	.	H	α-helix	trans	-61.9	-37.5	175.7	-76.8	-175	178	-178.9	0	112.2	M920 Q928	M920-K924 WeakPolarHBondContact O-CG 3.5Å; M920-K924 PolarHBondContact O-N 2.87Å; K924-Q928 PolarHBondContact O-N 3.22Å
925	Q	57.7	Low	53.1	Low	61 Å²	61	105.7 Å²	105.7	29%	0.285	52%	0.522	S	S	.	.	H	α-helix	trans	-71.7	-33.4	176.6	-72.7	178.9	-6.4	0	0	112.7	K921 R922 L923 F1044	K921-Q925 WeakPolarHBondContact O-CB 3.48Å; K921-Q925 WeakPolarHBondContact O-CG 3.43Å; K921-Q925 PolarHBondContact O-N 3.18Å; K921-Q925 VanDerWaalsContact O-N 3.1Å; R922-Q925 PolarHBondContact O-N 3.23Å; L923-Q925 VanDerWaalsContact C-N 3.3Å; L923-Q925 PolarHBondContact O-N 3.42Å; Q925-F1044 PolarHBondContact NE2-O 3.49Å; Q925-F1044 PolarHBondContact OE1-O 2.99Å
926	Q	53.6	Low	51.3	Low	112 Å²	112	105 Å²	105	52%	0.523	54%	0.535	S	S	.	.	H	α-helix	trans	-70.6	-42.1	174.4	-75.3	176.4	-12.5	0	0	112.5	R922 L923 Q928 Q929 Q930	R922-Q926 WeakPolarHBondContact O-CG 3.29Å; R922-Q926 PolarHBondContact O-N 3.04Å; L923-Q926 PolarHBondContact O-N 3.36Å; Q926-Q928 VanDerWaalsContact C-N 3.29Å; Q926-Q928 PolarHBondContact O-N 3.18Å; Q926-Q929 PolarHBondContact O-N 2.98Å; Q926-Q929 VanDerWaalsContact O-N 3.1Å; Q926-Q930 PolarHBondContact O-N 3.18Å
927	H	51.3	Low	49.9	Very low	119 Å²	119	108.2 Å²	108.2	55%	0.551	56%	0.555	S	S	*	*	H	α-helix	trans	-65	-28.9	175.2	-85.4	15.9	0	0	0	113.6	L923 Q929	L923-H927 PolarHBondContact O-N 3.19Å; H927-Q929 VanDerWaalsContact C-N 3.29Å; H927-Q929 PolarHBondContact O-N 3.16Å
928	Q	46.1	Very low	48.2	Very low	166 Å²	166	115 Å²	115	78%	0.776	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-16	173.5	-80.9	-179.3	-11.2	0	0	114	K924 Q926	K924-Q928 PolarHBondContact O-N 3.22Å; Q926-Q928 VanDerWaalsContact C-N 3.29Å; Q926-Q928 PolarHBondContact O-N 3.18Å
929	Q	47	Very low	46.5	Very low	157 Å²	157	122.5 Å²	122.5	73%	0.734	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-13.7	178.7	-71.7	-179.7	6.7	0	0	114	Q926 H927	Q926-Q929 PolarHBondContact O-N 2.98Å; Q926-Q929 VanDerWaalsContact O-N 3.1Å; H927-Q929 VanDerWaalsContact C-N 3.29Å; H927-Q929 PolarHBondContact O-N 3.16Å
930	Q	41.2	Very low	45	Very low	141 Å²	141	125 Å²	125	66%	0.659	64%	0.638	S	S	*	*	S	Bend	trans	-101	-0.4	-175.3	-82.3	174.3	-26.7	0	0	115.6	Q926 I932	Q926-Q930 PolarHBondContact O-N 3.18Å; Q930-I932 PolarHBondContact O-N 3.46Å
931	N	35.2	Very low	43.4	Very low	147 Å²	147	127.6 Å²	127.6	79%	0.786	65%	0.653	S	S	*	*			trans	-79	36.7	177.7	-83	-15.2	0	0	0	114.6
932	I	34.3	Very low	42	Very low	147 Å²	147	134.5 Å²	134.5	75%	0.754	68%	0.68	S	S	*	*	S	Bend	trans	-136.3	114.3	170.7	-52.7	177.2	0	0	0	107.4	Q930	Q930-I932 PolarHBondContact O-N 3.46Å
933	V	35.8	Very low	40.5	Very low	140 Å²	140	138.4 Å²	138.4	85%	0.848	70%	0.702	S	S	*	*	S	Bend	trans	106.4	123	173	-167.8	0	0	0	0	115.2
934	D	34.2	Very low	39.1	Very low	160 Å²	160	139.6 Å²	139.6	86%	0.856	71%	0.708	S	S	*	*			trans	-64.5	156.2	-163.6	-72.6	-52.2	0	0	0	117.8
935	D	29.6	Very low	37.7	Very low	167 Å²	167	141.1 Å²	141.1	89%	0.893	72%	0.72	S	S	*	*			trans	-42.9	141.7	179.2	-72.4	-45.6	0	0	0	118.6
936	G	32.9	Very low	36.5	Very low	66 Å²	66	145.4 Å²	145.4	68%	0.68	75%	0.746	S	S	*	*	S	Bend	trans	118.7	93.6	157.9	0	0	0	0	0	113.5
937	D	33.8	Very low	35.2	Very low	164 Å²	164	146.5 Å²	146.5	88%	0.877	75%	0.752	S	S	*	*			trans	136.5	21	157.1	-68.3	-17.2	0	0	0	116.8
938	L	31.8	Very low	34.1	Very low	150 Å²	150	146 Å²	146	79%	0.785	75%	0.754	S	S	*	*			trans	-115.6	79.4	170.9	-92.5	92.6	0	0	0	113
939	F	31.9	Very low	33.5	Very low	187 Å²	187	145.8 Å²	145.8	82%	0.82	76%	0.757	S	S	*	*	S	Bend	trans	-118	3.2	163.6	-115.7	-84.2	0	0	0	114
940	N	33.8	Very low	32.8	Very low	145 Å²	145	144.1 Å²	144.1	78%	0.775	75%	0.753	S	S	*	*	S	Bend	trans	-111.3	1.1	-171	-90.2	-14	0	0	0	117.5
941	D	30.6	Very low	32.4	Very low	124 Å²	124	146.3 Å²	146.3	66%	0.663	76%	0.763	S	S	*	*			trans	-108.5	13.7	-179.8	-77.1	-18.5	0	0	0	115.2	Q943	D941-Q943 PolarHBondContact O-N 3.27Å
942	Y	34.4	Very low	32.2	Very low	179 Å²	179	147 Å²	147	70%	0.702	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-68.7	2.5	169.2	-85.8	-81.2	0	0	0	113.9	L944 L945	Y942-L944 VanDerWaalsContact C-N 3.31Å; Y942-L944 PolarHBondContact O-N 3.12Å; Y942-L945 HydrophobicContact CD1-CD1 4.03Å; Y942-L945 HydrophobicContact CE1-CD1 4.22Å
943	Q	33.1	Very low	31.8	Very low	170 Å²	170	144.4 Å²	144.4	79%	0.794	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-80.5	1.7	174.7	-95.4	170.3	-5.3	0	0	115.2	D941	D941-Q943 PolarHBondContact O-N 3.27Å
944	L	32.5	Very low	31.4	Very low	118 Å²	118	144.5 Å²	144.5	62%	0.618	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-106	3.4	176.4	-86.5	157.5	0	0	0	115.5	Y942 N946 M947	Y942-L944 VanDerWaalsContact C-N 3.31Å; Y942-L944 PolarHBondContact O-N 3.12Å; L944-N946 PolarHBondContact O-N 2.77Å; L944-M947 HydrophobicContact CD2-CG 4.36Å; L944-M947 HydrophobicContact CD2-SD 3.69Å
945	L	30.2	Very low	31	Very low	143 Å²	143	146 Å²	146	75%	0.749	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	11.6	168.2	-87.6	151	0	0	0	113.5	Y942	Y942-L945 HydrophobicContact CD1-CD1 4.03Å; Y942-L945 HydrophobicContact CE1-CD1 4.22Å
946	N	32.3	Very low	31.1	Very low	152 Å²	152	147.4 Å²	147.4	81%	0.813	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	14.1	170	-88.2	-15.7	0	0	0	113.6	L944 D948	L944-N946 PolarHBondContact O-N 2.77Å; N946-D948 PolarHBondContact O-N 2.97Å
947	M	27.8	Very low	30.8	Very low	135 Å²	135	152.7 Å²	152.7	67%	0.665	76%	0.763	S	S	*	*	S	Bend	trans	-88.3	104.6	177.8	-87.6	-176.1	57.8	0	0	112.5	L944	L944-M947 HydrophobicContact CD2-CG 4.36Å; L944-M947 HydrophobicContact CD2-SD 3.69Å
948	D	28.4	Very low	30.7	Very low	108 Å²	108	152 Å²	152	58%	0.578	76%	0.759	S	S	*	*			trans	74	46.7	150.1	-56.2	-25.4	0	0	0	120.1	N946 N950	N946-D948 PolarHBondContact O-N 2.97Å; D948-N950 PolarHBondContact O-N 3.19Å; D948-N950 VanDerWaalsContact O-N 3.16Å
949	L	33.5	Very low	30.5	Very low	161 Å²	161	153.7 Å²	153.7	84%	0.843	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-67.9	5.6	152	-86.4	157.9	0	0	0	113.5
950	N	31.5	Very low	30.3	Very low	123 Å²	123	151.9 Å²	151.9	66%	0.658	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-81.4	-13.3	-178.1	-79.9	-28.5	0	0	0	114.7	D948 L952 S953	D948-N950 PolarHBondContact O-N 3.19Å; D948-N950 VanDerWaalsContact O-N 3.16Å; N950-L952 PolarHBondContact O-N 3.49Å; N950-S953 PolarHBondContact O-OG 3.5Å
951	E	33.4	Very low	30.2	Very low	186 Å²	186	153.3 Å²	153.3	87%	0.869	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-85	-0.2	-179.6	-76.6	-160.8	155.2	0	0	115.5
952	L	30.8	Very low	30.1	Very low	161 Å²	161	155.4 Å²	155.4	84%	0.843	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-97.8	13.4	172.7	-87	133.8	0	0	0	113.6	N950	N950-L952 PolarHBondContact O-N 3.49Å
953	S	26.2	Very low	29.8	Very low	93 Å²	93	153.5 Å²	153.5	65%	0.65	78%	0.777	S	S	*	*			trans	-99.9	76.2	178.6	64.2	0	0	0	0	112.3	N950	N950-S953 PolarHBondContact O-OG 3.5Å
954	L	26.7	Very low	29.6	Very low	143 Å²	143	153.2 Å²	153.2	75%	0.749	78%	0.781	S	S	*	*			trans	-130.3	119.1	160.7	-94.5	158	0	0	0	107.6
955	F	26	Very low	29.4	Very low	191 Å²	191	153.9 Å²	153.9	84%	0.838	79%	0.794	S	S	*	*	S	Bend	trans	81.8	89	-178.9	-46.8	-73.2	0	0	0	115
956	E	30.7	Very low	29.4	Very low	197 Å²	197	152.6 Å²	152.6	92%	0.921	80%	0.795	S	S	*	*				-167.8	128.9	115.8	-100.6	170.4	-169.2	0	0	111
957	H	28.5	Very low	29.3	Very low	176 Å²	176	153.9 Å²	153.9	82%	0.815	80%	0.8	S	S	*	*			trans	-85	153.3	173.3	-99	37.7	0	0	0	109.9
958	D	29.8	Very low	29.4	Very low	150 Å²	150	149.8 Å²	149.8	80%	0.802	79%	0.792	S	S	*	*			trans	84.2	85.2	159.9	-58.1	-19.5	0	0	0	117.9
959	H	27.6	Very low	29.5	Very low	185 Å²	185	151.3 Å²	151.3	86%	0.856	80%	0.8	S	S	*	*			trans	-56.9	131.4	153	-81.4	-73.7	0	0	0	112.1
960	D	29.3	Very low	29.5	Very low	150 Å²	150	146 Å²	146	80%	0.802	79%	0.785	S	S	*	*				-173.8	122	118.4	-95.4	-23.6	0	0	0	109.9
961	I	31	Very low	29.5	Very low	175 Å²	175	147.8 Å²	147.8	90%	0.897	79%	0.791	S	S	*	*			trans	153.7	116.8	145.1	-75.1	157.2	0	0	0	108.8
962	M	29.1	Very low	29.6	Very low	167 Å²	167	143.7 Å²	143.7	82%	0.823	78%	0.775	S	S	*	*			trans	-67.8	149.2	-169.5	-66.1	-166.4	-164.3	0	0	115.8
963	N	28.2	Very low	29.7	Very low	139 Å²	139	141.7 Å²	141.7	74%	0.743	76%	0.76	S	S	*	*			trans	37	113.5	132.4	-60.5	-23.9	0	0	0	119.8
964	D	28	Very low	30.1	Very low	164 Å²	164	143.1 Å²	143.1	88%	0.877	76%	0.76	S	S	*	*				-177.9	99.6	125.2	-94.7	-18.1	0	0	0	111.5
965	C	27.9	Very low	30.6	Very low	132 Å²	132	143.7 Å²	143.7	89%	0.892	76%	0.756	S	S	*	*			trans	-174	148.6	142	-113.5	0	0	0	0	112
966	P	30.7	Very low	31	Very low	116 Å²	116	139.1 Å²	139.1	75%	0.753	75%	0.747	S	S	*	*			trans	-95.7	146.4	-149.3	35	-30.9	0	0	0	115.8	G968	P966-G968 PolarHBondContact O-N 3.16Å
967	I	29.3	Very low	31.3	Very low	179 Å²	179	135 Å²	135	92%	0.918	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	18.7	-175.7	-63.6	161.5	0	0	0	113.7
968	G	29.8	Very low	31.8	Very low	49 Å²	49	131.4 Å²	131.4	51%	0.505	72%	0.721	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	-16.8	-163.9	0	0	0	0	0	118.8	P966	P966-G968 PolarHBondContact O-N 3.16Å
969	N	31.9	Very low	32.3	Very low	140 Å²	140	130.9 Å²	130.9	75%	0.749	72%	0.718	S	S	*	*	S	Bend	trans	-108.1	-2	-165.6	-90.6	-8.6	0	0	0	116.4
970	G	33.4	Very low	32.7	Very low	51 Å²	51	129.8 Å²	129.8	53%	0.526	71%	0.713	S	S	.	*	H	α-helix	trans	-80.1	-36	179.6	0	0	0	0	0	114.3	N972	G970-N972 VanDerWaalsContact C-N 3.35Å; G970-N972 PolarHBondContact O-N 3.18Å
971	M	32	Very low	32.8	Very low	160 Å²	160	128.3 Å²	128.3	79%	0.788	72%	0.715	S	S	*	*	H	α-helix	trans	-71.7	-26.3	-178.6	-84.8	-173.2	167	0	0	113.5	K975	M971-K975 PolarHBondContact O-N 2.83Å
972	N	34.3	Very low	33.1	Very low	99 Å²	99	128.8 Å²	128.8	53%	0.529	71%	0.71	S	S	.	*	H	α-helix	trans	-79	-28.4	-178.7	-69	-14.8	0	0	0	113	G970 C976	G970-N972 VanDerWaalsContact C-N 3.35Å; G970-N972 PolarHBondContact O-N 3.18Å; N972-C976 PolarHBondContact O-N 2.9Å
973	K	33.7	Very low	33.5	Very low	119 Å²	119	130.3 Å²	130.3	52%	0.517	72%	0.715	S	S	.	*	H	α-helix	trans	-75.9	-27.7	176.5	-140.1	174.4	-177.8	-175.3	0	111.8	N878 D879 L977	N878-K973 PolarHBondContact O-NZ 3.07Å; D879-K973 IonicContact OD1-NZ 3.5Å; D879-K973 PolarHBondContact OD1-NZ 2.85Å; K973-L977 WeakPolarHBondContact O-CD1 3.32Å
974	L	34.5	Very low	34.3	Very low	124 Å²	124	128.7 Å²	128.7	65%	0.649	70%	0.703	S	S	*	*	H	α-helix	trans	-78.7	-28.3	174.6	-84.4	151.5	0	0	0	113.2
975	K	37	Very low	35.8	Very low	155 Å²	155	126.2 Å²	126.2	67%	0.674	69%	0.69	S	S	*	*	H	α-helix	trans	-73.9	-30.4	175.2	-126.2	175.5	179.9	-178.5	0	113.4	M971 L977 T978	M971-K975 PolarHBondContact O-N 2.83Å; K975-L977 VanDerWaalsContact C-N 3.32Å; K975-L977 PolarHBondContact O-N 2.77Å; K975-T978 PolarHBondContact O-OG1 2.94Å
976	C	34	Very low	37.4	Very low	95 Å²	95	121.8 Å²	121.8	64%	0.642	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-12.7	175.7	-86.8	0	0	0	0	114.7	N972	N972-C976 PolarHBondContact O-N 2.9Å
977	L	36.6	Very low	39	Very low	109 Å²	109	121.9 Å²	121.9	57%	0.571	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-11.1	-177.9	-76.1	162	0	0	0	113.4	K973 K975	K973-L977 WeakPolarHBondContact O-CD1 3.32Å; K975-L977 VanDerWaalsContact C-N 3.32Å; K975-L977 PolarHBondContact O-N 2.77Å
978	T	40	Very low	40.6	Very low	102 Å²	102	116.7 Å²	116.7	63%	0.626	63%	0.627	S	S	*	*	S	Bend	trans	-84.3	-16	177.5	36.2	0	0	0	0	114	K975	K975-T978 PolarHBondContact O-OG1 2.94Å
979	D	39.4	Very low	42.3	Very low	139 Å²	139	115.7 Å²	115.7	74%	0.743	61%	0.61	S	S	*	*	S	Bend	trans	-100.8	-1.9	-174.3	-72.6	-29.1	0	0	0	115.2
980	Q	37.2	Very low	44.3	Very low	161 Å²	161	109.6 Å²	109.6	75%	0.752	58%	0.577	S	S	*	*			trans	-105.7	90.8	178.4	-68.7	-169.6	0.8	0	0	112.7	K982	Q980-K982 PolarHBondContact O-N 3.38Å
981	S	31.6	Very low	46.3	Very low	119 Å²	119	107.9 Å²	107.9	83%	0.832	56%	0.557	S	S	*	*			trans	-66.8	75.8	172.6	48	0	0	0	0	113.5
982	K	36.8	Very low	48.6	Very low	185 Å²	185	100.3 Å²	100.3	80%	0.804	52%	0.52	S	S	*	.	S	Bend	trans	-142.7	132	159.6	-70.8	-171.9	179.6	171.3	0	110.8	Q980 Q984	Q980-K982 PolarHBondContact O-N 3.38Å; K982-Q984 PolarHBondContact O-N 3.02Å
983	E	38.4	Very low	50.9	Low	199 Å²	199	98.9 Å²	98.9	93%	0.93	51%	0.512	S	S	*	.			trans	-49.5	93.1	176.4	-67.7	171.3	148.9	0	0	111.9
984	Q	45	Very low	53.2	Low	105 Å²	105	93.4 Å²	93.4	49%	0.491	49%	0.489	S	S	.	.			trans	-88.6	110.3	172	-76.3	-177.7	-3.4	0	0	109.2	K982	K982-Q984 PolarHBondContact O-N 3.02Å
985	N	57.8	Low	55.6	Low	112 Å²	112	89.1 Å²	89.1	60%	0.599	47%	0.474	S	S	*	.			trans	-54	143.6	172.4	-80.2	-27.9	0	0	0	110.8	Q987 S988	N985-Q987 HydrophobicContact CB-CB 4.33Å; N985-Q987 PolarHBondContact O-N 2.64Å; N985-S988 PolarHBondContact O-N 2.87Å; N985-S988 PolarHBondContact O-OG 2.75Å
986	I	61.7	Low	58	Low	39 Å²	39	85 Å²	85	20%	0.2	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-51.5	-28.7	176.1	-65.7	166.4	0	0	0	112.2	K921 S988 L989 L990 D1018	K921-I986 HydrophobicContact CD-CD1 3.75Å; I986-S988 PolarHBondContact O-N 2.99Å; I986-L989 PolarHBondContact O-N 3.19Å; I986-L990 HydrophobicContact CG2-CD1 4.44Å; I986-L990 HydrophobicContact CG2-CG 4.49Å; I986-L990 PolarHBondContact O-N 2.95Å; I986-D1018 WeakPolarHBondContact CD1-OD2 3.38Å
987	Q	64.1	Low	60.5	Low	119 Å²	119	80.5 Å²	80.5	56%	0.556	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-54.2	-30.8	173.4	-67.4	171.4	-4.5	0	0	113.7	N985 P994 L1017	N985-Q987 HydrophobicContact CB-CB 4.33Å; N985-Q987 PolarHBondContact O-N 2.64Å; Q987-P994 HydrophobicContact CG-CG 4.38Å; Q987-L1017 HydrophobicContact CG-CD2 4.27Å
988	S	63.1	Low	62.8	Low	69 Å²	69	76.7 Å²	76.7	48%	0.483	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-85.6	-9.1	177.2	69.9	0	0	0	0	113.7	N985 I986	N985-S988 PolarHBondContact O-N 2.87Å; N985-S988 PolarHBondContact O-OG 2.75Å; I986-S988 PolarHBondContact O-N 2.99Å
989	L	66.9	Low	65	Low	29 Å²	29	79.5 Å²	79.5	15%	0.152	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-17.5	177.1	-80.6	89	0	0	0	112.8	A917 M920 I986	A917-L989 HydrophobicContact CB-CB 4.21Å; M920-L989 HydrophobicContact CB-CD2 3.76Å; M920-L989 HydrophobicContact CE-CD2 3.83Å; M920-L989 HydrophobicContact CG-CD2 4.19Å; M920-L989 HydrophobicContact SD-CD2 3.5Å; M920-L989 WeakPolarHBondContact SD-CD2 3.34Å; I986-L989 PolarHBondContact O-N 3.19Å
990	L	73.4	Confident	67.3	Low	11 Å²	11	73.9 Å²	73.9	6%	0.058	37%	0.373	C	S	.	.	S	Bend	trans	-82.2	134.7	174.1	-68	170	0	0	0	109.5	A917 I986 Y992 P994	A917-L990 HydrophobicContact CB-CD2 3.92Å; I986-L990 HydrophobicContact CG2-CD1 4.44Å; I986-L990 HydrophobicContact CG2-CG 4.49Å; I986-L990 PolarHBondContact O-N 2.95Å; L990-Y992 HydrophobicContact CD1-CE2 4.38Å; L990-Y992 PolarHBondContact O-N 2.86Å; L990-P994 HydrophobicContact CD1-CB 4.23Å; L990-P994 HydrophobicContact CD1-CG 4.21Å
991	P	75.8	Confident	69.6	Low	15 Å²	15	66.2 Å²	66.2	10%	0.097	34%	0.338	C	S	.	.	S	Bend	trans	-78.1	-0.3	179.3	31.5	-34.4	0	0	0	113.3	I880 Q883 H886 V913	I880-P991 HydrophobicContact CG2-CB 4.19Å; Q883-P991 WeakPolarHBondContact CA-O 3.39Å; H886-P991 PolarHBondContact CD2-O 3.17Å; H886-P991 WeakPolarHBondContact NE2-CB 3.27Å; V913-P991 HydrophobicContact CG1-CG 3.15Å
992	Y	79.4	Confident	72.1	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.008	32%	0.324	C	S	.	.	S	Bend	trans	-129.7	150.6	175.7	54.3	-98.9	0	0	0	109.8	I890 L910 V913 L990 P994 V997 I1013	I890-Y992 HydrophobicContact CD1-CD1 4.15Å; I890-Y992 HydrophobicContact CD1-CG 4.01Å; L910-Y992 HydrophobicContact CD2-CE1 4.17Å; L910-Y992 HydrophobicContact CD2-CE2 4.33Å; V913-Y992 HydrophobicContact CB-CE1 4.43Å; V913-Y992 HydrophobicContact CG1-CD1 4.2Å; V913-Y992 HydrophobicContact CG1-CE1 3.94Å; L990-Y992 HydrophobicContact CD1-CE2 4.38Å; L990-Y992 PolarHBondContact O-N 2.86Å; Y992-P994 WeakPolarHBondContact O-CD 3.37Å; Y992-V997 HydrophobicContact CD2-CB 4.42Å; Y992-V997 HydrophobicContact CD2-CG2 3.45Å; Y992-V997 VanDerWaalsContact CD2-CG2 3.45Å; Y992-V997 HydrophobicContact CE2-CG2 3.97Å; Y992-V997 HydrophobicContact CG-CG2 4.09Å; Y992-I1013 HydrophobicContact CE2-CD1 3.89Å
993	D	83.3	Confident	74.4	Confident	69 Å²	69	64 Å²	64	37%	0.369	32%	0.315	S	S	.	.			trans	-68.5	114.6	169.1	172.9	20.3	0	0	0	110.6	H887 G995 Y996 V997	H887-D993 PolarHBondContact NE2-N 3.16Å; H887-D993 VanDerWaalsContact NE2-N 3.17Å; D993-G995 PolarHBondContact O-N 2.87Å; D993-G995 PolarHBondContact OD1-N 2.67Å; D993-Y996 PolarHBondContact O-N 3.31Å; D993-Y996 PolarHBondContact OD2-N 3.08Å; D993-V997 PolarHBondContact O-N 2.82Å
994	P	82.4	Confident	76.6	Confident	4 Å²	4	55.2 Å²	55.2	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-25.6	178.5	25.7	-33.8	0	0	0	112.6	Q987 L990 Y992 V997 L998 I1013 L1017	Q987-P994 HydrophobicContact CG-CG 4.38Å; L990-P994 HydrophobicContact CD1-CB 4.23Å; L990-P994 HydrophobicContact CD1-CG 4.21Å; Y992-P994 WeakPolarHBondContact O-CD 3.37Å; P994-V997 PolarHBondContact O-N 2.85Å; P994-L998 VanDerWaalsContact O-CB 3.26Å; P994-L998 WeakPolarHBondContact O-CB 3.5Å; P994-L998 PolarHBondContact O-N 3.27Å; P994-I1013 HydrophobicContact CB-CG2 3.89Å; P994-L1017 HydrophobicContact CB-CD1 4.26Å; P994-L1017 HydrophobicContact CB-CD2 3.96Å; P994-L1017 HydrophobicContact CB-CG 4.24Å; P994-L1017 HydrophobicContact CG-CD2 3.7Å
995	G	84.4	Confident	78.3	Confident	33 Å²	33	56.5 Å²	56.5	34%	0.34	29%	0.285	S	S	.	.	H	α-helix	trans	-67.4	-41.3	175.4	0	0	0	0	0	113.1	D993 R999	D993-G995 PolarHBondContact O-N 2.87Å; D993-G995 PolarHBondContact OD1-N 2.67Å; G995-R999 PolarHBondContact O-N 2.88Å; G995-R999 VanDerWaalsContact O-N 3.1Å
996	Y	87.2	Confident	79.6	Confident	69 Å²	69	51.3 Å²	51.3	27%	0.271	26%	0.257	S	S	.	.	H	α-helix	trans	-62.1	-47.4	172.7	175	-101	0	0	0	111.6	H887 D993 L998 R999 L1000	H887-Y996 HydrophobicContact CB-CD1 4.25Å; H887-Y996 HydrophobicContact CB-CE1 3.85Å; H887-Y996 AromaticContact CD2-CD1 3.49Å; H887-Y996 VanDerWaalsContact CD2-CD1 3.49Å; H887-Y996 WeakPolarHBondContact CD2-CD1 3.31Å; H887-Y996 AromaticContact CD2-CE1 3.96Å; H887-Y996 AromaticContact CE1-CD1 3.74Å; H887-Y996 AromaticContact CE1-CG 3.71Å; H887-Y996 AromaticContact CG-CD1 3.7Å; H887-Y996 AromaticContact CG-CE1 3.83Å; H887-Y996 AromaticContact ND1-CD1 3.9Å; H887-Y996 AromaticContact NE2-CD1 3.52Å; H887-Y996 AromaticContact NE2-CG 3.86Å; D993-Y996 PolarHBondContact O-N 3.31Å; D993-Y996 PolarHBondContact OD2-N 3.08Å; Y996-L998 PolarHBondContact O-N 3.1Å; Y996-R999 PolarHBondContact O-N 3.42Å; Y996-L1000 HydrophobicContact CE1-CD2 4.37Å; Y996-L1000 WeakPolarHBondContact O-CB 3.46Å; Y996-L1000 PolarHBondContact O-N 2.95Å
997	V	86.2	Confident	80.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-42.4	179.6	-178.4	0	0	0	0	111.4	I890 L910 Y992 D993 P994 R999 L1000 C1001 I1013	I890-V997 HydrophobicContact CD1-CG2 3.8Å; I890-V997 HydrophobicContact CG2-CG2 4.34Å; L910-V997 HydrophobicContact CD1-CG1 4.13Å; L910-V997 HydrophobicContact CD2-CG1 3.9Å; Y992-V997 HydrophobicContact CD2-CB 4.42Å; Y992-V997 HydrophobicContact CD2-CG2 3.45Å; Y992-V997 VanDerWaalsContact CD2-CG2 3.45Å; Y992-V997 HydrophobicContact CE2-CG2 3.97Å; Y992-V997 HydrophobicContact CG-CG2 4.09Å; D993-V997 PolarHBondContact O-N 2.82Å; P994-V997 PolarHBondContact O-N 2.85Å; V997-R999 VanDerWaalsContact C-N 3.32Å; V997-R999 PolarHBondContact O-N 2.65Å; V997-L1000 PolarHBondContact O-N 3.13Å; V997-C1001 WeakPolarHBondContact O-CB 3.37Å; V997-C1001 PolarHBondContact O-N 3.09Å; V997-C1001 PolarHBondContact O-SG 3.36Å; V997-I1013 HydrophobicContact CB-CD1 4.4Å; V997-I1013 HydrophobicContact CB-CG1 4.45Å; V997-I1013 HydrophobicContact CG1-CD1 3.96Å; V997-I1013 HydrophobicContact CG1-CG1 3.91Å
998	L	85.5	Confident	81.3	Confident	30 Å²	30	54.7 Å²	54.7	16%	0.157	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-40.8	176.6	-172.8	71.1	0	0	0	111.7	P994 Y996 K1002 V1010 I1013 L1014	P994-L998 VanDerWaalsContact O-CB 3.26Å; P994-L998 WeakPolarHBondContact O-CB 3.5Å; P994-L998 PolarHBondContact O-N 3.27Å; Y996-L998 PolarHBondContact O-N 3.1Å; L998-K1002 WeakPolarHBondContact O-CB 3.19Å; L998-K1002 VanDerWaalsContact O-CG 3.27Å; L998-K1002 WeakPolarHBondContact O-CG 3.35Å; L998-K1002 PolarHBondContact O-N 3.04Å; L998-V1010 HydrophobicContact CD1-CB 4.39Å; L998-V1010 HydrophobicContact CD1-CG1 3.9Å; L998-V1010 HydrophobicContact CD1-CG2 4.45Å; L998-I1013 HydrophobicContact CB-CG2 4.28Å; L998-I1013 HydrophobicContact CD1-CB 4.47Å; L998-I1013 HydrophobicContact CD1-CG2 4.38Å; L998-L1014 HydrophobicContact CD1-CG 4.41Å
999	R	86	Confident	82.2	Confident	160 Å²	160	51.4 Å²	51.4	60%	0.604	25%	0.25	S	S	*	.	H	α-helix	trans	-65.3	-48.4	176.1	-174.2	-176.5	-59	153.1	6.3	111.3	G995 Y996 V997 K1002 E1003	G995-R999 PolarHBondContact O-N 2.88Å; G995-R999 VanDerWaalsContact O-N 3.1Å; Y996-R999 PolarHBondContact O-N 3.42Å; V997-R999 VanDerWaalsContact C-N 3.32Å; V997-R999 PolarHBondContact O-N 2.65Å; R999-K1002 WeakPolarHBondContact O-CB 3.33Å; R999-K1002 PolarHBondContact O-N 2.81Å; R999-E1003 WeakPolarHBondContact CG-OE1 3.42Å; R999-E1003 WeakPolarHBondContact O-CG 3.47Å; R999-E1003 PolarHBondContact O-N 3.22Å
1000	L	87.5	Confident	83.1	Confident	21 Å²	21	50.8 Å²	50.8	11%	0.11	25%	0.248	C	C	.	.	H	α-helix	trans	-63.6	-43.2	-179.9	-170.7	76.7	0	0	0	111.9	I890 A894 Y996 V997 K1002 E1003 V1004	I890-L1000 HydrophobicContact CG2-CD2 3.6Å; A894-L1000 HydrophobicContact CB-CD1 4.26Å; A894-L1000 HydrophobicContact CB-CD2 3.51Å; A894-L1000 HydrophobicContact CB-CG 3.81Å; Y996-L1000 HydrophobicContact CE1-CD2 4.37Å; Y996-L1000 WeakPolarHBondContact O-CB 3.46Å; Y996-L1000 PolarHBondContact O-N 2.95Å; V997-L1000 PolarHBondContact O-N 3.13Å; L1000-K1002 VanDerWaalsContact C-N 3.27Å; L1000-K1002 PolarHBondContact O-N 2.67Å; L1000-E1003 PolarHBondContact O-N 3.34Å; L1000-V1004 WeakPolarHBondContact O-CB 3.33Å; L1000-V1004 WeakPolarHBondContact O-CG2 3.26Å; L1000-V1004 PolarHBondContact O-N 2.97Å
1001	C	85.5	Confident	83.6	Confident	1 Å²	1	51 Å²	51	1%	0.007	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-34.8	175.4	-67.1	0	0	0	0	111.7	V997 D1005 H1006 V1010	V997-C1001 WeakPolarHBondContact O-CB 3.37Å; V997-C1001 PolarHBondContact O-N 3.09Å; V997-C1001 PolarHBondContact O-SG 3.36Å; C1001-D1005 PolarHBondContact O-N 3.1Å; C1001-H1006 HydrophobicContact CB-CB 4.29Å; C1001-H1006 PolarHBondContact O-N 3.12Å; C1001-V1010 HydrophobicContact CB-CG2 3.82Å
1002	K	84.3	Confident	83.9	Confident	124 Å²	124	51.8 Å²	51.8	54%	0.539	25%	0.25	S	S	.	.	H	α-helix	trans	-71.1	-35.9	172.9	-76.7	-179.6	178.4	-173.6	0	112.8	L998 R999 L1000 V1004 D1005 V1010	L998-K1002 WeakPolarHBondContact O-CB 3.19Å; L998-K1002 VanDerWaalsContact O-CG 3.27Å; L998-K1002 WeakPolarHBondContact O-CG 3.35Å; L998-K1002 PolarHBondContact O-N 3.04Å; R999-K1002 WeakPolarHBondContact O-CB 3.33Å; R999-K1002 PolarHBondContact O-N 2.81Å; L1000-K1002 VanDerWaalsContact C-N 3.27Å; L1000-K1002 PolarHBondContact O-N 2.67Å; K1002-V1004 VanDerWaalsContact C-N 3.3Å; K1002-D1005 PolarHBondContact O-N 2.77Å; K1002-V1010 HydrophobicContact CG-CG2 3.94Å
1003	E	85.3	Confident	84.1	Confident	132 Å²	132	51.7 Å²	51.7	62%	0.617	25%	0.25	S	C	*	.	H	α-helix	trans	-68.6	-29.9	176.4	-75.7	172.4	-172.7	0	0	112.5	R999 L1000	R999-E1003 WeakPolarHBondContact CG-OE1 3.42Å; R999-E1003 WeakPolarHBondContact O-CG 3.47Å; R999-E1003 PolarHBondContact O-N 3.22Å; L1000-E1003 PolarHBondContact O-N 3.34Å
1004	V	83.1	Confident	84.1	Confident	16 Å²	16	48.8 Å²	48.8	10%	0.097	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	6.1	-178.5	179.4	0	0	0	0	112.4	A894 Y897 H898 L1000 K1002 H1006	A894-V1004 HydrophobicContact CB-CG2 4.2Å; Y897-V1004 HydrophobicContact CD1-CG1 3.48Å; Y897-V1004 VanDerWaalsContact CD1-CG1 3.48Å; Y897-V1004 HydrophobicContact CE1-CG1 4.14Å; Y897-V1004 HydrophobicContact CG-CG1 4.43Å; H898-V1004 HydrophobicContact CB-CG1 4.2Å; L1000-V1004 WeakPolarHBondContact O-CB 3.33Å; L1000-V1004 WeakPolarHBondContact O-CG2 3.26Å; L1000-V1004 PolarHBondContact O-N 2.97Å; K1002-V1004 VanDerWaalsContact C-N 3.3Å; V1004-H1006 VanDerWaalsContact C-N 3.25Å; V1004-H1006 PolarHBondContact O-N 3.05Å
1005	D	82.3	Confident	83.9	Confident	132 Å²	132	51.1 Å²	51.1	71%	0.706	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	34.3	-177.4	-72.9	-33	0	0	0	114.5	C1001 K1002 L1007	C1001-D1005 PolarHBondContact O-N 3.1Å; K1002-D1005 PolarHBondContact O-N 2.77Å; D1005-L1007 PolarHBondContact O-N 2.95Å
1006	H	83.1	Confident	83.7	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.009	23%	0.232	C	C	.	.			trans	-88.4	84.2	-178.7	-169.8	-54.8	0	0	0	112.3	Y897 M907 C1001 V1004 K1008 G1009 V1010	Y897-H1006 AromaticContact CD2-CD2 3.9Å; Y897-H1006 HydrophobicContact CE1-CB 4.25Å; Y897-H1006 AromaticContact CE1-CD2 3.86Å; Y897-H1006 AromaticContact CE2-CD2 3.63Å; Y897-H1006 AromaticContact CZ-CD2 3.59Å; M907-H1006 WeakPolarHBondContact CG-CE1 3.36Å; M907-H1006 PolarHBondContact SD-CE1 3.35Å; C1001-H1006 HydrophobicContact CB-CB 4.29Å; C1001-H1006 PolarHBondContact O-N 3.12Å; V1004-H1006 VanDerWaalsContact C-N 3.25Å; V1004-H1006 PolarHBondContact O-N 3.05Å; H1006-K1008 PolarHBondContact O-N 3.39Å; H1006-G1009 PolarHBondContact CE1-N 3.37Å; H1006-G1009 VanDerWaalsContact CE1-N 3.32Å; H1006-G1009 PolarHBondContact ND1-N 3.25Å; H1006-G1009 PolarHBondContact O-N 3.5Å; H1006-V1010 PolarHBondContact O-N 2.96Å
1007	L	81	Confident	83.3	Confident	104 Å²	104	48.9 Å²	48.9	55%	0.545	23%	0.229	S	C	.	.	H	α-helix	trans	-57.9	-47.2	-174.3	-66.7	172.9	0	0	0	115.5	D1005 G1009 V1010 L1011 L1030	D1005-L1007 PolarHBondContact O-N 2.95Å; L1007-G1009 VanDerWaalsContact C-N 3.32Å; L1007-G1009 PolarHBondContact O-N 3.48Å; L1007-V1010 WeakPolarHBondContact O-CB 3.33Å; L1007-V1010 PolarHBondContact O-N 3.49Å; L1007-V1010 VanDerWaalsContact O-N 3.14Å; L1007-L1011 PolarHBondContact O-N 3.26Å; L1007-L1011 VanDerWaalsContact O-N 3.09Å; L1007-L1030 HydrophobicContact CD2-CD1 4.14Å
1008	K	81.3	Confident	82.7	Confident	125 Å²	125	52.6 Å²	52.6	54%	0.543	25%	0.249	S	C	.	.	H	α-helix	trans	-58.5	-44.4	-178.2	-65.4	177.7	-176.9	173.7	0	111.9	D904 M907 H1006 V1010 L1011 Y1012	D904-K1008 IonicContact OD2-NZ 3.35Å; D904-K1008 PolarHBondContact OD2-NZ 2.91Å; M907-K1008 HydrophobicContact CE-CB 4.25Å; M907-K1008 HydrophobicContact CG-CB 4.42Å; M907-K1008 HydrophobicContact SD-CB 4.04Å; H1006-K1008 PolarHBondContact O-N 3.39Å; K1008-V1010 PolarHBondContact O-N 3.06Å; K1008-L1011 PolarHBondContact O-N 3.24Å; K1008-Y1012 WeakPolarHBondContact O-CB 3.44Å; K1008-Y1012 PolarHBondContact O-N 3.39Å
1009	G	82.1	Confident	82.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-38.3	176.3	0	0	0	0	0	113.1	M907 H1006 L1007 Y1012 I1013	M907-G1009 WeakPolarHBondContact SD-CA 3.44Å; M907-G1009 PolarHBondContact SD-N 3.23Å; M907-G1009 VanDerWaalsContact SD-N 3.41Å; H1006-G1009 PolarHBondContact CE1-N 3.37Å; H1006-G1009 VanDerWaalsContact CE1-N 3.32Å; H1006-G1009 PolarHBondContact ND1-N 3.25Å; H1006-G1009 PolarHBondContact O-N 3.5Å; L1007-G1009 VanDerWaalsContact C-N 3.32Å; L1007-G1009 PolarHBondContact O-N 3.48Å; G1009-Y1012 PolarHBondContact O-N 2.78Å; G1009-I1013 WeakPolarHBondContact O-CG1 3.29Å; G1009-I1013 PolarHBondContact O-N 3.16Å
1010	V	85.1	Confident	82.3	Confident	17 Å²	17	47.5 Å²	47.5	10%	0.103	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-48.9	173.7	172.9	0	0	0	0	110.9	L998 C1001 K1002 H1006 L1007 K1008 Y1012 I1013 L1014	L998-V1010 HydrophobicContact CD1-CB 4.39Å; L998-V1010 HydrophobicContact CD1-CG1 3.9Å; L998-V1010 HydrophobicContact CD1-CG2 4.45Å; C1001-V1010 HydrophobicContact CB-CG2 3.82Å; K1002-V1010 HydrophobicContact CG-CG2 3.94Å; H1006-V1010 PolarHBondContact O-N 2.96Å; L1007-V1010 WeakPolarHBondContact O-CB 3.33Å; L1007-V1010 PolarHBondContact O-N 3.49Å; L1007-V1010 VanDerWaalsContact O-N 3.14Å; K1008-V1010 PolarHBondContact O-N 3.06Å; V1010-Y1012 VanDerWaalsContact C-N 3.34Å; V1010-Y1012 PolarHBondContact O-N 2.9Å; V1010-I1013 PolarHBondContact O-N 3.46Å; V1010-L1014 HydrophobicContact CG1-CD1 4.05Å; V1010-L1014 VanDerWaalsContact O-CG 3.28Å; V1010-L1014 WeakPolarHBondContact O-CG 3.46Å; V1010-L1014 PolarHBondContact O-N 2.95Å; V1010-L1014 VanDerWaalsContact O-N 3.1Å
1011	L	83.8	Confident	82.1	Confident	15 Å²	15	52.8 Å²	52.8	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-62.1	-41.7	178	-68.5	168.3	0	0	0	111.6	L1007 K1008 L1014 Q1015 L1026	L1007-L1011 PolarHBondContact O-N 3.26Å; L1007-L1011 VanDerWaalsContact O-N 3.09Å; K1008-L1011 PolarHBondContact O-N 3.24Å; L1011-L1014 PolarHBondContact O-N 3.31Å; L1011-Q1015 WeakPolarHBondContact O-CG 3.2Å; L1011-Q1015 PolarHBondContact O-N 2.95Å; L1011-L1026 HydrophobicContact CD2-CB 4.29Å
1012	Y	83	Confident	82	Confident	31 Å²	31	57.5 Å²	57.5	12%	0.122	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-47.6	178.5	-171.3	-106.4	0	0	0	113	M907 L910 E911 S914 I918 K1008 G1009 V1010 L1014 Q1015 L1016	M907-Y1012 HydrophobicContact CE-CG 4.26Å; L910-Y1012 HydrophobicContact CB-CD1 4.23Å; L910-Y1012 HydrophobicContact CB-CE1 4.19Å; E911-Y1012 HydrophobicContact CG-CE2 4.1Å; S914-Y1012 VanDerWaalsContact OG-CE1 3.28Å; S914-Y1012 WeakPolarHBondContact OG-CE1 3.38Å; S914-Y1012 VanDerWaalsContact OG-CZ 3.29Å; S914-Y1012 PolarHBondContact OG-OH 3.26Å; I918-Y1012 WeakPolarHBondContact CD1-OH 3.39Å; K1008-Y1012 WeakPolarHBondContact O-CB 3.44Å; K1008-Y1012 PolarHBondContact O-N 3.39Å; G1009-Y1012 PolarHBondContact O-N 2.78Å; V1010-Y1012 VanDerWaalsContact C-N 3.34Å; V1010-Y1012 PolarHBondContact O-N 2.9Å; Y1012-L1014 VanDerWaalsContact C-N 3.33Å; Y1012-L1014 PolarHBondContact O-N 3.03Å; Y1012-Q1015 WeakPolarHBondContact O-CB 3.47Å; Y1012-Q1015 PolarHBondContact O-N 3.47Å; Y1012-L1016 HydrophobicContact CD1-CD1 3.79Å; Y1012-L1016 HydrophobicContact CD1-CG 4.5Å; Y1012-L1016 HydrophobicContact CE1-CD1 3.44Å; Y1012-L1016 VanDerWaalsContact CE1-CD1 3.44Å; Y1012-L1016 HydrophobicContact CE1-CG 4.18Å; Y1012-L1016 PolarHBondContact O-N 3.19Å
1013	I	83.6	Confident	81.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65	-37.4	177.5	-64.4	-58.7	0	0	0	111.2	L910 Y992 P994 V997 L998 G1009 V1010 L1016 L1017	L910-I1013 HydrophobicContact CD2-CD1 4.47Å; Y992-I1013 HydrophobicContact CE2-CD1 3.89Å; P994-I1013 HydrophobicContact CB-CG2 3.89Å; V997-I1013 HydrophobicContact CB-CD1 4.4Å; V997-I1013 HydrophobicContact CB-CG1 4.45Å; V997-I1013 HydrophobicContact CG1-CD1 3.96Å; V997-I1013 HydrophobicContact CG1-CG1 3.91Å; L998-I1013 HydrophobicContact CB-CG2 4.28Å; L998-I1013 HydrophobicContact CD1-CB 4.47Å; L998-I1013 HydrophobicContact CD1-CG2 4.38Å; G1009-I1013 WeakPolarHBondContact O-CG1 3.29Å; G1009-I1013 PolarHBondContact O-N 3.16Å; V1010-I1013 PolarHBondContact O-N 3.46Å; I1013-L1016 HydrophobicContact CD1-CD1 4.07Å; I1013-L1016 WeakPolarHBondContact O-CB 3.39Å; I1013-L1016 PolarHBondContact O-N 3.24Å; I1013-L1017 HydrophobicContact CG2-CD1 3.96Å; I1013-L1017 HydrophobicContact CG2-CG 4.37Å; I1013-L1017 WeakPolarHBondContact O-CB 3.39Å; I1013-L1017 WeakPolarHBondContact O-CG 3.45Å; I1013-L1017 PolarHBondContact O-N 3.09Å
1014	L	83.8	Confident	81.9	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-65.2	-39.3	175.1	-70.3	169.9	0	0	0	112.5	L998 V1010 L1011 Y1012 L1016 L1017 M1019 A1023 L1026	L998-L1014 HydrophobicContact CD1-CG 4.41Å; V1010-L1014 HydrophobicContact CG1-CD1 4.05Å; V1010-L1014 VanDerWaalsContact O-CG 3.28Å; V1010-L1014 WeakPolarHBondContact O-CG 3.46Å; V1010-L1014 PolarHBondContact O-N 2.95Å; V1010-L1014 VanDerWaalsContact O-N 3.1Å; L1011-L1014 PolarHBondContact O-N 3.31Å; Y1012-L1014 VanDerWaalsContact C-N 3.33Å; Y1012-L1014 PolarHBondContact O-N 3.03Å; L1014-L1016 VanDerWaalsContact C-N 3.33Å; L1014-L1017 PolarHBondContact O-N 3.24Å; L1014-M1019 HydrophobicContact CD2-CB 4.36Å; L1014-M1019 HydrophobicContact CD2-SD 4.26Å; L1014-M1019 PolarHBondContact O-N 2.79Å; L1014-M1019 VanDerWaalsContact O-N 3.12Å; L1014-A1023 HydrophobicContact CB-CB 3.99Å; L1014-L1026 HydrophobicContact CD1-CD1 3.34Å
1015	Q	77.9	Confident	82	Confident	53 Å²	53	49.3 Å²	49.3	25%	0.248	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-39.2	172.5	-71.7	174.8	8	0	0	111.8	L1011 Y1012 L1017 D1018 H1020 A1023 I1039	L1011-Q1015 WeakPolarHBondContact O-CG 3.2Å; L1011-Q1015 PolarHBondContact O-N 2.95Å; Y1012-Q1015 WeakPolarHBondContact O-CB 3.47Å; Y1012-Q1015 PolarHBondContact O-N 3.47Å; Q1015-L1017 VanDerWaalsContact C-N 3.35Å; Q1015-D1018 PolarHBondContact O-N 3.48Å; Q1015-H1020 PolarHBondContact O-CE1 2.9Å; Q1015-H1020 VanDerWaalsContact O-CE1 3.27Å; Q1015-A1023 HydrophobicContact CG-CB 4.44Å; Q1015-I1039 HydrophobicContact CG-CG1 4.3Å
1016	L	79.5	Confident	82	Confident	14 Å²	14	45.7 Å²	45.7	7%	0.073	22%	0.221	C	C	.	.	H	α-helix	trans	-66.3	-34.9	175.8	-78.7	171.1	0	0	0	113	I918 Y1012 I1013 L1014 D1018	I918-L1016 HydrophobicContact CD1-CD2 4.03Å; I918-L1016 HydrophobicContact CG1-CD2 3.81Å; Y1012-L1016 HydrophobicContact CD1-CD1 3.79Å; Y1012-L1016 HydrophobicContact CD1-CG 4.5Å; Y1012-L1016 HydrophobicContact CE1-CD1 3.44Å; Y1012-L1016 VanDerWaalsContact CE1-CD1 3.44Å; Y1012-L1016 HydrophobicContact CE1-CG 4.18Å; Y1012-L1016 PolarHBondContact O-N 3.19Å; I1013-L1016 HydrophobicContact CD1-CD1 4.07Å; I1013-L1016 WeakPolarHBondContact O-CB 3.39Å; I1013-L1016 PolarHBondContact O-N 3.24Å; L1014-L1016 VanDerWaalsContact C-N 3.33Å; L1016-D1018 PolarHBondContact O-N 3.33Å
1017	L	78.9	Confident	82	Confident	41 Å²	41	45.6 Å²	45.6	22%	0.215	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	8.1	179.6	-72.6	174.4	0	0	0	114.3	Q987 P994 I1013 L1014 Q1015 M1019	Q987-L1017 HydrophobicContact CG-CD2 4.27Å; P994-L1017 HydrophobicContact CB-CD1 4.26Å; P994-L1017 HydrophobicContact CB-CD2 3.96Å; P994-L1017 HydrophobicContact CB-CG 4.24Å; P994-L1017 HydrophobicContact CG-CD2 3.7Å; I1013-L1017 HydrophobicContact CG2-CD1 3.96Å; I1013-L1017 HydrophobicContact CG2-CG 4.37Å; I1013-L1017 WeakPolarHBondContact O-CB 3.39Å; I1013-L1017 WeakPolarHBondContact O-CG 3.45Å; I1013-L1017 PolarHBondContact O-N 3.09Å; L1014-L1017 PolarHBondContact O-N 3.24Å; Q1015-L1017 VanDerWaalsContact C-N 3.35Å; L1017-M1019 HydrophobicContact CB-CG 3.97Å; L1017-M1019 HydrophobicContact CB-SD 4.19Å; L1017-M1019 HydrophobicContact CD1-SD 4.42Å; L1017-M1019 WeakPolarHBondContact O-CG 3.29Å; L1017-M1019 PolarHBondContact O-N 3.4Å
1018	D	75.1	Confident	82.1	Confident	79 Å²	79	41.9 Å²	41.9	42%	0.422	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	15.3	-174.4	-79.4	-50.5	0	0	0	114.6	K921 I986 Q1015 L1016 H1020	K921-D1018 WeakPolarHBondContact CE-OD2 3.41Å; K921-D1018 IonicContact NZ-OD1 3.51Å; K921-D1018 PolarHBondContact NZ-OD1 3.01Å; K921-D1018 IonicContact NZ-OD2 3.92Å; K921-D1018 PolarHBondContact NZ-OD2 2.93Å; I986-D1018 WeakPolarHBondContact CD1-OD2 3.38Å; Q1015-D1018 PolarHBondContact O-N 3.48Å; L1016-D1018 PolarHBondContact O-N 3.33Å; D1018-H1020 PolarHBondContact O-N 3.04Å; D1018-H1020 IonicContact OD1-CD2 2.84Å; D1018-H1020 IonicContact OD1-NE2 2.86Å; D1018-H1020 PolarHBondContact OD1-NE2 3.45Å
1019	M	81.7	Confident	82.1	Confident	68 Å²	68	42 Å²	42	34%	0.335	20%	0.204	S	C	.	.			trans	-87.6	48.9	179.1	-55.3	-176.7	83.4	0	0	110.4	L1014 L1017 Q1021 E1022 A1023	L1014-M1019 HydrophobicContact CD2-CB 4.36Å; L1014-M1019 HydrophobicContact CD2-SD 4.26Å; L1014-M1019 PolarHBondContact O-N 2.79Å; L1014-M1019 VanDerWaalsContact O-N 3.12Å; L1017-M1019 HydrophobicContact CB-CG 3.97Å; L1017-M1019 HydrophobicContact CB-SD 4.19Å; L1017-M1019 HydrophobicContact CD1-SD 4.42Å; L1017-M1019 WeakPolarHBondContact O-CG 3.29Å; L1017-M1019 PolarHBondContact O-N 3.4Å; M1019-Q1021 VanDerWaalsContact C-N 3.27Å; M1019-Q1021 PolarHBondContact O-N 3.27Å; M1019-E1022 HydrophobicContact CB-CB 4.36Å; M1019-E1022 HydrophobicContact CE-CG 4.47Å; M1019-E1022 WeakPolarHBondContact CE-OE1 3.38Å; M1019-E1022 WeakPolarHBondContact CE-OE2 3.15Å; M1019-E1022 PolarHBondContact O-N 2.91Å; M1019-E1022 VanDerWaalsContact O-N 3.14Å; M1019-A1023 PolarHBondContact O-N 2.54Å
1020	H	80	Confident	81.9	Confident	15 Å²	15	46.3 Å²	46.3	7%	0.069	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-32.1	-173.1	-62.6	-63.9	0	0	0	113.4	Q1015 D1018 L1024 L1045 L1053	Q1015-H1020 PolarHBondContact O-CE1 2.9Å; Q1015-H1020 VanDerWaalsContact O-CE1 3.27Å; D1018-H1020 PolarHBondContact O-N 3.04Å; D1018-H1020 IonicContact OD1-CD2 2.84Å; D1018-H1020 IonicContact OD1-NE2 2.86Å; D1018-H1020 PolarHBondContact OD1-NE2 3.45Å; H1020-L1024 VanDerWaalsContact O-CB 3.26Å; H1020-L1024 WeakPolarHBondContact O-CB 3.4Å; H1020-L1024 PolarHBondContact O-N 2.78Å; H1020-L1045 HydrophobicContact CB-CD2 4.34Å; H1020-L1045 WeakPolarHBondContact CD2-CD2 3.05Å; H1020-L1053 HydrophobicContact CB-CD1 4Å
1021	Q	83.1	Confident	81.4	Confident	131 Å²	131	51.8 Å²	51.8	61%	0.612	26%	0.255	S	S	*	.	H	α-helix	trans	-67.9	-40.2	176.2	-172.3	176.7	-6.7	0	0	111.8	M1019 Q1025	M1019-Q1021 VanDerWaalsContact C-N 3.27Å; M1019-Q1021 PolarHBondContact O-N 3.27Å; Q1021-Q1025 VanDerWaalsContact O-CB 3.29Å; Q1021-Q1025 WeakPolarHBondContact O-CB 3.27Å; Q1021-Q1025 PolarHBondContact O-N 2.64Å
1022	E	83.3	Confident	81.1	Confident	101 Å²	101	54.3 Å²	54.3	47%	0.472	27%	0.269	S	S	.	.	H	α-helix	trans	-72.2	-38.5	176	-65.3	-178.5	-167.6	0	0	111.5	M1019 Q1025 L1026	M1019-E1022 HydrophobicContact CB-CB 4.36Å; M1019-E1022 HydrophobicContact CE-CG 4.47Å; M1019-E1022 WeakPolarHBondContact CE-OE1 3.38Å; M1019-E1022 WeakPolarHBondContact CE-OE2 3.15Å; M1019-E1022 PolarHBondContact O-N 2.91Å; M1019-E1022 VanDerWaalsContact O-N 3.14Å; E1022-Q1025 PolarHBondContact O-N 3.34Å; E1022-L1026 WeakPolarHBondContact O-CB 3.36Å; E1022-L1026 WeakPolarHBondContact O-CG 3.27Å; E1022-L1026 PolarHBondContact O-N 3.07Å
1023	A	83.1	Confident	80.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.8	-45.3	172.8	0	0	0	0	0	111.4	L1014 Q1015 M1019 L1026 A1027 I1039	L1014-A1023 HydrophobicContact CB-CB 3.99Å; Q1015-A1023 HydrophobicContact CG-CB 4.44Å; M1019-A1023 PolarHBondContact O-N 2.54Å; A1023-L1026 PolarHBondContact O-N 2.83Å; A1023-A1027 WeakPolarHBondContact O-CB 3.45Å; A1023-A1027 PolarHBondContact O-N 3.29Å; A1023-I1039 HydrophobicContact CB-CD1 4.07Å
1024	L	84.7	Confident	80.7	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-63.9	-44.1	176.5	-171.1	76.4	0	0	0	110.8	H1020 A1027 I1028 A1036 I1039 L1053 Q1056	H1020-L1024 VanDerWaalsContact O-CB 3.26Å; H1020-L1024 WeakPolarHBondContact O-CB 3.4Å; H1020-L1024 PolarHBondContact O-N 2.78Å; L1024-A1027 PolarHBondContact O-N 3.46Å; L1024-I1028 HydrophobicContact CD2-CD1 4.25Å; L1024-I1028 HydrophobicContact CG-CD1 3.89Å; L1024-I1028 WeakPolarHBondContact O-CB 3.5Å; L1024-I1028 WeakPolarHBondContact O-CG1 3.48Å; L1024-I1028 PolarHBondContact O-N 2.93Å; L1024-A1036 HydrophobicContact CD1-CB 3.84Å; L1024-I1039 HydrophobicContact CB-CG2 4.23Å; L1024-I1039 HydrophobicContact CD1-CB 4.37Å; L1024-I1039 HydrophobicContact CD1-CG2 4.28Å; L1024-L1053 HydrophobicContact CD2-CB 4.42Å; L1024-L1053 HydrophobicContact CD2-CD2 3.94Å; L1024-Q1056 HydrophobicContact CD2-CB 4.27Å
1025	Q	84.5	Confident	80.3	Confident	97 Å²	97	60.8 Å²	60.8	45%	0.453	31%	0.311	S	S	.	.	H	α-helix	trans	-62.7	-42.9	178	-177.6	63.2	26.3	0	0	112	Q1021 E1022 I1028 E1029	Q1021-Q1025 VanDerWaalsContact O-CB 3.29Å; Q1021-Q1025 WeakPolarHBondContact O-CB 3.27Å; Q1021-Q1025 PolarHBondContact O-N 2.64Å; E1022-Q1025 PolarHBondContact O-N 3.34Å; Q1025-I1028 PolarHBondContact O-N 3.2Å; Q1025-E1029 WeakPolarHBondContact CG-OE1 3.5Å; Q1025-E1029 PolarHBondContact NE2-OE1 3.13Å; Q1025-E1029 WeakPolarHBondContact O-CB 3.48Å; Q1025-E1029 VanDerWaalsContact O-CG 3.28Å; Q1025-E1029 WeakPolarHBondContact O-CG 3.5Å; Q1025-E1029 PolarHBondContact O-N 2.61Å
1026	L	83.7	Confident	80.4	Confident	57 Å²	57	58.3 Å²	58.3	30%	0.298	30%	0.299	S	S	.	.	H	α-helix	trans	-65.9	-39.4	175.1	-74.7	168.8	0	0	0	112	L1011 L1014 E1022 A1023 I1028 E1029 L1030	L1011-L1026 HydrophobicContact CD2-CB 4.29Å; L1014-L1026 HydrophobicContact CD1-CD1 3.34Å; E1022-L1026 WeakPolarHBondContact O-CB 3.36Å; E1022-L1026 WeakPolarHBondContact O-CG 3.27Å; E1022-L1026 PolarHBondContact O-N 3.07Å; A1023-L1026 PolarHBondContact O-N 2.83Å; L1026-I1028 VanDerWaalsContact C-N 3.33Å; L1026-E1029 PolarHBondContact O-N 3.3Å; L1026-L1030 WeakPolarHBondContact O-CB 3.4Å; L1026-L1030 WeakPolarHBondContact O-CD1 3.39Å; L1026-L1030 WeakPolarHBondContact O-CG 3.31Å; L1026-L1030 PolarHBondContact O-N 2.96Å
1027	A	82.6	Confident	80.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.7	-39.8	174.1	0	0	0	0	0	111.8	A1023 L1024 L1030 N1031 D1032 A1036 I1039	A1023-A1027 WeakPolarHBondContact O-CB 3.45Å; A1023-A1027 PolarHBondContact O-N 3.29Å; L1024-A1027 PolarHBondContact O-N 3.46Å; A1027-L1030 PolarHBondContact O-N 3.23Å; A1027-N1031 PolarHBondContact O-N 3.02Å; A1027-D1032 PolarHBondContact O-N 2.79Å; A1027-A1036 HydrophobicContact CB-CB 4.19Å; A1027-I1039 HydrophobicContact CB-CD1 3.9Å
1028	I	83.7	Confident	80.4	Confident	26 Å²	26	64.6 Å²	64.6	13%	0.133	33%	0.326	C	S	.	.	H	α-helix	trans	-66	-44.7	174.2	-70.5	166.6	0	0	0	110.9	L1024 Q1025 L1026 L1030 N1031	L1024-I1028 HydrophobicContact CD2-CD1 4.25Å; L1024-I1028 HydrophobicContact CG-CD1 3.89Å; L1024-I1028 WeakPolarHBondContact O-CB 3.5Å; L1024-I1028 WeakPolarHBondContact O-CG1 3.48Å; L1024-I1028 PolarHBondContact O-N 2.93Å; Q1025-I1028 PolarHBondContact O-N 3.2Å; L1026-I1028 VanDerWaalsContact C-N 3.33Å; I1028-L1030 PolarHBondContact O-N 2.84Å; I1028-N1031 PolarHBondContact O-N 3.15Å
1029	E	81.5	Confident	80.6	Confident	126 Å²	126	60.9 Å²	60.9	59%	0.589	31%	0.306	S	S	*	.	H	α-helix	trans	-63.1	-30.4	177.5	-76.9	172.3	-168.1	0	0	112.7	Q1025 L1026 N1031	Q1025-E1029 WeakPolarHBondContact CG-OE1 3.5Å; Q1025-E1029 PolarHBondContact NE2-OE1 3.13Å; Q1025-E1029 WeakPolarHBondContact O-CB 3.48Å; Q1025-E1029 VanDerWaalsContact O-CG 3.28Å; Q1025-E1029 WeakPolarHBondContact O-CG 3.5Å; Q1025-E1029 PolarHBondContact O-N 2.61Å; L1026-E1029 PolarHBondContact O-N 3.3Å; E1029-N1031 VanDerWaalsContact C-N 3.33Å
1030	L	76.3	Confident	80.4	Confident	91 Å²	91	57.7 Å²	57.7	48%	0.476	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	1.4	175.1	-66.1	169.1	0	0	0	113.5	L1007 L1026 A1027 I1028 D1032	L1007-L1030 HydrophobicContact CD2-CD1 4.14Å; L1026-L1030 WeakPolarHBondContact O-CB 3.4Å; L1026-L1030 WeakPolarHBondContact O-CD1 3.39Å; L1026-L1030 WeakPolarHBondContact O-CG 3.31Å; L1026-L1030 PolarHBondContact O-N 2.96Å; A1027-L1030 PolarHBondContact O-N 3.23Å; I1028-L1030 PolarHBondContact O-N 2.84Å; L1030-D1032 PolarHBondContact O-N 2.84Å
1031	N	75.2	Confident	80.4	Confident	132 Å²	132	61.4 Å²	61.4	71%	0.706	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	27	-176.4	-91.7	-4.1	0	0	0	114.8	A1027 I1028 E1029 I1033	A1027-N1031 PolarHBondContact O-N 3.02Å; I1028-N1031 PolarHBondContact O-N 3.15Å; E1029-N1031 VanDerWaalsContact C-N 3.33Å; N1031-I1033 PolarHBondContact O-N 2.86Å
1032	D	78	Confident	79.8	Confident	68 Å²	68	56.2 Å²	56.2	36%	0.364	29%	0.286	S	S	.	.			trans	-95.7	80.9	179	-166.3	-16.7	0	0	0	111.2	A1027 L1030 P1034 C1035 A1036	A1027-D1032 PolarHBondContact O-N 2.79Å; L1030-D1032 PolarHBondContact O-N 2.84Å; D1032-P1034 VanDerWaalsContact OD1-CD 3.22Å; D1032-P1034 WeakPolarHBondContact OD1-CD 3.27Å; D1032-C1035 HydrophobicContact CB-CB 4.11Å; D1032-C1035 VanDerWaalsContact CG-CB 3.41Å; D1032-C1035 PolarHBondContact O-N 2.85Å; D1032-C1035 WeakPolarHBondContact OD1-CB 3.48Å; D1032-C1035 PolarHBondContact OD1-N 2.91Å; D1032-C1035 WeakPolarHBondContact OD2-CB 3.45Å; D1032-A1036 WeakPolarHBondContact O-CB 3.37Å; D1032-A1036 PolarHBondContact O-N 3.22Å
1033	I	78.3	Confident	79	Confident	74 Å²	74	57.9 Å²	57.9	38%	0.379	29%	0.294	S	S	.	.	H	α-helix	trans	-59.7	-42.5	177.4	-56.2	172.5	0	0	0	112.3	N1031 C1035 A1036 K1037 I1061	N1031-I1033 PolarHBondContact O-N 2.86Å; I1033-C1035 PolarHBondContact O-N 2.84Å; I1033-A1036 PolarHBondContact O-N 3.1Å; I1033-K1037 WeakPolarHBondContact O-CG 3.3Å; I1033-K1037 PolarHBondContact O-N 2.88Å; I1033-I1061 HydrophobicContact CG2-CD1 4.31Å
1034	P	79.3	Confident	78	Confident	86 Å²	86	60 Å²	60	56%	0.558	30%	0.303	S	S	*	.	H	α-helix	trans	-54.5	-48.9	173.6	-25.7	32.6	0	0	0	113.2	D1032 A1036 K1037 E1038	D1032-P1034 VanDerWaalsContact OD1-CD 3.22Å; D1032-P1034 WeakPolarHBondContact OD1-CD 3.27Å; P1034-A1036 VanDerWaalsContact C-N 3.32Å; P1034-A1036 PolarHBondContact O-N 2.85Å; P1034-K1037 WeakPolarHBondContact O-CB 3.32Å; P1034-K1037 PolarHBondContact O-N 2.85Å; P1034-E1038 PolarHBondContact O-N 3.13Å
1035	C	75.8	Confident	77.2	Confident	16 Å²	16	60.8 Å²	60.8	11%	0.108	31%	0.307	C	S	.	.	H	α-helix	trans	-67.4	-35.2	179.1	-163.9	0	0	0	0	111.9	D1032 I1033 K1037 E1038 I1039	D1032-C1035 HydrophobicContact CB-CB 4.11Å; D1032-C1035 VanDerWaalsContact CG-CB 3.41Å; D1032-C1035 PolarHBondContact O-N 2.85Å; D1032-C1035 WeakPolarHBondContact OD1-CB 3.48Å; D1032-C1035 PolarHBondContact OD1-N 2.91Å; D1032-C1035 WeakPolarHBondContact OD2-CB 3.45Å; I1033-C1035 PolarHBondContact O-N 2.84Å; C1035-K1037 VanDerWaalsContact C-N 3.33Å; C1035-K1037 PolarHBondContact O-N 3.42Å; C1035-E1038 PolarHBondContact O-N 3.01Å; C1035-I1039 WeakPolarHBondContact O-CD1 3.26Å; C1035-I1039 VanDerWaalsContact O-CG1 3.31Å; C1035-I1039 WeakPolarHBondContact O-CG1 3.42Å; C1035-I1039 PolarHBondContact O-N 3.42Å
1036	A	80.3	Confident	76.4	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-37.2	172.8	0	0	0	0	0	112.6	L1024 A1027 D1032 I1033 P1034 A1040 L1057	L1024-A1036 HydrophobicContact CD1-CB 3.84Å; A1027-A1036 HydrophobicContact CB-CB 4.19Å; D1032-A1036 WeakPolarHBondContact O-CB 3.37Å; D1032-A1036 PolarHBondContact O-N 3.22Å; I1033-A1036 PolarHBondContact O-N 3.1Å; P1034-A1036 VanDerWaalsContact C-N 3.32Å; P1034-A1036 PolarHBondContact O-N 2.85Å; A1036-A1040 WeakPolarHBondContact O-CB 3.42Å; A1036-A1040 PolarHBondContact O-N 2.84Å; A1036-L1057 HydrophobicContact CB-CD1 3.86Å
1037	K	80.4	Confident	75.7	Confident	59 Å²	59	61 Å²	61	26%	0.257	32%	0.317	S	S	.	.	H	α-helix	trans	-63.5	-44.1	172	-74.3	-175.1	175.8	-156.6	0	111.4	I1033 P1034 C1035 I1039 A1040 Q1041 L1057 D1077	I1033-K1037 WeakPolarHBondContact O-CG 3.3Å; I1033-K1037 PolarHBondContact O-N 2.88Å; P1034-K1037 WeakPolarHBondContact O-CB 3.32Å; P1034-K1037 PolarHBondContact O-N 2.85Å; C1035-K1037 VanDerWaalsContact C-N 3.33Å; C1035-K1037 PolarHBondContact O-N 3.42Å; K1037-I1039 PolarHBondContact O-N 3.48Å; K1037-A1040 PolarHBondContact O-N 2.82Å; K1037-Q1041 WeakPolarHBondContact O-CB 3.4Å; K1037-Q1041 PolarHBondContact O-N 2.61Å; K1037-L1057 HydrophobicContact CG-CD2 4.03Å; K1037-D1077 IonicContact NZ-OD2 2.6Å; K1037-D1077 PolarHBondContact NZ-OD2 3.12Å
1038	E	78.3	Confident	75.5	Confident	128 Å²	128	65.8 Å²	65.8	60%	0.598	34%	0.341	S	S	*	.	H	α-helix	trans	-61	-44.1	177.3	-70.2	177.1	173.3	0	0	111.9	P1034 C1035 A1040 Q1041 S1042	P1034-E1038 PolarHBondContact O-N 3.13Å; C1035-E1038 PolarHBondContact O-N 3.01Å; E1038-A1040 PolarHBondContact O-N 2.8Å; E1038-Q1041 PolarHBondContact O-N 2.88Å; E1038-S1042 PolarHBondContact O-N 3.41Å; E1038-S1042 VanDerWaalsContact O-N 3.15Å
1039	I	78.9	Confident	75.2	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-60.9	-44.8	176.1	-66.9	160.5	0	0	0	110.9	Q1015 A1023 L1024 A1027 C1035 K1037 S1042	Q1015-I1039 HydrophobicContact CG-CG1 4.3Å; A1023-I1039 HydrophobicContact CB-CD1 4.07Å; L1024-I1039 HydrophobicContact CB-CG2 4.23Å; L1024-I1039 HydrophobicContact CD1-CB 4.37Å; L1024-I1039 HydrophobicContact CD1-CG2 4.28Å; A1027-I1039 HydrophobicContact CB-CD1 3.9Å; C1035-I1039 WeakPolarHBondContact O-CD1 3.26Å; C1035-I1039 VanDerWaalsContact O-CG1 3.31Å; C1035-I1039 WeakPolarHBondContact O-CG1 3.42Å; C1035-I1039 PolarHBondContact O-N 3.42Å; K1037-I1039 PolarHBondContact O-N 3.48Å; I1039-S1042 VanDerWaalsContact O-CB 3.27Å; I1039-S1042 WeakPolarHBondContact O-CB 3.28Å; I1039-S1042 PolarHBondContact O-N 2.81Å
1040	A	77.9	Confident	75.1	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-71	-29.9	178.3	0	0	0	0	0	112.7	A1036 K1037 E1038 S1042 R1050 L1053 W1054 L1057	A1036-A1040 WeakPolarHBondContact O-CB 3.42Å; A1036-A1040 PolarHBondContact O-N 2.84Å; K1037-A1040 PolarHBondContact O-N 2.82Å; E1038-A1040 PolarHBondContact O-N 2.8Å; A1040-S1042 VanDerWaalsContact C-N 3.29Å; A1040-S1042 PolarHBondContact O-N 2.88Å; A1040-R1050 WeakPolarHBondContact O-CG 3.45Å; A1040-L1053 HydrophobicContact CB-CB 4.26Å; A1040-W1054 VanDerWaalsContact C-NE1 3.35Å; A1040-W1054 HydrophobicContact CB-CD2 4.08Å; A1040-W1054 HydrophobicContact CB-CG 4.28Å; A1040-W1054 HydrophobicContact CB-CZ2 4.26Å; A1040-W1054 PolarHBondContact O-NE1 3.3Å; A1040-L1057 HydrophobicContact CB-CD2 4.23Å
1041	Q	78.9	Confident	75.3	Confident	94 Å²	94	64 Å²	64	44%	0.439	33%	0.327	S	S	.	.	H	α-helix	trans	-80.1	-10.1	-180	-167.4	164.2	-4.9	0	0	113.4	K1037 E1038 E1043 R1050 W1054	K1037-Q1041 WeakPolarHBondContact O-CB 3.4Å; K1037-Q1041 PolarHBondContact O-N 2.61Å; E1038-Q1041 PolarHBondContact O-N 2.88Å; Q1041-E1043 PolarHBondContact O-N 3.32Å; Q1041-R1050 PolarHBondContact O-NH1 2.79Å; Q1041-R1050 VanDerWaalsContact O-NH1 3.16Å; Q1041-R1050 PolarHBondContact O-NH2 3.48Å; Q1041-R1050 VanDerWaalsContact O-NH2 3.13Å; Q1041-W1054 HydrophobicContact CB-CZ2 3.96Å; Q1041-W1054 HydrophobicContact CG-CZ2 4.46Å
1042	S	71.4	Confident	75.6	Confident	21 Å²	21	62.9 Å²	62.9	15%	0.147	32%	0.318	C	S	.	.			trans	-44.8	120.5	-179.6	174.8	0	0	0	0	113	E1038 I1039 A1040 F1044 L1045	E1038-S1042 PolarHBondContact O-N 3.41Å; E1038-S1042 VanDerWaalsContact O-N 3.15Å; I1039-S1042 VanDerWaalsContact O-CB 3.27Å; I1039-S1042 WeakPolarHBondContact O-CB 3.28Å; I1039-S1042 PolarHBondContact O-N 2.81Å; A1040-S1042 VanDerWaalsContact C-N 3.29Å; A1040-S1042 PolarHBondContact O-N 2.88Å; S1042-F1044 PolarHBondContact O-N 3.08Å; S1042-F1044 WeakPolarHBondContact OG-CD2 3.49Å; S1042-L1045 PolarHBondContact O-N 2.99Å
1043	E	67.1	Low	75.8	Confident	136 Å²	136	60 Å²	60	64%	0.636	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-18.3	-179.3	-62.4	176.4	160.6	0	0	113	R922 Q1041 L1045	R922-E1043 IonicContact NH2-OE2 2.66Å; R922-E1043 PolarHBondContact NH2-OE2 3.38Å; R922-E1043 VanDerWaalsContact NH2-OE2 3.11Å; Q1041-E1043 PolarHBondContact O-N 3.32Å; E1043-L1045 VanDerWaalsContact C-N 3.27Å; E1043-L1045 PolarHBondContact O-N 2.77Å
1044	F	62	Low	76.1	Confident	46 Å²	46	56.5 Å²	56.5	20%	0.202	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-9.9	-177.9	-51.5	-78.8	0	0	0	113.4	I918 R922 Q925 S1042	I918-F1044 HydrophobicContact CG2-CD1 4.35Å; I918-F1044 HydrophobicContact CG2-CE1 3.27Å; I918-F1044 HydrophobicContact CG2-CE2 4.23Å; I918-F1044 HydrophobicContact CG2-CZ 3.21Å; R922-F1044 HydrophobicContact CG-CD1 3.89Å; R922-F1044 HydrophobicContact CG-CE1 3.45Å; R922-F1044 VanDerWaalsContact CG-CE1 3.45Å; Q925-F1044 PolarHBondContact NE2-O 3.49Å; Q925-F1044 PolarHBondContact OE1-O 2.99Å; S1042-F1044 PolarHBondContact O-N 3.08Å; S1042-F1044 WeakPolarHBondContact OG-CD2 3.49Å
1045	L	66.4	Low	76.2	Confident	18 Å²	18	54.5 Å²	54.5	9%	0.094	27%	0.269	C	S	.	.	S	Bend	trans	-83.1	134	180	-67.4	167.8	0	0	0	109.9	H1020 S1042 E1043 S1047 V1049 R1050 L1053	H1020-L1045 HydrophobicContact CB-CD2 4.34Å; H1020-L1045 WeakPolarHBondContact CD2-CD2 3.05Å; S1042-L1045 PolarHBondContact O-N 2.99Å; E1043-L1045 VanDerWaalsContact C-N 3.27Å; E1043-L1045 PolarHBondContact O-N 2.77Å; L1045-S1047 PolarHBondContact O-N 3.41Å; L1045-V1049 HydrophobicContact CD2-CB 4.37Å; L1045-V1049 HydrophobicContact CD2-CG1 3.85Å; L1045-R1050 HydrophobicContact CB-CB 3.91Å; L1045-R1050 HydrophobicContact CD1-CB 4.44Å; L1045-L1053 HydrophobicContact CD1-CD1 3.54Å; L1045-L1053 HydrophobicContact CD2-CD1 4.3Å
1046	N	67.9	Low	76.4	Confident	91 Å²	91	57.7 Å²	57.7	49%	0.487	28%	0.282	S	S	.	.			trans	-54	141.4	166.2	-173.2	-8.5	0	0	0	109.2	I1048 V1049 R1050	N1046-I1048 PolarHBondContact O-N 2.84Å; N1046-V1049 HydrophobicContact CB-CG2 4.49Å; N1046-V1049 PolarHBondContact O-N 2.92Å; N1046-R1050 PolarHBondContact O-N 3.49Å
1047	S	70.7	Confident	76.5	Confident	67 Å²	67	57.8 Å²	57.8	47%	0.469	28%	0.282	S	S	.	.	H	α-helix	trans	-44.3	-34.9	177.8	63.1	0	0	0	0	113.6	L1045 R1051	L1045-S1047 PolarHBondContact O-N 3.41Å; S1047-R1051 WeakPolarHBondContact O-CB 3.39Å; S1047-R1051 PolarHBondContact O-N 3.4Å
1048	I	77.5	Confident	76.3	Confident	100 Å²	100	55.2 Å²	55.2	51%	0.513	27%	0.272	S	S	.	.	H	α-helix	trans	-66.7	-52.1	176.8	-57.9	170.2	0	0	0	111.8	N1046 R1051 Q1052	N1046-I1048 PolarHBondContact O-N 2.84Å; I1048-R1051 PolarHBondContact O-N 3.14Å; I1048-Q1052 WeakPolarHBondContact O-CG 3.32Å; I1048-Q1052 PolarHBondContact O-N 2.96Å
1049	V	77	Confident	76.4	Confident	56 Å²	56	53.9 Å²	53.9	34%	0.339	27%	0.265	S	S	.	.	H	α-helix	trans	-70.5	-39.9	-177.5	-176.4	0	0	0	0	110.2	L1045 N1046 R1051 Q1052 L1053	L1045-V1049 HydrophobicContact CD2-CB 4.37Å; L1045-V1049 HydrophobicContact CD2-CG1 3.85Å; N1046-V1049 HydrophobicContact CB-CG2 4.49Å; N1046-V1049 PolarHBondContact O-N 2.92Å; V1049-R1051 PolarHBondContact O-N 3.29Å; V1049-Q1052 WeakPolarHBondContact O-CB 3.29Å; V1049-Q1052 PolarHBondContact O-N 3.04Å; V1049-Q1052 VanDerWaalsContact O-N 3.13Å; V1049-L1053 HydrophobicContact CG1-CG 4.47Å; V1049-L1053 WeakPolarHBondContact O-CG 3.07Å; V1049-L1053 PolarHBondContact O-N 2.81Å
1050	R	79.8	Confident	76.3	Confident	37 Å²	37	56.8 Å²	56.8	14%	0.14	28%	0.279	C	S	.	.	H	α-helix	trans	-55.9	-52.3	172.3	-172.6	160.4	171.4	171.6	1.2	110.4	A1040 Q1041 L1045 N1046 Q1052 L1053 W1054 L1080	A1040-R1050 WeakPolarHBondContact O-CG 3.45Å; Q1041-R1050 PolarHBondContact O-NH1 2.79Å; Q1041-R1050 VanDerWaalsContact O-NH1 3.16Å; Q1041-R1050 PolarHBondContact O-NH2 3.48Å; Q1041-R1050 VanDerWaalsContact O-NH2 3.13Å; L1045-R1050 HydrophobicContact CB-CB 3.91Å; L1045-R1050 HydrophobicContact CD1-CB 4.44Å; N1046-R1050 PolarHBondContact O-N 3.49Å; R1050-Q1052 VanDerWaalsContact C-N 3.28Å; R1050-Q1052 PolarHBondContact O-N 2.71Å; R1050-L1053 PolarHBondContact O-N 3.39Å; R1050-W1054 PolarHBondContact O-N 3.16Å; R1050-L1080 HydrophobicContact CB-CD1 4.17Å; R1050-L1080 HydrophobicContact CG-CD1 3.84Å
1051	R	79.4	Confident	76.2	Confident	113 Å²	113	57.2 Å²	57.2	43%	0.426	28%	0.281	S	S	.	.	H	α-helix	trans	-57.2	-39.4	175.5	-175.4	173.5	174.2	-142.2	-2.1	112.2	S1047 I1048 V1049 I1055 D1085	S1047-R1051 WeakPolarHBondContact O-CB 3.39Å; S1047-R1051 PolarHBondContact O-N 3.4Å; I1048-R1051 PolarHBondContact O-N 3.14Å; V1049-R1051 PolarHBondContact O-N 3.29Å; R1051-I1055 HydrophobicContact CG-CD1 3.98Å; R1051-I1055 WeakPolarHBondContact O-CB 3.31Å; R1051-I1055 WeakPolarHBondContact O-CD1 3.43Å; R1051-I1055 WeakPolarHBondContact O-CG1 3.48Å; R1051-I1055 PolarHBondContact O-N 2.86Å; R1051-D1085 IonicContact CZ-OD1 3.59Å; R1051-D1085 IonicContact CZ-OD2 2.97Å; R1051-D1085 IonicContact NE-OD1 3.81Å; R1051-D1085 IonicContact NE-OD2 3.13Å; R1051-D1085 PolarHBondContact NE-OD2 3.33Å; R1051-D1085 VanDerWaalsContact NH2-CG 3.3Å; R1051-D1085 IonicContact NH2-OD1 3.57Å; R1051-D1085 PolarHBondContact NH2-OD1 2.81Å; R1051-D1085 IonicContact NH2-OD2 3.97Å; R1051-D1085 PolarHBondContact NH2-OD2 3.11Å
1052	Q	82.5	Confident	76	Confident	108 Å²	108	55.6 Å²	55.6	51%	0.505	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-45.7	175.9	-74.4	172.6	-15	0	0	113.5	I1048 V1049 R1050 I1055 Q1056	I1048-Q1052 WeakPolarHBondContact O-CG 3.32Å; I1048-Q1052 PolarHBondContact O-N 2.96Å; V1049-Q1052 WeakPolarHBondContact O-CB 3.29Å; V1049-Q1052 PolarHBondContact O-N 3.04Å; V1049-Q1052 VanDerWaalsContact O-N 3.13Å; R1050-Q1052 VanDerWaalsContact C-N 3.28Å; R1050-Q1052 PolarHBondContact O-N 2.71Å; Q1052-I1055 PolarHBondContact O-N 2.89Å; Q1052-Q1056 WeakPolarHBondContact O-CG 3.39Å; Q1052-Q1056 PolarHBondContact O-N 2.71Å
1053	L	82.8	Confident	76.1	Confident	7 Å²	7	58.5 Å²	58.5	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-65.1	-40.5	177.1	-63.9	178.9	0	0	0	111.3	H1020 L1024 A1040 L1045 V1049 R1050 I1055 Q1056 L1057	H1020-L1053 HydrophobicContact CB-CD1 4Å; L1024-L1053 HydrophobicContact CD2-CB 4.42Å; L1024-L1053 HydrophobicContact CD2-CD2 3.94Å; A1040-L1053 HydrophobicContact CB-CB 4.26Å; L1045-L1053 HydrophobicContact CD1-CD1 3.54Å; L1045-L1053 HydrophobicContact CD2-CD1 4.3Å; V1049-L1053 HydrophobicContact CG1-CG 4.47Å; V1049-L1053 WeakPolarHBondContact O-CG 3.07Å; V1049-L1053 PolarHBondContact O-N 2.81Å; R1050-L1053 PolarHBondContact O-N 3.39Å; L1053-I1055 VanDerWaalsContact C-N 3.32Å; L1053-I1055 PolarHBondContact O-N 2.84Å; L1053-Q1056 PolarHBondContact O-N 2.86Å; L1053-L1057 WeakPolarHBondContact O-CB 3.34Å; L1053-L1057 PolarHBondContact O-N 2.72Å
1054	W	83.3	Confident	76.2	Confident	1 Å²	1	55.1 Å²	55.1	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-62.2	-37.6	172.9	-81.3	101.3	0	0	0	112.2	A1040 Q1041 R1050 L1057 A1058 L1074 D1077 C1078	A1040-W1054 VanDerWaalsContact C-NE1 3.35Å; A1040-W1054 HydrophobicContact CB-CD2 4.08Å; A1040-W1054 HydrophobicContact CB-CG 4.28Å; A1040-W1054 HydrophobicContact CB-CZ2 4.26Å; A1040-W1054 PolarHBondContact O-NE1 3.3Å; Q1041-W1054 HydrophobicContact CB-CZ2 3.96Å; Q1041-W1054 HydrophobicContact CG-CZ2 4.46Å; R1050-W1054 PolarHBondContact O-N 3.16Å; W1054-L1057 HydrophobicContact CE3-CD2 4.21Å; W1054-L1057 HydrophobicContact CZ3-CD2 4.2Å; W1054-A1058 WeakPolarHBondContact O-CB 3.5Å; W1054-A1058 PolarHBondContact O-N 3Å; W1054-L1074 HydrophobicContact CE3-CD2 4.26Å; W1054-L1074 HydrophobicContact CZ3-CD2 3.62Å; W1054-D1077 HydrophobicContact CH2-CB 4.12Å; W1054-D1077 HydrophobicContact CZ3-CB 4.42Å; W1054-C1078 HydrophobicContact CD2-CB 3.94Å; W1054-C1078 HydrophobicContact CE3-CB 4.17Å; W1054-C1078 HydrophobicContact CG-CB 4.44Å; W1054-C1078 HydrophobicContact CH2-CB 4.34Å; W1054-C1078 HydrophobicContact CZ2-CB 4.13Å; W1054-C1078 HydrophobicContact CZ3-CB 4.34Å
1055	I	81.3	Confident	75.9	Confident	45 Å²	45	59.3 Å²	59.3	23%	0.231	31%	0.308	C	S	.	.	H	α-helix	trans	-66.5	-41.3	173.7	-70.5	163.7	0	0	0	111	R1051 Q1052 L1053 A1058 H1059 L1081 Y1089	R1051-I1055 HydrophobicContact CG-CD1 3.98Å; R1051-I1055 WeakPolarHBondContact O-CB 3.31Å; R1051-I1055 WeakPolarHBondContact O-CD1 3.43Å; R1051-I1055 WeakPolarHBondContact O-CG1 3.48Å; R1051-I1055 PolarHBondContact O-N 2.86Å; Q1052-I1055 PolarHBondContact O-N 2.89Å; L1053-I1055 VanDerWaalsContact C-N 3.32Å; L1053-I1055 PolarHBondContact O-N 2.84Å; I1055-A1058 PolarHBondContact O-N 3.23Å; I1055-H1059 WeakPolarHBondContact O-CB 3.33Å; I1055-H1059 PolarHBondContact O-N 3.37Å; I1055-L1081 HydrophobicContact CG1-CD1 4.45Å; I1055-Y1089 HydrophobicContact CG2-CE2 4.29Å
1056	Q	81.1	Confident	75.5	Confident	83 Å²	83	62.8 Å²	62.8	39%	0.388	35%	0.349	S	S	.	.	H	α-helix	trans	-64.9	-43.1	176.4	-73.9	-178.8	-4.8	0	0	112	L1024 Q1052 L1053 H1059 H1060	L1024-Q1056 HydrophobicContact CD2-CB 4.27Å; Q1052-Q1056 WeakPolarHBondContact O-CG 3.39Å; Q1052-Q1056 PolarHBondContact O-N 2.71Å; L1053-Q1056 PolarHBondContact O-N 2.86Å; Q1056-H1059 PolarHBondContact O-N 3.02Å; Q1056-H1060 WeakPolarHBondContact O-CB 3.35Å; Q1056-H1060 PolarHBondContact O-N 3.24Å
1057	L	81.6	Confident	75.1	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-63.3	-46.8	174.5	-176.9	64.9	0	0	0	111.2	A1036 K1037 A1040 L1053 W1054 H1059 H1060 I1061 L1074	A1036-L1057 HydrophobicContact CB-CD1 3.86Å; K1037-L1057 HydrophobicContact CG-CD2 4.03Å; A1040-L1057 HydrophobicContact CB-CD2 4.23Å; L1053-L1057 WeakPolarHBondContact O-CB 3.34Å; L1053-L1057 PolarHBondContact O-N 2.72Å; W1054-L1057 HydrophobicContact CE3-CD2 4.21Å; W1054-L1057 HydrophobicContact CZ3-CD2 4.2Å; L1057-H1059 PolarHBondContact O-N 2.98Å; L1057-H1060 PolarHBondContact O-N 2.65Å; L1057-I1061 HydrophobicContact CD1-CD1 3.91Å; L1057-I1061 HydrophobicContact CD1-CG1 4.39Å; L1057-I1061 HydrophobicContact CD2-CD1 4.46Å; L1057-I1061 HydrophobicContact CG-CD1 3.77Å; L1057-I1061 WeakPolarHBondContact O-CB 3.39Å; L1057-I1061 VanDerWaalsContact O-CG1 3.29Å; L1057-I1061 WeakPolarHBondContact O-CG1 3.22Å; L1057-I1061 PolarHBondContact O-N 2.8Å; L1057-L1074 HydrophobicContact CD2-CD2 4.36Å
1058	A	77.6	Confident	74.7	Confident	5 Å²	5	61.5 Å²	61.5	4%	0.041	34%	0.339	C	S	.	.	H	α-helix	trans	-62.8	-41.2	176.5	0	0	0	0	0	111.7	W1054 I1055 I1061 I1062 L1074	W1054-A1058 WeakPolarHBondContact O-CB 3.5Å; W1054-A1058 PolarHBondContact O-N 3Å; I1055-A1058 PolarHBondContact O-N 3.23Å; A1058-I1061 PolarHBondContact O-N 3.06Å; A1058-I1062 VanDerWaalsContact O-CB 3.29Å; A1058-I1062 WeakPolarHBondContact O-CB 3.39Å; A1058-I1062 WeakPolarHBondContact O-CD1 3.41Å; A1058-I1062 WeakPolarHBondContact O-CG1 3.44Å; A1058-I1062 PolarHBondContact O-N 3.31Å; A1058-L1074 HydrophobicContact CB-CD1 4.35Å
1059	H	79	Confident	74.2	Confident	99 Å²	99	64.2 Å²	64.2	46%	0.458	35%	0.35	S	S	.	.	H	α-helix	trans	-63.1	-41.1	175.3	-179.2	-93	0	0	0	111.7	I1055 Q1056 L1057 S1063	I1055-H1059 WeakPolarHBondContact O-CB 3.33Å; I1055-H1059 PolarHBondContact O-N 3.37Å; Q1056-H1059 PolarHBondContact O-N 3.02Å; L1057-H1059 PolarHBondContact O-N 2.98Å; H1059-S1063 VanDerWaalsContact O-CB 3.22Å; H1059-S1063 WeakPolarHBondContact O-CB 3.39Å; H1059-S1063 PolarHBondContact O-N 2.57Å; H1059-S1063 PolarHBondContact O-OG 2.83Å
1060	H	77.1	Confident	73.7	Confident	62 Å²	62	66.1 Å²	66.1	29%	0.287	36%	0.355	S	S	.	.	H	α-helix	trans	-66.5	-49	175.1	-167.1	75.6	0	0	0	111.1	Q1056 L1057 I1062 S1063 T1064	Q1056-H1060 WeakPolarHBondContact O-CB 3.35Å; Q1056-H1060 PolarHBondContact O-N 3.24Å; L1057-H1060 PolarHBondContact O-N 2.65Å; H1060-I1062 VanDerWaalsContact C-N 3.32Å; H1060-I1062 PolarHBondContact O-N 2.85Å; H1060-S1063 CarbonylContact O-C 3.59Å; H1060-S1063 PolarHBondContact O-N 3.12Å; H1060-T1064 PolarHBondContact CD2-OG1 2.84Å; H1060-T1064 VanDerWaalsContact CD2-OG1 3.31Å; H1060-T1064 PolarHBondContact CE1-OG1 2.85Å; H1060-T1064 PolarHBondContact ND1-OG1 3.43Å; H1060-T1064 PolarHBondContact NE2-OG1 2.8Å; H1060-T1064 WeakPolarHBondContact O-CB 3.37Å; H1060-T1064 PolarHBondContact O-N 2.63Å; H1060-T1064 PolarHBondContact O-OG1 3.22Å
1061	I	75.6	Confident	73.1	Confident	10 Å²	10	64.4 Å²	64.4	5%	0.051	35%	0.349	C	S	.	.	H	α-helix	trans	-60.6	-40.1	179.1	-68.5	168.6	0	0	0	111.7	I1033 L1057 A1058 S1063 E1070 L1074	I1033-I1061 HydrophobicContact CG2-CD1 4.31Å; L1057-I1061 HydrophobicContact CD1-CD1 3.91Å; L1057-I1061 HydrophobicContact CD1-CG1 4.39Å; L1057-I1061 HydrophobicContact CD2-CD1 4.46Å; L1057-I1061 HydrophobicContact CG-CD1 3.77Å; L1057-I1061 WeakPolarHBondContact O-CB 3.39Å; L1057-I1061 VanDerWaalsContact O-CG1 3.29Å; L1057-I1061 WeakPolarHBondContact O-CG1 3.22Å; L1057-I1061 PolarHBondContact O-N 2.8Å; A1058-I1061 PolarHBondContact O-N 3.06Å; I1061-S1063 VanDerWaalsContact C-N 3.3Å; I1061-S1063 PolarHBondContact O-N 2.79Å; I1061-E1070 HydrophobicContact CG2-CB 4.19Å; I1061-L1074 HydrophobicContact CB-CD1 4.35Å; I1061-L1074 HydrophobicContact CD1-CD1 3.55Å; I1061-L1074 HydrophobicContact CD1-CD2 3.99Å; I1061-L1074 HydrophobicContact CD1-CG 4.3Å; I1061-L1074 HydrophobicContact CG2-CD1 4.31Å
1062	I	75.8	Confident	72.6	Confident	60 Å²	60	60.3 Å²	60.3	31%	0.308	34%	0.335	S	S	.	.	H	α-helix	trans	-68.5	-29.9	175.8	-66.8	165.8	0	0	0	111.7	A1058 H1060 A1071 I1086	A1058-I1062 VanDerWaalsContact O-CB 3.29Å; A1058-I1062 WeakPolarHBondContact O-CB 3.39Å; A1058-I1062 WeakPolarHBondContact O-CD1 3.41Å; A1058-I1062 WeakPolarHBondContact O-CG1 3.44Å; A1058-I1062 PolarHBondContact O-N 3.31Å; H1060-I1062 VanDerWaalsContact C-N 3.32Å; H1060-I1062 PolarHBondContact O-N 2.85Å; I1062-A1071 HydrophobicContact CG1-CB 4.36Å; I1062-I1086 HydrophobicContact CD1-CG2 4.06Å
1063	S	73.5	Confident	72.2	Confident	81 Å²	81	58.6 Å²	58.6	57%	0.566	33%	0.329	S	S	*	.	H	α-helix	trans	-87.8	-32.4	-177.4	-60.1	0	0	0	0	114.3	H1059 H1060 I1061	H1059-S1063 VanDerWaalsContact O-CB 3.22Å; H1059-S1063 WeakPolarHBondContact O-CB 3.39Å; H1059-S1063 PolarHBondContact O-N 2.57Å; H1059-S1063 PolarHBondContact O-OG 2.83Å; H1060-S1063 CarbonylContact O-C 3.59Å; H1060-S1063 PolarHBondContact O-N 3.12Å; I1061-S1063 VanDerWaalsContact C-N 3.3Å; I1061-S1063 PolarHBondContact O-N 2.79Å
1064	T	68	Low	71.6	Confident	66 Å²	66	58.3 Å²	58.3	41%	0.405	33%	0.328	S	S	.	.	H	α-helix	trans	-93.4	-35.8	-166.2	-40.3	0	0	0	0	112.8	H1060	H1060-T1064 PolarHBondContact CD2-OG1 2.84Å; H1060-T1064 VanDerWaalsContact CD2-OG1 3.31Å; H1060-T1064 PolarHBondContact CE1-OG1 2.85Å; H1060-T1064 PolarHBondContact ND1-OG1 3.43Å; H1060-T1064 PolarHBondContact NE2-OG1 2.8Å; H1060-T1064 WeakPolarHBondContact O-CB 3.37Å; H1060-T1064 PolarHBondContact O-N 2.63Å; H1060-T1064 PolarHBondContact O-OG1 3.22Å
1065	D	56.6	Low	71	Confident	133 Å²	133	59.4 Å²	59.4	71%	0.711	33%	0.334	S	S	*	.	S	Bend	trans	-164.8	115.2	178.3	-92	-42	0	0	0	114	G1067	D1065-G1067 VanDerWaalsContact C-N 3.27Å; D1065-G1067 PolarHBondContact O-N 2.77Å
1066	G	56.6	Low	70.4	Confident	91 Å²	91	65.4 Å²	65.4	94%	0.938	35%	0.353	S	S	*	.			trans	48.1	-5.8	140.3	0	0	0	0	0	124	M1068	G1066-M1068 PolarHBondContact O-N 2.83Å
1067	G	59.9	Low	69.9	Low	21 Å²	21	64.4 Å²	64.4	22%	0.216	35%	0.351	C	S	.	.			trans	-102.8	68.5	-161.7	0	0	0	0	0	114.9	D1065 Q1069 E1070 A1071	D1065-G1067 VanDerWaalsContact C-N 3.27Å; D1065-G1067 PolarHBondContact O-N 2.77Å; G1067-Q1069 PolarHBondContact O-N 3.33Å; G1067-Q1069 VanDerWaalsContact O-N 3.15Å; G1067-E1070 WeakPolarHBondContact O-CA 3.4Å; G1067-E1070 PolarHBondContact O-N 3.17Å; G1067-A1071 PolarHBondContact O-N 3.2Å
1068	M	63.3	Low	69.2	Low	111 Å²	111	64.4 Å²	64.4	55%	0.547	35%	0.351	S	S	.	.	H	α-helix	trans	-53.4	-34.4	167.7	-69.7	-172.4	-146	0	0	111.4	G1066 I1072	G1066-M1068 PolarHBondContact O-N 2.83Å; M1068-I1072 WeakPolarHBondContact O-CD1 3.29Å; M1068-I1072 VanDerWaalsContact O-CG1 3.24Å; M1068-I1072 WeakPolarHBondContact O-CG1 3.22Å; M1068-I1072 PolarHBondContact O-N 3.47Å
1069	Q	66.9	Low	68.7	Low	156 Å²	156	69.8 Å²	69.8	73%	0.729	39%	0.385	S	S	*	.	H	α-helix	trans	-70.9	-36.1	174.9	-66.9	-175.7	-10.9	0	0	112.5	G1067 I1072 N1073	G1067-Q1069 PolarHBondContact O-N 3.33Å; G1067-Q1069 VanDerWaalsContact O-N 3.15Å; Q1069-I1072 PolarHBondContact O-N 2.84Å; Q1069-N1073 WeakPolarHBondContact O-CB 3.43Å; Q1069-N1073 PolarHBondContact O-N 2.83Å; Q1069-N1073 PolarHBondContact O-ND2 3.34Å; Q1069-N1073 PolarHBondContact O-OD1 2.95Å
1070	E	66.9	Low	68.1	Low	97 Å²	97	68.2 Å²	68.2	45%	0.453	38%	0.38	S	S	.	.	H	α-helix	trans	-67.9	-39.7	175.2	-67.2	-168.4	173.9	0	0	111	I1061 G1067 I1072 N1073 L1074	I1061-E1070 HydrophobicContact CG2-CB 4.19Å; G1067-E1070 WeakPolarHBondContact O-CA 3.4Å; G1067-E1070 PolarHBondContact O-N 3.17Å; E1070-I1072 PolarHBondContact O-N 3.18Å; E1070-N1073 CarbonylContact O-C 3.5Å; E1070-N1073 WeakPolarHBondContact O-CB 3.48Å; E1070-N1073 PolarHBondContact O-N 2.81Å; E1070-N1073 VanDerWaalsContact O-N 3.15Å; E1070-L1074 VanDerWaalsContact O-CG 3.3Å; E1070-L1074 WeakPolarHBondContact O-CG 3.4Å; E1070-L1074 PolarHBondContact O-N 2.64Å
1071	A	67.1	Low	67.9	Low	1 Å²	1	65.8 Å²	65.8	1%	0.008	37%	0.369	C	S	.	.	H	α-helix	trans	-63.8	-36.5	172.9	0	0	0	0	0	113.2	I1062 G1067 L1074 L1075 F1090	I1062-A1071 HydrophobicContact CG1-CB 4.36Å; G1067-A1071 PolarHBondContact O-N 3.2Å; A1071-L1074 PolarHBondContact O-N 2.82Å; A1071-L1075 PolarHBondContact O-N 3.42Å; A1071-F1090 HydrophobicContact CB-CE1 4.35Å; A1071-F1090 HydrophobicContact CB-CZ 4.39Å
1072	I	69	Low	67.6	Low	27 Å²	27	71.1 Å²	71.1	14%	0.138	39%	0.392	C	S	.	.	H	α-helix	trans	-70.1	-34.5	172.6	-68.1	165	0	0	0	111.1	M1068 Q1069 E1070 L1075 R1076	M1068-I1072 WeakPolarHBondContact O-CD1 3.29Å; M1068-I1072 VanDerWaalsContact O-CG1 3.24Å; M1068-I1072 WeakPolarHBondContact O-CG1 3.22Å; M1068-I1072 PolarHBondContact O-N 3.47Å; Q1069-I1072 PolarHBondContact O-N 2.84Å; E1070-I1072 PolarHBondContact O-N 3.18Å; I1072-L1075 WeakPolarHBondContact O-CB 3.41Å; I1072-L1075 PolarHBondContact O-N 3.25Å; I1072-R1076 PolarHBondContact O-N 3.13Å
1073	N	72.5	Confident	67.3	Low	71 Å²	71	70.7 Å²	70.7	38%	0.38	39%	0.39	S	S	.	.	H	α-helix	trans	-68.4	-36.2	173.1	-68.3	-20.3	0	0	0	111.1	Q1069 E1070 L1075 R1076 D1077	Q1069-N1073 WeakPolarHBondContact O-CB 3.43Å; Q1069-N1073 PolarHBondContact O-N 2.83Å; Q1069-N1073 PolarHBondContact O-ND2 3.34Å; Q1069-N1073 PolarHBondContact O-OD1 2.95Å; E1070-N1073 CarbonylContact O-C 3.5Å; E1070-N1073 WeakPolarHBondContact O-CB 3.48Å; E1070-N1073 PolarHBondContact O-N 2.81Å; E1070-N1073 VanDerWaalsContact O-N 3.15Å; N1073-L1075 VanDerWaalsContact C-N 3.27Å; N1073-L1075 PolarHBondContact O-N 3.16Å; N1073-R1076 WeakPolarHBondContact O-CA 3.35Å; N1073-R1076 WeakPolarHBondContact O-CB 3.34Å; N1073-R1076 PolarHBondContact O-N 3.22Å; N1073-D1077 PolarHBondContact O-N 2.8Å
1074	L	71.4	Confident	67.4	Low	2 Å²	2	73.5 Å²	73.5	1%	0.01	39%	0.394	C	S	.	.	H	α-helix	trans	-61.3	-31.9	172.7	-65	167.4	0	0	0	112.6	W1054 L1057 A1058 I1061 E1070 A1071 R1076 D1077 C1078	W1054-L1074 HydrophobicContact CE3-CD2 4.26Å; W1054-L1074 HydrophobicContact CZ3-CD2 3.62Å; L1057-L1074 HydrophobicContact CD2-CD2 4.36Å; A1058-L1074 HydrophobicContact CB-CD1 4.35Å; I1061-L1074 HydrophobicContact CB-CD1 4.35Å; I1061-L1074 HydrophobicContact CD1-CD1 3.55Å; I1061-L1074 HydrophobicContact CD1-CD2 3.99Å; I1061-L1074 HydrophobicContact CD1-CG 4.3Å; I1061-L1074 HydrophobicContact CG2-CD1 4.31Å; E1070-L1074 VanDerWaalsContact O-CG 3.3Å; E1070-L1074 WeakPolarHBondContact O-CG 3.4Å; E1070-L1074 PolarHBondContact O-N 2.64Å; A1071-L1074 PolarHBondContact O-N 2.82Å; L1074-R1076 VanDerWaalsContact C-N 3.32Å; L1074-D1077 PolarHBondContact O-N 3.23Å; L1074-C1078 PolarHBondContact O-N 2.92Å
1075	L	69.8	Low	67.7	Low	23 Å²	23	71.4 Å²	71.4	12%	0.12	38%	0.38	C	S	.	.	H	α-helix	trans	-68.5	-28.9	172.3	-79	167	0	0	0	112.9	A1071 I1072 N1073 L1081 L1083 I1086	A1071-L1075 PolarHBondContact O-N 3.42Å; I1072-L1075 WeakPolarHBondContact O-CB 3.41Å; I1072-L1075 PolarHBondContact O-N 3.25Å; N1073-L1075 VanDerWaalsContact C-N 3.27Å; N1073-L1075 PolarHBondContact O-N 3.16Å; L1075-L1081 HydrophobicContact CD2-CD2 4.42Å; L1075-L1081 HydrophobicContact CD2-CG 4.24Å; L1075-L1083 HydrophobicContact CD1-CD1 4.09Å; L1075-I1086 HydrophobicContact CD1-CD1 3.94Å; L1075-I1086 HydrophobicContact CD2-CD1 3.31Å; L1075-I1086 HydrophobicContact CD2-CG1 4.03Å; L1075-I1086 HydrophobicContact CG-CD1 3.35Å; L1075-I1086 HydrophobicContact CG-CG1 4.47Å
1076	R	69.5	Low	68.4	Low	171 Å²	171	65.2 Å²	65.2	65%	0.645	35%	0.347	S	S	*	.	H	α-helix	trans	-79	-32.2	173.2	-65.8	-179.5	-176.8	-179.3	0.4	111.5	I1072 N1073 L1074	I1072-R1076 PolarHBondContact O-N 3.13Å; N1073-R1076 WeakPolarHBondContact O-CA 3.35Å; N1073-R1076 WeakPolarHBondContact O-CB 3.34Å; N1073-R1076 PolarHBondContact O-N 3.22Å; L1074-R1076 VanDerWaalsContact C-N 3.32Å
1077	D	69.3	Low	69.1	Low	63 Å²	63	65 Å²	65	34%	0.337	32%	0.324	S	S	.	.	H	α-helix	trans	-75.6	-23.8	-176.8	-65.3	-13.4	0	0	0	112.9	K1037 W1054 N1073 L1074	K1037-D1077 IonicContact NZ-OD2 2.6Å; K1037-D1077 PolarHBondContact NZ-OD2 3.12Å; W1054-D1077 HydrophobicContact CH2-CB 4.12Å; W1054-D1077 HydrophobicContact CZ3-CB 4.42Å; N1073-D1077 PolarHBondContact O-N 2.8Å; L1074-D1077 PolarHBondContact O-N 3.23Å
1078	C	67.9	Low	69.8	Low	2 Å²	2	68.6 Å²	68.6	1%	0.014	34%	0.344	C	S	.	.			trans	-127.1	114.6	-175.5	-170.4	0	0	0	0	114.1	W1054 L1074 L1080 L1081	W1054-C1078 HydrophobicContact CD2-CB 3.94Å; W1054-C1078 HydrophobicContact CE3-CB 4.17Å; W1054-C1078 HydrophobicContact CG-CB 4.44Å; W1054-C1078 HydrophobicContact CH2-CB 4.34Å; W1054-C1078 HydrophobicContact CZ2-CB 4.13Å; W1054-C1078 HydrophobicContact CZ3-CB 4.34Å; L1074-C1078 PolarHBondContact O-N 2.92Å; C1078-L1080 PolarHBondContact O-N 2.93Å; C1078-L1081 HydrophobicContact CB-CB 4.05Å; C1078-L1081 PolarHBondContact O-N 3.13Å
1079	P	66.3	Low	70.1	Confident	118 Å²	118	68 Å²	68	77%	0.766	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-12.2	177.1	28.5	-33.7	0	0	0	113.9
1080	L	67.5	Low	70.2	Confident	67 Å²	67	62.4 Å²	62.4	35%	0.351	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-17.5	179.2	-62.9	172.9	0	0	0	113	R1050 C1078 K1082	R1050-L1080 HydrophobicContact CB-CD1 4.17Å; R1050-L1080 HydrophobicContact CG-CD1 3.84Å; C1078-L1080 PolarHBondContact O-N 2.93Å; L1080-K1082 PolarHBondContact O-N 2.98Å
1081	L	73.3	Confident	70.1	Confident	11 Å²	11	65.4 Å²	65.4	6%	0.058	32%	0.323	C	S	.	.			trans	-90.7	105.3	-177.1	-166.1	64.1	0	0	0	108.6	I1055 L1075 C1078 D1085 I1086	I1055-L1081 HydrophobicContact CG1-CD1 4.45Å; L1075-L1081 HydrophobicContact CD2-CD2 4.42Å; L1075-L1081 HydrophobicContact CD2-CG 4.24Å; C1078-L1081 HydrophobicContact CB-CB 4.05Å; C1078-L1081 PolarHBondContact O-N 3.13Å; L1081-D1085 HydrophobicContact CD1-CB 3.87Å; L1081-I1086 HydrophobicContact CD1-CD1 4.47Å; L1081-I1086 HydrophobicContact CD1-CG1 4.06Å; L1081-I1086 HydrophobicContact CD2-CD1 3.33Å; L1081-I1086 HydrophobicContact CD2-CG1 3.84Å; L1081-I1086 HydrophobicContact CG-CD1 3.75Å; L1081-I1086 HydrophobicContact CG-CG1 3.79Å
1082	K	69.2	Low	69.7	Low	122 Å²	122	74.4 Å²	74.4	53%	0.53	37%	0.365	S	S	.	.			trans	-79.5	155.7	177.6	-66.9	-176.2	-179.7	-178.5	0	110.2	L1080 E1084 D1085	L1080-K1082 PolarHBondContact O-N 2.98Å; K1082-E1084 HydrophobicContact CB-CB 4.34Å; K1082-E1084 PolarHBondContact O-N 2.88Å; K1082-E1084 VanDerWaalsContact O-N 3.12Å; K1082-D1085 PolarHBondContact N-OD2 3.1Å; K1082-D1085 WeakPolarHBondContact O-CB 3.42Å; K1082-D1085 PolarHBondContact O-N 3.1Å
1083	L	69.9	Low	69.4	Low	50 Å²	50	82 Å²	82	26%	0.262	40%	0.398	S	S	.	.	H	α-helix	trans	-52.8	-35.2	171.5	-173.9	65.6	0	0	0	111.6	L1075 D1085 I1086 L1087 F1099 I1103	L1075-L1083 HydrophobicContact CD1-CD1 4.09Å; L1083-D1085 PolarHBondContact O-N 2.96Å; L1083-I1086 PolarHBondContact O-N 2.82Å; L1083-L1087 HydrophobicContact CG-CD1 4.01Å; L1083-L1087 HydrophobicContact CG-CG 4.32Å; L1083-L1087 WeakPolarHBondContact O-CB 3.15Å; L1083-L1087 WeakPolarHBondContact O-CD1 3.27Å; L1083-L1087 VanDerWaalsContact O-CG 3.23Å; L1083-L1087 WeakPolarHBondContact O-CG 3.38Å; L1083-L1087 PolarHBondContact O-N 2.8Å; L1083-F1099 HydrophobicContact CD1-CD1 3.69Å; L1083-F1099 HydrophobicContact CD1-CE1 3.95Å; L1083-F1099 HydrophobicContact CD1-CG 4.4Å; L1083-I1103 HydrophobicContact CD2-CG1 4.32Å
1084	E	74.6	Confident	69.1	Low	140 Å²	140	80.6 Å²	80.6	65%	0.654	39%	0.391	S	S	*	.	H	α-helix	trans	-58.2	-26.9	175.7	-62.3	172.9	-175.1	0	0	114.1	K1082 P1088	K1082-E1084 HydrophobicContact CB-CB 4.34Å; K1082-E1084 PolarHBondContact O-N 2.88Å; K1082-E1084 VanDerWaalsContact O-N 3.12Å; E1084-P1088 WeakPolarHBondContact O-CD 2.99Å
1085	D	73.3	Confident	68.9	Low	22 Å²	22	84.2 Å²	84.2	12%	0.118	41%	0.413	C	S	.	.	H	α-helix	trans	-86.4	-26.6	-172.6	-66.3	-22.1	0	0	0	113.2	R1051 L1081 K1082 L1083 Y1089	R1051-D1085 IonicContact CZ-OD1 3.59Å; R1051-D1085 IonicContact CZ-OD2 2.97Å; R1051-D1085 IonicContact NE-OD1 3.81Å; R1051-D1085 IonicContact NE-OD2 3.13Å; R1051-D1085 PolarHBondContact NE-OD2 3.33Å; R1051-D1085 VanDerWaalsContact NH2-CG 3.3Å; R1051-D1085 IonicContact NH2-OD1 3.57Å; R1051-D1085 PolarHBondContact NH2-OD1 2.81Å; R1051-D1085 IonicContact NH2-OD2 3.97Å; R1051-D1085 PolarHBondContact NH2-OD2 3.11Å; L1081-D1085 HydrophobicContact CD1-CB 3.87Å; K1082-D1085 PolarHBondContact N-OD2 3.1Å; K1082-D1085 WeakPolarHBondContact O-CB 3.42Å; K1082-D1085 PolarHBondContact O-N 3.1Å; L1083-D1085 PolarHBondContact O-N 2.96Å; D1085-Y1089 WeakPolarHBondContact O-CE2 3.32Å
1086	I	73.1	Confident	68.8	Low	3 Å²	3	89.7 Å²	89.7	2%	0.015	44%	0.441	C	S	.	.	H	α-helix	trans	-98.7	-26.9	-179.2	-43.2	-174	0	0	0	111.6	I1062 L1075 L1081 L1083 Y1089 F1090	I1062-I1086 HydrophobicContact CD1-CG2 4.06Å; L1075-I1086 HydrophobicContact CD1-CD1 3.94Å; L1075-I1086 HydrophobicContact CD2-CD1 3.31Å; L1075-I1086 HydrophobicContact CD2-CG1 4.03Å; L1075-I1086 HydrophobicContact CG-CD1 3.35Å; L1075-I1086 HydrophobicContact CG-CG1 4.47Å; L1081-I1086 HydrophobicContact CD1-CD1 4.47Å; L1081-I1086 HydrophobicContact CD1-CG1 4.06Å; L1081-I1086 HydrophobicContact CD2-CD1 3.33Å; L1081-I1086 HydrophobicContact CD2-CG1 3.84Å; L1081-I1086 HydrophobicContact CG-CD1 3.75Å; L1081-I1086 HydrophobicContact CG-CG1 3.79Å; L1083-I1086 PolarHBondContact O-N 2.82Å; I1086-Y1089 PolarHBondContact O-N 3.39Å; I1086-F1090 HydrophobicContact CB-CE2 3.85Å; I1086-F1090 HydrophobicContact CB-CZ 4.46Å; I1086-F1090 HydrophobicContact CG2-CD2 4.17Å; I1086-F1090 HydrophobicContact CG2-CE2 3.36Å; I1086-F1090 HydrophobicContact CG2-CZ 3.62Å; I1086-F1090 VanDerWaalsContact O-CD2 3.26Å; I1086-F1090 WeakPolarHBondContact O-CD2 3.5Å
1087	L	70.8	Confident	68.8	Low	88 Å²	88	87.6 Å²	87.6	46%	0.461	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-43.2	-40.9	177.3	-89.1	166.2	0	0	0	114.7	L1083 Y1089	L1083-L1087 HydrophobicContact CG-CD1 4.01Å; L1083-L1087 HydrophobicContact CG-CG 4.32Å; L1083-L1087 WeakPolarHBondContact O-CB 3.15Å; L1083-L1087 WeakPolarHBondContact O-CD1 3.27Å; L1083-L1087 VanDerWaalsContact O-CG 3.23Å; L1083-L1087 WeakPolarHBondContact O-CG 3.38Å; L1083-L1087 PolarHBondContact O-N 2.8Å; L1087-Y1089 VanDerWaalsContact C-N 3.31Å; L1087-Y1089 PolarHBondContact O-N 2.94Å
1088	P	74.3	Confident	68.7	Low	96 Å²	96	88.8 Å²	88.8	62%	0.623	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-67.3	-21.7	180	-23.1	35.2	0	0	0	115.9	E1084	E1084-P1088 WeakPolarHBondContact O-CD 2.99Å
1089	Y	69.9	Low	68.7	Low	98 Å²	98	89.5 Å²	89.5	38%	0.384	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-94.9	-7.1	-174.5	-56.9	-75.8	0	0	0	113.2	I1055 D1085 I1086 L1087	I1055-Y1089 HydrophobicContact CG2-CE2 4.29Å; D1085-Y1089 WeakPolarHBondContact O-CE2 3.32Å; I1086-Y1089 PolarHBondContact O-N 3.39Å; L1087-Y1089 VanDerWaalsContact C-N 3.31Å; L1087-Y1089 PolarHBondContact O-N 2.94Å
1090	F	68.1	Low	69.2	Low	38 Å²	38	89.7 Å²	89.7	17%	0.167	44%	0.438	C	S	.	.	S	Bend	trans	-80.8	148.8	175.8	-69.7	-71.2	0	0	0	112.3	A1071 I1086 V1094 F1099	A1071-F1090 HydrophobicContact CB-CE1 4.35Å; A1071-F1090 HydrophobicContact CB-CZ 4.39Å; I1086-F1090 HydrophobicContact CB-CE2 3.85Å; I1086-F1090 HydrophobicContact CB-CZ 4.46Å; I1086-F1090 HydrophobicContact CG2-CD2 4.17Å; I1086-F1090 HydrophobicContact CG2-CE2 3.36Å; I1086-F1090 HydrophobicContact CG2-CZ 3.62Å; I1086-F1090 VanDerWaalsContact O-CD2 3.26Å; I1086-F1090 WeakPolarHBondContact O-CD2 3.5Å; F1090-V1094 HydrophobicContact CB-CG2 3.96Å; F1090-V1094 HydrophobicContact CD1-CG2 4.27Å; F1090-V1094 HydrophobicContact CG-CG2 4.35Å; F1090-F1099 HydrophobicContact CE2-CE1 4.37Å; F1090-F1099 HydrophobicContact CE2-CZ 4.22Å; F1090-F1099 HydrophobicContact CZ-CE1 4.43Å; F1090-F1099 HydrophobicContact CZ-CZ 4.41Å
1091	H	64.4	Low	69.5	Low	161 Å²	161	91.7 Å²	91.7	75%	0.745	45%	0.449	S	S	*	.			trans	-65.2	152.1	170.8	-69.5	-52.5	0	0	0	112	F1093	H1091-F1093 PolarHBondContact O-N 3.46Å
1092	Q	59.4	Low	69.3	Low	190 Å²	190	92.6 Å²	92.6	89%	0.888	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-3.9	-176.7	-80.9	-178.9	-1.7	0	0	116.4
1093	F	63	Low	69.5	Low	187 Å²	187	90 Å²	90	82%	0.82	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	12.2	-171.7	-60.8	-75.7	0	0	0	114.9	H1091	H1091-F1093 PolarHBondContact O-N 3.46Å
1094	V	65.9	Low	70	Confident	41 Å²	41	90.4 Å²	90.4	25%	0.248	45%	0.453	C	S	.	.			trans	-74.9	126.8	179.1	-173.6	0	0	0	0	111.1	F1090 F1099	F1090-V1094 HydrophobicContact CB-CG2 3.96Å; F1090-V1094 HydrophobicContact CD1-CG2 4.27Å; F1090-V1094 HydrophobicContact CG-CG2 4.35Å; V1094-F1099 HydrophobicContact CB-CE2 4.4Å; V1094-F1099 HydrophobicContact CG1-CD2 4.43Å; V1094-F1099 HydrophobicContact CG1-CE2 3.36Å; V1094-F1099 HydrophobicContact CG1-CZ 3.7Å
1095	T	67.6	Low	70	Confident	77 Å²	77	88.3 Å²	88.3	47%	0.472	45%	0.45	S	S	.	.			trans	-84.5	135.7	-179.7	53.6	0	0	0	0	111.9	D1097 Q1098	T1095-D1097 PolarHBondContact O-N 2.75Å; T1095-Q1098 WeakPolarHBondContact O-CB 3.48Å; T1095-Q1098 PolarHBondContact O-N 2.87Å; T1095-Q1098 PolarHBondContact OG1-NE2 3.29Å
1096	I	67.5	Low	69.9	Low	138 Å²	138	90.1 Å²	90.1	71%	0.708	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-52.6	-30.8	179.1	-66.6	169.7	0	0	0	113.1	Q1098 F1099 K1100	I1096-Q1098 PolarHBondContact O-N 3.24Å; I1096-Q1098 VanDerWaalsContact O-N 3.09Å; I1096-F1099 PolarHBondContact O-N 3.29Å; I1096-K1100 PolarHBondContact O-N 2.64Å
1097	D	69.7	Low	70.2	Confident	128 Å²	128	94.9 Å²	94.9	68%	0.684	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-56.7	-27.2	179.4	-153.3	34.8	0	0	0	112.6	T1095 F1099	T1095-D1097 PolarHBondContact O-N 2.75Å; D1097-F1099 PolarHBondContact O-N 2.86Å
1098	Q	66.4	Low	70.7	Confident	88 Å²	88	95.7 Å²	95.7	41%	0.411	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-72.5	-12.7	177.1	-63.1	176.2	10	0	0	113.6	T1095 I1096	T1095-Q1098 WeakPolarHBondContact O-CB 3.48Å; T1095-Q1098 PolarHBondContact O-N 2.87Å; T1095-Q1098 PolarHBondContact OG1-NE2 3.29Å; I1096-Q1098 PolarHBondContact O-N 3.24Å; I1096-Q1098 VanDerWaalsContact O-N 3.09Å
1099	F	68.5	Low	70.6	Confident	17 Å²	17	94 Å²	94	8%	0.075	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-114.6	-1.7	-179	-58.2	-75	0	0	0	114	L1083 F1090 V1094 I1096 D1097 D1101 V1102 I1103	L1083-F1099 HydrophobicContact CD1-CD1 3.69Å; L1083-F1099 HydrophobicContact CD1-CE1 3.95Å; L1083-F1099 HydrophobicContact CD1-CG 4.4Å; F1090-F1099 HydrophobicContact CE2-CE1 4.37Å; F1090-F1099 HydrophobicContact CE2-CZ 4.22Å; F1090-F1099 HydrophobicContact CZ-CE1 4.43Å; F1090-F1099 HydrophobicContact CZ-CZ 4.41Å; V1094-F1099 HydrophobicContact CB-CE2 4.4Å; V1094-F1099 HydrophobicContact CG1-CD2 4.43Å; V1094-F1099 HydrophobicContact CG1-CE2 3.36Å; V1094-F1099 HydrophobicContact CG1-CZ 3.7Å; I1096-F1099 PolarHBondContact O-N 3.29Å; D1097-F1099 PolarHBondContact O-N 2.86Å; F1099-D1101 VanDerWaalsContact C-N 3.31Å; F1099-D1101 PolarHBondContact O-N 3.18Å; F1099-V1102 PolarHBondContact O-N 3.11Å; F1099-V1102 VanDerWaalsContact O-N 3.11Å; F1099-I1103 HydrophobicContact CB-CD1 4.22Å; F1099-I1103 WeakPolarHBondContact O-CG1 3.38Å; F1099-I1103 PolarHBondContact O-N 2.88Å
1100	K	76.6	Confident	70.9	Confident	121 Å²	121	96.7 Å²	96.7	53%	0.526	50%	0.495	S	S	.	.	H	α-helix	trans	-52.3	-47.2	-173	-177.9	-176.7	175.5	-172.8	0	112.9	I1096 V1102 I1103 C1104	I1096-K1100 PolarHBondContact O-N 2.64Å; K1100-V1102 VanDerWaalsContact C-N 3.35Å; K1100-V1102 PolarHBondContact O-N 3.43Å; K1100-I1103 PolarHBondContact O-N 2.97Å; K1100-C1104 PolarHBondContact O-N 2.78Å
1101	D	74.1	Confident	71.7	Confident	109 Å²	109	99.6 Å²	99.6	58%	0.583	51%	0.512	S	S	*	.	H	α-helix	trans	-66.5	-38.5	-177.2	-61.1	-17.8	0	0	0	111.7	F1099 I1103 C1104 T1105	F1099-D1101 VanDerWaalsContact C-N 3.31Å; F1099-D1101 PolarHBondContact O-N 3.18Å; D1101-I1103 VanDerWaalsContact C-N 3.32Å; D1101-I1103 PolarHBondContact O-N 3.32Å; D1101-C1104 PolarHBondContact O-N 2.86Å; D1101-T1105 WeakPolarHBondContact O-CB 3.46Å; D1101-T1105 PolarHBondContact O-N 2.88Å; D1101-T1105 PolarHBondContact O-OG1 2.63Å
1102	V	68.7	Low	72.5	Confident	30 Å²	30	97.8 Å²	97.8	18%	0.182	50%	0.504	C	S	.	.	H	α-helix	trans	-67.2	-36.2	178.4	-175.2	0	0	0	0	110.7	F1099 K1100 S1106	F1099-V1102 PolarHBondContact O-N 3.11Å; F1099-V1102 VanDerWaalsContact O-N 3.11Å; K1100-V1102 VanDerWaalsContact C-N 3.35Å; K1100-V1102 PolarHBondContact O-N 3.43Å; V1102-S1106 PolarHBondContact O-N 3.46Å; V1102-S1106 VanDerWaalsContact O-N 3.13Å; V1102-S1106 PolarHBondContact O-OG 2.91Å
1103	I	73.9	Confident	73.3	Confident	67 Å²	67	97.3 Å²	97.3	34%	0.344	49%	0.494	S	S	.	.	H	α-helix	trans	-68.6	-46.3	176.4	-65	166.9	0	0	0	110.9	L1083 F1099 K1100 D1101 S1106 L1107	L1083-I1103 HydrophobicContact CD2-CG1 4.32Å; F1099-I1103 HydrophobicContact CB-CD1 4.22Å; F1099-I1103 WeakPolarHBondContact O-CG1 3.38Å; F1099-I1103 PolarHBondContact O-N 2.88Å; K1100-I1103 PolarHBondContact O-N 2.97Å; D1101-I1103 VanDerWaalsContact C-N 3.32Å; D1101-I1103 PolarHBondContact O-N 3.32Å; I1103-S1106 PolarHBondContact O-N 3.46Å; I1103-L1107 HydrophobicContact CG2-CD1 4.37Å; I1103-L1107 PolarHBondContact O-N 2.81Å; I1103-L1107 VanDerWaalsContact O-N 3.15Å
1104	C	79.8	Confident	74.2	Confident	59 Å²	59	93.8 Å²	93.8	40%	0.399	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-45.1	177.6	-71.9	0	0	0	0	111.9	K1100 D1101 S1106 L1107 D1108	K1100-C1104 PolarHBondContact O-N 2.78Å; D1101-C1104 PolarHBondContact O-N 2.86Å; C1104-S1106 VanDerWaalsContact C-N 3.25Å; C1104-S1106 PolarHBondContact O-N 2.9Å; C1104-L1107 PolarHBondContact O-N 3.38Å; C1104-L1107 VanDerWaalsContact O-N 3.08Å; C1104-D1108 PolarHBondContact O-N 2.95Å
1105	T	74.5	Confident	75.1	Confident	96 Å²	96	96.3 Å²	96.3	59%	0.589	50%	0.495	S	S	*	.	H	α-helix	trans	-59.2	-38.5	177.3	-50	0	0	0	0	111.7	D1101 S1109	D1101-T1105 WeakPolarHBondContact O-CB 3.46Å; D1101-T1105 PolarHBondContact O-N 2.88Å; D1101-T1105 PolarHBondContact O-OG1 2.63Å; T1105-S1109 PolarHBondContact O-N 3.06Å
1106	S	72.5	Confident	75.7	Confident	60 Å²	60	97.1 Å²	97.1	42%	0.42	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-39.5	176.6	-56.5	0	0	0	0	112.1	V1102 I1103 C1104 Y1110	V1102-S1106 PolarHBondContact O-N 3.46Å; V1102-S1106 VanDerWaalsContact O-N 3.13Å; V1102-S1106 PolarHBondContact O-OG 2.91Å; I1103-S1106 PolarHBondContact O-N 3.46Å; C1104-S1106 VanDerWaalsContact C-N 3.25Å; C1104-S1106 PolarHBondContact O-N 2.9Å; S1106-Y1110 WeakPolarHBondContact O-CD2 3.26Å; S1106-Y1110 PolarHBondContact O-N 2.8Å
1107	L	79.6	Confident	76.4	Confident	104 Å²	104	94.5 Å²	94.5	55%	0.545	49%	0.486	S	S	.	.	H	α-helix	trans	-69.4	-38.3	179	-73.3	168.2	0	0	0	112.7	I1103 C1104 Y1110 N1111	I1103-L1107 HydrophobicContact CG2-CD1 4.37Å; I1103-L1107 PolarHBondContact O-N 2.81Å; I1103-L1107 VanDerWaalsContact O-N 3.15Å; C1104-L1107 PolarHBondContact O-N 3.38Å; C1104-L1107 VanDerWaalsContact O-N 3.08Å; L1107-Y1110 PolarHBondContact O-N 2.79Å; L1107-N1111 PolarHBondContact O-N 2.72Å; L1107-N1111 PolarHBondContact O-ND2 2.74Å
1108	D	80.9	Confident	77.2	Confident	105 Å²	105	94.7 Å²	94.7	56%	0.561	48%	0.481	S	S	*	.	H	α-helix	trans	-66.8	-40.8	178.3	-68.4	-28.2	0	0	0	111.7	C1104 Y1110 N1111 E1112	C1104-D1108 PolarHBondContact O-N 2.95Å; D1108-Y1110 VanDerWaalsContact C-N 3.27Å; D1108-Y1110 PolarHBondContact O-N 3.44Å; D1108-N1111 PolarHBondContact O-N 3.3Å; D1108-N1111 VanDerWaalsContact O-N 3.08Å; D1108-E1112 PolarHBondContact O-N 2.91Å; D1108-E1112 VanDerWaalsContact O-N 3.09Å
1109	S	71.8	Confident	78	Confident	59 Å²	59	95 Å²	95	41%	0.413	49%	0.485	S	S	.	.	H	α-helix	trans	-60.3	-35.3	175.8	-175.8	0	0	0	0	112.9	T1105 R1113	T1105-S1109 PolarHBondContact O-N 3.06Å; S1109-R1113 PolarHBondContact O-N 2.89Å
1110	Y	75.8	Confident	78.4	Confident	156 Å²	156	100.4 Å²	100.4	61%	0.612	51%	0.511	S	S	*	.	H	α-helix	trans	-67.8	-36.6	174.8	-77.1	-61.2	0	0	0	112.7	S1106 L1107 D1108 I1114	S1106-Y1110 WeakPolarHBondContact O-CD2 3.26Å; S1106-Y1110 PolarHBondContact O-N 2.8Å; L1107-Y1110 PolarHBondContact O-N 2.79Å; D1108-Y1110 VanDerWaalsContact C-N 3.27Å; D1108-Y1110 PolarHBondContact O-N 3.44Å; Y1110-I1114 WeakPolarHBondContact O-CG1 3.36Å
1111	N	85	Confident	78.8	Confident	98 Å²	98	99 Å²	99	52%	0.524	51%	0.508	S	S	.	.	H	α-helix	trans	-70.3	-41.7	178.6	-72.4	-41	0	0	0	112.2	L1107 D1108 R1113 I1114 D1115	L1107-N1111 PolarHBondContact O-N 2.72Å; L1107-N1111 PolarHBondContact O-ND2 2.74Å; D1108-N1111 PolarHBondContact O-N 3.3Å; D1108-N1111 VanDerWaalsContact O-N 3.08Å; N1111-R1113 VanDerWaalsContact C-N 3.32Å; N1111-R1113 PolarHBondContact O-N 3.37Å; N1111-I1114 WeakPolarHBondContact O-CB 3.49Å; N1111-I1114 PolarHBondContact O-N 3.22Å; N1111-I1114 VanDerWaalsContact O-N 3.14Å; N1111-D1115 PolarHBondContact O-N 3.4Å
1112	E	80.7	Confident	79.3	Confident	124 Å²	124	99.8 Å²	99.8	58%	0.579	51%	0.508	S	S	*	.	H	α-helix	trans	-62.5	-39.3	178.5	-170.5	-179.8	-174	0	0	112.2	D1108 I1114 D1115 N1116	D1108-E1112 PolarHBondContact O-N 2.91Å; D1108-E1112 VanDerWaalsContact O-N 3.09Å; E1112-I1114 PolarHBondContact O-N 3.1Å; E1112-D1115 PolarHBondContact O-N 3.15Å; E1112-N1116 PolarHBondContact O-N 2.92Å
1113	R	77.4	Confident	79.7	Confident	180 Å²	180	101.6 Å²	101.6	68%	0.679	52%	0.522	S	S	*	.	H	α-helix	trans	-59.5	-35.2	175.9	-123.2	177.9	173.4	104.8	0.3	112.4	S1109 N1111 V1117	S1109-R1113 PolarHBondContact O-N 2.89Å; N1111-R1113 VanDerWaalsContact C-N 3.32Å; N1111-R1113 PolarHBondContact O-N 3.37Å; R1113-V1117 WeakPolarHBondContact O-CG2 3.27Å; R1113-V1117 PolarHBondContact O-N 2.63Å
1114	I	82.2	Confident	80.1	Confident	112 Å²	112	102 Å²	102	57%	0.574	53%	0.528	S	S	*	.	H	α-helix	trans	-69.8	-39.5	178.8	-67	167.2	0	0	0	110.7	Y1110 N1111 E1112 K1118	Y1110-I1114 WeakPolarHBondContact O-CG1 3.36Å; N1111-I1114 WeakPolarHBondContact O-CB 3.49Å; N1111-I1114 PolarHBondContact O-N 3.22Å; N1111-I1114 VanDerWaalsContact O-N 3.14Å; E1112-I1114 PolarHBondContact O-N 3.1Å; I1114-K1118 PolarHBondContact O-N 3.36Å
1115	D	85.1	Confident	80.5	Confident	95 Å²	95	105.1 Å²	105.1	51%	0.508	54%	0.538	S	S	.	.	H	α-helix	trans	-70.3	-38	178.9	-76.2	-29.7	0	0	0	112.7	N1111 E1112 V1117 K1118 N1119	N1111-D1115 PolarHBondContact O-N 3.4Å; E1112-D1115 PolarHBondContact O-N 3.15Å; D1115-V1117 PolarHBondContact O-N 3.18Å; D1115-K1118 WeakPolarHBondContact O-CB 3.43Å; D1115-K1118 PolarHBondContact O-N 3.15Å; D1115-N1119 PolarHBondContact O-N 3.46Å
1116	N	79.1	Confident	81	Confident	94 Å²	94	107.2 Å²	107.2	50%	0.503	54%	0.539	S	S	.	.	H	α-helix	trans	-60.6	-46	177.1	-78	-19.8	0	0	0	112.4	E1112 K1118 N1119 E1120	E1112-N1116 PolarHBondContact O-N 2.92Å; N1116-K1118 PolarHBondContact O-N 3.29Å; N1116-N1119 PolarHBondContact O-N 3Å; N1116-E1120 PolarHBondContact O-N 2.96Å
1117	V	81.8	Confident	81.4	Confident	82 Å²	82	108 Å²	108	50%	0.497	54%	0.541	S	S	.	.	H	α-helix	trans	-60.9	-34.5	177.5	173.6	0	0	0	0	111.4	R1113 D1115 E1120 I1121	R1113-V1117 WeakPolarHBondContact O-CG2 3.27Å; R1113-V1117 PolarHBondContact O-N 2.63Å; D1115-V1117 PolarHBondContact O-N 3.18Å; V1117-E1120 PolarHBondContact O-N 3.38Å; V1117-I1121 HydrophobicContact CG1-CD1 4.37Å; V1117-I1121 WeakPolarHBondContact O-CG1 3.41Å; V1117-I1121 PolarHBondContact O-N 3.46Å
1118	K	86.3	Confident	81.7	Confident	133 Å²	133	107.1 Å²	107.1	58%	0.578	54%	0.537	S	S	*	.	H	α-helix	trans	-68.9	-36.2	179.2	-166	178.8	178.8	-176.7	0	112.7	I1114 D1115 N1116	I1114-K1118 PolarHBondContact O-N 3.36Å; D1115-K1118 WeakPolarHBondContact O-CB 3.43Å; D1115-K1118 PolarHBondContact O-N 3.15Å; N1116-K1118 PolarHBondContact O-N 3.29Å
1119	N	83.7	Confident	81.9	Confident	94 Å²	94	106.6 Å²	106.6	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-70.7	-38	177.1	-70.2	-25.8	0	0	0	112	D1115 N1116 I1121 Q1122 S1123	D1115-N1119 PolarHBondContact O-N 3.46Å; N1116-N1119 PolarHBondContact O-N 3Å; N1119-I1121 VanDerWaalsContact C-N 3.28Å; N1119-I1121 PolarHBondContact O-N 3.02Å; N1119-Q1122 PolarHBondContact O-N 3.27Å; N1119-Q1122 VanDerWaalsContact O-N 3.09Å; N1119-S1123 PolarHBondContact O-N 3.43Å
1120	E	77.6	Confident	82.4	Confident	130 Å²	130	108.8 Å²	108.8	61%	0.607	54%	0.537	S	S	*	.	H	α-helix	trans	-62.8	-34.5	178.2	-154.9	176.1	-168.3	0	0	112.4	N1116 V1117 Q1122 S1123 T1124	N1116-E1120 PolarHBondContact O-N 2.96Å; V1117-E1120 PolarHBondContact O-N 3.38Å; E1120-Q1122 VanDerWaalsContact C-N 3.34Å; E1120-Q1122 PolarHBondContact O-N 3.43Å; E1120-S1123 PolarHBondContact O-OG 2.95Å; E1120-T1124 WeakPolarHBondContact O-CG2 3.1Å; E1120-T1124 PolarHBondContact O-N 3.2Å; E1120-T1124 PolarHBondContact O-OG1 2.81Å; E1120-T1124 VanDerWaalsContact O-OG1 3.05Å
1121	I	84.2	Confident	82.6	Confident	93 Å²	93	106.3 Å²	106.3	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-67.6	-33.4	174.2	-66.5	167.3	0	0	0	111.8	V1117 N1119 T1124 M1125	V1117-I1121 HydrophobicContact CG1-CD1 4.37Å; V1117-I1121 WeakPolarHBondContact O-CG1 3.41Å; V1117-I1121 PolarHBondContact O-N 3.46Å; N1119-I1121 VanDerWaalsContact C-N 3.28Å; N1119-I1121 PolarHBondContact O-N 3.02Å; I1121-T1124 PolarHBondContact O-OG1 3.15Å; I1121-M1125 WeakPolarHBondContact O-CG 3.49Å; I1121-M1125 PolarHBondContact O-N 2.88Å
1122	Q	84.6	Confident	82.5	Confident	125 Å²	125	109.1 Å²	109.1	58%	0.584	54%	0.537	S	S	*	.	H	α-helix	trans	-76.2	-35.4	-179.8	-70.3	-176.5	-12	0	0	112.9	N1119 E1120 K1126	N1119-Q1122 PolarHBondContact O-N 3.27Å; N1119-Q1122 VanDerWaalsContact O-N 3.09Å; E1120-Q1122 VanDerWaalsContact C-N 3.34Å; E1120-Q1122 PolarHBondContact O-N 3.43Å; Q1122-K1126 PolarHBondContact O-N 3.02Å
1123	S	77.2	Confident	82.5	Confident	67 Å²	67	107.2 Å²	107.2	47%	0.469	54%	0.535	S	S	.	.	H	α-helix	trans	-66.9	-45.6	178	60.1	0	0	0	0	111.5	N1119 E1120 M1125 K1126 T1127	N1119-S1123 PolarHBondContact O-N 3.43Å; E1120-S1123 PolarHBondContact O-OG 2.95Å; S1123-M1125 VanDerWaalsContact C-N 3.32Å; S1123-M1125 PolarHBondContact O-N 2.77Å; S1123-K1126 WeakPolarHBondContact O-CB 3.45Å; S1123-K1126 PolarHBondContact O-N 2.84Å; S1123-K1126 VanDerWaalsContact O-N 3.09Å; S1123-T1127 PolarHBondContact O-N 3.07Å; S1123-T1127 PolarHBondContact O-OG1 3.09Å
1124	T	81.6	Confident	82.6	Confident	75 Å²	75	104.2 Å²	104.2	46%	0.46	53%	0.528	S	S	.	.	H	α-helix	trans	-60.3	-37.7	178.6	49.5	0	0	0	0	113	E1120 I1121 K1126 T1127 I1128	E1120-T1124 WeakPolarHBondContact O-CG2 3.1Å; E1120-T1124 PolarHBondContact O-N 3.2Å; E1120-T1124 PolarHBondContact O-OG1 2.81Å; E1120-T1124 VanDerWaalsContact O-OG1 3.05Å; I1121-T1124 PolarHBondContact O-OG1 3.15Å; T1124-K1126 VanDerWaalsContact C-N 3.31Å; T1124-K1126 PolarHBondContact O-N 3.1Å; T1124-T1127 PolarHBondContact O-N 2.96Å; T1124-I1128 WeakPolarHBondContact O-CG1 3.29Å; T1124-I1128 PolarHBondContact O-N 2.82Å
1125	M	88.1	Confident	82.2	Confident	125 Å²	125	102 Å²	102	62%	0.616	52%	0.523	S	S	*	.	H	α-helix	trans	-61.7	-36.5	174.6	-77	-174.8	160.5	0	0	113.1	I1121 S1123	I1121-M1125 WeakPolarHBondContact O-CG 3.49Å; I1121-M1125 PolarHBondContact O-N 2.88Å; S1123-M1125 VanDerWaalsContact C-N 3.32Å; S1123-M1125 PolarHBondContact O-N 2.77Å
1126	K	86.3	Confident	81.8	Confident	140 Å²	140	101.5 Å²	101.5	61%	0.609	52%	0.52	S	S	*	.	H	α-helix	trans	-68.5	-41.9	-179.4	-167.5	-178.6	175.7	-170.6	0	111.9	Q1122 S1123 T1124 I1128 D1129 E1130	Q1122-K1126 PolarHBondContact O-N 3.02Å; S1123-K1126 WeakPolarHBondContact O-CB 3.45Å; S1123-K1126 PolarHBondContact O-N 2.84Å; S1123-K1126 VanDerWaalsContact O-N 3.09Å; T1124-K1126 VanDerWaalsContact C-N 3.31Å; T1124-K1126 PolarHBondContact O-N 3.1Å; K1126-I1128 VanDerWaalsContact C-N 3.29Å; K1126-I1128 PolarHBondContact O-N 2.91Å; K1126-D1129 PolarHBondContact O-N 2.86Å; K1126-E1130 PolarHBondContact O-N 2.95Å
1127	T	80	Confident	81.7	Confident	77 Å²	77	102.9 Å²	102.9	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-62.2	-36.3	178.9	-38	0	0	0	0	112.1	S1123 T1124 D1129 E1130 L1131	S1123-T1127 PolarHBondContact O-N 3.07Å; S1123-T1127 PolarHBondContact O-OG1 3.09Å; T1124-T1127 PolarHBondContact O-N 2.96Å; T1127-D1129 PolarHBondContact O-N 3.15Å; T1127-E1130 PolarHBondContact O-N 2.97Å; T1127-L1131 WeakPolarHBondContact O-CG 3.34Å; T1127-L1131 PolarHBondContact O-N 3.24Å; T1127-L1131 VanDerWaalsContact O-N 3.14Å
1128	I	86.5	Confident	81	Confident	86 Å²	86	104.3 Å²	104.3	44%	0.441	53%	0.531	S	S	.	.	H	α-helix	trans	-64.7	-38.9	178.3	-68.4	168.4	0	0	0	111.6	T1124 K1126 L1131 R1132	T1124-I1128 WeakPolarHBondContact O-CG1 3.29Å; T1124-I1128 PolarHBondContact O-N 2.82Å; K1126-I1128 VanDerWaalsContact C-N 3.29Å; K1126-I1128 PolarHBondContact O-N 2.91Å; I1128-L1131 PolarHBondContact O-N 2.83Å; I1128-R1132 WeakPolarHBondContact O-CG 3.47Å; I1128-R1132 PolarHBondContact O-N 3.44Å; I1128-R1132 VanDerWaalsContact O-N 3.15Å
1129	D	85.1	Confident	80.3	Confident	93 Å²	93	106.9 Å²	106.9	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-69.6	-34.3	178.5	-78.9	-20.1	0	0	0	112.1	K1126 T1127 R1132 T1133	K1126-D1129 PolarHBondContact O-N 2.86Å; T1127-D1129 PolarHBondContact O-N 3.15Å; D1129-R1132 PolarHBondContact O-N 3.11Å; D1129-R1132 IonicContact OD1-CZ 3.98Å; D1129-R1132 IonicContact OD1-NH1 3.55Å; D1129-R1132 PolarHBondContact OD1-NH1 3.25Å; D1129-T1133 PolarHBondContact O-N 3.45Å
1130	E	82.6	Confident	79.5	Confident	105 Å²	105	111.6 Å²	111.6	49%	0.491	55%	0.55	S	S	.	.	H	α-helix	trans	-63.6	-46.9	173.1	-69.4	176.8	-173.9	0	0	111.6	K1126 T1127 R1132 T1133 Q1134	K1126-E1130 PolarHBondContact O-N 2.95Å; T1127-E1130 PolarHBondContact O-N 2.97Å; E1130-R1132 VanDerWaalsContact C-N 3.29Å; E1130-R1132 PolarHBondContact O-N 2.56Å; E1130-T1133 PolarHBondContact O-N 3.44Å; E1130-T1133 PolarHBondContact O-OG1 3.48Å; E1130-Q1134 PolarHBondContact O-N 3.45Å
1131	L	79.5	Confident	79	Confident	105 Å²	105	115.3 Å²	115.3	55%	0.55	56%	0.558	S	S	.	*	H	α-helix	trans	-59.2	-38	176.7	-71.7	171.4	0	0	0	112.5	T1127 I1128 T1133 Q1134 S1135	T1127-L1131 WeakPolarHBondContact O-CG 3.34Å; T1127-L1131 PolarHBondContact O-N 3.24Å; T1127-L1131 VanDerWaalsContact O-N 3.14Å; I1128-L1131 PolarHBondContact O-N 2.83Å; L1131-T1133 VanDerWaalsContact C-N 3.31Å; L1131-T1133 PolarHBondContact O-N 3.16Å; L1131-Q1134 PolarHBondContact O-N 2.68Å; L1131-S1135 PolarHBondContact O-N 2.66Å
1132	R	82.6	Confident	78.5	Confident	156 Å²	156	120.7 Å²	120.7	59%	0.589	57%	0.574	S	S	*	*	H	α-helix	trans	-61.9	-36.6	174.8	-74.2	171.1	175.3	165.8	-2.9	112.6	I1128 D1129 E1130 N1136	I1128-R1132 WeakPolarHBondContact O-CG 3.47Å; I1128-R1132 PolarHBondContact O-N 3.44Å; I1128-R1132 VanDerWaalsContact O-N 3.15Å; D1129-R1132 PolarHBondContact O-N 3.11Å; D1129-R1132 IonicContact OD1-CZ 3.98Å; D1129-R1132 IonicContact OD1-NH1 3.55Å; D1129-R1132 PolarHBondContact OD1-NH1 3.25Å; E1130-R1132 VanDerWaalsContact C-N 3.29Å; E1130-R1132 PolarHBondContact O-N 2.56Å; R1132-N1136 PolarHBondContact O-N 2.79Å
1133	T	81.5	Confident	77.8	Confident	85 Å²	85	119.8 Å²	119.8	52%	0.521	57%	0.57	S	S	.	*	H	α-helix	trans	-69.4	-40	176.5	65.2	0	0	0	0	112.6	D1129 E1130 L1131 N1136 N1137	D1129-T1133 PolarHBondContact O-N 3.45Å; E1130-T1133 PolarHBondContact O-N 3.44Å; E1130-T1133 PolarHBondContact O-OG1 3.48Å; L1131-T1133 VanDerWaalsContact C-N 3.31Å; L1131-T1133 PolarHBondContact O-N 3.16Å; T1133-N1136 PolarHBondContact O-N 3.25Å; T1133-N1137 PolarHBondContact O-N 2.53Å
1134	Q	79.5	Confident	77.9	Confident	117 Å²	117	123.7 Å²	123.7	55%	0.547	58%	0.584	S	S	.	*	H	α-helix	trans	-64.8	-42.3	177.7	-68	-175.2	-5.5	0	0	111.9	E1130 L1131 N1136 N1137 L1138	E1130-Q1134 PolarHBondContact O-N 3.45Å; L1131-Q1134 PolarHBondContact O-N 2.68Å; Q1134-N1136 VanDerWaalsContact C-N 3.3Å; Q1134-N1136 PolarHBondContact O-N 2.88Å; Q1134-N1137 PolarHBondContact O-N 3.22Å; Q1134-N1137 VanDerWaalsContact O-N 3.14Å; Q1134-L1138 PolarHBondContact O-N 2.91Å
1135	S	74	Confident	77.7	Confident	65 Å²	65	123.1 Å²	123.1	46%	0.455	58%	0.577	S	S	.	*	H	α-helix	trans	-58.4	-39.5	175.7	-175.9	0	0	0	0	112.6	L1131 N1137 L1138 R1139	L1131-S1135 PolarHBondContact O-N 2.66Å; S1135-N1137 PolarHBondContact O-N 2.83Å; S1135-L1138 PolarHBondContact O-N 3.15Å; S1135-R1139 PolarHBondContact O-N 2.79Å
1136	N	76.6	Confident	77.3	Confident	85 Å²	85	124 Å²	124	46%	0.455	58%	0.579	S	S	.	*	H	α-helix	trans	-67.5	-31.6	176.7	-81.8	-25	0	0	0	113.5	R1132 T1133 Q1134 Y1140	R1132-N1136 PolarHBondContact O-N 2.79Å; T1133-N1136 PolarHBondContact O-N 3.25Å; Q1134-N1136 VanDerWaalsContact C-N 3.3Å; Q1134-N1136 PolarHBondContact O-N 2.88Å; N1136-Y1140 WeakPolarHBondContact O-CD2 3.43Å
1137	N	75.9	Confident	76.9	Confident	123 Å²	123	124.2 Å²	124.2	66%	0.658	59%	0.587	S	S	*	*	H	α-helix	trans	-73.1	-36.6	176.8	-72.3	-25.2	0	0	0	112.4	T1133 Q1134 S1135 R1139 Y1140	T1133-N1137 PolarHBondContact O-N 2.53Å; Q1134-N1137 PolarHBondContact O-N 3.22Å; Q1134-N1137 VanDerWaalsContact O-N 3.14Å; S1135-N1137 PolarHBondContact O-N 2.83Å; N1137-R1139 PolarHBondContact O-N 3.48Å; N1137-Y1140 PolarHBondContact O-N 2.75Å
1138	L	66.6	Low	77	Confident	111 Å²	111	125.4 Å²	125.4	58%	0.581	59%	0.591	S	S	*	*	H	α-helix	trans	-65	-27.4	178.6	-74.9	162.7	0	0	0	112.7	Q1134 S1135 Y1140	Q1134-L1138 PolarHBondContact O-N 2.91Å; S1135-L1138 PolarHBondContact O-N 3.15Å; L1138-Y1140 PolarHBondContact O-N 2.75Å; L1138-Y1140 VanDerWaalsContact O-N 3.17Å
1139	R	72	Confident	76.9	Confident	187 Å²	187	122.1 Å²	122.1	71%	0.706	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-16.4	177.7	-84.4	-179	170.8	163.3	-3.6	115.5	S1135 N1137	S1135-R1139 PolarHBondContact O-N 2.79Å; N1137-R1139 PolarHBondContact O-N 3.48Å
1140	Y	67.6	Low	77.1	Confident	193 Å²	193	124.2 Å²	124.2	76%	0.757	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	16.8	-173.8	-61.6	-76.1	0	0	0	114.7	N1136 N1137 L1138	N1136-Y1140 WeakPolarHBondContact O-CD2 3.43Å; N1137-Y1140 PolarHBondContact O-N 2.75Å; L1138-Y1140 PolarHBondContact O-N 2.75Å; L1138-Y1140 VanDerWaalsContact O-N 3.17Å
1141	R	67.4	Low	77.4	Confident	209 Å²	209	119.2 Å²	119.2	79%	0.789	55%	0.553	S	S	*	*			trans	-73.6	136.5	172.5	-92.8	-178.5	161.4	176	-5.8	111.3
1142	Y	72.8	Confident	77.8	Confident	206 Å²	206	117.3 Å²	117.3	81%	0.808	55%	0.546	S	S	*	.			trans	-134.6	153.1	174.4	64.6	-90.9	0	0	0	110.6	I1144	Y1142-I1144 HydrophobicContact CE2-CG1 4.43Å
1143	E	70.1	Confident	77.9	Confident	106 Å²	106	113.8 Å²	113.8	50%	0.495	54%	0.536	S	S	.	.			trans	-126.4	139.5	177.8	-168.2	169.6	177.9	0	0	109.9	V1165	E1143-V1165 WeakPolarHBondContact OE2-CG1 3.4Å
1144	I	80.2	Confident	78.2	Confident	148 Å²	148	111.2 Å²	111.2	76%	0.759	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-95.4	118.1	-177.6	-57.6	174.6	0	0	0	108.5	Y1142	Y1142-I1144 HydrophobicContact CE2-CG1 4.43Å
1145	I	76.9	Confident	78.5	Confident	63 Å²	63	110.8 Å²	110.8	32%	0.323	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-100.2	127.9	-177.9	-55	165.5	0	0	0	109.9	S1149 L1158 F1163 V1165	I1145-S1149 WeakPolarHBondContact CG2-OG 3.16Å; I1145-L1158 HydrophobicContact CG2-CD2 4.41Å; I1145-F1163 HydrophobicContact CD1-CE2 3.51Å; I1145-F1163 HydrophobicContact CD1-CZ 3.93Å; I1145-V1165 HydrophobicContact CD1-CG2 3.48Å; I1145-V1165 VanDerWaalsContact CD1-CG2 3.48Å; I1145-V1165 HydrophobicContact CG1-CG2 4.16Å
1146	E	80	Confident	79	Confident	143 Å²	143	113 Å²	113	67%	0.668	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-73.5	147.5	175.4	-60.3	-172.4	151.6	0	0	112	D1148 S1149	E1146-D1148 VanDerWaalsContact CB-OD1 3.27Å; E1146-D1148 WeakPolarHBondContact CB-OD1 3.23Å; E1146-D1148 PolarHBondContact O-N 2.68Å; E1146-D1148 VanDerWaalsContact O-N 3.12Å; E1146-S1149 VanDerWaalsContact O-CB 3.26Å; E1146-S1149 WeakPolarHBondContact O-CB 3.46Å; E1146-S1149 PolarHBondContact O-N 3.35Å; E1146-S1149 PolarHBondContact O-OG 3.07Å
1147	N	77.3	Confident	79.5	Confident	145 Å²	145	111.6 Å²	111.6	78%	0.775	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.3	-174.5	-91.4	-13.4	0	0	0	114.3
1148	D	82.3	Confident	79.9	Confident	102 Å²	102	105.7 Å²	105.7	55%	0.545	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	5.6	179.1	61.2	-27.2	0	0	0	113.4	E1146	E1146-D1148 VanDerWaalsContact CB-OD1 3.27Å; E1146-D1148 WeakPolarHBondContact CB-OD1 3.23Å; E1146-D1148 PolarHBondContact O-N 2.68Å; E1146-D1148 VanDerWaalsContact O-N 3.12Å
1149	S	83.8	Confident	80.6	Confident	18 Å²	18	104.2 Å²	104.2	13%	0.126	48%	0.482	C	S	.	.			trans	-55.4	137.8	172	57.4	0	0	0	0	111.8	I1145 E1146 L1158	I1145-S1149 WeakPolarHBondContact CG2-OG 3.16Å; E1146-S1149 VanDerWaalsContact O-CB 3.26Å; E1146-S1149 WeakPolarHBondContact O-CB 3.46Å; E1146-S1149 PolarHBondContact O-N 3.35Å; E1146-S1149 PolarHBondContact O-OG 3.07Å; S1149-L1158 PolarHBondContact O-N 2.64Å
1150	R	89.4	Confident	81.2	Confident	137 Å²	137	100.9 Å²	100.9	52%	0.517	48%	0.478	S	S	.	.	B	Isolated β-bridge	trans	-121.2	150	-175.8	-67.4	172.3	-176.1	-89.3	-2.8	110.4	T1152 N1155 H1156	R1150-T1152 PolarHBondContact O-N 2.81Å; R1150-N1155 WeakPolarHBondContact CD-O 3.37Å; R1150-N1155 PolarHBondContact NH1-O 2.73Å; R1150-H1156 WeakPolarHBondContact CA-O 3.44Å
1151	C	89.9	Confident	81.9	Confident	0 Å²	0	98.5 Å²	98.5	0%	0	47%	0.467	C	S	.	.			trans	-66.9	128	169.1	172	0	0	0	0	109.9	H1153 N1155 H1156 L1158 H1173	C1151-H1153 PolarHBondContact O-N 2.93Å; C1151-N1155 VanDerWaalsContact O-CA 3.3Å; C1151-N1155 WeakPolarHBondContact O-CA 3.33Å; C1151-N1155 PolarHBondContact O-N 2.82Å; C1151-H1156 PolarHBondContact N-O 3.1Å; C1151-L1158 HydrophobicContact CB-CD1 4.13Å; C1151-H1173 WeakPolarHBondContact CB-CE1 3.25Å; C1151-H1173 VanDerWaalsContact CB-ND1 3.28Å; C1151-H1173 WeakPolarHBondContact CB-ND1 3.45Å; C1151-H1173 PolarHBondContact SG-N 3.01Å
1152	T	87.2	Confident	82.7	Confident	64 Å²	64	91.5 Å²	91.5	39%	0.393	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-26.3	-176.7	-42.8	0	0	0	0	113	R1150 N1171 F1172 L1225	R1150-T1152 PolarHBondContact O-N 2.81Å; T1152-N1171 PolarHBondContact N-O 2.99Å; T1152-N1171 PolarHBondContact OG1-O 2.88Å; T1152-F1172 HydrophobicContact CG2-CE1 4.43Å; T1152-L1225 HydrophobicContact CG2-CD1 3.76Å
1153	H	84.8	Confident	83.2	Confident	82 Å²	82	85.5 Å²	85.5	38%	0.38	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-50.9	-179.9	-177.1	-105.5	0	0	0	113.3	C1151 C1176 E1179 L1180	C1151-H1153 PolarHBondContact O-N 2.93Å; H1153-C1176 HydrophobicContact CB-CB 3.68Å; H1153-E1179 IonicContact CE1-OE2 3.09Å; H1153-E1179 PolarHBondContact CE1-OE2 2.95Å; H1153-L1180 HydrophobicContact CB-CD1 4.07Å
1154	C	88.4	Confident	84	Confident	32 Å²	32	82.5 Å²	82.5	22%	0.216	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-4.5	-172.5	76.6	0	0	0	0	114.6	H1156 H1173	C1154-H1156 PolarHBondContact O-N 3.39Å; C1154-H1156 PolarHBondContact O-ND1 2.86Å; C1154-H1173 PolarHBondContact SG-CE1 2.73Å; C1154-H1173 PolarHBondContact SG-ND1 2.85Å
1155	N	84.8	Confident	84.3	Confident	107 Å²	107	77.4 Å²	77.4	57%	0.572	39%	0.393	S	S	*	.			trans	57.5	12	-178.3	-72.5	-35.1	0	0	0	116.6	R1150 C1151	R1150-N1155 WeakPolarHBondContact CD-O 3.37Å; R1150-N1155 PolarHBondContact NH1-O 2.73Å; C1151-N1155 VanDerWaalsContact O-CA 3.3Å; C1151-N1155 WeakPolarHBondContact O-CA 3.33Å; C1151-N1155 PolarHBondContact O-N 2.82Å
1156	H	85.8	Confident	84.6	Confident	111 Å²	111	75 Å²	75	51%	0.514	38%	0.38	S	S	.	.	S	Bend	trans	-86.4	157	172.6	-68.2	71.7	0	0	0	111	R1150 C1151 C1154 L1158 L1160	R1150-H1156 WeakPolarHBondContact CA-O 3.44Å; C1151-H1156 PolarHBondContact N-O 3.1Å; C1154-H1156 PolarHBondContact O-N 3.39Å; C1154-H1156 PolarHBondContact O-ND1 2.86Å; H1156-L1158 PolarHBondContact O-N 3.05Å; H1156-L1160 HydrophobicContact CB-CD1 4.46Å
1157	L	87.4	Confident	84.5	Confident	56 Å²	56	74.3 Å²	74.3	29%	0.293	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-51.7	132.5	178.3	-118.3	74.8	0	0	0	111	T1159 L1160 H1173	L1157-T1159 VanDerWaalsContact C-N 3.27Å; L1157-T1159 PolarHBondContact O-N 3.1Å; L1157-L1160 HydrophobicContact CB-CD1 3.76Å; L1157-L1160 HydrophobicContact CB-CG 3.81Å; L1157-L1160 WeakPolarHBondContact O-CB 3.44Å; L1157-L1160 PolarHBondContact O-N 2.87Å; L1157-H1173 PolarHBondContact O-CE1 3.34Å; L1157-H1173 PolarHBondContact O-NE2 3.03Å
1158	L	84.3	Confident	84.8	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-59.7	-42	-177.1	-152	79.7	0	0	0	111.1	I1145 S1149 C1151 H1156 L1160 R1161 F1163 V1165 N1171 H1173	I1145-L1158 HydrophobicContact CG2-CD2 4.41Å; S1149-L1158 PolarHBondContact O-N 2.64Å; C1151-L1158 HydrophobicContact CB-CD1 4.13Å; H1156-L1158 PolarHBondContact O-N 3.05Å; L1158-L1160 PolarHBondContact O-N 2.73Å; L1158-R1161 PolarHBondContact O-N 2.77Å; L1158-F1163 HydrophobicContact CB-CD1 4.48Å; L1158-F1163 HydrophobicContact CD1-CB 4.07Å; L1158-F1163 HydrophobicContact CD1-CG 4.49Å; L1158-F1163 HydrophobicContact CD2-CB 3.87Å; L1158-F1163 HydrophobicContact CD2-CD1 3.93Å; L1158-F1163 HydrophobicContact CD2-CD2 3.26Å; L1158-F1163 HydrophobicContact CD2-CE1 4.29Å; L1158-F1163 HydrophobicContact CD2-CE2 3.69Å; L1158-F1163 HydrophobicContact CD2-CG 3.41Å; L1158-F1163 VanDerWaalsContact CD2-CG 3.41Å; L1158-F1163 HydrophobicContact CD2-CZ 4.18Å; L1158-F1163 HydrophobicContact CG-CB 3.57Å; L1158-F1163 HydrophobicContact CG-CD1 3.87Å; L1158-F1163 HydrophobicContact CG-CD2 3.95Å; L1158-F1163 HydrophobicContact CG-CG 3.53Å; L1158-F1163 WeakPolarHBondContact O-CD1 3.27Å; L1158-V1165 HydrophobicContact CD2-CG2 4.24Å; L1158-N1171 HydrophobicContact CD1-CB 3.47Å; L1158-N1171 VanDerWaalsContact CD1-CB 3.47Å; L1158-N1171 HydrophobicContact CD2-CB 3.86Å; L1158-N1171 HydrophobicContact CG-CB 4.31Å; L1158-H1173 PolarHBondContact O-CD2 2.87Å; L1158-H1173 PolarHBondContact O-NE2 3.47Å
1159	T	81.3	Confident	84.8	Confident	79 Å²	79	67 Å²	67	49%	0.485	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-65.6	-8	-177.9	55.4	0	0	0	0	115.4	L1157	L1157-T1159 VanDerWaalsContact C-N 3.27Å; L1157-T1159 PolarHBondContact O-N 3.1Å
1160	L	82.8	Confident	84.9	Confident	117 Å²	117	68.9 Å²	68.9	61%	0.613	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-78.1	-19.3	179	-68.1	172.3	0	0	0	113.7	H1156 L1157 L1158	H1156-L1160 HydrophobicContact CB-CD1 4.46Å; L1157-L1160 HydrophobicContact CB-CD1 3.76Å; L1157-L1160 HydrophobicContact CB-CG 3.81Å; L1157-L1160 WeakPolarHBondContact O-CB 3.44Å; L1157-L1160 PolarHBondContact O-N 2.87Å; L1158-L1160 PolarHBondContact O-N 2.73Å
1161	R	83.1	Confident	84.8	Confident	143 Å²	143	63.8 Å²	63.8	54%	0.54	35%	0.35	S	S	.	.	S	Bend	trans	-144.6	165.1	-179.8	-58.4	179.1	-178.7	164.8	1.7	109.1	L1158 F1163 H1173	L1158-R1161 PolarHBondContact O-N 2.77Å; R1161-F1163 WeakPolarHBondContact O-CD1 3.41Å; R1161-H1173 HydrophobicContact CB-CB 4.42Å
1162	A	84.1	Confident	84.8	Confident	63 Å²	63	63.9 Å²	63.9	52%	0.521	35%	0.351	S	S	.	.			trans	-58.1	140.9	170.6	0	0	0	0	0	110.5	H1173 I1174	A1162-H1173 WeakPolarHBondContact O-CA 3.43Å; A1162-I1174 HydrophobicContact CB-CD1 3.41Å; A1162-I1174 VanDerWaalsContact CB-CD1 3.41Å; A1162-I1174 HydrophobicContact CB-CG1 3.91Å; A1162-I1174 PolarHBondContact O-N 2.67Å
1163	F	84.3	Confident	84.9	Confident	79 Å²	79	60.9 Å²	60.9	35%	0.346	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156	-170.2	62.6	-100.9	0	0	0	112.6	I1145 L1158 R1161 V1165 F1172	I1145-F1163 HydrophobicContact CD1-CE2 3.51Å; I1145-F1163 HydrophobicContact CD1-CZ 3.93Å; L1158-F1163 HydrophobicContact CB-CD1 4.48Å; L1158-F1163 HydrophobicContact CD1-CB 4.07Å; L1158-F1163 HydrophobicContact CD1-CG 4.49Å; L1158-F1163 HydrophobicContact CD2-CB 3.87Å; L1158-F1163 HydrophobicContact CD2-CD1 3.93Å; L1158-F1163 HydrophobicContact CD2-CD2 3.26Å; L1158-F1163 HydrophobicContact CD2-CE1 4.29Å; L1158-F1163 HydrophobicContact CD2-CE2 3.69Å; L1158-F1163 HydrophobicContact CD2-CG 3.41Å; L1158-F1163 VanDerWaalsContact CD2-CG 3.41Å; L1158-F1163 HydrophobicContact CD2-CZ 4.18Å; L1158-F1163 HydrophobicContact CG-CB 3.57Å; L1158-F1163 HydrophobicContact CG-CD1 3.87Å; L1158-F1163 HydrophobicContact CG-CD2 3.95Å; L1158-F1163 HydrophobicContact CG-CG 3.53Å; L1158-F1163 WeakPolarHBondContact O-CD1 3.27Å; R1161-F1163 WeakPolarHBondContact O-CD1 3.41Å; F1163-V1165 HydrophobicContact CD2-CG2 3.81Å; F1163-V1165 HydrophobicContact CE2-CG2 3.82Å; F1163-F1172 CarbonylContact C-O 3.54Å; F1163-F1172 WeakPolarHBondContact CA-O 3.12Å; F1163-F1172 VanDerWaalsContact CB-O 3.28Å; F1163-F1172 WeakPolarHBondContact CB-O 3.43Å
1164	Y	86.7	Confident	84.9	Confident	44 Å²	44	59 Å²	59	17%	0.173	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	142.2	168.3	-77.5	-77.9	0	0	0	110.1	N1171 F1172 I1174 L1177 F1215 D1216 A1220	Y1164-N1171 WeakPolarHBondContact O-CA 3.33Å; Y1164-F1172 PolarHBondContact N-O 2.95Å; Y1164-F1172 PolarHBondContact O-N 3.04Å; Y1164-I1174 HydrophobicContact CD2-CG1 3.92Å; Y1164-I1174 HydrophobicContact CE2-CD1 4.1Å; Y1164-I1174 HydrophobicContact CE2-CG1 3.75Å; Y1164-L1177 HydrophobicContact CD2-CD2 3.75Å; Y1164-L1177 HydrophobicContact CG-CD2 4.2Å; Y1164-F1215 AromaticContact CE2-CD1 3.69Å; Y1164-F1215 HydrophobicContact CE2-CD1 3.69Å; Y1164-F1215 AromaticContact CE2-CE1 3.82Å; Y1164-F1215 HydrophobicContact CE2-CE1 3.82Å; Y1164-D1216 WeakPolarHBondContact CE1-OD1 3.33Å; Y1164-D1216 PolarHBondContact OH-OD1 3.49Å; Y1164-D1216 VanDerWaalsContact OH-OD1 3.11Å; Y1164-A1220 HydrophobicContact CD1-CB 3.86Å; Y1164-A1220 HydrophobicContact CE1-CB 3.61Å; Y1164-A1220 HydrophobicContact CG-CB 4.44Å
1165	V	86.1	Confident	84.7	Confident	41 Å²	41	59.7 Å²	59.7	25%	0.248	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.5	171.2	177.7	0	0	0	0	107.4	E1143 I1145 L1158 F1163 N1171	E1143-V1165 WeakPolarHBondContact OE2-CG1 3.4Å; I1145-V1165 HydrophobicContact CD1-CG2 3.48Å; I1145-V1165 VanDerWaalsContact CD1-CG2 3.48Å; I1145-V1165 HydrophobicContact CG1-CG2 4.16Å; L1158-V1165 HydrophobicContact CD2-CG2 4.24Å; F1163-V1165 HydrophobicContact CD2-CG2 3.81Å; F1163-V1165 HydrophobicContact CE2-CG2 3.82Å; V1165-N1171 WeakPolarHBondContact CG1-OD1 3.34Å; V1165-N1171 WeakPolarHBondContact CG2-OD1 3.49Å
1166	F	83.2	Confident	84.7	Confident	13 Å²	13	54.8 Å²	54.8	6%	0.057	30%	0.304	C	S	.	.			trans	-85.9	150	178	-72.8	-86.2	0	0	0	110.6	C1168 G1169 H1170 F1172 L1177 A1220 D1222 C1223	F1166-C1168 WeakPolarHBondContact CB-SG 3.35Å; F1166-C1168 PolarHBondContact O-N 3.31Å; F1166-G1169 PolarHBondContact O-N 3.39Å; F1166-H1170 PolarHBondContact N-O 2.84Å; F1166-H1170 VanDerWaalsContact N-O 3.1Å; F1166-F1172 AromaticContact CD2-CD2 3.9Å; F1166-F1172 HydrophobicContact CD2-CD2 3.9Å; F1166-F1172 AromaticContact CD2-CE2 3.96Å; F1166-F1172 HydrophobicContact CD2-CE2 3.96Å; F1166-F1172 AromaticContact CE2-CD2 3.72Å; F1166-F1172 HydrophobicContact CE2-CD2 3.72Å; F1166-F1172 AromaticContact CE2-CE2 3.97Å; F1166-F1172 HydrophobicContact CE2-CE2 3.97Å; F1166-L1177 HydrophobicContact CE2-CD1 4.03Å; F1166-L1177 HydrophobicContact CE2-CD2 3.95Å; F1166-L1177 HydrophobicContact CZ-CD1 4.23Å; F1166-L1177 HydrophobicContact CZ-CD2 3.91Å; F1166-A1220 WeakPolarHBondContact CE1-O 3.43Å; F1166-D1222 VanDerWaalsContact CE1-C 3.44Å; F1166-D1222 WeakPolarHBondContact CE1-O 3.44Å; F1166-C1223 HydrophobicContact CB-CB 4.22Å; F1166-C1223 HydrophobicContact CD1-CB 3.85Å; F1166-C1223 HydrophobicContact CD2-CB 4.32Å; F1166-C1223 HydrophobicContact CE1-CB 4.27Å; F1166-C1223 HydrophobicContact CG-CB 3.87Å
1167	P	77.8	Confident	84.7	Confident	127 Å²	127	49.5 Å²	49.5	83%	0.825	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-13.8	177.1	-24.4	33.3	0	0	0	115.5	G1169	P1167-G1169 VanDerWaalsContact C-N 3.33Å
1168	C	82.7	Confident	84.4	Confident	62 Å²	62	47.3 Å²	47.3	42%	0.419	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-3.7	173.9	66.2	0	0	0	0	113.9	F1166 H1170 C1226	F1166-C1168 WeakPolarHBondContact CB-SG 3.35Å; F1166-C1168 PolarHBondContact O-N 3.31Å; C1168-H1170 PolarHBondContact SG-ND1 3Å; C1168-C1226 WeakPolarHBondContact CB-SG 3.3Å; C1168-C1226 PolarHBondContact SG-SG 3.47Å
1169	G	82.3	Confident	84.3	Confident	33 Å²	33	52.9 Å²	52.9	34%	0.34	29%	0.294	S	S	.	.	S	Bend	trans	88.4	2.4	-178.6	0	0	0	0	0	115.5	F1166 P1167	F1166-G1169 PolarHBondContact O-N 3.39Å; P1167-G1169 VanDerWaalsContact C-N 3.33Å
1170	H	86.2	Confident	84.4	Confident	57 Å²	57	51.3 Å²	51.3	26%	0.264	28%	0.283	S	S	.	.			trans	-82.1	131.5	177.2	-67.3	127.8	0	0	0	111.3	F1166 C1168 F1172 C1223	F1166-H1170 PolarHBondContact N-O 2.84Å; F1166-H1170 VanDerWaalsContact N-O 3.1Å; C1168-H1170 PolarHBondContact SG-ND1 3Å; H1170-F1172 HydrophobicContact CB-CD2 4.49Å; H1170-F1172 HydrophobicContact CB-CE2 3.59Å; H1170-F1172 HydrophobicContact CB-CZ 4.04Å; H1170-C1223 PolarHBondContact ND1-SG 3.24Å
1171	N	88	Confident	84.3	Confident	29 Å²	29	45.8 Å²	45.8	16%	0.155	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.9	-175.3	-53.8	-49.5	0	0	0	110.9	T1152 L1158 Y1164 V1165	T1152-N1171 PolarHBondContact N-O 2.99Å; T1152-N1171 PolarHBondContact OG1-O 2.88Å; L1158-N1171 HydrophobicContact CD1-CB 3.47Å; L1158-N1171 VanDerWaalsContact CD1-CB 3.47Å; L1158-N1171 HydrophobicContact CD2-CB 3.86Å; L1158-N1171 HydrophobicContact CG-CB 4.31Å; Y1164-N1171 WeakPolarHBondContact O-CA 3.33Å; V1165-N1171 WeakPolarHBondContact CG1-OD1 3.34Å; V1165-N1171 WeakPolarHBondContact CG2-OD1 3.49Å
1172	F	88.6	Confident	84.1	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.009	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	143.3	-179.9	-56.1	-88.6	0	0	0	111.5	T1152 F1163 Y1164 F1166 H1170 L1177 L1180 L1225	T1152-F1172 HydrophobicContact CG2-CE1 4.43Å; F1163-F1172 CarbonylContact C-O 3.54Å; F1163-F1172 WeakPolarHBondContact CA-O 3.12Å; F1163-F1172 VanDerWaalsContact CB-O 3.28Å; F1163-F1172 WeakPolarHBondContact CB-O 3.43Å; Y1164-F1172 PolarHBondContact N-O 2.95Å; Y1164-F1172 PolarHBondContact O-N 3.04Å; F1166-F1172 AromaticContact CD2-CD2 3.9Å; F1166-F1172 HydrophobicContact CD2-CD2 3.9Å; F1166-F1172 AromaticContact CD2-CE2 3.96Å; F1166-F1172 HydrophobicContact CD2-CE2 3.96Å; F1166-F1172 AromaticContact CE2-CD2 3.72Å; F1166-F1172 HydrophobicContact CE2-CD2 3.72Å; F1166-F1172 AromaticContact CE2-CE2 3.97Å; F1166-F1172 HydrophobicContact CE2-CE2 3.97Å; H1170-F1172 HydrophobicContact CB-CD2 4.49Å; H1170-F1172 HydrophobicContact CB-CE2 3.59Å; H1170-F1172 HydrophobicContact CB-CZ 4.04Å; F1172-L1177 HydrophobicContact CB-CB 3.93Å; F1172-L1177 HydrophobicContact CB-CD1 4.3Å; F1172-L1177 HydrophobicContact CD2-CD1 4Å; F1172-L1177 HydrophobicContact CE2-CD1 4.45Å; F1172-L1177 HydrophobicContact CG-CD1 4.06Å; F1172-L1180 HydrophobicContact CD1-CD1 4.09Å; F1172-L1180 HydrophobicContact CE1-CD1 3.91Å; F1172-L1225 HydrophobicContact CE1-CD1 4.14Å; F1172-L1225 HydrophobicContact CE1-CG 4.5Å; F1172-L1225 HydrophobicContact CZ-CD1 3.63Å; F1172-L1225 HydrophobicContact CZ-CG 3.89Å
1173	H	89.2	Confident	83.7	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	145.9	161.6	-61.7	129.5	0	0	0	109.4	C1151 C1154 L1157 L1158 R1161 A1162 S1175 C1176 L1177	C1151-H1173 WeakPolarHBondContact CB-CE1 3.25Å; C1151-H1173 VanDerWaalsContact CB-ND1 3.28Å; C1151-H1173 WeakPolarHBondContact CB-ND1 3.45Å; C1151-H1173 PolarHBondContact SG-N 3.01Å; C1154-H1173 PolarHBondContact SG-CE1 2.73Å; C1154-H1173 PolarHBondContact SG-ND1 2.85Å; L1157-H1173 PolarHBondContact O-CE1 3.34Å; L1157-H1173 PolarHBondContact O-NE2 3.03Å; L1158-H1173 PolarHBondContact O-CD2 2.87Å; L1158-H1173 PolarHBondContact O-NE2 3.47Å; R1161-H1173 HydrophobicContact CB-CB 4.42Å; A1162-H1173 WeakPolarHBondContact O-CA 3.43Å; H1173-S1175 PolarHBondContact O-N 2.89Å; H1173-C1176 HydrophobicContact CB-CB 4.21Å; H1173-C1176 PolarHBondContact O-N 2.84Å; H1173-L1177 PolarHBondContact O-N 3.02Å
1174	I	85.3	Confident	83.2	Confident	43 Å²	43	46.7 Å²	46.7	22%	0.221	26%	0.257	C	S	.	.	H	α-helix	trans	-50.1	-46	176.1	-67	-172.5	0	0	0	110.9	A1162 Y1164 C1176 L1177 T1178 F1215	A1162-I1174 HydrophobicContact CB-CD1 3.41Å; A1162-I1174 VanDerWaalsContact CB-CD1 3.41Å; A1162-I1174 HydrophobicContact CB-CG1 3.91Å; A1162-I1174 PolarHBondContact O-N 2.67Å; Y1164-I1174 HydrophobicContact CD2-CG1 3.92Å; Y1164-I1174 HydrophobicContact CE2-CD1 4.1Å; Y1164-I1174 HydrophobicContact CE2-CG1 3.75Å; I1174-C1176 VanDerWaalsContact C-N 3.33Å; I1174-C1176 PolarHBondContact O-N 3.35Å; I1174-L1177 PolarHBondContact O-N 3.04Å; I1174-T1178 PolarHBondContact O-N 3.22Å; I1174-T1178 PolarHBondContact O-OG1 2.8Å; I1174-F1215 HydrophobicContact CG2-CE1 3.69Å; I1174-F1215 HydrophobicContact CG2-CE2 4.19Å; I1174-F1215 HydrophobicContact CG2-CZ 3.42Å; I1174-F1215 VanDerWaalsContact CG2-CZ 3.42Å
1175	S	83.7	Confident	82.5	Confident	47 Å²	47	45.6 Å²	45.6	33%	0.329	25%	0.254	S	S	.	.	H	α-helix	trans	-60.9	-40.6	178.2	60.3	0	0	0	0	113	H1173 E1179	H1173-S1175 PolarHBondContact O-N 2.89Å; S1175-E1179 WeakPolarHBondContact O-CG 3.21Å; S1175-E1179 PolarHBondContact O-N 2.95Å
1176	C	85.2	Confident	82	Confident	4 Å²	4	46.1 Å²	46.1	3%	0.027	26%	0.26	C	S	.	.	H	α-helix	trans	-74.6	-38.9	-178.2	-66.1	0	0	0	0	112	H1153 H1173 I1174 T1178 E1179 L1180	H1153-C1176 HydrophobicContact CB-CB 3.68Å; H1173-C1176 HydrophobicContact CB-CB 4.21Å; H1173-C1176 PolarHBondContact O-N 2.84Å; I1174-C1176 VanDerWaalsContact C-N 3.33Å; I1174-C1176 PolarHBondContact O-N 3.35Å; C1176-T1178 VanDerWaalsContact C-N 3.32Å; C1176-E1179 PolarHBondContact O-N 2.82Å; C1176-L1180 WeakPolarHBondContact O-CG 3.42Å; C1176-L1180 PolarHBondContact O-N 2.8Å; C1176-L1180 VanDerWaalsContact O-N 3.16Å
1177	L	85.6	Confident	81.6	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-40.4	174.3	-170.4	62.9	0	0	0	110.8	Y1164 F1166 F1172 H1173 I1174 E1179 L1180 V1181 I1219 V1224	Y1164-L1177 HydrophobicContact CD2-CD2 3.75Å; Y1164-L1177 HydrophobicContact CG-CD2 4.2Å; F1166-L1177 HydrophobicContact CE2-CD1 4.03Å; F1166-L1177 HydrophobicContact CE2-CD2 3.95Å; F1166-L1177 HydrophobicContact CZ-CD1 4.23Å; F1166-L1177 HydrophobicContact CZ-CD2 3.91Å; F1172-L1177 HydrophobicContact CB-CB 3.93Å; F1172-L1177 HydrophobicContact CB-CD1 4.3Å; F1172-L1177 HydrophobicContact CD2-CD1 4Å; F1172-L1177 HydrophobicContact CE2-CD1 4.45Å; F1172-L1177 HydrophobicContact CG-CD1 4.06Å; H1173-L1177 PolarHBondContact O-N 3.02Å; I1174-L1177 PolarHBondContact O-N 3.04Å; L1177-E1179 VanDerWaalsContact C-N 3.35Å; L1177-E1179 PolarHBondContact O-N 3Å; L1177-L1180 PolarHBondContact O-N 2.79Å; L1177-V1181 HydrophobicContact CD1-CG2 4.28Å; L1177-V1181 HydrophobicContact CG-CG2 4.39Å; L1177-V1181 WeakPolarHBondContact O-CG2 3.48Å; L1177-V1181 PolarHBondContact O-N 2.88Å; L1177-I1219 HydrophobicContact CB-CG2 4.31Å; L1177-I1219 HydrophobicContact CD2-CG2 3.48Å; L1177-I1219 VanDerWaalsContact CD2-CG2 3.48Å; L1177-I1219 HydrophobicContact CG-CG2 3.51Å; L1177-V1224 HydrophobicContact CD1-CG2 3.72Å
1178	T	82.7	Confident	81.5	Confident	9 Å²	9	51 Å²	51	6%	0.055	29%	0.287	C	S	.	.	H	α-helix	trans	-58.7	-44.7	174.9	-47.8	0	0	0	0	112.2	I1174 C1176 L1180 K1182 L1193 L1197 F1215 I1219	I1174-T1178 PolarHBondContact O-N 3.22Å; I1174-T1178 PolarHBondContact O-OG1 2.8Å; C1176-T1178 VanDerWaalsContact C-N 3.32Å; T1178-L1180 VanDerWaalsContact C-N 3.29Å; T1178-L1180 PolarHBondContact O-N 2.92Å; T1178-K1182 HydrophobicContact CG2-CD 4.47Å; T1178-K1182 VanDerWaalsContact O-CG 3.28Å; T1178-K1182 WeakPolarHBondContact O-CG 3.33Å; T1178-K1182 PolarHBondContact O-N 3.19Å; T1178-L1193 HydrophobicContact CG2-CD2 4.25Å; T1178-L1197 HydrophobicContact CG2-CD1 4.42Å; T1178-F1215 VanDerWaalsContact OG1-CZ 3.31Å; T1178-F1215 WeakPolarHBondContact OG1-CZ 3.45Å; T1178-I1219 HydrophobicContact CG2-CD1 4.28Å
1179	E	81.7	Confident	81.1	Confident	118 Å²	118	51.5 Å²	51.5	55%	0.551	28%	0.284	S	S	*	.	H	α-helix	trans	-64.2	-35.9	179.2	-77.1	174.9	174.1	0	0	112	H1153 S1175 C1176 L1177	H1153-E1179 IonicContact CE1-OE2 3.09Å; H1153-E1179 PolarHBondContact CE1-OE2 2.95Å; S1175-E1179 WeakPolarHBondContact O-CG 3.21Å; S1175-E1179 PolarHBondContact O-N 2.95Å; C1176-E1179 PolarHBondContact O-N 2.82Å; L1177-E1179 VanDerWaalsContact C-N 3.35Å; L1177-E1179 PolarHBondContact O-N 3Å
1180	L	82.1	Confident	80.8	Confident	46 Å²	46	52.4 Å²	52.4	24%	0.241	28%	0.281	C	S	.	.	H	α-helix	trans	-75.6	-35	179.1	-74.5	172.3	0	0	0	113.8	H1153 F1172 C1176 L1177 T1178 P1183 Y1184 V1224	H1153-L1180 HydrophobicContact CB-CD1 4.07Å; F1172-L1180 HydrophobicContact CD1-CD1 4.09Å; F1172-L1180 HydrophobicContact CE1-CD1 3.91Å; C1176-L1180 WeakPolarHBondContact O-CG 3.42Å; C1176-L1180 PolarHBondContact O-N 2.8Å; C1176-L1180 VanDerWaalsContact O-N 3.16Å; L1177-L1180 PolarHBondContact O-N 2.79Å; T1178-L1180 VanDerWaalsContact C-N 3.29Å; T1178-L1180 PolarHBondContact O-N 2.92Å; L1180-P1183 WeakPolarHBondContact O-CD 3.37Å; L1180-Y1184 WeakPolarHBondContact O-CD2 3.19Å; L1180-Y1184 WeakPolarHBondContact O-CE2 3.33Å; L1180-V1224 HydrophobicContact CB-CG1 4.31Å
1181	V	82.2	Confident	80.3	Confident	1 Å²	1	52 Å²	52	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-83.4	-31.4	-176.1	176.2	0	0	0	0	112.5	L1177 P1183 Y1184 L1185 I1219 V1224	L1177-V1181 HydrophobicContact CD1-CG2 4.28Å; L1177-V1181 HydrophobicContact CG-CG2 4.39Å; L1177-V1181 WeakPolarHBondContact O-CG2 3.48Å; L1177-V1181 PolarHBondContact O-N 2.88Å; V1181-P1183 VanDerWaalsContact C-N 3.33Å; V1181-P1183 WeakPolarHBondContact O-CD 3.27Å; V1181-P1183 VanDerWaalsContact O-N 3.08Å; V1181-Y1184 PolarHBondContact O-N 3.44Å; V1181-L1185 HydrophobicContact CG1-CD1 3.99Å; V1181-L1185 HydrophobicContact CG1-CD2 3.67Å; V1181-L1185 HydrophobicContact CG1-CG 3.72Å; V1181-I1219 HydrophobicContact CG1-CG1 4.31Å; V1181-I1219 HydrophobicContact CG2-CG2 4.26Å; V1181-V1224 HydrophobicContact CG2-CG2 3.33Å
1182	K	77.7	Confident	79.7	Confident	97 Å²	97	55.5 Å²	55.5	42%	0.422	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-43.6	-42.9	-177.4	-93.6	174.3	176.4	177.5	0	116.3	T1178 Y1184 N1190 L1193	T1178-K1182 HydrophobicContact CG2-CD 4.47Å; T1178-K1182 VanDerWaalsContact O-CG 3.28Å; T1178-K1182 WeakPolarHBondContact O-CG 3.33Å; T1178-K1182 PolarHBondContact O-N 3.19Å; K1182-Y1184 PolarHBondContact O-N 3.45Å; K1182-N1190 PolarHBondContact O-ND2 3.14Å; K1182-L1193 HydrophobicContact CG-CD2 4.49Å
1183	P	75.9	Confident	79	Confident	97 Å²	97	55.5 Å²	55.5	63%	0.63	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-67.4	-20.2	-179.4	-20.3	33.5	0	0	0	114.8	L1180 V1181	L1180-P1183 WeakPolarHBondContact O-CD 3.37Å; V1181-P1183 VanDerWaalsContact C-N 3.33Å; V1181-P1183 WeakPolarHBondContact O-CD 3.27Å; V1181-P1183 VanDerWaalsContact O-N 3.08Å
1184	Y	74.3	Confident	78.2	Confident	109 Å²	109	57.9 Å²	57.9	43%	0.427	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-104.1	-7.6	-171.6	-53.7	-67	0	0	0	113.6	L1180 V1181 K1182 I1229 N1233	L1180-Y1184 WeakPolarHBondContact O-CD2 3.19Å; L1180-Y1184 WeakPolarHBondContact O-CE2 3.33Å; V1181-Y1184 PolarHBondContact O-N 3.44Å; K1182-Y1184 PolarHBondContact O-N 3.45Å; Y1184-I1229 HydrophobicContact CD1-CG2 4.43Å; Y1184-I1229 HydrophobicContact CD2-CG2 3.74Å; Y1184-I1229 HydrophobicContact CE2-CG2 4.22Å; Y1184-I1229 HydrophobicContact CG-CG2 3.84Å; Y1184-N1233 WeakPolarHBondContact CD1-ND2 3.2Å; Y1184-N1233 HydrophobicContact CE1-CB 4.33Å; Y1184-N1233 WeakPolarHBondContact CE1-ND2 3.37Å; Y1184-N1233 WeakPolarHBondContact CE1-OD1 3.31Å
1185	L	72.6	Confident	77.7	Confident	21 Å²	21	62.2 Å²	62.2	11%	0.11	33%	0.332	C	S	.	.	S	Bend	trans	-77.2	137.5	179.2	-66.2	175.9	0	0	0	111.4	V1181 E1189 N1190 L1193 I1218	V1181-L1185 HydrophobicContact CG1-CD1 3.99Å; V1181-L1185 HydrophobicContact CG1-CD2 3.67Å; V1181-L1185 HydrophobicContact CG1-CG 3.72Å; L1185-E1189 HydrophobicContact CB-CB 4.06Å; L1185-E1189 HydrophobicContact CD2-CB 4.06Å; L1185-N1190 HydrophobicContact CB-CB 4.49Å; L1185-N1190 WeakPolarHBondContact CB-ND2 2.98Å; L1185-N1190 PolarHBondContact O-ND2 2.83Å; L1185-N1190 VanDerWaalsContact O-ND2 3.07Å; L1185-L1193 HydrophobicContact CD1-CD2 3.68Å; L1185-I1218 HydrophobicContact CD1-CG2 4.02Å; L1185-I1218 HydrophobicContact CD2-CG2 3.45Å; L1185-I1218 VanDerWaalsContact CD2-CG2 3.45Å; L1185-I1218 HydrophobicContact CG-CG2 4.39Å
1186	S	74.6	Confident	76.9	Confident	53 Å²	53	60.2 Å²	60.2	37%	0.371	32%	0.318	S	S	.	.			trans	-58.5	160.1	169.5	67.3	0	0	0	0	111.4	E1188 E1189 N1190	S1186-E1188 PolarHBondContact O-N 2.9Å; S1186-E1189 VanDerWaalsContact CB-OE2 3.27Å; S1186-E1189 WeakPolarHBondContact CB-OE2 3.42Å; S1186-E1189 PolarHBondContact N-OE2 3.39Å; S1186-E1189 PolarHBondContact O-N 3.16Å; S1186-E1189 VanDerWaalsContact O-N 3.16Å; S1186-E1189 WeakPolarHBondContact OG-CB 3.08Å; S1186-E1189 WeakPolarHBondContact OG-CG 3.48Å; S1186-E1189 PolarHBondContact OG-N 3.43Å; S1186-E1189 PolarHBondContact OG-OE2 2.79Å; S1186-N1190 WeakPolarHBondContact O-CB 3.22Å; S1186-N1190 PolarHBondContact O-N 3.41Å
1187	A	75.5	Confident	76.1	Confident	92 Å²	92	62.7 Å²	62.7	76%	0.76	33%	0.331	S	S	*	.	H	α-helix	trans	-58.9	-31.4	178.6	0	0	0	0	0	112.6	S1191	A1187-S1191 WeakPolarHBondContact O-CB 3.3Å; A1187-S1191 PolarHBondContact O-N 2.85Å
1188	E	74.7	Confident	75.2	Confident	149 Å²	149	69.1 Å²	69.1	70%	0.696	36%	0.361	S	S	*	.	H	α-helix	trans	-70.5	-45.6	174.5	-78.4	-166.4	148.2	0	0	112.4	S1186 S1191 K1192	S1186-E1188 PolarHBondContact O-N 2.9Å; E1188-S1191 WeakPolarHBondContact O-CB 3.43Å; E1188-S1191 PolarHBondContact O-N 2.83Å; E1188-K1192 WeakPolarHBondContact O-CG 3.27Å; E1188-K1192 PolarHBondContact O-N 2.91Å
1189	E	74.4	Confident	74.2	Confident	73 Å²	73	70.7 Å²	70.7	34%	0.341	37%	0.373	S	S	.	.	H	α-helix	trans	-66.3	-41.4	179.6	-69.9	161.2	148.7	0	0	111.7	L1185 S1186 S1191 K1192 L1193 I1218	L1185-E1189 HydrophobicContact CB-CB 4.06Å; L1185-E1189 HydrophobicContact CD2-CB 4.06Å; S1186-E1189 VanDerWaalsContact CB-OE2 3.27Å; S1186-E1189 WeakPolarHBondContact CB-OE2 3.42Å; S1186-E1189 PolarHBondContact N-OE2 3.39Å; S1186-E1189 PolarHBondContact O-N 3.16Å; S1186-E1189 VanDerWaalsContact O-N 3.16Å; S1186-E1189 WeakPolarHBondContact OG-CB 3.08Å; S1186-E1189 WeakPolarHBondContact OG-CG 3.48Å; S1186-E1189 PolarHBondContact OG-N 3.43Å; S1186-E1189 PolarHBondContact OG-OE2 2.79Å; E1189-S1191 VanDerWaalsContact C-N 3.26Å; E1189-S1191 PolarHBondContact O-N 3.42Å; E1189-K1192 PolarHBondContact O-N 2.94Å; E1189-L1193 WeakPolarHBondContact O-CB 3.21Å; E1189-L1193 PolarHBondContact O-N 3.14Å; E1189-I1218 HydrophobicContact CB-CG2 4.22Å
1190	N	76.7	Confident	73.1	Confident	53 Å²	53	70.4 Å²	70.4	28%	0.283	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-33.8	173.1	-92.3	-41.5	0	0	0	112.3	K1182 L1185 S1186 S1194	K1182-N1190 PolarHBondContact O-ND2 3.14Å; L1185-N1190 HydrophobicContact CB-CB 4.49Å; L1185-N1190 WeakPolarHBondContact CB-ND2 2.98Å; L1185-N1190 PolarHBondContact O-ND2 2.83Å; L1185-N1190 VanDerWaalsContact O-ND2 3.07Å; S1186-N1190 WeakPolarHBondContact O-CB 3.22Å; S1186-N1190 PolarHBondContact O-N 3.41Å; N1190-S1194 WeakPolarHBondContact O-CB 3.24Å; N1190-S1194 PolarHBondContact O-N 3.43Å; N1190-S1194 PolarHBondContact O-OG 3.23Å
1191	S	75.9	Confident	71.9	Confident	47 Å²	47	75.2 Å²	75.2	33%	0.329	40%	0.397	S	S	.	.	H	α-helix	trans	-70	-39.1	173.9	-176.9	0	0	0	0	112.1	A1187 E1188 E1189 S1194 K1195	A1187-S1191 WeakPolarHBondContact O-CB 3.3Å; A1187-S1191 PolarHBondContact O-N 2.85Å; E1188-S1191 WeakPolarHBondContact O-CB 3.43Å; E1188-S1191 PolarHBondContact O-N 2.83Å; E1189-S1191 VanDerWaalsContact C-N 3.26Å; E1189-S1191 PolarHBondContact O-N 3.42Å; S1191-S1194 WeakPolarHBondContact CA-OG 3.33Å; S1191-S1194 PolarHBondContact O-OG 3.5Å; S1191-S1194 VanDerWaalsContact O-OG 3.12Å; S1191-K1195 WeakPolarHBondContact O-CD 3.19Å; S1191-K1195 VanDerWaalsContact O-CG 3.24Å; S1191-K1195 WeakPolarHBondContact O-CG 3.46Å; S1191-K1195 PolarHBondContact O-N 3.05Å; S1191-K1195 PolarHBondContact OG-NZ 3Å
1192	K	74.9	Confident	70.6	Confident	104 Å²	104	81.2 Å²	81.2	45%	0.452	43%	0.429	S	S	.	.	H	α-helix	trans	-66.3	-45.1	174	-69.9	176.5	-177.5	176.7	0	111.3	E1188 E1189 K1195 A1196 I1218	E1188-K1192 WeakPolarHBondContact O-CG 3.27Å; E1188-K1192 PolarHBondContact O-N 2.91Å; E1189-K1192 PolarHBondContact O-N 2.94Å; K1192-K1195 PolarHBondContact O-N 2.98Å; K1192-A1196 PolarHBondContact O-N 3.49Å; K1192-I1218 HydrophobicContact CB-CD1 3.85Å; K1192-I1218 HydrophobicContact CD-CD1 4.28Å
1193	L	73.2	Confident	69.2	Low	2 Å²	2	80.2 Å²	80.2	1%	0.01	45%	0.446	C	S	.	.	H	α-helix	trans	-65.5	-42.9	-179.9	-177.3	66.8	0	0	0	112.7	T1178 K1182 L1185 E1189 A1196 L1197 F1215 I1219	T1178-L1193 HydrophobicContact CG2-CD2 4.25Å; K1182-L1193 HydrophobicContact CG-CD2 4.49Å; L1185-L1193 HydrophobicContact CD1-CD2 3.68Å; E1189-L1193 WeakPolarHBondContact O-CB 3.21Å; E1189-L1193 PolarHBondContact O-N 3.14Å; L1193-A1196 WeakPolarHBondContact O-CB 3.34Å; L1193-A1196 PolarHBondContact O-N 2.94Å; L1193-L1197 HydrophobicContact CD1-CD1 4.5Å; L1193-L1197 HydrophobicContact CG-CD1 4.09Å; L1193-L1197 WeakPolarHBondContact O-CG 3.41Å; L1193-L1197 PolarHBondContact O-N 2.81Å; L1193-F1215 HydrophobicContact CD1-CD2 4.1Å; L1193-F1215 HydrophobicContact CD1-CE2 3.97Å; L1193-I1219 HydrophobicContact CD1-CD1 3.32Å; L1193-I1219 HydrophobicContact CD1-CG1 4.25Å; L1193-I1219 HydrophobicContact CD2-CD1 3.83Å; L1193-I1219 HydrophobicContact CG-CD1 4.21Å
1194	S	74.3	Confident	68	Low	51 Å²	51	80.7 Å²	80.7	36%	0.357	44%	0.443	S	S	.	.	H	α-helix	trans	-64.6	-41.1	177.9	51.3	0	0	0	0	112	N1190 S1191 A1196 L1197 E1198	N1190-S1194 WeakPolarHBondContact O-CB 3.24Å; N1190-S1194 PolarHBondContact O-N 3.43Å; N1190-S1194 PolarHBondContact O-OG 3.23Å; S1191-S1194 WeakPolarHBondContact CA-OG 3.33Å; S1191-S1194 PolarHBondContact O-OG 3.5Å; S1191-S1194 VanDerWaalsContact O-OG 3.12Å; S1194-A1196 VanDerWaalsContact C-N 3.32Å; S1194-A1196 PolarHBondContact O-N 3.15Å; S1194-L1197 PolarHBondContact O-N 2.65Å; S1194-E1198 WeakPolarHBondContact O-CG 3.27Å; S1194-E1198 PolarHBondContact O-N 2.83Å
1195	K	73	Confident	67.1	Low	134 Å²	134	82.3 Å²	82.3	58%	0.583	46%	0.459	S	S	*	.	H	α-helix	trans	-62.4	-36.5	172.2	-70.8	170.1	-173.5	167.8	0	112.9	S1191 K1192 S1199	S1191-K1195 WeakPolarHBondContact O-CD 3.19Å; S1191-K1195 VanDerWaalsContact O-CG 3.24Å; S1191-K1195 WeakPolarHBondContact O-CG 3.46Å; S1191-K1195 PolarHBondContact O-N 3.05Å; S1191-K1195 PolarHBondContact OG-NZ 3Å; K1192-K1195 PolarHBondContact O-N 2.98Å; K1195-S1199 PolarHBondContact O-N 2.81Å; K1195-S1199 VanDerWaalsContact O-N 3.16Å; K1195-S1199 PolarHBondContact O-OG 3Å
1196	A	68.2	Low	66.3	Low	4 Å²	4	85.4 Å²	85.4	3%	0.033	48%	0.483	C	S	.	.	H	α-helix	trans	-68.2	-43.4	175.5	0	0	0	0	0	111.6	K1192 L1193 S1194 E1198 S1199 Q1200 F1211 I1214	K1192-A1196 PolarHBondContact O-N 3.49Å; L1193-A1196 WeakPolarHBondContact O-CB 3.34Å; L1193-A1196 PolarHBondContact O-N 2.94Å; S1194-A1196 VanDerWaalsContact C-N 3.32Å; S1194-A1196 PolarHBondContact O-N 3.15Å; A1196-E1198 PolarHBondContact O-N 2.84Å; A1196-S1199 WeakPolarHBondContact CA-OG 3.26Å; A1196-S1199 PolarHBondContact O-N 2.87Å; A1196-S1199 PolarHBondContact O-OG 3.14Å; A1196-Q1200 PolarHBondContact O-N 2.89Å; A1196-F1211 HydrophobicContact CB-CD2 3.76Å; A1196-F1211 HydrophobicContact CB-CE2 4.06Å; A1196-F1211 VanDerWaalsContact O-CD2 3.24Å; A1196-F1211 WeakPolarHBondContact O-CD2 3.36Å; A1196-I1214 HydrophobicContact CB-CG2 4.34Å
1197	L	68.4	Low	65.5	Low	57 Å²	57	84.3 Å²	84.3	30%	0.298	48%	0.475	S	S	.	.	H	α-helix	trans	-65.3	-35.5	175.6	-74.9	164.5	0	0	0	112.7	T1178 L1193 S1194 Q1200 F1211	T1178-L1197 HydrophobicContact CG2-CD1 4.42Å; L1193-L1197 HydrophobicContact CD1-CD1 4.5Å; L1193-L1197 HydrophobicContact CG-CD1 4.09Å; L1193-L1197 WeakPolarHBondContact O-CG 3.41Å; L1193-L1197 PolarHBondContact O-N 2.81Å; S1194-L1197 PolarHBondContact O-N 2.65Å; L1197-Q1200 PolarHBondContact O-N 3.26Å; L1197-F1211 HydrophobicContact CD2-CE2 4.3Å; L1197-F1211 HydrophobicContact CD2-CZ 4.39Å
1198	E	66.4	Low	64.6	Low	135 Å²	135	83.7 Å²	83.7	63%	0.631	46%	0.458	S	S	*	.	H	α-helix	trans	-67.5	-35.2	174.8	-76.1	177.1	-178.2	0	0	112.5	S1194 A1196 Q1200 N1201	S1194-E1198 WeakPolarHBondContact O-CG 3.27Å; S1194-E1198 PolarHBondContact O-N 2.83Å; A1196-E1198 PolarHBondContact O-N 2.84Å; E1198-Q1200 VanDerWaalsContact C-N 3.34Å; E1198-Q1200 PolarHBondContact O-N 2.8Å; E1198-N1201 PolarHBondContact O-N 2.88Å
1199	S	62.5	Low	64	Low	42 Å²	42	79.4 Å²	79.4	29%	0.294	44%	0.444	S	S	.	.	H	α-helix	trans	-77.4	-15.5	179.4	41.6	0	0	0	0	114	K1195 A1196 N1201 L1202	K1195-S1199 PolarHBondContact O-N 2.81Å; K1195-S1199 VanDerWaalsContact O-N 3.16Å; K1195-S1199 PolarHBondContact O-OG 3Å; A1196-S1199 WeakPolarHBondContact CA-OG 3.26Å; A1196-S1199 PolarHBondContact O-N 2.87Å; A1196-S1199 PolarHBondContact O-OG 3.14Å; S1199-N1201 VanDerWaalsContact C-N 3.34Å; S1199-L1202 PolarHBondContact O-N 2.82Å
1200	Q	57.3	Low	63.5	Low	111 Å²	111	80.7 Å²	80.7	52%	0.519	45%	0.454	S	S	.	.	H	α-helix	trans	-68.9	-29	169.7	-110.9	-158.8	5.1	0	0	113.4	A1196 L1197 E1198 L1202 F1211	A1196-Q1200 PolarHBondContact O-N 2.89Å; L1197-Q1200 PolarHBondContact O-N 3.26Å; E1198-Q1200 VanDerWaalsContact C-N 3.34Å; E1198-Q1200 PolarHBondContact O-N 2.8Å; Q1200-L1202 PolarHBondContact O-N 2.97Å; Q1200-F1211 HydrophobicContact CG-CD1 4.35Å; Q1200-F1211 HydrophobicContact CG-CD2 3.94Å; Q1200-F1211 HydrophobicContact CG-CE1 4.37Å; Q1200-F1211 HydrophobicContact CG-CE2 3.96Å; Q1200-F1211 HydrophobicContact CG-CG 4.15Å; Q1200-F1211 HydrophobicContact CG-CZ 4.17Å
1201	N	56.8	Low	63	Low	148 Å²	148	78.7 Å²	78.7	79%	0.791	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-10.9	179.5	-76.7	-39.7	0	0	0	113.4	E1198 S1199	E1198-N1201 PolarHBondContact O-N 2.88Å; S1199-N1201 VanDerWaalsContact C-N 3.34Å
1202	L	54.7	Low	62.7	Low	127 Å²	127	81.6 Å²	81.6	67%	0.665	45%	0.451	S	S	*	.	S	Bend	trans	-108.4	88.7	176.8	-72.6	128.4	0	0	0	108.7	S1199 Q1200 N1204	S1199-L1202 PolarHBondContact O-N 2.82Å; Q1200-L1202 PolarHBondContact O-N 2.97Å; L1202-N1204 VanDerWaalsContact C-N 3.28Å; L1202-N1204 PolarHBondContact O-N 2.9Å
1203	G	49	Very low	62.6	Low	76 Å²	76	81.7 Å²	81.7	78%	0.784	46%	0.456	S	S	*	.			trans	-60.2	65.9	-168.7	0	0	0	0	0	118
1204	N	50.8	Low	62.5	Low	107 Å²	107	84.1 Å²	84.1	57%	0.572	47%	0.469	S	S	*	.			trans	-101.2	127.6	168.6	-85.1	-18.7	0	0	0	110.5	L1202 S1206 S1207	L1202-N1204 VanDerWaalsContact C-N 3.28Å; L1202-N1204 PolarHBondContact O-N 2.9Å; N1204-S1206 PolarHBondContact O-N 2.81Å; N1204-S1206 VanDerWaalsContact O-N 3.1Å; N1204-S1207 PolarHBondContact O-N 3.1Å; N1204-S1207 PolarHBondContact O-OG 3.28Å
1205	N	54.9	Low	62.5	Low	143 Å²	143	81.8 Å²	81.8	77%	0.765	45%	0.452	S	S	*	.	H	α-helix	trans	-61.5	-22.4	-178.4	-71.2	-14.4	0	0	0	114
1206	S	57.2	Low	62.7	Low	86 Å²	86	79 Å²	79	60%	0.601	44%	0.443	S	S	*	.	H	α-helix	trans	-79.9	-20.8	176.9	57.3	0	0	0	0	113.9	N1204 I1208 S1209	N1204-S1206 PolarHBondContact O-N 2.81Å; N1204-S1206 VanDerWaalsContact O-N 3.1Å; S1206-I1208 VanDerWaalsContact C-N 3.34Å; S1206-S1209 PolarHBondContact O-OG 3.08Å
1207	S	56.5	Low	63.2	Low	30 Å²	30	84.6 Å²	84.6	21%	0.21	47%	0.469	C	S	.	.	H	α-helix	trans	-83.4	-13.4	174.8	38	0	0	0	0	112.6	N1204 F1211	N1204-S1207 PolarHBondContact O-N 3.1Å; N1204-S1207 PolarHBondContact O-OG 3.28Å; S1207-F1211 VanDerWaalsContact O-CB 3.27Å; S1207-F1211 WeakPolarHBondContact O-CB 3.02Å; S1207-F1211 PolarHBondContact O-N 3.11Å; S1207-F1211 VanDerWaalsContact O-N 3.12Å
1208	I	57.8	Low	63.4	Low	78 Å²	78	82.7 Å²	82.7	40%	0.4	46%	0.459	S	S	.	.	H	α-helix	trans	-73.6	-43.3	178.6	-61.5	174	0	0	0	111.2	S1206 F1211 E1212	S1206-I1208 VanDerWaalsContact C-N 3.34Å; I1208-F1211 WeakPolarHBondContact O-CB 3.48Å; I1208-F1211 PolarHBondContact O-N 2.97Å; I1208-E1212 PolarHBondContact O-N 3.46Å
1209	S	61.1	Low	63.8	Low	59 Å²	59	76.4 Å²	76.4	41%	0.413	43%	0.43	S	S	.	.	H	α-helix	trans	-66.1	-43.1	178.3	52.4	0	0	0	0	112.3	S1206 F1211 E1212 D1213	S1206-S1209 PolarHBondContact O-OG 3.08Å; S1209-F1211 PolarHBondContact O-N 2.89Å; S1209-E1212 PolarHBondContact O-N 2.85Å; S1209-D1213 PolarHBondContact O-N 3.09Å; S1209-D1213 VanDerWaalsContact O-N 3.13Å
1210	N	64.5	Low	64.3	Low	101 Å²	101	75.4 Å²	75.4	54%	0.54	42%	0.424	S	S	.	.	H	α-helix	trans	-65	-29.1	174.6	-76	8.2	0	0	0	112.2	I1214	N1210-I1214 VanDerWaalsContact O-CD1 3.26Å; N1210-I1214 WeakPolarHBondContact O-CD1 3.25Å; N1210-I1214 WeakPolarHBondContact O-CG1 3.41Å; N1210-I1214 PolarHBondContact O-N 2.84Å
1211	F	65.8	Low	65.2	Low	11 Å²	11	76.4 Å²	76.4	5%	0.048	43%	0.433	C	S	.	.	H	α-helix	trans	-68.9	-46.4	175.9	176.8	-89.3	0	0	0	110.8	A1196 L1197 Q1200 S1207 I1208 S1209 I1214 F1215	A1196-F1211 HydrophobicContact CB-CD2 3.76Å; A1196-F1211 HydrophobicContact CB-CE2 4.06Å; A1196-F1211 VanDerWaalsContact O-CD2 3.24Å; A1196-F1211 WeakPolarHBondContact O-CD2 3.36Å; L1197-F1211 HydrophobicContact CD2-CE2 4.3Å; L1197-F1211 HydrophobicContact CD2-CZ 4.39Å; Q1200-F1211 HydrophobicContact CG-CD1 4.35Å; Q1200-F1211 HydrophobicContact CG-CD2 3.94Å; Q1200-F1211 HydrophobicContact CG-CE1 4.37Å; Q1200-F1211 HydrophobicContact CG-CE2 3.96Å; Q1200-F1211 HydrophobicContact CG-CG 4.15Å; Q1200-F1211 HydrophobicContact CG-CZ 4.17Å; S1207-F1211 VanDerWaalsContact O-CB 3.27Å; S1207-F1211 WeakPolarHBondContact O-CB 3.02Å; S1207-F1211 PolarHBondContact O-N 3.11Å; S1207-F1211 VanDerWaalsContact O-N 3.12Å; I1208-F1211 WeakPolarHBondContact O-CB 3.48Å; I1208-F1211 PolarHBondContact O-N 2.97Å; S1209-F1211 PolarHBondContact O-N 2.89Å; F1211-I1214 PolarHBondContact O-N 3.47Å; F1211-F1215 AromaticContact CE1-CD2 3.69Å; F1211-F1215 HydrophobicContact CE1-CD2 3.69Å; F1211-F1215 HydrophobicContact CE1-CE2 4.14Å; F1211-F1215 HydrophobicContact CE1-CG 4.3Å; F1211-F1215 HydrophobicContact CE2-CD2 4.05Å; F1211-F1215 HydrophobicContact CE2-CE2 4.35Å; F1211-F1215 AromaticContact CZ-CD2 3.42Å; F1211-F1215 HydrophobicContact CZ-CD2 3.42Å; F1211-F1215 VanDerWaalsContact CZ-CD2 3.42Å; F1211-F1215 AromaticContact CZ-CE2 3.59Å; F1211-F1215 HydrophobicContact CZ-CE2 3.59Å; F1211-F1215 HydrophobicContact CZ-CG 4.43Å; F1211-F1215 VanDerWaalsContact O-CB 3.3Å; F1211-F1215 WeakPolarHBondContact O-CB 3.36Å; F1211-F1215 PolarHBondContact O-N 3.07Å
1212	E	70.2	Confident	66.2	Low	108 Å²	108	72.3 Å²	72.3	51%	0.505	41%	0.411	S	S	.	.	H	α-helix	trans	-59.3	-47.3	178	-71.2	174.9	171	0	0	111.4	I1208 S1209 I1214 F1215 D1216	I1208-E1212 PolarHBondContact O-N 3.46Å; S1209-E1212 PolarHBondContact O-N 2.85Å; E1212-I1214 PolarHBondContact O-N 2.71Å; E1212-F1215 PolarHBondContact O-N 3.15Å; E1212-F1215 VanDerWaalsContact O-N 3.16Å; E1212-D1216 WeakPolarHBondContact O-CB 3.5Å; E1212-D1216 PolarHBondContact O-N 3.07Å
1213	D	72.5	Confident	67.6	Low	105 Å²	105	66.4 Å²	66.4	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-60.5	-43.8	179.3	-67.2	-28.3	0	0	0	112.8	S1209 F1215 D1216 E1217	S1209-D1213 PolarHBondContact O-N 3.09Å; S1209-D1213 VanDerWaalsContact O-N 3.13Å; D1213-F1215 VanDerWaalsContact C-N 3.33Å; D1213-D1216 PolarHBondContact O-N 2.7Å; D1213-E1217 WeakPolarHBondContact O-CB 3.15Å; D1213-E1217 PolarHBondContact O-N 3.16Å
1214	I	71	Confident	69	Low	53 Å²	53	63.5 Å²	63.5	27%	0.272	35%	0.347	S	S	.	.	H	α-helix	trans	-69.2	-35.4	178.7	-66	167.6	0	0	0	110.7	A1196 N1210 F1211 E1212 I1218	A1196-I1214 HydrophobicContact CB-CG2 4.34Å; N1210-I1214 VanDerWaalsContact O-CD1 3.26Å; N1210-I1214 WeakPolarHBondContact O-CD1 3.25Å; N1210-I1214 WeakPolarHBondContact O-CG1 3.41Å; N1210-I1214 PolarHBondContact O-N 2.84Å; F1211-I1214 PolarHBondContact O-N 3.47Å; E1212-I1214 PolarHBondContact O-N 2.71Å; I1214-I1218 HydrophobicContact CG2-CD1 3.71Å; I1214-I1218 HydrophobicContact CG2-CG1 4.46Å; I1214-I1218 WeakPolarHBondContact O-CB 3.2Å; I1214-I1218 WeakPolarHBondContact O-CG1 3.34Å; I1214-I1218 PolarHBondContact O-N 3.43Å; I1214-I1218 VanDerWaalsContact O-N 3.1Å
1215	F	74.2	Confident	70.3	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.009	34%	0.342	C	S	.	.	H	α-helix	trans	-70.4	-37.4	178.2	-141.4	-86.1	0	0	0	111.5	Y1164 I1174 T1178 L1193 F1211 E1212 D1213 I1219 A1220	Y1164-F1215 AromaticContact CE2-CD1 3.69Å; Y1164-F1215 HydrophobicContact CE2-CD1 3.69Å; Y1164-F1215 AromaticContact CE2-CE1 3.82Å; Y1164-F1215 HydrophobicContact CE2-CE1 3.82Å; I1174-F1215 HydrophobicContact CG2-CE1 3.69Å; I1174-F1215 HydrophobicContact CG2-CE2 4.19Å; I1174-F1215 HydrophobicContact CG2-CZ 3.42Å; I1174-F1215 VanDerWaalsContact CG2-CZ 3.42Å; T1178-F1215 VanDerWaalsContact OG1-CZ 3.31Å; T1178-F1215 WeakPolarHBondContact OG1-CZ 3.45Å; L1193-F1215 HydrophobicContact CD1-CD2 4.1Å; L1193-F1215 HydrophobicContact CD1-CE2 3.97Å; F1211-F1215 AromaticContact CE1-CD2 3.69Å; F1211-F1215 HydrophobicContact CE1-CD2 3.69Å; F1211-F1215 HydrophobicContact CE1-CE2 4.14Å; F1211-F1215 HydrophobicContact CE1-CG 4.3Å; F1211-F1215 HydrophobicContact CE2-CD2 4.05Å; F1211-F1215 HydrophobicContact CE2-CE2 4.35Å; F1211-F1215 AromaticContact CZ-CD2 3.42Å; F1211-F1215 HydrophobicContact CZ-CD2 3.42Å; F1211-F1215 VanDerWaalsContact CZ-CD2 3.42Å; F1211-F1215 AromaticContact CZ-CE2 3.59Å; F1211-F1215 HydrophobicContact CZ-CE2 3.59Å; F1211-F1215 HydrophobicContact CZ-CG 4.43Å; F1211-F1215 VanDerWaalsContact O-CB 3.3Å; F1211-F1215 WeakPolarHBondContact O-CB 3.36Å; F1211-F1215 PolarHBondContact O-N 3.07Å; E1212-F1215 PolarHBondContact O-N 3.15Å; E1212-F1215 VanDerWaalsContact O-N 3.16Å; D1213-F1215 VanDerWaalsContact C-N 3.33Å; F1215-I1219 HydrophobicContact CD1-CB 3.73Å; F1215-I1219 HydrophobicContact CD1-CD1 3.97Å; F1215-I1219 HydrophobicContact CD1-CG1 4.36Å; F1215-I1219 HydrophobicContact CD1-CG2 3.98Å; F1215-I1219 HydrophobicContact CD2-CD1 3.97Å; F1215-I1219 HydrophobicContact CE1-CB 3.71Å; F1215-I1219 HydrophobicContact CE1-CD1 3.5Å; F1215-I1219 VanDerWaalsContact CE1-CD1 3.5Å; F1215-I1219 HydrophobicContact CE1-CG1 4.18Å; F1215-I1219 HydrophobicContact CE1-CG2 3.51Å; F1215-I1219 HydrophobicContact CE2-CD1 3.51Å; F1215-I1219 HydrophobicContact CG-CB 4.45Å; F1215-I1219 HydrophobicContact CG-CD1 4.2Å; F1215-I1219 HydrophobicContact CZ-CB 4.41Å; F1215-I1219 HydrophobicContact CZ-CD1 3.27Å; F1215-I1219 HydrophobicContact CZ-CG1 4.4Å; F1215-I1219 HydrophobicContact CZ-CG2 4.26Å; F1215-I1219 WeakPolarHBondContact O-CA 3.48Å; F1215-I1219 WeakPolarHBondContact O-CB 3.49Å; F1215-I1219 PolarHBondContact O-N 3.33Å; F1215-A1220 PolarHBondContact O-N 3.4Å
1216	D	76.3	Confident	71.6	Confident	75 Å²	75	58.8 Å²	58.8	40%	0.401	33%	0.326	S	S	.	.	H	α-helix	trans	-66.8	-40.1	175.2	-76.7	-17.6	0	0	0	111.6	Y1164 E1212 D1213 N1221	Y1164-D1216 WeakPolarHBondContact CE1-OD1 3.33Å; Y1164-D1216 PolarHBondContact OH-OD1 3.49Å; Y1164-D1216 VanDerWaalsContact OH-OD1 3.11Å; E1212-D1216 WeakPolarHBondContact O-CB 3.5Å; E1212-D1216 PolarHBondContact O-N 3.07Å; D1213-D1216 PolarHBondContact O-N 2.7Å; D1216-N1221 PolarHBondContact O-N 2.91Å
1217	E	78.9	Confident	72.6	Confident	122 Å²	122	54.9 Å²	54.9	57%	0.57	30%	0.299	S	S	*	.	H	α-helix	trans	-67.2	-40.5	177.8	-171.3	-175.4	176.3	0	0	112.9	D1213 N1221	D1213-E1217 WeakPolarHBondContact O-CB 3.15Å; D1213-E1217 PolarHBondContact O-N 3.16Å; E1217-N1221 WeakPolarHBondContact O-CB 3.18Å
1218	I	73.2	Confident	73.8	Confident	17 Å²	17	58.5 Å²	58.5	9%	0.087	31%	0.313	C	S	.	.	H	α-helix	trans	-98.9	-43.6	-169.9	-59.9	177.3	0	0	0	112.5	L1185 E1189 K1192 I1214	L1185-I1218 HydrophobicContact CD1-CG2 4.02Å; L1185-I1218 HydrophobicContact CD2-CG2 3.45Å; L1185-I1218 VanDerWaalsContact CD2-CG2 3.45Å; L1185-I1218 HydrophobicContact CG-CG2 4.39Å; E1189-I1218 HydrophobicContact CB-CG2 4.22Å; K1192-I1218 HydrophobicContact CB-CD1 3.85Å; K1192-I1218 HydrophobicContact CD-CD1 4.28Å; I1214-I1218 HydrophobicContact CG2-CD1 3.71Å; I1214-I1218 HydrophobicContact CG2-CG1 4.46Å; I1214-I1218 WeakPolarHBondContact O-CB 3.2Å; I1214-I1218 WeakPolarHBondContact O-CG1 3.34Å; I1214-I1218 PolarHBondContact O-N 3.43Å; I1214-I1218 VanDerWaalsContact O-N 3.1Å
1219	I	74.8	Confident	74.6	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.015	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-37.9	-169	-67.8	175.6	0	0	0	112.3	L1177 T1178 V1181 L1193 F1215	L1177-I1219 HydrophobicContact CB-CG2 4.31Å; L1177-I1219 HydrophobicContact CD2-CG2 3.48Å; L1177-I1219 VanDerWaalsContact CD2-CG2 3.48Å; L1177-I1219 HydrophobicContact CG-CG2 3.51Å; T1178-I1219 HydrophobicContact CG2-CD1 4.28Å; V1181-I1219 HydrophobicContact CG1-CG1 4.31Å; V1181-I1219 HydrophobicContact CG2-CG2 4.26Å; L1193-I1219 HydrophobicContact CD1-CD1 3.32Å; L1193-I1219 HydrophobicContact CD1-CG1 4.25Å; L1193-I1219 HydrophobicContact CD2-CD1 3.83Å; L1193-I1219 HydrophobicContact CG-CD1 4.21Å; F1215-I1219 HydrophobicContact CD1-CB 3.73Å; F1215-I1219 HydrophobicContact CD1-CD1 3.97Å; F1215-I1219 HydrophobicContact CD1-CG1 4.36Å; F1215-I1219 HydrophobicContact CD1-CG2 3.98Å; F1215-I1219 HydrophobicContact CD2-CD1 3.97Å; F1215-I1219 HydrophobicContact CE1-CB 3.71Å; F1215-I1219 HydrophobicContact CE1-CD1 3.5Å; F1215-I1219 VanDerWaalsContact CE1-CD1 3.5Å; F1215-I1219 HydrophobicContact CE1-CG1 4.18Å; F1215-I1219 HydrophobicContact CE1-CG2 3.51Å; F1215-I1219 HydrophobicContact CE2-CD1 3.51Å; F1215-I1219 HydrophobicContact CG-CB 4.45Å; F1215-I1219 HydrophobicContact CG-CD1 4.2Å; F1215-I1219 HydrophobicContact CZ-CB 4.41Å; F1215-I1219 HydrophobicContact CZ-CD1 3.27Å; F1215-I1219 HydrophobicContact CZ-CG1 4.4Å; F1215-I1219 HydrophobicContact CZ-CG2 4.26Å; F1215-I1219 WeakPolarHBondContact O-CA 3.48Å; F1215-I1219 WeakPolarHBondContact O-CB 3.49Å; F1215-I1219 PolarHBondContact O-N 3.33Å
1220	A	73.7	Confident	75.2	Confident	22 Å²	22	54.9 Å²	54.9	18%	0.182	29%	0.293	C	S	.	.	S	Bend	trans	-91.9	0.7	-177.3	0	0	0	0	0	114.1	Y1164 F1166 F1215 D1222	Y1164-A1220 HydrophobicContact CD1-CB 3.86Å; Y1164-A1220 HydrophobicContact CE1-CB 3.61Å; Y1164-A1220 HydrophobicContact CG-CB 4.44Å; F1166-A1220 WeakPolarHBondContact CE1-O 3.43Å; F1215-A1220 PolarHBondContact O-N 3.4Å; A1220-D1222 VanDerWaalsContact C-N 3.31Å; A1220-D1222 PolarHBondContact O-N 2.81Å
1221	N	75.5	Confident	75.8	Confident	131 Å²	131	55.2 Å²	55.2	70%	0.701	29%	0.294	S	S	*	.	S	Bend	trans	-63.1	-36.2	-176	-158.3	12.5	0	0	0	112.6	D1216 E1217	D1216-N1221 PolarHBondContact O-N 2.91Å; E1217-N1221 WeakPolarHBondContact O-CB 3.18Å
1222	D	78	Confident	76.1	Confident	62 Å²	62	60.4 Å²	60.4	33%	0.332	32%	0.318	S	S	.	.	S	Bend	trans	-148	153.8	177.3	-150.5	-11.9	0	0	0	113.1	F1166 A1220 V1224 G1227 H1228	F1166-D1222 VanDerWaalsContact CE1-C 3.44Å; F1166-D1222 WeakPolarHBondContact CE1-O 3.44Å; A1220-D1222 VanDerWaalsContact C-N 3.31Å; A1220-D1222 PolarHBondContact O-N 2.81Å; D1222-V1224 PolarHBondContact O-N 2.92Å; D1222-G1227 WeakPolarHBondContact OD1-CA 3.11Å; D1222-G1227 VanDerWaalsContact OD2-CA 3.24Å; D1222-G1227 WeakPolarHBondContact OD2-CA 3.36Å; D1222-H1228 WeakPolarHBondContact OD2-CB 3.2Å; D1222-H1228 PolarHBondContact OD2-N 2.54Å
1223	C	83.3	Confident	76	Confident	3 Å²	3	56 Å²	56	2%	0.02	30%	0.298	C	S	.	.			trans	-74.6	124.8	-179.6	-175.7	0	0	0	0	110.8	F1166 H1170 L1225 C1226 G1227	F1166-C1223 HydrophobicContact CB-CB 4.22Å; F1166-C1223 HydrophobicContact CD1-CB 3.85Å; F1166-C1223 HydrophobicContact CD2-CB 4.32Å; F1166-C1223 HydrophobicContact CE1-CB 4.27Å; F1166-C1223 HydrophobicContact CG-CB 3.87Å; H1170-C1223 PolarHBondContact ND1-SG 3.24Å; C1223-L1225 PolarHBondContact O-N 2.89Å; C1223-L1225 VanDerWaalsContact O-N 3.08Å; C1223-C1226 PolarHBondContact O-N 2.89Å; C1223-G1227 VanDerWaalsContact O-CA 3.24Å; C1223-G1227 WeakPolarHBondContact O-CA 3.21Å; C1223-G1227 PolarHBondContact O-N 3.27Å
1224	V	78.5	Confident	75.8	Confident	15 Å²	15	55.5 Å²	55.5	9%	0.091	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24	-179.1	-172.6	0	0	0	0	113.7	L1177 L1180 V1181 D1222 I1229	L1177-V1224 HydrophobicContact CD1-CG2 3.72Å; L1180-V1224 HydrophobicContact CB-CG1 4.31Å; V1181-V1224 HydrophobicContact CG2-CG2 3.33Å; D1222-V1224 PolarHBondContact O-N 2.92Å; V1224-I1229 HydrophobicContact CG1-CG2 4.33Å
1225	L	79	Confident	75.6	Confident	86 Å²	86	55.2 Å²	55.2	45%	0.45	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-26.4	-177.3	-66.7	178.1	0	0	0	114.3	T1152 F1172 C1223 A1230	T1152-L1225 HydrophobicContact CG2-CD1 3.76Å; F1172-L1225 HydrophobicContact CE1-CD1 4.14Å; F1172-L1225 HydrophobicContact CE1-CG 4.5Å; F1172-L1225 HydrophobicContact CZ-CD1 3.63Å; F1172-L1225 HydrophobicContact CZ-CG 3.89Å; C1223-L1225 PolarHBondContact O-N 2.89Å; C1223-L1225 VanDerWaalsContact O-N 3.08Å; L1225-A1230 WeakPolarHBondContact O-CB 3.5Å
1226	C	81.9	Confident	75.1	Confident	65 Å²	65	59.2 Å²	59.2	44%	0.439	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.7	3.5	-174.6	66.1	0	0	0	0	114.9	C1168 C1223	C1168-C1226 WeakPolarHBondContact CB-SG 3.3Å; C1168-C1226 PolarHBondContact SG-SG 3.47Å; C1223-C1226 PolarHBondContact O-N 2.89Å
1227	G	78.7	Confident	74.3	Confident	4 Å²	4	62.2 Å²	62.2	4%	0.041	33%	0.33	C	S	.	.	S	Bend	trans	-89.5	-169.9	176.1	0	0	0	0	0	113.5	D1222 C1223 I1229 A1230 I1231	D1222-G1227 WeakPolarHBondContact OD1-CA 3.11Å; D1222-G1227 VanDerWaalsContact OD2-CA 3.24Å; D1222-G1227 WeakPolarHBondContact OD2-CA 3.36Å; C1223-G1227 VanDerWaalsContact O-CA 3.24Å; C1223-G1227 WeakPolarHBondContact O-CA 3.21Å; C1223-G1227 PolarHBondContact O-N 3.27Å; G1227-I1229 VanDerWaalsContact C-N 3.25Å; G1227-I1229 PolarHBondContact O-N 2.71Å; G1227-A1230 WeakPolarHBondContact O-CB 3.25Å; G1227-A1230 PolarHBondContact O-N 3.32Å; G1227-I1231 WeakPolarHBondContact O-CG1 3.46Å; G1227-I1231 PolarHBondContact O-N 3.31Å; G1227-I1231 VanDerWaalsContact O-N 3.13Å
1228	H	79.9	Confident	73.6	Confident	107 Å²	107	65.6 Å²	65.6	50%	0.495	34%	0.339	S	S	.	.	H	α-helix	trans	-53.1	-39.9	177.2	-159.4	-87	0	0	0	112.5	D1222 A1230 I1231 E1232	D1222-H1228 WeakPolarHBondContact OD2-CB 3.2Å; D1222-H1228 PolarHBondContact OD2-N 2.54Å; H1228-A1230 VanDerWaalsContact C-N 3.28Å; H1228-A1230 PolarHBondContact O-N 2.74Å; H1228-I1231 PolarHBondContact O-N 2.79Å; H1228-I1231 VanDerWaalsContact O-N 3.11Å; H1228-E1232 IonicContact CE1-OE1 2.75Å; H1228-E1232 PolarHBondContact CE1-OE1 3.37Å; H1228-E1232 IonicContact CE1-OE2 2.88Å; H1228-E1232 VanDerWaalsContact ND1-CD 3.35Å; H1228-E1232 IonicContact ND1-OE1 3.23Å; H1228-E1232 IonicContact ND1-OE2 3Å; H1228-E1232 PolarHBondContact O-N 3.34Å
1229	I	75.8	Confident	73.3	Confident	34 Å²	34	68.4 Å²	68.4	17%	0.174	35%	0.349	C	S	.	.	H	α-helix	trans	-60.2	-38.8	176.8	-60.7	174.2	0	0	0	111	Y1184 V1224 G1227 N1233	Y1184-I1229 HydrophobicContact CD1-CG2 4.43Å; Y1184-I1229 HydrophobicContact CD2-CG2 3.74Å; Y1184-I1229 HydrophobicContact CE2-CG2 4.22Å; Y1184-I1229 HydrophobicContact CG-CG2 3.84Å; V1224-I1229 HydrophobicContact CG1-CG2 4.33Å; G1227-I1229 VanDerWaalsContact C-N 3.25Å; G1227-I1229 PolarHBondContact O-N 2.71Å; I1229-N1233 WeakPolarHBondContact O-CB 3.46Å; I1229-N1233 PolarHBondContact O-N 2.86Å; I1229-N1233 PolarHBondContact O-ND2 3.34Å
1230	A	73.7	Confident	72.8	Confident	27 Å²	27	77.2 Å²	77.2	22%	0.223	39%	0.39	C	S	.	.	H	α-helix	trans	-69.6	-41.5	175.9	0	0	0	0	0	111.2	L1225 G1227 H1228 N1233 L1234	L1225-A1230 WeakPolarHBondContact O-CB 3.5Å; G1227-A1230 WeakPolarHBondContact O-CB 3.25Å; G1227-A1230 PolarHBondContact O-N 3.32Å; H1228-A1230 VanDerWaalsContact C-N 3.28Å; H1228-A1230 PolarHBondContact O-N 2.74Å; A1230-N1233 PolarHBondContact O-N 2.92Å; A1230-L1234 PolarHBondContact O-N 3.21Å
1231	I	77.7	Confident	72.5	Confident	107 Å²	107	80.5 Å²	80.5	55%	0.549	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-44.9	-178.2	-63.6	168.9	0	0	0	111.1	G1227 H1228 N1233 L1234	G1227-I1231 WeakPolarHBondContact O-CG1 3.46Å; G1227-I1231 PolarHBondContact O-N 3.31Å; G1227-I1231 VanDerWaalsContact O-N 3.13Å; H1228-I1231 PolarHBondContact O-N 2.79Å; H1228-I1231 VanDerWaalsContact O-N 3.11Å; I1231-N1233 VanDerWaalsContact C-N 3.31Å; I1231-N1233 PolarHBondContact O-N 2.85Å; I1231-L1234 PolarHBondContact O-N 3.36Å
1232	E	71.5	Confident	72.1	Confident	120 Å²	120	80.6 Å²	80.6	56%	0.561	40%	0.401	S	S	*	.	H	α-helix	trans	-68.2	-29.2	179	-75.2	-173.3	145.1	0	0	113.2	H1228	H1228-E1232 IonicContact CE1-OE1 2.75Å; H1228-E1232 PolarHBondContact CE1-OE1 3.37Å; H1228-E1232 IonicContact CE1-OE2 2.88Å; H1228-E1232 VanDerWaalsContact ND1-CD 3.35Å; H1228-E1232 IonicContact ND1-OE1 3.23Å; H1228-E1232 IonicContact ND1-OE2 3Å; H1228-E1232 PolarHBondContact O-N 3.34Å
1233	N	67	Low	71.9	Confident	16 Å²	16	83 Å²	83	9%	0.086	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	4.3	-177.4	-67.1	-61.3	0	0	0	114	Y1184 I1229 A1230 I1231 S1235 K1236 L1237	Y1184-N1233 WeakPolarHBondContact CD1-ND2 3.2Å; Y1184-N1233 HydrophobicContact CE1-CB 4.33Å; Y1184-N1233 WeakPolarHBondContact CE1-ND2 3.37Å; Y1184-N1233 WeakPolarHBondContact CE1-OD1 3.31Å; I1229-N1233 WeakPolarHBondContact O-CB 3.46Å; I1229-N1233 PolarHBondContact O-N 2.86Å; I1229-N1233 PolarHBondContact O-ND2 3.34Å; A1230-N1233 PolarHBondContact O-N 2.92Å; I1231-N1233 VanDerWaalsContact C-N 3.31Å; I1231-N1233 PolarHBondContact O-N 2.85Å; N1233-S1235 PolarHBondContact O-N 3.05Å; N1233-K1236 PolarHBondContact O-N 3.41Å; N1233-K1236 WeakPolarHBondContact OD1-CD 3.4Å; N1233-K1236 WeakPolarHBondContact OD1-CE 3.24Å; N1233-K1236 PolarHBondContact OD1-NZ 3.06Å; N1233-L1237 PolarHBondContact O-N 2.73Å
1234	L	69	Low	71.4	Confident	95 Å²	95	86 Å²	86	50%	0.497	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-35.4	173.7	-84.7	163.3	0	0	0	112.2	A1230 I1231 L1237 Y1238	A1230-L1234 PolarHBondContact O-N 3.21Å; I1231-L1234 PolarHBondContact O-N 3.36Å; L1234-L1237 HydrophobicContact CD2-CD1 4.38Å; L1234-Y1238 VanDerWaalsContact O-CD2 3.29Å; L1234-Y1238 WeakPolarHBondContact O-CD2 3.47Å; L1234-Y1238 WeakPolarHBondContact O-CE2 3.4Å
1235	S	66.8	Low	71.4	Confident	47 Å²	47	87.2 Å²	87.2	33%	0.329	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-30.9	178.5	60.3	0	0	0	0	113.2	N1233 Y1239 Y1245	N1233-S1235 PolarHBondContact O-N 3.05Å; S1235-Y1239 WeakPolarHBondContact O-CD2 3.36Å; S1235-Y1245 PolarHBondContact OG-OH 3.34Å
1236	K	63.6	Low	71.3	Confident	85 Å²	85	88 Å²	88	37%	0.37	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-76.2	-23.4	-179.4	-66.8	-176.9	-170.1	155.5	0	113.1	N1233 Y1238 Y1239 Y1245	N1233-K1236 PolarHBondContact O-N 3.41Å; N1233-K1236 WeakPolarHBondContact OD1-CD 3.4Å; N1233-K1236 WeakPolarHBondContact OD1-CE 3.24Å; N1233-K1236 PolarHBondContact OD1-NZ 3.06Å; K1236-Y1238 PolarHBondContact O-N 3.4Å; K1236-Y1238 VanDerWaalsContact O-N 3.16Å; K1236-Y1239 PolarHBondContact O-N 3.27Å; K1236-Y1245 HydrophobicContact CG-CD1 4.12Å; K1236-Y1245 HydrophobicContact CG-CD2 4.29Å; K1236-Y1245 HydrophobicContact CG-CE1 3.93Å; K1236-Y1245 HydrophobicContact CG-CE2 4.1Å; K1236-Y1245 HydrophobicContact CG-CG 4.29Å
1237	L	59.1	Low	71	Confident	139 Å²	139	89.1 Å²	89.1	73%	0.728	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-63.5	-17.3	179.4	-71.6	169.5	0	0	0	113.7	N1233 L1234	N1233-L1237 PolarHBondContact O-N 2.73Å; L1234-L1237 HydrophobicContact CD2-CD1 4.38Å
1238	Y	64.8	Low	70.9	Confident	192 Å²	192	92 Å²	92	75%	0.753	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-87.6	-3.5	-178.4	-64.6	-78.8	0	0	0	114.5	L1234 K1236	L1234-Y1238 VanDerWaalsContact O-CD2 3.29Å; L1234-Y1238 WeakPolarHBondContact O-CD2 3.47Å; L1234-Y1238 WeakPolarHBondContact O-CE2 3.4Å; K1236-Y1238 PolarHBondContact O-N 3.4Å; K1236-Y1238 VanDerWaalsContact O-N 3.16Å
1239	Y	66.8	Low	70.7	Confident	77 Å²	77	89.9 Å²	89.9	30%	0.302	44%	0.439	S	S	.	.			trans	-122.5	130.5	-173.9	-62.7	-88.6	0	0	0	111.2	S1235 K1236 N1241 D1244 Y1245 E1248	S1235-Y1239 WeakPolarHBondContact O-CD2 3.36Å; K1236-Y1239 PolarHBondContact O-N 3.27Å; Y1239-N1241 VanDerWaalsContact C-N 3.33Å; Y1239-N1241 PolarHBondContact O-N 3.02Å; Y1239-D1244 HydrophobicContact CD1-CB 4.06Å; Y1239-Y1245 AromaticContact CD2-CD2 3.51Å; Y1239-Y1245 HydrophobicContact CD2-CD2 3.51Å; Y1239-Y1245 HydrophobicContact CD2-CG 4.21Å; Y1239-Y1245 AromaticContact CE2-CD2 3.64Å; Y1239-Y1245 HydrophobicContact CE2-CD2 3.64Å; Y1239-Y1245 HydrophobicContact CE2-CE2 4.37Å; Y1239-Y1245 HydrophobicContact CG-CD2 4.27Å; Y1239-E1248 HydrophobicContact CE1-CB 3.73Å; Y1239-E1248 HydrophobicContact CE1-CG 3.69Å; Y1239-E1248 WeakPolarHBondContact OH-CB 3.38Å
1240	E	65.3	Low	70.7	Confident	188 Å²	188	91.7 Å²	91.7	88%	0.879	46%	0.455	S	S	*	.	S	Bend	trans	-67.2	-33.6	179.9	-74.6	-173.4	163.4	0	0	112.4
1241	N	65.9	Low	70.6	Confident	91 Å²	91	96.1 Å²	96.1	49%	0.487	47%	0.474	S	S	.	.	S	Bend	trans	-127.9	147	179.7	-53.4	-60.4	0	0	0	111	Y1239 I1243 D1244 Y1245	Y1239-N1241 VanDerWaalsContact C-N 3.33Å; Y1239-N1241 PolarHBondContact O-N 3.02Å; N1241-I1243 PolarHBondContact O-N 2.71Å; N1241-D1244 WeakPolarHBondContact CB-OD2 3.27Å; N1241-D1244 PolarHBondContact ND2-OD2 3.08Å; N1241-D1244 VanDerWaalsContact ND2-OD2 3.08Å; N1241-D1244 PolarHBondContact O-N 2.74Å; N1241-Y1245 PolarHBondContact O-N 3.31Å
1242	Q	68.4	Low	70.4	Confident	132 Å²	132	100.9 Å²	100.9	62%	0.617	49%	0.485	S	S	*	.	H	α-helix	trans	-59.3	-29.2	174.8	-177.3	155.1	-19.3	0	0	113	Y1245 E1246	Q1242-Y1245 PolarHBondContact O-N 3.41Å; Q1242-E1246 HydrophobicContact CG-CG 4.42Å; Q1242-E1246 WeakPolarHBondContact CG-OE1 3.32Å; Q1242-E1246 PolarHBondContact NE2-OE1 3.27Å; Q1242-E1246 VanDerWaalsContact NE2-OE1 3.11Å; Q1242-E1246 WeakPolarHBondContact O-CB 3.46Å; Q1242-E1246 WeakPolarHBondContact O-CG 3.35Å; Q1242-E1246 PolarHBondContact O-N 2.76Å
1243	I	72.5	Confident	69.8	Low	113 Å²	113	104.6 Å²	104.6	58%	0.579	50%	0.502	S	S	*	.	H	α-helix	trans	-64.8	-39.4	175.2	-66.2	157.5	0	0	0	111.4	N1241 E1246 N1247	N1241-I1243 PolarHBondContact O-N 2.71Å; I1243-E1246 PolarHBondContact O-N 2.81Å; I1243-N1247 WeakPolarHBondContact O-CB 3.45Å; I1243-N1247 VanDerWaalsContact O-CG 3.23Å; I1243-N1247 PolarHBondContact O-N 2.93Å; I1243-N1247 PolarHBondContact O-ND2 3.25Å
1244	D	74.4	Confident	70	Confident	65 Å²	65	109 Å²	109	35%	0.348	52%	0.523	S	S	.	.	H	α-helix	trans	-71.3	-36.9	-179.5	-61	-38.6	0	0	0	110.6	Y1239 N1241 E1248	Y1239-D1244 HydrophobicContact CD1-CB 4.06Å; N1241-D1244 WeakPolarHBondContact CB-OD2 3.27Å; N1241-D1244 PolarHBondContact ND2-OD2 3.08Å; N1241-D1244 VanDerWaalsContact ND2-OD2 3.08Å; N1241-D1244 PolarHBondContact O-N 2.74Å; D1244-E1248 PolarHBondContact O-N 2.68Å
1245	Y	77.1	Confident	70	Confident	42 Å²	42	109.7 Å²	109.7	17%	0.165	52%	0.524	C	S	.	.	H	α-helix	trans	-63.6	-47	171.3	176.6	-105.7	0	0	0	112.2	S1235 K1236 Y1239 N1241 Q1242 E1248 L1249	S1235-Y1245 PolarHBondContact OG-OH 3.34Å; K1236-Y1245 HydrophobicContact CG-CD1 4.12Å; K1236-Y1245 HydrophobicContact CG-CD2 4.29Å; K1236-Y1245 HydrophobicContact CG-CE1 3.93Å; K1236-Y1245 HydrophobicContact CG-CE2 4.1Å; K1236-Y1245 HydrophobicContact CG-CG 4.29Å; Y1239-Y1245 AromaticContact CD2-CD2 3.51Å; Y1239-Y1245 HydrophobicContact CD2-CD2 3.51Å; Y1239-Y1245 HydrophobicContact CD2-CG 4.21Å; Y1239-Y1245 AromaticContact CE2-CD2 3.64Å; Y1239-Y1245 HydrophobicContact CE2-CD2 3.64Å; Y1239-Y1245 HydrophobicContact CE2-CE2 4.37Å; Y1239-Y1245 HydrophobicContact CG-CD2 4.27Å; N1241-Y1245 PolarHBondContact O-N 3.31Å; Q1242-Y1245 PolarHBondContact O-N 3.41Å; Y1245-E1248 PolarHBondContact O-N 2.85Å; Y1245-L1249 HydrophobicContact CE1-CD2 4.46Å; Y1245-L1249 VanDerWaalsContact O-CB 3.3Å; Y1245-L1249 WeakPolarHBondContact O-CB 3.35Å; Y1245-L1249 PolarHBondContact O-N 3.46Å
1246	E	77.1	Confident	70.2	Confident	102 Å²	102	113.2 Å²	113.2	48%	0.477	54%	0.535	S	S	.	.	H	α-helix	trans	-65.5	-37.7	178.8	-75	174.3	-169.3	0	0	111.9	Q1242 I1243 L1249 S1250	Q1242-E1246 HydrophobicContact CG-CG 4.42Å; Q1242-E1246 WeakPolarHBondContact CG-OE1 3.32Å; Q1242-E1246 PolarHBondContact NE2-OE1 3.27Å; Q1242-E1246 VanDerWaalsContact NE2-OE1 3.11Å; Q1242-E1246 WeakPolarHBondContact O-CB 3.46Å; Q1242-E1246 WeakPolarHBondContact O-CG 3.35Å; Q1242-E1246 PolarHBondContact O-N 2.76Å; I1243-E1246 PolarHBondContact O-N 2.81Å; E1246-L1249 PolarHBondContact O-N 2.67Å; E1246-S1250 WeakPolarHBondContact O-CB 3.33Å; E1246-S1250 PolarHBondContact O-N 3.32Å
1247	N	76.8	Confident	70.6	Confident	88 Å²	88	114.9 Å²	114.9	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-62.8	-47.4	173.6	-78.1	-23.5	0	0	0	111.6	I1243 S1250 I1251	I1243-N1247 WeakPolarHBondContact O-CB 3.45Å; I1243-N1247 VanDerWaalsContact O-CG 3.23Å; I1243-N1247 PolarHBondContact O-N 2.93Å; I1243-N1247 PolarHBondContact O-ND2 3.25Å; N1247-S1250 PolarHBondContact O-N 3.08Å; N1247-S1250 PolarHBondContact O-OG 3.32Å; N1247-I1251 WeakPolarHBondContact O-CG1 3.32Å; N1247-I1251 PolarHBondContact O-N 2.79Å
1248	E	75	Confident	71.3	Confident	65 Å²	65	113.4 Å²	113.4	30%	0.304	53%	0.533	S	S	.	.	H	α-helix	trans	-66.3	-43.8	175.6	-94.1	-68.3	177.3	0	0	111.6	Y1239 D1244 Y1245 S1250 I1251 W1252	Y1239-E1248 HydrophobicContact CE1-CB 3.73Å; Y1239-E1248 HydrophobicContact CE1-CG 3.69Å; Y1239-E1248 WeakPolarHBondContact OH-CB 3.38Å; D1244-E1248 PolarHBondContact O-N 2.68Å; Y1245-E1248 PolarHBondContact O-N 2.85Å; E1248-S1250 PolarHBondContact O-N 3.24Å; E1248-S1250 VanDerWaalsContact O-N 3.13Å; E1248-I1251 CarbonylContact O-C 3.46Å; E1248-I1251 WeakPolarHBondContact O-CA 2.92Å; E1248-I1251 WeakPolarHBondContact O-CB 3.13Å; E1248-I1251 PolarHBondContact O-N 3.37Å; E1248-W1252 PolarHBondContact O-N 3.43Å; E1248-W1252 PolarHBondContact OE2-NE1 3.24Å
1249	L	76.1	Confident	71.7	Confident	63 Å²	63	108.1 Å²	108.1	33%	0.33	52%	0.519	S	S	.	.	H	α-helix	trans	-55.6	-36.3	176.1	-165	78.7	0	0	0	111.5	Y1245 E1246 I1251 W1252 Q1253	Y1245-L1249 HydrophobicContact CE1-CD2 4.46Å; Y1245-L1249 VanDerWaalsContact O-CB 3.3Å; Y1245-L1249 WeakPolarHBondContact O-CB 3.35Å; Y1245-L1249 PolarHBondContact O-N 3.46Å; E1246-L1249 PolarHBondContact O-N 2.67Å; L1249-I1251 VanDerWaalsContact C-N 3.29Å; L1249-I1251 PolarHBondContact O-N 3.14Å; L1249-W1252 PolarHBondContact O-N 3.01Å; L1249-Q1253 HydrophobicContact CG-CG 4.3Å; L1249-Q1253 WeakPolarHBondContact O-CB 3.05Å; L1249-Q1253 WeakPolarHBondContact O-CG 3.49Å; L1249-Q1253 PolarHBondContact O-N 2.97Å
1250	S	75.1	Confident	72.1	Confident	72 Å²	72	110.4 Å²	110.4	50%	0.503	53%	0.534	S	S	.	.	H	α-helix	trans	-71.5	-18.2	174.1	79.5	0	0	0	0	114.8	E1246 N1247 E1248	E1246-S1250 WeakPolarHBondContact O-CB 3.33Å; E1246-S1250 PolarHBondContact O-N 3.32Å; N1247-S1250 PolarHBondContact O-N 3.08Å; N1247-S1250 PolarHBondContact O-OG 3.32Å; E1248-S1250 PolarHBondContact O-N 3.24Å; E1248-S1250 VanDerWaalsContact O-N 3.13Å
1251	I	73.6	Confident	72.6	Confident	120 Å²	120	104.4 Å²	104.4	62%	0.615	51%	0.508	S	S	*	.	H	α-helix	trans	-84.3	-32.7	172.2	-64.7	165.4	0	0	0	110.1	N1247 E1248 L1249	N1247-I1251 WeakPolarHBondContact O-CG1 3.32Å; N1247-I1251 PolarHBondContact O-N 2.79Å; E1248-I1251 CarbonylContact O-C 3.46Å; E1248-I1251 WeakPolarHBondContact O-CA 2.92Å; E1248-I1251 WeakPolarHBondContact O-CB 3.13Å; E1248-I1251 PolarHBondContact O-N 3.37Å; L1249-I1251 VanDerWaalsContact C-N 3.29Å; L1249-I1251 PolarHBondContact O-N 3.14Å
1252	W	71.8	Confident	73.2	Confident	206 Å²	206	105.5 Å²	105.5	78%	0.78	51%	0.509	S	S	*	.	H	α-helix	trans	-86	-26.7	178.8	-68.7	96.4	0	0	0	114.5	E1248 L1249	E1248-W1252 PolarHBondContact O-N 3.43Å; E1248-W1252 PolarHBondContact OE2-NE1 3.24Å; L1249-W1252 PolarHBondContact O-N 3.01Å
1253	Q	60.3	Low	73.6	Confident	198 Å²	198	103.1 Å²	103.1	93%	0.925	50%	0.5	S	S	*	.			trans	-81.4	0	170.4	-73.8	-178.2	-11.2	0	0	111	L1249	L1249-Q1253 HydrophobicContact CG-CG 4.3Å; L1249-Q1253 WeakPolarHBondContact O-CB 3.05Å; L1249-Q1253 WeakPolarHBondContact O-CG 3.49Å; L1249-Q1253 PolarHBondContact O-N 2.97Å

Retrieved 1,253 of 1,253 residues in 2232.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).