A0A5K4EXT6_SCHMA Loading...

Putative voltage-gated potassium channel

AlphaFold DB , UniProt , Accession A0A5K4EXT6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,475 aa.

						>A0A5K4EXT6_SCHMA|A0A5K4EXT6
MSQHKGLSTPQNKFLETIVERSDALHANFVLGNAQRKYYPIVYCSDGFLLLTHYSRANVMSRSSICQFLWGSETTPTVRMEINQAFHNHYEYRNRAVFYTRTGFYLCYICLQYRIPCTSEPFTCDFTVTPIRNERSEVVLFLCSYQKITQDLIHSNMYQSGYKMNHSKTHSILSWASELPFSKSYLHMKNNNFNETVENNEAHLQRSYSKVNLTQTSILSGSPEENDQYEESHTSTNTSQLISKHCLNITGTISTTSFSTSYSNQDLLKESQINIKRNSYDVPSDFYSETKLNYPKEYYLPSFCQSTSFVDVLHNPSCTTIPQNIPRKFNACIQRNFSILSLPQIKSQLRKFSRRKSVTKTSEETNSKGIHEFTLTSPAESPVISYVKLKTTSRNYSPTKTDKIITANENNKKTHFWERFDYLPYSTILSNQSNDNQPKKDKIVNSDQINLQQSNLPNTNQLLDPLKTELKNINTQSNKPNKTTKCFSFISQRLSDHQSYSYGNISKKFYEPDPKKYSYKRRKSLAIIHGLGFRGRKIRKSNSSKLNQQIKNFSVKNVPEYKIQKLTKSNFVLLHYGLFHIIWDWLLLILTFYIAFIVPYNVTFESHSTHSGRCRIIDLLVEIFLIVDVILNFHTTYVNKNGQIVNDRHLIAKHYAKGWLILDLLAALPVDFILIICQMTSMINLQNVNIHTNFIEKLNYVNVSMNDTQLYDGNNKYEIRPIVNFNLISLLQMMKLARLLRLARLIQKIIRLSQYSVIVLGLLMFSFALVAHWCACIWYVIGLYEIDGSDIGWLEDLARRLKSPFQLNRSGGPTEGSKYFTALYFTCSSLTSVGFGNVSANTTNEKIFAICIMLLGALMHAAVFGNVTAIIQRMYARRTTFQSKVQDLKEFIEVYRIPKTLKSRMEDFFQTTWAINRGIDVPEVLKIYPEELQGDIYLHLNREVLGLKVFEKANRDCLKSLAINFKLTFCTPGEYLIHTGDILRRLYFVSNGSLEVLETDEVVALLGKNDWFGAFLETDMPINGTTNNVSSSTFPIIRSRCDVKSLTYCDLHYIDLVTLSEILNQHPRFKAELKSYLYEDLSFNIQEGVENYLSNDVITVPAITLQLANDEKDWEGSETKLNVINDVESLKPPKFVFDNKGRSCSLTTYDEESGLLIPYANDRSNSEIAITKPLSTRTKPTITGINQIGWQFRSPSLSTKYLSHYPRRLQSTDKIVTKRRFFLLKSSKSSGCSSNIDLTQKSKENKSPPSNYKPIEINETMSHKIFTCNPKSFSPKHNRRHTMPTVEARNSESKSTSSSVMNKYRRSDLHTDDTWIFSNHSSGTQSNDELCSSSITSAQCLSYNYGKTLLSSQCLSIPNVNFTDNTQPQMVPIKPICVSMQVTQFNSLNCDINTISTSNLCLYTPNTSPVNSIWSCTNDYNHNRYTLSNRVYHVQGSNLNEINLTNELRNLNNRLECIELQFTKLFKLIESKQFL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.8	Very low	31.6	Very low	253 Å²	253	132.3 Å²	132.3	100%	1.246	72%	0.719	S	S	*	*				0	133.7	0	-169.3	171.1	178.2	0	0	108.9
2	S	22.7	Very low	33.3	Very low	106 Å²	106	129.4 Å²	129.4	74%	0.741	70%	0.702	S	S	*	*			trans	-100.2	156.5	-166.5	50.5	0	0	0	0	114.7
3	Q	23.8	Very low	34.7	Very low	167 Å²	167	130.6 Å²	130.6	78%	0.78	70%	0.697	S	S	*	*			trans	23.5	111	155.8	-57.9	-178.4	19.8	0	0	119.2
4	H	29.3	Very low	36.5	Very low	158 Å²	158	129.5 Å²	129.5	73%	0.731	68%	0.683	S	S	*	*			trans	-137.4	81.6	137.2	-92.7	-41.6	0	0	0	111.3
5	K	28.4	Very low	38.2	Very low	194 Å²	194	122.6 Å²	122.6	84%	0.843	65%	0.647	S	S	*	*			trans	-55.2	143.5	162.4	-72.2	-173.8	174.8	-172.8	0	109.9
6	G	26.2	Very low	39.5	Very low	63 Å²	63	119.3 Å²	119.3	65%	0.649	63%	0.627	S	S	*	*			trans	43.8	82.8	153.2	0	0	0	0	0	116.5	S8	G6-S8 PolarHBondContact O-N 2.79Å; G6-S8 PolarHBondContact O-OG 2.62Å
7	L	33.8	Very low	40.6	Very low	110 Å²	110	115.6 Å²	115.6	58%	0.576	61%	0.61	S	S	*	*			trans	-77.6	60.9	152.6	-80.6	157.8	0	0	0	110.2	T9	L7-T9 VanDerWaalsContact C-N 3.32Å; L7-T9 PolarHBondContact O-N 2.74Å
8	S	37.9	Very low	41.8	Very low	98 Å²	98	111.3 Å²	111.3	69%	0.685	59%	0.587	S	S	*	*			trans	-56.4	106.5	146.7	42.8	0	0	0	0	106.9	G6	G6-S8 PolarHBondContact O-N 2.79Å; G6-S8 PolarHBondContact O-OG 2.62Å
9	T	37	Very low	42.8	Very low	43 Å²	43	107.1 Å²	107.1	26%	0.264	57%	0.566	S	S	.	*			trans	-52.8	138.9	143.7	38.9	0	0	0	0	106.4	L7 Q11 L15 V42	L7-T9 VanDerWaalsContact C-N 3.32Å; L7-T9 PolarHBondContact O-N 2.74Å; T9-Q11 PolarHBondContact O-N 3.39Å; T9-L15 HydrophobicContact CG2-CD1 4.23Å; T9-V42 HydrophobicContact CG2-CG1 3.82Å
10	P	34.6	Very low	43.7	Very low	87 Å²	87	108.9 Å²	108.9	57%	0.565	57%	0.571	S	S	*	*			trans	-51.8	136.9	170.5	23.1	-33	0	0	0	107.7	N12	P10-N12 PolarHBondContact O-N 3.05Å
11	Q	43	Very low	44.3	Very low	176 Å²	176	112.6 Å²	112.6	82%	0.822	58%	0.577	S	S	*	*			trans	-68.9	62.6	178	-78.3	-177.1	-35.2	0	0	110.6	T9 K13	T9-Q11 PolarHBondContact O-N 3.39Å; Q11-K13 PolarHBondContact O-N 3.34Å
12	N	52	Low	45.4	Very low	98 Å²	98	101.2 Å²	101.2	52%	0.524	52%	0.523	S	S	.	.			trans	-73.1	114.1	171.2	-86.3	-33.3	0	0	0	106.6	P10 F14 L15	P10-N12 PolarHBondContact O-N 3.05Å; N12-F14 HydrophobicContact CB-CB 4.34Å; N12-F14 PolarHBondContact O-N 3.3Å; N12-L15 PolarHBondContact O-N 3.03Å
13	K	52.3	Low	46.9	Very low	145 Å²	145	98.4 Å²	98.4	63%	0.63	50%	0.5	S	S	*	.	H	α-helix	trans	-44.7	-23.7	171.7	-66.9	-177.6	174.8	-177.8	0	113.7	Q11 L15 E16 T17	Q11-K13 PolarHBondContact O-N 3.34Å; K13-L15 PolarHBondContact O-N 2.98Å; K13-E16 PolarHBondContact O-N 2.98Å; K13-T17 WeakPolarHBondContact O-CB 3.43Å; K13-T17 PolarHBondContact O-N 3.14Å; K13-T17 PolarHBondContact O-OG1 3.16Å
14	F	59.1	Low	48.2	Very low	115 Å²	115	94.3 Å²	94.3	50%	0.504	49%	0.494	S	S	.	.	H	α-helix	trans	-52.9	-45.1	170.7	-174.9	-97.9	0	0	0	114	N12 I18 I131	N12-F14 HydrophobicContact CB-CB 4.34Å; N12-F14 PolarHBondContact O-N 3.3Å; F14-I18 HydrophobicContact CD1-CD1 3.83Å; F14-I18 HydrophobicContact CE1-CD1 3.36Å; F14-I18 HydrophobicContact CE2-CD1 4.28Å; F14-I18 HydrophobicContact CG-CD1 4.46Å; F14-I18 HydrophobicContact CZ-CD1 3.63Å; F14-I18 VanDerWaalsContact O-CG1 3.31Å; F14-I18 WeakPolarHBondContact O-CG1 3.31Å; F14-I18 PolarHBondContact O-N 3.16Å; F14-I131 HydrophobicContact CE1-CG2 3.83Å; F14-I131 HydrophobicContact CZ-CG2 3.75Å
15	L	62.4	Low	49.3	Very low	26 Å²	26	93.3 Å²	93.3	14%	0.136	49%	0.493	C	S	.	.	H	α-helix	trans	-67.2	-50	177.4	-88.1	168.4	0	0	0	111	T9 N12 K13 T17 I18 V19 L31 L140	T9-L15 HydrophobicContact CG2-CD1 4.23Å; N12-L15 PolarHBondContact O-N 3.03Å; K13-L15 PolarHBondContact O-N 2.98Å; L15-T17 VanDerWaalsContact C-N 3.34Å; L15-T17 PolarHBondContact O-N 3.26Å; L15-I18 PolarHBondContact O-N 2.84Å; L15-I18 VanDerWaalsContact O-N 3.13Å; L15-V19 WeakPolarHBondContact O-CG2 3.5Å; L15-V19 PolarHBondContact O-N 2.72Å; L15-L31 HydrophobicContact CD2-CD1 3.95Å; L15-L140 HydrophobicContact CD2-CD1 3.77Å; L15-L140 HydrophobicContact CG-CD1 4.3Å
16	E	58.2	Low	50.4	Low	70 Å²	70	91.8 Å²	91.8	33%	0.327	49%	0.489	S	S	.	.	H	α-helix	trans	-58.4	-44.5	177.1	-64.3	170.8	148.8	0	0	111.3	K13 I18 V19 E20	K13-E16 PolarHBondContact O-N 2.98Å; E16-I18 VanDerWaalsContact C-N 3.3Å; E16-I18 PolarHBondContact O-N 3.33Å; E16-V19 PolarHBondContact O-N 2.84Å; E16-V19 VanDerWaalsContact O-N 3.16Å; E16-E20 WeakPolarHBondContact O-CB 3.37Å; E16-E20 WeakPolarHBondContact O-CG 3.35Å; E16-E20 PolarHBondContact O-N 2.79Å
17	T	59.4	Low	52.5	Low	56 Å²	56	90.3 Å²	90.3	34%	0.344	47%	0.471	S	S	.	.	H	α-helix	trans	-64.6	-30.8	177.5	-57.3	0	0	0	0	112.7	K13 L15 R21	K13-T17 WeakPolarHBondContact O-CB 3.43Å; K13-T17 PolarHBondContact O-N 3.14Å; K13-T17 PolarHBondContact O-OG1 3.16Å; L15-T17 VanDerWaalsContact C-N 3.34Å; L15-T17 PolarHBondContact O-N 3.26Å; T17-R21 VanDerWaalsContact O-CB 3.29Å; T17-R21 WeakPolarHBondContact O-CB 3.46Å; T17-R21 WeakPolarHBondContact O-CG 3.4Å; T17-R21 PolarHBondContact O-N 3.36Å
18	I	61.5	Low	55	Low	39 Å²	39	87.1 Å²	87.1	20%	0.2	45%	0.454	C	S	.	.	H	α-helix	trans	-71.4	-48.1	172.1	-74.9	170	0	0	0	109.7	F14 L15 E16 R21 S22 L31 I131	F14-I18 HydrophobicContact CD1-CD1 3.83Å; F14-I18 HydrophobicContact CE1-CD1 3.36Å; F14-I18 HydrophobicContact CE2-CD1 4.28Å; F14-I18 HydrophobicContact CG-CD1 4.46Å; F14-I18 HydrophobicContact CZ-CD1 3.63Å; F14-I18 VanDerWaalsContact O-CG1 3.31Å; F14-I18 WeakPolarHBondContact O-CG1 3.31Å; F14-I18 PolarHBondContact O-N 3.16Å; L15-I18 PolarHBondContact O-N 2.84Å; L15-I18 VanDerWaalsContact O-N 3.13Å; E16-I18 VanDerWaalsContact C-N 3.3Å; E16-I18 PolarHBondContact O-N 3.33Å; I18-R21 PolarHBondContact O-N 3.21Å; I18-S22 VanDerWaalsContact O-CB 3.29Å; I18-S22 WeakPolarHBondContact O-CB 3.27Å; I18-S22 PolarHBondContact O-N 3.23Å; I18-S22 PolarHBondContact O-OG 3.3Å; I18-L31 HydrophobicContact CG2-CD1 4.17Å; I18-I131 HydrophobicContact CD1-CD1 4.42Å
19	V	61.3	Low	57.4	Low	30 Å²	30	82.8 Å²	82.8	18%	0.182	42%	0.423	C	S	.	.	H	α-helix	trans	-59.2	-53.9	179.7	169.3	0	0	0	0	111.1	L15 E16 R21 S22 D23 Y43	L15-V19 WeakPolarHBondContact O-CG2 3.5Å; L15-V19 PolarHBondContact O-N 2.72Å; E16-V19 PolarHBondContact O-N 2.84Å; E16-V19 VanDerWaalsContact O-N 3.16Å; V19-R21 VanDerWaalsContact C-N 3.3Å; V19-R21 PolarHBondContact O-N 3.17Å; V19-S22 PolarHBondContact O-N 2.98Å; V19-S22 PolarHBondContact O-OG 2.78Å; V19-S22 VanDerWaalsContact O-OG 3.1Å; V19-D23 PolarHBondContact O-N 3.15Å; V19-Y43 HydrophobicContact CB-CE2 4.23Å; V19-Y43 HydrophobicContact CG1-CE2 3.62Å; V19-Y43 HydrophobicContact CG2-CD1 4.18Å; V19-Y43 HydrophobicContact CG2-CD2 3.68Å; V19-Y43 HydrophobicContact CG2-CE1 4.07Å; V19-Y43 HydrophobicContact CG2-CE2 3.51Å; V19-Y43 HydrophobicContact CG2-CG 4.03Å
20	E	59.6	Low	59.9	Low	144 Å²	144	80.7 Å²	80.7	67%	0.673	41%	0.41	S	S	*	.	H	α-helix	trans	-57	-40.8	178.4	-71.9	-174.2	145.7	0	0	112.7	E16 S22 A24	E16-E20 WeakPolarHBondContact O-CB 3.37Å; E16-E20 WeakPolarHBondContact O-CG 3.35Å; E16-E20 PolarHBondContact O-N 2.79Å; E20-S22 VanDerWaalsContact C-N 3.26Å; E20-S22 PolarHBondContact O-N 3.4Å; E20-A24 VanDerWaalsContact O-CB 3.3Å; E20-A24 WeakPolarHBondContact O-CB 3.39Å
21	R	56.7	Low	62.5	Low	186 Å²	186	76.6 Å²	76.6	70%	0.702	38%	0.384	S	S	*	.	H	α-helix	trans	-72.4	-14.2	178.7	-82.8	-176.3	158.4	140.1	-0.7	114.7	T17 I18 V19	T17-R21 VanDerWaalsContact O-CB 3.29Å; T17-R21 WeakPolarHBondContact O-CB 3.46Å; T17-R21 WeakPolarHBondContact O-CG 3.4Å; T17-R21 PolarHBondContact O-N 3.36Å; I18-R21 PolarHBondContact O-N 3.21Å; V19-R21 VanDerWaalsContact C-N 3.3Å; V19-R21 PolarHBondContact O-N 3.17Å
22	S	54.2	Low	64.7	Low	15 Å²	15	68.2 Å²	68.2	11%	0.105	34%	0.344	C	S	.	.	H	α-helix	trans	-118	-33.2	-169.4	57.5	0	0	0	0	113.5	I18 V19 E20 A24 L25 H26 A27 F29	I18-S22 VanDerWaalsContact O-CB 3.29Å; I18-S22 WeakPolarHBondContact O-CB 3.27Å; I18-S22 PolarHBondContact O-N 3.23Å; I18-S22 PolarHBondContact O-OG 3.3Å; V19-S22 PolarHBondContact O-N 2.98Å; V19-S22 PolarHBondContact O-OG 2.78Å; V19-S22 VanDerWaalsContact O-OG 3.1Å; E20-S22 VanDerWaalsContact C-N 3.26Å; E20-S22 PolarHBondContact O-N 3.4Å; S22-A24 PolarHBondContact O-N 3.47Å; S22-L25 PolarHBondContact O-N 2.86Å; S22-H26 PolarHBondContact O-N 3.43Å; S22-A27 PolarHBondContact O-N 3.11Å; S22-F29 WeakPolarHBondContact OG-CE1 3.36Å; S22-F29 WeakPolarHBondContact OG-CZ 3.33Å
23	D	54.5	Low	66.4	Low	47 Å²	47	64.4 Å²	64.4	25%	0.251	32%	0.324	S	S	.	.	H	α-helix	trans	-58.7	-34.6	161.5	-91.6	-39.2	0	0	0	110	V19 L25 H26 Y43 R327	V19-D23 PolarHBondContact O-N 3.15Å; D23-L25 PolarHBondContact O-N 3.49Å; D23-L25 VanDerWaalsContact O-N 3.17Å; D23-H26 PolarHBondContact O-N 3.21Å; D23-Y43 VanDerWaalsContact CG-OH 3.32Å; D23-Y43 PolarHBondContact OD1-OH 3.26Å; D23-Y43 PolarHBondContact OD2-OH 3.44Å; D23-R327 IonicContact OD1-NH1 3.49Å
24	A	51.6	Low	68.1	Low	80 Å²	80	58 Å²	58	66%	0.661	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-7	173.2	0	0	0	0	0	115.6	E20 S22	E20-A24 VanDerWaalsContact O-CB 3.3Å; E20-A24 WeakPolarHBondContact O-CB 3.39Å; S22-A24 PolarHBondContact O-N 3.47Å
25	L	51.7	Low	69.3	Low	137 Å²	137	58.5 Å²	58.5	72%	0.717	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	6.7	179.6	-75.7	170.9	0	0	0	113.1	S22 D23 A27	S22-L25 PolarHBondContact O-N 2.86Å; D23-L25 PolarHBondContact O-N 3.49Å; D23-L25 VanDerWaalsContact O-N 3.17Å; L25-A27 PolarHBondContact O-N 2.85Å; L25-A27 VanDerWaalsContact O-N 3.12Å
26	H	52.7	Low	70.2	Confident	163 Å²	163	61.5 Å²	61.5	76%	0.755	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	32.6	-171.5	-63.6	-64.9	0	0	0	113.5	S22 D23	S22-H26 PolarHBondContact O-N 3.43Å; D23-H26 PolarHBondContact O-N 3.21Å
27	A	68.7	Low	71.3	Confident	32 Å²	32	66.1 Å²	66.1	26%	0.264	33%	0.33	S	S	.	.			trans	-70.5	136.3	-172.7	0	0	0	0	0	111.8	S22 L25 F29 S45	S22-A27 PolarHBondContact O-N 3.11Å; L25-A27 PolarHBondContact O-N 2.85Å; L25-A27 VanDerWaalsContact O-N 3.12Å; A27-F29 HydrophobicContact CB-CD1 3.84Å; A27-F29 HydrophobicContact CB-CE1 4.28Å; A27-F29 WeakPolarHBondContact O-CD1 3.43Å; A27-F29 PolarHBondContact O-N 2.89Å; A27-S45 VanDerWaalsContact O-CB 3.25Å; A27-S45 WeakPolarHBondContact O-CB 3.35Å; A27-S45 PolarHBondContact O-OG 3.06Å
28	N	86.9	Confident	72.4	Confident	43 Å²	43	71 Å²	71	23%	0.23	34%	0.344	C	S	.	.			trans	-88.2	93.4	178.3	-61.9	-18.6	0	0	0	110.1	G47 L51 S144 Y145	N28-G47 WeakPolarHBondContact OD1-CA 3.49Å; N28-G47 PolarHBondContact OD1-O 2.97Å; N28-G47 VanDerWaalsContact OD1-O 3.1Å; N28-L51 HydrophobicContact CB-CD2 4.13Å; N28-S144 WeakPolarHBondContact O-CA 3.36Å; N28-S144 PolarHBondContact O-OG 3.34Å; N28-Y145 VanDerWaalsContact CB-O 3.26Å; N28-Y145 WeakPolarHBondContact CB-O 3.27Å; N28-Y145 PolarHBondContact O-N 3.13Å
29	F	88.6	Confident	73.7	Confident	6 Å²	6	70.5 Å²	70.5	3%	0.026	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	165.1	-177	77.4	-81.8	0	0	0	114.2	S22 A27 L31 Y43 S45 L142 C143	S22-F29 WeakPolarHBondContact OG-CE1 3.36Å; S22-F29 WeakPolarHBondContact OG-CZ 3.33Å; A27-F29 HydrophobicContact CB-CD1 3.84Å; A27-F29 HydrophobicContact CB-CE1 4.28Å; A27-F29 WeakPolarHBondContact O-CD1 3.43Å; A27-F29 PolarHBondContact O-N 2.89Å; F29-L31 HydrophobicContact CD2-CG 4.27Å; F29-L31 HydrophobicContact CE2-CD1 3.98Å; F29-L31 HydrophobicContact CE2-CG 4.04Å; F29-Y43 HydrophobicContact CE1-CE1 4.33Å; F29-Y43 AromaticContact CE2-CD1 3.85Å; F29-Y43 HydrophobicContact CE2-CD1 3.85Å; F29-Y43 AromaticContact CE2-CE1 3.69Å; F29-Y43 HydrophobicContact CE2-CE1 3.69Å; F29-Y43 HydrophobicContact CZ-CD1 4.08Å; F29-Y43 AromaticContact CZ-CE1 3.43Å; F29-Y43 HydrophobicContact CZ-CE1 3.43Å; F29-Y43 VanDerWaalsContact CZ-CE1 3.43Å; F29-S45 VanDerWaalsContact CE1-CB 3.46Å; F29-S45 PolarHBondContact N-OG 3.45Å; F29-S45 PolarHBondContact O-N 2.81Å; F29-S45 PolarHBondContact O-OG 3.34Å; F29-L142 HydrophobicContact CB-CD1 3.94Å; F29-L142 HydrophobicContact CD2-CD1 3.42Å; F29-L142 VanDerWaalsContact CD2-CD1 3.42Å; F29-L142 HydrophobicContact CE2-CD1 4.29Å; F29-L142 HydrophobicContact CG-CD1 3.93Å; F29-C143 CarbonylContact C-O 3.52Å; F29-C143 WeakPolarHBondContact CA-O 3.16Å; F29-C143 WeakPolarHBondContact CB-O 3.47Å
30	V	89.2	Confident	75.1	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	144.4	-177.8	-179	0	0	0	0	109.2	I41 C44 F48 C143 Y145	V30-I41 HydrophobicContact CG1-CB 4.14Å; V30-I41 HydrophobicContact CG1-CD1 3.57Å; V30-I41 HydrophobicContact CG1-CG1 3.47Å; V30-I41 VanDerWaalsContact CG1-CG1 3.47Å; V30-I41 HydrophobicContact CG1-CG2 3.59Å; V30-C44 HydrophobicContact CG2-CB 4.31Å; V30-F48 HydrophobicContact CG2-CB 4.3Å; V30-F48 HydrophobicContact CG2-CD1 3.67Å; V30-F48 HydrophobicContact CG2-CD2 3.54Å; V30-F48 HydrophobicContact CG2-CE1 3.79Å; V30-F48 HydrophobicContact CG2-CE2 3.65Å; V30-F48 HydrophobicContact CG2-CG 3.53Å; V30-F48 HydrophobicContact CG2-CZ 3.77Å; V30-C143 HydrophobicContact CB-CB 4.37Å; V30-C143 PolarHBondContact N-O 3.33Å; V30-C143 PolarHBondContact O-N 3.26Å; V30-Y145 HydrophobicContact CG2-CE2 4.05Å
31	L	88.7	Confident	76.5	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	113.2	175.9	-73.9	165.6	0	0	0	110.4	L15 I18 F29 V42 Y43 I131 F141 L142	L15-L31 HydrophobicContact CD2-CD1 3.95Å; I18-L31 HydrophobicContact CG2-CD1 4.17Å; F29-L31 HydrophobicContact CD2-CG 4.27Å; F29-L31 HydrophobicContact CE2-CD1 3.98Å; F29-L31 HydrophobicContact CE2-CG 4.04Å; L31-V42 PolarHBondContact O-N 3.47Å; L31-Y43 HydrophobicContact CD1-CD1 4.19Å; L31-Y43 PolarHBondContact N-O 3.38Å; L31-Y43 PolarHBondContact O-N 3.28Å; L31-I131 HydrophobicContact CD2-CD1 4.13Å; L31-F141 WeakPolarHBondContact CA-O 3.35Å; L31-L142 HydrophobicContact CD2-CB 3.97Å; L31-L142 HydrophobicContact CD2-CD1 3.94Å; L31-L142 HydrophobicContact CG-CD1 4.43Å
32	G	88.8	Confident	77.8	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	146.6	173.8	0	0	0	0	0	112.8	A34 P40 L140 F141	G32-A34 PolarHBondContact O-N 3.13Å; G32-P40 WeakPolarHBondContact CA-O 3.43Å; G32-L140 CarbonylContact O-C 3.58Å; G32-L140 VanDerWaalsContact O-CA 3.23Å; G32-L140 WeakPolarHBondContact O-CA 3.47Å; G32-F141 PolarHBondContact N-O 3.07Å; G32-F141 PolarHBondContact O-N 3Å
33	N	88	Confident	79.3	Confident	19 Å²	19	58 Å²	58	10%	0.102	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	110.8	174.3	-173	-21.1	0	0	0	111	Q35 Y39 P40 V42 V139	N33-Q35 VanDerWaalsContact C-N 3.28Å; N33-Q35 PolarHBondContact O-N 3.25Å; N33-Q35 WeakPolarHBondContact OD1-CB 3.15Å; N33-Q35 PolarHBondContact OD1-N 2.97Å; N33-Y39 WeakPolarHBondContact O-CA 3.44Å; N33-P40 HydrophobicContact CB-CG 4.3Å; N33-P40 PolarHBondContact N-O 2.94Å; N33-V42 HydrophobicContact CB-CG2 3.75Å; N33-V139 PolarHBondContact OD1-O 3.33Å
34	A	88.2	Confident	80.8	Confident	9 Å²	9	55.8 Å²	55.8	7%	0.074	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-19.1	-178.7	0	0	0	0	0	113.5	G32 R36 V138 V139 F141	G32-A34 PolarHBondContact O-N 3.13Å; A34-R36 VanDerWaalsContact C-N 3.3Å; A34-V138 HydrophobicContact CB-CB 4.18Å; A34-V138 HydrophobicContact CB-CG1 3.58Å; A34-V139 PolarHBondContact N-O 2.86Å; A34-F141 HydrophobicContact CB-CD2 3.51Å; A34-F141 HydrophobicContact CB-CE2 3.52Å; A34-F141 HydrophobicContact CB-CG 4.42Å; A34-F141 HydrophobicContact CB-CZ 4.44Å
35	Q	83.9	Confident	82.4	Confident	127 Å²	127	52 Å²	52	59%	0.593	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	1.5	-179	-49.2	-173.6	-68.4	0	0	113.3	N33 V139	N33-Q35 VanDerWaalsContact C-N 3.28Å; N33-Q35 PolarHBondContact O-N 3.25Å; N33-Q35 WeakPolarHBondContact OD1-CB 3.15Å; N33-Q35 PolarHBondContact OD1-N 2.97Å; Q35-V139 HydrophobicContact CG-CG1 4.29Å
36	R	81.4	Confident	83.6	Confident	88 Å²	88	47.6 Å²	47.6	33%	0.332	22%	0.223	S	C	.	.	S	Bend	trans	-120.6	138.9	179	-86.9	-171.5	160	-112.9	-7.1	111.6	A34 Y39 P40	A34-R36 VanDerWaalsContact C-N 3.3Å; R36-Y39 PolarHBondContact O-N 3.38Å; R36-P40 HydrophobicContact CB-CG 3.89Å
37	K	81.3	Confident	85	Confident	167 Å²	167	40.2 Å²	40.2	73%	0.726	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.3	140	171.1	-159.4	179	-177.7	-176.7	0	109.8	Y39	K37-Y39 PolarHBondContact O-N 2.97Å
38	Y	82.2	Confident	85.9	Confident	160 Å²	160	38.7 Å²	38.7	63%	0.627	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.4	4.1	-173	-45.9	-77.1	0	0	0	116.3	S63	Y38-S63 WeakPolarHBondContact O-CA 3.39Å; Y38-S63 WeakPolarHBondContact O-CB 3.23Å; Y38-S63 PolarHBondContact O-OG 3.01Å
39	Y	89.6	Confident	85.8	Confident	28 Å²	28	37.7 Å²	37.7	11%	0.11	17%	0.173	C	C	.	.			trans	52.5	58	171.8	-40.7	-66.2	0	0	0	114.2	N33 R36 K37 S64 I65 F86 F141	N33-Y39 WeakPolarHBondContact O-CA 3.44Å; R36-Y39 PolarHBondContact O-N 3.38Å; K37-Y39 PolarHBondContact O-N 2.97Å; Y39-S64 WeakPolarHBondContact CB-OG 3.41Å; Y39-S64 WeakPolarHBondContact O-CB 3.03Å; Y39-S64 PolarHBondContact O-N 3.5Å; Y39-S64 PolarHBondContact O-OG 2.96Å; Y39-S64 VanDerWaalsContact O-OG 3.1Å; Y39-I65 HydrophobicContact CD2-CD1 3.94Å; Y39-I65 HydrophobicContact CD2-CG1 4.23Å; Y39-I65 HydrophobicContact CE2-CD1 4.23Å; Y39-F86 HydrophobicContact CD2-CB 3.93Å; Y39-F86 AromaticContact CD2-CD1 3.89Å; Y39-F86 HydrophobicContact CD2-CD1 3.89Å; Y39-F86 HydrophobicContact CD2-CG 4.16Å; Y39-F86 HydrophobicContact CE2-CB 3.65Å; Y39-F86 HydrophobicContact CE2-CD1 4.41Å; Y39-F86 HydrophobicContact CE2-CG 4.38Å; Y39-F86 HydrophobicContact CG-CD1 4.03Å; Y39-F86 PolarHBondContact OH-O 2.64Å; Y39-F141 HydrophobicContact CD1-CD2 4.2Å; Y39-F141 AromaticContact CD1-CE2 3.77Å; Y39-F141 HydrophobicContact CD1-CE2 3.77Å; Y39-F141 AromaticContact CE1-CE2 3.97Å; Y39-F141 HydrophobicContact CE1-CE2 3.97Å; Y39-F141 HydrophobicContact CG-CE2 4.34Å
40	P	89.8	Confident	85.4	Confident	29 Å²	29	43.7 Å²	43.7	19%	0.188	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-65.2	139.8	-170.7	26.9	-35.1	0	0	0	112.7	G32 N33 R36 V42 R62	G32-P40 WeakPolarHBondContact CA-O 3.43Å; N33-P40 HydrophobicContact CB-CG 4.3Å; N33-P40 PolarHBondContact N-O 2.94Å; R36-P40 HydrophobicContact CB-CG 3.89Å; P40-V42 PolarHBondContact O-N 2.86Å; P40-R62 CarbonylContact C-O 3.55Å; P40-R62 WeakPolarHBondContact CA-O 3.21Å
41	I	89.1	Confident	85.1	Confident	6 Å²	6	44.7 Å²	44.7	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	120.7	178.6	-67.3	168.3	0	0	0	110.3	V30 V59 S61 R62 F68	V30-I41 HydrophobicContact CG1-CB 4.14Å; V30-I41 HydrophobicContact CG1-CD1 3.57Å; V30-I41 HydrophobicContact CG1-CG1 3.47Å; V30-I41 VanDerWaalsContact CG1-CG1 3.47Å; V30-I41 HydrophobicContact CG1-CG2 3.59Å; I41-V59 HydrophobicContact CD1-CG1 4.04Å; I41-V59 WeakPolarHBondContact CD1-O 3.4Å; I41-V59 HydrophobicContact CG2-CG1 4.36Å; I41-S61 PolarHBondContact O-N 3.48Å; I41-R62 WeakPolarHBondContact CB-O 3.46Å; I41-R62 HydrophobicContact CD1-CB 4.21Å; I41-R62 VanDerWaalsContact CG1-O 3.25Å; I41-R62 WeakPolarHBondContact CG1-O 3.4Å; I41-R62 PolarHBondContact N-O 2.91Å; I41-F68 HydrophobicContact CD1-CE1 4.35Å
42	V	85.6	Confident	84.9	Confident	40 Å²	40	44.7 Å²	44.7	24%	0.242	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-29.4	179.2	-169.9	0	0	0	0	111.5	T9 L31 N33 P40 M60	T9-V42 HydrophobicContact CG2-CG1 3.82Å; L31-V42 PolarHBondContact O-N 3.47Å; N33-V42 HydrophobicContact CB-CG2 3.75Å; P40-V42 PolarHBondContact O-N 2.86Å; V42-M60 VanDerWaalsContact O-CE 3.26Å; V42-M60 WeakPolarHBondContact O-CE 3.36Å
43	Y	85.3	Confident	84.5	Confident	37 Å²	37	49.9 Å²	49.9	15%	0.145	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	143.9	176.5	172.2	-79.9	0	0	0	110.6	V19 D23 F29 L31	V19-Y43 HydrophobicContact CB-CE2 4.23Å; V19-Y43 HydrophobicContact CG1-CE2 3.62Å; V19-Y43 HydrophobicContact CG2-CD1 4.18Å; V19-Y43 HydrophobicContact CG2-CD2 3.68Å; V19-Y43 HydrophobicContact CG2-CE1 4.07Å; V19-Y43 HydrophobicContact CG2-CE2 3.51Å; V19-Y43 HydrophobicContact CG2-CG 4.03Å; D23-Y43 VanDerWaalsContact CG-OH 3.32Å; D23-Y43 PolarHBondContact OD1-OH 3.26Å; D23-Y43 PolarHBondContact OD2-OH 3.44Å; F29-Y43 HydrophobicContact CE1-CE1 4.33Å; F29-Y43 AromaticContact CE2-CD1 3.85Å; F29-Y43 HydrophobicContact CE2-CD1 3.85Å; F29-Y43 AromaticContact CE2-CE1 3.69Å; F29-Y43 HydrophobicContact CE2-CE1 3.69Å; F29-Y43 HydrophobicContact CZ-CD1 4.08Å; F29-Y43 AromaticContact CZ-CE1 3.43Å; F29-Y43 HydrophobicContact CZ-CE1 3.43Å; F29-Y43 VanDerWaalsContact CZ-CE1 3.43Å; L31-Y43 HydrophobicContact CD1-CD1 4.19Å; L31-Y43 PolarHBondContact N-O 3.38Å; L31-Y43 PolarHBondContact O-N 3.28Å
44	C	85.5	Confident	84.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.8	169.8	56.1	0	0	0	0	110.1	V30 F48 R56 V59	V30-C44 HydrophobicContact CG2-CB 4.31Å; C44-F48 HydrophobicContact CB-CD1 4.2Å; C44-R56 PolarHBondContact O-NH2 3.39Å; C44-V59 HydrophobicContact CB-CG1 3.8Å
45	S	84.5	Confident	83.6	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.007	24%	0.244	C	C	.	.			trans	-74.9	156.9	-179.7	73.4	0	0	0	0	112.3	A27 F29 G47 F48 L49	A27-S45 VanDerWaalsContact O-CB 3.25Å; A27-S45 WeakPolarHBondContact O-CB 3.35Å; A27-S45 PolarHBondContact O-OG 3.06Å; F29-S45 VanDerWaalsContact CE1-CB 3.46Å; F29-S45 PolarHBondContact N-OG 3.45Å; F29-S45 PolarHBondContact O-N 2.81Å; F29-S45 PolarHBondContact O-OG 3.34Å; S45-G47 PolarHBondContact O-N 2.98Å; S45-F48 PolarHBondContact O-N 3Å; S45-F48 PolarHBondContact OG-N 2.9Å; S45-F48 VanDerWaalsContact OG-N 3.16Å; S45-L49 WeakPolarHBondContact O-CG 3.44Å; S45-L49 PolarHBondContact O-N 3.26Å
46	D	78.3	Confident	83.5	Confident	44 Å²	44	48.7 Å²	48.7	24%	0.235	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-32.6	173.5	-83.6	11.5	0	0	0	111.9	L49 L50 R56 R327	D46-L49 PolarHBondContact O-N 3.07Å; D46-L50 WeakPolarHBondContact O-CG 3.47Å; D46-L50 PolarHBondContact O-N 3.4Å; D46-R56 IonicContact OD1-CZ 3.76Å; D46-R56 VanDerWaalsContact OD1-CZ 3.23Å; D46-R56 IonicContact OD1-NH1 3.96Å; D46-R56 PolarHBondContact OD1-NH1 2.76Å; D46-R56 IonicContact OD1-NH2 2.64Å; D46-R56 PolarHBondContact OD1-NH2 3.46Å; D46-R327 VanDerWaalsContact CG-CZ 3.49Å; D46-R327 IonicContact OD1-CZ 2.73Å; D46-R327 VanDerWaalsContact OD1-CZ 3.24Å; D46-R327 IonicContact OD1-NE 3.31Å; D46-R327 IonicContact OD1-NH1 3.21Å; D46-R327 PolarHBondContact OD1-NH1 3.01Å; D46-R327 IonicContact OD1-NH2 2.69Å; D46-R327 WeakPolarHBondContact OD2-CD 3.39Å; D46-R327 IonicContact OD2-CZ 3.44Å; D46-R327 IonicContact OD2-NE 2.64Å; D46-R327 PolarHBondContact OD2-NE 3.24Å; D46-R327 IonicContact OD2-NH1 2.73Å; D46-R327 PolarHBondContact OD2-NH1 3.29Å
47	G	82	Confident	83.1	Confident	8 Å²	8	46.7 Å²	46.7	8%	0.082	23%	0.227	C	C	.	.	H	α-helix	trans	-61.2	-42	174.8	0	0	0	0	0	113.1	N28 S45 L49 L50 L51	N28-G47 WeakPolarHBondContact OD1-CA 3.49Å; N28-G47 PolarHBondContact OD1-O 2.97Å; N28-G47 VanDerWaalsContact OD1-O 3.1Å; S45-G47 PolarHBondContact O-N 2.98Å; G47-L49 VanDerWaalsContact C-N 3.34Å; G47-L49 PolarHBondContact O-N 2.99Å; G47-L50 PolarHBondContact O-N 3.09Å; G47-L51 WeakPolarHBondContact O-CB 3.21Å; G47-L51 PolarHBondContact O-N 3.11Å
48	F	87.3	Confident	83	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.1	-38.2	175.5	176.5	-94.7	0	0	0	112.6	V30 C44 S45 L51 T52 V59 F68 L69 Y145	V30-F48 HydrophobicContact CG2-CB 4.3Å; V30-F48 HydrophobicContact CG2-CD1 3.67Å; V30-F48 HydrophobicContact CG2-CD2 3.54Å; V30-F48 HydrophobicContact CG2-CE1 3.79Å; V30-F48 HydrophobicContact CG2-CE2 3.65Å; V30-F48 HydrophobicContact CG2-CG 3.53Å; V30-F48 HydrophobicContact CG2-CZ 3.77Å; C44-F48 HydrophobicContact CB-CD1 4.2Å; S45-F48 PolarHBondContact O-N 3Å; S45-F48 PolarHBondContact OG-N 2.9Å; S45-F48 VanDerWaalsContact OG-N 3.16Å; F48-L51 PolarHBondContact O-N 2.86Å; F48-T52 HydrophobicContact CD2-CG2 4.08Å; F48-T52 HydrophobicContact CE1-CG2 4.29Å; F48-T52 HydrophobicContact CE2-CG2 3.69Å; F48-T52 HydrophobicContact CZ-CG2 3.82Å; F48-T52 WeakPolarHBondContact O-CB 3.2Å; F48-T52 WeakPolarHBondContact O-CG2 3.44Å; F48-T52 PolarHBondContact O-N 3.24Å; F48-T52 VanDerWaalsContact O-N 3.08Å; F48-T52 PolarHBondContact O-OG1 3.38Å; F48-V59 HydrophobicContact CD1-CG1 4.21Å; F48-V59 HydrophobicContact CE1-CG1 3.66Å; F48-V59 HydrophobicContact CE1-CG2 4.02Å; F48-F68 HydrophobicContact CE1-CZ 4.47Å; F48-F68 HydrophobicContact CZ-CE2 4.46Å; F48-F68 HydrophobicContact CZ-CZ 4.2Å; F48-L69 HydrophobicContact CE2-CD1 4.03Å; F48-L69 HydrophobicContact CZ-CD1 3.97Å; F48-Y145 AromaticContact CD2-CD2 3.59Å; F48-Y145 HydrophobicContact CD2-CD2 3.59Å; F48-Y145 AromaticContact CD2-CE2 3.75Å; F48-Y145 HydrophobicContact CD2-CE2 3.75Å; F48-Y145 HydrophobicContact CD2-CG 4.16Å; F48-Y145 HydrophobicContact CE2-CD1 4.35Å; F48-Y145 AromaticContact CE2-CD2 3.7Å; F48-Y145 HydrophobicContact CE2-CD2 3.7Å; F48-Y145 HydrophobicContact CE2-CE1 4.12Å; F48-Y145 AromaticContact CE2-CE2 3.44Å; F48-Y145 HydrophobicContact CE2-CE2 3.44Å; F48-Y145 VanDerWaalsContact CE2-CE2 3.44Å; F48-Y145 HydrophobicContact CE2-CG 4.16Å; F48-Y145 AromaticContact CE2-CZ 3.67Å; F48-Y145 HydrophobicContact CZ-CE2 4.49Å
49	L	84.7	Confident	83	Confident	23 Å²	23	33.5 Å²	33.5	12%	0.12	18%	0.176	C	C	.	.	H	α-helix	trans	-68.4	-39.4	177.3	-58.8	173.7	0	0	0	111.6	S45 D46 G47 H53 Y54 R56 V59	S45-L49 WeakPolarHBondContact O-CG 3.44Å; S45-L49 PolarHBondContact O-N 3.26Å; D46-L49 PolarHBondContact O-N 3.07Å; G47-L49 VanDerWaalsContact C-N 3.34Å; G47-L49 PolarHBondContact O-N 2.99Å; L49-H53 WeakPolarHBondContact O-CA 3.34Å; L49-H53 PolarHBondContact O-N 3.2Å; L49-Y54 VanDerWaalsContact CD2-O 3.23Å; L49-Y54 WeakPolarHBondContact CD2-O 3.49Å; L49-R56 HydrophobicContact CD1-CB 3.77Å; L49-R56 HydrophobicContact CD1-CG 4.37Å; L49-R56 HydrophobicContact CD2-CB 4.44Å; L49-V59 HydrophobicContact CD2-CB 4.29Å; L49-V59 HydrophobicContact CD2-CG2 3.83Å
50	L	80.8	Confident	82.6	Confident	131 Å²	131	35.5 Å²	35.5	69%	0.686	19%	0.187	S	C	*	.	H	α-helix	trans	-66.9	-38.7	173.6	-72.7	166.1	0	0	0	112.6	D46 G47	D46-L50 WeakPolarHBondContact O-CG 3.47Å; D46-L50 PolarHBondContact O-N 3.4Å; G47-L50 PolarHBondContact O-N 3.09Å
51	L	82.3	Confident	82.2	Confident	21 Å²	21	39 Å²	39	11%	0.11	21%	0.212	C	C	.	.	H	α-helix	trans	-68.1	-39	178.8	174.4	64.2	0	0	0	112.9	N28 G47 F48 F122 K147	N28-L51 HydrophobicContact CB-CD2 4.13Å; G47-L51 WeakPolarHBondContact O-CB 3.21Å; G47-L51 PolarHBondContact O-N 3.11Å; F48-L51 PolarHBondContact O-N 2.86Å; L51-F122 HydrophobicContact CD1-CD2 4.2Å; L51-F122 HydrophobicContact CD1-CE2 3.98Å; L51-F122 HydrophobicContact CD1-CZ 4.45Å; L51-F122 HydrophobicContact CD2-CE2 3.96Å; L51-F122 HydrophobicContact CD2-CZ 4.36Å; L51-F122 HydrophobicContact CG-CE2 3.97Å; L51-F122 HydrophobicContact CG-CZ 4.13Å; L51-K147 HydrophobicContact CD1-CB 3.9Å; L51-K147 HydrophobicContact CD1-CD 3.87Å; L51-K147 HydrophobicContact CD1-CG 4.42Å
52	T	84.4	Confident	82	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-101.5	-14	-170.4	61.4	0	0	0	0	113.8	F48 Y54 L69 R101 F122	F48-T52 HydrophobicContact CD2-CG2 4.08Å; F48-T52 HydrophobicContact CE1-CG2 4.29Å; F48-T52 HydrophobicContact CE2-CG2 3.69Å; F48-T52 HydrophobicContact CZ-CG2 3.82Å; F48-T52 WeakPolarHBondContact O-CB 3.2Å; F48-T52 WeakPolarHBondContact O-CG2 3.44Å; F48-T52 PolarHBondContact O-N 3.24Å; F48-T52 VanDerWaalsContact O-N 3.08Å; F48-T52 PolarHBondContact O-OG1 3.38Å; T52-Y54 VanDerWaalsContact O-CD2 3.32Å; T52-Y54 WeakPolarHBondContact O-CD2 3.47Å; T52-Y54 PolarHBondContact O-N 2.94Å; T52-L69 HydrophobicContact CG2-CD1 4.01Å; T52-L69 HydrophobicContact CG2-CD2 3.9Å; T52-R101 PolarHBondContact O-N 3.03Å; T52-F122 HydrophobicContact CG2-CZ 4.28Å
53	H	79.7	Confident	82.2	Confident	109 Å²	109	44.7 Å²	44.7	51%	0.505	23%	0.232	S	C	.	.			trans	61.8	12	-172.3	-59.4	-95.4	0	0	0	115.2	L49 R101	L49-H53 WeakPolarHBondContact O-CA 3.34Å; L49-H53 PolarHBondContact O-N 3.2Å; H53-R101 HydrophobicContact CB-CB 4.02Å; H53-R101 VanDerWaalsContact O-CD 3.3Å; H53-R101 WeakPolarHBondContact O-CD 3.35Å
54	Y	80.3	Confident	82.3	Confident	49 Å²	49	42.9 Å²	42.9	19%	0.192	23%	0.225	C	C	.	.			trans	-79.3	139.2	169.6	-73.3	-101.9	0	0	0	111.2	L49 T52 N58 V59 F68 L69 R101	L49-Y54 VanDerWaalsContact CD2-O 3.23Å; L49-Y54 WeakPolarHBondContact CD2-O 3.49Å; T52-Y54 VanDerWaalsContact O-CD2 3.32Å; T52-Y54 WeakPolarHBondContact O-CD2 3.47Å; T52-Y54 PolarHBondContact O-N 2.94Å; Y54-N58 HydrophobicContact CD1-CB 4.25Å; Y54-V59 VanDerWaalsContact CB-CG2 3.46Å; Y54-V59 HydrophobicContact CG-CG2 4.36Å; Y54-F68 HydrophobicContact CD1-CD2 4.08Å; Y54-F68 HydrophobicContact CD1-CE2 4.26Å; Y54-F68 HydrophobicContact CD2-CD2 4.35Å; Y54-F68 HydrophobicContact CD2-CE2 4.23Å; Y54-F68 AromaticContact CE1-CD2 3.8Å; Y54-F68 HydrophobicContact CE1-CD2 3.8Å; Y54-F68 HydrophobicContact CE1-CE2 4.42Å; Y54-F68 HydrophobicContact CE2-CD2 4.1Å; Y54-F68 HydrophobicContact CE2-CE2 4.4Å; Y54-F68 HydrophobicContact CG-CD2 4.36Å; Y54-F68 HydrophobicContact CG-CE2 4.18Å; Y54-F68 AromaticContact CZ-CD2 3.83Å; Y54-F68 PolarHBondContact OH-O 2.88Å; Y54-L69 HydrophobicContact CD2-CD2 4.01Å; Y54-L69 HydrophobicContact CE2-CD2 3.65Å; Y54-R101 HydrophobicContact CD1-CG 4.42Å; Y54-R101 HydrophobicContact CD2-CB 3.87Å; Y54-R101 HydrophobicContact CD2-CG 4.39Å; Y54-R101 HydrophobicContact CE1-CG 4.17Å; Y54-R101 HydrophobicContact CE2-CB 3.67Å; Y54-R101 HydrophobicContact CE2-CG 4.13Å; Y54-R101 HydrophobicContact CG-CB 4.4Å
55	S	77.7	Confident	82.4	Confident	26 Å²	26	43.3 Å²	43.3	18%	0.182	23%	0.228	C	C	.	.			trans	-71.4	148.8	172.2	33.2	0	0	0	0	110.6	A57 N58 V59 R101	S55-A57 PolarHBondContact O-N 3.02Å; S55-A57 VanDerWaalsContact O-N 3.14Å; S55-N58 WeakPolarHBondContact O-CB 3.42Å; S55-N58 PolarHBondContact O-N 2.88Å; S55-N58 PolarHBondContact OG-OD1 2.9Å; S55-V59 PolarHBondContact O-N 2.8Å; S55-R101 PolarHBondContact OG-NH1 2.92Å
56	R	81.1	Confident	82.4	Confident	56 Å²	56	43.3 Å²	43.3	21%	0.211	23%	0.227	C	C	.	.	H	α-helix	trans	-53.4	-40.2	-178.5	-177.1	160.9	-88.5	121.7	-5.9	112.5	C44 D46 L49 N58 V59 M60	C44-R56 PolarHBondContact O-NH2 3.39Å; D46-R56 IonicContact OD1-CZ 3.76Å; D46-R56 VanDerWaalsContact OD1-CZ 3.23Å; D46-R56 IonicContact OD1-NH1 3.96Å; D46-R56 PolarHBondContact OD1-NH1 2.76Å; D46-R56 IonicContact OD1-NH2 2.64Å; D46-R56 PolarHBondContact OD1-NH2 3.46Å; L49-R56 HydrophobicContact CD1-CB 3.77Å; L49-R56 HydrophobicContact CD1-CG 4.37Å; L49-R56 HydrophobicContact CD2-CB 4.44Å; R56-N58 VanDerWaalsContact C-N 3.28Å; R56-N58 PolarHBondContact O-N 2.84Å; R56-V59 PolarHBondContact O-N 2.87Å; R56-M60 HydrophobicContact CG-CG 3.93Å; R56-M60 WeakPolarHBondContact O-CG 3.29Å; R56-M60 PolarHBondContact O-N 2.91Å
57	A	73.1	Confident	82.8	Confident	45 Å²	45	46.2 Å²	46.2	37%	0.372	24%	0.239	S	C	.	.	H	α-helix	trans	-62.9	-29	177.1	0	0	0	0	0	113.8	S55 P322	S55-A57 PolarHBondContact O-N 3.02Å; S55-A57 VanDerWaalsContact O-N 3.14Å; A57-P322 HydrophobicContact CB-CB 4.35Å
58	N	79.9	Confident	82.9	Confident	51 Å²	51	47.8 Å²	47.8	27%	0.273	24%	0.244	S	C	.	.	H	α-helix	trans	-82.8	-19.8	180	-67	41	0	0	0	112.8	Y54 S55 R56 R62	Y54-N58 HydrophobicContact CD1-CB 4.25Å; S55-N58 WeakPolarHBondContact O-CB 3.42Å; S55-N58 PolarHBondContact O-N 2.88Å; S55-N58 PolarHBondContact OG-OD1 2.9Å; R56-N58 VanDerWaalsContact C-N 3.28Å; R56-N58 PolarHBondContact O-N 2.84Å; N58-R62 WeakPolarHBondContact O-CG 3.34Å; N58-R62 PolarHBondContact O-NE 3.35Å
59	V	83	Confident	82.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-98.2	-39.8	-175.2	176.1	0	0	0	0	112.3	I41 C44 F48 L49 Y54 S55 R56 R62 F68	I41-V59 HydrophobicContact CD1-CG1 4.04Å; I41-V59 WeakPolarHBondContact CD1-O 3.4Å; I41-V59 HydrophobicContact CG2-CG1 4.36Å; C44-V59 HydrophobicContact CB-CG1 3.8Å; F48-V59 HydrophobicContact CD1-CG1 4.21Å; F48-V59 HydrophobicContact CE1-CG1 3.66Å; F48-V59 HydrophobicContact CE1-CG2 4.02Å; L49-V59 HydrophobicContact CD2-CB 4.29Å; L49-V59 HydrophobicContact CD2-CG2 3.83Å; Y54-V59 VanDerWaalsContact CB-CG2 3.46Å; Y54-V59 HydrophobicContact CG-CG2 4.36Å; S55-V59 PolarHBondContact O-N 2.8Å; R56-V59 PolarHBondContact O-N 2.87Å; V59-R62 WeakPolarHBondContact O-CB 3.41Å; V59-R62 PolarHBondContact O-N 3.42Å; V59-F68 HydrophobicContact CG1-CZ 4.38Å; V59-F68 HydrophobicContact CG2-CE2 4.47Å; V59-F68 HydrophobicContact CG2-CZ 4.4Å
60	M	81.2	Confident	82.9	Confident	70 Å²	70	49.1 Å²	49.1	35%	0.345	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	147	176.4	-66.3	-71.5	-69.2	0	0	110.3	V42 R56 R62	V42-M60 VanDerWaalsContact O-CE 3.26Å; V42-M60 WeakPolarHBondContact O-CE 3.36Å; R56-M60 HydrophobicContact CG-CG 3.93Å; R56-M60 WeakPolarHBondContact O-CG 3.29Å; R56-M60 PolarHBondContact O-N 2.91Å; M60-R62 PolarHBondContact O-N 2.89Å
61	S	80.5	Confident	82.7	Confident	101 Å²	101	43.9 Å²	43.9	71%	0.706	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	-10.1	-175.2	81.5	0	0	0	0	118.4	I41	I41-S61 PolarHBondContact O-N 3.48Å
62	R	85.5	Confident	82.3	Confident	141 Å²	141	48 Å²	48	53%	0.532	26%	0.256	S	S	.	.	S	Bend	trans	-59.8	162.4	165.4	-63.5	-71.3	-175.9	171.1	-5.4	110.9	P40 I41 N58 V59 M60 F68	P40-R62 CarbonylContact C-O 3.55Å; P40-R62 WeakPolarHBondContact CA-O 3.21Å; I41-R62 WeakPolarHBondContact CB-O 3.46Å; I41-R62 HydrophobicContact CD1-CB 4.21Å; I41-R62 VanDerWaalsContact CG1-O 3.25Å; I41-R62 WeakPolarHBondContact CG1-O 3.4Å; I41-R62 PolarHBondContact N-O 2.91Å; N58-R62 WeakPolarHBondContact O-CG 3.34Å; N58-R62 PolarHBondContact O-NE 3.35Å; V59-R62 WeakPolarHBondContact O-CB 3.41Å; V59-R62 PolarHBondContact O-N 3.42Å; M60-R62 PolarHBondContact O-N 2.89Å; R62-F68 HydrophobicContact CB-CD1 4.09Å; R62-F68 HydrophobicContact CB-CE1 3.86Å; R62-F68 HydrophobicContact CG-CD1 4.2Å; R62-F68 HydrophobicContact CG-CE1 4.2Å
63	S	88.5	Confident	82	Confident	25 Å²	25	52.9 Å²	52.9	18%	0.175	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-67.3	137.1	173	-176.4	0	0	0	0	112.1	Y38 I65 C66	Y38-S63 WeakPolarHBondContact O-CA 3.39Å; Y38-S63 WeakPolarHBondContact O-CB 3.23Å; Y38-S63 PolarHBondContact O-OG 3.01Å; S63-I65 PolarHBondContact O-N 2.92Å; S63-I65 WeakPolarHBondContact OG-CB 3.41Å; S63-I65 PolarHBondContact OG-N 3.1Å; S63-C66 PolarHBondContact O-N 3.18Å
64	S	87.1	Confident	82.1	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-4.2	173.7	64.8	0	0	0	0	114.5	Y39 C66 F86	Y39-S64 WeakPolarHBondContact CB-OG 3.41Å; Y39-S64 WeakPolarHBondContact O-CB 3.03Å; Y39-S64 PolarHBondContact O-N 3.5Å; Y39-S64 PolarHBondContact O-OG 2.96Å; Y39-S64 VanDerWaalsContact O-OG 3.1Å; S64-C66 PolarHBondContact O-N 2.85Å; S64-F86 WeakPolarHBondContact O-CZ 3.29Å; S64-F86 WeakPolarHBondContact OG-CE1 3.38Å
65	I	89	Confident	82.2	Confident	9 Å²	9	48.6 Å²	48.6	5%	0.046	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-22	162.5	-62.6	167.8	0	0	0	110.2	Y39 S63 Q67 W70 I82 F86	Y39-I65 HydrophobicContact CD2-CD1 3.94Å; Y39-I65 HydrophobicContact CD2-CG1 4.23Å; Y39-I65 HydrophobicContact CE2-CD1 4.23Å; S63-I65 PolarHBondContact O-N 2.92Å; S63-I65 WeakPolarHBondContact OG-CB 3.41Å; S63-I65 PolarHBondContact OG-N 3.1Å; I65-Q67 VanDerWaalsContact C-N 3.31Å; I65-Q67 HydrophobicContact CB-CG 4.25Å; I65-Q67 HydrophobicContact CG2-CG 3.64Å; I65-Q67 PolarHBondContact O-N 3.23Å; I65-W70 HydrophobicContact CG2-CH2 3.89Å; I65-W70 HydrophobicContact CG2-CZ2 3.53Å; I65-I82 HydrophobicContact CG2-CG2 4.1Å; I65-F86 HydrophobicContact CB-CD2 4.41Å; I65-F86 HydrophobicContact CB-CE2 4.38Å; I65-F86 HydrophobicContact CD1-CB 4.5Å; I65-F86 HydrophobicContact CG1-CB 4.26Å; I65-F86 HydrophobicContact CG1-CD1 4.35Å; I65-F86 HydrophobicContact CG1-CD2 3.55Å; I65-F86 HydrophobicContact CG1-CE2 3.91Å; I65-F86 HydrophobicContact CG1-CG 3.79Å; I65-F86 HydrophobicContact CG1-CZ 4.45Å
66	C	84.7	Confident	82.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.286	C	S	.	.			trans	54.5	41.8	176.9	-67.7	0	0	0	0	113.9	S63 S64 F68 L69 Y145	S63-C66 PolarHBondContact O-N 3.18Å; S64-C66 PolarHBondContact O-N 2.85Å; C66-F68 HydrophobicContact CB-CE1 4.02Å; C66-F68 HydrophobicContact CB-CZ 4.25Å; C66-F68 PolarHBondContact O-N 3.4Å; C66-L69 HydrophobicContact CB-CD1 4.09Å; C66-L69 HydrophobicContact CB-CG 4.34Å; C66-L69 WeakPolarHBondContact O-CB 3.42Å; C66-L69 PolarHBondContact O-N 2.86Å; C66-Y145 VanDerWaalsContact CB-OH 3.28Å; C66-Y145 WeakPolarHBondContact CB-OH 3.29Å; C66-Y145 PolarHBondContact SG-OH 3.37Å
67	Q	85.4	Confident	82.8	Confident	105 Å²	105	53.1 Å²	53.1	49%	0.491	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-52.5	-26.7	175.3	-61.9	176.7	-27.6	0	0	113.3	I65 L69 W70	I65-Q67 VanDerWaalsContact C-N 3.31Å; I65-Q67 HydrophobicContact CB-CG 4.25Å; I65-Q67 HydrophobicContact CG2-CG 3.64Å; I65-Q67 PolarHBondContact O-N 3.23Å; Q67-L69 PolarHBondContact O-N 3.22Å; Q67-W70 HydrophobicContact CB-CD2 4.34Å; Q67-W70 HydrophobicContact CB-CE3 4.29Å; Q67-W70 HydrophobicContact CB-CZ3 4.5Å; Q67-W70 HydrophobicContact CG-CD2 4.43Å; Q67-W70 HydrophobicContact CG-CE3 4.22Å; Q67-W70 HydrophobicContact CG-CH2 3.87Å; Q67-W70 HydrophobicContact CG-CZ2 4.04Å; Q67-W70 HydrophobicContact CG-CZ3 3.95Å; Q67-W70 WeakPolarHBondContact O-CB 3.15Å; Q67-W70 PolarHBondContact O-N 3.02Å; Q67-W70 VanDerWaalsContact O-N 3.16Å
68	F	85.1	Confident	83.4	Confident	42 Å²	42	51.5 Å²	51.5	18%	0.184	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-69.5	-7.1	176.2	65.7	-94.1	0	0	0	114.6	I41 F48 Y54 V59 R62 C66	I41-F68 HydrophobicContact CD1-CE1 4.35Å; F48-F68 HydrophobicContact CE1-CZ 4.47Å; F48-F68 HydrophobicContact CZ-CE2 4.46Å; F48-F68 HydrophobicContact CZ-CZ 4.2Å; Y54-F68 HydrophobicContact CD1-CD2 4.08Å; Y54-F68 HydrophobicContact CD1-CE2 4.26Å; Y54-F68 HydrophobicContact CD2-CD2 4.35Å; Y54-F68 HydrophobicContact CD2-CE2 4.23Å; Y54-F68 AromaticContact CE1-CD2 3.8Å; Y54-F68 HydrophobicContact CE1-CD2 3.8Å; Y54-F68 HydrophobicContact CE1-CE2 4.42Å; Y54-F68 HydrophobicContact CE2-CD2 4.1Å; Y54-F68 HydrophobicContact CE2-CE2 4.4Å; Y54-F68 HydrophobicContact CG-CD2 4.36Å; Y54-F68 HydrophobicContact CG-CE2 4.18Å; Y54-F68 AromaticContact CZ-CD2 3.83Å; Y54-F68 PolarHBondContact OH-O 2.88Å; V59-F68 HydrophobicContact CG1-CZ 4.38Å; V59-F68 HydrophobicContact CG2-CE2 4.47Å; V59-F68 HydrophobicContact CG2-CZ 4.4Å; R62-F68 HydrophobicContact CB-CD1 4.09Å; R62-F68 HydrophobicContact CB-CE1 3.86Å; R62-F68 HydrophobicContact CG-CD1 4.2Å; R62-F68 HydrophobicContact CG-CE1 4.2Å; C66-F68 HydrophobicContact CB-CE1 4.02Å; C66-F68 HydrophobicContact CB-CZ 4.25Å; C66-F68 PolarHBondContact O-N 3.4Å
69	L	86.4	Confident	83.9	Confident	1 Å²	1	53 Å²	53	1%	0.005	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-100.6	-2.8	172.8	-61.3	-178.6	0	0	0	113	F48 T52 Y54 C66 Q67 F98 Y99 Y145	F48-L69 HydrophobicContact CE2-CD1 4.03Å; F48-L69 HydrophobicContact CZ-CD1 3.97Å; T52-L69 HydrophobicContact CG2-CD1 4.01Å; T52-L69 HydrophobicContact CG2-CD2 3.9Å; Y54-L69 HydrophobicContact CD2-CD2 4.01Å; Y54-L69 HydrophobicContact CE2-CD2 3.65Å; C66-L69 HydrophobicContact CB-CD1 4.09Å; C66-L69 HydrophobicContact CB-CG 4.34Å; C66-L69 WeakPolarHBondContact O-CB 3.42Å; C66-L69 PolarHBondContact O-N 2.86Å; Q67-L69 PolarHBondContact O-N 3.22Å; L69-F98 HydrophobicContact CB-CB 4.06Å; L69-F98 HydrophobicContact CB-CD1 3.7Å; L69-F98 HydrophobicContact CB-CE1 4.44Å; L69-F98 HydrophobicContact CB-CG 4.05Å; L69-F98 HydrophobicContact CD1-CG 4.42Å; L69-F98 CarbonylContact O-C 3.56Å; L69-F98 VanDerWaalsContact O-CA 3.31Å; L69-F98 WeakPolarHBondContact O-CA 3.32Å; L69-Y99 PolarHBondContact O-N 2.86Å; L69-Y145 HydrophobicContact CD1-CE1 3.92Å
70	W	85.7	Confident	84.1	Confident	49 Å²	49	58.5 Å²	58.5	19%	0.186	32%	0.315	C	S	.	.			trans	-82.6	136.8	-177.9	-59.2	-3.7	0	0	0	110.6	I65 Q67 T74 R79 F98	I65-W70 HydrophobicContact CG2-CH2 3.89Å; I65-W70 HydrophobicContact CG2-CZ2 3.53Å; Q67-W70 HydrophobicContact CB-CD2 4.34Å; Q67-W70 HydrophobicContact CB-CE3 4.29Å; Q67-W70 HydrophobicContact CB-CZ3 4.5Å; Q67-W70 HydrophobicContact CG-CD2 4.43Å; Q67-W70 HydrophobicContact CG-CE3 4.22Å; Q67-W70 HydrophobicContact CG-CH2 3.87Å; Q67-W70 HydrophobicContact CG-CZ2 4.04Å; Q67-W70 HydrophobicContact CG-CZ3 3.95Å; Q67-W70 WeakPolarHBondContact O-CB 3.15Å; Q67-W70 PolarHBondContact O-N 3.02Å; Q67-W70 VanDerWaalsContact O-N 3.16Å; W70-T74 HydrophobicContact CB-CG2 4.24Å; W70-T74 HydrophobicContact CG-CG2 4.11Å; W70-R79 HydrophobicContact CD2-CG 4Å; W70-R79 HydrophobicContact CE3-CB 4.32Å; W70-R79 HydrophobicContact CE3-CG 3.77Å; W70-R79 HydrophobicContact CH2-CB 3.92Å; W70-R79 HydrophobicContact CH2-CG 4.19Å; W70-R79 HydrophobicContact CZ2-CB 4.39Å; W70-R79 HydrophobicContact CZ2-CG 4.43Å; W70-R79 HydrophobicContact CZ3-CB 3.89Å; W70-R79 HydrophobicContact CZ3-CG 3.87Å; W70-F98 AromaticContact CD1-CE1 3.72Å; W70-F98 AromaticContact NE1-CE1 3.88Å
71	G	76.9	Confident	84.5	Confident	22 Å²	22	58.3 Å²	58.3	23%	0.227	31%	0.313	C	S	.	.			trans	-140.3	-160.3	173.9	0	0	0	0	0	111.6	E73 T74 R79 Y99	G71-E73 PolarHBondContact O-N 3.31Å; G71-T74 PolarHBondContact N-OG1 3.25Å; G71-T74 WeakPolarHBondContact O-CB 3.44Å; G71-T74 PolarHBondContact O-N 2.92Å; G71-T74 VanDerWaalsContact O-N 3.17Å; G71-T74 PolarHBondContact O-OG1 2.96Å; G71-R79 PolarHBondContact O-NH2 3.34Å; G71-Y99 VanDerWaalsContact CA-CD2 3.41Å
72	S	74.3	Confident	84.9	Confident	107 Å²	107	53.5 Å²	53.5	75%	0.748	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-46.3	-170.8	39	0	0	0	0	113.6	T74 Y99	S72-T74 VanDerWaalsContact C-N 3.26Å; S72-T74 PolarHBondContact O-N 2.71Å; S72-Y99 PolarHBondContact OG-OH 3.21Å; S72-Y99 VanDerWaalsContact OG-OH 3.11Å
73	E	77.9	Confident	85.1	Confident	103 Å²	103	49 Å²	49	48%	0.481	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-10.4	179.9	-68.8	160.2	-122.8	0	0	114.1	G71 T75 V97 Y99	G71-E73 PolarHBondContact O-N 3.31Å; E73-T75 PolarHBondContact O-N 3.3Å; E73-V97 HydrophobicContact CB-CB 4.16Å; E73-V97 HydrophobicContact CB-CG1 3.88Å; E73-V97 HydrophobicContact CB-CG2 4.45Å; E73-Y99 HydrophobicContact CB-CE2 4.47Å; E73-Y99 VanDerWaalsContact CB-OH 3.28Å; E73-Y99 WeakPolarHBondContact CB-OH 3.43Å; E73-Y99 VanDerWaalsContact CD-OH 3.29Å; E73-Y99 VanDerWaalsContact CG-OH 3.29Å; E73-Y99 WeakPolarHBondContact CG-OH 3.41Å; E73-Y99 PolarHBondContact N-OH 3.41Å; E73-Y99 PolarHBondContact OE1-OH 2.65Å
74	T	81.8	Confident	85.2	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	28%	0.279	C	S	.	.	S	Bend	trans	-72.7	93.8	176	-43.3	0	0	0	0	109	W70 G71 S72 R79 V97	W70-T74 HydrophobicContact CB-CG2 4.24Å; W70-T74 HydrophobicContact CG-CG2 4.11Å; G71-T74 PolarHBondContact N-OG1 3.25Å; G71-T74 WeakPolarHBondContact O-CB 3.44Å; G71-T74 PolarHBondContact O-N 2.92Å; G71-T74 VanDerWaalsContact O-N 3.17Å; G71-T74 PolarHBondContact O-OG1 2.96Å; S72-T74 VanDerWaalsContact C-N 3.26Å; S72-T74 PolarHBondContact O-N 2.71Å; T74-R79 HydrophobicContact CG2-CG 4.17Å; T74-R79 VanDerWaalsContact O-CZ 3.23Å; T74-R79 PolarHBondContact O-NE 3.23Å; T74-R79 PolarHBondContact O-NH2 3.17Å; T74-V97 WeakPolarHBondContact CB-O 3.13Å; T74-V97 WeakPolarHBondContact CG2-O 3.4Å; T74-V97 PolarHBondContact OG1-O 2.76Å
75	T	82.6	Confident	85.3	Confident	67 Å²	67	52.3 Å²	52.3	41%	0.411	28%	0.279	S	S	.	.			trans	-56.3	144.9	-171.7	56.6	0	0	0	0	113.7	E73 T77 V78 R79	E73-T75 PolarHBondContact O-N 3.3Å; T75-T77 VanDerWaalsContact C-N 3.26Å; T75-T77 PolarHBondContact O-N 2.92Å; T75-T77 PolarHBondContact OG1-OG1 2.97Å; T75-V78 PolarHBondContact O-N 2.71Å; T75-V78 WeakPolarHBondContact OG1-CG2 3.26Å; T75-R79 WeakPolarHBondContact O-CG 3.22Å; T75-R79 PolarHBondContact O-N 3.16Å; T75-R79 VanDerWaalsContact O-N 3.11Å
76	P	83.9	Confident	85.3	Confident	92 Å²	92	51.9 Å²	51.9	60%	0.597	28%	0.276	S	S	*	.	H	α-helix	trans	-64.1	-30	-177	25.2	-34.2	0	0	0	112.9	R79 M80	P76-R79 PolarHBondContact O-N 3.33Å; P76-M80 WeakPolarHBondContact O-CG 3.43Å; P76-M80 PolarHBondContact O-N 3.38Å
77	T	86.6	Confident	85.5	Confident	84 Å²	84	57.4 Å²	57.4	52%	0.515	30%	0.302	S	S	.	.	H	α-helix	trans	-59.6	-51.6	172.5	47.7	0	0	0	0	111.5	T75 R79 M80 E81	T75-T77 VanDerWaalsContact C-N 3.26Å; T75-T77 PolarHBondContact O-N 2.92Å; T75-T77 PolarHBondContact OG1-OG1 2.97Å; T77-R79 VanDerWaalsContact C-N 3.3Å; T77-R79 PolarHBondContact O-N 3.04Å; T77-M80 PolarHBondContact O-N 3.01Å; T77-E81 WeakPolarHBondContact O-CG 3.5Å; T77-E81 PolarHBondContact O-N 3.11Å
78	V	86.4	Confident	85.6	Confident	12 Å²	12	57.7 Å²	57.7	7%	0.073	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-36.6	176.7	168.6	0	0	0	0	111.6	T75 E81 I82 A96	T75-V78 PolarHBondContact O-N 2.71Å; T75-V78 WeakPolarHBondContact OG1-CG2 3.26Å; V78-E81 PolarHBondContact O-N 3.05Å; V78-I82 HydrophobicContact CG1-CD1 3.76Å; V78-I82 HydrophobicContact CG1-CG1 4.4Å; V78-I82 WeakPolarHBondContact O-CB 3.12Å; V78-I82 WeakPolarHBondContact O-CD1 3.42Å; V78-I82 WeakPolarHBondContact O-CG1 3.34Å; V78-I82 PolarHBondContact O-N 2.9Å; V78-A96 HydrophobicContact CG1-CB 4.01Å
79	R	88.9	Confident	85.7	Confident	81 Å²	81	58.9 Å²	58.9	31%	0.306	31%	0.313	S	S	.	.	H	α-helix	trans	-62.3	-42.1	173	-61.7	178	-159.7	-171.3	4.5	111.8	W70 G71 T74 T75 P76 T77 N83	W70-R79 HydrophobicContact CD2-CG 4Å; W70-R79 HydrophobicContact CE3-CB 4.32Å; W70-R79 HydrophobicContact CE3-CG 3.77Å; W70-R79 HydrophobicContact CH2-CB 3.92Å; W70-R79 HydrophobicContact CH2-CG 4.19Å; W70-R79 HydrophobicContact CZ2-CB 4.39Å; W70-R79 HydrophobicContact CZ2-CG 4.43Å; W70-R79 HydrophobicContact CZ3-CB 3.89Å; W70-R79 HydrophobicContact CZ3-CG 3.87Å; G71-R79 PolarHBondContact O-NH2 3.34Å; T74-R79 HydrophobicContact CG2-CG 4.17Å; T74-R79 VanDerWaalsContact O-CZ 3.23Å; T74-R79 PolarHBondContact O-NE 3.23Å; T74-R79 PolarHBondContact O-NH2 3.17Å; T75-R79 WeakPolarHBondContact O-CG 3.22Å; T75-R79 PolarHBondContact O-N 3.16Å; T75-R79 VanDerWaalsContact O-N 3.11Å; P76-R79 PolarHBondContact O-N 3.33Å; T77-R79 VanDerWaalsContact C-N 3.3Å; T77-R79 PolarHBondContact O-N 3.04Å; R79-N83 WeakPolarHBondContact O-CB 3.45Å; R79-N83 VanDerWaalsContact O-CG 3.32Å; R79-N83 PolarHBondContact O-N 3.46Å; R79-N83 VanDerWaalsContact O-N 3.09Å; R79-N83 PolarHBondContact O-ND2 3.15Å; R79-N83 VanDerWaalsContact O-ND2 3.11Å
80	M	88.1	Confident	85.8	Confident	117 Å²	117	62.7 Å²	62.7	58%	0.576	33%	0.328	S	S	*	.	H	α-helix	trans	-68	-45.6	176.2	-71.7	-178.2	72.2	0	0	112.1	P76 T77 I82 N83 Q84	P76-M80 WeakPolarHBondContact O-CG 3.43Å; P76-M80 PolarHBondContact O-N 3.38Å; T77-M80 PolarHBondContact O-N 3.01Å; M80-I82 PolarHBondContact O-N 3.43Å; M80-N83 PolarHBondContact O-N 3.02Å; M80-Q84 WeakPolarHBondContact O-CB 3.43Å; M80-Q84 WeakPolarHBondContact O-CG 3.38Å; M80-Q84 PolarHBondContact O-N 3.06Å
81	E	89.8	Confident	85.9	Confident	66 Å²	66	67 Å²	67	31%	0.308	35%	0.35	S	S	.	.	H	α-helix	trans	-59.2	-43.2	177.7	-72.3	173.6	-161.3	0	0	112.2	T77 V78 Q84 A85 Y90 Y92 N94	T77-E81 WeakPolarHBondContact O-CG 3.5Å; T77-E81 PolarHBondContact O-N 3.11Å; V78-E81 PolarHBondContact O-N 3.05Å; E81-Q84 PolarHBondContact O-N 3.19Å; E81-A85 WeakPolarHBondContact O-CB 3.49Å; E81-A85 PolarHBondContact O-N 3.27Å; E81-Y90 PolarHBondContact O-OH 3.4Å; E81-Y92 HydrophobicContact CB-CD2 4.43Å; E81-Y92 HydrophobicContact CB-CE2 3.57Å; E81-Y92 HydrophobicContact CG-CE2 4.39Å; E81-Y92 WeakPolarHBondContact OE2-CE2 3.46Å; E81-Y92 PolarHBondContact OE2-OH 3.39Å; E81-Y92 VanDerWaalsContact OE2-OH 3.07Å; E81-N94 PolarHBondContact OE2-ND2 3.42Å
82	I	88.9	Confident	86.5	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-63.4	-48.7	174.7	-68.3	167.6	0	0	0	110.3	I65 V78 M80 Q84 A85 F86 Y92 F126	I65-I82 HydrophobicContact CG2-CG2 4.1Å; V78-I82 HydrophobicContact CG1-CD1 3.76Å; V78-I82 HydrophobicContact CG1-CG1 4.4Å; V78-I82 WeakPolarHBondContact O-CB 3.12Å; V78-I82 WeakPolarHBondContact O-CD1 3.42Å; V78-I82 WeakPolarHBondContact O-CG1 3.34Å; V78-I82 PolarHBondContact O-N 2.9Å; M80-I82 PolarHBondContact O-N 3.43Å; I82-Q84 VanDerWaalsContact C-N 3.31Å; I82-Q84 PolarHBondContact O-N 3.19Å; I82-A85 WeakPolarHBondContact O-CB 3.48Å; I82-A85 PolarHBondContact O-N 3.49Å; I82-F86 HydrophobicContact CG2-CD2 4Å; I82-F86 HydrophobicContact CG2-CE2 3.93Å; I82-F86 WeakPolarHBondContact O-CD2 3.42Å; I82-F86 PolarHBondContact O-N 3.04Å; I82-Y92 HydrophobicContact CD1-CE1 4.24Å; I82-Y92 HydrophobicContact CG1-CD1 4.03Å; I82-Y92 HydrophobicContact CG1-CE1 3.36Å; I82-F126 HydrophobicContact CD1-CD1 3.87Å; I82-F126 HydrophobicContact CD1-CE1 3.85Å; I82-F126 HydrophobicContact CG1-CD1 4.15Å; I82-F126 HydrophobicContact CG1-CE1 3.98Å; I82-F126 HydrophobicContact CG2-CE1 4.19Å
83	N	89.9	Confident	87.2	Confident	47 Å²	47	69.5 Å²	69.5	25%	0.251	34%	0.336	S	S	.	.	H	α-helix	trans	-58.5	-43.4	178.5	-79.8	-35.7	0	0	0	111.6	R79 M80 F86 H87	R79-N83 WeakPolarHBondContact O-CB 3.45Å; R79-N83 VanDerWaalsContact O-CG 3.32Å; R79-N83 PolarHBondContact O-N 3.46Å; R79-N83 VanDerWaalsContact O-N 3.09Å; R79-N83 PolarHBondContact O-ND2 3.15Å; R79-N83 VanDerWaalsContact O-ND2 3.11Å; M80-N83 PolarHBondContact O-N 3.02Å; N83-F86 PolarHBondContact O-N 3.43Å; N83-H87 PolarHBondContact O-N 2.98Å; N83-H87 VanDerWaalsContact O-N 3.15Å; N83-H87 PolarHBondContact O-ND1 3.45Å
84	Q	89.1	Confident	87.6	Confident	94 Å²	94	67.6 Å²	67.6	44%	0.439	33%	0.329	S	S	.	.	H	α-helix	trans	-63.6	-38.8	176.4	-73.7	177	-1.1	0	0	112.2	M80 E81 I82 F86 H87 N88 Y90	M80-Q84 WeakPolarHBondContact O-CB 3.43Å; M80-Q84 WeakPolarHBondContact O-CG 3.38Å; M80-Q84 PolarHBondContact O-N 3.06Å; E81-Q84 PolarHBondContact O-N 3.19Å; I82-Q84 VanDerWaalsContact C-N 3.31Å; I82-Q84 PolarHBondContact O-N 3.19Å; Q84-F86 VanDerWaalsContact C-N 3.34Å; Q84-F86 PolarHBondContact O-N 2.81Å; Q84-H87 PolarHBondContact O-N 2.66Å; Q84-N88 VanDerWaalsContact O-CB 3.31Å; Q84-N88 WeakPolarHBondContact O-CB 3.28Å; Q84-N88 PolarHBondContact O-N 2.72Å; Q84-Y90 HydrophobicContact CB-CE1 4.28Å; Q84-Y90 VanDerWaalsContact CB-OH 3.27Å; Q84-Y90 WeakPolarHBondContact CB-OH 3.31Å; Q84-Y90 WeakPolarHBondContact O-CE1 3.29Å
85	A	89.7	Confident	87.9	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.2	-41.7	177.9	0	0	0	0	0	113.2	E81 I82 H89 Y90 Y92	E81-A85 WeakPolarHBondContact O-CB 3.49Å; E81-A85 PolarHBondContact O-N 3.27Å; I82-A85 WeakPolarHBondContact O-CB 3.48Å; I82-A85 PolarHBondContact O-N 3.49Å; A85-H89 PolarHBondContact O-N 3.5Å; A85-H89 VanDerWaalsContact O-N 3.16Å; A85-Y90 HydrophobicContact CB-CD2 3.95Å; A85-Y90 HydrophobicContact CB-CE1 4.48Å; A85-Y90 HydrophobicContact CB-CE2 3.48Å; A85-Y90 VanDerWaalsContact CB-CE2 3.48Å; A85-Y90 PolarHBondContact N-OH 3.02Å; A85-Y90 PolarHBondContact O-N 3.07Å; A85-Y92 VanDerWaalsContact CB-CB 3.49Å; A85-Y92 HydrophobicContact CB-CG 4.09Å
86	F	90.4	Very high	88	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-70.4	-40.8	176.5	-81.9	-80.2	0	0	0	112.8	Y39 S64 I65 I82 N83 Q84 V128 F141	Y39-F86 HydrophobicContact CD2-CB 3.93Å; Y39-F86 AromaticContact CD2-CD1 3.89Å; Y39-F86 HydrophobicContact CD2-CD1 3.89Å; Y39-F86 HydrophobicContact CD2-CG 4.16Å; Y39-F86 HydrophobicContact CE2-CB 3.65Å; Y39-F86 HydrophobicContact CE2-CD1 4.41Å; Y39-F86 HydrophobicContact CE2-CG 4.38Å; Y39-F86 HydrophobicContact CG-CD1 4.03Å; Y39-F86 PolarHBondContact OH-O 2.64Å; S64-F86 WeakPolarHBondContact O-CZ 3.29Å; S64-F86 WeakPolarHBondContact OG-CE1 3.38Å; I65-F86 HydrophobicContact CB-CD2 4.41Å; I65-F86 HydrophobicContact CB-CE2 4.38Å; I65-F86 HydrophobicContact CD1-CB 4.5Å; I65-F86 HydrophobicContact CG1-CB 4.26Å; I65-F86 HydrophobicContact CG1-CD1 4.35Å; I65-F86 HydrophobicContact CG1-CD2 3.55Å; I65-F86 HydrophobicContact CG1-CE2 3.91Å; I65-F86 HydrophobicContact CG1-CG 3.79Å; I65-F86 HydrophobicContact CG1-CZ 4.45Å; I82-F86 HydrophobicContact CG2-CD2 4Å; I82-F86 HydrophobicContact CG2-CE2 3.93Å; I82-F86 WeakPolarHBondContact O-CD2 3.42Å; I82-F86 PolarHBondContact O-N 3.04Å; N83-F86 PolarHBondContact O-N 3.43Å; Q84-F86 VanDerWaalsContact C-N 3.34Å; Q84-F86 PolarHBondContact O-N 2.81Å; F86-V128 HydrophobicContact CE1-CG1 4.03Å; F86-V128 HydrophobicContact CE2-CG1 4.01Å; F86-V128 HydrophobicContact CE2-CG2 3.83Å; F86-V128 HydrophobicContact CZ-CG1 3.73Å; F86-V128 HydrophobicContact CZ-CG2 4.02Å; F86-F141 HydrophobicContact CD1-CB 4.37Å; F86-F141 HydrophobicContact CD1-CD1 4.01Å; F86-F141 AromaticContact CD1-CD2 3.61Å; F86-F141 HydrophobicContact CD1-CD2 3.61Å; F86-F141 HydrophobicContact CD1-CE1 4.08Å; F86-F141 AromaticContact CD1-CE2 3.7Å; F86-F141 HydrophobicContact CD1-CE2 3.7Å; F86-F141 AromaticContact CD1-CG 3.76Å; F86-F141 HydrophobicContact CD1-CG 3.76Å; F86-F141 AromaticContact CD1-CZ 3.92Å; F86-F141 HydrophobicContact CD1-CZ 3.92Å; F86-F141 HydrophobicContact CE1-CB 3.67Å; F86-F141 AromaticContact CE1-CD1 3.98Å; F86-F141 HydrophobicContact CE1-CD1 3.98Å; F86-F141 AromaticContact CE1-CD2 3.76Å; F86-F141 HydrophobicContact CE1-CD2 3.76Å; F86-F141 HydrophobicContact CE1-CE2 4.32Å; F86-F141 AromaticContact CE1-CG 3.56Å; F86-F141 HydrophobicContact CE1-CG 3.56Å; F86-F141 WeakPolarHBondContact O-CZ 3.44Å
87	H	87.1	Confident	88.1	Confident	115 Å²	115	69.1 Å²	69.1	53%	0.532	32%	0.319	S	S	.	.	H	α-helix	trans	-71.9	-42.3	179	-72.9	82.5	0	0	0	113	N83 Q84 H89	N83-H87 PolarHBondContact O-N 2.98Å; N83-H87 VanDerWaalsContact O-N 3.15Å; N83-H87 PolarHBondContact O-ND1 3.45Å; Q84-H87 PolarHBondContact O-N 2.66Å; H87-H89 VanDerWaalsContact C-N 3.34Å
88	N	87.3	Confident	88.1	Confident	111 Å²	111	65.1 Å²	65.1	59%	0.594	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	6.3	-175.1	-64.1	-11.4	0	0	0	113	Q84 Y90	Q84-N88 VanDerWaalsContact O-CB 3.31Å; Q84-N88 WeakPolarHBondContact O-CB 3.28Å; Q84-N88 PolarHBondContact O-N 2.72Å; N88-Y90 VanDerWaalsContact C-N 3.27Å; N88-Y90 HydrophobicContact CB-CD1 3.58Å; N88-Y90 HydrophobicContact CB-CE1 3.8Å; N88-Y90 PolarHBondContact O-N 3.38Å; N88-Y90 VanDerWaalsContact O-N 3.16Å
89	H	88.6	Confident	87.9	Confident	67 Å²	67	65.6 Å²	65.6	31%	0.31	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	33.9	174.5	-66.4	-65.6	0	0	0	115.4	A85 H87 R132 V138 F141	A85-H89 PolarHBondContact O-N 3.5Å; A85-H89 VanDerWaalsContact O-N 3.16Å; H87-H89 VanDerWaalsContact C-N 3.34Å; H89-R132 PolarHBondContact O-NH2 3.45Å; H89-V138 HydrophobicContact CB-CG2 3.98Å; H89-F141 AromaticContact ND1-CE2 3.96Å; H89-F141 AromaticContact ND1-CZ 3.36Å; H89-F141 WeakPolarHBondContact ND1-CZ 3.31Å
90	Y	87.7	Confident	87.4	Confident	81 Å²	81	62.1 Å²	62.1	32%	0.318	28%	0.283	S	S	.	.			trans	-97.8	168.9	176.1	64.7	-106.6	0	0	0	113.1	E81 Q84 A85 N88 Y92	E81-Y90 PolarHBondContact O-OH 3.4Å; Q84-Y90 HydrophobicContact CB-CE1 4.28Å; Q84-Y90 VanDerWaalsContact CB-OH 3.27Å; Q84-Y90 WeakPolarHBondContact CB-OH 3.31Å; Q84-Y90 WeakPolarHBondContact O-CE1 3.29Å; A85-Y90 HydrophobicContact CB-CD2 3.95Å; A85-Y90 HydrophobicContact CB-CE1 4.48Å; A85-Y90 HydrophobicContact CB-CE2 3.48Å; A85-Y90 VanDerWaalsContact CB-CE2 3.48Å; A85-Y90 PolarHBondContact N-OH 3.02Å; A85-Y90 PolarHBondContact O-N 3.07Å; N88-Y90 VanDerWaalsContact C-N 3.27Å; N88-Y90 HydrophobicContact CB-CD1 3.58Å; N88-Y90 HydrophobicContact CB-CE1 3.8Å; N88-Y90 PolarHBondContact O-N 3.38Å; N88-Y90 VanDerWaalsContact O-N 3.16Å; Y90-Y92 HydrophobicContact CE2-CD2 4.41Å
91	E	87.3	Confident	86.6	Confident	139 Å²	139	59.6 Å²	59.6	65%	0.65	27%	0.267	S	S	*	.			trans	-88.7	119.4	175.8	-178.4	169.2	168.3	0	0	109.3	V128 T129	E91-V128 WeakPolarHBondContact CA-O 3.17Å; E91-T129 HydrophobicContact CG-CG2 3.89Å
92	Y	89.8	Confident	85	Confident	15 Å²	15	58.7 Å²	58.7	6%	0.059	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	137.3	-178.7	174.3	-105.5	0	0	0	111.1	E81 I82 A85 Y90 N94 F126 T127 V128	E81-Y92 HydrophobicContact CB-CD2 4.43Å; E81-Y92 HydrophobicContact CB-CE2 3.57Å; E81-Y92 HydrophobicContact CG-CE2 4.39Å; E81-Y92 WeakPolarHBondContact OE2-CE2 3.46Å; E81-Y92 PolarHBondContact OE2-OH 3.39Å; E81-Y92 VanDerWaalsContact OE2-OH 3.07Å; I82-Y92 HydrophobicContact CD1-CE1 4.24Å; I82-Y92 HydrophobicContact CG1-CD1 4.03Å; I82-Y92 HydrophobicContact CG1-CE1 3.36Å; A85-Y92 VanDerWaalsContact CB-CB 3.49Å; A85-Y92 HydrophobicContact CB-CG 4.09Å; Y90-Y92 HydrophobicContact CE2-CD2 4.41Å; Y92-N94 HydrophobicContact CE1-CB 4.01Å; Y92-N94 HydrophobicContact CE2-CB 3.79Å; Y92-N94 VanDerWaalsContact CZ-CB 3.4Å; Y92-N94 WeakPolarHBondContact OH-CB 3.45Å; Y92-F126 HydrophobicContact CD1-CD1 4.33Å; Y92-F126 HydrophobicContact CE1-CD1 4.13Å; Y92-T127 CarbonylContact O-C 3.5Å; Y92-T127 WeakPolarHBondContact O-CA 3.48Å; Y92-V128 HydrophobicContact CD1-CG2 4.46Å; Y92-V128 PolarHBondContact N-O 3.03Å; Y92-V128 PolarHBondContact O-N 2.96Å
93	R	90	Very high	82.6	Confident	168 Å²	168	60.2 Å²	60.2	63%	0.634	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.6	115.4	173.3	179.4	170.7	-175.3	-169.5	-0.4	109.7	D125 F126 T127	R93-D125 IonicContact CZ-OD2 3.42Å; R93-D125 IonicContact NE-OD2 2.91Å; R93-D125 PolarHBondContact NE-OD2 2.93Å; R93-D125 IonicContact NH2-OD2 2.71Å; R93-D125 PolarHBondContact NH2-OD2 3.03Å; R93-F126 WeakPolarHBondContact CA-O 3.17Å; R93-T127 HydrophobicContact CB-CG2 3.95Å; R93-T127 HydrophobicContact CG-CG2 3.62Å
94	N	86.5	Confident	79.8	Confident	62 Å²	62	65.1 Å²	65.1	33%	0.332	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	169.3	173.1	-155.5	-10.3	0	0	0	109	E81 Y92 F126	E81-N94 PolarHBondContact OE2-ND2 3.42Å; Y92-N94 HydrophobicContact CE1-CB 4.01Å; Y92-N94 HydrophobicContact CE2-CB 3.79Å; Y92-N94 VanDerWaalsContact CZ-CB 3.4Å; Y92-N94 WeakPolarHBondContact OH-CB 3.45Å; N94-F126 PolarHBondContact N-O 2.99Å; N94-F126 PolarHBondContact O-N 2.93Å
95	R	87.3	Confident	77.2	Confident	160 Å²	160	66 Å²	66	60%	0.604	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	140.2	168.1	-69.1	-179.3	-168.7	157.7	7.2	109.6	C124 D125 I148	R95-C124 WeakPolarHBondContact CA-O 3.25Å; R95-D125 WeakPolarHBondContact CG-OD1 3.46Å; R95-D125 IonicContact NE-OD1 2.89Å; R95-I148 HydrophobicContact CG-CD1 4.12Å
96	A	85.6	Confident	74.6	Confident	4 Å²	4	71.6 Å²	71.6	3%	0.033	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137.5	173	0	0	0	0	0	109.8	V78 F98 C124 F126	V78-A96 HydrophobicContact CG1-CB 4.01Å; A96-F98 HydrophobicContact CB-CD2 4.29Å; A96-F98 HydrophobicContact CB-CE1 4.12Å; A96-F98 HydrophobicContact CB-CE2 3.71Å; A96-F98 HydrophobicContact CB-CZ 3.62Å; A96-C124 PolarHBondContact N-O 3.1Å; A96-C124 PolarHBondContact O-N 3.35Å; A96-F126 HydrophobicContact CB-CB 4.22Å
97	V	84.9	Confident	71.8	Confident	28 Å²	28	74.2 Å²	74.2	17%	0.17	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	123.1	166.1	-174.2	0	0	0	0	107.7	E73 T74 Y99 P121	E73-V97 HydrophobicContact CB-CB 4.16Å; E73-V97 HydrophobicContact CB-CG1 3.88Å; E73-V97 HydrophobicContact CB-CG2 4.45Å; T74-V97 WeakPolarHBondContact CB-O 3.13Å; T74-V97 WeakPolarHBondContact CG2-O 3.4Å; T74-V97 PolarHBondContact OG1-O 2.76Å; V97-Y99 HydrophobicContact CG1-CE2 4.39Å; V97-P121 HydrophobicContact CG1-CB 3.75Å
98	F	87.2	Confident	69.5	Low	0 Å²	0	77.1 Å²	77.1	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	158.9	176.3	-69.6	-52.2	0	0	0	109.7	L69 W70 A96 P121 F122 C124 F126 Y145	L69-F98 HydrophobicContact CB-CB 4.06Å; L69-F98 HydrophobicContact CB-CD1 3.7Å; L69-F98 HydrophobicContact CB-CE1 4.44Å; L69-F98 HydrophobicContact CB-CG 4.05Å; L69-F98 HydrophobicContact CD1-CG 4.42Å; L69-F98 CarbonylContact O-C 3.56Å; L69-F98 VanDerWaalsContact O-CA 3.31Å; L69-F98 WeakPolarHBondContact O-CA 3.32Å; W70-F98 AromaticContact CD1-CE1 3.72Å; W70-F98 AromaticContact NE1-CE1 3.88Å; A96-F98 HydrophobicContact CB-CD2 4.29Å; A96-F98 HydrophobicContact CB-CE1 4.12Å; A96-F98 HydrophobicContact CB-CE2 3.71Å; A96-F98 HydrophobicContact CB-CZ 3.62Å; F98-P121 CarbonylContact O-C 3.52Å; F98-P121 WeakPolarHBondContact O-CA 3.23Å; F98-F122 HydrophobicContact CB-CD1 4.36Å; F98-F122 HydrophobicContact CB-CE1 3.75Å; F98-F122 HydrophobicContact CB-CE2 4.13Å; F98-F122 HydrophobicContact CB-CZ 3.62Å; F98-F122 PolarHBondContact N-O 3.38Å; F98-F122 WeakPolarHBondContact O-CD1 3.44Å; F98-F122 PolarHBondContact O-N 2.89Å; F98-C124 WeakPolarHBondContact CD2-SG 3.43Å; F98-C124 VanDerWaalsContact CE2-SG 3.52Å; F98-F126 HydrophobicContact CE2-CB 4.08Å; F98-F126 HydrophobicContact CE2-CD1 4.5Å; F98-F126 HydrophobicContact CE2-CD2 4.06Å; F98-F126 AromaticContact CE2-CG 3.96Å; F98-F126 HydrophobicContact CE2-CG 3.96Å; F98-F126 HydrophobicContact CZ-CB 4.46Å; F98-F126 HydrophobicContact CZ-CD1 4.11Å; F98-F126 HydrophobicContact CZ-CD2 4.3Å; F98-F126 HydrophobicContact CZ-CE1 4.44Å; F98-F126 HydrophobicContact CZ-CG 4.04Å; F98-Y145 AromaticContact CD2-CD1 3.91Å; F98-Y145 HydrophobicContact CD2-CD1 3.91Å; F98-Y145 AromaticContact CD2-CE1 3.93Å; F98-Y145 HydrophobicContact CD2-CE1 3.93Å; F98-Y145 AromaticContact CE2-CD1 3.68Å; F98-Y145 HydrophobicContact CE2-CD1 3.68Å; F98-Y145 AromaticContact CE2-CE1 3.48Å; F98-Y145 HydrophobicContact CE2-CE1 3.48Å; F98-Y145 VanDerWaalsContact CE2-CE1 3.48Å; F98-Y145 HydrophobicContact CZ-CE1 4.01Å
99	Y	81.1	Confident	67.4	Low	22 Å²	22	76.9 Å²	76.9	9%	0.086	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	142.6	-178.3	-71.6	-101.2	0	0	0	111.4	L69 G71 S72 E73 V97 P121	L69-Y99 PolarHBondContact O-N 2.86Å; G71-Y99 VanDerWaalsContact CA-CD2 3.41Å; S72-Y99 PolarHBondContact OG-OH 3.21Å; S72-Y99 VanDerWaalsContact OG-OH 3.11Å; E73-Y99 HydrophobicContact CB-CE2 4.47Å; E73-Y99 VanDerWaalsContact CB-OH 3.28Å; E73-Y99 WeakPolarHBondContact CB-OH 3.43Å; E73-Y99 VanDerWaalsContact CD-OH 3.29Å; E73-Y99 VanDerWaalsContact CG-OH 3.29Å; E73-Y99 WeakPolarHBondContact CG-OH 3.41Å; E73-Y99 PolarHBondContact N-OH 3.41Å; E73-Y99 PolarHBondContact OE1-OH 2.65Å; V97-Y99 HydrophobicContact CG1-CE2 4.39Å; Y99-P121 HydrophobicContact CD1-CB 4.1Å; Y99-P121 HydrophobicContact CE1-CB 3.66Å; Y99-P121 HydrophobicContact CE1-CG 4.17Å; Y99-P121 HydrophobicContact CE2-CB 4.39Å
100	T	79.6	Confident	64.9	Low	8 Å²	8	75.2 Å²	75.2	5%	0.049	35%	0.349	C	S	.	.			trans	-81.7	160.3	171.6	61.8	0	0	0	0	111.3	T102 E120 F122	T100-T102 PolarHBondContact O-N 2.84Å; T100-T102 VanDerWaalsContact O-N 3.11Å; T100-T102 WeakPolarHBondContact OG1-CG2 3.44Å; T100-T102 PolarHBondContact OG1-OG1 3.42Å; T100-E120 PolarHBondContact N-O 2.83Å; T100-E120 PolarHBondContact OG1-N 2.97Å; T100-E120 PolarHBondContact OG1-O 2.93Å; T100-E120 VanDerWaalsContact OG1-O 3.11Å; T100-F122 HydrophobicContact CG2-CD1 3.63Å; T100-F122 HydrophobicContact CG2-CE1 3.92Å
101	R	71	Confident	62.8	Low	64 Å²	64	77.7 Å²	77.7	24%	0.242	37%	0.367	C	S	.	.			trans	-79	30.4	175.5	-157.8	-166.2	165.3	-172.1	-3.4	113.6	T52 H53 Y54 S55 G103 Y105	T52-R101 PolarHBondContact O-N 3.03Å; H53-R101 HydrophobicContact CB-CB 4.02Å; H53-R101 VanDerWaalsContact O-CD 3.3Å; H53-R101 WeakPolarHBondContact O-CD 3.35Å; Y54-R101 HydrophobicContact CD1-CG 4.42Å; Y54-R101 HydrophobicContact CD2-CB 3.87Å; Y54-R101 HydrophobicContact CD2-CG 4.39Å; Y54-R101 HydrophobicContact CE1-CG 4.17Å; Y54-R101 HydrophobicContact CE2-CB 3.67Å; Y54-R101 HydrophobicContact CE2-CG 4.13Å; Y54-R101 HydrophobicContact CG-CB 4.4Å; S55-R101 PolarHBondContact OG-NH1 2.92Å; R101-G103 PolarHBondContact O-N 2.79Å; R101-Y105 PolarHBondContact NH2-OH 3.13Å
102	T	56.4	Low	60.6	Low	47 Å²	47	75.3 Å²	75.3	29%	0.288	36%	0.356	S	S	.	.			trans	-73	103	-175.8	51.3	0	0	0	0	111.7	T100 T118 S119 E120	T100-T102 PolarHBondContact O-N 2.84Å; T100-T102 VanDerWaalsContact O-N 3.11Å; T100-T102 WeakPolarHBondContact OG1-CG2 3.44Å; T100-T102 PolarHBondContact OG1-OG1 3.42Å; T102-T118 PolarHBondContact OG1-O 3.4Å; T102-S119 VanDerWaalsContact OG1-CA 3.32Å; T102-S119 WeakPolarHBondContact OG1-CA 3.44Å; T102-E120 PolarHBondContact OG1-N 3.48Å
103	G	37.8	Very low	58.2	Low	32 Å²	32	82.1 Å²	82.1	33%	0.33	38%	0.383	S	S	.	.	S	Bend	trans	156	93.9	175.1	0	0	0	0	0	111.7	R101	R101-G103 PolarHBondContact O-N 2.79Å
104	F	32.4	Very low	55.4	Low	151 Å²	151	85.4 Å²	85.4	66%	0.662	40%	0.395	S	S	*	.	S	Bend	trans	165	-18.7	151.4	-102.4	-66.3	0	0	0	114	Y299	F104-Y299 HydrophobicContact CB-CE2 3.74Å; F104-Y299 WeakPolarHBondContact O-CD2 3.22Å; F104-Y299 WeakPolarHBondContact O-CE2 3.39Å
105	Y	33.3	Very low	53.1	Low	112 Å²	112	86.6 Å²	86.6	44%	0.439	40%	0.401	S	S	.	.	S	Bend	trans	-120.8	123.7	-157.1	-34.6	-90.3	0	0	0	93.8	R101 Y299	R101-Y105 PolarHBondContact NH2-OH 3.13Å; Y105-Y299 WeakPolarHBondContact CA-OH 3.49Å; Y105-Y299 WeakPolarHBondContact CB-OH 3.43Å; Y105-Y299 AromaticContact CD1-CD2 3.11Å; Y105-Y299 HydrophobicContact CD1-CD2 3.11Å; Y105-Y299 AromaticContact CD1-CE2 3.29Å; Y105-Y299 HydrophobicContact CD1-CE2 3.29Å; Y105-Y299 AromaticContact CD1-CG 3.93Å; Y105-Y299 HydrophobicContact CD1-CG 3.93Å; Y105-Y299 HydrophobicContact CD2-CD2 4.04Å; Y105-Y299 HydrophobicContact CD2-CE1 4.07Å; Y105-Y299 AromaticContact CD2-CE2 3.14Å; Y105-Y299 HydrophobicContact CD2-CE2 3.14Å; Y105-Y299 AromaticContact CD2-CZ 3.14Å; Y105-Y299 WeakPolarHBondContact CD2-OH 3.34Å; Y105-Y299 HydrophobicContact CE1-CD2 4.29Å; Y105-Y299 HydrophobicContact CE1-CE2 4.22Å; Y105-Y299 HydrophobicContact CE2-CE2 4.1Å; Y105-Y299 AromaticContact CG-CD1 3.87Å; Y105-Y299 HydrophobicContact CG-CD1 3.87Å; Y105-Y299 AromaticContact CG-CD2 2.9Å; Y105-Y299 HydrophobicContact CG-CD2 2.9Å; Y105-Y299 AromaticContact CG-CE1 3.65Å; Y105-Y299 HydrophobicContact CG-CE1 3.65Å; Y105-Y299 AromaticContact CG-CE2 2.58Å; Y105-Y299 HydrophobicContact CG-CE2 2.58Å; Y105-Y299 AromaticContact CG-CG 3.56Å; Y105-Y299 HydrophobicContact CG-CG 3.56Å; Y105-Y299 AromaticContact CG-CZ 3.01Å; Y105-Y299 PolarHBondContact N-OH 3.41Å; Y105-Y299 VanDerWaalsContact O-CD1 3.29Å; Y105-Y299 WeakPolarHBondContact O-CD1 3.35Å; Y105-Y299 WeakPolarHBondContact O-CE1 3.26Å
106	L	36.2	Very low	50.5	Low	118 Å²	118	84.3 Å²	84.3	62%	0.618	41%	0.407	S	S	*	.	S	Bend	trans	57.2	78.7	167.8	-70	166.9	0	0	0	119.5	Y299 L300	L106-Y299 HydrophobicContact CB-CD1 3.8Å; L106-Y299 HydrophobicContact CD1-CD1 3.97Å; L106-Y299 HydrophobicContact CG-CD1 3.66Å; L106-Y299 HydrophobicContact CG-CG 4.41Å; L106-L300 HydrophobicContact CD1-CB 4.45Å
107	C	31.8	Very low	48.1	Very low	55 Å²	55	87.9 Å²	87.9	37%	0.372	43%	0.43	S	S	.	.			trans	-150	113.9	133.7	-174.3	0	0	0	0	109.9	I109 C110 L111	C107-I109 PolarHBondContact O-N 2.91Å; C107-C110 HydrophobicContact CB-CB 3.97Å; C107-C110 PolarHBondContact O-N 3.38Å; C107-L111 PolarHBondContact O-N 3.37Å
108	Y	38.9	Very low	46.2	Very low	175 Å²	175	92 Å²	92	69%	0.686	46%	0.456	S	S	*	.	H	α-helix	trans	-60.7	-46.1	-178.5	-164.2	-100.2	0	0	0	111	C110 L111 Q112	Y108-C110 PolarHBondContact O-N 2.87Å; Y108-L111 WeakPolarHBondContact O-CB 3.31Å; Y108-L111 PolarHBondContact O-N 3.02Å; Y108-Q112 PolarHBondContact O-N 2.98Å
109	I	41.5	Very low	44.9	Very low	106 Å²	106	94.9 Å²	94.9	54%	0.544	48%	0.476	S	S	.	.	H	α-helix	trans	-60.7	-46.1	179	-58.2	174.4	0	0	0	111.6	C107 L111 Q112 Y113	C107-I109 PolarHBondContact O-N 2.91Å; I109-L111 VanDerWaalsContact C-N 3.3Å; I109-L111 PolarHBondContact O-N 2.96Å; I109-Q112 PolarHBondContact O-N 2.99Å; I109-Y113 HydrophobicContact CG2-CD2 3.7Å; I109-Y113 HydrophobicContact CG2-CE2 4.08Å; I109-Y113 WeakPolarHBondContact O-CD2 3.28Å; I109-Y113 PolarHBondContact O-N 2.91Å
110	C	36.2	Very low	44.2	Very low	33 Å²	33	99.5 Å²	99.5	22%	0.223	50%	0.498	C	S	.	.	H	α-helix	trans	-66.3	-31.7	179.7	-63	0	0	0	0	113.2	C107 Y108 R114 I115	C107-C110 HydrophobicContact CB-CB 3.97Å; C107-C110 PolarHBondContact O-N 3.38Å; Y108-C110 PolarHBondContact O-N 2.87Å; C110-R114 PolarHBondContact O-N 3.03Å; C110-I115 HydrophobicContact CB-CB 4.31Å; C110-I115 PolarHBondContact O-N 2.76Å; C110-I115 VanDerWaalsContact O-N 3.11Å
111	L	43.5	Very low	44.2	Very low	132 Å²	132	101.9 Å²	101.9	69%	0.691	51%	0.514	S	S	*	.	H	α-helix	trans	-67.3	-43.6	172.8	-98.3	157.4	0	0	0	111.7	C107 Y108 I109	C107-L111 PolarHBondContact O-N 3.37Å; Y108-L111 WeakPolarHBondContact O-CB 3.31Å; Y108-L111 PolarHBondContact O-N 3.02Å; I109-L111 VanDerWaalsContact C-N 3.3Å; I109-L111 PolarHBondContact O-N 2.96Å
112	Q	42.9	Very low	44.7	Very low	90 Å²	90	99.1 Å²	99.1	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-72.4	-31.5	-177.5	-160.1	153.9	-9	0	0	113.1	Y108 I109 E201	Y108-Q112 PolarHBondContact O-N 2.98Å; I109-Q112 PolarHBondContact O-N 2.99Å; Q112-E201 PolarHBondContact NE2-OE2 2.65Å
113	Y	37.8	Very low	45.9	Very low	158 Å²	158	99.2 Å²	99.2	62%	0.62	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	11.2	-179	-68.7	-75.9	0	0	0	115.3	I109 I115	I109-Y113 HydrophobicContact CG2-CD2 3.7Å; I109-Y113 HydrophobicContact CG2-CE2 4.08Å; I109-Y113 WeakPolarHBondContact O-CD2 3.28Å; I109-Y113 PolarHBondContact O-N 2.91Å; Y113-I115 PolarHBondContact O-N 3Å; Y113-I115 VanDerWaalsContact O-N 3.14Å
114	R	32.7	Very low	48.2	Very low	237 Å²	237	97.7 Å²	97.7	89%	0.894	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	31.6	-177.6	-74.7	-173.8	170.3	-176.8	-1.1	114.8	C110	C110-R114 PolarHBondContact O-N 3.03Å
115	I	36.4	Very low	50.8	Low	87 Å²	87	91.9 Å²	91.9	45%	0.446	46%	0.464	S	S	.	.			trans	-77.8	126.1	-175.5	-56.5	174.3	0	0	0	109.8	C110 Y113 C117	C110-I115 HydrophobicContact CB-CB 4.31Å; C110-I115 PolarHBondContact O-N 2.76Å; C110-I115 VanDerWaalsContact O-N 3.11Å; Y113-I115 PolarHBondContact O-N 3Å; Y113-I115 VanDerWaalsContact O-N 3.14Å; I115-C117 PolarHBondContact O-N 2.88Å
116	P	33.2	Very low	53.5	Low	112 Å²	112	86.6 Å²	86.6	73%	0.727	44%	0.444	S	S	*	.			trans	-68.2	114.3	-179.4	26.9	-33.9	0	0	0	111.3	T118	P116-T118 PolarHBondContact O-N 3.21Å
117	C	36.1	Very low	56.1	Low	78 Å²	78	82.7 Å²	82.7	53%	0.527	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-71.3	123.3	176.1	-63.6	0	0	0	0	110.7	I115	I115-C117 PolarHBondContact O-N 2.88Å
118	T	43.9	Very low	58.9	Low	116 Å²	116	80 Å²	80	71%	0.712	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-87.3	139.9	-179.1	44.6	0	0	0	0	112.6	T102 P116	T102-T118 PolarHBondContact OG1-O 3.4Å; P116-T118 PolarHBondContact O-N 3.21Å
119	S	59.4	Low	61.3	Low	59 Å²	59	73.6 Å²	73.6	41%	0.413	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-77.8	117.2	172	54.7	0	0	0	0	110.3	T102 P121	T102-S119 VanDerWaalsContact OG1-CA 3.32Å; T102-S119 WeakPolarHBondContact OG1-CA 3.44Å; S119-P121 WeakPolarHBondContact O-CD 3.36Å
120	E	67.3	Low	63.6	Low	120 Å²	120	69.3 Å²	69.3	56%	0.561	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-71.5	127.7	-179.2	-68.6	-171.7	166.6	0	0	111.9	T100 T102	T100-E120 PolarHBondContact N-O 2.83Å; T100-E120 PolarHBondContact OG1-N 2.97Å; T100-E120 PolarHBondContact OG1-O 2.93Å; T100-E120 VanDerWaalsContact OG1-O 3.11Å; T102-E120 PolarHBondContact OG1-N 3.48Å
121	P	78.9	Confident	65.8	Low	58 Å²	58	69 Å²	69	38%	0.377	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	147.1	166.4	29.4	-32	0	0	0	111.1	V97 F98 Y99 S119	V97-P121 HydrophobicContact CG1-CB 3.75Å; F98-P121 CarbonylContact O-C 3.52Å; F98-P121 WeakPolarHBondContact O-CA 3.23Å; Y99-P121 HydrophobicContact CD1-CB 4.1Å; Y99-P121 HydrophobicContact CE1-CB 3.66Å; Y99-P121 HydrophobicContact CE1-CG 4.17Å; Y99-P121 HydrophobicContact CE2-CB 4.39Å; S119-P121 WeakPolarHBondContact O-CD 3.36Å
122	F	81.2	Confident	67.7	Low	5 Å²	5	68.2 Å²	68.2	2%	0.022	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	132.3	169.2	69.2	-83	0	0	0	111.1	L51 T52 F98 T100 C124 K147	L51-F122 HydrophobicContact CD1-CD2 4.2Å; L51-F122 HydrophobicContact CD1-CE2 3.98Å; L51-F122 HydrophobicContact CD1-CZ 4.45Å; L51-F122 HydrophobicContact CD2-CE2 3.96Å; L51-F122 HydrophobicContact CD2-CZ 4.36Å; L51-F122 HydrophobicContact CG-CE2 3.97Å; L51-F122 HydrophobicContact CG-CZ 4.13Å; T52-F122 HydrophobicContact CG2-CZ 4.28Å; F98-F122 HydrophobicContact CB-CD1 4.36Å; F98-F122 HydrophobicContact CB-CE1 3.75Å; F98-F122 HydrophobicContact CB-CE2 4.13Å; F98-F122 HydrophobicContact CB-CZ 3.62Å; F98-F122 PolarHBondContact N-O 3.38Å; F98-F122 WeakPolarHBondContact O-CD1 3.44Å; F98-F122 PolarHBondContact O-N 2.89Å; T100-F122 HydrophobicContact CG2-CD1 3.63Å; T100-F122 HydrophobicContact CG2-CE1 3.92Å; F122-C124 HydrophobicContact CD2-CB 4.28Å; F122-C124 HydrophobicContact CE2-CB 4.22Å; F122-K147 HydrophobicContact CB-CD 4.23Å; F122-K147 HydrophobicContact CD2-CD 4.35Å; F122-K147 HydrophobicContact CD2-CG 4.32Å
123	T	83.5	Confident	69.3	Low	50 Å²	50	66.6 Å²	66.6	31%	0.307	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	133.5	171.5	-61.2	0	0	0	0	109.8	I148	T123-I148 HydrophobicContact CG2-CD1 4.13Å; T123-I148 PolarHBondContact O-N 3.43Å
124	C	84.5	Confident	71.1	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	151.1	169.7	80.8	0	0	0	0	112.8	R95 A96 F98 F122 F126 Q146	R95-C124 WeakPolarHBondContact CA-O 3.25Å; A96-C124 PolarHBondContact N-O 3.1Å; A96-C124 PolarHBondContact O-N 3.35Å; F98-C124 WeakPolarHBondContact CD2-SG 3.43Å; F98-C124 VanDerWaalsContact CE2-SG 3.52Å; F122-C124 HydrophobicContact CD2-CB 4.28Å; F122-C124 HydrophobicContact CE2-CB 4.22Å; C124-F126 PolarHBondContact O-N 3.25Å; C124-Q146 CarbonylContact C-O 3.55Å; C124-Q146 VanDerWaalsContact CA-O 3.23Å; C124-Q146 WeakPolarHBondContact CA-O 3.39Å; C124-Q146 WeakPolarHBondContact CB-O 3.4Å
125	D	88.3	Confident	73.2	Confident	29 Å²	29	66.9 Å²	66.9	16%	0.155	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	107.5	160.7	-116.3	46.1	0	0	0	106.8	R93 R95 Q146	R93-D125 IonicContact CZ-OD2 3.42Å; R93-D125 IonicContact NE-OD2 2.91Å; R93-D125 PolarHBondContact NE-OD2 2.93Å; R93-D125 IonicContact NH2-OD2 2.71Å; R93-D125 PolarHBondContact NH2-OD2 3.03Å; R95-D125 WeakPolarHBondContact CG-OD1 3.46Å; R95-D125 IonicContact NE-OD1 2.89Å; D125-Q146 HydrophobicContact CB-CB 4.13Å; D125-Q146 PolarHBondContact N-O 3.36Å; D125-Q146 PolarHBondContact O-N 3.06Å
126	F	89.9	Confident	75.1	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	134.8	-179.5	-177.4	-127.5	0	0	0	110.3	I82 Y92 R93 N94 A96 F98 C124 V128 C143 Y145	I82-F126 HydrophobicContact CD1-CD1 3.87Å; I82-F126 HydrophobicContact CD1-CE1 3.85Å; I82-F126 HydrophobicContact CG1-CD1 4.15Å; I82-F126 HydrophobicContact CG1-CE1 3.98Å; I82-F126 HydrophobicContact CG2-CE1 4.19Å; Y92-F126 HydrophobicContact CD1-CD1 4.33Å; Y92-F126 HydrophobicContact CE1-CD1 4.13Å; R93-F126 WeakPolarHBondContact CA-O 3.17Å; N94-F126 PolarHBondContact N-O 2.99Å; N94-F126 PolarHBondContact O-N 2.93Å; A96-F126 HydrophobicContact CB-CB 4.22Å; F98-F126 HydrophobicContact CE2-CB 4.08Å; F98-F126 HydrophobicContact CE2-CD1 4.5Å; F98-F126 HydrophobicContact CE2-CD2 4.06Å; F98-F126 AromaticContact CE2-CG 3.96Å; F98-F126 HydrophobicContact CE2-CG 3.96Å; F98-F126 HydrophobicContact CZ-CB 4.46Å; F98-F126 HydrophobicContact CZ-CD1 4.11Å; F98-F126 HydrophobicContact CZ-CD2 4.3Å; F98-F126 HydrophobicContact CZ-CE1 4.44Å; F98-F126 HydrophobicContact CZ-CG 4.04Å; C124-F126 PolarHBondContact O-N 3.25Å; F126-V128 HydrophobicContact CD1-CG2 4.3Å; F126-V128 HydrophobicContact CE1-CG2 3.46Å; F126-V128 VanDerWaalsContact CE1-CG2 3.46Å; F126-V128 HydrophobicContact CE2-CG2 4.28Å; F126-V128 HydrophobicContact CZ-CG2 3.44Å; F126-V128 VanDerWaalsContact CZ-CG2 3.44Å; F126-C143 HydrophobicContact CE2-CB 4.04Å; F126-C143 HydrophobicContact CZ-CB 4.32Å; F126-Y145 AromaticContact CD2-CD1 3.83Å; F126-Y145 HydrophobicContact CD2-CD1 3.83Å; F126-Y145 AromaticContact CD2-CE1 3.62Å; F126-Y145 HydrophobicContact CD2-CE1 3.62Å; F126-Y145 HydrophobicContact CD2-CE2 4.35Å; F126-Y145 HydrophobicContact CD2-CG 4.28Å; F126-Y145 AromaticContact CD2-CZ 3.89Å; F126-Y145 HydrophobicContact CE2-CD1 4.16Å; F126-Y145 HydrophobicContact CE2-CD2 4.42Å; F126-Y145 AromaticContact CE2-CE1 3.54Å; F126-Y145 HydrophobicContact CE2-CE1 3.54Å; F126-Y145 AromaticContact CE2-CE2 3.83Å; F126-Y145 HydrophobicContact CE2-CE2 3.83Å; F126-Y145 AromaticContact CE2-CZ 3.34Å; F126-Y145 WeakPolarHBondContact CE2-OH 3.47Å; F126-Y145 HydrophobicContact CZ-CE1 4.48Å
127	T	89.8	Confident	77.3	Confident	36 Å²	36	65.3 Å²	65.3	22%	0.221	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	127.9	-178.8	44.5	0	0	0	0	111.5	Y92 R93 C143 S144	Y92-T127 CarbonylContact O-C 3.5Å; Y92-T127 WeakPolarHBondContact O-CA 3.48Å; R93-T127 HydrophobicContact CB-CG2 3.95Å; R93-T127 HydrophobicContact CG-CG2 3.62Å; T127-C143 CarbonylContact O-C 3.58Å; T127-C143 VanDerWaalsContact O-CA 3.26Å; T127-C143 WeakPolarHBondContact O-CA 3.5Å; T127-S144 PolarHBondContact N-O 3.46Å; T127-S144 PolarHBondContact O-N 2.72Å; T127-S144 WeakPolarHBondContact OG1-CB 3.44Å; T127-S144 PolarHBondContact OG1-O 3.22Å
128	V	90.3	Very high	79.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.7	174.1	-179.2	0	0	0	0	108.2	F86 E91 Y92 F126 F141	F86-V128 HydrophobicContact CE1-CG1 4.03Å; F86-V128 HydrophobicContact CE2-CG1 4.01Å; F86-V128 HydrophobicContact CE2-CG2 3.83Å; F86-V128 HydrophobicContact CZ-CG1 3.73Å; F86-V128 HydrophobicContact CZ-CG2 4.02Å; E91-V128 WeakPolarHBondContact CA-O 3.17Å; Y92-V128 HydrophobicContact CD1-CG2 4.46Å; Y92-V128 PolarHBondContact N-O 3.03Å; Y92-V128 PolarHBondContact O-N 2.96Å; F126-V128 HydrophobicContact CD1-CG2 4.3Å; F126-V128 HydrophobicContact CE1-CG2 3.46Å; F126-V128 VanDerWaalsContact CE1-CG2 3.46Å; F126-V128 HydrophobicContact CE2-CG2 4.28Å; F126-V128 HydrophobicContact CZ-CG2 3.44Å; F126-V128 VanDerWaalsContact CZ-CG2 3.44Å; V128-F141 HydrophobicContact CG1-CD1 3.74Å; V128-F141 HydrophobicContact CG1-CE1 4.36Å; V128-F141 HydrophobicContact CG1-CG 4.48Å
129	T	89.7	Confident	81.4	Confident	39 Å²	39	58.6 Å²	58.6	24%	0.239	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	116.5	-177.9	43.6	0	0	0	0	111.5	E91 I131 L142	E91-T129 HydrophobicContact CG-CG2 3.89Å; T129-I131 PolarHBondContact O-N 2.9Å; T129-L142 PolarHBondContact N-O 3.4Å; T129-L142 PolarHBondContact O-N 3.32Å; T129-L142 WeakPolarHBondContact OG1-CB 3.18Å; T129-L142 PolarHBondContact OG1-O 3.44Å
130	P	89.5	Confident	82.8	Confident	16 Å²	16	56.3 Å²	56.3	10%	0.104	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	115.9	177.1	27.3	-32.5	0	0	0	111.5	V138 F141	P130-V138 HydrophobicContact CB-CG1 3.66Å; P130-V138 HydrophobicContact CB-CG2 4Å; P130-F141 HydrophobicContact CB-CD1 4.21Å; P130-F141 HydrophobicContact CB-CE1 4.04Å
131	I	83.5	Confident	83.9	Confident	27 Å²	27	50.6 Å²	50.6	14%	0.138	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.8	174.3	-56.8	-179.2	0	0	0	108.7	F14 I18 L31 T129 V138 V139 L140 L142	F14-I131 HydrophobicContact CE1-CG2 3.83Å; F14-I131 HydrophobicContact CZ-CG2 3.75Å; I18-I131 HydrophobicContact CD1-CD1 4.42Å; L31-I131 HydrophobicContact CD2-CD1 4.13Å; T129-I131 PolarHBondContact O-N 2.9Å; I131-V138 WeakPolarHBondContact O-CA 3.19Å; I131-V139 PolarHBondContact O-N 3.46Å; I131-L140 HydrophobicContact CB-CB 4.13Å; I131-L140 WeakPolarHBondContact CB-O 3.18Å; I131-L140 HydrophobicContact CD1-CB 4.15Å; I131-L140 HydrophobicContact CG1-CB 4.47Å; I131-L140 PolarHBondContact N-O 2.83Å; I131-L140 PolarHBondContact O-N 3.36Å; I131-L142 HydrophobicContact CD1-CB 3.98Å; I131-L142 HydrophobicContact CG1-CB 4.33Å
132	R	82.8	Confident	84.4	Confident	116 Å²	116	50 Å²	50	44%	0.438	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	145.3	178.8	-68.6	171.4	-175	-97.2	0.3	111.8	H89 S136 E137 V138	H89-R132 PolarHBondContact O-NH2 3.45Å; R132-S136 VanDerWaalsContact CD-O 3.27Å; R132-S136 WeakPolarHBondContact CD-O 3.31Å; R132-S136 WeakPolarHBondContact CG-O 3.24Å; R132-S136 PolarHBondContact NH1-O 2.6Å; R132-E137 CarbonylContact C-O 3.56Å; R132-E137 WeakPolarHBondContact CA-O 3.5Å; R132-V138 HydrophobicContact CG-CB 4.4Å; R132-V138 HydrophobicContact CG-CG2 3.72Å
133	N	77.5	Confident	84.8	Confident	55 Å²	55	49.8 Å²	49.8	29%	0.294	25%	0.246	S	C	.	.			trans	-79.4	-175.1	171.9	65.8	12	0	0	0	112.2	R135 S136 E137 V139	N133-R135 PolarHBondContact O-N 2.91Å; N133-R135 WeakPolarHBondContact OD1-CA 3.2Å; N133-R135 WeakPolarHBondContact OD1-CB 3.5Å; N133-R135 PolarHBondContact OD1-N 3.3Å; N133-S136 PolarHBondContact O-N 3.06Å; N133-S136 PolarHBondContact OD1-N 3.23Å; N133-S136 VanDerWaalsContact OD1-N 3.14Å; N133-E137 PolarHBondContact N-O 2.67Å; N133-E137 PolarHBondContact ND2-OE2 2.79Å; N133-E137 PolarHBondContact OD1-N 3.24Å; N133-E137 PolarHBondContact OD1-O 3.3Å; N133-V139 HydrophobicContact CB-CG2 3.64Å
134	E	75.2	Confident	85	Confident	203 Å²	203	49.3 Å²	49.3	95%	0.949	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.9	177.4	-59	-178.8	162.7	0	0	113.3	S136	E134-S136 VanDerWaalsContact C-N 3.32Å
135	R	75.5	Confident	85.2	Confident	199 Å²	199	49.3 Å²	49.3	75%	0.751	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	4.7	173.4	-59.3	-179.6	178.8	-177.7	-1.9	113.4	N133 E137	N133-R135 PolarHBondContact O-N 2.91Å; N133-R135 WeakPolarHBondContact OD1-CA 3.2Å; N133-R135 WeakPolarHBondContact OD1-CB 3.5Å; N133-R135 PolarHBondContact OD1-N 3.3Å; R135-E137 HydrophobicContact CB-CG 4.04Å; R135-E137 PolarHBondContact O-N 2.92Å
136	S	76.2	Confident	85.1	Confident	78 Å²	78	54.3 Å²	54.3	55%	0.545	27%	0.267	S	S	.	.	S	Bend	trans	66.4	8.5	-174.5	-56.5	0	0	0	0	116.3	R132 N133 E134	R132-S136 VanDerWaalsContact CD-O 3.27Å; R132-S136 WeakPolarHBondContact CD-O 3.31Å; R132-S136 WeakPolarHBondContact CG-O 3.24Å; R132-S136 PolarHBondContact NH1-O 2.6Å; N133-S136 PolarHBondContact O-N 3.06Å; N133-S136 PolarHBondContact OD1-N 3.23Å; N133-S136 VanDerWaalsContact OD1-N 3.14Å; E134-S136 VanDerWaalsContact C-N 3.32Å
137	E	80.2	Confident	84.5	Confident	88 Å²	88	59.1 Å²	59.1	41%	0.411	29%	0.288	S	S	.	.			trans	-75.4	139.2	174.1	-54.7	159.2	158.5	0	0	109.7	R132 N133 R135 V139	R132-E137 CarbonylContact C-O 3.56Å; R132-E137 WeakPolarHBondContact CA-O 3.5Å; N133-E137 PolarHBondContact N-O 2.67Å; N133-E137 PolarHBondContact ND2-OE2 2.79Å; N133-E137 PolarHBondContact OD1-N 3.24Å; N133-E137 PolarHBondContact OD1-O 3.3Å; R135-E137 HydrophobicContact CB-CG 4.04Å; R135-E137 PolarHBondContact O-N 2.92Å; E137-V139 PolarHBondContact O-N 3.5Å
138	V	83.6	Confident	83.7	Confident	16 Å²	16	60.2 Å²	60.2	10%	0.097	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	124.3	177.2	-169.5	0	0	0	0	110.1	A34 H89 P130 I131 R132	A34-V138 HydrophobicContact CB-CB 4.18Å; A34-V138 HydrophobicContact CB-CG1 3.58Å; H89-V138 HydrophobicContact CB-CG2 3.98Å; P130-V138 HydrophobicContact CB-CG1 3.66Å; P130-V138 HydrophobicContact CB-CG2 4Å; I131-V138 WeakPolarHBondContact O-CA 3.19Å; R132-V138 HydrophobicContact CG-CB 4.4Å; R132-V138 HydrophobicContact CG-CG2 3.72Å
139	V	83.6	Confident	82.1	Confident	37 Å²	37	65.1 Å²	65.1	22%	0.224	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-38.7	-178.1	-163.5	0	0	0	0	111.9	N33 A34 Q35 I131 N133 E137	N33-V139 PolarHBondContact OD1-O 3.33Å; A34-V139 PolarHBondContact N-O 2.86Å; Q35-V139 HydrophobicContact CG-CG1 4.29Å; I131-V139 PolarHBondContact O-N 3.46Å; N133-V139 HydrophobicContact CB-CG2 3.64Å; E137-V139 PolarHBondContact O-N 3.5Å
140	L	88	Confident	79.9	Confident	10 Å²	10	71.5 Å²	71.5	5%	0.052	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	149.4	-176.4	-61.9	168.4	0	0	0	110	L15 G32 I131	L15-L140 HydrophobicContact CD2-CD1 3.77Å; L15-L140 HydrophobicContact CG-CD1 4.3Å; G32-L140 CarbonylContact O-C 3.58Å; G32-L140 VanDerWaalsContact O-CA 3.23Å; G32-L140 WeakPolarHBondContact O-CA 3.47Å; I131-L140 HydrophobicContact CB-CB 4.13Å; I131-L140 WeakPolarHBondContact CB-O 3.18Å; I131-L140 HydrophobicContact CD1-CB 4.15Å; I131-L140 HydrophobicContact CG1-CB 4.47Å; I131-L140 PolarHBondContact N-O 2.83Å; I131-L140 PolarHBondContact O-N 3.36Å
141	F	90	Very high	77	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126	163.2	-73.3	-79.8	0	0	0	109	L31 G32 A34 Y39 F86 H89 V128 P130	L31-F141 WeakPolarHBondContact CA-O 3.35Å; G32-F141 PolarHBondContact N-O 3.07Å; G32-F141 PolarHBondContact O-N 3Å; A34-F141 HydrophobicContact CB-CD2 3.51Å; A34-F141 HydrophobicContact CB-CE2 3.52Å; A34-F141 HydrophobicContact CB-CG 4.42Å; A34-F141 HydrophobicContact CB-CZ 4.44Å; Y39-F141 HydrophobicContact CD1-CD2 4.2Å; Y39-F141 AromaticContact CD1-CE2 3.77Å; Y39-F141 HydrophobicContact CD1-CE2 3.77Å; Y39-F141 AromaticContact CE1-CE2 3.97Å; Y39-F141 HydrophobicContact CE1-CE2 3.97Å; Y39-F141 HydrophobicContact CG-CE2 4.34Å; F86-F141 HydrophobicContact CD1-CB 4.37Å; F86-F141 HydrophobicContact CD1-CD1 4.01Å; F86-F141 AromaticContact CD1-CD2 3.61Å; F86-F141 HydrophobicContact CD1-CD2 3.61Å; F86-F141 HydrophobicContact CD1-CE1 4.08Å; F86-F141 AromaticContact CD1-CE2 3.7Å; F86-F141 HydrophobicContact CD1-CE2 3.7Å; F86-F141 AromaticContact CD1-CG 3.76Å; F86-F141 HydrophobicContact CD1-CG 3.76Å; F86-F141 AromaticContact CD1-CZ 3.92Å; F86-F141 HydrophobicContact CD1-CZ 3.92Å; F86-F141 HydrophobicContact CE1-CB 3.67Å; F86-F141 AromaticContact CE1-CD1 3.98Å; F86-F141 HydrophobicContact CE1-CD1 3.98Å; F86-F141 AromaticContact CE1-CD2 3.76Å; F86-F141 HydrophobicContact CE1-CD2 3.76Å; F86-F141 HydrophobicContact CE1-CE2 4.32Å; F86-F141 AromaticContact CE1-CG 3.56Å; F86-F141 HydrophobicContact CE1-CG 3.56Å; F86-F141 WeakPolarHBondContact O-CZ 3.44Å; H89-F141 AromaticContact ND1-CE2 3.96Å; H89-F141 AromaticContact ND1-CZ 3.36Å; H89-F141 WeakPolarHBondContact ND1-CZ 3.31Å; V128-F141 HydrophobicContact CG1-CD1 3.74Å; V128-F141 HydrophobicContact CG1-CE1 4.36Å; V128-F141 HydrophobicContact CG1-CG 4.48Å; P130-F141 HydrophobicContact CB-CD1 4.21Å; P130-F141 HydrophobicContact CB-CE1 4.04Å
142	L	88.9	Confident	74.4	Confident	47 Å²	47	83.3 Å²	83.3	25%	0.246	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	116.7	170.4	168	64	0	0	0	109	F29 L31 T129 I131	F29-L142 HydrophobicContact CB-CD1 3.94Å; F29-L142 HydrophobicContact CD2-CD1 3.42Å; F29-L142 VanDerWaalsContact CD2-CD1 3.42Å; F29-L142 HydrophobicContact CE2-CD1 4.29Å; F29-L142 HydrophobicContact CG-CD1 3.93Å; L31-L142 HydrophobicContact CD2-CB 3.97Å; L31-L142 HydrophobicContact CD2-CD1 3.94Å; L31-L142 HydrophobicContact CG-CD1 4.43Å; T129-L142 PolarHBondContact N-O 3.4Å; T129-L142 PolarHBondContact O-N 3.32Å; T129-L142 WeakPolarHBondContact OG1-CB 3.18Å; T129-L142 PolarHBondContact OG1-O 3.44Å; I131-L142 HydrophobicContact CD1-CB 3.98Å; I131-L142 HydrophobicContact CG1-CB 4.33Å
143	C	89.8	Confident	71.6	Confident	0 Å²	0	84.8 Å²	84.8	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	117.3	-177.1	-50.1	0	0	0	0	109.1	F29 V30 F126 T127 Y145	F29-C143 CarbonylContact C-O 3.52Å; F29-C143 WeakPolarHBondContact CA-O 3.16Å; F29-C143 WeakPolarHBondContact CB-O 3.47Å; V30-C143 HydrophobicContact CB-CB 4.37Å; V30-C143 PolarHBondContact N-O 3.33Å; V30-C143 PolarHBondContact O-N 3.26Å; F126-C143 HydrophobicContact CE2-CB 4.04Å; F126-C143 HydrophobicContact CZ-CB 4.32Å; T127-C143 CarbonylContact O-C 3.58Å; T127-C143 VanDerWaalsContact O-CA 3.26Å; T127-C143 WeakPolarHBondContact O-CA 3.5Å; C143-Y145 HydrophobicContact CB-CE2 4.14Å
144	S	88.5	Confident	69.1	Low	39 Å²	39	90.8 Å²	90.8	27%	0.273	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	141.8	-176.7	-178.5	0	0	0	0	112.1	N28 T127	N28-S144 WeakPolarHBondContact O-CA 3.36Å; N28-S144 PolarHBondContact O-OG 3.34Å; T127-S144 PolarHBondContact N-O 3.46Å; T127-S144 PolarHBondContact O-N 2.72Å; T127-S144 WeakPolarHBondContact OG1-CB 3.44Å; T127-S144 PolarHBondContact OG1-O 3.22Å
145	Y	88.8	Confident	66.7	Low	1 Å²	1	85.5 Å²	85.5	0%	0.004	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	96.2	-166.7	-63.7	-99.1	0	0	0	111.2	N28 V30 F48 C66 L69 F98 F126 C143	N28-Y145 VanDerWaalsContact CB-O 3.26Å; N28-Y145 WeakPolarHBondContact CB-O 3.27Å; N28-Y145 PolarHBondContact O-N 3.13Å; V30-Y145 HydrophobicContact CG2-CE2 4.05Å; F48-Y145 AromaticContact CD2-CD2 3.59Å; F48-Y145 HydrophobicContact CD2-CD2 3.59Å; F48-Y145 AromaticContact CD2-CE2 3.75Å; F48-Y145 HydrophobicContact CD2-CE2 3.75Å; F48-Y145 HydrophobicContact CD2-CG 4.16Å; F48-Y145 HydrophobicContact CE2-CD1 4.35Å; F48-Y145 AromaticContact CE2-CD2 3.7Å; F48-Y145 HydrophobicContact CE2-CD2 3.7Å; F48-Y145 HydrophobicContact CE2-CE1 4.12Å; F48-Y145 AromaticContact CE2-CE2 3.44Å; F48-Y145 HydrophobicContact CE2-CE2 3.44Å; F48-Y145 VanDerWaalsContact CE2-CE2 3.44Å; F48-Y145 HydrophobicContact CE2-CG 4.16Å; F48-Y145 AromaticContact CE2-CZ 3.67Å; F48-Y145 HydrophobicContact CZ-CE2 4.49Å; C66-Y145 VanDerWaalsContact CB-OH 3.28Å; C66-Y145 WeakPolarHBondContact CB-OH 3.29Å; C66-Y145 PolarHBondContact SG-OH 3.37Å; L69-Y145 HydrophobicContact CD1-CE1 3.92Å; F98-Y145 AromaticContact CD2-CD1 3.91Å; F98-Y145 HydrophobicContact CD2-CD1 3.91Å; F98-Y145 AromaticContact CD2-CE1 3.93Å; F98-Y145 HydrophobicContact CD2-CE1 3.93Å; F98-Y145 AromaticContact CE2-CD1 3.68Å; F98-Y145 HydrophobicContact CE2-CD1 3.68Å; F98-Y145 AromaticContact CE2-CE1 3.48Å; F98-Y145 HydrophobicContact CE2-CE1 3.48Å; F98-Y145 VanDerWaalsContact CE2-CE1 3.48Å; F98-Y145 HydrophobicContact CZ-CE1 4.01Å; F126-Y145 AromaticContact CD2-CD1 3.83Å; F126-Y145 HydrophobicContact CD2-CD1 3.83Å; F126-Y145 AromaticContact CD2-CE1 3.62Å; F126-Y145 HydrophobicContact CD2-CE1 3.62Å; F126-Y145 HydrophobicContact CD2-CE2 4.35Å; F126-Y145 HydrophobicContact CD2-CG 4.28Å; F126-Y145 AromaticContact CD2-CZ 3.89Å; F126-Y145 HydrophobicContact CE2-CD1 4.16Å; F126-Y145 HydrophobicContact CE2-CD2 4.42Å; F126-Y145 AromaticContact CE2-CE1 3.54Å; F126-Y145 HydrophobicContact CE2-CE1 3.54Å; F126-Y145 AromaticContact CE2-CE2 3.83Å; F126-Y145 HydrophobicContact CE2-CE2 3.83Å; F126-Y145 AromaticContact CE2-CZ 3.34Å; F126-Y145 WeakPolarHBondContact CE2-OH 3.47Å; F126-Y145 HydrophobicContact CZ-CE1 4.48Å; C143-Y145 HydrophobicContact CB-CE2 4.14Å
146	Q	84.8	Confident	64.2	Low	134 Å²	134	84.5 Å²	84.5	63%	0.626	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	96.2	-180	-174.5	169.6	-17.4	0	0	110.3	C124 D125 I148	C124-Q146 CarbonylContact C-O 3.55Å; C124-Q146 VanDerWaalsContact CA-O 3.23Å; C124-Q146 WeakPolarHBondContact CA-O 3.39Å; C124-Q146 WeakPolarHBondContact CB-O 3.4Å; D125-Q146 HydrophobicContact CB-CB 4.13Å; D125-Q146 PolarHBondContact N-O 3.36Å; D125-Q146 PolarHBondContact O-N 3.06Å; Q146-I148 PolarHBondContact O-N 3.41Å
147	K	77.5	Confident	61.7	Low	100 Å²	100	88.1 Å²	88.1	44%	0.435	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	131.5	176.8	-176.5	168.6	179.1	168.3	0	109.7	L51 F122	L51-K147 HydrophobicContact CD1-CB 3.9Å; L51-K147 HydrophobicContact CD1-CD 3.87Å; L51-K147 HydrophobicContact CD1-CG 4.42Å; F122-K147 HydrophobicContact CB-CD 4.23Å; F122-K147 HydrophobicContact CD2-CD 4.35Å; F122-K147 HydrophobicContact CD2-CG 4.32Å
148	I	74.4	Confident	59.1	Low	59 Å²	59	94.9 Å²	94.9	30%	0.303	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-93.9	117.3	176	-56.8	-179.2	0	0	0	107.2	R95 T123 Q146	R95-I148 HydrophobicContact CG-CD1 4.12Å; T123-I148 HydrophobicContact CG2-CD1 4.13Å; T123-I148 PolarHBondContact O-N 3.43Å; Q146-I148 PolarHBondContact O-N 3.41Å
149	T	56.3	Low	56.3	Low	103 Å²	103	103.1 Å²	103.1	63%	0.632	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-76.7	126.9	165.1	41.6	0	0	0	0	108.7	D151	T149-D151 PolarHBondContact O-N 2.93Å
150	Q	43.5	Very low	53.5	Low	173 Å²	173	106.8 Å²	106.8	81%	0.808	55%	0.545	S	S	*	.			trans	-83.7	97.1	172.4	-75.5	174.2	-71	0	0	109.1	L152	Q150-L152 PolarHBondContact O-N 3.07Å
151	D	28	Very low	50.5	Low	144 Å²	144	109.5 Å²	109.5	77%	0.77	58%	0.576	S	S	*	*			trans	-77.9	65.1	175	-62.6	-39.1	0	0	0	110.9	T149	T149-D151 PolarHBondContact O-N 2.93Å
152	L	28.3	Very low	47.4	Very low	147 Å²	147	120.3 Å²	120.3	77%	0.77	62%	0.618	S	S	*	*			trans	-151.7	108.6	174.3	-96.2	126.3	0	0	0	113.4	Q150	Q150-L152 PolarHBondContact O-N 3.07Å
153	I	25.2	Very low	44.2	Very low	148 Å²	148	127.5 Å²	127.5	76%	0.759	65%	0.648	S	S	*	*			trans	47.8	82.1	145.4	-41.1	176.1	0	0	0	117.7
154	H	24.9	Very low	41.1	Very low	181 Å²	181	135.2 Å²	135.2	84%	0.838	69%	0.685	S	S	*	*				-163.4	178.9	129.3	-129.2	-108	0	0	0	113.5
155	S	24.2	Very low	38.1	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	71%	0.706	S	S	*	*			trans	56.5	83.4	169.9	60.7	0	0	0	0	117.9	M157	S155-M157 PolarHBondContact O-N 3.23Å
156	N	23.8	Very low	35.3	Very low	178 Å²	178	149.1 Å²	149.1	95%	0.952	75%	0.75	S	S	*	*	S	Bend	trans	-68.6	70	142.9	-89.5	-27.8	0	0	0	109.9
157	M	23.7	Very low	32.5	Very low	154 Å²	154	146.3 Å²	146.3	76%	0.759	75%	0.745	S	S	*	*			trans	-159.6	153.6	166.3	-108.6	179.4	-178.2	0	0	109.3	S155	S155-M157 PolarHBondContact O-N 3.23Å
158	Y	24.9	Very low	30.1	Very low	230 Å²	230	151.5 Å²	151.5	90%	0.902	77%	0.768	S	S	*	*	S	Bend	trans	60.7	36.1	-174.4	-67.6	-78.4	0	0	0	116.8
159	Q	25	Very low	27.9	Very low	189 Å²	189	154.2 Å²	154.2	88%	0.883	79%	0.787	S	S	*	*			trans	-142.9	52.8	156.2	-144.7	172	90.8	0	0	114.1
160	S	24.5	Very low	26.7	Very low	114 Å²	114	157 Å²	157	80%	0.797	79%	0.793	S	S	*	*			trans	-117.1	119.9	172.9	53.9	0	0	0	0	111.1
161	G	24.6	Very low	26.1	Very low	68 Å²	68	153 Å²	153	70%	0.701	78%	0.784	S	S	*	*	S	Bend	trans	79.9	116	-174.6	0	0	0	0	0	112.5
162	Y	25.5	Very low	26.4	Very low	227 Å²	227	152.9 Å²	152.9	89%	0.89	78%	0.782	S	S	*	*			cis	-125.8	102.5	8.6	-83.4	-108.5	0	0	0	111.9
163	K	22.1	Very low	26.7	Very low	198 Å²	198	152.5 Å²	152.5	86%	0.861	78%	0.78	S	S	*	*			trans	-104.4	101	144.7	-88.2	-178.2	177.8	170.5	0	107.1
164	M	25.1	Very low	26.9	Very low	161 Å²	161	148.6 Å²	148.6	79%	0.793	77%	0.765	S	S	*	*			trans	-131.2	138.5	166.8	-96.4	-64.8	179.9	0	0	109.5	H166	M164-H166 PolarHBondContact O-N 3.2Å
165	N	25.5	Very low	27.3	Very low	133 Å²	133	147.5 Å²	147.5	71%	0.711	75%	0.754	S	S	*	*			trans	-64	131.4	-176	-56.4	-49.8	0	0	0	108.9	S167	N165-S167 PolarHBondContact O-N 3.44Å
166	H	28.7	Very low	27.8	Very low	199 Å²	199	145.9 Å²	145.9	92%	0.921	75%	0.746	S	S	*	*				56.3	21.4	57.9	-122.9	-68.1	0	0	0	115	M164	M164-H166 PolarHBondContact O-N 3.2Å
167	S	26.5	Very low	28.2	Very low	75 Å²	75	141 Å²	141	52%	0.524	73%	0.726	S	S	.	*			trans	-135.6	110.3	169.5	53.9	0	0	0	0	114.5	N165 T169	N165-S167 PolarHBondContact O-N 3.44Å; S167-T169 PolarHBondContact O-N 2.89Å
168	K	27.2	Very low	28.9	Very low	209 Å²	209	140.5 Å²	140.5	91%	0.909	72%	0.722	S	S	*	*	S	Bend	trans	62.6	-16.5	150.3	-65.6	-174.8	175.4	-179.5	0	122.9
169	T	29.2	Very low	29.3	Very low	116 Å²	116	134.2 Å²	134.2	71%	0.712	70%	0.703	S	S	*	*			trans	-97.5	-14.7	-170.4	50.3	0	0	0	0	117.6	S167 S171	S167-T169 PolarHBondContact O-N 2.89Å; T169-S171 PolarHBondContact O-N 2.92Å
170	H	29.6	Very low	29.8	Very low	163 Å²	163	127.7 Å²	127.7	76%	0.755	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	6.4	-168.6	-104.3	-77.1	0	0	0	117.1	S174	H170-S174 PolarHBondContact O-OG 3.46Å
171	S	32	Very low	30.3	Very low	89 Å²	89	131.2 Å²	131.2	62%	0.622	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-22.1	-172.3	45.8	0	0	0	0	115.8	T169	T169-S171 PolarHBondContact O-N 2.92Å
172	I	35	Very low	30.7	Very low	140 Å²	140	130.9 Å²	130.9	72%	0.718	67%	0.665	S	S	*	*	S	Bend	trans	-100.1	-48.1	-171.6	-62	175.3	0	0	0	111.5	S174 W175	I172-S174 VanDerWaalsContact C-N 3.3Å; I172-S174 PolarHBondContact O-N 2.9Å; I172-W175 PolarHBondContact O-N 3.04Å
173	L	33.4	Very low	30.9	Very low	139 Å²	139	125.6 Å²	125.6	73%	0.728	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-70.7	-18.9	-174.8	-75	162.6	0	0	0	114.4	W175 A176	L173-W175 PolarHBondContact O-N 3.13Å; L173-A176 PolarHBondContact O-N 3.19Å
174	S	30.5	Very low	31.4	Very low	66 Å²	66	120.7 Å²	120.7	46%	0.462	64%	0.638	S	S	.	*	G	3₁₀ helix	trans	-73.8	-9	177.7	59.9	0	0	0	0	114.7	H170 I172	H170-S174 PolarHBondContact O-OG 3.46Å; I172-S174 VanDerWaalsContact C-N 3.3Å; I172-S174 PolarHBondContact O-N 2.9Å
175	W	33.5	Very low	31.7	Very low	159 Å²	159	122.3 Å²	122.3	60%	0.602	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-86	-25.3	170.9	-90.3	18	0	0	0	113	I172 L173 S177 E178 W659 L662	I172-W175 PolarHBondContact O-N 3.04Å; L173-W175 PolarHBondContact O-N 3.13Å; W175-S177 VanDerWaalsContact C-N 3.29Å; W175-S177 PolarHBondContact O-N 2.62Å; W175-E178 PolarHBondContact O-N 3.1Å; W175-W659 HydrophobicContact CH2-CH2 4.2Å; W175-W659 HydrophobicContact CH2-CZ3 4.16Å; W175-L662 HydrophobicContact CH2-CD1 3.92Å; W175-L662 HydrophobicContact CZ3-CD1 4.35Å
176	A	33	Very low	31.9	Very low	56 Å²	56	121.5 Å²	121.5	46%	0.463	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-67.7	-26.7	-176.9	0	0	0	0	0	113.5	L173	L173-A176 PolarHBondContact O-N 3.19Å
177	S	33.3	Very low	32.1	Very low	77 Å²	77	117.3 Å²	117.3	54%	0.538	61%	0.612	S	S	.	*	G	3₁₀ helix	trans	-84.3	-4.9	-176.6	57.4	0	0	0	0	115.3	W175 K183	W175-S177 VanDerWaalsContact C-N 3.29Å; W175-S177 PolarHBondContact O-N 2.62Å; S177-K183 PolarHBondContact O-NZ 3.34Å
178	E	37.6	Very low	32.3	Very low	143 Å²	143	121.2 Å²	121.2	67%	0.668	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-96	-3.6	170.4	-66.8	-161	179.3	0	0	113.5	W175 P180	W175-E178 PolarHBondContact O-N 3.1Å; E178-P180 WeakPolarHBondContact O-CD 3.47Å
179	L	34.7	Very low	32.4	Very low	97 Å²	97	118.5 Å²	118.5	51%	0.508	61%	0.612	S	S	.	*			trans	-67.9	124.7	172.3	-73.2	166.8	0	0	0	110.9	F181	L179-F181 VanDerWaalsContact C-N 3.34Å; L179-F181 PolarHBondContact O-N 3.37Å
180	P	34.9	Very low	32.4	Very low	52 Å²	52	117.9 Å²	117.9	34%	0.338	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.3	-24	-171.4	-24.9	35.3	0	0	0	116.1	E178 S182 K183 I750	E178-P180 WeakPolarHBondContact O-CD 3.47Å; P180-S182 VanDerWaalsContact C-N 3.28Å; P180-S182 PolarHBondContact O-N 3.06Å; P180-S182 VanDerWaalsContact O-N 3.15Å; P180-K183 PolarHBondContact O-N 3.33Å; P180-I750 HydrophobicContact CG-CD1 3.64Å; P180-I750 HydrophobicContact CG-CG1 4.26Å
181	F	35.2	Very low	32.4	Very low	188 Å²	188	112.5 Å²	112.5	83%	0.825	58%	0.581	S	S	*	*	H	α-helix	trans	-63.6	-23.8	-165.4	-70	-78.9	0	0	0	115.3	L179	L179-F181 VanDerWaalsContact C-N 3.34Å; L179-F181 PolarHBondContact O-N 3.37Å
182	S	32.8	Very low	32.2	Very low	61 Å²	61	115.4 Å²	115.4	43%	0.427	59%	0.59	S	S	.	*	H	α-helix	trans	-80.8	-26.6	175.6	58	0	0	0	0	113.8	P180 Y185 L186	P180-S182 VanDerWaalsContact C-N 3.28Å; P180-S182 PolarHBondContact O-N 3.06Å; P180-S182 VanDerWaalsContact O-N 3.15Å; S182-Y185 PolarHBondContact O-N 2.59Å; S182-L186 PolarHBondContact O-N 3.16Å; S182-L186 VanDerWaalsContact O-N 3.15Å
183	K	29.5	Very low	31.8	Very low	117 Å²	117	114.3 Å²	114.3	51%	0.509	58%	0.58	S	S	.	*	H	α-helix	trans	-76.4	-27.5	-171.4	-81.7	166.1	175.8	148	0	113.5	S177 P180 H187	S177-K183 PolarHBondContact O-NZ 3.34Å; P180-K183 PolarHBondContact O-N 3.33Å; K183-H187 PolarHBondContact O-N 3.04Å; K183-H187 VanDerWaalsContact O-N 3.14Å
184	S	33	Very low	31.5	Very low	94 Å²	94	109.1 Å²	109.1	66%	0.657	55%	0.553	S	S	*	*	H	α-helix	trans	-67.7	-37.8	173.5	-54.4	0	0	0	0	112.4
185	Y	31.7	Very low	31.3	Very low	196 Å²	196	114.3 Å²	114.3	77%	0.769	57%	0.57	S	S	*	*	H	α-helix	trans	-74.8	-39.8	178.5	-133.9	-94.9	0	0	0	111.9	S182 H187 M188 K189	S182-Y185 PolarHBondContact O-N 2.59Å; Y185-H187 VanDerWaalsContact C-N 3.28Å; Y185-H187 PolarHBondContact O-N 3.25Å; Y185-M188 PolarHBondContact O-N 3.37Å; Y185-K189 PolarHBondContact O-N 3.17Å
186	L	29.4	Very low	30.9	Very low	116 Å²	116	112.9 Å²	112.9	61%	0.607	58%	0.579	S	S	*	*	H	α-helix	trans	-68.6	-21.5	176.4	-80.4	164.7	0	0	0	113.8	S182	S182-L186 PolarHBondContact O-N 3.16Å; S182-L186 VanDerWaalsContact O-N 3.15Å
187	H	31.9	Very low	30.7	Very low	111 Å²	111	115.4 Å²	115.4	51%	0.514	59%	0.588	S	S	.	*	H	α-helix	trans	-77.5	-31.1	175.1	-119.7	-86	0	0	0	113.6	K183 Y185 Q1435	K183-H187 PolarHBondContact O-N 3.04Å; K183-H187 VanDerWaalsContact O-N 3.14Å; Y185-H187 VanDerWaalsContact C-N 3.28Å; Y185-H187 PolarHBondContact O-N 3.25Å; H187-Q1435 PolarHBondContact ND1-NE2 2.98Å; H187-Q1435 VanDerWaalsContact ND1-NE2 3.1Å; H187-Q1435 PolarHBondContact O-NE2 2.88Å; H187-Q1435 VanDerWaalsContact O-NE2 3.13Å; H187-Q1435 PolarHBondContact O-OE1 2.81Å
188	M	31.2	Very low	30.4	Very low	157 Å²	157	119.8 Å²	119.8	77%	0.773	60%	0.6	S	S	*	*	H	α-helix	trans	-77.8	-37.1	173.8	-98.2	-178.6	70.6	0	0	112.9	Y185 N190	Y185-M188 PolarHBondContact O-N 3.37Å; M188-N190 PolarHBondContact O-N 3.25Å
189	K	28.2	Very low	29.8	Very low	152 Å²	152	119.7 Å²	119.7	66%	0.661	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-4.2	-176.3	-157.5	166.7	-177.1	176.7	0	114.4	Y185	Y185-K189 PolarHBondContact O-N 3.17Å
190	N	29.4	Very low	29.4	Very low	103 Å²	103	122.4 Å²	122.4	55%	0.551	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	9	-175.3	-145.3	66	0	0	0	114.8	M188	M188-N190 PolarHBondContact O-N 3.25Å
191	N	29.5	Very low	28.9	Very low	50 Å²	50	126.9 Å²	126.9	27%	0.267	64%	0.636	S	S	.	*	S	Bend	trans	-111.5	-5.6	173.3	-62	-4.4	0	0	0	113.5	H1433 Q1435	N191-H1433 PolarHBondContact ND2-ND1 2.69Å; N191-H1433 PolarHBondContact OD1-CE1 3.35Å; N191-Q1435 PolarHBondContact ND2-OE1 3.01Å; N191-Q1435 PolarHBondContact OD1-NE2 2.82Å; N191-Q1435 PolarHBondContact OD1-OE1 3.33Å
192	N	29.1	Very low	28.4	Very low	150 Å²	150	121.7 Å²	121.7	80%	0.802	63%	0.628	S	S	*	*	S	Bend	trans	-119.2	18.6	-174.3	-86	62.3	0	0	0	113.1
193	F	27	Very low	28	Very low	117 Å²	117	127.3 Å²	127.3	51%	0.513	65%	0.647	S	S	.	*	S	Bend	trans	-104.2	147.5	169.4	-132.3	-101.1	0	0	0	108.7	T307	F193-T307 WeakPolarHBondContact O-CG2 3.12Å; F193-T307 PolarHBondContact O-OG1 2.94Å
194	N	26.7	Very low	27.8	Very low	30 Å²	30	128.6 Å²	128.6	16%	0.16	66%	0.658	C	S	.	*			trans	91.2	1.3	159.6	-157.2	133	0	0	0	118	T196 S306 T307 S308	N194-T196 PolarHBondContact O-N 2.88Å; N194-S306 VanDerWaalsContact CB-CB 3.42Å; N194-S306 WeakPolarHBondContact CB-OG 3.32Å; N194-S306 WeakPolarHBondContact OD1-CB 3.48Å; N194-S306 PolarHBondContact OD1-N 3.05Å; N194-S306 VanDerWaalsContact OD1-N 3.17Å; N194-S306 PolarHBondContact OD1-OG 3.26Å; N194-T307 VanDerWaalsContact CB-OG1 3.31Å; N194-T307 WeakPolarHBondContact CB-OG1 3.32Å; N194-T307 PolarHBondContact ND2-O 3.11Å; N194-T307 PolarHBondContact O-OG1 3.26Å; N194-S308 PolarHBondContact O-OG 2.96Å; N194-S308 VanDerWaalsContact O-OG 3.06Å
195	E	26	Very low	27.4	Very low	175 Å²	175	130.7 Å²	130.7	82%	0.818	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	67.7	146.1	-76.7	-175	154.7	0	0	108.2	T307	E195-T307 PolarHBondContact N-OG1 3.43Å
196	T	26	Very low	27.1	Very low	129 Å²	129	131.9 Å²	131.9	79%	0.791	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-178.6	28.3	178.4	11.3	0	0	0	0	113	N194	N194-T196 PolarHBondContact O-N 2.88Å
197	V	27.8	Very low	26.8	Very low	108 Å²	108	129.8 Å²	129.8	66%	0.655	66%	0.656	S	S	*	*			trans	-133.6	55	166.5	-160.9	0	0	0	0	111
198	E	26.2	Very low	26.6	Very low	170 Å²	170	133 Å²	133	79%	0.794	67%	0.665	S	S	*	*	S	Bend	trans	-80.1	150	142.2	-70.2	-171	127.2	0	0	108.4
199	N	26.4	Very low	26.3	Very low	141 Å²	141	129.3 Å²	129.3	75%	0.754	66%	0.655	S	S	*	*	S	Bend	trans	60.8	68.2	163	-53.7	-36.3	0	0	0	117.4
200	N	26.6	Very low	26.2	Very low	154 Å²	154	125.5 Å²	125.5	82%	0.824	64%	0.638	S	S	*	*			trans	-151.2	31.3	147.4	-113.5	-32.9	0	0	0	116.7
201	E	24.1	Very low	26.1	Very low	145 Å²	145	125.2 Å²	125.2	68%	0.678	64%	0.64	S	S	*	*			trans	-106	84.9	145.1	-83	-157.1	144.1	0	0	108.4	Q112	Q112-E201 PolarHBondContact NE2-OE2 2.65Å
202	A	23.8	Very low	25.9	Very low	80 Å²	80	128 Å²	128	66%	0.661	66%	0.655	S	S	*	*			trans	-132.1	41	-179.9	0	0	0	0	0	112.1
203	H	24.7	Very low	25.8	Very low	179 Å²	179	127.2 Å²	127.2	83%	0.829	65%	0.65	S	S	*	*			trans	-131.1	127.6	170.5	-104.8	-91.3	0	0	0	111
204	L	25	Very low	25.8	Very low	143 Å²	143	126.3 Å²	126.3	75%	0.749	65%	0.654	S	S	*	*	S	Bend	trans	76.1	69.3	-174.2	-62.9	157.3	0	0	0	114.2
205	Q	25	Very low	25.7	Very low	138 Å²	138	132.4 Å²	132.4	65%	0.645	68%	0.681	S	S	*	*				94.5	143.1	60.7	-78.9	-176.2	-6.7	0	0	114.1
206	R	24.7	Very low	25.7	Very low	221 Å²	221	129.5 Å²	129.5	83%	0.834	68%	0.676	S	S	*	*			trans	76.4	131	161.3	-66.1	161	-178.2	-178.4	0.4	117.4
207	S	24.4	Very low	25.7	Very low	72 Å²	72	127.8 Å²	127.8	50%	0.503	67%	0.669	S	S	.	*			cis	-165	166.6	-10.6	-79.1	0	0	0	0	111.9
208	Y	26.4	Very low	25.6	Very low	180 Å²	180	129.3 Å²	129.3	71%	0.706	67%	0.672	S	S	*	*			trans	65.3	114.9	157.6	-50.6	-53.6	0	0	0	116.6
209	S	26.6	Very low	25.5	Very low	79 Å²	79	128.6 Å²	128.6	55%	0.552	67%	0.673	S	S	*	*				72.7	146.6	53.4	88.6	0	0	0	0	113.4
210	K	26.2	Very low	25.5	Very low	72 Å²	72	127.2 Å²	127.2	31%	0.313	67%	0.674	S	S	.	*			cis	-162.3	-165.1	23.9	-158.8	149.8	167.2	-76.5	0	112	E270	K210-E270 HydrophobicContact CD-CG 4.19Å; K210-E270 VanDerWaalsContact CD-OE1 3.24Å; K210-E270 WeakPolarHBondContact CD-OE1 3.14Å; K210-E270 WeakPolarHBondContact CG-OE1 3.39Å; K210-E270 IonicContact NZ-OE1 2.82Å; K210-E270 PolarHBondContact NZ-OE1 3.23Å; K210-E270 IonicContact NZ-OE2 3.57Å; K210-E270 PolarHBondContact NZ-OE2 2.95Å
211	V	26.3	Very low	25.5	Very low	97 Å²	97	123.5 Å²	123.5	59%	0.588	67%	0.672	S	S	*	*			trans	85.3	102.4	171.4	-167	0	0	0	0	111.6
212	N	26.2	Very low	25.6	Very low	108 Å²	108	121.9 Å²	121.9	58%	0.578	68%	0.677	S	S	*	*				70.5	152.4	58.9	-55.8	10.8	0	0	0	111.5
213	L	26.5	Very low	26.1	Very low	134 Å²	134	122.1 Å²	122.1	70%	0.702	67%	0.672	S	S	*	*			cis	-133.8	126.5	18.9	-100.6	94	0	0	0	109.5
214	T	25.9	Very low	26.1	Very low	97 Å²	97	121.6 Å²	121.6	60%	0.595	67%	0.67	S	S	*	*				82.7	159.8	84	60.2	0	0	0	0	116.3
215	Q	26	Very low	26.3	Very low	158 Å²	158	122.6 Å²	122.6	74%	0.738	67%	0.671	S	S	*	*			trans	76.7	131.1	149.4	-85.2	155	-28.7	0	0	118.1
216	T	26.1	Very low	26.3	Very low	114 Å²	114	121.9 Å²	121.9	70%	0.699	67%	0.671	S	S	*	*			cis	-158.9	155.8	-7.5	-13.5	0	0	0	0	112.8
217	S	25.8	Very low	26.5	Very low	93 Å²	93	117.6 Å²	117.6	65%	0.65	67%	0.665	S	S	*	*			trans	23.1	146	139.3	66.2	0	0	0	0	120.6
218	I	25.1	Very low	26.5	Very low	141 Å²	141	120.2 Å²	120.2	72%	0.723	67%	0.669	S	S	*	*				-162.6	132.7	83.4	-106.7	170.3	0	0	0	113.4
219	L	24.6	Very low	26.5	Very low	154 Å²	154	120.2 Å²	120.2	81%	0.806	67%	0.669	S	S	*	*			trans	56	155.7	158.4	-83.8	61.1	0	0	0	118.5
220	S	25.3	Very low	26.5	Very low	112 Å²	112	124.8 Å²	124.8	78%	0.783	68%	0.682	S	S	*	*			cis	-170.4	160.3	-11.7	43.8	0	0	0	0	109.1
221	G	27.3	Very low	26.6	Very low	76 Å²	76	127.8 Å²	127.8	78%	0.784	70%	0.697	S	S	*	*			trans	134.3	53.5	159.9	0	0	0	0	0	118.7
222	S	26.7	Very low	26.6	Very low	111 Å²	111	127.9 Å²	127.9	78%	0.776	70%	0.702	S	S	*	*			trans	-60.9	-180	155.7	47.4	0	0	0	0	113.5
223	P	33.3	Very low	26.8	Very low	86 Å²	86	130.2 Å²	130.2	56%	0.558	71%	0.709	S	S	*	*			cis	-144.3	-162.6	-35.8	38.1	-17.8	0	0	0	114.3
224	E	25	Very low	26.9	Very low	168 Å²	168	129.8 Å²	129.8	79%	0.785	71%	0.712	S	S	*	*			trans	65.8	165.3	151.3	-77.7	126.9	-129.8	0	0	118.5
225	E	29	Very low	26.9	Very low	163 Å²	163	129.5 Å²	129.5	76%	0.762	71%	0.714	S	S	*	*			cis	-155.9	140.3	19.5	-154.3	166.1	-155.1	0	0	114.8
226	N	25.7	Very low	27	Very low	123 Å²	123	127.5 Å²	127.5	66%	0.658	71%	0.713	S	S	*	*			trans	29.9	162	149.2	-54.8	-22.8	0	0	0	128.7
227	D	28.5	Very low	27	Very low	131 Å²	131	128.4 Å²	128.4	70%	0.701	71%	0.713	S	S	*	*			trans	79.1	148.3	143.3	-73.6	-18.7	0	0	0	123.6
228	Q	24.9	Very low	27.1	Very low	127 Å²	127	130 Å²	130	59%	0.593	72%	0.719	S	S	*	*			cis	-168.2	167.4	-23.2	-143.3	164.7	60	0	0	112.3
229	Y	25.9	Very low	27.3	Very low	180 Å²	180	129.1 Å²	129.1	71%	0.706	73%	0.726	S	S	*	*			trans	59.9	114.9	168.5	-62.3	-65.3	0	0	0	120.1
230	E	26.4	Very low	27.3	Very low	175 Å²	175	130.7 Å²	130.7	82%	0.818	73%	0.729	S	S	*	*				77.1	152.1	72.4	-70.3	-162.4	107.1	0	0	114.9
231	E	28	Very low	27.3	Very low	136 Å²	136	133.4 Å²	133.4	64%	0.636	73%	0.734	S	S	*	*			cis	-117.6	-144.1	24.4	-163.6	-124.6	140.3	0	0	110.5	H233	E231-H233 IonicContact OE1-CD2 3.29Å; E231-H233 PolarHBondContact OE1-CD2 3.08Å; E231-H233 IonicContact OE1-CG 3.58Å; E231-H233 PolarHBondContact OE1-N 3.44Å; E231-H233 IonicContact OE1-NE2 2.65Å
232	S	26.2	Very low	27.2	Very low	98 Å²	98	137.5 Å²	137.5	69%	0.685	74%	0.736	S	S	*	*			cis	-150.8	163.2	12	-56.1	0	0	0	0	119.5
233	H	29.9	Very low	27	Very low	157 Å²	157	137.6 Å²	137.6	73%	0.727	74%	0.737	S	S	*	*			trans	-79.9	167.6	176.2	-66.4	-47.7	0	0	0	116.4	E231	E231-H233 IonicContact OE1-CD2 3.29Å; E231-H233 PolarHBondContact OE1-CD2 3.08Å; E231-H233 IonicContact OE1-CG 3.58Å; E231-H233 PolarHBondContact OE1-N 3.44Å; E231-H233 IonicContact OE1-NE2 2.65Å
234	T	29.4	Very low	26.6	Very low	125 Å²	125	143 Å²	143	77%	0.767	75%	0.751	S	S	*	*			cis	-158.7	158.1	-3.2	11	0	0	0	0	115.3
235	S	25.5	Very low	26.9	Very low	92 Å²	92	144 Å²	144	64%	0.643	76%	0.756	S	S	*	*			trans	-34.7	162	161.8	56.8	0	0	0	0	120.9
236	T	28.4	Very low	26.8	Very low	115 Å²	115	140.8 Å²	140.8	71%	0.706	75%	0.75	S	S	*	*				-175.4	158.2	64.7	23	0	0	0	0	116.7
237	N	27	Very low	26.9	Very low	134 Å²	134	142 Å²	142	72%	0.717	76%	0.756	S	S	*	*			trans	72	110	138.3	-66.8	-4.7	0	0	0	127
238	T	26.7	Very low	26.6	Very low	125 Å²	125	141.3 Å²	141.3	77%	0.767	75%	0.752	S	S	*	*				56.3	124	125.9	65	0	0	0	0	123.6
239	S	29.1	Very low	26.6	Very low	124 Å²	124	141.6 Å²	141.6	87%	0.867	76%	0.756	S	S	*	*				177.1	172.9	92.4	52.1	0	0	0	0	114.2
240	Q	25.4	Very low	26.6	Very low	187 Å²	187	139.4 Å²	139.4	87%	0.874	76%	0.762	S	S	*	*			trans	-74	145.1	-160	-58.6	159.7	-15.7	0	0	116.4
241	L	25.4	Very low	26.5	Very low	169 Å²	169	134.2 Å²	134.2	89%	0.885	76%	0.755	S	S	*	*				-166.7	167.9	128.5	-110.4	164.2	0	0	0	113.8
242	I	23.9	Very low	26.3	Very low	161 Å²	161	134.3 Å²	134.3	83%	0.826	77%	0.765	S	S	*	*			trans	-99.5	121.6	-159	-61.3	159.3	0	0	0	112.7
243	S	24.4	Very low	26.1	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	77%	0.774	S	S	*	*			trans	-162.5	150.4	144.5	-163.4	0	0	0	0	112.1	H245	S243-H245 PolarHBondContact O-N 2.77Å
244	K	24.8	Very low	25.9	Very low	200 Å²	200	135.5 Å²	135.5	87%	0.87	78%	0.776	S	S	*	*			trans	-78	110.4	-166.8	-69.1	175.8	177.4	175.6	0	113.4
245	H	29.9	Very low	25.7	Very low	190 Å²	190	135.2 Å²	135.2	88%	0.88	78%	0.775	S	S	*	*			trans	35.7	85.3	162.4	-83.1	-78.9	0	0	0	117.7	S243	S243-H245 PolarHBondContact O-N 2.77Å
246	C	27	Very low	25.6	Very low	95 Å²	95	137.5 Å²	137.5	64%	0.642	79%	0.785	S	S	*	*			trans	-46.5	158.8	151.9	-67	0	0	0	0	112.8
247	L	27.1	Very low	25.4	Very low	147 Å²	147	137 Å²	137	77%	0.77	79%	0.786	S	S	*	*			cis	62.6	148.8	45.1	-51.5	166	0	0	0	110.3
248	N	23.7	Very low	25.2	Very low	117 Å²	117	138.8 Å²	138.8	63%	0.626	79%	0.788	S	S	*	*			cis	-164.8	176	-1.8	-122.2	-9.4	0	0	0	109.5
249	I	25.1	Very low	25	Very low	133 Å²	133	137.6 Å²	137.6	68%	0.682	79%	0.785	S	S	*	*			trans	30.7	123.2	134.5	-51.6	164	0	0	0	116.7
250	T	24.8	Very low	24.8	Very low	134 Å²	134	137.7 Å²	137.7	82%	0.822	78%	0.78	S	S	*	*				-173.1	153.5	62.7	-24.3	0	0	0	0	112.1
251	G	24.7	Very low	24.7	Very low	66 Å²	66	132.9 Å²	132.9	68%	0.68	77%	0.767	S	S	*	*			trans	68.6	169	157.6	0	0	0	0	0	116.8
252	T	23.5	Very low	24.6	Very low	138 Å²	138	134.8 Å²	134.8	85%	0.847	76%	0.764	S	S	*	*			cis	-152.6	172.7	-16.9	-7.6	0	0	0	0	109.3	S254	T252-S254 PolarHBondContact O-N 3.03Å
253	I	22.9	Very low	24.7	Very low	168 Å²	168	132 Å²	132	86%	0.862	76%	0.759	S	S	*	*			trans	-50.1	124.6	-178.7	-58.5	153.2	0	0	0	113.3
254	S	25.5	Very low	24.7	Very low	112 Å²	112	132.5 Å²	132.5	78%	0.783	75%	0.753	S	S	*	*			trans	-161.8	157.9	148.8	59.5	0	0	0	0	112.1	T252	T252-S254 PolarHBondContact O-N 3.03Å
255	T	24	Very low	24.8	Very low	119 Å²	119	131.2 Å²	131.2	73%	0.73	75%	0.75	S	S	*	*			trans	-120.2	153.4	-176.6	47.9	0	0	0	0	111.3
256	T	23.6	Very low	24.6	Very low	141 Å²	141	128 Å²	128	87%	0.865	74%	0.739	S	S	*	*			trans	63	160.1	168.3	50.4	0	0	0	0	115
257	S	24.8	Very low	24.4	Very low	103 Å²	103	130.1 Å²	130.1	72%	0.72	74%	0.743	S	S	*	*			cis	-145.1	179.9	16.9	59.7	0	0	0	0	114.3
258	F	22.4	Very low	24.2	Very low	173 Å²	173	128.8 Å²	128.8	76%	0.759	74%	0.736	S	S	*	*			trans	-29.5	157.7	143.4	-71.1	-92.2	0	0	0	114.7
259	S	22.7	Very low	24.2	Very low	100 Å²	100	130.1 Å²	130.1	70%	0.699	74%	0.736	S	S	*	*			cis	-163.7	175.6	12.4	22.4	0	0	0	0	113.4
260	T	24.5	Very low	24.2	Very low	125 Å²	125	127.6 Å²	127.6	77%	0.767	72%	0.722	S	S	*	*			trans	-12.5	150.6	154.1	56.6	0	0	0	0	117.9
261	S	23.6	Very low	24.2	Very low	87 Å²	87	125.5 Å²	125.5	61%	0.608	71%	0.713	S	S	*	*				175.3	168	75.8	53.2	0	0	0	0	115.1
262	Y	24.6	Very low	24.2	Very low	208 Å²	208	129.7 Å²	129.7	82%	0.816	72%	0.715	S	S	*	*			trans	60.6	157.7	161.9	-63.9	-63.8	0	0	0	118.4
263	S	26.1	Very low	24.3	Very low	102 Å²	102	130.4 Å²	130.4	71%	0.713	71%	0.712	S	S	*	*			cis	-141	146.9	9.4	44.8	0	0	0	0	114.8
264	N	24	Very low	24.2	Very low	125 Å²	125	128.9 Å²	128.9	67%	0.668	71%	0.705	S	S	*	*			trans	19.6	128.3	135.7	-40.3	-17.8	0	0	0	119.9
265	Q	26.5	Very low	24.1	Very low	173 Å²	173	130.5 Å²	130.5	81%	0.808	70%	0.704	S	S	*	*				175.5	109	100.8	-92.1	-175.3	-25.2	0	0	114.6
266	D	24.6	Very low	24	Very low	122 Å²	122	131.9 Å²	131.9	65%	0.652	70%	0.7	S	S	*	*				63.7	106.5	121.4	-58.4	-28.1	0	0	0	125.3
267	L	23.3	Very low	24	Very low	139 Å²	139	134.4 Å²	134.4	73%	0.728	69%	0.693	S	S	*	*				76.9	130.3	113.4	-68.7	169.3	0	0	0	123.9
268	L	23.5	Very low	23.9	Very low	120 Å²	120	136.2 Å²	136.2	63%	0.628	70%	0.695	S	S	*	*			trans	71.3	150	144.6	-63.2	166	0	0	0	118.1
269	K	24.4	Very low	23.9	Very low	144 Å²	144	131.6 Å²	131.6	63%	0.626	68%	0.684	S	S	*	*			cis	-159.6	-176.1	29	-136.6	151.8	-172.2	175.4	0	113
270	E	24.5	Very low	24.1	Very low	80 Å²	80	136.2 Å²	136.2	37%	0.374	69%	0.687	S	S	.	*			trans	-49.7	163.6	169.5	-98.2	82.6	-146.3	0	0	113.5	K210	K210-E270 HydrophobicContact CD-CG 4.19Å; K210-E270 VanDerWaalsContact CD-OE1 3.24Å; K210-E270 WeakPolarHBondContact CD-OE1 3.14Å; K210-E270 WeakPolarHBondContact CG-OE1 3.39Å; K210-E270 IonicContact NZ-OE1 2.82Å; K210-E270 PolarHBondContact NZ-OE1 3.23Å; K210-E270 IonicContact NZ-OE2 3.57Å; K210-E270 PolarHBondContact NZ-OE2 2.95Å
271	S	24.8	Very low	24.1	Very low	91 Å²	91	136.4 Å²	136.4	64%	0.636	68%	0.684	S	S	*	*			cis	-163	151.6	49.3	51.5	0	0	0	0	117.3
272	Q	24.5	Very low	24.1	Very low	153 Å²	153	138.5 Å²	138.5	72%	0.715	69%	0.693	S	S	*	*			trans	-19.7	153.1	137.5	-55.1	177.7	-3.5	0	0	117.1
273	I	24.8	Very low	24.3	Very low	154 Å²	154	133.5 Å²	133.5	79%	0.79	69%	0.685	S	S	*	*				-162.9	153.3	110.6	-101.4	160.3	0	0	0	111.4
274	N	22.3	Very low	24.1	Very low	136 Å²	136	133 Å²	133	73%	0.727	68%	0.682	S	S	*	*			trans	-72.4	-167.3	-179.8	-75.1	-70.6	0	0	0	113.5
275	I	23.4	Very low	24.1	Very low	145 Å²	145	133.6 Å²	133.6	74%	0.744	69%	0.685	S	S	*	*			trans	100.3	124.6	159.4	-55.6	163.9	0	0	0	113.2
276	K	21.6	Very low	24.1	Very low	149 Å²	149	133.3 Å²	133.3	65%	0.648	68%	0.682	S	S	*	*			cis	178	156.9	-23.3	-119.2	168.5	-178.8	169.1	0	106
277	R	22.8	Very low	24.1	Very low	194 Å²	194	136.6 Å²	136.6	73%	0.732	69%	0.686	S	S	*	*			trans	63.1	133.8	143.2	-75.7	175.5	176.4	168	-5.7	120.3
278	N	22.5	Very low	24.1	Very low	141 Å²	141	134.7 Å²	134.7	75%	0.754	69%	0.685	S	S	*	*			trans	72.4	152	133.9	-65.2	26.4	0	0	0	118.4
279	S	23.3	Very low	24.1	Very low	75 Å²	75	137.4 Å²	137.4	52%	0.524	69%	0.694	S	S	.	*			cis	-170.4	-168.1	-22.8	48.9	0	0	0	0	108
280	Y	25.8	Very low	24.2	Very low	197 Å²	197	137 Å²	137	77%	0.773	70%	0.704	S	S	*	*			trans	84.5	88.5	167.4	-54.8	-66.2	0	0	0	118.3
281	D	24.6	Very low	24.1	Very low	130 Å²	130	142.9 Å²	142.9	70%	0.695	73%	0.728	S	S	*	*				66.9	109.3	100.6	-59	3.6	0	0	0	120.7
282	V	25.3	Very low	24.1	Very low	131 Å²	131	144.6 Å²	144.6	79%	0.794	73%	0.73	S	S	*	*				55.4	136	100.6	162.9	0	0	0	0	118.2
283	P	27.8	Very low	24.3	Very low	102 Å²	102	142.4 Å²	142.4	66%	0.662	72%	0.723	S	S	*	*			cis	-145.7	-150.8	-19.8	41.1	-19.4	0	0	0	113.7
284	S	23	Very low	24.2	Very low	93 Å²	93	140.8 Å²	140.8	65%	0.65	71%	0.708	S	S	*	*			trans	79.6	128.8	144.9	55	0	0	0	0	121.9
285	D	23.4	Very low	24.5	Very low	137 Å²	137	138.8 Å²	138.8	73%	0.733	70%	0.702	S	S	*	*			trans	97.1	115.1	135.3	-70.9	5.6	0	0	0	123.9
286	F	25.2	Very low	24.6	Very low	166 Å²	166	138 Å²	138	73%	0.728	69%	0.693	S	S	*	*			trans	91.1	108.7	138	-83.2	-130.9	0	0	0	120.9
287	Y	26	Very low	24.9	Very low	192 Å²	192	135.4 Å²	135.4	75%	0.753	68%	0.683	S	S	*	*			trans	75.4	94.3	144.6	-77.4	-98	0	0	0	122.1
288	S	22.9	Very low	25	Very low	99 Å²	99	136.6 Å²	136.6	69%	0.692	69%	0.689	S	S	*	*				73.2	132.5	117.5	67.8	0	0	0	0	122.7
289	E	23.9	Very low	25.2	Very low	177 Å²	177	133.7 Å²	133.7	83%	0.827	67%	0.668	S	S	*	*			trans	72.4	86.1	155.1	-62.9	-164.2	156	0	0	120.9
290	T	25.1	Very low	25.2	Very low	136 Å²	136	136.7 Å²	136.7	83%	0.834	68%	0.678	S	S	*	*			trans	67.6	100.1	136	59.8	0	0	0	0	119.8
291	K	22.9	Very low	25.4	Very low	202 Å²	202	132.4 Å²	132.4	88%	0.878	67%	0.674	S	S	*	*			trans	-107.2	141.7	147.9	-73.3	176.3	-180	168.9	0	109.2
292	L	26.1	Very low	25.4	Very low	128 Å²	128	131.8 Å²	131.8	67%	0.67	68%	0.68	S	S	*	*			trans	-142.9	123.1	169.3	-147.5	163.1	0	0	0	108
293	N	26.9	Very low	25.3	Very low	107 Å²	107	134.8 Å²	134.8	57%	0.572	68%	0.683	S	S	*	*			trans	-95.7	161.1	-164.1	-82	-16.8	0	0	0	114.5	C318	N293-C318 VanDerWaalsContact CB-SG 3.57Å; N293-C318 WeakPolarHBondContact O-CA 3Å; N293-C318 WeakPolarHBondContact O-CB 3.29Å
294	Y	23.7	Very low	25	Very low	120 Å²	120	134.7 Å²	134.7	47%	0.471	68%	0.683	S	S	.	*			trans	-105.5	168.9	163.1	-68.8	-79.2	0	0	0	106.3	T319 T320	Y294-T319 WeakPolarHBondContact CE1-O 3.48Å; Y294-T319 PolarHBondContact OH-O 3.31Å; Y294-T320 WeakPolarHBondContact CE1-OG1 3.44Å; Y294-T320 WeakPolarHBondContact OH-CB 3.26Å; Y294-T320 WeakPolarHBondContact OH-CG2 3.37Å; Y294-T320 PolarHBondContact OH-OG1 3.11Å
295	P	27.7	Very low	25.1	Very low	93 Å²	93	136.4 Å²	136.4	60%	0.604	68%	0.681	S	S	*	*			cis	-162	-161.2	44.6	37.7	-10.1	0	0	0	118.4
296	K	26.9	Very low	25.1	Very low	128 Å²	128	132.4 Å²	132.4	56%	0.557	66%	0.664	S	S	*	*			trans	81.8	146.3	154.4	-68.7	173	163.4	-76.5	0	117.9
297	E	27.3	Very low	25.1	Very low	95 Å²	95	127.1 Å²	127.1	44%	0.444	65%	0.645	S	S	.	*			cis	-158.6	150.3	-16.8	-129.2	150.4	-160.1	0	0	111.6
298	Y	24.6	Very low	25.1	Very low	219 Å²	219	121.7 Å²	121.7	86%	0.859	64%	0.635	S	S	*	*			trans	-159.4	106.3	155.5	-96.8	-72.7	0	0	0	107.8
299	Y	26.7	Very low	25.2	Very low	80 Å²	80	126.2 Å²	126.2	31%	0.314	64%	0.643	S	S	.	*			trans	-83.9	-168.2	170.2	-116.4	-97.3	0	0	0	109.8	F104 Y105 L106	F104-Y299 HydrophobicContact CB-CE2 3.74Å; F104-Y299 WeakPolarHBondContact O-CD2 3.22Å; F104-Y299 WeakPolarHBondContact O-CE2 3.39Å; Y105-Y299 WeakPolarHBondContact CA-OH 3.49Å; Y105-Y299 WeakPolarHBondContact CB-OH 3.43Å; Y105-Y299 AromaticContact CD1-CD2 3.11Å; Y105-Y299 HydrophobicContact CD1-CD2 3.11Å; Y105-Y299 AromaticContact CD1-CE2 3.29Å; Y105-Y299 HydrophobicContact CD1-CE2 3.29Å; Y105-Y299 AromaticContact CD1-CG 3.93Å; Y105-Y299 HydrophobicContact CD1-CG 3.93Å; Y105-Y299 HydrophobicContact CD2-CD2 4.04Å; Y105-Y299 HydrophobicContact CD2-CE1 4.07Å; Y105-Y299 AromaticContact CD2-CE2 3.14Å; Y105-Y299 HydrophobicContact CD2-CE2 3.14Å; Y105-Y299 AromaticContact CD2-CZ 3.14Å; Y105-Y299 WeakPolarHBondContact CD2-OH 3.34Å; Y105-Y299 HydrophobicContact CE1-CD2 4.29Å; Y105-Y299 HydrophobicContact CE1-CE2 4.22Å; Y105-Y299 HydrophobicContact CE2-CE2 4.1Å; Y105-Y299 AromaticContact CG-CD1 3.87Å; Y105-Y299 HydrophobicContact CG-CD1 3.87Å; Y105-Y299 AromaticContact CG-CD2 2.9Å; Y105-Y299 HydrophobicContact CG-CD2 2.9Å; Y105-Y299 AromaticContact CG-CE1 3.65Å; Y105-Y299 HydrophobicContact CG-CE1 3.65Å; Y105-Y299 AromaticContact CG-CE2 2.58Å; Y105-Y299 HydrophobicContact CG-CE2 2.58Å; Y105-Y299 AromaticContact CG-CG 3.56Å; Y105-Y299 HydrophobicContact CG-CG 3.56Å; Y105-Y299 AromaticContact CG-CZ 3.01Å; Y105-Y299 PolarHBondContact N-OH 3.41Å; Y105-Y299 VanDerWaalsContact O-CD1 3.29Å; Y105-Y299 WeakPolarHBondContact O-CD1 3.35Å; Y105-Y299 WeakPolarHBondContact O-CE1 3.26Å; L106-Y299 HydrophobicContact CB-CD1 3.8Å; L106-Y299 HydrophobicContact CD1-CD1 3.97Å; L106-Y299 HydrophobicContact CG-CD1 3.66Å; L106-Y299 HydrophobicContact CG-CG 4.41Å
300	L	23.3	Very low	25.3	Very low	139 Å²	139	124 Å²	124	73%	0.728	64%	0.641	S	S	*	*			trans	-109.2	-161.1	-160.9	-133.7	76.2	0	0	0	113.8	L106	L106-L300 HydrophobicContact CD1-CB 4.45Å
301	P	29.8	Very low	25.3	Very low	107 Å²	107	123.8 Å²	123.8	70%	0.695	64%	0.635	S	S	*	*			trans	-114.2	150.8	-138.5	40	-23.8	0	0	0	116.2
302	S	23.9	Very low	25.5	Very low	116 Å²	116	119.9 Å²	119.9	81%	0.811	63%	0.628	S	S	*	*			trans	-156.9	170	164	53	0	0	0	0	114
303	F	23.1	Very low	25.4	Very low	195 Å²	195	118.9 Å²	118.9	86%	0.855	62%	0.623	S	S	*	*			trans	-52.9	157.3	-180	-81.5	-115	0	0	0	116.6
304	C	22.8	Very low	25.4	Very low	100 Å²	100	120.2 Å²	120.2	68%	0.676	63%	0.625	S	S	*	*			trans	72.8	145.3	156.6	-62.8	0	0	0	0	119.8
305	Q	24.2	Very low	25.5	Very low	129 Å²	129	120.1 Å²	120.1	60%	0.603	63%	0.632	S	S	*	*			trans	24.2	131.8	140.4	-66.4	159.3	-67.7	0	0	119.7
306	S	23.2	Very low	25.4	Very low	52 Å²	52	120.1 Å²	120.1	36%	0.364	63%	0.632	S	S	.	*			cis	-164.1	-126.9	-19.5	8.6	0	0	0	0	110.8	N194	N194-S306 VanDerWaalsContact CB-CB 3.42Å; N194-S306 WeakPolarHBondContact CB-OG 3.32Å; N194-S306 WeakPolarHBondContact OD1-CB 3.48Å; N194-S306 PolarHBondContact OD1-N 3.05Å; N194-S306 VanDerWaalsContact OD1-N 3.17Å; N194-S306 PolarHBondContact OD1-OG 3.26Å
307	T	25.4	Very low	25.3	Very low	56 Å²	56	119.2 Å²	119.2	34%	0.344	64%	0.642	S	S	.	*			trans	-79.5	-173.9	-159.1	62.9	0	0	0	0	118.9	F193 N194 E195	F193-T307 WeakPolarHBondContact O-CG2 3.12Å; F193-T307 PolarHBondContact O-OG1 2.94Å; N194-T307 VanDerWaalsContact CB-OG1 3.31Å; N194-T307 WeakPolarHBondContact CB-OG1 3.32Å; N194-T307 PolarHBondContact ND2-O 3.11Å; N194-T307 PolarHBondContact O-OG1 3.26Å; E195-T307 PolarHBondContact N-OG1 3.43Å
308	S	27.6	Very low	25.3	Very low	78 Å²	78	117.2 Å²	117.2	55%	0.545	64%	0.638	S	S	.	*			trans	81.9	114.8	146.4	38.2	0	0	0	0	117.7	N194	N194-S308 PolarHBondContact O-OG 2.96Å; N194-S308 VanDerWaalsContact O-OG 3.06Å
309	F	23	Very low	25.2	Very low	194 Å²	194	111 Å²	111	85%	0.851	62%	0.623	S	S	*	*			trans	-154	108.8	-178	-170.9	-75.2	0	0	0	110.5
310	V	26.6	Very low	25.3	Very low	131 Å²	131	111.8 Å²	111.8	79%	0.794	64%	0.636	S	S	*	*			trans	-148.6	135.6	159.2	-166.2	0	0	0	0	102.1
311	D	25.3	Very low	25.4	Very low	131 Å²	131	112.7 Å²	112.7	70%	0.701	64%	0.641	S	S	*	*			cis	-159	178.8	43	-152.8	-10.5	0	0	0	113.8
312	V	26.7	Very low	25.2	Very low	120 Å²	120	112.1 Å²	112.1	73%	0.727	64%	0.637	S	S	*	*			trans	72.4	135.2	160.1	-178.7	0	0	0	0	118.8
313	L	23.8	Very low	25.3	Very low	107 Å²	107	114.8 Å²	114.8	56%	0.56	64%	0.636	S	S	*	*			trans	-98.3	156.2	175.8	-52.9	76.8	0	0	0	110.6
314	H	27.7	Very low	25.8	Very low	134 Å²	134	109.9 Å²	109.9	62%	0.62	62%	0.619	S	S	*	*				-167.9	152.1	119.6	-116.1	-82.6	0	0	0	115.4	H1422	H314-H1422 AromaticContact CE1-CD2 3.7Å; H314-H1422 AromaticContact CE1-CE1 3.54Å; H314-H1422 AromaticContact CE1-NE2 3.19Å; H314-H1422 PolarHBondContact CE1-NE2 3.05Å; H314-H1422 AromaticContact ND1-CE1 3.98Å; H314-H1422 AromaticContact ND1-NE2 3.32Å; H314-H1422 PolarHBondContact ND1-NE2 3.36Å
315	N	26.9	Very low	26.2	Very low	118 Å²	118	109.9 Å²	109.9	63%	0.631	61%	0.611	S	S	*	*			trans	67.7	130	165	-69.1	-2	0	0	0	120.8	N1421	N315-N1421 PolarHBondContact OD1-ND2 3.4Å
316	P	25.2	Very low	26.5	Very low	93 Å²	93	107.9 Å²	107.9	60%	0.604	61%	0.609	S	S	*	*			trans	-109.1	157	179.8	40.7	-33.3	0	0	0	114.8	N1421	P316-N1421 WeakPolarHBondContact CD-ND2 3.47Å
317	S	24.9	Very low	27.2	Very low	109 Å²	109	111.7 Å²	111.7	76%	0.762	62%	0.616	S	S	*	*			trans	-175.1	172	147	52.3	0	0	0	0	110.7
318	C	26	Very low	27.5	Very low	53 Å²	53	118 Å²	118	36%	0.358	64%	0.638	S	S	.	*			trans	81.5	117.7	171.7	-55.4	0	0	0	0	117.5	N293	N293-C318 VanDerWaalsContact CB-SG 3.57Å; N293-C318 WeakPolarHBondContact O-CA 3Å; N293-C318 WeakPolarHBondContact O-CB 3.29Å
319	T	23.3	Very low	27.7	Very low	88 Å²	88	119.6 Å²	119.6	54%	0.54	64%	0.636	S	S	.	*			trans	-114.9	167.2	-171.5	47	0	0	0	0	113.9	Y294	Y294-T319 WeakPolarHBondContact CE1-O 3.48Å; Y294-T319 PolarHBondContact OH-O 3.31Å
320	T	28	Very low	28.1	Very low	97 Å²	97	114.3 Å²	114.3	60%	0.595	62%	0.617	S	S	*	*			trans	86.5	166	172.6	118	0	0	0	0	120.5	Y294	Y294-T320 WeakPolarHBondContact CE1-OG1 3.44Å; Y294-T320 WeakPolarHBondContact OH-CB 3.26Å; Y294-T320 WeakPolarHBondContact OH-CG2 3.37Å; Y294-T320 PolarHBondContact OH-OG1 3.11Å
321	I	25.5	Very low	28.3	Very low	159 Å²	159	109.7 Å²	109.7	82%	0.815	59%	0.592	S	S	*	*			trans	-141.4	118.2	-148.7	-61.1	159.8	0	0	0	109.9
322	P	26.4	Very low	28.5	Very low	95 Å²	95	106.1 Å²	106.1	62%	0.617	58%	0.577	S	S	*	*			trans	-116.7	100.1	174.7	35.3	-24.6	0	0	0	114	A57	A57-P322 HydrophobicContact CB-CB 4.35Å
323	Q	26	Very low	28.8	Very low	172 Å²	172	103.1 Å²	103.1	80%	0.804	56%	0.556	S	S	*	*			trans	-3.5	116.1	152.8	-59.5	171.9	-7.9	0	0	117.3
324	N	32.4	Very low	29.3	Very low	91 Å²	91	105.3 Å²	105.3	49%	0.487	56%	0.563	S	S	.	*			trans	-157.2	91.5	148.4	-102.9	-68.2	0	0	0	111.9
325	I	31.2	Very low	29.5	Very low	100 Å²	100	103.1 Å²	103.1	51%	0.513	55%	0.55	S	S	.	.			trans	-70.8	125.8	173.4	-63.7	172.3	0	0	0	109.3	F329	I325-F329 HydrophobicContact CG2-CB 3.81Å; I325-F329 HydrophobicContact CG2-CD1 3.79Å; I325-F329 HydrophobicContact CG2-CG 4.24Å
326	P	30.9	Very low	29.9	Very low	87 Å²	87	103 Å²	103	57%	0.565	55%	0.549	S	S	*	.			trans	-61.6	139.3	177.5	-23.5	33.9	0	0	0	111.8	K328 F329 N330	P326-K328 PolarHBondContact O-N 3.47Å; P326-F329 WeakPolarHBondContact O-CA 3.49Å; P326-F329 VanDerWaalsContact O-CB 3.28Å; P326-F329 WeakPolarHBondContact O-CB 3.48Å; P326-F329 PolarHBondContact O-N 3.21Å; P326-N330 PolarHBondContact O-N 3.2Å
327	R	37.5	Very low	30.2	Very low	132 Å²	132	104.6 Å²	104.6	50%	0.498	55%	0.547	S	S	.	.	H	α-helix	trans	-61.2	-18	179.5	-76.7	179.5	166.4	-159.5	-7.7	114	D23 D46 A331	D23-R327 IonicContact OD1-NH1 3.49Å; D46-R327 VanDerWaalsContact CG-CZ 3.49Å; D46-R327 IonicContact OD1-CZ 2.73Å; D46-R327 VanDerWaalsContact OD1-CZ 3.24Å; D46-R327 IonicContact OD1-NE 3.31Å; D46-R327 IonicContact OD1-NH1 3.21Å; D46-R327 PolarHBondContact OD1-NH1 3.01Å; D46-R327 IonicContact OD1-NH2 2.69Å; D46-R327 WeakPolarHBondContact OD2-CD 3.39Å; D46-R327 IonicContact OD2-CZ 3.44Å; D46-R327 IonicContact OD2-NE 2.64Å; D46-R327 PolarHBondContact OD2-NE 3.24Å; D46-R327 IonicContact OD2-NH1 2.73Å; D46-R327 PolarHBondContact OD2-NH1 3.29Å; R327-A331 PolarHBondContact O-N 2.89Å
328	K	33.1	Very low	30.5	Very low	188 Å²	188	103.5 Å²	103.5	82%	0.817	54%	0.539	S	S	*	.	H	α-helix	trans	-68	-29.5	167.2	-73.3	-177	178.3	176.1	0	113.5	P326 C332	P326-K328 PolarHBondContact O-N 3.47Å; K328-C332 PolarHBondContact O-N 3.17Å
329	F	30.5	Very low	30.7	Very low	112 Å²	112	107.5 Å²	107.5	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-78.8	-39.1	179.8	-157.3	-106.5	0	0	0	111.6	I325 P326 A331 C332 I333	I325-F329 HydrophobicContact CG2-CB 3.81Å; I325-F329 HydrophobicContact CG2-CD1 3.79Å; I325-F329 HydrophobicContact CG2-CG 4.24Å; P326-F329 WeakPolarHBondContact O-CA 3.49Å; P326-F329 VanDerWaalsContact O-CB 3.28Å; P326-F329 WeakPolarHBondContact O-CB 3.48Å; P326-F329 PolarHBondContact O-N 3.21Å; F329-A331 VanDerWaalsContact C-N 3.29Å; F329-A331 PolarHBondContact O-N 3.07Å; F329-C332 CarbonylContact O-C 3.55Å; F329-C332 WeakPolarHBondContact O-CA 3.49Å; F329-C332 VanDerWaalsContact O-CB 3.24Å; F329-C332 WeakPolarHBondContact O-CB 3.24Å; F329-C332 PolarHBondContact O-N 3.21Å; F329-I333 HydrophobicContact CD1-CD1 3.7Å; F329-I333 HydrophobicContact CD1-CG1 4.26Å; F329-I333 HydrophobicContact CE1-CD1 3.8Å; F329-I333 HydrophobicContact CE1-CG1 4.33Å; F329-I333 PolarHBondContact O-N 3.31Å
330	N	31.4	Very low	30.9	Very low	84 Å²	84	109.5 Å²	109.5	45%	0.449	56%	0.562	S	S	.	*	H	α-helix	trans	-64	-34	169.7	-82.8	3.1	0	0	0	112.4	P326 C332 I333 Q334	P326-N330 PolarHBondContact O-N 3.2Å; N330-C332 PolarHBondContact O-N 2.96Å; N330-I333 PolarHBondContact O-N 3.38Å; N330-Q334 WeakPolarHBondContact O-CB 3.35Å; N330-Q334 PolarHBondContact O-N 3.05Å
331	A	31.5	Very low	31.2	Very low	34 Å²	34	108.7 Å²	108.7	28%	0.281	56%	0.56	S	S	.	*	H	α-helix	trans	-68.6	-11.6	168.8	0	0	0	0	0	113.7	R327 F329 R335	R327-A331 PolarHBondContact O-N 2.89Å; F329-A331 VanDerWaalsContact C-N 3.29Å; F329-A331 PolarHBondContact O-N 3.07Å; A331-R335 VanDerWaalsContact O-CD 3.28Å; A331-R335 WeakPolarHBondContact O-CD 3.33Å; A331-R335 VanDerWaalsContact O-CG 3.27Å; A331-R335 WeakPolarHBondContact O-CG 3.4Å; A331-R335 PolarHBondContact O-NE 3.15Å; A331-R335 PolarHBondContact O-NH1 3.36Å
332	C	28.7	Very low	31.5	Very low	56 Å²	56	106.4 Å²	106.4	38%	0.378	55%	0.549	S	S	.	.	H	α-helix	trans	-95.6	-40.7	173.8	-151.9	0	0	0	0	111.7	K328 F329 N330 Q334 R335 N336	K328-C332 PolarHBondContact O-N 3.17Å; F329-C332 CarbonylContact O-C 3.55Å; F329-C332 WeakPolarHBondContact O-CA 3.49Å; F329-C332 VanDerWaalsContact O-CB 3.24Å; F329-C332 WeakPolarHBondContact O-CB 3.24Å; F329-C332 PolarHBondContact O-N 3.21Å; N330-C332 PolarHBondContact O-N 2.96Å; C332-Q334 PolarHBondContact O-N 3.29Å; C332-R335 WeakPolarHBondContact O-CA 3.43Å; C332-R335 WeakPolarHBondContact O-CB 3.36Å; C332-R335 PolarHBondContact O-N 2.73Å; C332-N336 PolarHBondContact O-N 2.96Å
333	I	33.7	Very low	31.6	Very low	56 Å²	56	105.5 Å²	105.5	29%	0.287	54%	0.543	S	S	.	.	H	α-helix	trans	-62.6	-43.2	173.5	-67.3	171.8	0	0	0	110.5	F329 N330 R335 N336 F337	F329-I333 HydrophobicContact CD1-CD1 3.7Å; F329-I333 HydrophobicContact CD1-CG1 4.26Å; F329-I333 HydrophobicContact CE1-CD1 3.8Å; F329-I333 HydrophobicContact CE1-CG1 4.33Å; F329-I333 PolarHBondContact O-N 3.31Å; N330-I333 PolarHBondContact O-N 3.38Å; I333-R335 PolarHBondContact O-N 3.44Å; I333-N336 PolarHBondContact O-N 2.97Å; I333-F337 PolarHBondContact O-N 2.87Å
334	Q	34.4	Very low	32.1	Very low	153 Å²	153	101.8 Å²	101.8	72%	0.715	53%	0.526	S	S	*	.	H	α-helix	trans	-65.6	-17.4	171.3	-75.2	-168.5	-15.6	0	0	113.9	N330 C332 S338	N330-Q334 WeakPolarHBondContact O-CB 3.35Å; N330-Q334 PolarHBondContact O-N 3.05Å; C332-Q334 PolarHBondContact O-N 3.29Å; Q334-S338 VanDerWaalsContact O-CB 3.31Å; Q334-S338 WeakPolarHBondContact O-CB 3.21Å; Q334-S338 PolarHBondContact O-OG 3.16Å
335	R	33	Very low	32.3	Very low	88 Å²	88	102 Å²	102	33%	0.332	53%	0.526	S	S	.	.	H	α-helix	trans	-80.8	-44	174.3	-81.7	173.5	-175.9	106.2	39.2	112.5	A331 C332 I333 S338 N641 G642	A331-R335 VanDerWaalsContact O-CD 3.28Å; A331-R335 WeakPolarHBondContact O-CD 3.33Å; A331-R335 VanDerWaalsContact O-CG 3.27Å; A331-R335 WeakPolarHBondContact O-CG 3.4Å; A331-R335 PolarHBondContact O-NE 3.15Å; A331-R335 PolarHBondContact O-NH1 3.36Å; C332-R335 WeakPolarHBondContact O-CA 3.43Å; C332-R335 WeakPolarHBondContact O-CB 3.36Å; C332-R335 PolarHBondContact O-N 2.73Å; I333-R335 PolarHBondContact O-N 3.44Å; R335-S338 PolarHBondContact O-OG 2.81Å; R335-N641 PolarHBondContact NH2-O 2.88Å; R335-G642 VanDerWaalsContact CZ-CA 3.45Å; R335-G642 VanDerWaalsContact CZ-O 3.3Å; R335-G642 PolarHBondContact NE-O 2.79Å; R335-G642 VanDerWaalsContact NH2-CA 3.31Å; R335-G642 PolarHBondContact NH2-O 2.93Å
336	N	33.6	Very low	32.4	Very low	115 Å²	115	103.1 Å²	103.1	62%	0.615	53%	0.527	S	S	*	.	H	α-helix	trans	-77.9	-24	-175.7	-68.4	-3.6	0	0	0	112.3	C332 I333	C332-N336 PolarHBondContact O-N 2.96Å; I333-N336 PolarHBondContact O-N 2.97Å
337	F	31.9	Very low	32.6	Very low	128 Å²	128	101.4 Å²	101.4	56%	0.561	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-1.9	173.6	-89.8	-91.7	0	0	0	116.3	I333 L932	I333-F337 PolarHBondContact O-N 2.87Å; F337-L932 HydrophobicContact CD2-CD1 4.47Å; F337-L932 HydrophobicContact CE2-CD1 3.51Å; F337-L932 HydrophobicContact CE2-CD2 4.28Å; F337-L932 HydrophobicContact CZ-CD1 3.87Å; F337-L932 HydrophobicContact CZ-CD2 3.83Å
338	S	31.5	Very low	32.5	Very low	85 Å²	85	97.4 Å²	97.4	59%	0.594	50%	0.504	S	S	*	.	S	Bend	trans	-96	-3.2	174.9	52.6	0	0	0	0	114.9	Q334 R335	Q334-S338 VanDerWaalsContact O-CB 3.31Å; Q334-S338 WeakPolarHBondContact O-CB 3.21Å; Q334-S338 PolarHBondContact O-OG 3.16Å; R335-S338 PolarHBondContact O-OG 2.81Å
339	I	31.2	Very low	32.7	Very low	138 Å²	138	93.8 Å²	93.8	71%	0.708	49%	0.493	S	S	*	.	S	Bend	trans	-85.8	-23.4	178.7	-65.9	175	0	0	0	112.1	S341	I339-S341 PolarHBondContact O-N 3.32Å
340	L	27.4	Very low	32.8	Very low	130 Å²	130	97.3 Å²	97.3	68%	0.681	50%	0.503	S	S	*	.			trans	-77.9	55.7	176.6	-95.5	160.5	0	0	0	113.5
341	S	33.9	Very low	33	Very low	79 Å²	79	100.5 Å²	100.5	55%	0.552	51%	0.513	S	S	*	.			trans	-75.9	141.2	165.9	79.8	0	0	0	0	110.7	I339 P343	I339-S341 PolarHBondContact O-N 3.32Å; S341-P343 WeakPolarHBondContact O-CD 3.45Å
342	L	31.2	Very low	33.1	Very low	111 Å²	111	107.7 Å²	107.7	58%	0.581	54%	0.539	S	S	*	.	S	Bend	trans	-88.9	99	-176.8	-80.6	68.1	0	0	0	112.9
343	P	29.8	Very low	33.4	Very low	77 Å²	77	109.7 Å²	109.7	50%	0.5	55%	0.553	S	S	.	*	S	Bend	trans	-109.9	-43.5	142.8	-12.1	29.9	0	0	0	114.6	S341 K346 S347	S341-P343 WeakPolarHBondContact O-CD 3.45Å; P343-K346 CarbonylContact O-C 3.57Å; P343-K346 PolarHBondContact O-N 3.05Å; P343-S347 PolarHBondContact O-N 3.22Å; P343-S347 VanDerWaalsContact O-N 3.07Å
344	Q	34.6	Very low	33.2	Very low	93 Å²	93	117.5 Å²	117.5	44%	0.435	58%	0.579	S	S	.	*	H	α-helix	trans	-72.2	-41.3	-165.3	-85.2	139.5	-67.9	0	0	114.5	K346 S347 Q348	Q344-K346 VanDerWaalsContact C-N 3.28Å; Q344-K346 PolarHBondContact O-N 3.47Å; Q344-S347 WeakPolarHBondContact O-CA 3.49Å; Q344-S347 VanDerWaalsContact O-CB 3.29Å; Q344-S347 WeakPolarHBondContact O-CB 3.43Å; Q344-S347 PolarHBondContact O-N 3.4Å; Q344-Q348 PolarHBondContact O-N 2.92Å
345	I	37.7	Very low	32.9	Very low	97 Å²	97	121.2 Å²	121.2	50%	0.497	59%	0.586	S	S	.	*	H	α-helix	trans	-60.9	-38.9	173.5	-66.8	173.7	0	0	0	110.7	S347 Q348 L349	I345-S347 PolarHBondContact O-N 3.03Å; I345-Q348 PolarHBondContact O-N 3.18Å; I345-L349 HydrophobicContact CG2-CD1 3.73Å; I345-L349 HydrophobicContact CG2-CG 4.3Å; I345-L349 WeakPolarHBondContact O-CB 3.41Å; I345-L349 WeakPolarHBondContact O-CG 3.38Å; I345-L349 PolarHBondContact O-N 3.35Å
346	K	32.3	Very low	32.6	Very low	122 Å²	122	127.1 Å²	127.1	53%	0.53	61%	0.614	S	S	.	*	H	α-helix	trans	-70.6	-12.7	172.1	-85.7	-177.5	175	174.6	0	114.1	P343 Q344 R350	P343-K346 CarbonylContact O-C 3.57Å; P343-K346 PolarHBondContact O-N 3.05Å; Q344-K346 VanDerWaalsContact C-N 3.28Å; Q344-K346 PolarHBondContact O-N 3.47Å; K346-R350 WeakPolarHBondContact O-CB 3.3Å; K346-R350 WeakPolarHBondContact O-CD 3.25Å; K346-R350 WeakPolarHBondContact O-CG 3.5Å
347	S	35.1	Very low	32.3	Very low	51 Å²	51	127.4 Å²	127.4	36%	0.357	63%	0.625	S	S	.	*	H	α-helix	trans	-86.8	-45.9	172.2	-166	0	0	0	0	111.4	P343 Q344 I345 R350 K351	P343-S347 PolarHBondContact O-N 3.22Å; P343-S347 VanDerWaalsContact O-N 3.07Å; Q344-S347 WeakPolarHBondContact O-CA 3.49Å; Q344-S347 VanDerWaalsContact O-CB 3.29Å; Q344-S347 WeakPolarHBondContact O-CB 3.43Å; Q344-S347 PolarHBondContact O-N 3.4Å; I345-S347 PolarHBondContact O-N 3.03Å; S347-R350 PolarHBondContact O-N 3.41Å; S347-K351 PolarHBondContact O-N 2.92Å
348	Q	35.3	Very low	32.1	Very low	48 Å²	48	127.9 Å²	127.9	22%	0.224	64%	0.639	C	S	.	*	H	α-helix	trans	-69.5	-42.7	178.5	-62.6	-67.9	54.6	0	0	112.1	Q344 I345 R350 K351 F352 N1450	Q344-Q348 PolarHBondContact O-N 2.92Å; I345-Q348 PolarHBondContact O-N 3.18Å; Q348-R350 VanDerWaalsContact C-N 3.25Å; Q348-R350 PolarHBondContact O-N 3.03Å; Q348-K351 PolarHBondContact O-N 3.27Å; Q348-F352 PolarHBondContact O-N 3.39Å; Q348-N1450 PolarHBondContact NE2-OD1 2.89Å; Q348-N1450 VanDerWaalsContact NE2-OD1 3.15Å
349	L	38.6	Very low	32	Very low	113 Å²	113	130.1 Å²	130.1	59%	0.592	65%	0.649	S	S	*	*	H	α-helix	trans	-62.7	-31.1	173.8	-69.8	173.2	0	0	0	112.4	I345 K351 S353	I345-L349 HydrophobicContact CG2-CD1 3.73Å; I345-L349 HydrophobicContact CG2-CG 4.3Å; I345-L349 WeakPolarHBondContact O-CB 3.41Å; I345-L349 WeakPolarHBondContact O-CG 3.38Å; I345-L349 PolarHBondContact O-N 3.35Å; L349-K351 VanDerWaalsContact C-N 3.3Å; L349-K351 PolarHBondContact O-N 2.88Å; L349-S353 WeakPolarHBondContact O-CB 3.16Å; L349-S353 PolarHBondContact O-N 3.39Å
350	R	32.6	Very low	31.8	Very low	186 Å²	186	132.3 Å²	132.3	70%	0.702	65%	0.653	S	S	*	*	H	α-helix	trans	-72.5	-18	172.4	-80.2	178.2	-176	179.5	-1.7	114.1	K346 S347 Q348	K346-R350 WeakPolarHBondContact O-CB 3.3Å; K346-R350 WeakPolarHBondContact O-CD 3.25Å; K346-R350 WeakPolarHBondContact O-CG 3.5Å; S347-R350 PolarHBondContact O-N 3.41Å; Q348-R350 VanDerWaalsContact C-N 3.25Å; Q348-R350 PolarHBondContact O-N 3.03Å
351	K	35.5	Very low	31.8	Very low	151 Å²	151	132.3 Å²	132.3	66%	0.657	66%	0.658	S	S	*	*	H	α-helix	trans	-89.5	-38.3	173.1	-74.2	-169.7	172.2	-169.4	0	112.3	S347 Q348 L349	S347-K351 PolarHBondContact O-N 2.92Å; Q348-K351 PolarHBondContact O-N 3.27Å; L349-K351 VanDerWaalsContact C-N 3.3Å; L349-K351 PolarHBondContact O-N 2.88Å
352	F	32.8	Very low	31.6	Very low	185 Å²	185	134.1 Å²	134.1	81%	0.811	67%	0.671	S	S	*	*	H	α-helix	trans	-70.9	-36.2	173.6	-92.7	-91.8	0	0	0	113	Q348 R354	Q348-F352 PolarHBondContact O-N 3.39Å; F352-R354 PolarHBondContact O-N 3.12Å
353	S	34.6	Very low	31.5	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	18.2	177.3	-168	0	0	0	0	114.7	L349	L349-S353 WeakPolarHBondContact O-CB 3.16Å; L349-S353 PolarHBondContact O-N 3.39Å
354	R	30.3	Very low	31.5	Very low	220 Å²	220	141.7 Å²	141.7	83%	0.83	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.3	38.4	-179	-82.9	-169	167.7	-163.3	-2.8	114.3	F352	F352-R354 PolarHBondContact O-N 3.12Å
355	R	27.7	Very low	31.3	Very low	232 Å²	232	142.6 Å²	142.6	88%	0.875	71%	0.709	S	S	*	*	S	Bend	trans	-134.8	146.1	155.8	-70.8	-173.4	171.9	170.8	-3.4	108.8
356	K	27.3	Very low	30.8	Very low	212 Å²	212	144.7 Å²	144.7	92%	0.922	72%	0.721	S	S	*	*	S	Bend	trans	65.8	83.1	-170.8	-60.3	-172.4	176.3	-174.8	0	116.1
357	S	26.7	Very low	30.5	Very low	121 Å²	121	143.5 Å²	143.5	85%	0.846	73%	0.728	S	S	*	*			trans	-169	67.7	147.9	18.5	0	0	0	0	111.2
358	V	27.3	Very low	30.2	Very low	138 Å²	138	151 Å²	151	84%	0.836	76%	0.755	S	S	*	*			trans	-139.9	128	162.9	-179.9	0	0	0	0	103.6
359	T	29.3	Very low	29.7	Very low	131 Å²	131	151.9 Å²	151.9	80%	0.804	78%	0.777	S	S	*	*			cis	-127	172.2	11.3	-21.9	0	0	0	0	111.1
360	K	28	Very low	29.2	Very low	184 Å²	184	154.4 Å²	154.4	80%	0.8	79%	0.789	S	S	*	*			trans	-121.6	105.5	172	-140.4	-162	-171.9	-120.1	0	110.8
361	T	28.2	Very low	28.8	Very low	130 Å²	130	152.6 Å²	152.6	80%	0.798	79%	0.788	S	S	*	*			trans	-166.4	135.3	165.7	40.9	0	0	0	0	105.7
362	S	28.9	Very low	28.3	Very low	117 Å²	117	150.2 Å²	150.2	82%	0.818	78%	0.779	S	S	*	*			cis	-153.8	158.6	-3.5	41.7	0	0	0	0	108.5
363	E	28.3	Very low	27.9	Very low	161 Å²	161	146.8 Å²	146.8	75%	0.752	76%	0.764	S	S	*	*			trans	-96.2	139.2	175.2	-79	157.2	138.3	0	0	110.5
364	E	30.1	Very low	27.4	Very low	186 Å²	186	147.1 Å²	147.1	87%	0.869	76%	0.762	S	S	*	*			trans	64	148.8	159.5	-60.2	178.2	162.5	0	0	117.4
365	T	30.5	Very low	27.1	Very low	113 Å²	113	143.6 Å²	143.6	69%	0.693	76%	0.759	S	S	*	*			cis	-139.2	160.2	26	54.7	0	0	0	0	115.1
366	N	27.9	Very low	26.9	Very low	141 Å²	141	138.1 Å²	138.1	75%	0.754	75%	0.752	S	S	*	*			trans	77.5	92.2	147.6	-65.8	-14	0	0	0	122.3
367	S	25.5	Very low	26.8	Very low	97 Å²	97	133.8 Å²	133.8	68%	0.678	75%	0.748	S	S	*	*				95.6	140.2	115.6	82.8	0	0	0	0	120.7
368	K	28	Very low	26.6	Very low	208 Å²	208	133.6 Å²	133.6	90%	0.904	74%	0.744	S	S	*	*			trans	60.7	116.6	167	-56.7	174.7	-174.6	177.3	0	115.8
369	G	26.4	Very low	26.5	Very low	67 Å²	67	131.4 Å²	131.4	69%	0.691	74%	0.74	S	S	*	*			cis	147.7	167.7	-3.3	0	0	0	0	0	111.1
370	I	26.7	Very low	26.3	Very low	165 Å²	165	135 Å²	135	85%	0.846	75%	0.748	S	S	*	*			trans	66.1	124.2	166.8	-53.6	172.9	0	0	0	114.3
371	H	25.5	Very low	26.1	Very low	148 Å²	148	131 Å²	131	69%	0.685	74%	0.743	S	S	*	*			cis	-166	-162.7	-12.9	-128.2	-81.2	0	0	0	107.3
372	E	24.9	Very low	26	Very low	101 Å²	101	128.5 Å²	128.5	47%	0.472	73%	0.729	S	S	.	*			trans	97.8	136	163.2	-52.1	-158.8	-170.1	0	0	118	I1215 V1216	E372-I1215 WeakPolarHBondContact CA-O 3.24Å; E372-I1215 WeakPolarHBondContact CB-O 3.3Å; E372-I1215 HydrophobicContact CG-CG2 4.13Å; E372-I1215 WeakPolarHBondContact CG-O 3.08Å; E372-I1215 WeakPolarHBondContact OE1-CG2 3.36Å; E372-V1216 PolarHBondContact OE2-N 3.43Å
373	F	24.7	Very low	25.8	Very low	114 Å²	114	130.1 Å²	130.1	50%	0.5	73%	0.734	S	S	.	*			trans	5.1	108.2	-177.1	-70.7	-64.8	0	0	0	118.2	I1215 V1216	F373-I1215 VanDerWaalsContact CD2-O 3.25Å; F373-I1215 WeakPolarHBondContact CD2-O 3.48Å; F373-I1215 WeakPolarHBondContact CE2-O 3.45Å; F373-V1216 VanDerWaalsContact CE2-N 3.29Å
374	T	23	Very low	25.7	Very low	103 Å²	103	129 Å²	129	63%	0.632	73%	0.731	S	S	*	*			cis	47.9	106.3	46.9	72.6	0	0	0	0	115.9
375	L	23.5	Very low	25.5	Very low	147 Å²	147	124 Å²	124	77%	0.77	72%	0.717	S	S	*	*				-177.6	143.8	127.7	-96.7	158.2	0	0	0	112.2
376	T	24.7	Very low	25.2	Very low	117 Å²	117	128.4 Å²	128.4	72%	0.718	72%	0.722	S	S	*	*			trans	39.7	98.5	156.7	55	0	0	0	0	120.7
377	S	25.2	Very low	25.2	Very low	121 Å²	121	127.1 Å²	127.1	85%	0.846	72%	0.719	S	S	*	*				-169.7	103.3	106.6	38.6	0	0	0	0	112.5
378	P	22.8	Very low	25.2	Very low	116 Å²	116	131.2 Å²	131.2	75%	0.753	73%	0.725	S	S	*	*			trans	-88.2	169.4	156.4	36.6	-32.1	0	0	0	111.1
379	A	25	Very low	25.1	Very low	92 Å²	92	127.5 Å²	127.5	76%	0.76	72%	0.715	S	S	*	*			trans	59.2	98.8	161.7	0	0	0	0	0	118.5
380	E	25.1	Very low	25.1	Very low	206 Å²	206	133 Å²	133	96%	0.963	72%	0.72	S	S	*	*			trans	-141.8	83.5	138.8	-144.1	174.6	-106.8	0	0	110.4
381	S	23.7	Very low	25	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	72%	0.717	S	S	*	*			trans	-163.6	140.5	174	81.7	0	0	0	0	107.7
382	P	25.4	Very low	25.1	Very low	77 Å²	77	130.5 Å²	130.5	50%	0.5	72%	0.722	S	S	.	*				-137.8	139.9	67.8	39.6	-26.5	0	0	0	116.3	I384	P382-I384 HydrophobicContact CB-CD1 3.99Å; P382-I384 HydrophobicContact CB-CG1 3.93Å; P382-I384 HydrophobicContact CG-CD1 3.82Å; P382-I384 HydrophobicContact CG-CG1 4.13Å; P382-I384 PolarHBondContact O-N 3.17Å
383	V	25.2	Very low	25.1	Very low	152 Å²	152	130.2 Å²	130.2	92%	0.921	73%	0.732	S	S	*	*			trans	-74.8	109.8	161.7	172.9	0	0	0	0	109.4
384	I	26.9	Very low	25.2	Very low	136 Å²	136	135.5 Å²	135.5	70%	0.697	75%	0.748	S	S	*	*			trans	-139.4	130.3	174.8	-52.9	178.9	0	0	0	108.1	P382	P382-I384 HydrophobicContact CB-CD1 3.99Å; P382-I384 HydrophobicContact CB-CG1 3.93Å; P382-I384 HydrophobicContact CG-CD1 3.82Å; P382-I384 HydrophobicContact CG-CG1 4.13Å; P382-I384 PolarHBondContact O-N 3.17Å
385	S	25.1	Very low	25.2	Very low	81 Å²	81	136.5 Å²	136.5	57%	0.566	75%	0.75	S	S	*	*	S	Bend	cis	-154.3	155.1	-23.6	57.6	0	0	0	0	105.8
386	Y	24.9	Very low	25.4	Very low	206 Å²	206	139.9 Å²	139.9	81%	0.808	75%	0.754	S	S	*	*	S	Bend		-145.2	129.7	60.5	-101.6	-104.3	0	0	0	113.3
387	V	26.3	Very low	25.3	Very low	114 Å²	114	138.7 Å²	138.7	69%	0.691	75%	0.751	S	S	*	*			trans	60.5	105.7	140.3	174.3	0	0	0	0	117
388	K	25.8	Very low	25.5	Very low	183 Å²	183	137.7 Å²	137.7	80%	0.796	74%	0.741	S	S	*	*				61	139.2	81.4	-82.5	-176.3	174.5	174.2	0	112.9
389	L	26.5	Very low	25.8	Very low	131 Å²	131	137.7 Å²	137.7	69%	0.686	74%	0.739	S	S	*	*			cis	-152.3	157.9	19	-116.7	155.7	0	0	0	112.9
390	K	26.9	Very low	25.8	Very low	183 Å²	183	142.3 Å²	142.3	80%	0.796	74%	0.742	S	S	*	*			trans	20.7	121.7	157.4	-78	171.9	-172.2	-178.5	0	121.3
391	T	25	Very low	25.9	Very low	128 Å²	128	138.9 Å²	138.9	79%	0.785	74%	0.735	S	S	*	*			trans	-61.5	142.4	143.5	46.9	0	0	0	0	113.2
392	T	27.2	Very low	25.9	Very low	131 Å²	131	140.7 Å²	140.7	80%	0.804	74%	0.737	S	S	*	*			trans	162.2	143.9	140.6	30.1	0	0	0	0	107.5
393	S	25.4	Very low	25.9	Very low	95 Å²	95	145.7 Å²	145.7	66%	0.664	75%	0.751	S	S	*	*			cis	166.9	144.6	-23.6	46.9	0	0	0	0	105.8
394	R	25.2	Very low	25.9	Very low	225 Å²	225	145.1 Å²	145.1	85%	0.849	74%	0.741	S	S	*	*			trans	83.5	126.1	174.7	-57.9	179.2	170.9	170.7	-3.3	117.4
395	N	24.4	Very low	25.9	Very low	125 Å²	125	145.2 Å²	145.2	67%	0.668	74%	0.742	S	S	*	*			trans	45.7	127.4	135.2	-40.6	1.2	0	0	0	117.8
396	Y	26.9	Very low	25.9	Very low	217 Å²	217	147.5 Å²	147.5	85%	0.851	75%	0.752	S	S	*	*			cis	-152.9	166.9	47.4	-108.8	-85	0	0	0	114.8
397	S	23.1	Very low	26	Very low	93 Å²	93	142 Å²	142	65%	0.65	75%	0.749	S	S	*	*			trans	-102.3	175.1	166.9	54.8	0	0	0	0	111
398	P	30.2	Very low	25.9	Very low	100 Å²	100	143.4 Å²	143.4	65%	0.649	75%	0.753	S	S	*	*			cis	-136.8	-159.6	-30.2	32.5	-10	0	0	0	112
399	T	27.2	Very low	26	Very low	115 Å²	115	143 Å²	143	71%	0.706	75%	0.754	S	S	*	*			trans	70.1	144.3	148.2	42.8	0	0	0	0	122.2
400	K	24.9	Very low	25.9	Very low	189 Å²	189	143.4 Å²	143.4	82%	0.822	76%	0.757	S	S	*	*			trans	13.2	138.5	146.3	-47.7	179.3	177.3	-179.6	0	117.9
401	T	28.4	Very low	26	Very low	135 Å²	135	139.8 Å²	139.8	83%	0.828	75%	0.746	S	S	*	*				-160.6	175.5	56.9	29	0	0	0	0	112.9
402	D	24.2	Very low	26.1	Very low	139 Å²	139	141.6 Å²	141.6	74%	0.743	74%	0.743	S	S	*	*			trans	-62.8	164.1	168.3	-74.7	-72.6	0	0	0	115.1
403	K	25.6	Very low	26.1	Very low	181 Å²	181	143.3 Å²	143.3	79%	0.787	74%	0.74	S	S	*	*			trans	75.9	126.5	144.3	-81.8	163.2	-177.4	177	0	121
404	I	24.8	Very low	26.3	Very low	140 Å²	140	143.9 Å²	143.9	72%	0.718	74%	0.739	S	S	*	*				91.5	122.2	125.4	-73.8	172.7	0	0	0	120.3
405	I	26	Very low	26.5	Very low	138 Å²	138	140.8 Å²	140.8	71%	0.708	73%	0.734	S	S	*	*			trans	80.9	98.3	148.9	-75.9	170.7	0	0	0	121.9
406	T	24.7	Very low	26.6	Very low	129 Å²	129	141.1 Å²	141.1	79%	0.791	73%	0.73	S	S	*	*			trans	66.1	169.8	132.2	70.9	0	0	0	0	123
407	A	26.9	Very low	26.6	Very low	90 Å²	90	140.7 Å²	140.7	74%	0.744	73%	0.727	S	S	*	*			trans	61.4	98.9	174.5	0	0	0	0	0	115.1
408	N	23.9	Very low	26.8	Very low	145 Å²	145	140.9 Å²	140.9	78%	0.775	72%	0.718	S	S	*	*			cis	63.9	86	46.9	-169.8	67.7	0	0	0	114.9
409	E	28.2	Very low	26.5	Very low	175 Å²	175	144.2 Å²	144.2	82%	0.818	72%	0.717	S	S	*	*			trans	-153.2	148.1	140.1	-131.5	179.9	-139.6	0	0	112.6
410	N	24.2	Very low	26.4	Very low	139 Å²	139	146.1 Å²	146.1	74%	0.743	72%	0.716	S	S	*	*			trans	-106.5	128.4	177.4	-68.1	-77.6	0	0	0	109.8
411	N	29.7	Very low	26.4	Very low	106 Å²	106	141.5 Å²	141.5	57%	0.567	70%	0.7	S	S	*	*			trans	-158	129.7	160.8	-95.1	-49.3	0	0	0	113.1
412	K	27.9	Very low	26.3	Very low	166 Å²	166	145 Å²	145	72%	0.722	70%	0.7	S	S	*	*				48.4	138.2	122.7	-61.9	177.1	-172.9	120.4	0	118
413	K	27.3	Very low	26.4	Very low	167 Å²	167	144.9 Å²	144.9	73%	0.726	70%	0.698	S	S	*	*			cis	-177.5	151.7	15.1	-120.1	177.6	178.4	-174.7	0	109
414	T	28.7	Very low	26.4	Very low	107 Å²	107	141.6 Å²	141.6	66%	0.656	70%	0.696	S	S	*	*			trans	55.9	165.8	144.1	60.2	0	0	0	0	120.7
415	H	28.8	Very low	26.3	Very low	161 Å²	161	145.4 Å²	145.4	75%	0.745	70%	0.702	S	S	*	*			cis	-151.5	135.9	-28.1	-106	-51.3	0	0	0	104.8
416	F	27.1	Very low	26.3	Very low	132 Å²	132	143.3 Å²	143.3	58%	0.579	70%	0.7	S	S	*	*				62.2	103.4	83.5	-164.9	-79.2	0	0	0	114.6	E418	F416-E418 HydrophobicContact CE1-CG 3.86Å; F416-E418 HydrophobicContact CZ-CG 3.97Å
417	W	27.3	Very low	26.3	Very low	208 Å²	208	142.8 Å²	142.8	79%	0.788	70%	0.697	S	S	*	*				-158.9	112.7	123.4	-83.2	100.6	0	0	0	104.4
418	E	25.9	Very low	26.2	Very low	97 Å²	97	144.3 Å²	144.3	45%	0.453	69%	0.691	S	S	.	*				56.9	133.8	104.2	-63	-159.5	174.2	0	0	114.9	F416	F416-E418 HydrophobicContact CE1-CG 3.86Å; F416-E418 HydrophobicContact CZ-CG 3.97Å
419	R	24.7	Very low	26.2	Very low	170 Å²	170	143 Å²	143	64%	0.642	68%	0.684	S	S	*	*			cis	-153.4	174.8	1.5	-114.8	167.3	161	121.7	1	107.2
420	F	25.8	Very low	26.1	Very low	154 Å²	154	136.7 Å²	136.7	68%	0.675	66%	0.659	S	S	*	*			cis	-149.7	-163.5	7.5	-132.8	-34.2	0	0	0	109.4
421	D	24.4	Very low	26.2	Very low	92 Å²	92	136.5 Å²	136.5	49%	0.492	66%	0.658	S	S	.	*			trans	-84.9	175.2	-169.8	-52.7	-51.6	0	0	0	113.8
422	Y	26.6	Very low	26.2	Very low	209 Å²	209	137.9 Å²	137.9	82%	0.82	66%	0.661	S	S	*	*			cis	-129.8	151.3	9.8	-68	-106.1	0	0	0	109.6
423	L	25.5	Very low	26.1	Very low	136 Å²	136	134.6 Å²	134.6	71%	0.712	66%	0.659	S	S	*	*			cis	75.1	144.9	41	-69	172.8	0	0	0	114.8
424	P	27.2	Very low	26.1	Very low	113 Å²	113	132.8 Å²	132.8	73%	0.734	66%	0.657	S	S	*	*			trans	-135.4	-147.6	-134.7	44.3	-25.2	0	0	0	114.1
425	Y	22.6	Very low	26.1	Very low	219 Å²	219	133.4 Å²	133.4	86%	0.859	66%	0.656	S	S	*	*			trans	-29.2	138.9	167.2	-101.5	-104.3	0	0	0	116.9
426	S	24.9	Very low	26.2	Very low	95 Å²	95	132.2 Å²	132.2	66%	0.664	66%	0.656	S	S	*	*			trans	63	112.3	142.4	63.8	0	0	0	0	121.6
427	T	24.5	Very low	26	Very low	118 Å²	118	134.3 Å²	134.3	72%	0.724	67%	0.667	S	S	*	*				78.6	98.6	115.6	-50.3	0	0	0	0	120.6
428	I	25.8	Very low	26.1	Very low	121 Å²	121	128.3 Å²	128.3	62%	0.621	66%	0.655	S	S	*	*			trans	71.3	112.8	136	-59.2	175.5	0	0	0	120.2
429	L	24.3	Very low	26.2	Very low	119 Å²	119	132.2 Å²	132.2	62%	0.623	67%	0.671	S	S	*	*			trans	20.5	122.2	145.9	-66.9	80	0	0	0	120.4	F487 S488	L429-F487 PolarHBondContact O-N 3.35Å; L429-S488 PolarHBondContact O-N 3.39Å
430	S	26.1	Very low	26.5	Very low	42 Å²	42	131.8 Å²	131.8	29%	0.294	67%	0.673	S	S	.	*				166.6	143.8	81.6	64.5	0	0	0	0	117	C486 F487 S488	S430-C486 PolarHBondContact OG-O 3.4Å; S430-F487 VanDerWaalsContact OG-C 3.24Å; S430-F487 PolarHBondContact OG-N 3.06Å; S430-S488 PolarHBondContact OG-N 3.3Å
431	N	25.2	Very low	26.6	Very low	135 Å²	135	129.2 Å²	129.2	72%	0.722	67%	0.667	S	S	*	*			trans	56.4	139.3	133.2	-64.8	1.7	0	0	0	125.1
432	Q	29.3	Very low	26.9	Very low	134 Å²	134	132.4 Å²	132.4	63%	0.626	68%	0.676	S	S	*	*			trans	84.1	83.9	150.3	-75.7	169.1	-14.2	0	0	120.5
433	S	25.8	Very low	27	Very low	98 Å²	98	129.3 Å²	129.3	69%	0.685	67%	0.672	S	S	*	*				22.9	136.5	116.9	60.5	0	0	0	0	120.8
434	N	28.2	Very low	27.2	Very low	129 Å²	129	128.1 Å²	128.1	69%	0.69	67%	0.671	S	S	*	*				-166.6	158.6	109.1	-116.3	43.6	0	0	0	114.8
435	D	29	Very low	27.2	Very low	119 Å²	119	129 Å²	129	64%	0.636	67%	0.669	S	S	*	*			trans	69	105.1	148.8	-63.1	-40	0	0	0	123.8
436	N	29.3	Very low	27.5	Very low	136 Å²	136	123.8 Å²	123.8	73%	0.727	66%	0.664	S	S	*	*				81.5	92.7	124.3	-57.9	-34	0	0	0	122.4
437	Q	24.5	Very low	27.7	Very low	177 Å²	177	124.5 Å²	124.5	83%	0.827	66%	0.661	S	S	*	*				36.8	163.2	101.8	-95	-162.5	26	0	0	121.3
438	P	29.7	Very low	28	Very low	82 Å²	82	126.3 Å²	126.3	53%	0.532	66%	0.661	S	S	.	*			cis	-143.4	-160.3	-6.4	30.1	-4.5	0	0	0	114.8
439	K	28.1	Very low	28.1	Very low	179 Å²	179	126.9 Å²	126.9	78%	0.778	66%	0.664	S	S	*	*			trans	79.9	139.4	154.3	-66.6	160.8	-176.2	170.1	0	115.9
440	K	29.1	Very low	28.2	Very low	160 Å²	160	127.5 Å²	127.5	70%	0.696	67%	0.668	S	S	*	*			cis	-166.1	167.6	-1.9	-128.6	-177.8	164.1	-133.8	0	113.4
441	D	29.1	Very low	28.4	Very low	100 Å²	100	133.1 Å²	133.1	54%	0.535	69%	0.694	S	S	.	*			trans	65.6	137.9	151	-69.8	8.3	0	0	0	117.1
442	K	30	Very low	28.4	Very low	159 Å²	159	134.5 Å²	134.5	69%	0.691	70%	0.696	S	S	*	*			cis	-166	149.7	8	-116.4	163.6	-175.2	170.4	0	111.8
443	I	29.5	Very low	28.3	Very low	144 Å²	144	137 Å²	137	74%	0.738	71%	0.708	S	S	*	*			trans	66.8	131.4	140.1	-69.6	166.9	0	0	0	117.6
444	V	29.6	Very low	28.4	Very low	112 Å²	112	137 Å²	137	68%	0.679	71%	0.707	S	S	*	*			cis	-155.1	168.2	-0.4	111.1	0	0	0	0	112.2
445	N	26.3	Very low	28.5	Very low	131 Å²	131	138.1 Å²	138.1	70%	0.701	71%	0.713	S	S	*	*			trans	-23.8	165.8	164.1	-32	-16.4	0	0	0	117.2
446	S	30	Very low	28.5	Very low	109 Å²	109	138.9 Å²	138.9	76%	0.762	72%	0.717	S	S	*	*			cis	-171.3	165	31.2	53.8	0	0	0	0	111
447	D	29.2	Very low	28.5	Very low	110 Å²	110	138 Å²	138	59%	0.588	72%	0.718	S	S	*	*			cis	-169.6	161.4	-14.6	-114.9	-113.6	0	0	0	109.2
448	Q	29.3	Very low	28.5	Very low	156 Å²	156	134.9 Å²	134.9	73%	0.729	71%	0.707	S	S	*	*			trans	64.7	158.8	148.3	-70.1	168.3	41.2	0	0	119.4
449	I	29.4	Very low	28.5	Very low	134 Å²	134	136 Å²	136	69%	0.687	71%	0.713	S	S	*	*			cis	-145.8	164	3.5	-131.3	157.5	0	0	0	113.5
450	N	25.4	Very low	28.3	Very low	132 Å²	132	133.3 Å²	133.3	71%	0.706	71%	0.707	S	S	*	*			trans	-38.3	154.9	-178.1	-48.1	-41.3	0	0	0	121.9
451	L	30.2	Very low	28.3	Very low	159 Å²	159	133.4 Å²	133.4	83%	0.832	71%	0.71	S	S	*	*				168.8	102.5	116.9	-87.1	161.5	0	0	0	108.9
452	Q	25.7	Very low	28.1	Very low	164 Å²	164	135.5 Å²	135.5	77%	0.766	72%	0.721	S	S	*	*				74.9	143.1	79.5	-79.2	-158.8	-11.5	0	0	117
453	Q	27.9	Very low	28	Very low	188 Å²	188	135 Å²	135	88%	0.879	73%	0.725	S	S	*	*			trans	71.7	137.5	179.1	-57.9	-177.6	9.1	0	0	115.4
454	S	26.6	Very low	27.8	Very low	96 Å²	96	135 Å²	135	67%	0.671	73%	0.726	S	S	*	*			cis	-154.4	166.5	-4.2	57.2	0	0	0	0	113.5
455	N	30.1	Very low	27.9	Very low	153 Å²	153	134.7 Å²	134.7	82%	0.818	73%	0.727	S	S	*	*			trans	72.5	82.5	155.5	-59.6	-10.1	0	0	0	120.9
456	L	29.6	Very low	27.8	Very low	136 Å²	136	134.8 Å²	134.8	71%	0.712	73%	0.726	S	S	*	*			trans	-51.7	178.4	141.1	-97.5	68.2	0	0	0	113.4	N458	L456-N458 HydrophobicContact CD2-CB 3.88Å; L456-N458 WeakPolarHBondContact CD2-ND2 3.47Å; L456-N458 HydrophobicContact CG-CB 3.93Å
457	P	29.8	Very low	27.7	Very low	116 Å²	116	137.8 Å²	137.8	75%	0.753	73%	0.726	S	S	*	*			cis	-123.9	163.8	12.4	42.4	-28.1	0	0	0	115.1
458	N	24.8	Very low	27.7	Very low	112 Å²	112	138.1 Å²	138.1	60%	0.599	73%	0.731	S	S	*	*			cis	86.2	150	20.9	-157.8	19.6	0	0	0	115.6	L456	L456-N458 HydrophobicContact CD2-CB 3.88Å; L456-N458 WeakPolarHBondContact CD2-ND2 3.47Å; L456-N458 HydrophobicContact CG-CB 3.93Å
459	T	27.7	Very low	27.7	Very low	105 Å²	105	138.6 Å²	138.6	64%	0.644	73%	0.734	S	S	*	*			trans	68.3	153	175.7	75	0	0	0	0	117.1
460	N	25.9	Very low	27.7	Very low	124 Å²	124	137.6 Å²	137.6	66%	0.663	73%	0.729	S	S	*	*			cis	-168.3	171.2	-32.2	-105.8	-21.3	0	0	0	109.9
461	Q	28.1	Very low	27.9	Very low	161 Å²	161	140.4 Å²	140.4	75%	0.752	74%	0.735	S	S	*	*			trans	68.8	149.9	146.2	-81.2	161.9	-4.7	0	0	120.6
462	L	25.8	Very low	28	Very low	145 Å²	145	138 Å²	138	76%	0.759	72%	0.723	S	S	*	*			trans	51.5	116.5	156	-85.2	73.8	0	0	0	118.1
463	L	27.6	Very low	28.2	Very low	148 Å²	148	136.6 Å²	136.6	78%	0.775	72%	0.719	S	S	*	*				96.2	149	78.9	-165.7	69.6	0	0	0	110.7
464	D	25.3	Very low	28.3	Very low	143 Å²	143	134.1 Å²	134.1	77%	0.765	71%	0.712	S	S	*	*			trans	-42.5	145	174.4	-73.5	-64.6	0	0	0	113.1
465	P	31.5	Very low	28.5	Very low	107 Å²	107	134.3 Å²	134.3	70%	0.695	71%	0.71	S	S	*	*				-158.6	156.4	67	42.4	-21.3	0	0	0	121.3
466	L	24.4	Very low	28.6	Very low	132 Å²	132	136 Å²	136	69%	0.691	71%	0.713	S	S	*	*			trans	59	139.9	130.8	-67.7	172.9	0	0	0	124.1
467	K	26.9	Very low	28.6	Very low	173 Å²	173	133.9 Å²	133.9	75%	0.752	71%	0.709	S	S	*	*			trans	68.6	157.7	142.7	-70.7	166	-175.7	172.8	0	115.9
468	T	28.6	Very low	28.7	Very low	116 Å²	116	134.7 Å²	134.7	71%	0.712	71%	0.707	S	S	*	*			cis	-147.9	158.8	2.9	-8.9	0	0	0	0	105.9
469	E	29.8	Very low	29.2	Very low	166 Å²	166	138.2 Å²	138.2	78%	0.776	72%	0.717	S	S	*	*			cis	-148.8	165.4	34	-80.6	-147.2	133.3	0	0	115.6
470	L	29.9	Very low	29.5	Very low	114 Å²	114	138 Å²	138	60%	0.597	72%	0.717	S	S	*	*			trans	-12.1	157.2	155.8	-54.4	86.9	0	0	0	119.3
471	K	30.2	Very low	29.9	Very low	191 Å²	191	138.7 Å²	138.7	83%	0.83	72%	0.721	S	S	*	*			cis	-146.2	155.7	27.8	-64.3	167.2	-175.5	174	0	110.1
472	N	30.8	Very low	30.3	Very low	107 Å²	107	139.4 Å²	139.4	57%	0.572	72%	0.722	S	S	*	*			cis	-161.7	150.5	-13.1	-104.5	1.4	0	0	0	108.1
473	I	31.4	Very low	30.6	Very low	135 Å²	135	138 Å²	138	69%	0.692	72%	0.719	S	S	*	*			trans	35.2	120.1	135.1	-51.8	168.2	0	0	0	116.6
474	N	29.9	Very low	30.9	Very low	136 Å²	136	137.1 Å²	137.1	73%	0.727	72%	0.72	S	S	*	*			cis	-172.1	171	7.9	-105.2	7.3	0	0	0	106.7
475	T	31.2	Very low	31.2	Very low	101 Å²	101	137.5 Å²	137.5	62%	0.62	72%	0.715	S	S	*	*			cis	-169.2	159.5	-17.2	26	0	0	0	0	108.6
476	Q	31	Very low	31.1	Very low	189 Å²	189	136.2 Å²	136.2	88%	0.883	71%	0.708	S	S	*	*			trans	64.9	142.2	162.9	-68.7	168.5	-4.8	0	0	117.8
477	S	30.4	Very low	31.3	Very low	91 Å²	91	137.9 Å²	137.9	64%	0.636	71%	0.71	S	S	*	*			cis	-161.7	159.7	-12.2	66.7	0	0	0	0	111.9
478	N	32	Very low	31.5	Very low	132 Å²	132	131.5 Å²	131.5	71%	0.706	69%	0.687	S	S	*	*			trans	59.1	148.2	156	-61.5	-52.1	0	0	0	120.3
479	K	34.3	Very low	31.7	Very low	187 Å²	187	134 Å²	134	81%	0.813	69%	0.688	S	S	*	*			cis	-157.6	174.9	-17.9	-110.6	-173.2	179.6	177.5	0	108.2
480	P	35.4	Very low	31.8	Very low	100 Å²	100	133.5 Å²	133.5	65%	0.649	69%	0.689	S	S	*	*			trans	-129.2	-160.2	-138.9	44.6	-28.6	0	0	0	116.6
481	N	34.3	Very low	31.9	Very low	138 Å²	138	132.5 Å²	132.5	74%	0.738	69%	0.692	S	S	*	*			trans	99.9	137.8	168.1	-56.7	-45.1	0	0	0	116.2
482	K	34.7	Very low	32	Very low	177 Å²	177	130.4 Å²	130.4	77%	0.77	69%	0.685	S	S	*	*			cis	-156.9	136.1	0.3	-125.4	173.9	-176.7	-177.8	0	112.4
483	T	32.7	Very low	31.8	Very low	114 Å²	114	134.5 Å²	134.5	70%	0.699	69%	0.693	S	S	*	*			trans	46.5	129.9	150.5	51.9	0	0	0	0	121.7
484	T	34.1	Very low	31.6	Very low	131 Å²	131	135.2 Å²	135.2	80%	0.804	70%	0.697	S	S	*	*			cis	74.8	151.6	32	81.1	0	0	0	0	115
485	K	32.4	Very low	31.6	Very low	151 Å²	151	133.6 Å²	133.6	66%	0.657	70%	0.696	S	S	*	*				-124.1	-113.1	55.1	-156.8	-178.4	-178	171.8	0	117.9
486	C	28.9	Very low	31.4	Very low	80 Å²	80	135.7 Å²	135.7	54%	0.541	70%	0.704	S	S	.	*			trans	-127.8	166.5	-157.8	-80	0	0	0	0	113.2	S430	S430-C486 PolarHBondContact OG-O 3.4Å
487	F	27.6	Very low	31.4	Very low	166 Å²	166	134.2 Å²	134.2	73%	0.728	70%	0.697	S	S	*	*			cis	76.6	80.3	5.4	-93.3	-103.7	0	0	0	120.6	L429 S430	L429-F487 PolarHBondContact O-N 3.35Å; S430-F487 VanDerWaalsContact OG-C 3.24Å; S430-F487 PolarHBondContact OG-N 3.06Å
488	S	32.4	Very low	31.1	Very low	40 Å²	40	137.4 Å²	137.4	28%	0.28	70%	0.701	S	S	.	*			trans	59.7	174.5	135.8	69.1	0	0	0	0	123.9	L429 S430	L429-S488 PolarHBondContact O-N 3.39Å; S430-S488 PolarHBondContact OG-N 3.3Å
489	F	31.9	Very low	31	Very low	167 Å²	167	137 Å²	137	73%	0.732	71%	0.709	S	S	*	*			trans	110.3	170.8	138.9	-122.5	-100.2	0	0	0	122.5
490	I	32.7	Very low	30.7	Very low	156 Å²	156	138.8 Å²	138.8	80%	0.8	71%	0.712	S	S	*	*			trans	93.6	122.8	178.2	-53.6	165.1	0	0	0	114.7
491	S	31.8	Very low	30	Very low	94 Å²	94	139.1 Å²	139.1	66%	0.657	72%	0.717	S	S	*	*			cis	112.1	162.1	-4.5	-154.1	0	0	0	0	118
492	Q	31.8	Very low	29.7	Very low	146 Å²	146	143.4 Å²	143.4	68%	0.682	73%	0.725	S	S	*	*			trans	88.7	147.5	-169.9	-57.1	-167.3	22.3	0	0	116
493	R	26.4	Very low	29.4	Very low	193 Å²	193	138 Å²	138	73%	0.728	72%	0.719	S	S	*	*			cis	-162.2	139.8	-4.1	-125.4	177.3	171.8	145.1	-18	113.9
494	L	28.5	Very low	29	Very low	150 Å²	150	140.9 Å²	140.9	79%	0.785	73%	0.73	S	S	*	*			trans	53.5	164.7	141	-73.4	170	0	0	0	125.4
495	S	28.2	Very low	28.9	Very low	102 Å²	102	142.8 Å²	142.8	71%	0.713	73%	0.734	S	S	*	*			trans	69.2	140.5	176.9	63.4	0	0	0	0	118.2
496	D	27.3	Very low	28.6	Very low	146 Å²	146	140.6 Å²	140.6	78%	0.781	74%	0.737	S	S	*	*			cis	-160.7	-178.8	-19.2	-100.8	-38.5	0	0	0	111.1
497	H	32.2	Very low	28.6	Very low	157 Å²	157	146.6 Å²	146.6	73%	0.727	75%	0.754	S	S	*	*			trans	79.7	107.3	166.9	-71.9	-91.3	0	0	0	122.7
498	Q	24.6	Very low	28.4	Very low	158 Å²	158	147.3 Å²	147.3	74%	0.738	76%	0.757	S	S	*	*				53	115.1	127.1	-65.8	170.8	-47	0	0	122.9
499	S	29.5	Very low	28.2	Very low	125 Å²	125	153.8 Å²	153.8	87%	0.874	78%	0.78	S	S	*	*			trans	-156.3	150.4	141.8	-71.8	0	0	0	0	109.9
500	Y	27.1	Very low	28	Very low	223 Å²	223	155.8 Å²	155.8	88%	0.875	79%	0.785	S	S	*	*			trans	-85.9	160.9	-165.4	-91.4	-96.8	0	0	0	116.3
501	S	21.3	Very low	27.6	Very low	107 Å²	107	156.8 Å²	156.8	75%	0.748	79%	0.786	S	S	*	*			trans	-142	141.5	176.2	-175.4	0	0	0	0	111.8
502	Y	28.3	Very low	27.6	Very low	229 Å²	229	157.8 Å²	157.8	90%	0.898	79%	0.79	S	S	*	*			trans	-158.7	145.5	161.6	-98	-80.6	0	0	0	107.9
503	G	28.8	Very low	27.4	Very low	64 Å²	64	154.7 Å²	154.7	66%	0.66	78%	0.778	S	S	*	*			cis	-169.2	160.1	-6.6	0	0	0	0	0	110.8
504	N	23.5	Very low	27.9	Very low	173 Å²	173	151.3 Å²	151.3	93%	0.925	78%	0.781	S	S	*	*			trans	-78.6	128.1	-177.8	-73.5	-51.1	0	0	0	112.6
505	I	31.1	Very low	28.2	Very low	172 Å²	172	151.5 Å²	151.5	88%	0.882	78%	0.776	S	S	*	*			trans	-130.7	135.8	153.7	-65.2	-175.1	0	0	0	109
506	S	26.5	Very low	28.4	Very low	104 Å²	104	155.3 Å²	155.3	73%	0.727	78%	0.779	S	S	*	*			trans	-92.3	149.4	-177	74.6	0	0	0	0	113.1
507	K	28.6	Very low	28.5	Very low	207 Å²	207	159.7 Å²	159.7	90%	0.9	79%	0.787	S	S	*	*				-163	144.6	128.4	-106.3	155.9	-173.6	175.3	0	111.6
508	K	24.2	Very low	28.7	Very low	181 Å²	181	154.2 Å²	154.2	79%	0.787	77%	0.766	S	S	*	*			trans	-68.9	154	168.7	-57.7	168.7	-178.7	174.2	0	108.9
509	F	27.3	Very low	29.1	Very low	175 Å²	175	155.9 Å²	155.9	77%	0.768	77%	0.767	S	S	*	*				176.2	153.8	106.2	-101.8	-75.8	0	0	0	112.6
510	Y	28.8	Very low	29.7	Very low	209 Å²	209	158.5 Å²	158.5	82%	0.82	76%	0.763	S	S	*	*			trans	60.5	97.6	172.9	-70.8	-72.9	0	0	0	119.8
511	E	24.8	Very low	30.2	Very low	178 Å²	178	156.8 Å²	156.8	83%	0.832	76%	0.755	S	S	*	*			trans	-70.2	136.2	150.8	-66.8	176.7	90.4	0	0	111.5
512	P	30.1	Very low	31.3	Very low	115 Å²	115	158.4 Å²	158.4	75%	0.747	75%	0.745	S	S	*	*			trans	-108.2	71.5	166.3	36.9	-29.7	0	0	0	112.6
513	D	29.3	Very low	31.9	Very low	81 Å²	81	156.4 Å²	156.4	43%	0.433	74%	0.741	S	S	.	*			trans	48.1	110.4	157.3	-160.6	12	0	0	0	118.7	K515	D513-K515 PolarHBondContact O-N 2.8Å; D513-K515 WeakPolarHBondContact OD1-CG 3.23Å; D513-K515 IonicContact OD1-NZ 2.62Å; D513-K515 PolarHBondContact OD1-NZ 2.74Å; D513-K515 WeakPolarHBondContact OD2-CD 3.5Å; D513-K515 IonicContact OD2-NZ 2.79Å; D513-K515 PolarHBondContact OD2-NZ 2.77Å
514	P	35.8	Very low	32.5	Very low	121 Å²	121	157 Å²	157	79%	0.786	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	16.2	-176.6	28.5	-36.5	0	0	0	116.1
515	K	34.1	Very low	33.4	Very low	154 Å²	154	152.2 Å²	152.2	67%	0.67	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-9.7	179.5	-58.5	-175	-161.8	78.4	0	114.5	D513	D513-K515 PolarHBondContact O-N 2.8Å; D513-K515 WeakPolarHBondContact OD1-CG 3.23Å; D513-K515 IonicContact OD1-NZ 2.62Å; D513-K515 PolarHBondContact OD1-NZ 2.74Å; D513-K515 WeakPolarHBondContact OD2-CD 3.5Å; D513-K515 IonicContact OD2-NZ 2.79Å; D513-K515 PolarHBondContact OD2-NZ 2.77Å
516	K	33.5	Very low	34.2	Very low	182 Å²	182	147 Å²	147	79%	0.791	69%	0.691	S	S	*	*			trans	-83.4	-20.7	-172.9	-86.8	-178.9	175.9	174.9	0	116.6	S518	K516-S518 VanDerWaalsContact C-N 3.26Å; K516-S518 PolarHBondContact O-N 3.05Å
517	Y	29.8	Very low	35	Very low	238 Å²	238	149.1 Å²	149.1	93%	0.933	69%	0.693	S	S	*	*			trans	-75.7	71.2	180	-80.8	-79.9	0	0	0	113.4
518	S	36.2	Very low	35.9	Very low	43 Å²	43	145.5 Å²	145.5	30%	0.301	68%	0.682	S	S	.	*			trans	-139.3	52.6	-173.1	-169.5	0	0	0	0	111.7	K516 R522	K516-S518 VanDerWaalsContact C-N 3.26Å; K516-S518 PolarHBondContact O-N 3.05Å; S518-R522 WeakPolarHBondContact O-CD 3.38Å; S518-R522 WeakPolarHBondContact O-CG 3.47Å; S518-R522 PolarHBondContact O-NE 3.45Å; S518-R522 PolarHBondContact OG-NE 3.23Å; S518-R522 PolarHBondContact OG-NH2 3.33Å
519	Y	33.1	Very low	37	Very low	193 Å²	193	142.3 Å²	142.3	76%	0.757	67%	0.669	S	S	*	*	S	Bend	trans	-112.2	-50.7	175.7	-122.3	-108.8	0	0	0	114	R521 R522	Y519-R521 PolarHBondContact O-N 3.1Å; Y519-R522 PolarHBondContact O-N 3.31Å
520	K	40.7	Very low	38.1	Very low	180 Å²	180	137 Å²	137	78%	0.783	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-18.8	-179	-74.2	-175.1	175.8	177.7	0	115
521	R	39	Very low	38.8	Very low	187 Å²	187	135.2 Å²	135.2	71%	0.706	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-9.6	173	-147.4	174.4	-170.2	167	4.3	114.2	Y519 L525	Y519-R521 PolarHBondContact O-N 3.1Å; R521-L525 HydrophobicContact CG-CD1 4.06Å; R521-L525 WeakPolarHBondContact O-CB 3.3Å; R521-L525 WeakPolarHBondContact O-CD1 3.41Å; R521-L525 VanDerWaalsContact O-CG 3.29Å; R521-L525 WeakPolarHBondContact O-CG 3.16Å; R521-L525 PolarHBondContact O-N 3.27Å
522	R	43.3	Very low	39.2	Very low	141 Å²	141	128.9 Å²	128.9	53%	0.532	65%	0.65	S	S	.	*	H	α-helix	trans	-82	-30.8	-174.5	-77.2	-172	-168.3	-176.4	7.4	114.5	S518 Y519 L525 A526	S518-R522 WeakPolarHBondContact O-CD 3.38Å; S518-R522 WeakPolarHBondContact O-CG 3.47Å; S518-R522 PolarHBondContact O-NE 3.45Å; S518-R522 PolarHBondContact OG-NE 3.23Å; S518-R522 PolarHBondContact OG-NH2 3.33Å; Y519-R522 PolarHBondContact O-N 3.31Å; R522-L525 PolarHBondContact O-N 2.96Å; R522-A526 WeakPolarHBondContact O-CB 3.3Å; R522-A526 PolarHBondContact O-N 3.35Å
523	K	42.3	Very low	39.5	Very low	187 Å²	187	133.7 Å²	133.7	81%	0.813	66%	0.659	S	S	*	*	H	α-helix	trans	-68.2	-38.6	-179.4	-111.3	-178.2	178.7	-179.9	0	113.6
524	S	39.5	Very low	40	Very low	77 Å²	77	141.6 Å²	141.6	54%	0.538	68%	0.683	S	S	.	*	H	α-helix	trans	-75.9	-30.8	173.6	51.3	0	0	0	0	113.2
525	L	43.2	Very low	39.9	Very low	71 Å²	71	139.2 Å²	139.2	37%	0.372	68%	0.681	S	S	.	*	H	α-helix	trans	-75.5	-35.2	173.1	-73	174.8	0	0	0	112.8	R521 R522 I527 I528 H529	R521-L525 HydrophobicContact CG-CD1 4.06Å; R521-L525 WeakPolarHBondContact O-CB 3.3Å; R521-L525 WeakPolarHBondContact O-CD1 3.41Å; R521-L525 VanDerWaalsContact O-CG 3.29Å; R521-L525 WeakPolarHBondContact O-CG 3.16Å; R521-L525 PolarHBondContact O-N 3.27Å; R522-L525 PolarHBondContact O-N 2.96Å; L525-I527 PolarHBondContact O-N 3.14Å; L525-I528 CarbonylContact O-C 3.56Å; L525-I528 PolarHBondContact O-N 2.87Å; L525-I528 VanDerWaalsContact O-N 3.07Å; L525-H529 VanDerWaalsContact O-CB 3.29Å; L525-H529 WeakPolarHBondContact O-CB 2.86Å; L525-H529 PolarHBondContact O-CD2 3.49Å; L525-H529 PolarHBondContact O-N 2.99Å
526	A	48.9	Very low	39.9	Very low	62 Å²	62	144 Å²	144	51%	0.512	69%	0.694	S	S	.	*	H	α-helix	trans	-60.8	-42.7	-175	0	0	0	0	0	113	R522 I528 H529 G530	R522-A526 WeakPolarHBondContact O-CB 3.3Å; R522-A526 PolarHBondContact O-N 3.35Å; A526-I528 PolarHBondContact O-N 3.23Å; A526-H529 PolarHBondContact O-N 3.03Å; A526-G530 PolarHBondContact O-N 3.06Å; A526-G530 VanDerWaalsContact O-N 3.1Å
527	I	43.3	Very low	40.1	Very low	150 Å²	150	145.1 Å²	145.1	77%	0.769	70%	0.699	S	S	*	*	H	α-helix	trans	-67.7	-20.7	179.2	-59.5	174.8	0	0	0	111.7	L525	L525-I527 PolarHBondContact O-N 3.14Å
528	I	46.7	Very low	40.6	Very low	130 Å²	130	140 Å²	140	67%	0.667	69%	0.687	S	S	*	*	H	α-helix	trans	-104.2	-27.1	-179	-60.8	177.2	0	0	0	112.1	L525 A526	L525-I528 CarbonylContact O-C 3.56Å; L525-I528 PolarHBondContact O-N 2.87Å; L525-I528 VanDerWaalsContact O-N 3.07Å; A526-I528 PolarHBondContact O-N 3.23Å
529	H	46.7	Very low	40.6	Very low	114 Å²	114	149.7 Å²	149.7	53%	0.528	72%	0.717	S	S	.	*	H	α-helix	trans	-82.7	-12.4	174.4	-89.6	-97.3	0	0	0	113.7	L525 A526 L531 G532	L525-H529 VanDerWaalsContact O-CB 3.29Å; L525-H529 WeakPolarHBondContact O-CB 2.86Å; L525-H529 PolarHBondContact O-CD2 3.49Å; L525-H529 PolarHBondContact O-N 2.99Å; A526-H529 PolarHBondContact O-N 3.03Å; H529-L531 PolarHBondContact O-N 2.79Å; H529-G532 PolarHBondContact O-N 3Å
530	G	50.6	Low	41	Very low	63 Å²	63	150 Å²	150	65%	0.649	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-12.6	176.2	0	0	0	0	0	115	A526	A526-G530 PolarHBondContact O-N 3.06Å; A526-G530 VanDerWaalsContact O-N 3.1Å
531	L	43.3	Very low	41.3	Very low	173 Å²	173	145 Å²	145	91%	0.906	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	17.2	178	-66	168	0	0	0	113.3	H529	H529-L531 PolarHBondContact O-N 2.79Å
532	G	34.1	Very low	41.5	Very low	44 Å²	44	141 Å²	141	45%	0.454	70%	0.702	S	S	.	*			trans	-139.2	32.1	-162.2	0	0	0	0	0	117.8	H529 R534	H529-G532 PolarHBondContact O-N 3Å; G532-R534 PolarHBondContact O-N 3.44Å
533	F	36.2	Very low	41.5	Very low	216 Å²	216	137.7 Å²	137.7	95%	0.947	70%	0.701	S	S	*	*			trans	-79.1	49.2	179.7	-104.4	-81.3	0	0	0	114.6
534	R	39.6	Very low	41.9	Very low	247 Å²	247	132.2 Å²	132.2	93%	0.932	69%	0.686	S	S	*	*	S	Bend	trans	-155.9	136.3	168.8	-127.6	168.1	176.1	163.2	-2.9	112	G532	G532-R534 PolarHBondContact O-N 3.44Å
535	G	34.6	Very low	42.6	Very low	71 Å²	71	135.1 Å²	135.1	73%	0.732	69%	0.689	S	S	*	*			trans	88.8	95	165.4	0	0	0	0	0	118	K537	G535-K537 PolarHBondContact O-N 3.17Å; G535-K537 VanDerWaalsContact O-N 3.13Å
536	R	33.3	Very low	42.7	Very low	254 Å²	254	136.2 Å²	136.2	96%	0.958	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	99.8	159.4	-76.8	177	171.4	161.3	-4.4	109.9
537	K	37.7	Very low	42.9	Very low	206 Å²	206	137.6 Å²	137.6	90%	0.896	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.3	-30.1	157.2	-108.4	157.2	-174.3	-178.6	0	115.8	G535 R539	G535-K537 PolarHBondContact O-N 3.17Å; G535-K537 VanDerWaalsContact O-N 3.13Å; K537-R539 PolarHBondContact O-N 3.42Å
538	I	40.9	Very low	43.6	Very low	132 Å²	132	136.7 Å²	136.7	68%	0.677	69%	0.686	S	S	*	*			trans	-84.4	64.2	-165.1	-42	178.7	0	0	0	113.7
539	R	36.1	Very low	43.9	Very low	245 Å²	245	136.7 Å²	136.7	93%	0.925	68%	0.683	S	S	*	*			trans	-97	-13	-174.4	-122.1	-178.7	-171.8	-177.8	2.7	117.4	K537	K537-R539 PolarHBondContact O-N 3.42Å
540	K	40.6	Very low	44.3	Very low	200 Å²	200	135.8 Å²	135.8	87%	0.87	68%	0.682	S	S	*	*	S	Bend	trans	-100.1	-34.4	180	-73.6	-173.1	175.7	-178.5	0	114.9	N542	K540-N542 PolarHBondContact O-N 2.63Å
541	S	47.9	Very low	44.3	Very low	74 Å²	74	140.2 Å²	140.2	52%	0.517	68%	0.683	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	-39.9	-170.8	-174.9	0	0	0	0	114.5	S543 S544	S541-S543 PolarHBondContact O-N 2.74Å; S541-S544 PolarHBondContact O-N 3.02Å; S541-S544 PolarHBondContact O-OG 3.02Å; S541-S544 VanDerWaalsContact O-OG 3.05Å
542	N	42.8	Very low	44.8	Very low	103 Å²	103	137.4 Å²	137.4	55%	0.551	67%	0.669	S	S	*	*	H	α-helix	trans	-70.1	-9.9	-170	-69.4	-10.3	0	0	0	115	K540 S544 L546	K540-N542 PolarHBondContact O-N 2.63Å; N542-S544 VanDerWaalsContact C-N 3.33Å; N542-S544 PolarHBondContact O-N 2.99Å; N542-L546 PolarHBondContact O-N 2.78Å
543	S	43.9	Very low	45.4	Very low	72 Å²	72	141.8 Å²	141.8	50%	0.503	68%	0.675	S	S	.	*	H	α-helix	trans	-68.6	-29.6	179	-163.9	0	0	0	0	113.3	S541 N547	S541-S543 PolarHBondContact O-N 2.74Å; S543-N547 PolarHBondContact O-N 3.32Å; S543-N547 VanDerWaalsContact O-N 3.15Å
544	S	50.5	Low	46	Very low	73 Å²	73	135.4 Å²	135.4	51%	0.51	66%	0.658	S	S	.	*	H	α-helix	trans	-72.8	-46	178.9	58.3	0	0	0	0	111.6	S541 N542 L546 N547 Q548	S541-S544 PolarHBondContact O-N 3.02Å; S541-S544 PolarHBondContact O-OG 3.02Å; S541-S544 VanDerWaalsContact O-OG 3.05Å; N542-S544 VanDerWaalsContact C-N 3.33Å; N542-S544 PolarHBondContact O-N 2.99Å; S544-L546 VanDerWaalsContact C-N 3.32Å; S544-L546 PolarHBondContact O-N 3.08Å; S544-N547 PolarHBondContact O-N 3.17Å; S544-Q548 PolarHBondContact O-N 2.86Å
545	K	54.3	Low	46.6	Very low	138 Å²	138	129.7 Å²	129.7	60%	0.6	65%	0.65	S	S	*	*	H	α-helix	trans	-59.9	-40.4	174.9	-73.1	-173.5	175.1	-178.1	0	112	Q548 Q549	K545-Q548 PolarHBondContact O-N 3.3Å; K545-Q549 WeakPolarHBondContact O-CG 3.31Å; K545-Q549 PolarHBondContact O-N 3.16Å
546	L	45.6	Very low	47.2	Very low	93 Å²	93	135 Å²	135	49%	0.487	65%	0.653	S	S	.	*	H	α-helix	trans	-62.9	-45.4	175	-167.2	73.1	0	0	0	111.4	N542 S544 Q548 Q549 I550	N542-L546 PolarHBondContact O-N 2.78Å; S544-L546 VanDerWaalsContact C-N 3.32Å; S544-L546 PolarHBondContact O-N 3.08Å; L546-Q548 VanDerWaalsContact C-N 3.33Å; L546-Q548 PolarHBondContact O-N 3.23Å; L546-Q549 PolarHBondContact O-N 2.98Å; L546-I550 HydrophobicContact CD2-CD1 4.46Å; L546-I550 HydrophobicContact CG-CD1 4.02Å; L546-I550 VanDerWaalsContact O-CG1 3.31Å; L546-I550 WeakPolarHBondContact O-CG1 3.29Å; L546-I550 PolarHBondContact O-N 3.14Å
547	N	52.2	Low	48	Very low	91 Å²	91	127.3 Å²	127.3	49%	0.487	63%	0.631	S	S	.	*	H	α-helix	trans	-65.8	-32.4	177.1	-74.7	-7.4	0	0	0	113	S543 S544 K551	S543-N547 PolarHBondContact O-N 3.32Å; S543-N547 VanDerWaalsContact O-N 3.15Å; S544-N547 PolarHBondContact O-N 3.17Å; N547-K551 WeakPolarHBondContact O-CB 3.47Å; N547-K551 PolarHBondContact O-N 3.28Å
548	Q	57.6	Low	48.3	Very low	131 Å²	131	122.3 Å²	122.3	61%	0.612	62%	0.617	S	S	*	*	H	α-helix	trans	-66.2	-44.2	170	-92.1	-179.1	-29.2	0	0	112.2	S544 K545 L546 I550 K551 N552	S544-Q548 PolarHBondContact O-N 2.86Å; K545-Q548 PolarHBondContact O-N 3.3Å; L546-Q548 VanDerWaalsContact C-N 3.33Å; L546-Q548 PolarHBondContact O-N 3.23Å; Q548-I550 VanDerWaalsContact C-N 3.34Å; Q548-I550 PolarHBondContact O-N 2.78Å; Q548-K551 PolarHBondContact O-N 3.28Å; Q548-N552 WeakPolarHBondContact O-CB 3.3Å; Q548-N552 VanDerWaalsContact O-CG 3.27Å; Q548-N552 PolarHBondContact O-N 2.73Å
549	Q	53.9	Low	48.4	Very low	131 Å²	131	121 Å²	121	61%	0.612	62%	0.617	S	S	*	*	H	α-helix	trans	-62.1	-41.1	175.2	-74.6	179.9	-25.3	0	0	111.8	K545 L546 N552 F553	K545-Q549 WeakPolarHBondContact O-CG 3.31Å; K545-Q549 PolarHBondContact O-N 3.16Å; L546-Q549 PolarHBondContact O-N 2.98Å; Q549-N552 PolarHBondContact O-N 3.01Å; Q549-F553 PolarHBondContact O-N 2.94Å
550	I	55.5	Low	48.6	Very low	95 Å²	95	115.6 Å²	115.6	49%	0.487	60%	0.603	S	S	.	*	H	α-helix	trans	-64.7	-45.4	175.7	-67.9	165.3	0	0	0	111.4	L546 Q548 N552 F553 S554	L546-I550 HydrophobicContact CD2-CD1 4.46Å; L546-I550 HydrophobicContact CG-CD1 4.02Å; L546-I550 VanDerWaalsContact O-CG1 3.31Å; L546-I550 WeakPolarHBondContact O-CG1 3.29Å; L546-I550 PolarHBondContact O-N 3.14Å; Q548-I550 VanDerWaalsContact C-N 3.34Å; Q548-I550 PolarHBondContact O-N 2.78Å; I550-N552 PolarHBondContact O-N 2.99Å; I550-F553 PolarHBondContact O-N 3.46Å; I550-S554 WeakPolarHBondContact O-CB 3.38Å; I550-S554 PolarHBondContact O-N 2.73Å
551	K	50.6	Low	48.4	Very low	156 Å²	156	115.7 Å²	115.7	68%	0.678	60%	0.599	S	S	*	*	H	α-helix	trans	-59.6	-44	174.3	-83.4	-168.9	172.2	-171.6	0	112.1	N547 Q548 F553 S554 V555	N547-K551 WeakPolarHBondContact O-CB 3.47Å; N547-K551 PolarHBondContact O-N 3.28Å; Q548-K551 PolarHBondContact O-N 3.28Å; K551-F553 VanDerWaalsContact C-N 3.32Å; K551-F553 PolarHBondContact O-N 3.45Å; K551-S554 PolarHBondContact O-N 3.43Å; K551-V555 WeakPolarHBondContact O-CG2 2.92Å; K551-V555 PolarHBondContact O-N 3.18Å
552	N	53.2	Low	47.9	Very low	113 Å²	113	118.7 Å²	118.7	60%	0.604	60%	0.603	S	S	*	*	H	α-helix	trans	-63.2	-38	177.5	-72.4	-8.7	0	0	0	112.1	Q548 Q549 I550 K556	Q548-N552 WeakPolarHBondContact O-CB 3.3Å; Q548-N552 VanDerWaalsContact O-CG 3.27Å; Q548-N552 PolarHBondContact O-N 2.73Å; Q549-N552 PolarHBondContact O-N 3.01Å; I550-N552 PolarHBondContact O-N 2.99Å; N552-K556 PolarHBondContact O-N 3.34Å
553	F	45.8	Very low	48	Very low	136 Å²	136	121.9 Å²	121.9	60%	0.596	62%	0.618	S	S	*	*	H	α-helix	trans	-64.3	-46.5	173.5	-126	-88.2	0	0	0	111.9	Q549 I550 K551 V555 N557	Q549-F553 PolarHBondContact O-N 2.94Å; I550-F553 PolarHBondContact O-N 3.46Å; K551-F553 VanDerWaalsContact C-N 3.32Å; K551-F553 PolarHBondContact O-N 3.45Å; F553-V555 VanDerWaalsContact C-N 3.28Å; F553-V555 PolarHBondContact O-N 2.87Å; F553-N557 HydrophobicContact CD1-CB 3.96Å; F553-N557 HydrophobicContact CE1-CB 4.09Å; F553-N557 WeakPolarHBondContact O-CB 3.35Å; F553-N557 PolarHBondContact O-N 3.21Å
554	S	50	Low	47.8	Very low	83 Å²	83	126.1 Å²	126.1	58%	0.58	63%	0.63	S	S	*	*	H	α-helix	trans	-68.1	-21.4	-174.8	-169.3	0	0	0	0	114.7	I550 K551	I550-S554 WeakPolarHBondContact O-CB 3.38Å; I550-S554 PolarHBondContact O-N 2.73Å; K551-S554 PolarHBondContact O-N 3.43Å
555	V	50.7	Low	47.6	Very low	126 Å²	126	131.8 Å²	131.8	76%	0.764	65%	0.645	S	S	*	*	H	α-helix	trans	-102.6	-26.3	-175.9	178.2	0	0	0	0	112.9	K551 F553	K551-V555 WeakPolarHBondContact O-CG2 2.92Å; K551-V555 PolarHBondContact O-N 3.18Å; F553-V555 VanDerWaalsContact C-N 3.28Å; F553-V555 PolarHBondContact O-N 2.87Å
556	K	48.9	Very low	47.5	Very low	183 Å²	183	128.8 Å²	128.8	80%	0.796	64%	0.636	S	S	*	*	H	α-helix	trans	-108.6	-27	-179.6	-72.7	-171	173.9	-176	0	115.3	N552	N552-K556 PolarHBondContact O-N 3.34Å
557	N	48.8	Very low	47.9	Very low	92 Å²	92	130 Å²	130	49%	0.492	65%	0.647	S	S	.	*			trans	-120	32.5	-162.6	-64.6	0.9	0	0	0	113.8	F553 P559	F553-N557 HydrophobicContact CD1-CB 3.96Å; F553-N557 HydrophobicContact CE1-CB 4.09Å; F553-N557 WeakPolarHBondContact O-CB 3.35Å; F553-N557 PolarHBondContact O-N 3.21Å; N557-P559 VanDerWaalsContact O-CD 3.24Å; N557-P559 WeakPolarHBondContact O-CD 3.36Å
558	V	43.8	Very low	48.1	Very low	101 Å²	101	133.8 Å²	133.8	61%	0.612	66%	0.659	S	S	*	*			trans	-85.5	109.5	164.6	-177	0	0	0	0	107.8	E560	V558-E560 PolarHBondContact O-N 3.05Å
559	P	42.9	Very low	48.4	Very low	105 Å²	105	130.3 Å²	130.3	68%	0.682	65%	0.649	S	S	*	*			trans	-67.5	106.7	173.3	27.8	-33	0	0	0	108.6	N557 Y561	N557-P559 VanDerWaalsContact O-CD 3.24Å; N557-P559 WeakPolarHBondContact O-CD 3.36Å; P559-Y561 PolarHBondContact O-N 3.24Å
560	E	40.4	Very low	49	Very low	131 Å²	131	131.1 Å²	131.1	61%	0.612	66%	0.658	S	S	*	*			trans	-65.3	122.7	171.6	-167.7	-178.9	-142.6	0	0	108.2	V558 K562	V558-E560 PolarHBondContact O-N 3.05Å; E560-K562 VanDerWaalsContact CD-CE 3.41Å; E560-K562 HydrophobicContact CG-CD 4.35Å; E560-K562 HydrophobicContact CG-CG 4.28Å; E560-K562 PolarHBondContact O-N 3.38Å; E560-K562 VanDerWaalsContact OE1-CE 3.3Å; E560-K562 WeakPolarHBondContact OE1-CE 3.33Å; E560-K562 IonicContact OE1-NZ 3.23Å; E560-K562 PolarHBondContact OE1-NZ 2.88Å; E560-K562 VanDerWaalsContact OE2-CD 3.3Å; E560-K562 WeakPolarHBondContact OE2-CD 3.15Å; E560-K562 VanDerWaalsContact OE2-CE 3.31Å; E560-K562 WeakPolarHBondContact OE2-CE 3.46Å; E560-K562 IonicContact OE2-NZ 2.74Å; E560-K562 PolarHBondContact OE2-NZ 2.82Å
561	Y	37.6	Very low	50	Low	203 Å²	203	134.5 Å²	134.5	80%	0.796	67%	0.669	S	S	*	*	S	Bend	trans	-76.8	38.6	-169.8	-143.8	-101	0	0	0	113.5	P559	P559-Y561 PolarHBondContact O-N 3.24Å
562	K	37.1	Very low	51.6	Low	136 Å²	136	128.2 Å²	128.2	59%	0.591	64%	0.644	S	S	*	*	S	Bend	trans	-91.5	141.1	166.8	-66.3	176.5	-167.6	147.6	0	107.9	E560 Q564	E560-K562 VanDerWaalsContact CD-CE 3.41Å; E560-K562 HydrophobicContact CG-CD 4.35Å; E560-K562 HydrophobicContact CG-CG 4.28Å; E560-K562 PolarHBondContact O-N 3.38Å; E560-K562 VanDerWaalsContact OE1-CE 3.3Å; E560-K562 WeakPolarHBondContact OE1-CE 3.33Å; E560-K562 IonicContact OE1-NZ 3.23Å; E560-K562 PolarHBondContact OE1-NZ 2.88Å; E560-K562 VanDerWaalsContact OE2-CD 3.3Å; E560-K562 WeakPolarHBondContact OE2-CD 3.15Å; E560-K562 VanDerWaalsContact OE2-CE 3.31Å; E560-K562 WeakPolarHBondContact OE2-CE 3.46Å; E560-K562 IonicContact OE2-NZ 2.74Å; E560-K562 PolarHBondContact OE2-NZ 2.82Å; K562-Q564 PolarHBondContact O-N 3.48Å
563	I	45.5	Very low	53.1	Low	170 Å²	170	125.5 Å²	125.5	87%	0.872	63%	0.629	S	S	*	*			trans	-43.6	116.1	171.3	-60.1	168.4	0	0	0	108.4	K565	I563-K565 PolarHBondContact O-N 2.97Å
564	Q	38.4	Very low	55	Low	161 Å²	161	121 Å²	121	75%	0.752	61%	0.611	S	S	*	*			trans	-69.5	93.9	-159.5	-162.8	179.5	38.6	0	0	110.3	K562 L566	K562-Q564 PolarHBondContact O-N 3.48Å; Q564-L566 PolarHBondContact O-N 3.09Å
565	K	45.7	Very low	56.5	Low	192 Å²	192	119.9 Å²	119.9	84%	0.835	60%	0.596	S	S	*	*			trans	-54.8	112.8	168.5	-73	179.7	-179.6	172	0	106.8	I563 T567	I563-K565 PolarHBondContact O-N 2.97Å; K565-T567 PolarHBondContact O-N 3.2Å
566	L	53.7	Low	58	Low	76 Å²	76	119.1 Å²	119.1	40%	0.398	58%	0.58	S	S	.	*			trans	-44	113.7	-179.1	-94.2	67.7	0	0	0	109	Q564 K568 I644	Q564-L566 PolarHBondContact O-N 3.09Å; L566-K568 VanDerWaalsContact C-N 3.32Å; L566-K568 PolarHBondContact O-N 2.91Å; L566-I644 HydrophobicContact CD2-CD1 4.41Å
567	T	54.3	Low	59.6	Low	117 Å²	117	111.5 Å²	111.5	72%	0.718	55%	0.553	S	S	*	*			trans	-66.9	95.5	179.3	46.8	0	0	0	0	107.1	K565 S569	K565-T567 PolarHBondContact O-N 3.2Å; T567-S569 PolarHBondContact O-N 2.82Å
568	K	55.5	Low	61.4	Low	172 Å²	172	113.2 Å²	113.2	75%	0.748	56%	0.562	S	S	*	*			trans	-56	112.4	-179.6	-66.7	-172.7	176.3	-170.9	0	108.8	L566	L566-K568 VanDerWaalsContact C-N 3.32Å; L566-K568 PolarHBondContact O-N 2.91Å
569	S	64.2	Low	63.5	Low	57 Å²	57	113.7 Å²	113.7	40%	0.399	56%	0.556	S	S	.	*			trans	-66.1	136.4	156.7	46.3	0	0	0	0	107.3	T567 F571 V572	T567-S569 PolarHBondContact O-N 2.82Å; S569-F571 PolarHBondContact O-N 3.12Å; S569-V572 PolarHBondContact O-N 2.69Å; S569-V572 WeakPolarHBondContact OG-CB 3.38Å; S569-V572 WeakPolarHBondContact OG-CG2 3.44Å
570	N	65.5	Low	65.5	Low	149 Å²	149	109.6 Å²	109.6	80%	0.797	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-2.3	-164.9	-70.5	-12.6	0	0	0	115.3
571	F	76.7	Confident	67.5	Low	165 Å²	165	106.9 Å²	106.9	72%	0.724	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.1	30.8	-177.3	-64.7	-79.1	0	0	0	113.1	S569 H634	S569-F571 PolarHBondContact O-N 3.12Å; F571-H634 PolarHBondContact O-CD2 3.02Å; F571-H634 VanDerWaalsContact O-CD2 3.24Å
572	V	84.1	Confident	69.9	Low	25 Å²	25	102.8 Å²	102.8	15%	0.152	51%	0.507	C	S	.	.			trans	-120.6	126.3	173.3	173.2	0	0	0	0	110.6	S569 H634 T636 I651	S569-V572 PolarHBondContact O-N 2.69Å; S569-V572 WeakPolarHBondContact OG-CB 3.38Å; S569-V572 WeakPolarHBondContact OG-CG2 3.44Å; V572-H634 CarbonylContact C-O 3.46Å; V572-H634 WeakPolarHBondContact CA-O 3.31Å; V572-T636 HydrophobicContact CG1-CG2 3.4Å; V572-I651 HydrophobicContact CG1-CD1 4.29Å
573	L	86.2	Confident	72.3	Confident	56 Å²	56	98 Å²	98	29%	0.293	49%	0.486	S	S	.	.	B	Isolated β-bridge	trans	-95	131.8	-177.7	-70.1	169.3	0	0	0	110.5	F579 L631 H634 T635 T636	L573-F579 HydrophobicContact CD1-CE1 4.4Å; L573-F579 HydrophobicContact CD2-CD1 4.26Å; L573-L631 HydrophobicContact CD1-CD2 3.6Å; L573-H634 PolarHBondContact N-O 3.31Å; L573-T635 HydrophobicContact CB-CG2 3.99Å; L573-T635 HydrophobicContact CD1-CG2 4.45Å; L573-T635 CarbonylContact O-C 3.53Å; L573-T635 WeakPolarHBondContact O-CA 3.26Å; L573-T636 PolarHBondContact O-N 3.16Å
574	L	85.2	Confident	74.1	Confident	41 Å²	41	91 Å²	91	22%	0.215	45%	0.45	C	S	.	.			trans	-77.3	131.5	173.9	-87	45	0	0	0	109.8	Y576 G577 T636	L574-Y576 HydrophobicContact CB-CD1 4.26Å; L574-Y576 HydrophobicContact CB-CE1 4.13Å; L574-Y576 HydrophobicContact CD2-CE1 4.07Å; L574-Y576 HydrophobicContact CD2-CE2 3.87Å; L574-Y576 WeakPolarHBondContact CD2-OH 3.45Å; L574-Y576 HydrophobicContact CG-CE1 3.93Å; L574-Y576 PolarHBondContact O-N 3.32Å; L574-Y576 VanDerWaalsContact O-N 3.12Å; L574-G577 PolarHBondContact O-N 3.43Å; L574-T636 HydrophobicContact CD1-CG2 4.17Å
575	H	82	Confident	76.2	Confident	59 Å²	59	88.7 Å²	88.7	27%	0.273	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-16.9	175.4	60.9	-88.7	0	0	0	114.8	T636 V638	H575-T636 WeakPolarHBondContact CB-O 3.32Å; H575-T636 PolarHBondContact N-OG1 2.67Å; H575-T636 PolarHBondContact ND1-O 2.67Å; H575-T636 VanDerWaalsContact ND1-O 3.11Å; H575-T636 PolarHBondContact ND1-OG1 3.3Å; H575-V638 WeakPolarHBondContact CE1-CG2 3.38Å; H575-V638 WeakPolarHBondContact NE2-CG2 3.36Å
576	Y	82	Confident	78.2	Confident	111 Å²	111	82.8 Å²	82.8	44%	0.435	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	11.2	172.4	61.7	-89.6	0	0	0	113	L574 I644	L574-Y576 HydrophobicContact CB-CD1 4.26Å; L574-Y576 HydrophobicContact CB-CE1 4.13Å; L574-Y576 HydrophobicContact CD2-CE1 4.07Å; L574-Y576 HydrophobicContact CD2-CE2 3.87Å; L574-Y576 WeakPolarHBondContact CD2-OH 3.45Å; L574-Y576 HydrophobicContact CG-CE1 3.93Å; L574-Y576 PolarHBondContact O-N 3.32Å; L574-Y576 VanDerWaalsContact O-N 3.12Å; Y576-I644 HydrophobicContact CE1-CD1 4.03Å
577	G	82.3	Confident	79.6	Confident	22 Å²	22	79.6 Å²	79.6	23%	0.227	40%	0.395	C	S	.	.			trans	-73.5	139.4	177	0	0	0	0	0	112	L574 F579 H580 I581	L574-G577 PolarHBondContact O-N 3.43Å; G577-F579 PolarHBondContact O-N 2.98Å; G577-F579 VanDerWaalsContact O-N 3.17Å; G577-H580 VanDerWaalsContact O-CB 3.31Å; G577-H580 WeakPolarHBondContact O-CB 3.18Å; G577-H580 PolarHBondContact O-N 3.18Å; G577-I581 PolarHBondContact O-N 3.25Å; G577-I581 VanDerWaalsContact O-N 3.14Å
578	L	86.2	Confident	80.8	Confident	129 Å²	129	74.7 Å²	74.7	68%	0.675	36%	0.364	S	S	*	.	H	α-helix	trans	-54.3	-37.9	-179	-64.8	174.2	0	0	0	113.4	I581 I582	L578-I581 PolarHBondContact O-N 3.36Å; L578-I582 VanDerWaalsContact O-CG1 3.31Å; L578-I582 WeakPolarHBondContact O-CG1 3.46Å; L578-I582 PolarHBondContact O-N 3.05Å
579	F	88.5	Confident	82.2	Confident	111 Å²	111	71.7 Å²	71.7	49%	0.487	36%	0.355	S	S	.	.	H	α-helix	trans	-60	-44.2	174.7	174.8	-99.1	0	0	0	112.3	L573 G577 I581 I582 W583 L631	L573-F579 HydrophobicContact CD1-CE1 4.4Å; L573-F579 HydrophobicContact CD2-CD1 4.26Å; G577-F579 PolarHBondContact O-N 2.98Å; G577-F579 VanDerWaalsContact O-N 3.17Å; F579-I581 VanDerWaalsContact C-N 3.34Å; F579-I581 PolarHBondContact O-N 3.11Å; F579-I582 PolarHBondContact O-N 3.14Å; F579-W583 HydrophobicContact CZ-CE3 4.14Å; F579-W583 VanDerWaalsContact O-CB 3.3Å; F579-W583 WeakPolarHBondContact O-CB 3.44Å; F579-W583 PolarHBondContact O-N 3.08Å; F579-L631 HydrophobicContact CE1-CD1 4.37Å; F579-L631 HydrophobicContact CE1-CD2 4.34Å
580	H	84	Confident	83.1	Confident	19 Å²	19	70.1 Å²	70.1	9%	0.088	34%	0.342	C	S	.	.	H	α-helix	trans	-63.1	-41.8	178.3	-168.3	-47.7	0	0	0	111.3	G577 W583 D584 T635	G577-H580 VanDerWaalsContact O-CB 3.31Å; G577-H580 WeakPolarHBondContact O-CB 3.18Å; G577-H580 PolarHBondContact O-N 3.18Å; H580-W583 PolarHBondContact O-N 3.23Å; H580-D584 IonicContact CE1-OD1 3.67Å; H580-D584 PolarHBondContact CE1-OD1 2.97Å; H580-D584 IonicContact CE1-OD2 3.08Å; H580-D584 PolarHBondContact CE1-OD2 2.86Å; H580-D584 IonicContact ND1-OD1 2.65Å; H580-D584 PolarHBondContact ND1-OD1 2.95Å; H580-D584 IonicContact ND1-OD2 2.76Å; H580-D584 PolarHBondContact ND1-OD2 2.82Å; H580-D584 WeakPolarHBondContact O-CB 3.41Å; H580-D584 PolarHBondContact O-N 3.2Å; H580-T635 VanDerWaalsContact CD2-CG2 3.43Å; H580-T635 WeakPolarHBondContact CD2-CG2 3.24Å; H580-T635 WeakPolarHBondContact NE2-CG2 3.24Å
581	I	82.5	Confident	83.9	Confident	74 Å²	74	63.2 Å²	63.2	38%	0.379	31%	0.305	S	S	.	.	H	α-helix	trans	-65	-43.3	178.3	-62.6	167.4	0	0	0	110.6	G577 L578 F579 D584 W585	G577-I581 PolarHBondContact O-N 3.25Å; G577-I581 VanDerWaalsContact O-N 3.14Å; L578-I581 PolarHBondContact O-N 3.36Å; F579-I581 VanDerWaalsContact C-N 3.34Å; F579-I581 PolarHBondContact O-N 3.11Å; I581-D584 PolarHBondContact O-N 3.24Å; I581-W585 PolarHBondContact O-N 2.63Å
582	I	87.9	Confident	84.2	Confident	117 Å²	117	57.4 Å²	57.4	60%	0.6	28%	0.28	S	S	*	.	H	α-helix	trans	-66.4	-40.6	177	-66.9	164.6	0	0	0	111	L578 F579 W585 L586	L578-I582 VanDerWaalsContact O-CG1 3.31Å; L578-I582 WeakPolarHBondContact O-CG1 3.46Å; L578-I582 PolarHBondContact O-N 3.05Å; F579-I582 PolarHBondContact O-N 3.14Å; I582-W585 PolarHBondContact O-N 3.19Å; I582-L586 PolarHBondContact O-N 2.92Å
583	W	88.6	Confident	84.3	Confident	36 Å²	36	59.3 Å²	59.3	14%	0.136	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-41.5	176	-171.9	-96.9	0	0	0	112.1	F579 H580 W585 L586 L587 F624 V627 L631	F579-W583 HydrophobicContact CZ-CE3 4.14Å; F579-W583 VanDerWaalsContact O-CB 3.3Å; F579-W583 WeakPolarHBondContact O-CB 3.44Å; F579-W583 PolarHBondContact O-N 3.08Å; H580-W583 PolarHBondContact O-N 3.23Å; W583-W585 VanDerWaalsContact C-N 3.33Å; W583-W585 PolarHBondContact O-N 3Å; W583-L586 HydrophobicContact CE3-CD2 4.38Å; W583-L586 HydrophobicContact CZ3-CD2 4.4Å; W583-L586 PolarHBondContact O-N 3.02Å; W583-L587 WeakPolarHBondContact O-CG 2.8Å; W583-L587 PolarHBondContact O-N 2.81Å; W583-F624 AromaticContact CH2-CD1 3.53Å; W583-F624 HydrophobicContact CH2-CD1 3.53Å; W583-F624 AromaticContact CH2-CE1 3.99Å; W583-F624 HydrophobicContact CH2-CE1 3.99Å; W583-F624 HydrophobicContact CZ2-CD1 4.24Å; W583-F624 AromaticContact CZ3-CD1 3.99Å; W583-F624 HydrophobicContact CZ3-CD1 3.99Å; W583-F624 HydrophobicContact CZ3-CE1 4.03Å; W583-V627 HydrophobicContact CH2-CB 4.1Å; W583-V627 HydrophobicContact CH2-CG1 3.56Å; W583-V627 HydrophobicContact CZ2-CB 4.02Å; W583-V627 HydrophobicContact CZ2-CG1 3.63Å; W583-L631 HydrophobicContact CD2-CD1 3.82Å; W583-L631 HydrophobicContact CE3-CD1 4.41Å; W583-L631 HydrophobicContact CG-CD1 4.25Å; W583-L631 HydrophobicContact CH2-CD1 4.26Å; W583-L631 HydrophobicContact CZ2-CD1 3.66Å
584	D	82.4	Confident	84.2	Confident	21 Å²	21	56.8 Å²	56.8	11%	0.112	27%	0.271	C	S	.	.	H	α-helix	trans	-59.8	-40.9	175	-71.2	-32.7	0	0	0	112.7	H580 I581 L588 K748	H580-D584 IonicContact CE1-OD1 3.67Å; H580-D584 PolarHBondContact CE1-OD1 2.97Å; H580-D584 IonicContact CE1-OD2 3.08Å; H580-D584 PolarHBondContact CE1-OD2 2.86Å; H580-D584 IonicContact ND1-OD1 2.65Å; H580-D584 PolarHBondContact ND1-OD1 2.95Å; H580-D584 IonicContact ND1-OD2 2.76Å; H580-D584 PolarHBondContact ND1-OD2 2.82Å; H580-D584 WeakPolarHBondContact O-CB 3.41Å; H580-D584 PolarHBondContact O-N 3.2Å; I581-D584 PolarHBondContact O-N 3.24Å; D584-L588 PolarHBondContact O-N 2.9Å; D584-K748 HydrophobicContact CB-CD 4.34Å; D584-K748 IonicContact OD1-NZ 3.34Å; D584-K748 PolarHBondContact OD1-NZ 3.17Å; D584-K748 WeakPolarHBondContact OD2-CD 3.44Å; D584-K748 WeakPolarHBondContact OD2-CE 3.43Å; D584-K748 IonicContact OD2-NZ 2.69Å; D584-K748 PolarHBondContact OD2-NZ 3.06Å
585	W	83.4	Confident	84.2	Confident	114 Å²	114	54.9 Å²	54.9	43%	0.432	26%	0.262	S	S	.	.	H	α-helix	trans	-69.1	-39.2	175.7	-83.4	109.1	0	0	0	112.7	I581 I582 W583 L588 I589 L752	I581-W585 PolarHBondContact O-N 2.63Å; I582-W585 PolarHBondContact O-N 3.19Å; W583-W585 VanDerWaalsContact C-N 3.33Å; W583-W585 PolarHBondContact O-N 3Å; W585-L588 HydrophobicContact CE3-CD2 3.85Å; W585-L588 HydrophobicContact CZ3-CD2 3.84Å; W585-L588 PolarHBondContact O-N 2.87Å; W585-I589 WeakPolarHBondContact O-CG1 3.18Å; W585-I589 PolarHBondContact O-N 3.02Å; W585-I589 VanDerWaalsContact O-N 3.15Å; W585-L752 HydrophobicContact CH2-CD1 4.39Å; W585-L752 HydrophobicContact CH2-CD2 3.68Å; W585-L752 HydrophobicContact CZ2-CD1 3.9Å; W585-L752 HydrophobicContact CZ2-CD2 3.86Å
586	L	86.8	Confident	84.5	Confident	67 Å²	67	56.1 Å²	56.1	35%	0.351	27%	0.267	S	S	.	.	H	α-helix	trans	-62.3	-45.8	174.2	-178.9	62.3	0	0	0	110.9	I582 W583 L588 I589 L590 F624	I582-L586 PolarHBondContact O-N 2.92Å; W583-L586 HydrophobicContact CE3-CD2 4.38Å; W583-L586 HydrophobicContact CZ3-CD2 4.4Å; W583-L586 PolarHBondContact O-N 3.02Å; L586-L588 VanDerWaalsContact C-N 3.35Å; L586-L588 PolarHBondContact O-N 3.37Å; L586-I589 PolarHBondContact O-N 3.4Å; L586-L590 HydrophobicContact CD1-CD1 4.47Å; L586-L590 HydrophobicContact CG-CD1 4.11Å; L586-L590 VanDerWaalsContact O-CG 3.3Å; L586-L590 WeakPolarHBondContact O-CG 3.15Å; L586-L590 PolarHBondContact O-N 3.3Å; L586-F624 HydrophobicContact CD2-CD1 4.11Å; L586-F624 HydrophobicContact CD2-CE1 3.68Å; L586-F624 HydrophobicContact CD2-CZ 4.4Å
587	L	83.7	Confident	84.6	Confident	9 Å²	9	52.6 Å²	52.6	5%	0.047	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-39.3	175.1	-72	176.4	0	0	0	112.6	W583 I589 L590 T591 L625 D628	W583-L587 WeakPolarHBondContact O-CG 2.8Å; W583-L587 PolarHBondContact O-N 2.81Å; L587-I589 PolarHBondContact O-N 3.25Å; L587-L590 PolarHBondContact O-N 3.1Å; L587-T591 WeakPolarHBondContact O-CG2 3.38Å; L587-T591 PolarHBondContact O-N 3.02Å; L587-T591 PolarHBondContact O-OG1 3.15Å; L587-L625 HydrophobicContact CD2-CD2 4.12Å; L587-D628 HydrophobicContact CD1-CB 3.95Å; L587-D628 VanDerWaalsContact CD1-OD1 3.31Å; L587-D628 WeakPolarHBondContact CD1-OD1 3.27Å; L587-D628 HydrophobicContact CD2-CB 4.11Å
588	L	79.5	Confident	84.6	Confident	14 Å²	14	51.8 Å²	51.8	7%	0.073	25%	0.245	C	C	.	.	H	α-helix	trans	-58.5	-48.5	175.9	-178.4	65.3	0	0	0	111.1	D584 W585 L586 L590 T591 F592 L742 L745	D584-L588 PolarHBondContact O-N 2.9Å; W585-L588 HydrophobicContact CE3-CD2 3.85Å; W585-L588 HydrophobicContact CZ3-CD2 3.84Å; W585-L588 PolarHBondContact O-N 2.87Å; L586-L588 VanDerWaalsContact C-N 3.35Å; L586-L588 PolarHBondContact O-N 3.37Å; L588-L590 PolarHBondContact O-N 2.9Å; L588-T591 WeakPolarHBondContact CA-OG1 3.4Å; L588-T591 PolarHBondContact O-N 3.37Å; L588-T591 PolarHBondContact O-OG1 3.46Å; L588-F592 HydrophobicContact CD1-CD2 4.38Å; L588-F592 HydrophobicContact CD1-CE1 4.13Å; L588-F592 HydrophobicContact CD1-CE2 3.72Å; L588-F592 HydrophobicContact CD1-CZ 3.58Å; L588-F592 HydrophobicContact CD2-CE2 4.1Å; L588-F592 HydrophobicContact CG-CD2 4.14Å; L588-F592 HydrophobicContact CG-CE2 3.64Å; L588-F592 HydrophobicContact CG-CZ 4.06Å; L588-F592 WeakPolarHBondContact O-CG 3.25Å; L588-F592 PolarHBondContact O-N 2.95Å; L588-L742 HydrophobicContact CD1-CD1 3.91Å; L588-L745 HydrophobicContact CB-CD1 3.93Å; L588-L745 HydrophobicContact CD1-CD1 3.61Å; L588-L745 HydrophobicContact CG-CD1 4.36Å
589	I	83.6	Confident	84.6	Confident	109 Å²	109	46 Å²	46	56%	0.559	22%	0.215	S	C	*	.	H	α-helix	trans	-60.8	-44.1	177.2	-65.4	165.6	0	0	0	110.8	W585 L586 L587 T591 F592 Y593	W585-I589 WeakPolarHBondContact O-CG1 3.18Å; W585-I589 PolarHBondContact O-N 3.02Å; W585-I589 VanDerWaalsContact O-N 3.15Å; L586-I589 PolarHBondContact O-N 3.4Å; L587-I589 PolarHBondContact O-N 3.25Å; I589-T591 PolarHBondContact O-N 2.92Å; I589-F592 PolarHBondContact O-N 3.1Å; I589-Y593 PolarHBondContact O-N 2.85Å
590	L	84.7	Confident	84.5	Confident	25 Å²	25	43.9 Å²	43.9	13%	0.131	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-37.3	176.5	-66	167.6	0	0	0	112.2	L586 L587 L588 F592 Y593 I594 V621 F624	L586-L590 HydrophobicContact CD1-CD1 4.47Å; L586-L590 HydrophobicContact CG-CD1 4.11Å; L586-L590 VanDerWaalsContact O-CG 3.3Å; L586-L590 WeakPolarHBondContact O-CG 3.15Å; L586-L590 PolarHBondContact O-N 3.3Å; L587-L590 PolarHBondContact O-N 3.1Å; L588-L590 PolarHBondContact O-N 2.9Å; L590-F592 VanDerWaalsContact C-N 3.35Å; L590-Y593 PolarHBondContact O-N 3.03Å; L590-I594 VanDerWaalsContact O-CG1 3.31Å; L590-I594 WeakPolarHBondContact O-CG1 3.36Å; L590-I594 PolarHBondContact O-N 3.01Å; L590-I594 VanDerWaalsContact O-N 3.13Å; L590-V621 HydrophobicContact CD2-CG2 4.02Å; L590-F624 HydrophobicContact CD1-CB 3.73Å; L590-F624 HydrophobicContact CD1-CD1 4.23Å; L590-F624 HydrophobicContact CD1-CD2 4.11Å; L590-F624 HydrophobicContact CD1-CG 3.77Å
591	T	81.4	Confident	84.3	Confident	4 Å²	4	43.8 Å²	43.8	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-67.5	-33.3	174.2	52.2	0	0	0	0	113.1	L587 L588 I589 I594 A595 R741	L587-T591 WeakPolarHBondContact O-CG2 3.38Å; L587-T591 PolarHBondContact O-N 3.02Å; L587-T591 PolarHBondContact O-OG1 3.15Å; L588-T591 WeakPolarHBondContact CA-OG1 3.4Å; L588-T591 PolarHBondContact O-N 3.37Å; L588-T591 PolarHBondContact O-OG1 3.46Å; I589-T591 PolarHBondContact O-N 2.92Å; T591-I594 PolarHBondContact O-N 3.25Å; T591-A595 PolarHBondContact O-N 2.99Å; T591-A595 VanDerWaalsContact O-N 3.08Å; T591-R741 HydrophobicContact CG2-CB 4.2Å
592	F	82.3	Confident	84	Confident	43 Å²	43	41.3 Å²	41.3	19%	0.189	19%	0.193	C	C	.	.	H	α-helix	trans	-71.9	-34.7	174.2	-69.5	-29.1	0	0	0	112.9	L588 I589 L590 A595 F596 L742 L762 F765	L588-F592 HydrophobicContact CD1-CD2 4.38Å; L588-F592 HydrophobicContact CD1-CE1 4.13Å; L588-F592 HydrophobicContact CD1-CE2 3.72Å; L588-F592 HydrophobicContact CD1-CZ 3.58Å; L588-F592 HydrophobicContact CD2-CE2 4.1Å; L588-F592 HydrophobicContact CG-CD2 4.14Å; L588-F592 HydrophobicContact CG-CE2 3.64Å; L588-F592 HydrophobicContact CG-CZ 4.06Å; L588-F592 WeakPolarHBondContact O-CG 3.25Å; L588-F592 PolarHBondContact O-N 2.95Å; I589-F592 PolarHBondContact O-N 3.1Å; L590-F592 VanDerWaalsContact C-N 3.35Å; F592-A595 PolarHBondContact O-N 2.6Å; F592-F596 PolarHBondContact O-N 3.33Å; F592-L742 HydrophobicContact CE1-CD1 4.24Å; F592-L762 HydrophobicContact CZ-CD2 4.14Å; F592-F765 HydrophobicContact CB-CE1 4.14Å; F592-F765 HydrophobicContact CB-CE2 4.18Å; F592-F765 HydrophobicContact CB-CZ 3.58Å; F592-F765 AromaticContact CD1-CD1 3.93Å; F592-F765 HydrophobicContact CD1-CD1 3.93Å; F592-F765 AromaticContact CD1-CE1 3.2Å; F592-F765 HydrophobicContact CD1-CE1 3.2Å; F592-F765 AromaticContact CD1-CZ 3.61Å; F592-F765 HydrophobicContact CD1-CZ 3.61Å; F592-F765 HydrophobicContact CD2-CE1 4.22Å; F592-F765 HydrophobicContact CD2-CE2 4.42Å; F592-F765 HydrophobicContact CD2-CZ 4.17Å; F592-F765 AromaticContact CE1-CD1 3.72Å; F592-F765 HydrophobicContact CE1-CD1 3.72Å; F592-F765 AromaticContact CE1-CE1 3.46Å; F592-F765 HydrophobicContact CE1-CE1 3.46Å; F592-F765 VanDerWaalsContact CE1-CE1 3.46Å; F592-F765 HydrophobicContact CE1-CZ 4.26Å; F592-F765 HydrophobicContact CE2-CD1 4.36Å; F592-F765 HydrophobicContact CE2-CE1 4.42Å; F592-F765 HydrophobicContact CG-CD1 4.34Å; F592-F765 AromaticContact CG-CE1 3.62Å; F592-F765 HydrophobicContact CG-CE1 3.62Å; F592-F765 HydrophobicContact CG-CE2 4.18Å; F592-F765 AromaticContact CG-CZ 3.54Å; F592-F765 HydrophobicContact CG-CZ 3.54Å; F592-F765 AromaticContact CZ-CD1 3.94Å; F592-F765 HydrophobicContact CZ-CD1 3.94Å; F592-F765 HydrophobicContact CZ-CE1 4.07Å
593	Y	86.4	Confident	83.6	Confident	65 Å²	65	36.9 Å²	36.9	26%	0.255	17%	0.172	S	C	.	.	H	α-helix	trans	-58.3	-50	169.4	174.3	-93.1	0	0	0	111.2	I589 L590 A595 F596 I597 I617 V621	I589-Y593 PolarHBondContact O-N 2.85Å; L590-Y593 PolarHBondContact O-N 3.03Å; Y593-A595 VanDerWaalsContact C-N 3.28Å; Y593-A595 PolarHBondContact O-N 2.93Å; Y593-F596 PolarHBondContact O-N 3.45Å; Y593-I597 HydrophobicContact CD2-CG1 3.95Å; Y593-I597 HydrophobicContact CE1-CB 4.3Å; Y593-I597 HydrophobicContact CE1-CG1 4.22Å; Y593-I597 HydrophobicContact CE1-CG2 4.39Å; Y593-I597 HydrophobicContact CE2-CD1 4.43Å; Y593-I597 HydrophobicContact CE2-CG1 3.6Å; Y593-I597 HydrophobicContact CG-CG1 4.4Å; Y593-I597 PolarHBondContact O-N 3.45Å; Y593-I617 HydrophobicContact CE1-CG2 3.77Å; Y593-I617 HydrophobicContact CE2-CG2 4.11Å; Y593-I617 VanDerWaalsContact CZ-CG2 3.46Å; Y593-I617 VanDerWaalsContact OH-CG2 3.29Å; Y593-I617 WeakPolarHBondContact OH-CG2 3.27Å; Y593-V621 HydrophobicContact CD1-CG2 3.99Å; Y593-V621 HydrophobicContact CE1-CG2 4.14Å
594	I	84.3	Confident	83.2	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-58.8	-40.7	178	-62.2	161.5	0	0	0	111.3	L590 T591 F596 V598 V621 L625 R738	L590-I594 VanDerWaalsContact O-CG1 3.31Å; L590-I594 WeakPolarHBondContact O-CG1 3.36Å; L590-I594 PolarHBondContact O-N 3.01Å; L590-I594 VanDerWaalsContact O-N 3.13Å; T591-I594 PolarHBondContact O-N 3.25Å; I594-F596 PolarHBondContact O-N 3.25Å; I594-V598 HydrophobicContact CG2-CG2 3.74Å; I594-V598 WeakPolarHBondContact O-CB 3.41Å; I594-V598 WeakPolarHBondContact O-CG2 3.31Å; I594-V598 PolarHBondContact O-N 3.47Å; I594-V598 VanDerWaalsContact O-N 3.13Å; I594-V621 HydrophobicContact CD1-CG1 3.57Å; I594-V621 HydrophobicContact CG1-CG1 3.76Å; I594-L625 HydrophobicContact CD1-CD1 3.98Å; I594-R738 HydrophobicContact CD1-CB 4.15Å; I594-R738 HydrophobicContact CG2-CB 4.14Å
595	A	85	Confident	82.7	Confident	2 Å²	2	37.1 Å²	37.1	2%	0.017	17%	0.173	C	C	.	.	H	α-helix	trans	-62.4	-23.6	-177.8	0	0	0	0	0	114.5	T591 F592 Y593 P599 L739 L769 W773	T591-A595 PolarHBondContact O-N 2.99Å; T591-A595 VanDerWaalsContact O-N 3.08Å; F592-A595 PolarHBondContact O-N 2.6Å; Y593-A595 VanDerWaalsContact C-N 3.28Å; Y593-A595 PolarHBondContact O-N 2.93Å; A595-P599 WeakPolarHBondContact O-CD 3.36Å; A595-P599 WeakPolarHBondContact O-CG 3.25Å; A595-L739 HydrophobicContact CB-CD1 4.38Å; A595-L739 HydrophobicContact CB-CD2 3.62Å; A595-L769 HydrophobicContact CB-CD1 3.66Å; A595-W773 PolarHBondContact O-NE1 3.18Å
596	F	88.1	Confident	81.5	Confident	84 Å²	84	35.3 Å²	35.3	37%	0.368	18%	0.178	S	C	.	.	H	α-helix	trans	-105.6	-36.9	-176.9	-164.5	-83.8	0	0	0	112.2	F592 Y593 I594 Y600 H772 Y819	F592-F596 PolarHBondContact O-N 3.33Å; Y593-F596 PolarHBondContact O-N 3.45Å; I594-F596 PolarHBondContact O-N 3.25Å; F596-Y600 WeakPolarHBondContact O-CB 3.41Å; F596-H772 HydrophobicContact CD2-CB 4.13Å; F596-H772 AromaticContact CD2-CD2 3.83Å; F596-H772 AromaticContact CD2-CG 3.69Å; F596-H772 HydrophobicContact CE2-CB 3.89Å; F596-H772 AromaticContact CE2-CG 3.63Å; F596-H772 AromaticContact CE2-ND1 3.7Å; F596-H772 AromaticContact CZ-ND1 3.78Å; F596-H772 PolarHBondContact O-CE1 2.96Å; F596-H772 PolarHBondContact O-NE2 2.92Å; F596-Y819 VanDerWaalsContact CZ-OH 3.31Å; F596-Y819 WeakPolarHBondContact CZ-OH 3.19Å
597	I	85.6	Confident	80	Confident	37 Å²	37	35.9 Å²	35.9	19%	0.19	18%	0.179	C	C	.	.	H	α-helix	trans	-81.6	-34.1	-177.2	-64.7	-59.8	0	0	0	112.5	Y593 Y600 N601	Y593-I597 HydrophobicContact CD2-CG1 3.95Å; Y593-I597 HydrophobicContact CE1-CB 4.3Å; Y593-I597 HydrophobicContact CE1-CG1 4.22Å; Y593-I597 HydrophobicContact CE1-CG2 4.39Å; Y593-I597 HydrophobicContact CE2-CD1 4.43Å; Y593-I597 HydrophobicContact CE2-CG1 3.6Å; Y593-I597 HydrophobicContact CG-CG1 4.4Å; Y593-I597 PolarHBondContact O-N 3.45Å; I597-Y600 PolarHBondContact O-N 2.78Å; I597-N601 WeakPolarHBondContact CG2-ND2 3.31Å; I597-N601 WeakPolarHBondContact CG2-OD1 3.18Å; I597-N601 WeakPolarHBondContact O-CB 3.42Å; I597-N601 PolarHBondContact O-N 3.19Å; I597-N601 PolarHBondContact O-OD1 3.44Å; I597-N601 VanDerWaalsContact O-OD1 3.06Å
598	V	81.5	Confident	78.5	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.03	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-48.8	179.8	171	0	0	0	0	113.3	I594 Y600 V602 K735 L736	I594-V598 HydrophobicContact CG2-CG2 3.74Å; I594-V598 WeakPolarHBondContact O-CB 3.41Å; I594-V598 WeakPolarHBondContact O-CG2 3.31Å; I594-V598 PolarHBondContact O-N 3.47Å; I594-V598 VanDerWaalsContact O-N 3.13Å; V598-Y600 VanDerWaalsContact C-N 3.33Å; V598-Y600 PolarHBondContact O-N 3.47Å; V598-V602 WeakPolarHBondContact O-CB 3.42Å; V598-V602 VanDerWaalsContact O-CG2 3.29Å; V598-V602 WeakPolarHBondContact O-CG2 3.23Å; V598-V602 PolarHBondContact O-N 3.5Å; V598-V602 VanDerWaalsContact O-N 3.15Å; V598-K735 HydrophobicContact CB-CB 4.48Å; V598-K735 HydrophobicContact CG1-CB 3.83Å; V598-K735 HydrophobicContact CG2-CB 3.77Å; V598-K735 HydrophobicContact CG2-CD 3.94Å; V598-L736 HydrophobicContact CB-CD2 3.84Å; V598-L736 HydrophobicContact CG1-CD2 3.6Å; V598-L736 HydrophobicContact CG1-CG 3.83Å
599	P	85.6	Confident	77.2	Confident	7 Å²	7	44.4 Å²	44.4	5%	0.045	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-40	177.3	-18.9	32	0	0	0	112	A595 V602 T603 L736 C776	A595-P599 WeakPolarHBondContact O-CD 3.36Å; A595-P599 WeakPolarHBondContact O-CG 3.25Å; P599-V602 PolarHBondContact O-N 3.26Å; P599-T603 WeakPolarHBondContact O-CG2 3.25Å; P599-T603 PolarHBondContact O-N 2.66Å; P599-T603 VanDerWaalsContact O-N 3.15Å; P599-T603 PolarHBondContact O-OG1 3.03Å; P599-L736 HydrophobicContact CG-CD2 4.11Å; P599-C776 HydrophobicContact CB-CB 4.23Å
600	Y	87	Confident	75.8	Confident	68 Å²	68	40.8 Å²	40.8	27%	0.267	22%	0.217	S	C	.	.	H	α-helix	trans	-59.1	-54.6	177.6	-177.5	-104	0	0	0	112	F596 I597 V598 V602 T603 F604 Y819	F596-Y600 WeakPolarHBondContact O-CB 3.41Å; I597-Y600 PolarHBondContact O-N 2.78Å; V598-Y600 VanDerWaalsContact C-N 3.33Å; V598-Y600 PolarHBondContact O-N 3.47Å; Y600-V602 VanDerWaalsContact C-N 3.33Å; Y600-V602 PolarHBondContact O-N 3.03Å; Y600-T603 PolarHBondContact O-N 3.47Å; Y600-T603 PolarHBondContact O-OG1 3.32Å; Y600-F604 HydrophobicContact CD2-CB 4.26Å; Y600-F604 AromaticContact CD2-CD2 3.63Å; Y600-F604 HydrophobicContact CD2-CD2 3.63Å; Y600-F604 HydrophobicContact CD2-CE2 4.33Å; Y600-F604 HydrophobicContact CD2-CG 4.15Å; Y600-F604 HydrophobicContact CE2-CB 3.9Å; Y600-F604 AromaticContact CE2-CD2 3.86Å; Y600-F604 HydrophobicContact CE2-CD2 3.86Å; Y600-F604 AromaticContact CE2-CG 3.92Å; Y600-F604 HydrophobicContact CE2-CG 3.92Å; Y600-F604 HydrophobicContact CG-CD2 4.48Å; Y600-F604 PolarHBondContact O-N 3.23Å; Y600-Y819 AromaticContact CD2-CD2 3.95Å; Y600-Y819 HydrophobicContact CD2-CD2 3.95Å; Y600-Y819 HydrophobicContact CD2-CE2 4.1Å; Y600-Y819 HydrophobicContact CD2-CG 4.46Å; Y600-Y819 AromaticContact CE2-CD2 3.98Å; Y600-Y819 HydrophobicContact CE2-CD2 3.98Å; Y600-Y819 HydrophobicContact CE2-CE2 4.48Å; Y600-Y819 HydrophobicContact CE2-CG 4.04Å
601	N	80.2	Confident	74.7	Confident	17 Å²	17	42.4 Å²	42.4	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-40.7	-178.1	-61.8	6.2	0	0	0	111.4	I597 T603 E605 H610	I597-N601 WeakPolarHBondContact CG2-ND2 3.31Å; I597-N601 WeakPolarHBondContact CG2-OD1 3.18Å; I597-N601 WeakPolarHBondContact O-CB 3.42Å; I597-N601 PolarHBondContact O-N 3.19Å; I597-N601 PolarHBondContact O-OD1 3.44Å; I597-N601 VanDerWaalsContact O-OD1 3.06Å; N601-T603 VanDerWaalsContact C-N 3.28Å; N601-T603 PolarHBondContact O-N 2.97Å; N601-E605 WeakPolarHBondContact O-CB 3.45Å; N601-E605 PolarHBondContact O-N 3.01Å; N601-H610 PolarHBondContact ND2-CE1 2.82Å
602	V	76.4	Confident	73.7	Confident	22 Å²	22	44.5 Å²	44.5	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-65.7	-28.6	179.5	169.3	0	0	0	0	112.9	V598 P599 Y600 Q732 M733	V598-V602 WeakPolarHBondContact O-CB 3.42Å; V598-V602 VanDerWaalsContact O-CG2 3.29Å; V598-V602 WeakPolarHBondContact O-CG2 3.23Å; V598-V602 PolarHBondContact O-N 3.5Å; V598-V602 VanDerWaalsContact O-N 3.15Å; P599-V602 PolarHBondContact O-N 3.26Å; Y600-V602 VanDerWaalsContact C-N 3.33Å; Y600-V602 PolarHBondContact O-N 3.03Å; V602-Q732 HydrophobicContact CG2-CB 3.67Å; V602-M733 HydrophobicContact CB-CE 4.3Å; V602-M733 HydrophobicContact CG1-CE 4.03Å; V602-M733 HydrophobicContact CG1-CG 4.02Å; V602-M733 HydrophobicContact CG1-SD 4.13Å; V602-M733 HydrophobicContact CG2-CE 4.36Å
603	T	80.1	Confident	73	Confident	23 Å²	23	52.2 Å²	52.2	14%	0.141	28%	0.281	C	S	.	.	H	α-helix	trans	-105.5	-32.6	-172.9	55.1	0	0	0	0	114.6	P599 Y600 N601 C776 Y779 V780	P599-T603 WeakPolarHBondContact O-CG2 3.25Å; P599-T603 PolarHBondContact O-N 2.66Å; P599-T603 VanDerWaalsContact O-N 3.15Å; P599-T603 PolarHBondContact O-OG1 3.03Å; Y600-T603 PolarHBondContact O-N 3.47Å; Y600-T603 PolarHBondContact O-OG1 3.32Å; N601-T603 VanDerWaalsContact C-N 3.28Å; N601-T603 PolarHBondContact O-N 2.97Å; T603-C776 HydrophobicContact CG2-CB 4.07Å; T603-Y779 VanDerWaalsContact O-CE1 3.25Å; T603-Y779 WeakPolarHBondContact O-CE1 3.5Å; T603-V780 HydrophobicContact CG2-CG2 3.51Å
604	F	80.2	Confident	72.3	Confident	16 Å²	16	51.1 Å²	51.1	7%	0.07	28%	0.282	C	S	.	.	H	α-helix	trans	-110.9	-18.4	-176.3	-64.8	-88	0	0	0	114.5	Y600 Y779 K818 Y819	Y600-F604 HydrophobicContact CD2-CB 4.26Å; Y600-F604 AromaticContact CD2-CD2 3.63Å; Y600-F604 HydrophobicContact CD2-CD2 3.63Å; Y600-F604 HydrophobicContact CD2-CE2 4.33Å; Y600-F604 HydrophobicContact CD2-CG 4.15Å; Y600-F604 HydrophobicContact CE2-CB 3.9Å; Y600-F604 AromaticContact CE2-CD2 3.86Å; Y600-F604 HydrophobicContact CE2-CD2 3.86Å; Y600-F604 AromaticContact CE2-CG 3.92Å; Y600-F604 HydrophobicContact CE2-CG 3.92Å; Y600-F604 HydrophobicContact CG-CD2 4.48Å; Y600-F604 PolarHBondContact O-N 3.23Å; F604-Y779 AromaticContact CD1-CD1 3.56Å; F604-Y779 HydrophobicContact CD1-CD1 3.56Å; F604-Y779 AromaticContact CD1-CE1 3.53Å; F604-Y779 HydrophobicContact CD1-CE1 3.53Å; F604-Y779 HydrophobicContact CD1-CG 4.21Å; F604-Y779 HydrophobicContact CD2-CD1 4.34Å; F604-Y779 AromaticContact CE1-CD1 3.24Å; F604-Y779 HydrophobicContact CE1-CD1 3.24Å; F604-Y779 AromaticContact CE1-CD2 3.99Å; F604-Y779 HydrophobicContact CE1-CD2 3.99Å; F604-Y779 AromaticContact CE1-CE1 3.64Å; F604-Y779 HydrophobicContact CE1-CE1 3.64Å; F604-Y779 HydrophobicContact CE1-CE2 4.34Å; F604-Y779 AromaticContact CE1-CG 3.44Å; F604-Y779 HydrophobicContact CE1-CG 3.44Å; F604-Y779 VanDerWaalsContact CE1-CG 3.44Å; F604-Y779 HydrophobicContact CE2-CD1 4.07Å; F604-Y779 HydrophobicContact CE2-CG 4.47Å; F604-Y779 HydrophobicContact CG-CD1 4.1Å; F604-Y779 HydrophobicContact CG-CE1 4.18Å; F604-Y779 AromaticContact CZ-CD1 3.52Å; F604-Y779 HydrophobicContact CZ-CD1 3.52Å; F604-Y779 HydrophobicContact CZ-CD2 4.46Å; F604-Y779 HydrophobicContact CZ-CE1 4.34Å; F604-Y779 AromaticContact CZ-CG 3.59Å; F604-Y779 HydrophobicContact CZ-CG 3.59Å; F604-K818 HydrophobicContact CE1-CB 4.2Å; F604-Y819 HydrophobicContact CD2-CD2 4.21Å; F604-Y819 HydrophobicContact CE1-CD2 4.35Å; F604-Y819 AromaticContact CE2-CD2 3.65Å; F604-Y819 HydrophobicContact CE2-CD2 3.65Å; F604-Y819 HydrophobicContact CE2-CE2 4.41Å; F604-Y819 AromaticContact CZ-CD2 3.73Å; F604-Y819 HydrophobicContact CZ-CD2 3.73Å; F604-Y819 HydrophobicContact CZ-CG 4.4Å
605	E	71.3	Confident	71.6	Confident	46 Å²	46	57.3 Å²	57.3	22%	0.215	31%	0.305	C	S	.	.	S	Bend	trans	-105.7	108.8	-174.4	-161.5	173.8	-172.5	0	0	111.5	N601 H610	N601-E605 WeakPolarHBondContact O-CB 3.45Å; N601-E605 PolarHBondContact O-N 3.01Å; E605-H610 VanDerWaalsContact OE1-CA 3.31Å; E605-H610 WeakPolarHBondContact OE1-CA 3.35Å; E605-H610 IonicContact OE1-CE1 3.18Å; E605-H610 IonicContact OE1-CG 3.78Å; E605-H610 IonicContact OE1-ND1 2.79Å; E605-H610 PolarHBondContact OE1-ND1 2.83Å; E605-H610 IonicContact OE2-CE1 2.65Å; E605-H610 PolarHBondContact OE2-CE1 3.2Å; E605-H610 IonicContact OE2-ND1 2.73Å; E605-H610 PolarHBondContact OE2-ND1 3.41Å
606	S	57.7	Low	71.4	Confident	77 Å²	77	62 Å²	62	54%	0.538	33%	0.329	S	S	.	.			trans	-64.6	137.5	175.5	-171.9	0	0	0	0	111	S608 T609	S606-S608 PolarHBondContact O-N 2.85Å; S606-T609 PolarHBondContact O-N 3.12Å; S606-T609 PolarHBondContact O-OG1 2.8Å
607	H	56	Low	71.1	Confident	79 Å²	79	61.5 Å²	61.5	37%	0.366	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-23.3	-172.5	-70.7	-74.3	0	0	0	114.7	I728 S729 Q732	H607-I728 WeakPolarHBondContact CE1-CG2 3.48Å; H607-S729 PolarHBondContact NE2-OG 2.76Å; H607-Q732 PolarHBondContact CE1-NE2 3.15Å; H607-Q732 PolarHBondContact CE1-OE1 3.41Å
608	S	51.8	Low	70.7	Confident	104 Å²	104	60 Å²	60	73%	0.727	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-27.3	-180	54.7	0	0	0	0	114.9	S606	S606-S608 PolarHBondContact O-N 2.85Å
609	T	51.6	Low	70.6	Confident	97 Å²	97	63 Å²	63	60%	0.595	34%	0.337	S	S	*	.			trans	-103.8	9.8	-170.1	52.5	0	0	0	0	114.4	S606 S611	S606-T609 PolarHBondContact O-N 3.12Å; S606-T609 PolarHBondContact O-OG1 2.8Å; T609-S611 PolarHBondContact O-N 2.84Å
610	H	55.7	Low	70.6	Confident	33 Å²	33	66.9 Å²	66.9	15%	0.153	36%	0.357	C	S	.	.			trans	-65.4	101.3	-168.7	-158	23.9	0	0	0	112.8	N601 E605 G612	N601-H610 PolarHBondContact ND2-CE1 2.82Å; E605-H610 VanDerWaalsContact OE1-CA 3.31Å; E605-H610 WeakPolarHBondContact OE1-CA 3.35Å; E605-H610 IonicContact OE1-CE1 3.18Å; E605-H610 IonicContact OE1-CG 3.78Å; E605-H610 IonicContact OE1-ND1 2.79Å; E605-H610 PolarHBondContact OE1-ND1 2.83Å; E605-H610 IonicContact OE2-CE1 2.65Å; E605-H610 PolarHBondContact OE2-CE1 3.2Å; E605-H610 IonicContact OE2-ND1 2.73Å; E605-H610 PolarHBondContact OE2-ND1 3.41Å; H610-G612 PolarHBondContact O-N 2.86Å
611	S	59.9	Low	70.5	Confident	60 Å²	60	63.7 Å²	63.7	42%	0.42	35%	0.345	S	S	.	.			trans	-59.8	133.5	-168.2	-170.3	0	0	0	0	111.3	T609 R613 C614 R615	T609-S611 PolarHBondContact O-N 2.84Å; S611-R613 PolarHBondContact O-N 3.49Å; S611-C614 WeakPolarHBondContact O-CB 3.46Å; S611-C614 PolarHBondContact O-N 3.15Å; S611-R615 PolarHBondContact O-N 2.94Å
612	G	62.2	Low	70.6	Confident	47 Å²	47	63.4 Å²	63.4	49%	0.485	34%	0.343	S	S	.	.	H	α-helix	trans	-55.3	-25.2	-176.7	0	0	0	0	0	114.1	H610 I616	H610-G612 PolarHBondContact O-N 2.86Å; G612-I616 WeakPolarHBondContact O-CD1 3.49Å; G612-I616 VanDerWaalsContact O-CG1 3.28Å; G612-I616 WeakPolarHBondContact O-CG1 3.44Å; G612-I616 PolarHBondContact O-N 3Å
613	R	67.6	Low	71.1	Confident	206 Å²	206	66.4 Å²	66.4	78%	0.777	36%	0.357	S	S	*	.	H	α-helix	trans	-64.4	-41.2	173.5	-65.5	178.1	-179.9	159.3	0.6	112.7	S611 I616 I617	S611-R613 PolarHBondContact O-N 3.49Å; R613-I616 PolarHBondContact O-N 2.94Å; R613-I617 WeakPolarHBondContact O-CG1 3.29Å; R613-I617 PolarHBondContact O-N 2.85Å
614	C	70.4	Confident	71.5	Confident	41 Å²	41	68.6 Å²	68.6	28%	0.277	37%	0.365	S	S	.	.	H	α-helix	trans	-66.1	-46.3	178.3	-59.4	0	0	0	0	110.8	S611 I616 I617 D618	S611-C614 WeakPolarHBondContact O-CB 3.46Å; S611-C614 PolarHBondContact O-N 3.15Å; C614-I616 VanDerWaalsContact C-N 3.26Å; C614-I616 PolarHBondContact O-N 2.98Å; C614-I617 PolarHBondContact O-N 3.29Å; C614-D618 PolarHBondContact O-N 3.35Å
615	R	70.7	Confident	71.6	Confident	132 Å²	132	67.9 Å²	67.9	50%	0.498	36%	0.362	S	S	.	.	H	α-helix	trans	-59.1	-33.8	176.9	-64.8	-176.1	179.7	178.1	-0.7	113	S611 L619	S611-R615 PolarHBondContact O-N 2.94Å; R615-L619 VanDerWaalsContact O-CB 3.27Å; R615-L619 WeakPolarHBondContact O-CB 3.49Å; R615-L619 PolarHBondContact O-N 3.39Å
616	I	79.1	Confident	72.3	Confident	101 Å²	101	69.3 Å²	69.3	52%	0.518	37%	0.37	S	S	.	.	H	α-helix	trans	-67	-38	174.3	-70.3	163	0	0	0	111.7	G612 R613 C614 L620	G612-I616 WeakPolarHBondContact O-CD1 3.49Å; G612-I616 VanDerWaalsContact O-CG1 3.28Å; G612-I616 WeakPolarHBondContact O-CG1 3.44Å; G612-I616 PolarHBondContact O-N 3Å; R613-I616 PolarHBondContact O-N 2.94Å; C614-I616 VanDerWaalsContact C-N 3.26Å; C614-I616 PolarHBondContact O-N 2.98Å; I616-L620 HydrophobicContact CG2-CD1 4.27Å; I616-L620 WeakPolarHBondContact O-CG 3.41Å; I616-L620 PolarHBondContact O-N 2.94Å
617	I	82.2	Confident	73.9	Confident	74 Å²	74	68.2 Å²	68.2	38%	0.379	36%	0.36	S	S	.	.	H	α-helix	trans	-71.5	-44.4	178.9	-58.4	167.5	0	0	0	110.3	Y593 R613 C614 L619 L620 V621	Y593-I617 HydrophobicContact CE1-CG2 3.77Å; Y593-I617 HydrophobicContact CE2-CG2 4.11Å; Y593-I617 VanDerWaalsContact CZ-CG2 3.46Å; Y593-I617 VanDerWaalsContact OH-CG2 3.29Å; Y593-I617 WeakPolarHBondContact OH-CG2 3.27Å; R613-I617 WeakPolarHBondContact O-CG1 3.29Å; R613-I617 PolarHBondContact O-N 2.85Å; C614-I617 PolarHBondContact O-N 3.29Å; I617-L619 VanDerWaalsContact C-N 3.31Å; I617-L619 PolarHBondContact O-N 3.44Å; I617-L620 PolarHBondContact O-N 3.28Å; I617-V621 HydrophobicContact CG2-CG2 4.45Å; I617-V621 VanDerWaalsContact O-CG2 3.28Å; I617-V621 WeakPolarHBondContact O-CG2 3.29Å; I617-V621 PolarHBondContact O-N 2.92Å
618	D	78	Confident	75.4	Confident	5 Å²	5	64.5 Å²	64.5	3%	0.027	34%	0.343	C	S	.	.	H	α-helix	trans	-59	-41.4	174.3	-97	18	0	0	0	111.7	C614 V621 E622 K735	C614-D618 PolarHBondContact O-N 3.35Å; D618-V621 WeakPolarHBondContact O-CB 3.27Å; D618-V621 PolarHBondContact O-N 3.32Å; D618-E622 WeakPolarHBondContact O-CG 3.3Å; D618-E622 PolarHBondContact O-N 3.34Å; D618-K735 IonicContact OD2-NZ 2.75Å; D618-K735 PolarHBondContact OD2-NZ 2.99Å
619	L	80.1	Confident	77.1	Confident	69 Å²	69	60.5 Å²	60.5	36%	0.361	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-45.1	173.3	174.6	63.7	0	0	0	112.7	R615 I617 V621 E622 I623 F672	R615-L619 VanDerWaalsContact O-CB 3.27Å; R615-L619 WeakPolarHBondContact O-CB 3.49Å; R615-L619 PolarHBondContact O-N 3.39Å; I617-L619 VanDerWaalsContact C-N 3.31Å; I617-L619 PolarHBondContact O-N 3.44Å; L619-V621 VanDerWaalsContact C-N 3.34Å; L619-E622 PolarHBondContact O-N 3.28Å; L619-I623 HydrophobicContact CD1-CD1 4.3Å; L619-I623 HydrophobicContact CG-CD1 4.21Å; L619-I623 WeakPolarHBondContact O-CG1 3.45Å; L619-I623 PolarHBondContact O-N 2.93Å; L619-F672 HydrophobicContact CD1-CE2 3.51Å; L619-F672 HydrophobicContact CD1-CZ 3.67Å
620	L	84.9	Confident	79	Confident	87 Å²	87	60.3 Å²	60.3	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-43.2	176.4	-74.9	170.5	0	0	0	111.1	I616 I617 E622 I623 F624	I616-L620 HydrophobicContact CG2-CD1 4.27Å; I616-L620 WeakPolarHBondContact O-CG 3.41Å; I616-L620 PolarHBondContact O-N 2.94Å; I617-L620 PolarHBondContact O-N 3.28Å; L620-E622 VanDerWaalsContact C-N 3.35Å; L620-E622 PolarHBondContact O-N 3.07Å; L620-I623 PolarHBondContact O-N 2.8Å; L620-F624 VanDerWaalsContact O-CD2 3.24Å; L620-F624 WeakPolarHBondContact O-CD2 3.46Å; L620-F624 PolarHBondContact O-N 3.25Å
621	V	84.3	Confident	80.6	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.012	31%	0.309	C	S	.	.	H	α-helix	trans	-55.9	-48.9	174.3	169	0	0	0	0	110.2	L590 Y593 I594 I617 D618 L619 I623 F624 L625	L590-V621 HydrophobicContact CD2-CG2 4.02Å; Y593-V621 HydrophobicContact CD1-CG2 3.99Å; Y593-V621 HydrophobicContact CE1-CG2 4.14Å; I594-V621 HydrophobicContact CD1-CG1 3.57Å; I594-V621 HydrophobicContact CG1-CG1 3.76Å; I617-V621 HydrophobicContact CG2-CG2 4.45Å; I617-V621 VanDerWaalsContact O-CG2 3.28Å; I617-V621 WeakPolarHBondContact O-CG2 3.29Å; I617-V621 PolarHBondContact O-N 2.92Å; D618-V621 WeakPolarHBondContact O-CB 3.27Å; D618-V621 PolarHBondContact O-N 3.32Å; L619-V621 VanDerWaalsContact C-N 3.34Å; V621-I623 VanDerWaalsContact C-N 3.34Å; V621-I623 PolarHBondContact O-N 2.83Å; V621-F624 PolarHBondContact O-N 2.79Å; V621-L625 HydrophobicContact CG1-CD1 3.72Å; V621-L625 HydrophobicContact CG1-CG 4.41Å; V621-L625 WeakPolarHBondContact O-CD1 3.28Å; V621-L625 WeakPolarHBondContact O-CG 3.28Å; V621-L625 PolarHBondContact O-N 2.86Å; V621-L625 VanDerWaalsContact O-N 3.09Å
622	E	81.6	Confident	81.9	Confident	10 Å²	10	58.4 Å²	58.4	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-42.3	176.4	-72.2	-174.3	176.9	0	0	112.9	D618 L619 L620 L625 I626 P669 R738	D618-E622 WeakPolarHBondContact O-CG 3.3Å; D618-E622 PolarHBondContact O-N 3.34Å; L619-E622 PolarHBondContact O-N 3.28Å; L620-E622 VanDerWaalsContact C-N 3.35Å; L620-E622 PolarHBondContact O-N 3.07Å; E622-L625 PolarHBondContact O-N 2.86Å; E622-I626 WeakPolarHBondContact O-CG1 3.29Å; E622-I626 PolarHBondContact O-N 3.18Å; E622-P669 WeakPolarHBondContact OE2-CA 3.31Å; E622-P669 VanDerWaalsContact OE2-CB 3.26Å; E622-P669 WeakPolarHBondContact OE2-CB 3.35Å; E622-R738 IonicContact OE1-CZ 2.92Å; E622-R738 IonicContact OE1-NH1 3.56Å; E622-R738 PolarHBondContact OE1-NH1 3.4Å; E622-R738 VanDerWaalsContact OE1-NH1 3.12Å; E622-R738 IonicContact OE1-NH2 3.95Å; E622-R738 PolarHBondContact OE1-NH2 2.84Å
623	I	86.8	Confident	83.3	Confident	86 Å²	86	59 Å²	59	44%	0.441	28%	0.284	S	S	.	.	H	α-helix	trans	-61.6	-46.5	176.8	-66.9	163.9	0	0	0	111.4	L619 L620 V621 L625 I626 V627	L619-I623 HydrophobicContact CD1-CD1 4.3Å; L619-I623 HydrophobicContact CG-CD1 4.21Å; L619-I623 WeakPolarHBondContact O-CG1 3.45Å; L619-I623 PolarHBondContact O-N 2.93Å; L620-I623 PolarHBondContact O-N 2.8Å; V621-I623 VanDerWaalsContact C-N 3.34Å; V621-I623 PolarHBondContact O-N 2.83Å; I623-L625 PolarHBondContact O-N 2.85Å; I623-I626 PolarHBondContact O-N 2.94Å; I623-V627 WeakPolarHBondContact O-CG2 3.34Å; I623-V627 PolarHBondContact O-N 2.75Å
624	F	88.7	Confident	84.3	Confident	69 Å²	69	50.8 Å²	50.8	30%	0.303	25%	0.254	S	S	.	.	H	α-helix	trans	-58.7	-37.4	176.1	-85.3	-76	0	0	0	112.3	W583 L586 L590 L620 V621 V627 D628	W583-F624 AromaticContact CH2-CD1 3.53Å; W583-F624 HydrophobicContact CH2-CD1 3.53Å; W583-F624 AromaticContact CH2-CE1 3.99Å; W583-F624 HydrophobicContact CH2-CE1 3.99Å; W583-F624 HydrophobicContact CZ2-CD1 4.24Å; W583-F624 AromaticContact CZ3-CD1 3.99Å; W583-F624 HydrophobicContact CZ3-CD1 3.99Å; W583-F624 HydrophobicContact CZ3-CE1 4.03Å; L586-F624 HydrophobicContact CD2-CD1 4.11Å; L586-F624 HydrophobicContact CD2-CE1 3.68Å; L586-F624 HydrophobicContact CD2-CZ 4.4Å; L590-F624 HydrophobicContact CD1-CB 3.73Å; L590-F624 HydrophobicContact CD1-CD1 4.23Å; L590-F624 HydrophobicContact CD1-CD2 4.11Å; L590-F624 HydrophobicContact CD1-CG 3.77Å; L620-F624 VanDerWaalsContact O-CD2 3.24Å; L620-F624 WeakPolarHBondContact O-CD2 3.46Å; L620-F624 PolarHBondContact O-N 3.25Å; V621-F624 PolarHBondContact O-N 2.79Å; F624-V627 PolarHBondContact O-N 2.86Å; F624-D628 PolarHBondContact O-N 3.11Å
625	L	83.9	Confident	85.2	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-74.7	-31.8	-179.1	-64	170.6	0	0	0	112.9	L587 I594 V621 E622 I623 V629	L587-L625 HydrophobicContact CD2-CD2 4.12Å; I594-L625 HydrophobicContact CD1-CD1 3.98Å; V621-L625 HydrophobicContact CG1-CD1 3.72Å; V621-L625 HydrophobicContact CG1-CG 4.41Å; V621-L625 WeakPolarHBondContact O-CD1 3.28Å; V621-L625 WeakPolarHBondContact O-CG 3.28Å; V621-L625 PolarHBondContact O-N 2.86Å; V621-L625 VanDerWaalsContact O-N 3.09Å; E622-L625 PolarHBondContact O-N 2.86Å; I623-L625 PolarHBondContact O-N 2.85Å; L625-V629 PolarHBondContact O-N 3.39Å
626	I	85.6	Confident	86.1	Confident	76 Å²	76	43.7 Å²	43.7	39%	0.39	22%	0.224	S	C	.	.	H	α-helix	trans	-69.3	-41.2	170.3	-67.7	164.2	0	0	0	110.3	E622 I623 D628 V629 I630 A667	E622-I626 WeakPolarHBondContact O-CG1 3.29Å; E622-I626 PolarHBondContact O-N 3.18Å; I623-I626 PolarHBondContact O-N 2.94Å; I626-D628 VanDerWaalsContact C-N 3.32Å; I626-D628 PolarHBondContact O-N 2.95Å; I626-V629 PolarHBondContact O-N 2.9Å; I626-I630 HydrophobicContact CG2-CD1 4.27Å; I626-I630 PolarHBondContact O-N 2.82Å; I626-A667 HydrophobicContact CG1-CB 4.45Å
627	V	90	Very high	86.5	Confident	53 Å²	53	41.1 Å²	41.1	32%	0.321	21%	0.208	S	C	.	.	H	α-helix	trans	-63.8	-36.4	176.4	174.6	0	0	0	0	111.6	W583 I623 F624 V629 I630 L631	W583-V627 HydrophobicContact CH2-CB 4.1Å; W583-V627 HydrophobicContact CH2-CG1 3.56Å; W583-V627 HydrophobicContact CZ2-CB 4.02Å; W583-V627 HydrophobicContact CZ2-CG1 3.63Å; I623-V627 WeakPolarHBondContact O-CG2 3.34Å; I623-V627 PolarHBondContact O-N 2.75Å; F624-V627 PolarHBondContact O-N 2.86Å; V627-V629 PolarHBondContact O-N 2.83Å; V627-I630 PolarHBondContact O-N 3.12Å; V627-L631 HydrophobicContact CG1-CD1 3.81Å; V627-L631 HydrophobicContact CG1-CG 4.14Å; V627-L631 WeakPolarHBondContact O-CB 3.45Å; V627-L631 VanDerWaalsContact O-CG 3.27Å; V627-L631 WeakPolarHBondContact O-CG 3.34Å; V627-L631 PolarHBondContact O-N 2.72Å
628	D	88.5	Confident	86.6	Confident	2 Å²	2	41 Å²	41	1%	0.011	21%	0.211	C	C	.	.	H	α-helix	trans	-56.4	-47.9	171.4	171.6	57	0	0	0	112.5	L587 F624 I626 I630 L631 N632 R741 R744	L587-D628 HydrophobicContact CD1-CB 3.95Å; L587-D628 VanDerWaalsContact CD1-OD1 3.31Å; L587-D628 WeakPolarHBondContact CD1-OD1 3.27Å; L587-D628 HydrophobicContact CD2-CB 4.11Å; F624-D628 PolarHBondContact O-N 3.11Å; I626-D628 VanDerWaalsContact C-N 3.32Å; I626-D628 PolarHBondContact O-N 2.95Å; D628-I630 VanDerWaalsContact C-N 3.31Å; D628-I630 PolarHBondContact O-N 3.22Å; D628-L631 PolarHBondContact O-N 3.44Å; D628-N632 VanDerWaalsContact CG-ND2 3.28Å; D628-N632 PolarHBondContact O-N 3.29Å; D628-N632 PolarHBondContact O-ND2 3.24Å; D628-N632 PolarHBondContact OD1-ND2 3.49Å; D628-N632 PolarHBondContact OD2-ND2 3.3Å; D628-R741 IonicContact OD2-NE 3.79Å; D628-R744 IonicContact OD1-NH1 3.99Å; D628-R744 PolarHBondContact OD1-NH1 3.49Å; D628-R744 IonicContact OD2-CZ 3.47Å; D628-R744 VanDerWaalsContact OD2-CZ 3.22Å; D628-R744 IonicContact OD2-NH1 3.05Å; D628-R744 PolarHBondContact OD2-NH1 3Å; D628-R744 IonicContact OD2-NH2 3.76Å; D628-R744 PolarHBondContact OD2-NH2 3.18Å
629	V	87.7	Confident	86.9	Confident	19 Å²	19	43.7 Å²	43.7	12%	0.115	23%	0.225	C	C	.	.	H	α-helix	trans	-58.3	-45.1	177	179.9	0	0	0	0	110.9	L625 I626 V627 L631 N632 F633 Y655 L660 D663 A667	L625-V629 PolarHBondContact O-N 3.39Å; I626-V629 PolarHBondContact O-N 2.9Å; V627-V629 PolarHBondContact O-N 2.83Å; V629-L631 PolarHBondContact O-N 2.69Å; V629-N632 PolarHBondContact O-N 3.27Å; V629-F633 HydrophobicContact CG1-CD2 4.45Å; V629-F633 HydrophobicContact CG1-CE2 4.08Å; V629-F633 VanDerWaalsContact O-CD2 3.29Å; V629-F633 WeakPolarHBondContact O-CD2 3.49Å; V629-F633 PolarHBondContact O-N 3.49Å; V629-Y655 HydrophobicContact CG1-CE1 4.46Å; V629-L660 HydrophobicContact CG1-CD1 4.05Å; V629-D663 HydrophobicContact CG2-CB 4.12Å; V629-A667 HydrophobicContact CG2-CB 4.34Å
630	I	90.5	Very high	87	Confident	94 Å²	94	50.4 Å²	50.4	48%	0.482	25%	0.252	S	S	.	.	H	α-helix	trans	-62.7	-43.8	177.8	-63.4	169.2	0	0	0	110.7	I626 V627 D628 N632 F633 H634	I626-I630 HydrophobicContact CG2-CD1 4.27Å; I626-I630 PolarHBondContact O-N 2.82Å; V627-I630 PolarHBondContact O-N 3.12Å; D628-I630 VanDerWaalsContact C-N 3.31Å; D628-I630 PolarHBondContact O-N 3.22Å; I630-N632 PolarHBondContact O-N 2.86Å; I630-F633 PolarHBondContact O-N 2.84Å; I630-H634 PolarHBondContact O-CE1 3.16Å; I630-H634 PolarHBondContact O-ND1 2.56Å
631	L	89.8	Confident	86.7	Confident	32 Å²	32	51.5 Å²	51.5	17%	0.168	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-39	178.8	-71	169.3	0	0	0	111.9	L573 F579 W583 V627 D628 V629 F633 H634 T635	L573-L631 HydrophobicContact CD1-CD2 3.6Å; F579-L631 HydrophobicContact CE1-CD1 4.37Å; F579-L631 HydrophobicContact CE1-CD2 4.34Å; W583-L631 HydrophobicContact CD2-CD1 3.82Å; W583-L631 HydrophobicContact CE3-CD1 4.41Å; W583-L631 HydrophobicContact CG-CD1 4.25Å; W583-L631 HydrophobicContact CH2-CD1 4.26Å; W583-L631 HydrophobicContact CZ2-CD1 3.66Å; V627-L631 HydrophobicContact CG1-CD1 3.81Å; V627-L631 HydrophobicContact CG1-CG 4.14Å; V627-L631 WeakPolarHBondContact O-CB 3.45Å; V627-L631 VanDerWaalsContact O-CG 3.27Å; V627-L631 WeakPolarHBondContact O-CG 3.34Å; V627-L631 PolarHBondContact O-N 2.72Å; D628-L631 PolarHBondContact O-N 3.44Å; V629-L631 PolarHBondContact O-N 2.69Å; L631-F633 VanDerWaalsContact C-N 3.27Å; L631-F633 PolarHBondContact O-N 2.79Å; L631-H634 CarbonylContact O-C 3.38Å; L631-H634 WeakPolarHBondContact O-CA 3.36Å; L631-H634 WeakPolarHBondContact O-CB 3.26Å; L631-H634 PolarHBondContact O-N 3.06Å; L631-T635 WeakPolarHBondContact O-CG2 3.39Å; L631-T635 PolarHBondContact O-N 2.77Å
632	N	87.6	Confident	86	Confident	21 Å²	21	52.3 Å²	52.3	11%	0.112	27%	0.267	C	S	.	.	H	α-helix	trans	-65.9	-23.1	179.5	-72.6	-52.7	0	0	0	114.1	D628 V629 I630 H634 T635 Y655 R744	D628-N632 VanDerWaalsContact CG-ND2 3.28Å; D628-N632 PolarHBondContact O-N 3.29Å; D628-N632 PolarHBondContact O-ND2 3.24Å; D628-N632 PolarHBondContact OD1-ND2 3.49Å; D628-N632 PolarHBondContact OD2-ND2 3.3Å; V629-N632 PolarHBondContact O-N 3.27Å; I630-N632 PolarHBondContact O-N 2.86Å; N632-H634 PolarHBondContact O-N 3.24Å; N632-T635 WeakPolarHBondContact CA-OG1 3.44Å; N632-T635 PolarHBondContact O-OG1 3.02Å; N632-Y655 HydrophobicContact CB-CD1 4.28Å; N632-Y655 HydrophobicContact CB-CD2 4.4Å; N632-Y655 HydrophobicContact CB-CE1 3.73Å; N632-Y655 HydrophobicContact CB-CE2 3.88Å; N632-R744 PolarHBondContact ND2-NH1 3.4Å
633	F	90.7	Very high	85.8	Confident	60 Å²	60	57.7 Å²	57.7	26%	0.263	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-9.5	167.3	-80.1	-72.6	0	0	0	114.3	V629 I630 L631 A652 Y655 L660	V629-F633 HydrophobicContact CG1-CD2 4.45Å; V629-F633 HydrophobicContact CG1-CE2 4.08Å; V629-F633 VanDerWaalsContact O-CD2 3.29Å; V629-F633 WeakPolarHBondContact O-CD2 3.49Å; V629-F633 PolarHBondContact O-N 3.49Å; I630-F633 PolarHBondContact O-N 2.84Å; L631-F633 VanDerWaalsContact C-N 3.27Å; L631-F633 PolarHBondContact O-N 2.79Å; F633-A652 HydrophobicContact CD1-CB 3.77Å; F633-A652 HydrophobicContact CE1-CB 4.08Å; F633-Y655 AromaticContact CD1-CD1 3.93Å; F633-Y655 HydrophobicContact CD1-CD1 3.93Å; F633-Y655 HydrophobicContact CD2-CD1 4.11Å; F633-Y655 AromaticContact CD2-CE1 3.96Å; F633-Y655 HydrophobicContact CD2-CE1 3.96Å; F633-Y655 AromaticContact CE1-CD1 3.85Å; F633-Y655 HydrophobicContact CE1-CD1 3.85Å; F633-Y655 HydrophobicContact CE1-CE1 4.47Å; F633-Y655 HydrophobicContact CE2-CD1 4.03Å; F633-Y655 AromaticContact CE2-CE1 3.82Å; F633-Y655 HydrophobicContact CE2-CE1 3.82Å; F633-Y655 HydrophobicContact CG-CD1 4.07Å; F633-Y655 HydrophobicContact CG-CE1 4.35Å; F633-Y655 AromaticContact CZ-CD1 3.9Å; F633-Y655 HydrophobicContact CZ-CD1 3.9Å; F633-Y655 HydrophobicContact CZ-CE1 4.11Å; F633-L660 HydrophobicContact CE1-CD2 4.49Å; F633-L660 HydrophobicContact CE2-CD1 3.75Å; F633-L660 HydrophobicContact CZ-CD1 3.65Å; F633-L660 HydrophobicContact CZ-CD2 3.77Å; F633-L660 HydrophobicContact CZ-CG 4.34Å
634	H	89.7	Confident	85.7	Confident	33 Å²	33	56.7 Å²	56.7	15%	0.153	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	-4.2	-178.1	-58.9	90.3	0	0	0	113.5	F571 V572 L573 I630 L631 N632 R648	F571-H634 PolarHBondContact O-CD2 3.02Å; F571-H634 VanDerWaalsContact O-CD2 3.24Å; V572-H634 CarbonylContact C-O 3.46Å; V572-H634 WeakPolarHBondContact CA-O 3.31Å; L573-H634 PolarHBondContact N-O 3.31Å; I630-H634 PolarHBondContact O-CE1 3.16Å; I630-H634 PolarHBondContact O-ND1 2.56Å; L631-H634 CarbonylContact O-C 3.38Å; L631-H634 WeakPolarHBondContact O-CA 3.36Å; L631-H634 WeakPolarHBondContact O-CB 3.26Å; L631-H634 PolarHBondContact O-N 3.06Å; N632-H634 PolarHBondContact O-N 3.24Å; H634-R648 PolarHBondContact NE2-NE 3.47Å; H634-R648 PolarHBondContact NE2-NH2 2.88Å
635	T	89.1	Confident	85.5	Confident	19 Å²	19	54.1 Å²	54.1	12%	0.117	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-86	133.7	-179.1	50.9	0	0	0	0	112	L573 H580 L631 N632 I651	L573-T635 HydrophobicContact CB-CG2 3.99Å; L573-T635 HydrophobicContact CD1-CG2 4.45Å; L573-T635 CarbonylContact O-C 3.53Å; L573-T635 WeakPolarHBondContact O-CA 3.26Å; H580-T635 VanDerWaalsContact CD2-CG2 3.43Å; H580-T635 WeakPolarHBondContact CD2-CG2 3.24Å; H580-T635 WeakPolarHBondContact NE2-CG2 3.24Å; L631-T635 WeakPolarHBondContact O-CG2 3.39Å; L631-T635 PolarHBondContact O-N 2.77Å; N632-T635 WeakPolarHBondContact CA-OG1 3.44Å; N632-T635 PolarHBondContact O-OG1 3.02Å; T635-I651 WeakPolarHBondContact O-CG2 3.45Å
636	T	90	Very high	85.5	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.025	29%	0.289	C	S	.	.			trans	-66.9	138	174.6	61.6	0	0	0	0	110.6	V572 L573 L574 H575 I644 V645 N646	V572-T636 HydrophobicContact CG1-CG2 3.4Å; L573-T636 PolarHBondContact O-N 3.16Å; L574-T636 HydrophobicContact CD1-CG2 4.17Å; H575-T636 WeakPolarHBondContact CB-O 3.32Å; H575-T636 PolarHBondContact N-OG1 2.67Å; H575-T636 PolarHBondContact ND1-O 2.67Å; H575-T636 VanDerWaalsContact ND1-O 3.11Å; H575-T636 PolarHBondContact ND1-OG1 3.3Å; T636-I644 HydrophobicContact CG2-CG2 4.11Å; T636-V645 WeakPolarHBondContact CB-O 3.5Å; T636-N646 VanDerWaalsContact CG2-OD1 3.31Å; T636-N646 WeakPolarHBondContact CG2-OD1 3.39Å
637	Y	86.9	Confident	85.5	Confident	47 Å²	47	57.7 Å²	57.7	18%	0.184	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	161.9	168.5	76.2	-83.9	0	0	0	111.3	N639 V645 I651 H654	Y637-N639 HydrophobicContact CE2-CB 4.28Å; Y637-V645 HydrophobicContact CD1-CB 4.13Å; Y637-V645 HydrophobicContact CE1-CB 3.7Å; Y637-V645 HydrophobicContact CE1-CG1 3.79Å; Y637-V645 HydrophobicContact CE1-CG2 4.12Å; Y637-V645 HydrophobicContact CE2-CG2 4.12Å; Y637-V645 PolarHBondContact O-N 3.06Å; Y637-I651 HydrophobicContact CD1-CG1 4.07Å; Y637-I651 HydrophobicContact CE1-CG1 4.32Å; Y637-H654 HydrophobicContact CD1-CB 4.14Å; Y637-H654 AromaticContact CD1-CD2 3.74Å; Y637-H654 AromaticContact CD2-CD2 3.45Å; Y637-H654 VanDerWaalsContact CD2-CD2 3.45Å; Y637-H654 WeakPolarHBondContact CD2-CD2 3.47Å; Y637-H654 AromaticContact CD2-CG 4Å; Y637-H654 AromaticContact CD2-NE2 3.58Å; Y637-H654 HydrophobicContact CE1-CB 3.69Å; Y637-H654 AromaticContact CE1-CG 3.94Å; Y637-H654 HydrophobicContact CE2-CB 4.37Å; Y637-H654 AromaticContact CE2-CD2 3.77Å; Y637-H654 AromaticContact CE2-CG 3.81Å; Y637-H654 AromaticContact CE2-NE2 3.98Å; Y637-H654 AromaticContact CG-CD2 3.45Å; Y637-H654 VanDerWaalsContact CG-CD2 3.45Å; Y637-H654 AromaticContact CG-NE2 3.97Å; Y637-H654 AromaticContact CZ-CG 3.78Å
638	V	84.9	Confident	85.4	Confident	73 Å²	73	62 Å²	62	44%	0.442	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	119.9	173.1	-178.6	0	0	0	0	108.1	H575 Q643	H575-V638 WeakPolarHBondContact CE1-CG2 3.38Å; H575-V638 WeakPolarHBondContact NE2-CG2 3.36Å; V638-Q643 WeakPolarHBondContact CA-O 3.34Å
639	N	83.3	Confident	85.5	Confident	61 Å²	61	70 Å²	70	33%	0.326	34%	0.344	S	S	.	.			trans	-68	163	177.6	-168.8	6.1	0	0	0	110.9	Y637 N641 G642 Q643 V645	Y637-N639 HydrophobicContact CE2-CB 4.28Å; N639-N641 PolarHBondContact O-N 2.87Å; N639-N641 VanDerWaalsContact O-N 3.14Å; N639-G642 VanDerWaalsContact O-CA 3.28Å; N639-G642 WeakPolarHBondContact O-CA 3.41Å; N639-G642 PolarHBondContact O-N 2.83Å; N639-Q643 PolarHBondContact N-O 3.3Å; N639-V645 HydrophobicContact CB-CG2 4.13Å
640	K	82.9	Confident	85.6	Confident	210 Å²	210	73 Å²	73	91%	0.913	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.1	174.8	-65.9	-166.4	176.2	-165.8	0	113	G642	K640-G642 PolarHBondContact O-N 2.65Å
641	N	77.6	Confident	85.6	Confident	109 Å²	109	68.7 Å²	68.7	58%	0.583	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-0.1	172.5	-64.9	5.4	0	0	0	113.4	R335 N639	R335-N641 PolarHBondContact NH2-O 2.88Å; N639-N641 PolarHBondContact O-N 2.87Å; N639-N641 VanDerWaalsContact O-N 3.14Å
642	G	70.7	Confident	85.7	Confident	20 Å²	20	68.6 Å²	68.6	21%	0.206	34%	0.341	C	S	.	.	S	Bend	trans	67.7	31	178.9	0	0	0	0	0	114.8	R335 N639 K640	R335-G642 VanDerWaalsContact CZ-CA 3.45Å; R335-G642 VanDerWaalsContact CZ-O 3.3Å; R335-G642 PolarHBondContact NE-O 2.79Å; R335-G642 VanDerWaalsContact NH2-CA 3.31Å; R335-G642 PolarHBondContact NH2-O 2.93Å; N639-G642 VanDerWaalsContact O-CA 3.28Å; N639-G642 WeakPolarHBondContact O-CA 3.41Å; N639-G642 PolarHBondContact O-N 2.83Å; K640-G642 PolarHBondContact O-N 2.65Å
643	Q	77.5	Confident	85.8	Confident	122 Å²	122	75.2 Å²	75.2	57%	0.57	37%	0.369	S	S	*	.			trans	-104.9	144	175.1	-69.5	168.8	-37.1	0	0	109.5	V638 N639	V638-Q643 WeakPolarHBondContact CA-O 3.34Å; N639-Q643 PolarHBondContact N-O 3.3Å
644	I	84.1	Confident	85.8	Confident	65 Å²	65	77.3 Å²	77.3	33%	0.333	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	124	177	-53.8	168.2	0	0	0	108.5	L566 Y576 T636	L566-I644 HydrophobicContact CD2-CD1 4.41Å; Y576-I644 HydrophobicContact CE1-CD1 4.03Å; T636-I644 HydrophobicContact CG2-CG2 4.11Å
645	V	85.2	Confident	85.8	Confident	16 Å²	16	76.6 Å²	76.6	10%	0.097	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	119.3	177.7	-178.7	0	0	0	0	109.5	T636 Y637 N639 D647 L650	T636-V645 WeakPolarHBondContact CB-O 3.5Å; Y637-V645 HydrophobicContact CD1-CB 4.13Å; Y637-V645 HydrophobicContact CE1-CB 3.7Å; Y637-V645 HydrophobicContact CE1-CG1 3.79Å; Y637-V645 HydrophobicContact CE1-CG2 4.12Å; Y637-V645 HydrophobicContact CE2-CG2 4.12Å; Y637-V645 PolarHBondContact O-N 3.06Å; N639-V645 HydrophobicContact CB-CG2 4.13Å; V645-D647 HydrophobicContact CG1-CB 4.48Å; V645-L650 HydrophobicContact CG1-CB 3.75Å; V645-L650 HydrophobicContact CG1-CD1 4.02Å
646	N	83.2	Confident	85.8	Confident	49 Å²	49	77.9 Å²	77.9	26%	0.262	39%	0.387	S	S	.	.			trans	-100.7	-9.3	-179.6	-63	-23.3	0	0	0	113.2	T636 R648	T636-N646 VanDerWaalsContact CG2-OD1 3.31Å; T636-N646 WeakPolarHBondContact CG2-OD1 3.39Å; N646-R648 PolarHBondContact O-N 2.86Å
647	D	86.2	Confident	85.8	Confident	102 Å²	102	86.8 Å²	86.8	55%	0.545	43%	0.426	S	S	.	.			trans	-77	112.5	-174.3	-63.7	-45.3	0	0	0	111.4	V645 H649 L650 I651	V645-D647 HydrophobicContact CG1-CB 4.48Å; D647-H649 PolarHBondContact O-N 3.35Å; D647-H649 VanDerWaalsContact O-N 3.09Å; D647-L650 HydrophobicContact CB-CB 4.16Å; D647-L650 HydrophobicContact CB-CD1 4.08Å; D647-L650 HydrophobicContact CB-CG 4.11Å; D647-L650 WeakPolarHBondContact O-CA 3.31Å; D647-L650 PolarHBondContact O-N 2.88Å; D647-I651 WeakPolarHBondContact O-CG1 3.4Å; D647-I651 PolarHBondContact O-N 3.48Å
648	R	87.2	Confident	85.6	Confident	143 Å²	143	86.1 Å²	86.1	54%	0.54	43%	0.433	S	S	.	.	H	α-helix	trans	-52.7	-35.5	-176.4	-164.1	178.4	-177.8	-149.1	4.6	113.5	H634 N646 A652	H634-R648 PolarHBondContact NE2-NE 3.47Å; H634-R648 PolarHBondContact NE2-NH2 2.88Å; N646-R648 PolarHBondContact O-N 2.86Å; R648-A652 VanDerWaalsContact O-CB 3.25Å; R648-A652 WeakPolarHBondContact O-CB 3.33Å; R648-A652 PolarHBondContact O-N 2.78Å
649	H	89.7	Confident	85.5	Confident	170 Å²	170	86.1 Å²	86.1	79%	0.787	43%	0.425	S	S	*	.	H	α-helix	trans	-71.1	-34.4	175.9	-65.9	-76.6	0	0	0	113.6	D647 K653	D647-H649 PolarHBondContact O-N 3.35Å; D647-H649 VanDerWaalsContact O-N 3.09Å; H649-K653 VanDerWaalsContact O-CB 3.27Å; H649-K653 WeakPolarHBondContact O-CB 3.33Å; H649-K653 PolarHBondContact O-N 2.88Å
650	L	89.9	Confident	85.6	Confident	83 Å²	83	85 Å²	85	44%	0.435	42%	0.42	S	S	.	.	H	α-helix	trans	-75.7	-39.5	175	-66.7	179.8	0	0	0	111.1	V645 D647 K653 H654	V645-L650 HydrophobicContact CG1-CB 3.75Å; V645-L650 HydrophobicContact CG1-CD1 4.02Å; D647-L650 HydrophobicContact CB-CB 4.16Å; D647-L650 HydrophobicContact CB-CD1 4.08Å; D647-L650 HydrophobicContact CB-CG 4.11Å; D647-L650 WeakPolarHBondContact O-CA 3.31Å; D647-L650 PolarHBondContact O-N 2.88Å; L650-K653 PolarHBondContact O-N 3.26Å; L650-H654 VanDerWaalsContact O-CB 3.25Å; L650-H654 WeakPolarHBondContact O-CB 3.2Å; L650-H654 PolarHBondContact O-N 3.15Å
651	I	90.6	Very high	85.6	Confident	4 Å²	4	80.4 Å²	80.4	2%	0.021	40%	0.404	C	S	.	.	H	α-helix	trans	-55.3	-55.4	170.5	-67.6	165.1	0	0	0	109.8	V572 T635 Y637 D647 K653 H654 Y655	V572-I651 HydrophobicContact CG1-CD1 4.29Å; T635-I651 WeakPolarHBondContact O-CG2 3.45Å; Y637-I651 HydrophobicContact CD1-CG1 4.07Å; Y637-I651 HydrophobicContact CE1-CG1 4.32Å; D647-I651 WeakPolarHBondContact O-CG1 3.4Å; D647-I651 PolarHBondContact O-N 3.48Å; I651-K653 PolarHBondContact O-N 2.69Å; I651-H654 PolarHBondContact O-N 2.87Å; I651-H654 VanDerWaalsContact O-N 3.17Å; I651-Y655 WeakPolarHBondContact O-CB 3.45Å; I651-Y655 PolarHBondContact O-N 2.87Å
652	A	91.6	Very high	85.6	Confident	29 Å²	29	77.2 Å²	77.2	24%	0.24	39%	0.386	C	S	.	.	H	α-helix	trans	-59.2	-44.2	179.5	0	0	0	0	0	112.7	F633 R648 H654 Y655 A656	F633-A652 HydrophobicContact CD1-CB 3.77Å; F633-A652 HydrophobicContact CE1-CB 4.08Å; R648-A652 VanDerWaalsContact O-CB 3.25Å; R648-A652 WeakPolarHBondContact O-CB 3.33Å; R648-A652 PolarHBondContact O-N 2.78Å; A652-H654 VanDerWaalsContact C-N 3.34Å; A652-H654 PolarHBondContact O-N 3.06Å; A652-Y655 PolarHBondContact O-N 3.09Å; A652-A656 WeakPolarHBondContact O-CB 3.46Å; A652-A656 PolarHBondContact O-N 3.31Å
653	K	91.2	Very high	86.1	Confident	161 Å²	161	76.3 Å²	76.3	70%	0.7	38%	0.377	S	S	*	.	H	α-helix	trans	-66.7	-32.8	177.5	-174.8	172.5	-178	174.1	0	112.9	H649 L650 I651 K657	H649-K653 VanDerWaalsContact O-CB 3.27Å; H649-K653 WeakPolarHBondContact O-CB 3.33Å; H649-K653 PolarHBondContact O-N 2.88Å; L650-K653 PolarHBondContact O-N 3.26Å; I651-K653 PolarHBondContact O-N 2.69Å; K653-K657 WeakPolarHBondContact O-CB 3.38Å; K653-K657 PolarHBondContact O-N 2.76Å
654	H	89.6	Confident	86.2	Confident	103 Å²	103	75.5 Å²	75.5	48%	0.477	38%	0.376	S	S	.	.	H	α-helix	trans	-71.2	-48.4	175.7	-176.3	62.1	0	0	0	111.1	Y637 L650 I651 A652 K657	Y637-H654 HydrophobicContact CD1-CB 4.14Å; Y637-H654 AromaticContact CD1-CD2 3.74Å; Y637-H654 AromaticContact CD2-CD2 3.45Å; Y637-H654 VanDerWaalsContact CD2-CD2 3.45Å; Y637-H654 WeakPolarHBondContact CD2-CD2 3.47Å; Y637-H654 AromaticContact CD2-CG 4Å; Y637-H654 AromaticContact CD2-NE2 3.58Å; Y637-H654 HydrophobicContact CE1-CB 3.69Å; Y637-H654 AromaticContact CE1-CG 3.94Å; Y637-H654 HydrophobicContact CE2-CB 4.37Å; Y637-H654 AromaticContact CE2-CD2 3.77Å; Y637-H654 AromaticContact CE2-CG 3.81Å; Y637-H654 AromaticContact CE2-NE2 3.98Å; Y637-H654 AromaticContact CG-CD2 3.45Å; Y637-H654 VanDerWaalsContact CG-CD2 3.45Å; Y637-H654 AromaticContact CG-NE2 3.97Å; Y637-H654 AromaticContact CZ-CG 3.78Å; L650-H654 VanDerWaalsContact O-CB 3.25Å; L650-H654 WeakPolarHBondContact O-CB 3.2Å; L650-H654 PolarHBondContact O-N 3.15Å; I651-H654 PolarHBondContact O-N 2.87Å; I651-H654 VanDerWaalsContact O-N 3.17Å; A652-H654 VanDerWaalsContact C-N 3.34Å; A652-H654 PolarHBondContact O-N 3.06Å; H654-K657 PolarHBondContact O-N 2.89Å
655	Y	89.9	Confident	85.8	Confident	18 Å²	18	77 Å²	77	7%	0.071	38%	0.384	C	S	.	.	H	α-helix	trans	-62.4	-45.7	178.1	-177.3	-134.1	0	0	0	112.3	V629 N632 F633 I651 A652 K657 G658 W659 L660 D663	V629-Y655 HydrophobicContact CG1-CE1 4.46Å; N632-Y655 HydrophobicContact CB-CD1 4.28Å; N632-Y655 HydrophobicContact CB-CD2 4.4Å; N632-Y655 HydrophobicContact CB-CE1 3.73Å; N632-Y655 HydrophobicContact CB-CE2 3.88Å; F633-Y655 AromaticContact CD1-CD1 3.93Å; F633-Y655 HydrophobicContact CD1-CD1 3.93Å; F633-Y655 HydrophobicContact CD2-CD1 4.11Å; F633-Y655 AromaticContact CD2-CE1 3.96Å; F633-Y655 HydrophobicContact CD2-CE1 3.96Å; F633-Y655 AromaticContact CE1-CD1 3.85Å; F633-Y655 HydrophobicContact CE1-CD1 3.85Å; F633-Y655 HydrophobicContact CE1-CE1 4.47Å; F633-Y655 HydrophobicContact CE2-CD1 4.03Å; F633-Y655 AromaticContact CE2-CE1 3.82Å; F633-Y655 HydrophobicContact CE2-CE1 3.82Å; F633-Y655 HydrophobicContact CG-CD1 4.07Å; F633-Y655 HydrophobicContact CG-CE1 4.35Å; F633-Y655 AromaticContact CZ-CD1 3.9Å; F633-Y655 HydrophobicContact CZ-CD1 3.9Å; F633-Y655 HydrophobicContact CZ-CE1 4.11Å; I651-Y655 WeakPolarHBondContact O-CB 3.45Å; I651-Y655 PolarHBondContact O-N 2.87Å; A652-Y655 PolarHBondContact O-N 3.09Å; Y655-K657 VanDerWaalsContact C-N 3.27Å; Y655-K657 PolarHBondContact O-N 3.03Å; Y655-G658 CarbonylContact O-C 3.59Å; Y655-G658 PolarHBondContact O-N 2.91Å; Y655-W659 HydrophobicContact CD2-CB 4.13Å; Y655-W659 HydrophobicContact CE2-CB 3.83Å; Y655-W659 PolarHBondContact O-N 2.82Å; Y655-L660 HydrophobicContact CD1-CB 4.35Å; Y655-L660 HydrophobicContact CD1-CD1 4.29Å; Y655-L660 HydrophobicContact CE1-CB 4.28Å; Y655-L660 HydrophobicContact CE1-CD1 3.74Å; Y655-L660 PolarHBondContact O-N 2.75Å; Y655-D663 WeakPolarHBondContact CE2-OD2 3.37Å; Y655-D663 WeakPolarHBondContact OH-CB 3.36Å; Y655-D663 PolarHBondContact OH-OD2 2.74Å
656	A	90.1	Very high	85.3	Confident	46 Å²	46	76.2 Å²	76.2	38%	0.38	38%	0.379	S	S	.	.	H	α-helix	trans	-65.2	-24.1	179	0	0	0	0	0	114.5	A652 G658 L660	A652-A656 WeakPolarHBondContact O-CB 3.46Å; A652-A656 PolarHBondContact O-N 3.31Å; A656-G658 VanDerWaalsContact C-N 3.34Å; A656-L660 HydrophobicContact CB-CD2 3.75Å
657	K	89.2	Confident	85	Confident	192 Å²	192	74.7 Å²	74.7	84%	0.835	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-14	174.6	-177.9	167.1	178.6	178.3	0	113.1	K653 H654 Y655	K653-K657 WeakPolarHBondContact O-CB 3.38Å; K653-K657 PolarHBondContact O-N 2.76Å; H654-K657 PolarHBondContact O-N 2.89Å; Y655-K657 VanDerWaalsContact C-N 3.27Å; Y655-K657 PolarHBondContact O-N 3.03Å
658	G	83.1	Confident	84.3	Confident	33 Å²	33	73 Å²	73	34%	0.34	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.9	-104.5	-177	0	0	0	0	0	112.2	Y655 A656 L660	Y655-G658 CarbonylContact O-C 3.59Å; Y655-G658 PolarHBondContact O-N 2.91Å; A656-G658 VanDerWaalsContact C-N 3.34Å; G658-L660 VanDerWaalsContact C-N 3.32Å; G658-L660 PolarHBondContact O-N 2.85Å
659	W	83	Confident	83.8	Confident	72 Å²	72	68.2 Å²	68.2	27%	0.273	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-23.3	-164.1	-64.8	103.2	0	0	0	115.7	W175 Y655 I661 L662 D663 A743 R744	W175-W659 HydrophobicContact CH2-CH2 4.2Å; W175-W659 HydrophobicContact CH2-CZ3 4.16Å; Y655-W659 HydrophobicContact CD2-CB 4.13Å; Y655-W659 HydrophobicContact CE2-CB 3.83Å; Y655-W659 PolarHBondContact O-N 2.82Å; W659-I661 PolarHBondContact O-N 3.06Å; W659-L662 HydrophobicContact CE3-CD1 3.79Å; W659-L662 HydrophobicContact CZ3-CD1 3.81Å; W659-L662 PolarHBondContact O-N 2.97Å; W659-L662 VanDerWaalsContact O-N 3.08Å; W659-D663 WeakPolarHBondContact O-CB 3.41Å; W659-D663 PolarHBondContact O-N 2.91Å; W659-A743 HydrophobicContact CH2-CB 3.97Å; W659-A743 HydrophobicContact CZ3-CB 3.89Å; W659-R744 HydrophobicContact CB-CG 4.46Å; W659-R744 HydrophobicContact CD2-CG 3.53Å; W659-R744 HydrophobicContact CE3-CG 3.37Å; W659-R744 HydrophobicContact CG-CG 4.02Å; W659-R744 HydrophobicContact CH2-CG 4.3Å; W659-R744 HydrophobicContact CZ2-CG 4.43Å; W659-R744 HydrophobicContact CZ3-CG 3.79Å
660	L	86	Confident	82.8	Confident	39 Å²	39	61 Å²	61	20%	0.204	32%	0.319	C	S	.	.	H	α-helix	trans	-51.3	-36.2	-176.2	179.4	63.6	0	0	0	113.9	V629 F633 Y655 A656 G658 D663 L664	V629-L660 HydrophobicContact CG1-CD1 4.05Å; F633-L660 HydrophobicContact CE1-CD2 4.49Å; F633-L660 HydrophobicContact CE2-CD1 3.75Å; F633-L660 HydrophobicContact CZ-CD1 3.65Å; F633-L660 HydrophobicContact CZ-CD2 3.77Å; F633-L660 HydrophobicContact CZ-CG 4.34Å; Y655-L660 HydrophobicContact CD1-CB 4.35Å; Y655-L660 HydrophobicContact CD1-CD1 4.29Å; Y655-L660 HydrophobicContact CE1-CB 4.28Å; Y655-L660 HydrophobicContact CE1-CD1 3.74Å; Y655-L660 PolarHBondContact O-N 2.75Å; A656-L660 HydrophobicContact CB-CD2 3.75Å; G658-L660 VanDerWaalsContact C-N 3.32Å; G658-L660 PolarHBondContact O-N 2.85Å; L660-D663 PolarHBondContact O-N 2.94Å; L660-L664 VanDerWaalsContact O-CB 3.27Å; L660-L664 WeakPolarHBondContact O-CB 3.37Å; L660-L664 PolarHBondContact O-N 3.23Å
661	I	82.1	Confident	81.7	Confident	113 Å²	113	58.5 Å²	58.5	58%	0.579	31%	0.306	S	S	*	.	H	α-helix	trans	-66.2	-48.4	-178.7	-60	174.2	0	0	0	110.8	W659 D663 L665	W659-I661 PolarHBondContact O-N 3.06Å; I661-D663 VanDerWaalsContact C-N 3.26Å; I661-D663 PolarHBondContact O-N 3.43Å; I661-L665 HydrophobicContact CG2-CD1 4.3Å; I661-L665 WeakPolarHBondContact O-CG 3.43Å; I661-L665 PolarHBondContact O-N 2.87Å; I661-L665 VanDerWaalsContact O-N 3.1Å
662	L	78	Confident	80.7	Confident	41 Å²	41	63.1 Å²	63.1	22%	0.215	33%	0.326	C	S	.	.	H	α-helix	trans	-63.9	-36.8	176	-64.1	176.5	0	0	0	111.1	W175 W659 A666 L740	W175-L662 HydrophobicContact CH2-CD1 3.92Å; W175-L662 HydrophobicContact CZ3-CD1 4.35Å; W659-L662 HydrophobicContact CE3-CD1 3.79Å; W659-L662 HydrophobicContact CZ3-CD1 3.81Å; W659-L662 PolarHBondContact O-N 2.97Å; W659-L662 VanDerWaalsContact O-N 3.08Å; L662-A666 WeakPolarHBondContact O-CB 3.44Å; L662-A666 PolarHBondContact O-N 3.48Å; L662-L740 HydrophobicContact CD2-CD1 4.25Å
663	D	80.1	Confident	79.6	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.011	34%	0.335	C	S	.	.	H	α-helix	trans	-74.5	-32.9	-175.6	-64.8	-19	0	0	0	113.2	V629 Y655 W659 L660 I661 A667 R741 R744	V629-D663 HydrophobicContact CG2-CB 4.12Å; Y655-D663 WeakPolarHBondContact CE2-OD2 3.37Å; Y655-D663 WeakPolarHBondContact OH-CB 3.36Å; Y655-D663 PolarHBondContact OH-OD2 2.74Å; W659-D663 WeakPolarHBondContact O-CB 3.41Å; W659-D663 PolarHBondContact O-N 2.91Å; L660-D663 PolarHBondContact O-N 2.94Å; I661-D663 VanDerWaalsContact C-N 3.26Å; I661-D663 PolarHBondContact O-N 3.43Å; D663-A667 WeakPolarHBondContact O-CB 3.46Å; D663-A667 PolarHBondContact O-N 3Å; D663-R741 PolarHBondContact O-NH2 2.79Å; D663-R744 VanDerWaalsContact CG-CZ 3.42Å; D663-R744 IonicContact OD1-CZ 2.9Å; D663-R744 IonicContact OD1-NE 2.86Å; D663-R744 PolarHBondContact OD1-NE 3.3Å; D663-R744 IonicContact OD1-NH2 2.86Å; D663-R744 PolarHBondContact OD1-NH2 3.14Å; D663-R744 IonicContact OD2-CZ 3.12Å; D663-R744 VanDerWaalsContact OD2-CZ 3.3Å; D663-R744 IonicContact OD2-NE 2.98Å; D663-R744 PolarHBondContact OD2-NE 3.19Å; D663-R744 VanDerWaalsContact OD2-NE 3.11Å; D663-R744 IonicContact OD2-NH2 2.68Å; D663-R744 PolarHBondContact OD2-NH2 3.48Å
664	L	80.3	Confident	78.2	Confident	105 Å²	105	59.2 Å²	59.2	55%	0.55	31%	0.308	S	S	.	.	H	α-helix	trans	-71.9	-46.5	172.5	-176.4	64.8	0	0	0	111.2	L660 A666 A667 L668	L660-L664 VanDerWaalsContact O-CB 3.27Å; L660-L664 WeakPolarHBondContact O-CB 3.37Å; L660-L664 PolarHBondContact O-N 3.23Å; L664-A666 VanDerWaalsContact C-N 3.28Å; L664-A666 PolarHBondContact O-N 3.4Å; L664-A667 CarbonylContact O-C 3.59Å; L664-A667 WeakPolarHBondContact O-CA 3.48Å; L664-A667 PolarHBondContact O-N 3.47Å; L664-L668 PolarHBondContact O-N 3.24Å; L664-L668 VanDerWaalsContact O-N 3.16Å
665	L	75.8	Confident	77	Confident	95 Å²	95	57.8 Å²	57.8	50%	0.497	30%	0.303	S	S	.	.	H	α-helix	trans	-55.9	-45.7	173.3	-74.4	169.4	0	0	0	111.2	I661 A667 L668	I661-L665 HydrophobicContact CG2-CD1 4.3Å; I661-L665 WeakPolarHBondContact O-CG 3.43Å; I661-L665 PolarHBondContact O-N 2.87Å; I661-L665 VanDerWaalsContact O-N 3.1Å; L665-A667 PolarHBondContact O-N 3.31Å; L665-L668 HydrophobicContact CD2-CD1 4.18Å; L665-L668 WeakPolarHBondContact O-CB 3.22Å; L665-L668 WeakPolarHBondContact O-CG 3.35Å; L665-L668 PolarHBondContact O-N 3.45Å
666	A	74.4	Confident	76	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.008	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-10.6	176.5	0	0	0	0	0	113.5	L662 L664 R738 R741	L662-A666 WeakPolarHBondContact O-CB 3.44Å; L662-A666 PolarHBondContact O-N 3.48Å; L664-A666 VanDerWaalsContact C-N 3.28Å; L664-A666 PolarHBondContact O-N 3.4Å; A666-R738 WeakPolarHBondContact O-CG 3.1Å; A666-R741 HydrophobicContact CB-CG 4.12Å; A666-R741 VanDerWaalsContact CB-NH1 3.3Å; A666-R741 VanDerWaalsContact O-CZ 3.29Å; A666-R741 PolarHBondContact O-NH1 2.98Å; A666-R741 PolarHBondContact O-NH2 3.2Å
667	A	76.5	Confident	74.6	Confident	16 Å²	16	62.5 Å²	62.5	13%	0.132	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	3.1	174.4	0	0	0	0	0	112.9	I626 V629 D663 L664 L665 P669	I626-A667 HydrophobicContact CG1-CB 4.45Å; V629-A667 HydrophobicContact CG2-CB 4.34Å; D663-A667 WeakPolarHBondContact O-CB 3.46Å; D663-A667 PolarHBondContact O-N 3Å; L664-A667 CarbonylContact O-C 3.59Å; L664-A667 WeakPolarHBondContact O-CA 3.48Å; L664-A667 PolarHBondContact O-N 3.47Å; L665-A667 PolarHBondContact O-N 3.31Å; A667-P669 WeakPolarHBondContact O-CD 3.3Å
668	L	72.8	Confident	73.2	Confident	68 Å²	68	57.8 Å²	57.8	36%	0.356	31%	0.308	S	S	.	.			trans	-62.7	123.9	176.1	-69.7	175.7	0	0	0	110.4	L664 L665 V670 R738	L664-L668 PolarHBondContact O-N 3.24Å; L664-L668 VanDerWaalsContact O-N 3.16Å; L665-L668 HydrophobicContact CD2-CD1 4.18Å; L665-L668 WeakPolarHBondContact O-CB 3.22Å; L665-L668 WeakPolarHBondContact O-CG 3.35Å; L665-L668 PolarHBondContact O-N 3.45Å; L668-V670 VanDerWaalsContact C-N 3.28Å; L668-V670 HydrophobicContact CB-CG2 4.38Å; L668-V670 PolarHBondContact O-N 2.98Å; L668-R738 PolarHBondContact O-NH2 2.96Å
669	P	74.9	Confident	72.1	Confident	42 Å²	42	61.6 Å²	61.6	27%	0.273	32%	0.318	S	S	.	.			trans	-83.8	74	179.5	35.3	-35.1	0	0	0	109.4	E622 A667 D671 F672 I673	E622-P669 WeakPolarHBondContact OE2-CA 3.31Å; E622-P669 VanDerWaalsContact OE2-CB 3.26Å; E622-P669 WeakPolarHBondContact OE2-CB 3.35Å; A667-P669 WeakPolarHBondContact O-CD 3.3Å; P669-D671 PolarHBondContact O-N 3.32Å; P669-F672 HydrophobicContact CB-CB 4.1Å; P669-F672 HydrophobicContact CB-CD2 3.82Å; P669-F672 HydrophobicContact CB-CG 4.34Å; P669-F672 HydrophobicContact CG-CB 4.38Å; P669-F672 PolarHBondContact O-N 2.98Å; P669-I673 PolarHBondContact O-N 2.9Å; P669-I673 VanDerWaalsContact O-N 3.07Å
670	V	69.3	Low	71	Confident	18 Å²	18	61.4 Å²	61.4	11%	0.109	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-34.2	-173.3	-177.7	0	0	0	0	111.6	L668 I673 L674 L731	L668-V670 VanDerWaalsContact C-N 3.28Å; L668-V670 HydrophobicContact CB-CG2 4.38Å; L668-V670 PolarHBondContact O-N 2.98Å; V670-I673 PolarHBondContact O-N 3.07Å; V670-L674 WeakPolarHBondContact O-CB 3.28Å; V670-L674 PolarHBondContact O-N 3.21Å; V670-L731 HydrophobicContact CG1-CB 3.99Å
671	D	67	Low	69.5	Low	31 Å²	31	63.3 Å²	63.3	17%	0.166	34%	0.341	C	S	.	.	H	α-helix	trans	-67.8	-37.3	176.9	-63.2	-31.6	0	0	0	112.1	P669 L674 I675 K735	P669-D671 PolarHBondContact O-N 3.32Å; D671-L674 PolarHBondContact O-N 3.46Å; D671-I675 WeakPolarHBondContact O-CB 3.34Å; D671-I675 WeakPolarHBondContact O-CD1 3.38Å; D671-I675 WeakPolarHBondContact O-CG1 3.46Å; D671-I675 PolarHBondContact O-N 3.37Å; D671-K735 VanDerWaalsContact CG-CE 3.42Å; D671-K735 WeakPolarHBondContact OD1-CE 3.24Å; D671-K735 IonicContact OD1-NZ 3.58Å; D671-K735 PolarHBondContact OD1-NZ 2.91Å; D671-K735 WeakPolarHBondContact OD2-CE 3.33Å; D671-K735 IonicContact OD2-NZ 2.83Å; D671-K735 PolarHBondContact OD2-NZ 3.07Å
672	F	69.2	Low	67.9	Low	100 Å²	100	65.5 Å²	65.5	44%	0.439	35%	0.351	S	S	.	.	H	α-helix	trans	-66.3	-38.7	171.9	-79.7	-94.9	0	0	0	111.7	L619 P669 L674 I675 I676	L619-F672 HydrophobicContact CD1-CE2 3.51Å; L619-F672 HydrophobicContact CD1-CZ 3.67Å; P669-F672 HydrophobicContact CB-CB 4.1Å; P669-F672 HydrophobicContact CB-CD2 3.82Å; P669-F672 HydrophobicContact CB-CG 4.34Å; P669-F672 HydrophobicContact CG-CB 4.38Å; P669-F672 PolarHBondContact O-N 2.98Å; F672-L674 VanDerWaalsContact C-N 3.35Å; F672-I675 PolarHBondContact O-N 3.3Å; F672-I676 VanDerWaalsContact O-CB 3.24Å; F672-I676 WeakPolarHBondContact O-CB 3.29Å; F672-I676 WeakPolarHBondContact O-CD1 3.21Å; F672-I676 WeakPolarHBondContact O-CG1 3.44Å; F672-I676 PolarHBondContact O-N 2.98Å
673	I	68.1	Low	66.7	Low	84 Å²	84	68.5 Å²	68.5	43%	0.431	37%	0.366	S	S	.	.	H	α-helix	trans	-62.8	-45.3	175.7	-63	170.1	0	0	0	109.7	P669 V670 I676 C677	P669-I673 PolarHBondContact O-N 2.9Å; P669-I673 VanDerWaalsContact O-N 3.07Å; V670-I673 PolarHBondContact O-N 3.07Å; I673-I676 PolarHBondContact O-N 3.31Å; I673-C677 WeakPolarHBondContact O-CB 3.13Å; I673-C677 PolarHBondContact O-N 2.98Å; I673-C677 PolarHBondContact O-SG 3.31Å
674	L	62.4	Low	64.7	Low	25 Å²	25	74.1 Å²	74.1	13%	0.131	40%	0.396	C	S	.	.	H	α-helix	trans	-61.4	-48.1	176.6	178.6	63.9	0	0	0	112.3	V670 D671 F672 C677 Q678 I728	V670-L674 WeakPolarHBondContact O-CB 3.28Å; V670-L674 PolarHBondContact O-N 3.21Å; D671-L674 PolarHBondContact O-N 3.46Å; F672-L674 VanDerWaalsContact C-N 3.35Å; L674-C677 PolarHBondContact O-N 3.47Å; L674-Q678 WeakPolarHBondContact O-CG 3.24Å; L674-Q678 PolarHBondContact O-N 3.28Å; L674-I728 HydrophobicContact CD1-CB 4.28Å; L674-I728 HydrophobicContact CD1-CD1 4.16Å; L674-I728 HydrophobicContact CD1-CG1 3.83Å; L674-I728 HydrophobicContact CD1-CG2 3.8Å; L674-I728 HydrophobicContact CD2-CG2 3.68Å; L674-I728 HydrophobicContact CG-CG2 4.41Å
675	I	64.7	Low	62.9	Low	72 Å²	72	74.3 Å²	74.3	37%	0.369	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-43.3	177.7	-69.6	163.9	0	0	0	110.4	D671 F672 Q678 M679	D671-I675 WeakPolarHBondContact O-CB 3.34Å; D671-I675 WeakPolarHBondContact O-CD1 3.38Å; D671-I675 WeakPolarHBondContact O-CG1 3.46Å; D671-I675 PolarHBondContact O-N 3.37Å; F672-I675 PolarHBondContact O-N 3.3Å; I675-Q678 PolarHBondContact O-N 3.24Å; I675-M679 HydrophobicContact CG2-CE 4.38Å; I675-M679 HydrophobicContact CG2-CG 4.17Å; I675-M679 WeakPolarHBondContact O-CB 3.44Å; I675-M679 WeakPolarHBondContact O-CG 3.22Å; I675-M679 PolarHBondContact O-N 2.83Å
676	I	68.3	Low	61.5	Low	102 Å²	102	77.1 Å²	77.1	52%	0.523	41%	0.408	S	S	.	.	H	α-helix	trans	-62.5	-44.9	177.1	-71.9	165.3	0	0	0	110.3	F672 I673 Q678 M679 T680	F672-I676 VanDerWaalsContact O-CB 3.24Å; F672-I676 WeakPolarHBondContact O-CB 3.29Å; F672-I676 WeakPolarHBondContact O-CD1 3.21Å; F672-I676 WeakPolarHBondContact O-CG1 3.44Å; F672-I676 PolarHBondContact O-N 2.98Å; I673-I676 PolarHBondContact O-N 3.31Å; I676-Q678 PolarHBondContact O-N 2.98Å; I676-M679 PolarHBondContact O-N 3.13Å; I676-T680 HydrophobicContact CG2-CG2 4.42Å; I676-T680 WeakPolarHBondContact O-CG2 3.43Å; I676-T680 PolarHBondContact O-N 2.82Å; I676-T680 PolarHBondContact O-OG1 2.79Å; I676-T680 VanDerWaalsContact O-OG1 3.06Å
677	C	62.1	Low	60	Low	62 Å²	62	84.6 Å²	84.6	42%	0.419	45%	0.448	S	S	.	.	H	α-helix	trans	-56.8	-49.1	174.5	-73	0	0	0	0	111.7	I673 L674 M679 T680 S681	I673-C677 WeakPolarHBondContact O-CB 3.13Å; I673-C677 PolarHBondContact O-N 2.98Å; I673-C677 PolarHBondContact O-SG 3.31Å; L674-C677 PolarHBondContact O-N 3.47Å; C677-M679 VanDerWaalsContact C-N 3.34Å; C677-M679 PolarHBondContact O-N 3.29Å; C677-T680 WeakPolarHBondContact CA-OG1 3.22Å; C677-T680 PolarHBondContact O-N 3.36Å; C677-T680 PolarHBondContact O-OG1 3.38Å; C677-S681 PolarHBondContact O-N 2.65Å; C677-S681 PolarHBondContact O-OG 2.82Å
678	Q	60	Low	58.6	Low	93 Å²	93	87.8 Å²	87.8	44%	0.435	47%	0.465	S	S	.	.	H	α-helix	trans	-61.3	-38.8	177.4	-73.3	174.8	-18.8	0	0	112.6	L674 I675 I676 S681 M682	L674-Q678 WeakPolarHBondContact O-CG 3.24Å; L674-Q678 PolarHBondContact O-N 3.28Å; I675-Q678 PolarHBondContact O-N 3.24Å; I676-Q678 PolarHBondContact O-N 2.98Å; Q678-S681 WeakPolarHBondContact CA-OG 3.39Å; Q678-S681 PolarHBondContact O-N 2.91Å; Q678-S681 PolarHBondContact O-OG 2.95Å; Q678-M682 WeakPolarHBondContact O-CG 3.32Å; Q678-M682 PolarHBondContact O-N 3.34Å
679	M	60	Low	56.9	Low	113 Å²	113	92.1 Å²	92.1	56%	0.557	49%	0.489	S	S	*	.	H	α-helix	trans	-71.4	-36.7	175.5	-66.6	-68.4	168.4	0	0	111.7	I675 I676 C677 S681 M682 I683	I675-M679 HydrophobicContact CG2-CE 4.38Å; I675-M679 HydrophobicContact CG2-CG 4.17Å; I675-M679 WeakPolarHBondContact O-CB 3.44Å; I675-M679 WeakPolarHBondContact O-CG 3.22Å; I675-M679 PolarHBondContact O-N 2.83Å; I676-M679 PolarHBondContact O-N 3.13Å; C677-M679 VanDerWaalsContact C-N 3.34Å; C677-M679 PolarHBondContact O-N 3.29Å; M679-S681 VanDerWaalsContact C-N 3.32Å; M679-S681 PolarHBondContact O-N 2.83Å; M679-M682 WeakPolarHBondContact O-CA 3.14Å; M679-M682 WeakPolarHBondContact O-CB 3.4Å; M679-M682 PolarHBondContact O-N 3.01Å; M679-I683 WeakPolarHBondContact O-CG1 3.44Å; M679-I683 PolarHBondContact O-N 2.82Å
680	T	59.4	Low	55.5	Low	67 Å²	67	96.4 Å²	96.4	41%	0.411	51%	0.508	S	S	.	.	H	α-helix	trans	-67.9	-29.1	174.2	48.9	0	0	0	0	113.1	I676 C677 M682 I683	I676-T680 HydrophobicContact CG2-CG2 4.42Å; I676-T680 WeakPolarHBondContact O-CG2 3.43Å; I676-T680 PolarHBondContact O-N 2.82Å; I676-T680 PolarHBondContact O-OG1 2.79Å; I676-T680 VanDerWaalsContact O-OG1 3.06Å; C677-T680 WeakPolarHBondContact CA-OG1 3.22Å; C677-T680 PolarHBondContact O-N 3.36Å; C677-T680 PolarHBondContact O-OG1 3.38Å; T680-M682 VanDerWaalsContact C-N 3.26Å; T680-M682 PolarHBondContact O-N 2.9Å; T680-I683 PolarHBondContact O-N 2.64Å
681	S	53.1	Low	54.1	Low	80 Å²	80	103.8 Å²	103.8	56%	0.559	54%	0.541	S	S	*	.	H	α-helix	trans	-72.5	-15.6	168.8	45.8	0	0	0	0	114	C677 Q678 M679	C677-S681 PolarHBondContact O-N 2.65Å; C677-S681 PolarHBondContact O-OG 2.82Å; Q678-S681 WeakPolarHBondContact CA-OG 3.39Å; Q678-S681 PolarHBondContact O-N 2.91Å; Q678-S681 PolarHBondContact O-OG 2.95Å; M679-S681 VanDerWaalsContact C-N 3.32Å; M679-S681 PolarHBondContact O-N 2.83Å
682	M	48.9	Very low	53.1	Low	159 Å²	159	105.1 Å²	105.1	78%	0.783	55%	0.55	S	S	*	*	H	α-helix	trans	-91	-22.1	173.5	-68.2	-83	-71.9	0	0	112.9	Q678 M679 T680 N684	Q678-M682 WeakPolarHBondContact O-CG 3.32Å; Q678-M682 PolarHBondContact O-N 3.34Å; M679-M682 WeakPolarHBondContact O-CA 3.14Å; M679-M682 WeakPolarHBondContact O-CB 3.4Å; M679-M682 PolarHBondContact O-N 3.01Å; T680-M682 VanDerWaalsContact C-N 3.26Å; T680-M682 PolarHBondContact O-N 2.9Å; M682-N684 PolarHBondContact O-N 3.11Å
683	I	53.8	Low	51.9	Low	103 Å²	103	106.1 Å²	106.1	53%	0.528	56%	0.56	S	S	.	*	S	Bend	trans	-88.4	108.3	178.5	-60.8	164	0	0	0	108.5	M679 T680 L685	M679-I683 WeakPolarHBondContact O-CG1 3.44Å; M679-I683 PolarHBondContact O-N 2.82Å; T680-I683 PolarHBondContact O-N 2.64Å; I683-L685 VanDerWaalsContact C-N 3.3Å; I683-L685 HydrophobicContact CG2-CD1 4.48Å; I683-L685 HydrophobicContact CG2-CG 4.07Å; I683-L685 PolarHBondContact O-N 3.1Å
684	N	38.6	Very low	50.9	Low	121 Å²	121	109.5 Å²	109.5	65%	0.647	57%	0.572	S	S	*	*			trans	-69.2	78.1	-177.7	-173.1	17.2	0	0	0	112.9	M682 Q686	M682-N684 PolarHBondContact O-N 3.11Å; N684-Q686 PolarHBondContact ND2-OE1 3.42Å; N684-Q686 PolarHBondContact O-N 3.4Å; N684-Q686 VanDerWaalsContact OD1-CG 3.28Å; N684-Q686 WeakPolarHBondContact OD1-CG 3.31Å; N684-Q686 PolarHBondContact OD1-OE1 2.88Å
685	L	41.9	Very low	50.1	Low	109 Å²	109	113 Å²	113	57%	0.571	59%	0.59	S	S	*	*			trans	-80	47.7	179.4	-83.8	168.2	0	0	0	113.4	I683 N687 V688	I683-L685 VanDerWaalsContact C-N 3.3Å; I683-L685 HydrophobicContact CG2-CD1 4.48Å; I683-L685 HydrophobicContact CG2-CG 4.07Å; I683-L685 PolarHBondContact O-N 3.1Å; L685-N687 PolarHBondContact O-N 3.47Å; L685-V688 HydrophobicContact CD2-CB 4.32Å; L685-V688 HydrophobicContact CD2-CG2 3.72Å
686	Q	46.8	Very low	49	Very low	153 Å²	153	115 Å²	115	72%	0.715	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-6.2	174.8	-92.7	173.7	-40.8	0	0	115	N684	N684-Q686 PolarHBondContact ND2-OE1 3.42Å; N684-Q686 PolarHBondContact O-N 3.4Å; N684-Q686 VanDerWaalsContact OD1-CG 3.28Å; N684-Q686 WeakPolarHBondContact OD1-CG 3.31Å; N684-Q686 PolarHBondContact OD1-OE1 2.88Å
687	N	42.7	Very low	47.8	Very low	158 Å²	158	117.8 Å²	117.8	85%	0.845	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	15.8	-169.8	-76.7	-35.2	0	0	0	115.8	L685	L685-N687 PolarHBondContact O-N 3.47Å
688	V	45.5	Very low	46.8	Very low	84 Å²	84	117.4 Å²	117.4	51%	0.509	60%	0.6	S	S	.	*			trans	-121.5	91.4	176.6	-177.3	0	0	0	0	111.3	L685 I690	L685-V688 HydrophobicContact CD2-CB 4.32Å; L685-V688 HydrophobicContact CD2-CG2 3.72Å; V688-I690 VanDerWaalsContact C-N 3.28Å; V688-I690 PolarHBondContact O-N 3.46Å
689	N	37.6	Very low	45.7	Very low	158 Å²	158	116.4 Å²	116.4	85%	0.845	60%	0.597	S	S	*	*			trans	-85.4	57.4	-170.3	-154.9	0.9	0	0	0	112.8
690	I	45.8	Very low	44.5	Very low	132 Å²	132	119.7 Å²	119.7	68%	0.677	61%	0.605	S	S	*	*	S	Bend	trans	-137	113.7	-176.6	-53.9	-179.6	0	0	0	110.6	V688	V688-I690 VanDerWaalsContact C-N 3.28Å; V688-I690 PolarHBondContact O-N 3.46Å
691	H	41.2	Very low	43.6	Very low	174 Å²	174	119.7 Å²	119.7	81%	0.806	60%	0.604	S	S	*	*			trans	66.4	40	168.9	-98.7	-76.7	0	0	0	118.4	N693	H691-N693 PolarHBondContact O-N 2.9Å
692	T	44.5	Very low	42.8	Very low	58 Å²	58	120.2 Å²	120.2	36%	0.356	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-61.3	-30.6	-179.3	52.6	0	0	0	0	116.2	F694 I695 E696	T692-F694 PolarHBondContact O-N 3.17Å; T692-I695 PolarHBondContact O-N 3.38Å; T692-E696 PolarHBondContact O-N 2.88Å; T692-E696 VanDerWaalsContact O-N 3.12Å; T692-E696 PolarHBondContact OG1-OE2 2.73Å
693	N	43.9	Very low	42.2	Very low	121 Å²	121	116.9 Å²	116.9	65%	0.647	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-52.4	-18.8	-168.1	-65.4	13.7	0	0	0	117.4	H691	H691-N693 PolarHBondContact O-N 2.9Å
694	F	46.8	Very low	41.3	Very low	155 Å²	155	115.7 Å²	115.7	68%	0.68	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-94.5	-34.2	176.3	-167.5	-102.9	0	0	0	112.8	T692 L698	T692-F694 PolarHBondContact O-N 3.17Å; F694-L698 HydrophobicContact CD1-CD1 3.93Å; F694-L698 HydrophobicContact CE1-CD1 3.68Å; F694-L698 HydrophobicContact CZ-CD1 4.44Å; F694-L698 PolarHBondContact O-N 2.79Å
695	I	45.9	Very low	41.2	Very low	98 Å²	98	113 Å²	113	50%	0.503	58%	0.575	S	S	.	*	H	α-helix	trans	-78.4	-38.2	-178.4	-62.1	178.7	0	0	0	110.4	T692 K697 L698 N699	T692-I695 PolarHBondContact O-N 3.38Å; I695-K697 VanDerWaalsContact C-N 3.29Å; I695-K697 PolarHBondContact O-N 3.31Å; I695-L698 PolarHBondContact O-N 3.17Å; I695-L698 VanDerWaalsContact O-N 3.1Å; I695-N699 PolarHBondContact O-N 3.06Å
696	E	42.4	Very low	40.7	Very low	114 Å²	114	113.9 Å²	113.9	53%	0.533	58%	0.58	S	S	.	*	H	α-helix	trans	-59.1	-41	173.2	-70.5	177.3	120.4	0	0	111.8	T692 L698 N699 Y700	T692-E696 PolarHBondContact O-N 2.88Å; T692-E696 VanDerWaalsContact O-N 3.12Å; T692-E696 PolarHBondContact OG1-OE2 2.73Å; E696-L698 VanDerWaalsContact C-N 3.29Å; E696-L698 PolarHBondContact O-N 3.15Å; E696-N699 PolarHBondContact O-N 3.17Å; E696-Y700 WeakPolarHBondContact O-CB 3.08Å; E696-Y700 PolarHBondContact O-N 3.33Å
697	K	42.6	Very low	39.9	Very low	161 Å²	161	112.7 Å²	112.7	70%	0.7	58%	0.578	S	S	*	*	H	α-helix	trans	-66.4	-26.8	176	-76.1	-170	173.4	-171.6	0	114.1	I695 V701	I695-K697 VanDerWaalsContact C-N 3.29Å; I695-K697 PolarHBondContact O-N 3.31Å; K697-V701 WeakPolarHBondContact O-CG2 3.39Å
698	L	40.6	Very low	39.5	Very low	55 Å²	55	110.5 Å²	110.5	29%	0.288	57%	0.571	S	S	.	*	H	α-helix	trans	-80.5	-36.6	173.6	-72	169.4	0	0	0	111.8	F694 I695 E696 L727	F694-L698 HydrophobicContact CD1-CD1 3.93Å; F694-L698 HydrophobicContact CE1-CD1 3.68Å; F694-L698 HydrophobicContact CZ-CD1 4.44Å; F694-L698 PolarHBondContact O-N 2.79Å; I695-L698 PolarHBondContact O-N 3.17Å; I695-L698 VanDerWaalsContact O-N 3.1Å; E696-L698 VanDerWaalsContact C-N 3.29Å; E696-L698 PolarHBondContact O-N 3.15Å; L698-L727 HydrophobicContact CD2-CD2 3.46Å; L698-L727 VanDerWaalsContact CD2-CD2 3.46Å
699	N	38.6	Very low	39	Very low	72 Å²	72	113.6 Å²	113.6	39%	0.385	58%	0.58	S	S	.	*	H	α-helix	trans	-71.5	-36.9	176.7	-75.5	-9.5	0	0	0	112.5	I695 E696 V701 N702 V703	I695-N699 PolarHBondContact O-N 3.06Å; E696-N699 PolarHBondContact O-N 3.17Å; N699-V701 PolarHBondContact O-N 3.42Å; N699-N702 PolarHBondContact O-N 3.12Å; N699-V703 WeakPolarHBondContact O-CG2 3.11Å; N699-V703 PolarHBondContact O-N 2.74Å; N699-V703 VanDerWaalsContact O-N 3.08Å
700	Y	34.8	Very low	38.8	Very low	181 Å²	181	114.3 Å²	114.3	71%	0.71	58%	0.583	S	S	*	*	H	α-helix	trans	-58.1	-38	178.4	-145.3	-82.7	0	0	0	112.2	E696 N702 V703 S704	E696-Y700 WeakPolarHBondContact O-CB 3.08Å; E696-Y700 PolarHBondContact O-N 3.33Å; Y700-N702 VanDerWaalsContact C-N 3.34Å; Y700-N702 PolarHBondContact O-N 2.85Å; Y700-V703 PolarHBondContact O-N 3.14Å; Y700-S704 WeakPolarHBondContact O-CB 3.34Å; Y700-S704 PolarHBondContact O-N 3.42Å; Y700-S704 PolarHBondContact O-OG 3.27Å
701	V	40	Very low	38.1	Very low	67 Å²	67	118 Å²	118	41%	0.406	59%	0.59	S	S	.	*	H	α-helix	trans	-67.5	-30.5	176.8	174.7	0	0	0	0	112.7	K697 N699	K697-V701 WeakPolarHBondContact O-CG2 3.39Å; N699-V701 PolarHBondContact O-N 3.42Å
702	N	36.4	Very low	37.7	Very low	91 Å²	91	117.3 Å²	117.3	49%	0.487	59%	0.592	S	S	.	*	H	α-helix	trans	-82	-20.1	175.6	-70.6	-27.9	0	0	0	113	N699 Y700	N699-N702 PolarHBondContact O-N 3.12Å; Y700-N702 VanDerWaalsContact C-N 3.34Å; Y700-N702 PolarHBondContact O-N 2.85Å
703	V	36.2	Very low	37.3	Very low	89 Å²	89	117 Å²	117	54%	0.539	60%	0.599	S	S	.	*	H	α-helix	trans	-91.4	-39.1	-179.2	174.2	0	0	0	0	111.5	N699 Y700 M705 N706	N699-V703 WeakPolarHBondContact O-CG2 3.11Å; N699-V703 PolarHBondContact O-N 2.74Å; N699-V703 VanDerWaalsContact O-N 3.08Å; Y700-V703 PolarHBondContact O-N 3.14Å; V703-M705 PolarHBondContact O-N 2.95Å; V703-N706 PolarHBondContact O-N 3.3Å
704	S	33.9	Very low	36.9	Very low	78 Å²	78	119.4 Å²	119.4	55%	0.545	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.2	28.2	-178.2	74.5	0	0	0	0	115	Y700	Y700-S704 WeakPolarHBondContact O-CB 3.34Å; Y700-S704 PolarHBondContact O-N 3.42Å; Y700-S704 PolarHBondContact O-OG 3.27Å
705	M	36.6	Very low	36.3	Very low	66 Å²	66	116.9 Å²	116.9	33%	0.325	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-126.9	-9.3	-178.7	-75.5	-178.7	158.2	0	0	113.8	V703 N724	V703-M705 PolarHBondContact O-N 2.95Å; M705-N724 HydrophobicContact CE-CB 3.77Å
706	N	32.6	Very low	35.5	Very low	126 Å²	126	122.1 Å²	122.1	67%	0.674	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	-18.5	177.6	-70.8	-20.2	0	0	0	113.6	V703	V703-N706 PolarHBondContact O-N 3.3Å
707	D	30	Very low	35.3	Very low	129 Å²	129	124 Å²	124	69%	0.69	63%	0.628	S	S	*	*			trans	-103.7	30.7	-165.5	-64.3	-33.4	0	0	0	114.7	Q709	D707-Q709 PolarHBondContact O-N 3.37Å
708	T	33.1	Very low	34.8	Very low	112 Å²	112	122 Å²	122	69%	0.687	62%	0.622	S	S	*	*			trans	-96.4	54.8	166.8	57	0	0	0	0	111.7	L710	T708-L710 VanDerWaalsContact C-N 3.35Å; T708-L710 PolarHBondContact O-N 2.85Å; T708-L710 VanDerWaalsContact O-N 3.13Å
709	Q	34.7	Very low	34.6	Very low	149 Å²	149	125.2 Å²	125.2	70%	0.696	64%	0.638	S	S	*	*			trans	-79.7	84.4	166.7	-67.3	-161.9	20.8	0	0	110	D707 Y711	D707-Q709 PolarHBondContact O-N 3.37Å; Q709-Y711 PolarHBondContact O-N 3.42Å
710	L	33.4	Very low	34.7	Very low	172 Å²	172	129.1 Å²	129.1	90%	0.901	65%	0.647	S	S	*	*			trans	-70.4	108.4	164.6	-90.5	163.2	0	0	0	108.9	T708 D712	T708-L710 VanDerWaalsContact C-N 3.35Å; T708-L710 PolarHBondContact O-N 2.85Å; T708-L710 VanDerWaalsContact O-N 3.13Å; L710-D712 PolarHBondContact O-N 3.28Å
711	Y	31.2	Very low	34.9	Very low	211 Å²	211	125.5 Å²	125.5	83%	0.827	65%	0.646	S	S	*	*			trans	-72.4	112.2	171.3	-88.6	-106.6	0	0	0	109.8	Q709	Q709-Y711 PolarHBondContact O-N 3.42Å
712	D	33.5	Very low	35	Very low	159 Å²	159	125.8 Å²	125.8	85%	0.85	65%	0.645	S	S	*	*			trans	-134.7	165.9	160.4	-157.6	-5.4	0	0	0	109.4	L710	L710-D712 PolarHBondContact O-N 3.28Å
713	G	35.2	Very low	35.6	Very low	50 Å²	50	125.8 Å²	125.8	52%	0.515	65%	0.647	S	S	.	*	S	Bend	trans	-60.8	130.8	-159.2	0	0	0	0	0	116.4	N715	G713-N715 PolarHBondContact O-N 3.26Å
714	N	36.2	Very low	35.8	Very low	173 Å²	173	126 Å²	126	93%	0.925	65%	0.645	S	S	*	*	S	Bend	trans	60.9	-18.2	157.9	-64.6	-19.2	0	0	0	120.1
715	N	34.2	Very low	36.7	Very low	102 Å²	102	127.2 Å²	127.2	55%	0.545	64%	0.641	S	S	.	*			trans	-104.4	111.8	-176.9	-73.9	-10.7	0	0	0	113	G713 Y717	G713-N715 PolarHBondContact O-N 3.26Å; N715-Y717 HydrophobicContact CB-CD2 3.96Å; N715-Y717 HydrophobicContact CB-CE2 3.36Å; N715-Y717 PolarHBondContact ND2-OH 3.36Å; N715-Y717 VanDerWaalsContact ND2-OH 3.09Å; N715-Y717 PolarHBondContact O-N 3.49Å
716	K	30.1	Very low	37.6	Very low	207 Å²	207	126.6 Å²	126.6	90%	0.9	64%	0.639	S	S	*	*			trans	-72.9	92.2	169.2	-78.7	-172.3	174.9	-177.1	0	111.2
717	Y	37.5	Very low	38.9	Very low	153 Å²	153	124.1 Å²	124.1	60%	0.6	63%	0.626	S	S	*	*			trans	-87.9	112.7	164.6	-62.5	-71.3	0	0	0	110.1	N715 I719	N715-Y717 HydrophobicContact CB-CD2 3.96Å; N715-Y717 HydrophobicContact CB-CE2 3.36Å; N715-Y717 PolarHBondContact ND2-OH 3.36Å; N715-Y717 VanDerWaalsContact ND2-OH 3.09Å; N715-Y717 PolarHBondContact O-N 3.49Å; Y717-I719 VanDerWaalsContact C-N 3.26Å; Y717-I719 PolarHBondContact O-N 2.92Å
718	E	31.3	Very low	40.4	Very low	119 Å²	119	119.6 Å²	119.6	56%	0.556	60%	0.601	S	S	*	*			trans	-67.7	88.6	162.9	-82.1	-164.6	176	0	0	108.6	R720	E718-R720 PolarHBondContact O-N 3.21Å; E718-R720 IonicContact OE2-CZ 3.4Å; E718-R720 IonicContact OE2-NE 2.64Å; E718-R720 PolarHBondContact OE2-NE 3.1Å; E718-R720 IonicContact OE2-NH2 3.58Å; E718-R720 PolarHBondContact OE2-NH2 3.4Å
719	I	37.8	Very low	41.9	Very low	123 Å²	123	114.6 Å²	114.6	63%	0.631	57%	0.571	S	S	*	*			trans	-70.6	80.9	166.1	-52.9	178.7	0	0	0	107.4	Y717	Y717-I719 VanDerWaalsContact C-N 3.26Å; Y717-I719 PolarHBondContact O-N 2.92Å
720	R	39.5	Very low	43.5	Very low	155 Å²	155	112.1 Å²	112.1	59%	0.585	56%	0.562	S	S	*	*			trans	-55.1	137.2	162.2	-68.4	179.3	178	-106.5	-18.7	107.1	E718 I722	E718-R720 PolarHBondContact O-N 3.21Å; E718-R720 IonicContact OE2-CZ 3.4Å; E718-R720 IonicContact OE2-NE 2.64Å; E718-R720 PolarHBondContact OE2-NE 3.1Å; E718-R720 IonicContact OE2-NH2 3.58Å; E718-R720 PolarHBondContact OE2-NH2 3.4Å; R720-I722 PolarHBondContact O-N 3.46Å
721	P	39.2	Very low	45	Very low	105 Å²	105	106.6 Å²	106.6	68%	0.682	53%	0.533	S	S	*	.			trans	-61.1	105.9	-175.5	23.1	-32.7	0	0	0	109.8
722	I	42.4	Very low	46.7	Very low	73 Å²	73	97.5 Å²	97.5	37%	0.374	50%	0.498	S	S	.	.			trans	-38.5	142	156	-60.6	176.6	0	0	0	107.5	R720 N724 D787	R720-I722 PolarHBondContact O-N 3.46Å; I722-N724 PolarHBondContact O-N 3.07Å; I722-D787 HydrophobicContact CD1-CB 4.05Å; I722-D787 WeakPolarHBondContact CD1-OD2 3.49Å; I722-D787 WeakPolarHBondContact CG1-OD2 3.49Å; I722-D787 WeakPolarHBondContact CG2-OD2 3.27Å
723	V	48.8	Very low	48.6	Very low	90 Å²	90	92.5 Å²	92.5	55%	0.545	47%	0.47	S	S	.	.			trans	-68	71.5	-164.1	-166.8	0	0	0	0	112.9	F725	V723-F725 PolarHBondContact O-N 2.65Å
724	N	40.6	Very low	50.2	Low	93 Å²	93	95.4 Å²	95.4	50%	0.497	47%	0.471	S	S	.	.			trans	-51.6	119.1	153.2	-80.7	-40.3	0	0	0	106.1	M705 I722 N726	M705-N724 HydrophobicContact CE-CB 3.77Å; I722-N724 PolarHBondContact O-N 3.07Å; N724-N726 PolarHBondContact O-N 2.79Å
725	F	53.2	Low	51.9	Low	104 Å²	104	87.6 Å²	87.6	46%	0.456	43%	0.429	S	S	.	.			trans	-67	83.1	171.7	-101.7	-99.9	0	0	0	108.3	V723 M733 V780	V723-F725 PolarHBondContact O-N 2.65Å; F725-M733 HydrophobicContact CE1-CG 4.42Å; F725-V780 HydrophobicContact CE2-CG1 4.08Å; F725-V780 HydrophobicContact CZ-CG1 4.48Å
726	N	56.1	Low	53.8	Low	54 Å²	54	85 Å²	85	29%	0.289	42%	0.415	S	S	.	.			trans	-49.5	147.3	176.1	-74.9	-16.9	0	0	0	109	N724 I728 S729 L730	N724-N726 PolarHBondContact O-N 2.79Å; N726-I728 HydrophobicContact CB-CB 4.31Å; N726-I728 CarbonylContact O-C 3.59Å; N726-I728 PolarHBondContact O-N 3.49Å; N726-S729 PolarHBondContact O-N 3Å; N726-L730 PolarHBondContact O-N 2.85Å; N726-L730 VanDerWaalsContact O-N 3.12Å
727	L	58.9	Low	55.7	Low	74 Å²	74	76.9 Å²	76.9	39%	0.387	39%	0.387	S	S	.	.	H	α-helix	trans	-50.7	-31.8	176.1	-176.4	61.6	0	0	0	111.3	L698 L730 L731	L698-L727 HydrophobicContact CD2-CD2 3.46Å; L698-L727 VanDerWaalsContact CD2-CD2 3.46Å; L727-L730 PolarHBondContact O-N 3.25Å; L727-L731 HydrophobicContact CG-CD1 4.02Å; L727-L731 HydrophobicContact CG-CG 4.41Å; L727-L731 VanDerWaalsContact O-CB 3.3Å; L727-L731 WeakPolarHBondContact O-CB 3.33Å; L727-L731 WeakPolarHBondContact O-CD1 3.44Å; L727-L731 WeakPolarHBondContact O-CG 3.44Å; L727-L731 PolarHBondContact O-N 2.97Å
728	I	62.7	Low	57.3	Low	33 Å²	33	69.9 Å²	69.9	17%	0.169	36%	0.359	C	S	.	.	H	α-helix	trans	-54.9	-53.6	170	-53	-178.7	0	0	0	112.8	H607 L674 N726 L730 L731 Q732	H607-I728 WeakPolarHBondContact CE1-CG2 3.48Å; L674-I728 HydrophobicContact CD1-CB 4.28Å; L674-I728 HydrophobicContact CD1-CD1 4.16Å; L674-I728 HydrophobicContact CD1-CG1 3.83Å; L674-I728 HydrophobicContact CD1-CG2 3.8Å; L674-I728 HydrophobicContact CD2-CG2 3.68Å; L674-I728 HydrophobicContact CG-CG2 4.41Å; N726-I728 HydrophobicContact CB-CB 4.31Å; N726-I728 CarbonylContact O-C 3.59Å; N726-I728 PolarHBondContact O-N 3.49Å; I728-L730 VanDerWaalsContact C-N 3.35Å; I728-L731 PolarHBondContact O-N 2.96Å; I728-Q732 WeakPolarHBondContact O-CG 3.4Å; I728-Q732 PolarHBondContact O-N 3.12Å
729	S	64.1	Low	59.3	Low	7 Å²	7	65.9 Å²	65.9	5%	0.049	34%	0.341	C	S	.	.	H	α-helix	trans	-66.9	-36.3	-179.3	-54.8	0	0	0	0	111.6	H607 N726 Q732 M733	H607-S729 PolarHBondContact NE2-OG 2.76Å; N726-S729 PolarHBondContact O-N 3Å; S729-Q732 PolarHBondContact O-N 2.79Å; S729-M733 VanDerWaalsContact O-CG 3.25Å; S729-M733 WeakPolarHBondContact O-CG 3.32Å; S729-M733 PolarHBondContact O-N 3.35Å
730	L	67.1	Low	60.8	Low	97 Å²	97	64.3 Å²	64.3	51%	0.508	33%	0.334	S	S	.	.	H	α-helix	trans	-67.1	-41.6	173.4	-175.1	64.2	0	0	0	112	N726 L727 I728 Q732 M733 M734	N726-L730 PolarHBondContact O-N 2.85Å; N726-L730 VanDerWaalsContact O-N 3.12Å; L727-L730 PolarHBondContact O-N 3.25Å; I728-L730 VanDerWaalsContact C-N 3.35Å; L730-Q732 VanDerWaalsContact C-N 3.34Å; L730-M733 WeakPolarHBondContact O-CB 3.27Å; L730-M733 PolarHBondContact O-N 3.17Å; L730-M734 PolarHBondContact O-N 3Å; L730-M734 VanDerWaalsContact O-N 3.08Å
731	L	65.5	Low	62.1	Low	56 Å²	56	57.4 Å²	57.4	29%	0.293	31%	0.308	S	S	.	.	H	α-helix	trans	-63.2	-38.9	172.7	-74.6	167.1	0	0	0	111.5	V670 L727 I728 M734	V670-L731 HydrophobicContact CG1-CB 3.99Å; L727-L731 HydrophobicContact CG-CD1 4.02Å; L727-L731 HydrophobicContact CG-CG 4.41Å; L727-L731 VanDerWaalsContact O-CB 3.3Å; L727-L731 WeakPolarHBondContact O-CB 3.33Å; L727-L731 WeakPolarHBondContact O-CD1 3.44Å; L727-L731 WeakPolarHBondContact O-CG 3.44Å; L727-L731 PolarHBondContact O-N 2.97Å; I728-L731 PolarHBondContact O-N 2.96Å; L731-M734 HydrophobicContact CD2-SD 3.98Å; L731-M734 VanDerWaalsContact O-CB 3.28Å; L731-M734 WeakPolarHBondContact O-CB 3.28Å; L731-M734 PolarHBondContact O-N 2.93Å; L731-M734 VanDerWaalsContact O-N 3.11Å
732	Q	67.5	Low	63.6	Low	20 Å²	20	55.6 Å²	55.6	9%	0.093	29%	0.292	C	S	.	.	H	α-helix	trans	-66.4	-36.6	172.5	-73.4	176.5	-6.7	0	0	112.2	V602 H607 I728 S729 L730 M734 K735	V602-Q732 HydrophobicContact CG2-CB 3.67Å; H607-Q732 PolarHBondContact CE1-NE2 3.15Å; H607-Q732 PolarHBondContact CE1-OE1 3.41Å; I728-Q732 WeakPolarHBondContact O-CG 3.4Å; I728-Q732 PolarHBondContact O-N 3.12Å; S729-Q732 PolarHBondContact O-N 2.79Å; L730-Q732 VanDerWaalsContact C-N 3.34Å; Q732-M734 PolarHBondContact O-N 3.08Å; Q732-K735 WeakPolarHBondContact O-CB 3.5Å; Q732-K735 WeakPolarHBondContact O-CG 3.46Å; Q732-K735 PolarHBondContact O-N 3.45Å
733	M	73.1	Confident	64.7	Low	55 Å²	55	53.7 Å²	53.7	27%	0.271	29%	0.287	S	S	.	.	H	α-helix	trans	-60.2	-31.1	170	-67.2	-101	74.5	0	0	112	V602 F725 S729 L730 K735 L736	V602-M733 HydrophobicContact CB-CE 4.3Å; V602-M733 HydrophobicContact CG1-CE 4.03Å; V602-M733 HydrophobicContact CG1-CG 4.02Å; V602-M733 HydrophobicContact CG1-SD 4.13Å; V602-M733 HydrophobicContact CG2-CE 4.36Å; F725-M733 HydrophobicContact CE1-CG 4.42Å; S729-M733 VanDerWaalsContact O-CG 3.25Å; S729-M733 WeakPolarHBondContact O-CG 3.32Å; S729-M733 PolarHBondContact O-N 3.35Å; L730-M733 WeakPolarHBondContact O-CB 3.27Å; L730-M733 PolarHBondContact O-N 3.17Å; M733-K735 PolarHBondContact O-N 2.73Å; M733-K735 VanDerWaalsContact O-N 3.17Å; M733-L736 HydrophobicContact CE-CD1 3.64Å; M733-L736 HydrophobicContact CE-CG 4.33Å; M733-L736 VanDerWaalsContact O-CB 3.3Å; M733-L736 WeakPolarHBondContact O-CB 3.47Å; M733-L736 PolarHBondContact O-N 3.29Å
734	M	68.9	Low	65.5	Low	110 Å²	110	51 Å²	51	54%	0.542	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-63.2	-16.3	171.9	-61.3	179.7	63.7	0	0	113.4	L730 L731 Q732 L736 A737	L730-M734 PolarHBondContact O-N 3Å; L730-M734 VanDerWaalsContact O-N 3.08Å; L731-M734 HydrophobicContact CD2-SD 3.98Å; L731-M734 VanDerWaalsContact O-CB 3.28Å; L731-M734 WeakPolarHBondContact O-CB 3.28Å; L731-M734 PolarHBondContact O-N 2.93Å; L731-M734 VanDerWaalsContact O-N 3.11Å; Q732-M734 PolarHBondContact O-N 3.08Å; M734-L736 PolarHBondContact O-N 3.35Å; M734-A737 WeakPolarHBondContact O-CB 3.43Å; M734-A737 PolarHBondContact O-N 3.28Å
735	K	70.9	Confident	66.6	Low	9 Å²	9	47.3 Å²	47.3	4%	0.039	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-58.4	-25.7	167	-66.9	-180	169.9	-175.7	0	111.8	V598 D618 D671 Q732 M733 A737 R738	V598-K735 HydrophobicContact CB-CB 4.48Å; V598-K735 HydrophobicContact CG1-CB 3.83Å; V598-K735 HydrophobicContact CG2-CB 3.77Å; V598-K735 HydrophobicContact CG2-CD 3.94Å; D618-K735 IonicContact OD2-NZ 2.75Å; D618-K735 PolarHBondContact OD2-NZ 2.99Å; D671-K735 VanDerWaalsContact CG-CE 3.42Å; D671-K735 WeakPolarHBondContact OD1-CE 3.24Å; D671-K735 IonicContact OD1-NZ 3.58Å; D671-K735 PolarHBondContact OD1-NZ 2.91Å; D671-K735 WeakPolarHBondContact OD2-CE 3.33Å; D671-K735 IonicContact OD2-NZ 2.83Å; D671-K735 PolarHBondContact OD2-NZ 3.07Å; Q732-K735 WeakPolarHBondContact O-CB 3.5Å; Q732-K735 WeakPolarHBondContact O-CG 3.46Å; Q732-K735 PolarHBondContact O-N 3.45Å; M733-K735 PolarHBondContact O-N 2.73Å; M733-K735 VanDerWaalsContact O-N 3.17Å; K735-A737 PolarHBondContact O-N 2.89Å; K735-R738 WeakPolarHBondContact O-CB 3.16Å; K735-R738 WeakPolarHBondContact O-CD 3.36Å; K735-R738 WeakPolarHBondContact O-CG 3.37Å; K735-R738 PolarHBondContact O-N 2.79Å
736	L	74.8	Confident	67.3	Low	48 Å²	48	45.8 Å²	45.8	25%	0.251	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-66.6	-18	173.9	-62.4	-178.8	0	0	0	113.3	V598 P599 M733 M734 R738 L739	V598-L736 HydrophobicContact CB-CD2 3.84Å; V598-L736 HydrophobicContact CG1-CD2 3.6Å; V598-L736 HydrophobicContact CG1-CG 3.83Å; P599-L736 HydrophobicContact CG-CD2 4.11Å; M733-L736 HydrophobicContact CE-CD1 3.64Å; M733-L736 HydrophobicContact CE-CG 4.33Å; M733-L736 VanDerWaalsContact O-CB 3.3Å; M733-L736 WeakPolarHBondContact O-CB 3.47Å; M733-L736 PolarHBondContact O-N 3.29Å; M734-L736 PolarHBondContact O-N 3.35Å; L736-R738 PolarHBondContact O-N 2.87Å; L736-R738 VanDerWaalsContact O-N 3.08Å; L736-L739 HydrophobicContact CB-CD1 4.38Å; L736-L739 HydrophobicContact CD2-CD1 3.98Å; L736-L739 VanDerWaalsContact O-CB 3.25Å; L736-L739 WeakPolarHBondContact O-CB 3.4Å; L736-L739 VanDerWaalsContact O-CG 3.31Å; L736-L739 WeakPolarHBondContact O-CG 3.37Å; L736-L739 PolarHBondContact O-N 3.46Å
737	A	69.6	Low	67.5	Low	36 Å²	36	49.2 Å²	49.2	30%	0.298	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-60	-18.9	168.6	0	0	0	0	0	112.4	M734 K735 L739 L740	M734-A737 WeakPolarHBondContact O-CB 3.43Å; M734-A737 PolarHBondContact O-N 3.28Å; K735-A737 PolarHBondContact O-N 2.89Å; A737-L739 PolarHBondContact O-N 3.33Å; A737-L740 HydrophobicContact CB-CD1 4.41Å; A737-L740 VanDerWaalsContact O-CB 3.31Å; A737-L740 WeakPolarHBondContact O-CB 3.26Å; A737-L740 WeakPolarHBondContact O-CG 3.12Å; A737-L740 PolarHBondContact O-N 3.43Å; A737-L740 VanDerWaalsContact O-N 3.12Å
738	R	72	Confident	67.8	Low	7 Å²	7	49.3 Å²	49.3	3%	0.026	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-60.5	-24.9	171.5	-62.3	173.8	179.8	-177.4	-0.2	112.7	I594 E622 A666 L668 K735 L736 L740 R741	I594-R738 HydrophobicContact CD1-CB 4.15Å; I594-R738 HydrophobicContact CG2-CB 4.14Å; E622-R738 IonicContact OE1-CZ 2.92Å; E622-R738 IonicContact OE1-NH1 3.56Å; E622-R738 PolarHBondContact OE1-NH1 3.4Å; E622-R738 VanDerWaalsContact OE1-NH1 3.12Å; E622-R738 IonicContact OE1-NH2 3.95Å; E622-R738 PolarHBondContact OE1-NH2 2.84Å; A666-R738 WeakPolarHBondContact O-CG 3.1Å; L668-R738 PolarHBondContact O-NH2 2.96Å; K735-R738 WeakPolarHBondContact O-CB 3.16Å; K735-R738 WeakPolarHBondContact O-CD 3.36Å; K735-R738 WeakPolarHBondContact O-CG 3.37Å; K735-R738 PolarHBondContact O-N 2.79Å; L736-R738 PolarHBondContact O-N 2.87Å; L736-R738 VanDerWaalsContact O-N 3.08Å; R738-L740 PolarHBondContact O-N 2.91Å; R738-R741 WeakPolarHBondContact O-CB 3.43Å; R738-R741 WeakPolarHBondContact O-CG 3.42Å; R738-R741 PolarHBondContact O-N 3.43Å
739	L	73.6	Confident	68	Low	35 Å²	35	49.6 Å²	49.6	18%	0.183	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-71.1	-17	177.3	-56.3	177.8	0	0	0	113.3	A595 L736 A737 R741 L742 W773	A595-L739 HydrophobicContact CB-CD1 4.38Å; A595-L739 HydrophobicContact CB-CD2 3.62Å; L736-L739 HydrophobicContact CB-CD1 4.38Å; L736-L739 HydrophobicContact CD2-CD1 3.98Å; L736-L739 VanDerWaalsContact O-CB 3.25Å; L736-L739 WeakPolarHBondContact O-CB 3.4Å; L736-L739 VanDerWaalsContact O-CG 3.31Å; L736-L739 WeakPolarHBondContact O-CG 3.37Å; L736-L739 PolarHBondContact O-N 3.46Å; A737-L739 PolarHBondContact O-N 3.33Å; L739-R741 PolarHBondContact O-N 3.33Å; L739-R741 VanDerWaalsContact O-N 3.12Å; L739-L742 WeakPolarHBondContact O-CB 3.29Å; L739-L742 PolarHBondContact O-N 3.1Å; L739-W773 HydrophobicContact CD1-CH2 3.72Å; L739-W773 HydrophobicContact CD1-CZ2 3.45Å; L739-W773 VanDerWaalsContact CD1-CZ2 3.45Å
740	L	69.5	Low	67.8	Low	90 Å²	90	52.8 Å²	52.8	47%	0.471	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-60.9	-19.4	170.8	-60	174	0	0	0	112	L662 A737 R738 L742 A743	L662-L740 HydrophobicContact CD2-CD1 4.25Å; A737-L740 HydrophobicContact CB-CD1 4.41Å; A737-L740 VanDerWaalsContact O-CB 3.31Å; A737-L740 WeakPolarHBondContact O-CB 3.26Å; A737-L740 WeakPolarHBondContact O-CG 3.12Å; A737-L740 PolarHBondContact O-N 3.43Å; A737-L740 VanDerWaalsContact O-N 3.12Å; R738-L740 PolarHBondContact O-N 2.91Å; L740-L742 PolarHBondContact O-N 3.13Å; L740-A743 VanDerWaalsContact O-CB 3.25Å; L740-A743 WeakPolarHBondContact O-CB 3Å; L740-A743 PolarHBondContact O-N 3.24Å; L740-A743 VanDerWaalsContact O-N 3.12Å
741	R	66.8	Low	67.7	Low	10 Å²	10	56.8 Å²	56.8	4%	0.038	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-61.8	-26.1	169	-69.6	-163.3	174.6	89.9	4.4	113.5	T591 D628 D663 A666 R738 L739 A743 R744 L745	T591-R741 HydrophobicContact CG2-CB 4.2Å; D628-R741 IonicContact OD2-NE 3.79Å; D663-R741 PolarHBondContact O-NH2 2.79Å; A666-R741 HydrophobicContact CB-CG 4.12Å; A666-R741 VanDerWaalsContact CB-NH1 3.3Å; A666-R741 VanDerWaalsContact O-CZ 3.29Å; A666-R741 PolarHBondContact O-NH1 2.98Å; A666-R741 PolarHBondContact O-NH2 3.2Å; R738-R741 WeakPolarHBondContact O-CB 3.43Å; R738-R741 WeakPolarHBondContact O-CG 3.42Å; R738-R741 PolarHBondContact O-N 3.43Å; L739-R741 PolarHBondContact O-N 3.33Å; L739-R741 VanDerWaalsContact O-N 3.12Å; R741-A743 PolarHBondContact O-N 3.31Å; R741-R744 WeakPolarHBondContact O-CB 3.47Å; R741-R744 PolarHBondContact O-N 3.39Å; R741-L745 PolarHBondContact O-N 3.19Å
742	L	69	Low	67.6	Low	66 Å²	66	55.6 Å²	55.6	35%	0.346	27%	0.274	S	S	.	.	H	α-helix	trans	-59.7	-28.6	175.1	-163.2	72.3	0	0	0	111	L588 F592 L739 L740 R744 L745 I746 I749	L588-L742 HydrophobicContact CD1-CD1 3.91Å; F592-L742 HydrophobicContact CE1-CD1 4.24Å; L739-L742 WeakPolarHBondContact O-CB 3.29Å; L739-L742 PolarHBondContact O-N 3.1Å; L740-L742 PolarHBondContact O-N 3.13Å; L742-R744 VanDerWaalsContact C-N 3.32Å; L742-R744 PolarHBondContact O-N 3.29Å; L742-L745 HydrophobicContact CD1-CD1 4.5Å; L742-L745 CarbonylContact O-C 3.55Å; L742-L745 WeakPolarHBondContact O-CA 3.38Å; L742-L745 WeakPolarHBondContact O-CB 3.25Å; L742-L745 PolarHBondContact O-N 3.27Å; L742-I746 PolarHBondContact O-N 2.85Å; L742-I749 HydrophobicContact CD1-CD1 4.28Å
743	A	67	Low	67.5	Low	34 Å²	34	57 Å²	57	28%	0.281	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-33.5	174.3	0	0	0	0	0	113.4	W659 L740 R741 L745 I746	W659-A743 HydrophobicContact CH2-CB 3.97Å; W659-A743 HydrophobicContact CZ3-CB 3.89Å; L740-A743 VanDerWaalsContact O-CB 3.25Å; L740-A743 WeakPolarHBondContact O-CB 3Å; L740-A743 PolarHBondContact O-N 3.24Å; L740-A743 VanDerWaalsContact O-N 3.12Å; R741-A743 PolarHBondContact O-N 3.31Å; A743-L745 VanDerWaalsContact C-N 3.26Å; A743-L745 PolarHBondContact O-N 3.1Å; A743-I746 HydrophobicContact CB-CD1 4.38Å; A743-I746 WeakPolarHBondContact O-CB 3.35Å; A743-I746 PolarHBondContact O-N 2.82Å
744	R	65.2	Low	67.1	Low	34 Å²	34	58.7 Å²	58.7	13%	0.128	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-28.9	169.6	-77.3	-165.8	-81.8	136.5	-13.2	112.5	D628 N632 W659 D663 R741 L742	D628-R744 IonicContact OD1-NH1 3.99Å; D628-R744 PolarHBondContact OD1-NH1 3.49Å; D628-R744 IonicContact OD2-CZ 3.47Å; D628-R744 VanDerWaalsContact OD2-CZ 3.22Å; D628-R744 IonicContact OD2-NH1 3.05Å; D628-R744 PolarHBondContact OD2-NH1 3Å; D628-R744 IonicContact OD2-NH2 3.76Å; D628-R744 PolarHBondContact OD2-NH2 3.18Å; N632-R744 PolarHBondContact ND2-NH1 3.4Å; W659-R744 HydrophobicContact CB-CG 4.46Å; W659-R744 HydrophobicContact CD2-CG 3.53Å; W659-R744 HydrophobicContact CE3-CG 3.37Å; W659-R744 HydrophobicContact CG-CG 4.02Å; W659-R744 HydrophobicContact CH2-CG 4.3Å; W659-R744 HydrophobicContact CZ2-CG 4.43Å; W659-R744 HydrophobicContact CZ3-CG 3.79Å; D663-R744 VanDerWaalsContact CG-CZ 3.42Å; D663-R744 IonicContact OD1-CZ 2.9Å; D663-R744 IonicContact OD1-NE 2.86Å; D663-R744 PolarHBondContact OD1-NE 3.3Å; D663-R744 IonicContact OD1-NH2 2.86Å; D663-R744 PolarHBondContact OD1-NH2 3.14Å; D663-R744 IonicContact OD2-CZ 3.12Å; D663-R744 VanDerWaalsContact OD2-CZ 3.3Å; D663-R744 IonicContact OD2-NE 2.98Å; D663-R744 PolarHBondContact OD2-NE 3.19Å; D663-R744 VanDerWaalsContact OD2-NE 3.11Å; D663-R744 IonicContact OD2-NH2 2.68Å; D663-R744 PolarHBondContact OD2-NH2 3.48Å; R741-R744 WeakPolarHBondContact O-CB 3.47Å; R741-R744 PolarHBondContact O-N 3.39Å; L742-R744 VanDerWaalsContact C-N 3.32Å; L742-R744 PolarHBondContact O-N 3.29Å
745	L	64.3	Low	67.2	Low	15 Å²	15	57.5 Å²	57.5	8%	0.079	28%	0.284	C	S	.	.	H	α-helix	trans	-82.7	-18.9	177.9	-58.3	-177.6	0	0	0	112.5	L588 R741 L742 A743 Q747 K748 I749	L588-L745 HydrophobicContact CB-CD1 3.93Å; L588-L745 HydrophobicContact CD1-CD1 3.61Å; L588-L745 HydrophobicContact CG-CD1 4.36Å; R741-L745 PolarHBondContact O-N 3.19Å; L742-L745 HydrophobicContact CD1-CD1 4.5Å; L742-L745 CarbonylContact O-C 3.55Å; L742-L745 WeakPolarHBondContact O-CA 3.38Å; L742-L745 WeakPolarHBondContact O-CB 3.25Å; L742-L745 PolarHBondContact O-N 3.27Å; A743-L745 VanDerWaalsContact C-N 3.26Å; A743-L745 PolarHBondContact O-N 3.1Å; L745-Q747 VanDerWaalsContact C-N 3.3Å; L745-Q747 PolarHBondContact O-N 2.89Å; L745-K748 HydrophobicContact CD2-CD 4Å; L745-K748 CarbonylContact O-C 3.57Å; L745-K748 WeakPolarHBondContact O-CA 3.17Å; L745-K748 WeakPolarHBondContact O-CB 3.37Å; L745-K748 PolarHBondContact O-N 2.82Å; L745-I749 HydrophobicContact CB-CD1 4.07Å; L745-I749 WeakPolarHBondContact O-CB 3.39Å; L745-I749 WeakPolarHBondContact O-CG1 3.41Å; L745-I749 PolarHBondContact O-N 3.31Å
746	I	67.2	Low	67.2	Low	72 Å²	72	58.1 Å²	58.1	37%	0.369	29%	0.289	S	S	.	.	H	α-helix	trans	-50.3	-46.3	175.9	-70.7	174.9	0	0	0	111.8	L742 A743 K748 I749 I750	L742-I746 PolarHBondContact O-N 2.85Å; A743-I746 HydrophobicContact CB-CD1 4.38Å; A743-I746 WeakPolarHBondContact O-CB 3.35Å; A743-I746 PolarHBondContact O-N 2.82Å; I746-K748 PolarHBondContact O-N 3.3Å; I746-I749 PolarHBondContact O-N 3.22Å; I746-I750 HydrophobicContact CG2-CD1 3.63Å; I746-I750 HydrophobicContact CG2-CG1 4.26Å; I746-I750 WeakPolarHBondContact O-CB 3.37Å; I746-I750 VanDerWaalsContact O-CG1 3.25Å; I746-I750 WeakPolarHBondContact O-CG1 3.3Å; I746-I750 PolarHBondContact O-N 3.44Å
747	Q	59.6	Low	67.2	Low	126 Å²	126	61.4 Å²	61.4	59%	0.589	31%	0.311	S	S	*	.	H	α-helix	trans	-64.8	-24.1	178.9	-67.3	-171.8	-9.3	0	0	113.8	L745	L745-Q747 VanDerWaalsContact C-N 3.3Å; L745-Q747 PolarHBondContact O-N 2.89Å
748	K	65	Low	67.6	Low	75 Å²	75	62.2 Å²	62.2	33%	0.326	31%	0.309	S	S	.	.	H	α-helix	trans	-86.6	-40.5	175.4	-60.1	173.8	-168.1	170.5	0	110.4	D584 L745 I746 I750 R751 L752	D584-K748 HydrophobicContact CB-CD 4.34Å; D584-K748 IonicContact OD1-NZ 3.34Å; D584-K748 PolarHBondContact OD1-NZ 3.17Å; D584-K748 WeakPolarHBondContact OD2-CD 3.44Å; D584-K748 WeakPolarHBondContact OD2-CE 3.43Å; D584-K748 IonicContact OD2-NZ 2.69Å; D584-K748 PolarHBondContact OD2-NZ 3.06Å; L745-K748 HydrophobicContact CD2-CD 4Å; L745-K748 CarbonylContact O-C 3.57Å; L745-K748 WeakPolarHBondContact O-CA 3.17Å; L745-K748 WeakPolarHBondContact O-CB 3.37Å; L745-K748 PolarHBondContact O-N 2.82Å; I746-K748 PolarHBondContact O-N 3.3Å; K748-I750 VanDerWaalsContact C-N 3.3Å; K748-I750 PolarHBondContact O-N 2.83Å; K748-R751 WeakPolarHBondContact O-CB 3.14Å; K748-R751 PolarHBondContact O-N 3.45Å; K748-L752 WeakPolarHBondContact O-CB 3.34Å; K748-L752 PolarHBondContact O-N 2.87Å
749	I	66.5	Low	67.8	Low	39 Å²	39	63.2 Å²	63.2	20%	0.2	32%	0.316	C	S	.	.	H	α-helix	trans	-59.7	-37.3	172.5	-69.1	165.6	0	0	0	111	L742 L745 I746 R751 L752 S753 L762	L742-I749 HydrophobicContact CD1-CD1 4.28Å; L745-I749 HydrophobicContact CB-CD1 4.07Å; L745-I749 WeakPolarHBondContact O-CB 3.39Å; L745-I749 WeakPolarHBondContact O-CG1 3.41Å; L745-I749 PolarHBondContact O-N 3.31Å; I746-I749 PolarHBondContact O-N 3.22Å; I749-R751 VanDerWaalsContact C-N 3.32Å; I749-R751 PolarHBondContact O-N 3.1Å; I749-L752 CarbonylContact O-C 3.59Å; I749-L752 WeakPolarHBondContact O-CA 3.25Å; I749-L752 WeakPolarHBondContact O-CB 3.48Å; I749-L752 PolarHBondContact O-N 2.86Å; I749-L752 VanDerWaalsContact O-N 3.08Å; I749-S753 WeakPolarHBondContact O-CB 3.35Å; I749-S753 PolarHBondContact O-N 3.5Å; I749-S753 PolarHBondContact O-OG 3.38Å; I749-L762 HydrophobicContact CG2-CD1 3.79Å
750	I	61.1	Low	68.2	Low	75 Å²	75	64.1 Å²	64.1	39%	0.385	32%	0.321	S	S	.	.	H	α-helix	trans	-66.4	-30.7	174.1	-70.6	163.9	0	0	0	112.4	P180 I746 K748 S753	P180-I750 HydrophobicContact CG-CD1 3.64Å; P180-I750 HydrophobicContact CG-CG1 4.26Å; I746-I750 HydrophobicContact CG2-CD1 3.63Å; I746-I750 HydrophobicContact CG2-CG1 4.26Å; I746-I750 WeakPolarHBondContact O-CB 3.37Å; I746-I750 VanDerWaalsContact O-CG1 3.25Å; I746-I750 WeakPolarHBondContact O-CG1 3.3Å; I746-I750 PolarHBondContact O-N 3.44Å; K748-I750 VanDerWaalsContact C-N 3.3Å; K748-I750 PolarHBondContact O-N 2.83Å; I750-S753 WeakPolarHBondContact CA-OG 3.3Å; I750-S753 PolarHBondContact O-OG 3.11Å
751	R	63.7	Low	68.8	Low	180 Å²	180	61.8 Å²	61.8	68%	0.679	32%	0.319	S	S	*	.	H	α-helix	trans	-73.9	-35.3	170.2	-168.7	-177.6	-59.2	172.5	3.9	111	K748 I749 Q754	K748-R751 WeakPolarHBondContact O-CB 3.14Å; K748-R751 PolarHBondContact O-N 3.45Å; I749-R751 VanDerWaalsContact C-N 3.32Å; I749-R751 PolarHBondContact O-N 3.1Å; R751-Q754 WeakPolarHBondContact O-CB 3.45Å; R751-Q754 WeakPolarHBondContact O-CG 3.45Å
752	L	64.3	Low	69.4	Low	32 Å²	32	63.3 Å²	63.3	17%	0.168	33%	0.327	C	S	.	.	H	α-helix	trans	-74.9	-28.4	-179.3	-157.9	65.6	0	0	0	112.5	W585 K748 I749 Q754 Y755 I758	W585-L752 HydrophobicContact CH2-CD1 4.39Å; W585-L752 HydrophobicContact CH2-CD2 3.68Å; W585-L752 HydrophobicContact CZ2-CD1 3.9Å; W585-L752 HydrophobicContact CZ2-CD2 3.86Å; K748-L752 WeakPolarHBondContact O-CB 3.34Å; K748-L752 PolarHBondContact O-N 2.87Å; I749-L752 CarbonylContact O-C 3.59Å; I749-L752 WeakPolarHBondContact O-CA 3.25Å; I749-L752 WeakPolarHBondContact O-CB 3.48Å; I749-L752 PolarHBondContact O-N 2.86Å; I749-L752 VanDerWaalsContact O-N 3.08Å; L752-Q754 PolarHBondContact O-N 3.27Å; L752-Y755 HydrophobicContact CD1-CD2 4.41Å; L752-Y755 WeakPolarHBondContact O-CB 3.42Å; L752-Y755 WeakPolarHBondContact O-CD2 3.32Å; L752-Y755 PolarHBondContact O-N 3.35Å; L752-I758 HydrophobicContact CD1-CD1 3.6Å; L752-I758 HydrophobicContact CD2-CG2 3.65Å; L752-I758 HydrophobicContact CG-CB 4.25Å; L752-I758 HydrophobicContact CG-CD1 3.82Å; L752-I758 HydrophobicContact CG-CG2 3.72Å
753	S	64.7	Low	70	Confident	49 Å²	49	61.8 Å²	61.8	34%	0.343	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-3.5	176.8	67	0	0	0	0	113.7	I749 I750 Y755 V759	I749-S753 WeakPolarHBondContact O-CB 3.35Å; I749-S753 PolarHBondContact O-N 3.5Å; I749-S753 PolarHBondContact O-OG 3.38Å; I750-S753 WeakPolarHBondContact CA-OG 3.3Å; I750-S753 PolarHBondContact O-OG 3.11Å; S753-Y755 PolarHBondContact O-N 3.48Å; S753-V759 VanDerWaalsContact CA-CG2 3.47Å; S753-V759 WeakPolarHBondContact O-CG2 3.49Å
754	Q	66.4	Low	70.9	Confident	91 Å²	91	66 Å²	66	43%	0.425	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.5	162.5	-63.5	-172.4	-10.8	0	0	111.4	R751 L752 R873	R751-Q754 WeakPolarHBondContact O-CB 3.45Å; R751-Q754 WeakPolarHBondContact O-CG 3.45Å; L752-Q754 PolarHBondContact O-N 3.27Å; Q754-R873 PolarHBondContact O-NH1 2.88Å; Q754-R873 PolarHBondContact O-NH2 2.89Å
755	Y	70.2	Confident	71.8	Confident	85 Å²	85	67.8 Å²	67.8	33%	0.333	34%	0.344	S	S	.	.	S	Bend	trans	-94.8	102.8	174.4	-56.4	-79.2	0	0	0	111.1	L752 S753 V757 I758 V759 L1448	L752-Y755 HydrophobicContact CD1-CD2 4.41Å; L752-Y755 WeakPolarHBondContact O-CB 3.42Å; L752-Y755 WeakPolarHBondContact O-CD2 3.32Å; L752-Y755 PolarHBondContact O-N 3.35Å; S753-Y755 PolarHBondContact O-N 3.48Å; Y755-V757 VanDerWaalsContact C-N 3.27Å; Y755-V757 PolarHBondContact O-N 3Å; Y755-V757 VanDerWaalsContact O-N 3.13Å; Y755-I758 HydrophobicContact CD2-CD1 4.11Å; Y755-I758 HydrophobicContact CG-CD1 4.17Å; Y755-I758 PolarHBondContact O-N 3.22Å; Y755-V759 PolarHBondContact O-N 3.44Å; Y755-L1448 HydrophobicContact CE1-CD1 3.88Å; Y755-L1448 HydrophobicContact CE1-CD2 4.22Å
756	S	71.5	Confident	72.7	Confident	22 Å²	22	69.1 Å²	69.1	15%	0.154	35%	0.354	C	S	.	.	H	α-helix	trans	-45.2	-44.3	179.7	-62.2	0	0	0	0	114.9	I758 V759 L760 I870	S756-I758 VanDerWaalsContact C-N 3.26Å; S756-I758 PolarHBondContact O-N 3.48Å; S756-V759 WeakPolarHBondContact O-CB 3.46Å; S756-V759 PolarHBondContact O-N 2.66Å; S756-L760 PolarHBondContact O-N 3.35Å; S756-I870 WeakPolarHBondContact O-CD1 3.47Å
757	V	74.9	Confident	73.7	Confident	116 Å²	116	67.7 Å²	67.7	70%	0.703	35%	0.346	S	S	*	.	H	α-helix	trans	-62.1	-34.7	-179	-178.3	0	0	0	0	111.9	Y755 L760 G761	Y755-V757 VanDerWaalsContact C-N 3.27Å; Y755-V757 PolarHBondContact O-N 3Å; Y755-V757 VanDerWaalsContact O-N 3.13Å; V757-L760 PolarHBondContact O-N 2.71Å; V757-G761 PolarHBondContact O-N 2.72Å
758	I	77.6	Confident	75.2	Confident	53 Å²	53	64.1 Å²	64.1	27%	0.272	34%	0.337	S	S	.	.	H	α-helix	trans	-79.6	-30.1	-179.4	-46.4	178.8	0	0	0	110.8	L752 Y755 S756 G761 L762	L752-I758 HydrophobicContact CD1-CD1 3.6Å; L752-I758 HydrophobicContact CD2-CG2 3.65Å; L752-I758 HydrophobicContact CG-CB 4.25Å; L752-I758 HydrophobicContact CG-CD1 3.82Å; L752-I758 HydrophobicContact CG-CG2 3.72Å; Y755-I758 HydrophobicContact CD2-CD1 4.11Å; Y755-I758 HydrophobicContact CG-CD1 4.17Å; Y755-I758 PolarHBondContact O-N 3.22Å; S756-I758 VanDerWaalsContact C-N 3.26Å; S756-I758 PolarHBondContact O-N 3.48Å; I758-G761 PolarHBondContact O-N 2.8Å; I758-L762 HydrophobicContact CG2-CD1 4.25Å; I758-L762 HydrophobicContact CG2-CG 4.4Å; I758-L762 WeakPolarHBondContact O-CB 3.29Å; I758-L762 VanDerWaalsContact O-CG 3.26Å; I758-L762 WeakPolarHBondContact O-CG 3.49Å; I758-L762 PolarHBondContact O-N 2.64Å
759	V	76.7	Confident	76.4	Confident	28 Å²	28	61.9 Å²	61.9	17%	0.17	33%	0.329	C	S	.	.	H	α-helix	trans	-59.4	-48.6	167.6	-176.6	0	0	0	0	110.2	S753 Y755 S756 G761 L762 L763	S753-V759 VanDerWaalsContact CA-CG2 3.47Å; S753-V759 WeakPolarHBondContact O-CG2 3.49Å; Y755-V759 PolarHBondContact O-N 3.44Å; S756-V759 WeakPolarHBondContact O-CB 3.46Å; S756-V759 PolarHBondContact O-N 2.66Å; V759-G761 PolarHBondContact O-N 3.19Å; V759-L762 PolarHBondContact O-N 3.43Å; V759-L763 HydrophobicContact CG1-CD1 3.94Å; V759-L763 HydrophobicContact CG1-CG 4.45Å; V759-L763 WeakPolarHBondContact O-CB 3.43Å; V759-L763 WeakPolarHBondContact O-CG 3.31Å; V759-L763 PolarHBondContact O-N 3.5Å
760	L	80.6	Confident	77.6	Confident	55 Å²	55	61.4 Å²	61.4	29%	0.288	33%	0.328	S	S	.	.	H	α-helix	trans	-61.5	-45.2	178.1	-177.7	58.7	0	0	0	112	S756 V757 L762 L763 M764 V867 I870	S756-L760 PolarHBondContact O-N 3.35Å; V757-L760 PolarHBondContact O-N 2.71Å; L760-L762 PolarHBondContact O-N 2.89Å; L760-L763 PolarHBondContact O-N 3.18Å; L760-M764 HydrophobicContact CD1-CG 4.29Å; L760-M764 HydrophobicContact CD1-SD 4.41Å; L760-M764 HydrophobicContact CG-SD 4.26Å; L760-M764 WeakPolarHBondContact O-CG 3.5Å; L760-M764 PolarHBondContact O-N 3.37Å; L760-V867 HydrophobicContact CD1-CG2 3.77Å; L760-I870 HydrophobicContact CB-CD1 4.21Å
761	G	83	Confident	79.2	Confident	41 Å²	41	57.9 Å²	57.9	42%	0.423	31%	0.31	S	S	.	.	H	α-helix	trans	-60.7	-40.9	176.3	0	0	0	0	0	113.4	V757 I758 V759 F765	V757-G761 PolarHBondContact O-N 2.72Å; I758-G761 PolarHBondContact O-N 2.8Å; V759-G761 PolarHBondContact O-N 3.19Å; G761-F765 WeakPolarHBondContact O-CB 3.5Å; G761-F765 PolarHBondContact O-N 3.24Å
762	L	78.8	Confident	80.6	Confident	41 Å²	41	49.4 Å²	49.4	22%	0.215	28%	0.278	C	S	.	.	H	α-helix	trans	-67.8	-38	175.2	-72.7	169.1	0	0	0	112.3	F592 I749 I758 V759 L760 F765 S766	F592-L762 HydrophobicContact CZ-CD2 4.14Å; I749-L762 HydrophobicContact CG2-CD1 3.79Å; I758-L762 HydrophobicContact CG2-CD1 4.25Å; I758-L762 HydrophobicContact CG2-CG 4.4Å; I758-L762 WeakPolarHBondContact O-CB 3.29Å; I758-L762 VanDerWaalsContact O-CG 3.26Å; I758-L762 WeakPolarHBondContact O-CG 3.49Å; I758-L762 PolarHBondContact O-N 2.64Å; V759-L762 PolarHBondContact O-N 3.43Å; L760-L762 PolarHBondContact O-N 2.89Å; L762-F765 PolarHBondContact O-N 3.3Å; L762-S766 WeakPolarHBondContact O-CB 3.43Å; L762-S766 PolarHBondContact O-N 3.44Å
763	L	82.7	Confident	82	Confident	35 Å²	35	52 Å²	52	18%	0.183	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-47.7	174.6	-74.2	168.4	0	0	0	111.4	V759 L760 F765 S766 F767 N866	V759-L763 HydrophobicContact CG1-CD1 3.94Å; V759-L763 HydrophobicContact CG1-CG 4.45Å; V759-L763 WeakPolarHBondContact O-CB 3.43Å; V759-L763 WeakPolarHBondContact O-CG 3.31Å; V759-L763 PolarHBondContact O-N 3.5Å; L760-L763 PolarHBondContact O-N 3.18Å; L763-F765 VanDerWaalsContact C-N 3.32Å; L763-F765 PolarHBondContact O-N 3.33Å; L763-S766 PolarHBondContact O-N 2.64Å; L763-S766 VanDerWaalsContact O-N 3.14Å; L763-S766 PolarHBondContact O-OG 2.89Å; L763-F767 PolarHBondContact O-N 2.78Å; L763-N866 HydrophobicContact CD1-CB 3.49Å; L763-N866 VanDerWaalsContact CD1-CB 3.49Å
764	M	84.8	Confident	83.4	Confident	123 Å²	123	50.1 Å²	50.1	61%	0.606	27%	0.272	S	S	*	.	H	α-helix	trans	-60.9	-40.2	176	-69.8	-178.6	73.3	0	0	112.1	L760 F767 A768	L760-M764 HydrophobicContact CD1-CG 4.29Å; L760-M764 HydrophobicContact CD1-SD 4.41Å; L760-M764 HydrophobicContact CG-SD 4.26Å; L760-M764 WeakPolarHBondContact O-CG 3.5Å; L760-M764 PolarHBondContact O-N 3.37Å; M764-F767 PolarHBondContact O-N 3.44Å; M764-A768 PolarHBondContact O-N 3.29Å; M764-A768 VanDerWaalsContact O-N 3.11Å
765	F	84.4	Confident	84.7	Confident	70 Å²	70	45.8 Å²	45.8	31%	0.307	25%	0.252	S	S	.	.	H	α-helix	trans	-64.2	-42.9	173.2	-176.4	-88.5	0	0	0	111.9	F592 G761 L762 L763 F767 A768 L769	F592-F765 HydrophobicContact CB-CE1 4.14Å; F592-F765 HydrophobicContact CB-CE2 4.18Å; F592-F765 HydrophobicContact CB-CZ 3.58Å; F592-F765 AromaticContact CD1-CD1 3.93Å; F592-F765 HydrophobicContact CD1-CD1 3.93Å; F592-F765 AromaticContact CD1-CE1 3.2Å; F592-F765 HydrophobicContact CD1-CE1 3.2Å; F592-F765 AromaticContact CD1-CZ 3.61Å; F592-F765 HydrophobicContact CD1-CZ 3.61Å; F592-F765 HydrophobicContact CD2-CE1 4.22Å; F592-F765 HydrophobicContact CD2-CE2 4.42Å; F592-F765 HydrophobicContact CD2-CZ 4.17Å; F592-F765 AromaticContact CE1-CD1 3.72Å; F592-F765 HydrophobicContact CE1-CD1 3.72Å; F592-F765 AromaticContact CE1-CE1 3.46Å; F592-F765 HydrophobicContact CE1-CE1 3.46Å; F592-F765 VanDerWaalsContact CE1-CE1 3.46Å; F592-F765 HydrophobicContact CE1-CZ 4.26Å; F592-F765 HydrophobicContact CE2-CD1 4.36Å; F592-F765 HydrophobicContact CE2-CE1 4.42Å; F592-F765 HydrophobicContact CG-CD1 4.34Å; F592-F765 AromaticContact CG-CE1 3.62Å; F592-F765 HydrophobicContact CG-CE1 3.62Å; F592-F765 HydrophobicContact CG-CE2 4.18Å; F592-F765 AromaticContact CG-CZ 3.54Å; F592-F765 HydrophobicContact CG-CZ 3.54Å; F592-F765 AromaticContact CZ-CD1 3.94Å; F592-F765 HydrophobicContact CZ-CD1 3.94Å; F592-F765 HydrophobicContact CZ-CE1 4.07Å; G761-F765 WeakPolarHBondContact O-CB 3.5Å; G761-F765 PolarHBondContact O-N 3.24Å; L762-F765 PolarHBondContact O-N 3.3Å; L763-F765 VanDerWaalsContact C-N 3.32Å; L763-F765 PolarHBondContact O-N 3.33Å; F765-F767 VanDerWaalsContact C-N 3.28Å; F765-F767 PolarHBondContact O-N 2.91Å; F765-A768 PolarHBondContact O-N 2.89Å; F765-L769 HydrophobicContact CE1-CB 4.16Å; F765-L769 HydrophobicContact CE1-CD1 3.74Å; F765-L769 HydrophobicContact CZ-CD1 4.42Å; F765-L769 WeakPolarHBondContact O-CB 3.47Å; F765-L769 PolarHBondContact O-N 3.49Å
766	S	83.1	Confident	85.7	Confident	44 Å²	44	42 Å²	42	31%	0.308	24%	0.238	S	C	.	.	H	α-helix	trans	-63.1	-34.7	177.2	74.4	0	0	0	0	112.7	L762 L763 L769 V770	L762-S766 WeakPolarHBondContact O-CB 3.43Å; L762-S766 PolarHBondContact O-N 3.44Å; L763-S766 PolarHBondContact O-N 2.64Å; L763-S766 VanDerWaalsContact O-N 3.14Å; L763-S766 PolarHBondContact O-OG 2.89Å; S766-L769 PolarHBondContact O-N 3.46Å; S766-V770 WeakPolarHBondContact O-CG2 3.44Å; S766-V770 PolarHBondContact O-N 2.64Å
767	F	88.1	Confident	86.7	Confident	42 Å²	42	45 Å²	45	18%	0.184	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-48.9	172.9	-174.2	-84.5	0	0	0	111.6	L763 M764 F765 L769 V770 A771 L830 T831 M859	L763-F767 PolarHBondContact O-N 2.78Å; M764-F767 PolarHBondContact O-N 3.44Å; F765-F767 VanDerWaalsContact C-N 3.28Å; F765-F767 PolarHBondContact O-N 2.91Å; F767-L769 VanDerWaalsContact C-N 3.33Å; F767-L769 PolarHBondContact O-N 3.49Å; F767-V770 PolarHBondContact O-N 3.37Å; F767-A771 WeakPolarHBondContact O-CB 3.12Å; F767-A771 PolarHBondContact O-N 2.92Å; F767-L830 HydrophobicContact CE2-CB 3.85Å; F767-L830 HydrophobicContact CZ-CB 3.61Å; F767-T831 HydrophobicContact CE1-CG2 4.15Å; F767-T831 HydrophobicContact CZ-CG2 3.62Å; F767-M859 HydrophobicContact CB-CE 4.31Å; F767-M859 HydrophobicContact CD2-CE 4.15Å
768	A	90.7	Very high	87.6	Confident	50 Å²	50	39.5 Å²	39.5	41%	0.413	22%	0.218	S	C	.	.	H	α-helix	trans	-62	-39.1	177.8	0	0	0	0	0	112.7	M764 F765 H772	M764-A768 PolarHBondContact O-N 3.29Å; M764-A768 VanDerWaalsContact O-N 3.11Å; F765-A768 PolarHBondContact O-N 2.89Å; A768-H772 VanDerWaalsContact O-CB 3.28Å; A768-H772 WeakPolarHBondContact O-CB 3.38Å; A768-H772 PolarHBondContact O-N 3.08Å
769	L	90.4	Very high	88.2	Confident	28 Å²	28	37.5 Å²	37.5	15%	0.147	21%	0.207	C	C	.	.	H	α-helix	trans	-65.8	-44.9	176.4	175	158	0	0	0	112	A595 F765 S766 F767 H772 W773	A595-L769 HydrophobicContact CB-CD1 3.66Å; F765-L769 HydrophobicContact CE1-CB 4.16Å; F765-L769 HydrophobicContact CE1-CD1 3.74Å; F765-L769 HydrophobicContact CZ-CD1 4.42Å; F765-L769 WeakPolarHBondContact O-CB 3.47Å; F765-L769 PolarHBondContact O-N 3.49Å; S766-L769 PolarHBondContact O-N 3.46Å; F767-L769 VanDerWaalsContact C-N 3.33Å; F767-L769 PolarHBondContact O-N 3.49Å; L769-H772 PolarHBondContact O-N 3.4Å; L769-W773 HydrophobicContact CD1-CZ2 4.28Å; L769-W773 HydrophobicContact CD2-CD2 3.75Å; L769-W773 HydrophobicContact CD2-CE3 3.96Å; L769-W773 HydrophobicContact CD2-CG 4.41Å; L769-W773 HydrophobicContact CD2-CH2 3.87Å; L769-W773 HydrophobicContact CD2-CZ2 3.62Å; L769-W773 HydrophobicContact CD2-CZ3 4.03Å; L769-W773 HydrophobicContact CG-CD2 4.49Å; L769-W773 HydrophobicContact CG-CZ2 4.11Å; L769-W773 PolarHBondContact O-N 2.87Å
770	V	91.7	Very high	88.8	Confident	30 Å²	30	38.3 Å²	38.3	18%	0.182	21%	0.212	C	C	.	.	H	α-helix	trans	-66.9	-42.6	177.1	172.1	0	0	0	0	111	S766 F767 H772 W773 C774 L830 L855 M859	S766-V770 WeakPolarHBondContact O-CG2 3.44Å; S766-V770 PolarHBondContact O-N 2.64Å; F767-V770 PolarHBondContact O-N 3.37Å; V770-H772 VanDerWaalsContact C-N 3.28Å; V770-H772 PolarHBondContact O-N 3.42Å; V770-W773 PolarHBondContact O-N 2.71Å; V770-C774 WeakPolarHBondContact O-CB 3.13Å; V770-C774 PolarHBondContact O-N 3.11Å; V770-C774 PolarHBondContact O-SG 2.88Å; V770-C774 VanDerWaalsContact O-SG 3.4Å; V770-L830 HydrophobicContact CG1-CD1 4.36Å; V770-L855 HydrophobicContact CG1-CD2 3.77Å; V770-L855 HydrophobicContact CG1-CG 4.47Å; V770-M859 HydrophobicContact CB-CE 3.92Å; V770-M859 HydrophobicContact CB-SD 4.05Å; V770-M859 HydrophobicContact CG1-CE 4.27Å; V770-M859 HydrophobicContact CG1-SD 3.72Å; V770-M859 HydrophobicContact CG2-CE 3.91Å; V770-M859 HydrophobicContact CG2-SD 4.22Å
771	A	93.9	Very high	89.2	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-58.4	-41.5	174.6	0	0	0	0	0	112.2	F767 A775 L823 T826 L830	F767-A771 WeakPolarHBondContact O-CB 3.12Å; F767-A771 PolarHBondContact O-N 2.92Å; A771-A775 WeakPolarHBondContact O-CB 3.04Å; A771-A775 PolarHBondContact O-N 3.22Å; A771-L823 HydrophobicContact CB-CD1 4.33Å; A771-T826 PolarHBondContact O-OG1 2.93Å; A771-T826 VanDerWaalsContact O-OG1 3.1Å; A771-L830 VanDerWaalsContact CA-CD1 3.49Å; A771-L830 HydrophobicContact CB-CD1 3.68Å
772	H	94.5	Very high	89.4	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-65.2	-43.7	175	170.8	72.1	0	0	0	112.6	F596 A768 L769 V770 A775 C776 Y819	F596-H772 HydrophobicContact CD2-CB 4.13Å; F596-H772 AromaticContact CD2-CD2 3.83Å; F596-H772 AromaticContact CD2-CG 3.69Å; F596-H772 HydrophobicContact CE2-CB 3.89Å; F596-H772 AromaticContact CE2-CG 3.63Å; F596-H772 AromaticContact CE2-ND1 3.7Å; F596-H772 AromaticContact CZ-ND1 3.78Å; F596-H772 PolarHBondContact O-CE1 2.96Å; F596-H772 PolarHBondContact O-NE2 2.92Å; A768-H772 VanDerWaalsContact O-CB 3.28Å; A768-H772 WeakPolarHBondContact O-CB 3.38Å; A768-H772 PolarHBondContact O-N 3.08Å; L769-H772 PolarHBondContact O-N 3.4Å; V770-H772 VanDerWaalsContact C-N 3.28Å; V770-H772 PolarHBondContact O-N 3.42Å; H772-A775 WeakPolarHBondContact O-CB 3.44Å; H772-A775 PolarHBondContact O-N 3.07Å; H772-C776 VanDerWaalsContact CE1-SG 3.57Å; H772-C776 PolarHBondContact O-N 2.95Å; H772-C776 PolarHBondContact O-SG 3.22Å; H772-Y819 AromaticContact CE1-CE2 3.95Å; H772-Y819 AromaticContact ND1-CE2 3.62Å; H772-Y819 AromaticContact ND1-CZ 3.74Å; H772-Y819 PolarHBondContact ND1-OH 3.1Å
773	W	92.5	Very high	89.6	Confident	87 Å²	87	35.2 Å²	35.2	33%	0.33	19%	0.187	S	C	.	.	H	α-helix	trans	-64.5	-44.4	175.5	-69.8	-0.1	0	0	0	112.1	A595 L739 L769 V770 A775 C776 I777	A595-W773 PolarHBondContact O-NE1 3.18Å; L739-W773 HydrophobicContact CD1-CH2 3.72Å; L739-W773 HydrophobicContact CD1-CZ2 3.45Å; L739-W773 VanDerWaalsContact CD1-CZ2 3.45Å; L769-W773 HydrophobicContact CD1-CZ2 4.28Å; L769-W773 HydrophobicContact CD2-CD2 3.75Å; L769-W773 HydrophobicContact CD2-CE3 3.96Å; L769-W773 HydrophobicContact CD2-CG 4.41Å; L769-W773 HydrophobicContact CD2-CH2 3.87Å; L769-W773 HydrophobicContact CD2-CZ2 3.62Å; L769-W773 HydrophobicContact CD2-CZ3 4.03Å; L769-W773 HydrophobicContact CG-CD2 4.49Å; L769-W773 HydrophobicContact CG-CZ2 4.11Å; L769-W773 PolarHBondContact O-N 2.87Å; V770-W773 PolarHBondContact O-N 2.71Å; W773-A775 VanDerWaalsContact C-N 3.29Å; W773-A775 PolarHBondContact O-N 3.02Å; W773-C776 PolarHBondContact O-N 2.92Å; W773-I777 WeakPolarHBondContact O-CG1 3Å; W773-I777 PolarHBondContact O-N 2.87Å
774	C	94.2	Very high	89.5	Confident	10 Å²	10	41.9 Å²	41.9	7%	0.068	21%	0.21	C	C	.	.	H	α-helix	trans	-59	-39.9	173	-73.6	0	0	0	0	111.8	V770 I777 W778 T826 F848 I852	V770-C774 WeakPolarHBondContact O-CB 3.13Å; V770-C774 PolarHBondContact O-N 3.11Å; V770-C774 PolarHBondContact O-SG 2.88Å; V770-C774 VanDerWaalsContact O-SG 3.4Å; C774-I777 PolarHBondContact O-N 2.9Å; C774-W778 WeakPolarHBondContact O-CB 3.4Å; C774-W778 PolarHBondContact O-N 3.24Å; C774-T826 HydrophobicContact CB-CG2 3.89Å; C774-F848 HydrophobicContact CB-CZ 4.45Å; C774-F848 WeakPolarHBondContact O-CZ 3.39Å; C774-I852 HydrophobicContact CB-CD1 3.77Å; C774-I852 HydrophobicContact CB-CG1 4.48Å
775	A	94.7	Very high	89.4	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-39.8	176.5	0	0	0	0	0	112.6	A771 H772 W773 W778 Y779 A822 L823	A771-A775 WeakPolarHBondContact O-CB 3.04Å; A771-A775 PolarHBondContact O-N 3.22Å; H772-A775 WeakPolarHBondContact O-CB 3.44Å; H772-A775 PolarHBondContact O-N 3.07Å; W773-A775 VanDerWaalsContact C-N 3.29Å; W773-A775 PolarHBondContact O-N 3.02Å; A775-W778 PolarHBondContact O-N 2.79Å; A775-Y779 PolarHBondContact O-N 3.01Å; A775-A822 HydrophobicContact CB-CB 4.14Å; A775-L823 HydrophobicContact CB-CB 4.17Å; A775-L823 HydrophobicContact CB-CD1 4.16Å
776	C	91.6	Very high	89.1	Confident	5 Å²	5	35.8 Å²	35.8	3%	0.034	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-42.1	175.2	-61.3	0	0	0	0	111.4	P599 T603 H772 W773 Y779 V780	P599-C776 HydrophobicContact CB-CB 4.23Å; T603-C776 HydrophobicContact CG2-CB 4.07Å; H772-C776 VanDerWaalsContact CE1-SG 3.57Å; H772-C776 PolarHBondContact O-N 2.95Å; H772-C776 PolarHBondContact O-SG 3.22Å; W773-C776 PolarHBondContact O-N 2.92Å; C776-Y779 PolarHBondContact O-N 3.06Å; C776-V780 WeakPolarHBondContact O-CG2 3.38Å; C776-V780 PolarHBondContact O-N 3.19Å; C776-V780 VanDerWaalsContact O-N 3.08Å
777	I	91.4	Very high	88.4	Confident	86 Å²	86	36.1 Å²	36.1	44%	0.441	18%	0.181	S	C	.	.	H	α-helix	trans	-67.3	-40.7	176.6	-60.5	161.8	0	0	0	111.2	W773 C774 Y779 V780 I781 F848	W773-I777 WeakPolarHBondContact O-CG1 3Å; W773-I777 PolarHBondContact O-N 2.87Å; C774-I777 PolarHBondContact O-N 2.9Å; I777-Y779 VanDerWaalsContact C-N 3.26Å; I777-Y779 PolarHBondContact O-N 3.47Å; I777-V780 PolarHBondContact O-N 3.08Å; I777-V780 VanDerWaalsContact O-N 3.13Å; I777-I781 HydrophobicContact CG2-CD1 4.07Å; I777-I781 HydrophobicContact CG2-CG1 4.47Å; I777-I781 WeakPolarHBondContact O-CG1 3.42Å; I777-I781 PolarHBondContact O-N 3.36Å; I777-F848 HydrophobicContact CB-CE2 3.89Å; I777-F848 HydrophobicContact CB-CZ 3.85Å; I777-F848 HydrophobicContact CG2-CD2 4.09Å; I777-F848 HydrophobicContact CG2-CE2 3.36Å; I777-F848 HydrophobicContact CG2-CZ 3.76Å
778	W	94.1	Very high	87.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.6	-37.3	174.8	-175.2	-113.3	0	0	0	112.5	C774 A775 G782 W793 F825 T826 V838 A840 E845 F848	C774-W778 WeakPolarHBondContact O-CB 3.4Å; C774-W778 PolarHBondContact O-N 3.24Å; A775-W778 PolarHBondContact O-N 2.79Å; W778-G782 PolarHBondContact O-N 3.04Å; W778-W793 AromaticContact CD1-CD2 3.98Å; W778-W793 AromaticContact CD1-CE2 3.41Å; W778-W793 VanDerWaalsContact CD1-CE2 3.41Å; W778-W793 AromaticContact CD1-CH2 3.94Å; W778-W793 AromaticContact CD1-CZ2 3.39Å; W778-W793 AromaticContact CD1-NE1 3.69Å; W778-W793 AromaticContact CD2-NE1 3.88Å; W778-W793 AromaticContact CE2-CD1 3.49Å; W778-W793 VanDerWaalsContact CE2-CD1 3.49Å; W778-W793 AromaticContact CE2-CD2 3.82Å; W778-W793 AromaticContact CE2-CE2 3.8Å; W778-W793 AromaticContact CE2-CG 3.66Å; W778-W793 AromaticContact CE2-NE1 3.55Å; W778-W793 HydrophobicContact CG-CZ2 4.29Å; W778-W793 HydrophobicContact CH2-CG 4.47Å; W778-W793 HydrophobicContact CZ2-CB 3.77Å; W778-W793 AromaticContact CZ2-CD1 3.52Å; W778-W793 HydrophobicContact CZ2-CD2 4.16Å; W778-W793 AromaticContact CZ2-CG 3.54Å; W778-W793 HydrophobicContact CZ2-CG 3.54Å; W778-W793 AromaticContact NE1-CD1 3.68Å; W778-W793 AromaticContact NE1-CD2 3.23Å; W778-W793 AromaticContact NE1-CE2 3.15Å; W778-W793 AromaticContact NE1-CE3 3.71Å; W778-W793 AromaticContact NE1-CG 3.61Å; W778-W793 AromaticContact NE1-CZ2 3.58Å; W778-W793 AromaticContact NE1-NE1 3.4Å; W778-W793 PolarHBondContact O-NE1 3.35Å; W778-W793 VanDerWaalsContact O-NE1 3.08Å; W778-F825 AromaticContact CD1-CD1 3.96Å; W778-F825 AromaticContact CD2-CD1 3.61Å; W778-F825 HydrophobicContact CD2-CD1 3.61Å; W778-F825 AromaticContact CD2-CE1 3.59Å; W778-F825 HydrophobicContact CD2-CE1 3.59Å; W778-F825 AromaticContact CE2-CD1 3.36Å; W778-F825 AromaticContact CE2-CE1 3.5Å; W778-F825 VanDerWaalsContact CE2-CE1 3.5Å; W778-F825 HydrophobicContact CE3-CD1 4.19Å; W778-F825 AromaticContact CE3-CE1 3.68Å; W778-F825 HydrophobicContact CE3-CE1 3.68Å; W778-F825 AromaticContact CG-CD1 3.95Å; W778-F825 HydrophobicContact CG-CD1 3.95Å; W778-F825 HydrophobicContact CG-CE1 4.34Å; W778-F825 HydrophobicContact CH2-CD1 4.24Å; W778-F825 AromaticContact CH2-CE1 3.54Å; W778-F825 HydrophobicContact CH2-CE1 3.54Å; W778-F825 HydrophobicContact CH2-CE2 4.44Å; W778-F825 AromaticContact CH2-CZ 3.65Å; W778-F825 HydrophobicContact CH2-CZ 3.65Å; W778-F825 AromaticContact CZ2-CD1 3.72Å; W778-F825 HydrophobicContact CZ2-CD1 3.72Å; W778-F825 HydrophobicContact CZ2-CD2 4.46Å; W778-F825 AromaticContact CZ2-CE1 3.5Å; W778-F825 HydrophobicContact CZ2-CE1 3.5Å; W778-F825 VanDerWaalsContact CZ2-CE1 3.5Å; W778-F825 HydrophobicContact CZ2-CE2 4.27Å; W778-F825 HydrophobicContact CZ2-CG 4.21Å; W778-F825 AromaticContact CZ2-CZ 3.79Å; W778-F825 HydrophobicContact CZ2-CZ 3.79Å; W778-F825 HydrophobicContact CZ3-CD1 4.46Å; W778-F825 AromaticContact CZ3-CE1 3.63Å; W778-F825 HydrophobicContact CZ3-CE1 3.63Å; W778-F825 HydrophobicContact CZ3-CZ 4.06Å; W778-F825 AromaticContact NE1-CD1 3.6Å; W778-T826 HydrophobicContact CB-CG2 4.24Å; W778-V838 HydrophobicContact CZ2-CG1 4.2Å; W778-A840 HydrophobicContact CH2-CB 4.17Å; W778-E845 HydrophobicContact CH2-CB 3.74Å; W778-E845 HydrophobicContact CH2-CG 3.71Å; W778-E845 HydrophobicContact CZ3-CB 3.76Å; W778-E845 HydrophobicContact CZ3-CG 3.8Å; W778-F848 HydrophobicContact CB-CE1 3.91Å; W778-F848 HydrophobicContact CB-CZ 4.5Å; W778-F848 HydrophobicContact CD2-CD1 4.46Å; W778-F848 HydrophobicContact CD2-CE1 4.35Å; W778-F848 AromaticContact CE3-CD1 3.41Å; W778-F848 HydrophobicContact CE3-CD1 3.41Å; W778-F848 VanDerWaalsContact CE3-CD1 3.41Å; W778-F848 AromaticContact CE3-CE1 3.68Å; W778-F848 HydrophobicContact CE3-CE1 3.68Å; W778-F848 HydrophobicContact CE3-CG 4.49Å; W778-F848 HydrophobicContact CG-CE1 4.5Å; W778-F848 AromaticContact CZ3-CD1 3.89Å; W778-F848 HydrophobicContact CZ3-CD1 3.89Å
779	Y	91.3	Very high	86.1	Confident	11 Å²	11	37.4 Å²	37.4	4%	0.043	20%	0.202	C	C	.	.	H	α-helix	trans	-70.7	-38.2	174.1	-173.3	-122.5	0	0	0	113.1	T603 F604 A775 C776 I777 G782 L783 W793 L794 K818	T603-Y779 VanDerWaalsContact O-CE1 3.25Å; T603-Y779 WeakPolarHBondContact O-CE1 3.5Å; F604-Y779 AromaticContact CD1-CD1 3.56Å; F604-Y779 HydrophobicContact CD1-CD1 3.56Å; F604-Y779 AromaticContact CD1-CE1 3.53Å; F604-Y779 HydrophobicContact CD1-CE1 3.53Å; F604-Y779 HydrophobicContact CD1-CG 4.21Å; F604-Y779 HydrophobicContact CD2-CD1 4.34Å; F604-Y779 AromaticContact CE1-CD1 3.24Å; F604-Y779 HydrophobicContact CE1-CD1 3.24Å; F604-Y779 AromaticContact CE1-CD2 3.99Å; F604-Y779 HydrophobicContact CE1-CD2 3.99Å; F604-Y779 AromaticContact CE1-CE1 3.64Å; F604-Y779 HydrophobicContact CE1-CE1 3.64Å; F604-Y779 HydrophobicContact CE1-CE2 4.34Å; F604-Y779 AromaticContact CE1-CG 3.44Å; F604-Y779 HydrophobicContact CE1-CG 3.44Å; F604-Y779 VanDerWaalsContact CE1-CG 3.44Å; F604-Y779 HydrophobicContact CE2-CD1 4.07Å; F604-Y779 HydrophobicContact CE2-CG 4.47Å; F604-Y779 HydrophobicContact CG-CD1 4.1Å; F604-Y779 HydrophobicContact CG-CE1 4.18Å; F604-Y779 AromaticContact CZ-CD1 3.52Å; F604-Y779 HydrophobicContact CZ-CD1 3.52Å; F604-Y779 HydrophobicContact CZ-CD2 4.46Å; F604-Y779 HydrophobicContact CZ-CE1 4.34Å; F604-Y779 AromaticContact CZ-CG 3.59Å; F604-Y779 HydrophobicContact CZ-CG 3.59Å; A775-Y779 PolarHBondContact O-N 3.01Å; C776-Y779 PolarHBondContact O-N 3.06Å; I777-Y779 VanDerWaalsContact C-N 3.26Å; I777-Y779 PolarHBondContact O-N 3.47Å; Y779-G782 PolarHBondContact O-N 3.05Å; Y779-L783 HydrophobicContact CD1-CD1 3.97Å; Y779-L783 HydrophobicContact CD1-CG 4.46Å; Y779-L783 HydrophobicContact CD2-CG 4.49Å; Y779-L783 HydrophobicContact CE1-CD1 3.6Å; Y779-L783 HydrophobicContact CE1-CD2 4.49Å; Y779-L783 HydrophobicContact CE1-CG 4.08Å; Y779-L783 HydrophobicContact CE2-CD2 4.29Å; Y779-L783 HydrophobicContact CE2-CG 4.09Å; Y779-L783 WeakPolarHBondContact O-CB 3.17Å; Y779-L783 WeakPolarHBondContact O-CG 3.13Å; Y779-L783 PolarHBondContact O-N 3.26Å; Y779-W793 HydrophobicContact CD2-CH2 4.47Å; Y779-W793 HydrophobicContact CD2-CZ2 4.16Å; Y779-L794 HydrophobicContact CD2-CD1 4.23Å; Y779-L794 HydrophobicContact CE2-CD1 4Å; Y779-L794 HydrophobicContact CE2-CD2 4.22Å; Y779-K818 HydrophobicContact CD2-CB 4.42Å; Y779-K818 HydrophobicContact CE2-CB 4.02Å; Y779-K818 HydrophobicContact CE2-CD 4.02Å; Y779-K818 HydrophobicContact CE2-CG 4.16Å; Y779-K818 PolarHBondContact OH-NZ 3.13Å
780	V	87.3	Confident	85.3	Confident	45 Å²	45	42.2 Å²	42.2	27%	0.273	23%	0.228	S	C	.	.	H	α-helix	trans	-64.5	-39.2	173.2	173.6	0	0	0	0	112.1	T603 F725 C776 I777 L783 Y784	T603-V780 HydrophobicContact CG2-CG2 3.51Å; F725-V780 HydrophobicContact CE2-CG1 4.08Å; F725-V780 HydrophobicContact CZ-CG1 4.48Å; C776-V780 WeakPolarHBondContact O-CG2 3.38Å; C776-V780 PolarHBondContact O-N 3.19Å; C776-V780 VanDerWaalsContact O-N 3.08Å; I777-V780 PolarHBondContact O-N 3.08Å; I777-V780 VanDerWaalsContact O-N 3.13Å; V780-L783 PolarHBondContact O-N 2.99Å; V780-Y784 PolarHBondContact O-N 3.43Å; V780-Y784 VanDerWaalsContact O-N 3.1Å
781	I	89.1	Confident	84.9	Confident	30 Å²	30	45.9 Å²	45.9	15%	0.154	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-48	173	-66.1	165.8	0	0	0	110	I777 L783 Y784 E785 N844 E845 F848	I777-I781 HydrophobicContact CG2-CD1 4.07Å; I777-I781 HydrophobicContact CG2-CG1 4.47Å; I777-I781 WeakPolarHBondContact O-CG1 3.42Å; I777-I781 PolarHBondContact O-N 3.36Å; I781-L783 VanDerWaalsContact C-N 3.33Å; I781-L783 PolarHBondContact O-N 3.08Å; I781-Y784 PolarHBondContact O-N 3.03Å; I781-Y784 VanDerWaalsContact O-N 3.13Å; I781-E785 PolarHBondContact O-N 3.5Å; I781-N844 HydrophobicContact CG2-CB 4.43Å; I781-E845 HydrophobicContact CG2-CG 4.09Å; I781-F848 HydrophobicContact CD1-CB 3.68Å; I781-F848 HydrophobicContact CD1-CD1 3.89Å; I781-F848 HydrophobicContact CD1-CD2 3.63Å; I781-F848 HydrophobicContact CD1-CE1 4.35Å; I781-F848 HydrophobicContact CD1-CE2 4.17Å; I781-F848 HydrophobicContact CD1-CG 3.45Å; I781-F848 VanDerWaalsContact CD1-CG 3.45Å; I781-F848 HydrophobicContact CD1-CZ 4.48Å
782	G	88.3	Confident	84.6	Confident	3 Å²	3	46.1 Å²	46.1	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-56.9	-44.6	176.6	0	0	0	0	0	112.8	W778 Y779 Y784 E785 I786	W778-G782 PolarHBondContact O-N 3.04Å; Y779-G782 PolarHBondContact O-N 3.05Å; G782-Y784 VanDerWaalsContact C-N 3.33Å; G782-Y784 PolarHBondContact O-N 3.08Å; G782-E785 PolarHBondContact O-N 3.36Å; G782-I786 WeakPolarHBondContact O-CG1 3.34Å; G782-I786 PolarHBondContact O-N 2.84Å
783	L	82.2	Confident	84.4	Confident	39 Å²	39	46.4 Å²	46.4	20%	0.204	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-36.2	176.3	-78.6	173.4	0	0	0	113.4	Y779 V780 I781 I786	Y779-L783 HydrophobicContact CD1-CD1 3.97Å; Y779-L783 HydrophobicContact CD1-CG 4.46Å; Y779-L783 HydrophobicContact CD2-CG 4.49Å; Y779-L783 HydrophobicContact CE1-CD1 3.6Å; Y779-L783 HydrophobicContact CE1-CD2 4.49Å; Y779-L783 HydrophobicContact CE1-CG 4.08Å; Y779-L783 HydrophobicContact CE2-CD2 4.29Å; Y779-L783 HydrophobicContact CE2-CG 4.09Å; Y779-L783 WeakPolarHBondContact O-CB 3.17Å; Y779-L783 WeakPolarHBondContact O-CG 3.13Å; Y779-L783 PolarHBondContact O-N 3.26Å; V780-L783 PolarHBondContact O-N 2.99Å; I781-L783 VanDerWaalsContact C-N 3.33Å; I781-L783 PolarHBondContact O-N 3.08Å; L783-I786 HydrophobicContact CD2-CD1 3.98Å
784	Y	81.3	Confident	84.3	Confident	174 Å²	174	42.3 Å²	42.3	68%	0.682	23%	0.234	S	C	*	.	H	α-helix	trans	-72.7	-28.1	-179.7	-175.7	-95.8	0	0	0	112.9	V780 I781 G782	V780-Y784 PolarHBondContact O-N 3.43Å; V780-Y784 VanDerWaalsContact O-N 3.1Å; I781-Y784 PolarHBondContact O-N 3.03Å; I781-Y784 VanDerWaalsContact O-N 3.13Å; G782-Y784 VanDerWaalsContact C-N 3.33Å; G782-Y784 PolarHBondContact O-N 3.08Å
785	E	83.1	Confident	83.9	Confident	21 Å²	21	44.1 Å²	44.1	10%	0.098	24%	0.241	C	C	.	.	H	α-helix	trans	-96.1	-12.5	-173.9	-64.4	-170.1	131	0	0	114.7	I781 G782 D787 G788 S789 T842 N844	I781-E785 PolarHBondContact O-N 3.5Å; G782-E785 PolarHBondContact O-N 3.36Å; E785-D787 PolarHBondContact O-N 3.06Å; E785-D787 VanDerWaalsContact O-N 3.12Å; E785-G788 PolarHBondContact O-N 3.02Å; E785-G788 VanDerWaalsContact O-N 3.15Å; E785-S789 PolarHBondContact O-N 3.33Å; E785-S789 VanDerWaalsContact O-N 3.1Å; E785-T842 WeakPolarHBondContact OE1-CB 3.38Å; E785-T842 PolarHBondContact OE1-OG1 2.96Å; E785-T842 VanDerWaalsContact OE1-OG1 3.07Å; E785-T842 VanDerWaalsContact OE2-CB 3.31Å; E785-T842 WeakPolarHBondContact OE2-CB 3.25Å; E785-T842 VanDerWaalsContact OE2-CG2 3.29Å; E785-T842 WeakPolarHBondContact OE2-CG2 3.33Å; E785-T842 PolarHBondContact OE2-OG1 2.83Å; E785-N844 WeakPolarHBondContact OE1-CB 3.29Å; E785-N844 PolarHBondContact OE1-ND2 3.06Å
786	I	78.1	Confident	83.5	Confident	45 Å²	45	45.3 Å²	45.3	23%	0.231	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-38.7	168.2	-67.9	164.1	0	0	0	111.3	G782 L783 G788 L794	G782-I786 WeakPolarHBondContact O-CG1 3.34Å; G782-I786 PolarHBondContact O-N 2.84Å; L783-I786 HydrophobicContact CD2-CD1 3.98Å; I786-G788 VanDerWaalsContact C-N 3.28Å; I786-G788 PolarHBondContact O-N 2.66Å; I786-L794 HydrophobicContact CD1-CD2 3.65Å; I786-L794 HydrophobicContact CG1-CD2 4.07Å
787	D	67.3	Low	83.5	Confident	51 Å²	51	45.9 Å²	45.9	27%	0.273	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-6	-168.6	-53.8	-35.9	0	0	0	113.3	I722 E785 R809	I722-D787 HydrophobicContact CD1-CB 4.05Å; I722-D787 WeakPolarHBondContact CD1-OD2 3.49Å; I722-D787 WeakPolarHBondContact CG1-OD2 3.49Å; I722-D787 WeakPolarHBondContact CG2-OD2 3.27Å; E785-D787 PolarHBondContact O-N 3.06Å; E785-D787 VanDerWaalsContact O-N 3.12Å; D787-R809 VanDerWaalsContact CG-NH1 3.28Å; D787-R809 IonicContact OD1-CZ 3.15Å; D787-R809 IonicContact OD1-NE 2.72Å; D787-R809 PolarHBondContact OD1-NE 3.24Å; D787-R809 IonicContact OD1-NH1 3.55Å; D787-R809 PolarHBondContact OD1-NH1 3.48Å; D787-R809 IonicContact OD1-NH2 2.71Å; D787-R809 IonicContact OD2-NH1 2.74Å
788	G	65.5	Low	83.3	Confident	65 Å²	65	41.8 Å²	41.8	67%	0.67	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-135.9	-8.5	-173.6	0	0	0	0	0	116.8	E785 I786	E785-G788 PolarHBondContact O-N 3.02Å; E785-G788 VanDerWaalsContact O-N 3.15Å; I786-G788 VanDerWaalsContact C-N 3.28Å; I786-G788 PolarHBondContact O-N 2.66Å
789	S	66.2	Low	82.9	Confident	54 Å²	54	47.7 Å²	47.7	38%	0.378	25%	0.252	S	S	.	.			trans	-162.6	122.6	178.1	-76.1	0	0	0	0	114.9	E785 I791 G792	E785-S789 PolarHBondContact O-N 3.33Å; E785-S789 VanDerWaalsContact O-N 3.1Å; S789-I791 PolarHBondContact O-N 2.96Å; S789-G792 PolarHBondContact O-N 2.99Å
790	D	72.7	Confident	82.7	Confident	128 Å²	128	53.5 Å²	53.5	68%	0.684	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	11.5	174.3	-52.1	-20.8	0	0	0	115.1	R799	D790-R799 PolarHBondContact O-NH2 3.14Å
791	I	83.6	Confident	82.8	Confident	107 Å²	107	55.3 Å²	55.3	55%	0.549	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-14	-168.4	-36.3	-178.5	0	0	0	111.4	S789 N841	S789-I791 PolarHBondContact O-N 2.96Å; I791-N841 HydrophobicContact CG2-CB 4.2Å; I791-N841 VanDerWaalsContact O-CB 3.29Å; I791-N841 WeakPolarHBondContact O-CB 3.35Å; I791-N841 PolarHBondContact O-ND2 3.38Å
792	G	86.9	Confident	82.6	Confident	7 Å²	7	63 Å²	63	7%	0.072	31%	0.314	C	S	.	.	S	Bend	trans	-63	156.6	-178.8	0	0	0	0	0	114.1	S789 L794 E795 D796 E845	S789-G792 PolarHBondContact O-N 2.99Å; G792-L794 PolarHBondContact O-N 2.99Å; G792-L794 VanDerWaalsContact O-N 3.13Å; G792-E795 PolarHBondContact O-N 3.38Å; G792-E795 VanDerWaalsContact O-N 3.12Å; G792-D796 PolarHBondContact O-N 3.32Å; G792-D796 VanDerWaalsContact O-N 3.14Å; G792-E845 WeakPolarHBondContact CA-OE1 3.17Å
793	W	91.9	Very high	82.5	Confident	6 Å²	6	64.5 Å²	64.5	2%	0.023	32%	0.324	C	S	.	.	H	α-helix	trans	-58.6	-30.5	-173.4	81.1	-96.6	0	0	0	113.4	W778 Y779 L797 T821 A822 V838 E845	W778-W793 AromaticContact CD1-CD2 3.98Å; W778-W793 AromaticContact CD1-CE2 3.41Å; W778-W793 VanDerWaalsContact CD1-CE2 3.41Å; W778-W793 AromaticContact CD1-CH2 3.94Å; W778-W793 AromaticContact CD1-CZ2 3.39Å; W778-W793 AromaticContact CD1-NE1 3.69Å; W778-W793 AromaticContact CD2-NE1 3.88Å; W778-W793 AromaticContact CE2-CD1 3.49Å; W778-W793 VanDerWaalsContact CE2-CD1 3.49Å; W778-W793 AromaticContact CE2-CD2 3.82Å; W778-W793 AromaticContact CE2-CE2 3.8Å; W778-W793 AromaticContact CE2-CG 3.66Å; W778-W793 AromaticContact CE2-NE1 3.55Å; W778-W793 HydrophobicContact CG-CZ2 4.29Å; W778-W793 HydrophobicContact CH2-CG 4.47Å; W778-W793 HydrophobicContact CZ2-CB 3.77Å; W778-W793 AromaticContact CZ2-CD1 3.52Å; W778-W793 HydrophobicContact CZ2-CD2 4.16Å; W778-W793 AromaticContact CZ2-CG 3.54Å; W778-W793 HydrophobicContact CZ2-CG 3.54Å; W778-W793 AromaticContact NE1-CD1 3.68Å; W778-W793 AromaticContact NE1-CD2 3.23Å; W778-W793 AromaticContact NE1-CE2 3.15Å; W778-W793 AromaticContact NE1-CE3 3.71Å; W778-W793 AromaticContact NE1-CG 3.61Å; W778-W793 AromaticContact NE1-CZ2 3.58Å; W778-W793 AromaticContact NE1-NE1 3.4Å; W778-W793 PolarHBondContact O-NE1 3.35Å; W778-W793 VanDerWaalsContact O-NE1 3.08Å; Y779-W793 HydrophobicContact CD2-CH2 4.47Å; Y779-W793 HydrophobicContact CD2-CZ2 4.16Å; W793-L797 HydrophobicContact CZ3-CD2 3.89Å; W793-L797 WeakPolarHBondContact O-CB 3.2Å; W793-L797 PolarHBondContact O-N 3.29Å; W793-T821 HydrophobicContact CE3-CG2 4.33Å; W793-T821 HydrophobicContact CZ3-CG2 3.76Å; W793-A822 HydrophobicContact CH2-CB 3.96Å; W793-A822 HydrophobicContact CZ2-CB 4.33Å; W793-V838 HydrophobicContact CB-CG1 4.31Å; W793-V838 HydrophobicContact CE3-CG1 4.19Å; W793-E845 WeakPolarHBondContact CB-OE1 3.42Å; W793-E845 VanDerWaalsContact CD1-OE1 3.23Å; W793-E845 PolarHBondContact N-OE1 3.18Å
794	L	89.1	Confident	82.4	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-75.6	-34.9	-178.8	-161.7	76.1	0	0	0	112.3	Y779 I786 G792 L797 A798 F805 K818	Y779-L794 HydrophobicContact CD2-CD1 4.23Å; Y779-L794 HydrophobicContact CE2-CD1 4Å; Y779-L794 HydrophobicContact CE2-CD2 4.22Å; I786-L794 HydrophobicContact CD1-CD2 3.65Å; I786-L794 HydrophobicContact CG1-CD2 4.07Å; G792-L794 PolarHBondContact O-N 2.99Å; G792-L794 VanDerWaalsContact O-N 3.13Å; L794-L797 HydrophobicContact CD1-CD2 4.44Å; L794-L797 PolarHBondContact O-N 3.2Å; L794-A798 WeakPolarHBondContact O-CB 3.31Å; L794-A798 PolarHBondContact O-N 3.24Å; L794-F805 HydrophobicContact CD2-CE2 4.29Å; L794-F805 HydrophobicContact CD2-CZ 3.77Å; L794-F805 HydrophobicContact CG-CE2 4.32Å; L794-F805 HydrophobicContact CG-CZ 4.11Å; L794-K818 HydrophobicContact CD1-CG 4.24Å
795	E	85.7	Confident	82.2	Confident	47 Å²	47	59.9 Å²	59.9	22%	0.22	31%	0.313	C	S	.	.	H	α-helix	trans	-70.9	-41.7	174.3	-176	51.4	-134.3	0	0	110.2	G792 L797 A798 R799 F805	G792-E795 PolarHBondContact O-N 3.38Å; G792-E795 VanDerWaalsContact O-N 3.12Å; E795-L797 VanDerWaalsContact C-N 3.31Å; E795-L797 PolarHBondContact O-N 3.09Å; E795-A798 WeakPolarHBondContact O-CB 3.17Å; E795-A798 PolarHBondContact O-N 3.28Å; E795-R799 VanDerWaalsContact O-CB 3.25Å; E795-R799 WeakPolarHBondContact O-CB 3.31Å; E795-R799 PolarHBondContact O-N 3.31Å; E795-F805 VanDerWaalsContact OE2-CD2 3.31Å; E795-F805 WeakPolarHBondContact OE2-CD2 3.3Å
796	D	87.5	Confident	81.7	Confident	26 Å²	26	64.8 Å²	64.8	14%	0.139	34%	0.336	C	S	.	.	H	α-helix	trans	-65.4	-33.2	173.9	-163.5	54.8	0	0	0	112.5	G792 R799 R800	G792-D796 PolarHBondContact O-N 3.32Å; G792-D796 VanDerWaalsContact O-N 3.14Å; D796-R799 IonicContact OD1-CZ 3.3Å; D796-R799 IonicContact OD1-NH1 3.33Å; D796-R799 PolarHBondContact OD1-NH1 3.3Å; D796-R800 WeakPolarHBondContact O-CB 3.14Å; D796-R800 WeakPolarHBondContact O-CG 3.48Å; D796-R800 PolarHBondContact O-N 3.47Å; D796-R800 IonicContact OD2-CZ 3.92Å; D796-R800 IonicContact OD2-NE 2.66Å; D796-R800 PolarHBondContact OD2-NE 3.38Å; D796-R800 IonicContact OD2-NH2 3.78Å; D796-R800 PolarHBondContact OD2-NH2 3.15Å
797	L	90.4	Very high	81.1	Confident	17 Å²	17	70.4 Å²	70.4	9%	0.089	37%	0.366	C	S	.	.	H	α-helix	trans	-63.5	-48.1	169.3	176.8	63.9	0	0	0	111.9	W793 L794 E795 R799 R800 L801 P813 T821	W793-L797 HydrophobicContact CZ3-CD2 3.89Å; W793-L797 WeakPolarHBondContact O-CB 3.2Å; W793-L797 PolarHBondContact O-N 3.29Å; L794-L797 HydrophobicContact CD1-CD2 4.44Å; L794-L797 PolarHBondContact O-N 3.2Å; E795-L797 VanDerWaalsContact C-N 3.31Å; E795-L797 PolarHBondContact O-N 3.09Å; L797-R799 VanDerWaalsContact C-N 3.3Å; L797-R799 PolarHBondContact O-N 3.37Å; L797-R800 PolarHBondContact O-N 3.1Å; L797-L801 HydrophobicContact CD1-CD1 3.55Å; L797-L801 HydrophobicContact CD1-CG 3.95Å; L797-L801 HydrophobicContact CD2-CD1 4.45Å; L797-L801 HydrophobicContact CG-CD1 3.84Å; L797-L801 WeakPolarHBondContact O-CB 3.44Å; L797-L801 WeakPolarHBondContact O-CG 3.43Å; L797-L801 PolarHBondContact O-N 3.27Å; L797-P813 HydrophobicContact CD2-CG 4.18Å; L797-P813 HydrophobicContact CG-CG 4.39Å; L797-T821 HydrophobicContact CD1-CG2 3.97Å; L797-T821 HydrophobicContact CD2-CG2 4Å
798	A	87.2	Confident	80.9	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-59.2	-43.1	179.8	0	0	0	0	0	111.4	L794 E795 K802 S803 F805 P813	L794-A798 WeakPolarHBondContact O-CB 3.31Å; L794-A798 PolarHBondContact O-N 3.24Å; E795-A798 WeakPolarHBondContact O-CB 3.17Å; E795-A798 PolarHBondContact O-N 3.28Å; A798-K802 PolarHBondContact O-N 3.39Å; A798-S803 WeakPolarHBondContact CB-O 3.27Å; A798-S803 CarbonylContact O-C 3.37Å; A798-S803 PolarHBondContact O-N 2.87Å; A798-F805 HydrophobicContact CB-CD2 3.88Å; A798-F805 HydrophobicContact CB-CE2 3.67Å; A798-P813 HydrophobicContact CB-CG 4.46Å
799	R	85.8	Confident	80.8	Confident	123 Å²	123	74.3 Å²	74.3	46%	0.464	36%	0.362	S	S	.	.	H	α-helix	trans	-59.7	-52	172.5	-172	-171.8	-58.2	147.2	-3.5	112.4	D790 E795 D796 L797 L801 K802	D790-R799 PolarHBondContact O-NH2 3.14Å; E795-R799 VanDerWaalsContact O-CB 3.25Å; E795-R799 WeakPolarHBondContact O-CB 3.31Å; E795-R799 PolarHBondContact O-N 3.31Å; D796-R799 IonicContact OD1-CZ 3.3Å; D796-R799 IonicContact OD1-NH1 3.33Å; D796-R799 PolarHBondContact OD1-NH1 3.3Å; L797-R799 VanDerWaalsContact C-N 3.3Å; L797-R799 PolarHBondContact O-N 3.37Å; R799-L801 VanDerWaalsContact C-N 3.34Å; R799-L801 PolarHBondContact O-N 2.83Å; R799-K802 PolarHBondContact O-N 3.18Å; R799-K802 VanDerWaalsContact O-N 3.14Å
800	R	88	Confident	80.6	Confident	134 Å²	134	73.9 Å²	73.9	51%	0.506	36%	0.36	S	S	.	.	H	α-helix	trans	-61.7	-37.6	178.8	-74.3	173.8	-164.2	-128.3	10	113.1	D796 L797 K802 N837	D796-R800 WeakPolarHBondContact O-CB 3.14Å; D796-R800 WeakPolarHBondContact O-CG 3.48Å; D796-R800 PolarHBondContact O-N 3.47Å; D796-R800 IonicContact OD2-CZ 3.92Å; D796-R800 IonicContact OD2-NE 2.66Å; D796-R800 PolarHBondContact OD2-NE 3.38Å; D796-R800 IonicContact OD2-NH2 3.78Å; D796-R800 PolarHBondContact OD2-NH2 3.15Å; L797-R800 PolarHBondContact O-N 3.1Å; R800-K802 VanDerWaalsContact C-N 3.28Å; R800-K802 PolarHBondContact O-N 3.32Å; R800-N837 PolarHBondContact NH1-O 3.44Å; R800-N837 VanDerWaalsContact NH1-O 3.11Å
801	L	88.5	Confident	80.5	Confident	83 Å²	83	70.4 Å²	70.4	44%	0.435	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-2.6	178	-70.6	173.5	0	0	0	114	L797 R799 S803 P813 S817	L797-L801 HydrophobicContact CD1-CD1 3.55Å; L797-L801 HydrophobicContact CD1-CG 3.95Å; L797-L801 HydrophobicContact CD2-CD1 4.45Å; L797-L801 HydrophobicContact CG-CD1 3.84Å; L797-L801 WeakPolarHBondContact O-CB 3.44Å; L797-L801 WeakPolarHBondContact O-CG 3.43Å; L797-L801 PolarHBondContact O-N 3.27Å; R799-L801 VanDerWaalsContact C-N 3.34Å; R799-L801 PolarHBondContact O-N 2.83Å; L801-S803 PolarHBondContact O-N 3Å; L801-P813 HydrophobicContact CD1-CB 3.74Å; L801-S817 VanDerWaalsContact CD1-OG 3.3Å; L801-S817 WeakPolarHBondContact CD1-OG 3.45Å
802	K	85.1	Confident	80.3	Confident	191 Å²	191	66.2 Å²	66.2	83%	0.83	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	29.8	-174.1	-51.4	-178.5	-178.7	-178.5	0	113	A798 R799 R800 P804	A798-K802 PolarHBondContact O-N 3.39Å; R799-K802 PolarHBondContact O-N 3.18Å; R799-K802 VanDerWaalsContact O-N 3.14Å; R800-K802 VanDerWaalsContact C-N 3.28Å; R800-K802 PolarHBondContact O-N 3.32Å; K802-P804 WeakPolarHBondContact O-CD 3.47Å
803	S	85.8	Confident	80.3	Confident	34 Å²	34	66.1 Å²	66.1	24%	0.238	34%	0.336	C	S	.	.			trans	-123.9	64.2	176.9	63.7	0	0	0	0	109.7	A798 L801 G812 P813	A798-S803 WeakPolarHBondContact CB-O 3.27Å; A798-S803 CarbonylContact O-C 3.37Å; A798-S803 PolarHBondContact O-N 2.87Å; L801-S803 PolarHBondContact O-N 3Å; S803-G812 CarbonylContact O-C 3.39Å; S803-G812 VanDerWaalsContact O-CA 3.25Å; S803-G812 WeakPolarHBondContact O-CA 3.31Å; S803-P813 WeakPolarHBondContact OG-CA 3.37Å
804	P	80.2	Confident	80	Confident	75 Å²	75	70.6 Å²	70.6	49%	0.487	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-63.4	159.7	-179.9	29.4	-36.4	0	0	0	111.6	K802 G812	K802-P804 WeakPolarHBondContact O-CD 3.47Å; P804-G812 PolarHBondContact O-N 2.87Å
805	F	78.1	Confident	79.7	Confident	42 Å²	42	74.1 Å²	74.1	18%	0.184	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-74.7	143.3	167.7	-60.9	-88.6	0	0	0	109.9	L794 E795 A798	L794-F805 HydrophobicContact CD2-CE2 4.29Å; L794-F805 HydrophobicContact CD2-CZ 3.77Å; L794-F805 HydrophobicContact CG-CE2 4.32Å; L794-F805 HydrophobicContact CG-CZ 4.11Å; E795-F805 VanDerWaalsContact OE2-CD2 3.31Å; E795-F805 WeakPolarHBondContact OE2-CD2 3.3Å; A798-F805 HydrophobicContact CB-CD2 3.88Å; A798-F805 HydrophobicContact CB-CE2 3.67Å
806	Q	71.5	Confident	79.8	Confident	124 Å²	124	73.4 Å²	73.4	58%	0.579	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-82	163.9	173.4	-60.7	169.7	-22.2	0	0	110.1	N808 R809 S810	Q806-N808 PolarHBondContact O-N 3.16Å; Q806-R809 WeakPolarHBondContact O-CA 3.44Å; Q806-R809 PolarHBondContact O-N 3.47Å; Q806-S810 WeakPolarHBondContact CB-O 3.36Å; Q806-S810 VanDerWaalsContact CG-O 3.31Å; Q806-S810 WeakPolarHBondContact CG-O 3.47Å; Q806-S810 PolarHBondContact N-O 2.95Å; Q806-S810 PolarHBondContact OE1-OG 2.69Å
807	L	67	Low	79.9	Confident	162 Å²	162	73.6 Å²	73.6	85%	0.848	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-31.7	178.1	-77.7	150.5	0	0	0	114	R809	L807-R809 PolarHBondContact O-N 2.95Å
808	N	62.3	Low	79.9	Confident	82 Å²	82	73.6 Å²	73.6	44%	0.439	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	15.8	177	-63.3	11	0	0	0	113.3	Q806 S810	Q806-N808 PolarHBondContact O-N 3.16Å; N808-S810 PolarHBondContact O-N 2.81Å
809	R	62.6	Low	80.2	Confident	116 Å²	116	74.5 Å²	74.5	44%	0.438	39%	0.391	S	S	.	.	S	Bend	trans	53.2	19.1	-171.1	-59	-176.6	-176.6	149.4	5.8	114.5	D787 Q806 L807	D787-R809 VanDerWaalsContact CG-NH1 3.28Å; D787-R809 IonicContact OD1-CZ 3.15Å; D787-R809 IonicContact OD1-NE 2.72Å; D787-R809 PolarHBondContact OD1-NE 3.24Å; D787-R809 IonicContact OD1-NH1 3.55Å; D787-R809 PolarHBondContact OD1-NH1 3.48Å; D787-R809 IonicContact OD1-NH2 2.71Å; D787-R809 IonicContact OD2-NH1 2.74Å; Q806-R809 WeakPolarHBondContact O-CA 3.44Å; Q806-R809 PolarHBondContact O-N 3.47Å; L807-R809 PolarHBondContact O-N 2.95Å
810	S	64	Low	80.6	Confident	46 Å²	46	75.1 Å²	75.1	32%	0.322	40%	0.398	S	S	.	.			trans	-84	148.2	170.1	45.9	0	0	0	0	111.3	Q806 N808	Q806-S810 WeakPolarHBondContact CB-O 3.36Å; Q806-S810 VanDerWaalsContact CG-O 3.31Å; Q806-S810 WeakPolarHBondContact CG-O 3.47Å; Q806-S810 PolarHBondContact N-O 2.95Å; Q806-S810 PolarHBondContact OE1-OG 2.69Å; N808-S810 PolarHBondContact O-N 2.81Å
811	G	68.8	Low	80.9	Confident	55 Å²	55	69.9 Å²	69.9	57%	0.567	38%	0.38	S	S	*	.	B	Isolated β-bridge	trans	89.5	-146.1	-173.9	0	0	0	0	0	112.8
812	G	80.5	Confident	81.2	Confident	19 Å²	19	65.9 Å²	65.9	20%	0.196	36%	0.36	C	S	.	.			trans	89.5	-179.1	-168.6	0	0	0	0	0	114.3	S803 P804	S803-G812 CarbonylContact O-C 3.39Å; S803-G812 VanDerWaalsContact O-CA 3.25Å; S803-G812 WeakPolarHBondContact O-CA 3.31Å; P804-G812 PolarHBondContact O-N 2.87Å
813	P	85.5	Confident	81.6	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.032	33%	0.33	C	S	.	.	S	Bend	trans	-72.3	157.9	177.6	29.4	-34.7	0	0	0	112.9	L797 A798 L801 S803 K818	L797-P813 HydrophobicContact CD2-CG 4.18Å; L797-P813 HydrophobicContact CG-CG 4.39Å; A798-P813 HydrophobicContact CB-CG 4.46Å; L801-P813 HydrophobicContact CD1-CB 3.74Å; S803-P813 WeakPolarHBondContact OG-CA 3.37Å; P813-K818 HydrophobicContact CG-CG 3.98Å; P813-K818 WeakPolarHBondContact O-CD 3.42Å; P813-K818 WeakPolarHBondContact O-CE 3.46Å
814	T	86.3	Confident	82.1	Confident	100 Å²	100	60.9 Å²	60.9	61%	0.613	33%	0.334	S	S	*	.			trans	-66.7	150.8	-177.8	65.1	0	0	0	0	112.9	G816 S817 K818	T814-G816 VanDerWaalsContact C-N 3.25Å; T814-G816 PolarHBondContact O-N 3.42Å; T814-S817 CarbonylContact O-C 3.6Å; T814-S817 WeakPolarHBondContact O-CA 3.46Å; T814-S817 WeakPolarHBondContact O-CB 3.16Å; T814-S817 PolarHBondContact O-N 3.31Å; T814-S817 WeakPolarHBondContact OG1-CB 3.2Å; T814-S817 PolarHBondContact OG1-N 3.28Å; T814-K818 WeakPolarHBondContact O-CG 3.4Å; T814-K818 PolarHBondContact O-N 2.99Å
815	E	82.5	Confident	82.7	Confident	76 Å²	76	57.8 Å²	57.8	36%	0.355	31%	0.312	S	S	.	.	H	α-helix	trans	-56.6	-37	179.9	-51.6	-38.5	118.9	0	0	113.4	K818 Y819	E815-K818 PolarHBondContact O-N 2.81Å; E815-K818 IonicContact OE1-NZ 3.36Å; E815-K818 PolarHBondContact OE1-NZ 2.83Å; E815-K818 WeakPolarHBondContact OE2-CD 3.37Å; E815-K818 IonicContact OE2-NZ 2.9Å; E815-K818 PolarHBondContact OE2-NZ 3.47Å; E815-Y819 WeakPolarHBondContact O-CB 3.35Å; E815-Y819 PolarHBondContact O-N 3.09Å
816	G	87.4	Confident	83.5	Confident	32 Å²	32	55.8 Å²	55.8	33%	0.33	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-44.1	171.8	0	0	0	0	0	112.2	T814 Y819 F820	T814-G816 VanDerWaalsContact C-N 3.25Å; T814-G816 PolarHBondContact O-N 3.42Å; G816-Y819 PolarHBondContact O-N 3Å; G816-F820 WeakPolarHBondContact O-CB 3.33Å; G816-F820 WeakPolarHBondContact O-CD2 3.4Å; G816-F820 WeakPolarHBondContact O-CG 3.19Å; G816-F820 PolarHBondContact O-N 3Å
817	S	90.5	Very high	84.6	Confident	30 Å²	30	51.8 Å²	51.8	21%	0.21	29%	0.289	C	S	.	.	H	α-helix	trans	-67.5	-41.1	177.6	-164.8	0	0	0	0	112.5	L801 T814 T821	L801-S817 VanDerWaalsContact CD1-OG 3.3Å; L801-S817 WeakPolarHBondContact CD1-OG 3.45Å; T814-S817 CarbonylContact O-C 3.6Å; T814-S817 WeakPolarHBondContact O-CA 3.46Å; T814-S817 WeakPolarHBondContact O-CB 3.16Å; T814-S817 PolarHBondContact O-N 3.31Å; T814-S817 WeakPolarHBondContact OG1-CB 3.2Å; T814-S817 PolarHBondContact OG1-N 3.28Å; S817-T821 VanDerWaalsContact O-CB 3.32Å; S817-T821 WeakPolarHBondContact O-CB 3.43Å; S817-T821 PolarHBondContact O-N 2.97Å; S817-T821 PolarHBondContact O-OG1 3.25Å
818	K	90.8	Very high	85.9	Confident	16 Å²	16	44.4 Å²	44.4	7%	0.07	25%	0.251	C	S	.	.	H	α-helix	trans	-57.3	-50.1	174.7	-68.5	159.6	160.2	173.7	0	110.7	F604 Y779 L794 P813 T814 E815 A822	F604-K818 HydrophobicContact CE1-CB 4.2Å; Y779-K818 HydrophobicContact CD2-CB 4.42Å; Y779-K818 HydrophobicContact CE2-CB 4.02Å; Y779-K818 HydrophobicContact CE2-CD 4.02Å; Y779-K818 HydrophobicContact CE2-CG 4.16Å; Y779-K818 PolarHBondContact OH-NZ 3.13Å; L794-K818 HydrophobicContact CD1-CG 4.24Å; P813-K818 HydrophobicContact CG-CG 3.98Å; P813-K818 WeakPolarHBondContact O-CD 3.42Å; P813-K818 WeakPolarHBondContact O-CE 3.46Å; T814-K818 WeakPolarHBondContact O-CG 3.4Å; T814-K818 PolarHBondContact O-N 2.99Å; E815-K818 PolarHBondContact O-N 2.81Å; E815-K818 IonicContact OE1-NZ 3.36Å; E815-K818 PolarHBondContact OE1-NZ 2.83Å; E815-K818 WeakPolarHBondContact OE2-CD 3.37Å; E815-K818 IonicContact OE2-NZ 2.9Å; E815-K818 PolarHBondContact OE2-NZ 3.47Å; K818-A822 WeakPolarHBondContact O-CB 3.41Å; K818-A822 PolarHBondContact O-N 3Å
819	Y	93	Very high	87.3	Confident	19 Å²	19	41.3 Å²	41.3	8%	0.075	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-50.6	178.7	176.1	-105.3	0	0	0	112.6	F596 Y600 F604 H772 E815 G816 T821 A822 L823	F596-Y819 VanDerWaalsContact CZ-OH 3.31Å; F596-Y819 WeakPolarHBondContact CZ-OH 3.19Å; Y600-Y819 AromaticContact CD2-CD2 3.95Å; Y600-Y819 HydrophobicContact CD2-CD2 3.95Å; Y600-Y819 HydrophobicContact CD2-CE2 4.1Å; Y600-Y819 HydrophobicContact CD2-CG 4.46Å; Y600-Y819 AromaticContact CE2-CD2 3.98Å; Y600-Y819 HydrophobicContact CE2-CD2 3.98Å; Y600-Y819 HydrophobicContact CE2-CE2 4.48Å; Y600-Y819 HydrophobicContact CE2-CG 4.04Å; F604-Y819 HydrophobicContact CD2-CD2 4.21Å; F604-Y819 HydrophobicContact CE1-CD2 4.35Å; F604-Y819 AromaticContact CE2-CD2 3.65Å; F604-Y819 HydrophobicContact CE2-CD2 3.65Å; F604-Y819 HydrophobicContact CE2-CE2 4.41Å; F604-Y819 AromaticContact CZ-CD2 3.73Å; F604-Y819 HydrophobicContact CZ-CD2 3.73Å; F604-Y819 HydrophobicContact CZ-CG 4.4Å; H772-Y819 AromaticContact CE1-CE2 3.95Å; H772-Y819 AromaticContact ND1-CE2 3.62Å; H772-Y819 AromaticContact ND1-CZ 3.74Å; H772-Y819 PolarHBondContact ND1-OH 3.1Å; E815-Y819 WeakPolarHBondContact O-CB 3.35Å; E815-Y819 PolarHBondContact O-N 3.09Å; G816-Y819 PolarHBondContact O-N 3Å; Y819-T821 PolarHBondContact O-N 2.9Å; Y819-A822 PolarHBondContact O-N 3.42Å; Y819-L823 HydrophobicContact CE1-CD2 4.04Å; Y819-L823 WeakPolarHBondContact O-CB 3.49Å; Y819-L823 PolarHBondContact O-N 3.32Å
820	F	94.2	Very high	88.7	Confident	137 Å²	137	35.8 Å²	35.8	60%	0.601	22%	0.215	S	C	*	.	H	α-helix	trans	-67.2	-34.2	-177.7	-72.5	-55.1	0	0	0	112.7	G816 Y824	G816-F820 WeakPolarHBondContact O-CB 3.33Å; G816-F820 WeakPolarHBondContact O-CD2 3.4Å; G816-F820 WeakPolarHBondContact O-CG 3.19Å; G816-F820 PolarHBondContact O-N 3Å; F820-Y824 WeakPolarHBondContact O-CB 3.44Å; F820-Y824 PolarHBondContact O-N 3.44Å
821	T	93.8	Very high	90.1	Very high	23 Å²	23	36 Å²	36	14%	0.141	22%	0.215	C	C	.	.	H	α-helix	trans	-67.6	-43.4	173.1	-60.9	0	0	0	0	111.8	W793 L797 S817 Y819 L823 Y824 F825 V838	W793-T821 HydrophobicContact CE3-CG2 4.33Å; W793-T821 HydrophobicContact CZ3-CG2 3.76Å; L797-T821 HydrophobicContact CD1-CG2 3.97Å; L797-T821 HydrophobicContact CD2-CG2 4Å; S817-T821 VanDerWaalsContact O-CB 3.32Å; S817-T821 WeakPolarHBondContact O-CB 3.43Å; S817-T821 PolarHBondContact O-N 2.97Å; S817-T821 PolarHBondContact O-OG1 3.25Å; Y819-T821 PolarHBondContact O-N 2.9Å; T821-L823 PolarHBondContact O-N 2.8Å; T821-Y824 PolarHBondContact O-N 3.16Å; T821-F825 PolarHBondContact O-N 3.39Å; T821-V838 HydrophobicContact CG2-CG2 3.52Å
822	A	94.5	Very high	91.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-43.5	175.9	0	0	0	0	0	111.8	A775 W793 K818 Y819 T826	A775-A822 HydrophobicContact CB-CB 4.14Å; W793-A822 HydrophobicContact CH2-CB 3.96Å; W793-A822 HydrophobicContact CZ2-CB 4.33Å; K818-A822 WeakPolarHBondContact O-CB 3.41Å; K818-A822 PolarHBondContact O-N 3Å; Y819-A822 PolarHBondContact O-N 3.42Å; A822-T826 WeakPolarHBondContact O-CG2 3.31Å; A822-T826 PolarHBondContact O-N 2.73Å; A822-T826 VanDerWaalsContact O-N 3.12Å; A822-T826 PolarHBondContact O-OG1 3Å; A822-T826 VanDerWaalsContact O-OG1 3.11Å
823	L	94.9	Very high	91.7	Very high	39 Å²	39	40.4 Å²	40.4	20%	0.204	23%	0.23	C	C	.	.	H	α-helix	trans	-65	-41.3	175.6	-173.1	66.6	0	0	0	111.7	A771 A775 Y819 T821 T826 C827	A771-L823 HydrophobicContact CB-CD1 4.33Å; A775-L823 HydrophobicContact CB-CB 4.17Å; A775-L823 HydrophobicContact CB-CD1 4.16Å; Y819-L823 HydrophobicContact CE1-CD2 4.04Å; Y819-L823 WeakPolarHBondContact O-CB 3.49Å; Y819-L823 PolarHBondContact O-N 3.32Å; T821-L823 PolarHBondContact O-N 2.8Å; L823-T826 PolarHBondContact O-OG1 2.76Å; L823-C827 WeakPolarHBondContact O-CB 3.25Å; L823-C827 PolarHBondContact O-N 2.69Å; L823-C827 PolarHBondContact O-SG 2.99Å
824	Y	94.9	Very high	91.8	Very high	80 Å²	80	42.7 Å²	42.7	31%	0.314	25%	0.254	S	S	.	.	H	α-helix	trans	-60.5	-48.2	176.7	165.3	-101.1	0	0	0	112.1	F820 T821 S828 F835 N837 V838	F820-Y824 WeakPolarHBondContact O-CB 3.44Å; F820-Y824 PolarHBondContact O-N 3.44Å; T821-Y824 PolarHBondContact O-N 3.16Å; Y824-S828 WeakPolarHBondContact O-CB 3.21Å; Y824-S828 PolarHBondContact O-N 3.46Å; Y824-S828 PolarHBondContact O-OG 2.94Å; Y824-F835 AromaticContact CE2-CD2 3.64Å; Y824-F835 HydrophobicContact CE2-CD2 3.64Å; Y824-F835 AromaticContact CE2-CE2 3.89Å; Y824-F835 HydrophobicContact CE2-CE2 3.89Å; Y824-F835 AromaticContact CZ-CD2 3.63Å; Y824-F835 WeakPolarHBondContact OH-CB 3.36Å; Y824-F835 VanDerWaalsContact OH-CD2 3.24Å; Y824-F835 WeakPolarHBondContact OH-CD2 3.48Å; Y824-F835 VanDerWaalsContact OH-CG 3.3Å; Y824-F835 WeakPolarHBondContact OH-CG 3.43Å; Y824-N837 HydrophobicContact CE1-CB 4.04Å; Y824-N837 PolarHBondContact OH-ND2 3.32Å; Y824-V838 HydrophobicContact CD1-CG2 4.32Å; Y824-V838 HydrophobicContact CE1-CG2 4.44Å
825	F	94.4	Very high	92.1	Very high	10 Å²	10	43.7 Å²	43.7	4%	0.044	25%	0.251	C	S	.	.	H	α-helix	trans	-55.9	-57.9	176.1	172.7	-109.5	0	0	0	110.5	W778 T821 C827 S828 S829 V838 A849	W778-F825 AromaticContact CD1-CD1 3.96Å; W778-F825 AromaticContact CD2-CD1 3.61Å; W778-F825 HydrophobicContact CD2-CD1 3.61Å; W778-F825 AromaticContact CD2-CE1 3.59Å; W778-F825 HydrophobicContact CD2-CE1 3.59Å; W778-F825 AromaticContact CE2-CD1 3.36Å; W778-F825 AromaticContact CE2-CE1 3.5Å; W778-F825 VanDerWaalsContact CE2-CE1 3.5Å; W778-F825 HydrophobicContact CE3-CD1 4.19Å; W778-F825 AromaticContact CE3-CE1 3.68Å; W778-F825 HydrophobicContact CE3-CE1 3.68Å; W778-F825 AromaticContact CG-CD1 3.95Å; W778-F825 HydrophobicContact CG-CD1 3.95Å; W778-F825 HydrophobicContact CG-CE1 4.34Å; W778-F825 HydrophobicContact CH2-CD1 4.24Å; W778-F825 AromaticContact CH2-CE1 3.54Å; W778-F825 HydrophobicContact CH2-CE1 3.54Å; W778-F825 HydrophobicContact CH2-CE2 4.44Å; W778-F825 AromaticContact CH2-CZ 3.65Å; W778-F825 HydrophobicContact CH2-CZ 3.65Å; W778-F825 AromaticContact CZ2-CD1 3.72Å; W778-F825 HydrophobicContact CZ2-CD1 3.72Å; W778-F825 HydrophobicContact CZ2-CD2 4.46Å; W778-F825 AromaticContact CZ2-CE1 3.5Å; W778-F825 HydrophobicContact CZ2-CE1 3.5Å; W778-F825 VanDerWaalsContact CZ2-CE1 3.5Å; W778-F825 HydrophobicContact CZ2-CE2 4.27Å; W778-F825 HydrophobicContact CZ2-CG 4.21Å; W778-F825 AromaticContact CZ2-CZ 3.79Å; W778-F825 HydrophobicContact CZ2-CZ 3.79Å; W778-F825 HydrophobicContact CZ3-CD1 4.46Å; W778-F825 AromaticContact CZ3-CE1 3.63Å; W778-F825 HydrophobicContact CZ3-CE1 3.63Å; W778-F825 HydrophobicContact CZ3-CZ 4.06Å; W778-F825 AromaticContact NE1-CD1 3.6Å; T821-F825 PolarHBondContact O-N 3.39Å; F825-C827 PolarHBondContact O-N 3.06Å; F825-S828 PolarHBondContact O-N 2.93Å; F825-S828 PolarHBondContact O-OG 2.89Å; F825-S829 PolarHBondContact O-N 3.22Å; F825-S829 PolarHBondContact O-OG 2.94Å; F825-V838 HydrophobicContact CB-CB 4.13Å; F825-V838 HydrophobicContact CB-CG1 4.01Å; F825-V838 HydrophobicContact CD2-CB 3.93Å; F825-V838 HydrophobicContact CD2-CG1 3.86Å; F825-V838 WeakPolarHBondContact CD2-O 3.31Å; F825-V838 HydrophobicContact CG-CB 4.34Å; F825-V838 HydrophobicContact CG-CG1 4.02Å; F825-A849 HydrophobicContact CZ-CB 4.33Å
826	T	95	Very high	92.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.8	-35.1	-175.5	59.8	0	0	0	0	113.1	A771 C774 W778 A822 L823 L830 I852	A771-T826 PolarHBondContact O-OG1 2.93Å; A771-T826 VanDerWaalsContact O-OG1 3.1Å; C774-T826 HydrophobicContact CB-CG2 3.89Å; W778-T826 HydrophobicContact CB-CG2 4.24Å; A822-T826 WeakPolarHBondContact O-CG2 3.31Å; A822-T826 PolarHBondContact O-N 2.73Å; A822-T826 VanDerWaalsContact O-N 3.12Å; A822-T826 PolarHBondContact O-OG1 3Å; A822-T826 VanDerWaalsContact O-OG1 3.11Å; L823-T826 PolarHBondContact O-OG1 2.76Å; T826-L830 VanDerWaalsContact O-CB 3.3Å; T826-L830 WeakPolarHBondContact O-CB 3.25Å; T826-L830 VanDerWaalsContact O-CG 3.23Å; T826-L830 WeakPolarHBondContact O-CG 3.49Å; T826-L830 PolarHBondContact O-N 3.05Å; T826-I852 HydrophobicContact CG2-CD1 3.68Å
827	C	93.5	Very high	92.2	Very high	40 Å²	40	45.2 Å²	45.2	27%	0.27	27%	0.266	S	S	.	.	H	α-helix	trans	-62.2	-46.2	170.5	-69.6	0	0	0	0	111.2	L823 F825 S829 L830 T831	L823-C827 WeakPolarHBondContact O-CB 3.25Å; L823-C827 PolarHBondContact O-N 2.69Å; L823-C827 PolarHBondContact O-SG 2.99Å; F825-C827 PolarHBondContact O-N 3.06Å; C827-S829 VanDerWaalsContact C-N 3.3Å; C827-S829 PolarHBondContact O-N 3.26Å; C827-L830 PolarHBondContact O-N 3.13Å; C827-T831 WeakPolarHBondContact O-CG2 3.47Å; C827-T831 PolarHBondContact O-N 2.99Å; C827-T831 PolarHBondContact O-OG1 3.47Å
828	S	93.8	Very high	92.2	Very high	8 Å²	8	44.9 Å²	44.9	6%	0.056	26%	0.262	C	S	.	.	H	α-helix	trans	-66.4	-30.2	-178	78.8	0	0	0	0	113.5	Y824 F825 T831 S832 V833 G834	Y824-S828 WeakPolarHBondContact O-CB 3.21Å; Y824-S828 PolarHBondContact O-N 3.46Å; Y824-S828 PolarHBondContact O-OG 2.94Å; F825-S828 PolarHBondContact O-N 2.93Å; F825-S828 PolarHBondContact O-OG 2.89Å; S828-T831 PolarHBondContact O-OG1 3.01Å; S828-S832 PolarHBondContact O-N 3.19Å; S828-V833 PolarHBondContact O-N 2.77Å; S828-G834 PolarHBondContact O-N 3.24Å
829	S	93.3	Very high	92.1	Very high	17 Å²	17	46.3 Å²	46.3	12%	0.119	27%	0.274	C	S	.	.	H	α-helix	trans	-77.5	-41.5	172.7	-56.5	0	0	0	0	112.2	F825 C827 T831 S832 I852	F825-S829 PolarHBondContact O-N 3.22Å; F825-S829 PolarHBondContact O-OG 2.94Å; C827-S829 VanDerWaalsContact C-N 3.3Å; C827-S829 PolarHBondContact O-N 3.26Å; S829-T831 VanDerWaalsContact C-N 3.34Å; S829-T831 PolarHBondContact O-N 3.39Å; S829-S832 PolarHBondContact O-N 2.72Å; S829-S832 VanDerWaalsContact O-N 3.09Å; S829-I852 VanDerWaalsContact CB-CG2 3.46Å
830	L	92.2	Very high	92.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-68.7	-28.8	177.7	-72.7	170.8	0	0	0	113.3	F767 V770 A771 T826 C827 S832 I852 L855 M859	F767-L830 HydrophobicContact CE2-CB 3.85Å; F767-L830 HydrophobicContact CZ-CB 3.61Å; V770-L830 HydrophobicContact CG1-CD1 4.36Å; A771-L830 VanDerWaalsContact CA-CD1 3.49Å; A771-L830 HydrophobicContact CB-CD1 3.68Å; T826-L830 VanDerWaalsContact O-CB 3.3Å; T826-L830 WeakPolarHBondContact O-CB 3.25Å; T826-L830 VanDerWaalsContact O-CG 3.23Å; T826-L830 WeakPolarHBondContact O-CG 3.49Å; T826-L830 PolarHBondContact O-N 3.05Å; C827-L830 PolarHBondContact O-N 3.13Å; L830-S832 VanDerWaalsContact C-N 3.32Å; L830-I852 HydrophobicContact CD2-CG2 3.91Å; L830-I852 HydrophobicContact CG-CG2 3.9Å; L830-L855 HydrophobicContact CD2-CB 4.45Å; L830-L855 HydrophobicContact CD2-CD2 4.4Å; L830-L855 HydrophobicContact CD2-CG 4.19Å; L830-M859 HydrophobicContact CD2-SD 4.49Å
831	T	91.8	Very high	91.9	Very high	51 Å²	51	42.1 Å²	42.1	31%	0.313	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	2.4	170.8	59.2	0	0	0	0	113.6	F767 C827 S828 S829 V833	F767-T831 HydrophobicContact CE1-CG2 4.15Å; F767-T831 HydrophobicContact CZ-CG2 3.62Å; C827-T831 WeakPolarHBondContact O-CG2 3.47Å; C827-T831 PolarHBondContact O-N 2.99Å; C827-T831 PolarHBondContact O-OG1 3.47Å; S828-T831 PolarHBondContact O-OG1 3.01Å; S829-T831 VanDerWaalsContact C-N 3.34Å; S829-T831 PolarHBondContact O-N 3.39Å; T831-V833 PolarHBondContact O-N 3.2Å; T831-V833 WeakPolarHBondContact OG1-CG2 3.43Å
832	S	91.1	Very high	91.8	Very high	85 Å²	85	41.8 Å²	41.8	59%	0.594	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	24.7	-175.3	58.4	0	0	0	0	115.6	S828 S829 L830	S828-S832 PolarHBondContact O-N 3.19Å; S829-S832 PolarHBondContact O-N 2.72Å; S829-S832 VanDerWaalsContact O-N 3.09Å; L830-S832 VanDerWaalsContact C-N 3.32Å
833	V	92.7	Very high	91.6	Very high	80 Å²	80	46.7 Å²	46.7	49%	0.485	29%	0.291	S	S	.	.			trans	-85.7	-36.9	179.1	176	0	0	0	0	112.5	S828 T831 F835	S828-V833 PolarHBondContact O-N 2.77Å; T831-V833 PolarHBondContact O-N 3.2Å; T831-V833 WeakPolarHBondContact OG1-CG2 3.43Å; V833-F835 HydrophobicContact CG1-CD1 4.01Å; V833-F835 HydrophobicContact CG1-CD2 4.06Å; V833-F835 HydrophobicContact CG1-CE1 3.66Å; V833-F835 HydrophobicContact CG1-CE2 3.72Å; V833-F835 HydrophobicContact CG1-CG 4.2Å; V833-F835 HydrophobicContact CG1-CZ 3.51Å; V833-F835 PolarHBondContact O-N 3.4Å
834	G	87.8	Confident	91.4	Very high	53 Å²	53	48.7 Å²	48.7	55%	0.546	30%	0.301	S	S	.	.			trans	56.2	49.8	165.9	0	0	0	0	0	116.9	S828 G836	S828-G834 PolarHBondContact O-N 3.24Å; G834-G836 PolarHBondContact O-N 2.91Å
835	F	91.3	Very high	91.4	Very high	122 Å²	122	44.9 Å²	44.9	54%	0.535	29%	0.286	S	S	.	.			trans	-56.6	-13.8	-173	-67.9	-70.4	0	0	0	117.6	Y824 V833 N837	Y824-F835 AromaticContact CE2-CD2 3.64Å; Y824-F835 HydrophobicContact CE2-CD2 3.64Å; Y824-F835 AromaticContact CE2-CE2 3.89Å; Y824-F835 HydrophobicContact CE2-CE2 3.89Å; Y824-F835 AromaticContact CZ-CD2 3.63Å; Y824-F835 WeakPolarHBondContact OH-CB 3.36Å; Y824-F835 VanDerWaalsContact OH-CD2 3.24Å; Y824-F835 WeakPolarHBondContact OH-CD2 3.48Å; Y824-F835 VanDerWaalsContact OH-CG 3.3Å; Y824-F835 WeakPolarHBondContact OH-CG 3.43Å; V833-F835 HydrophobicContact CG1-CD1 4.01Å; V833-F835 HydrophobicContact CG1-CD2 4.06Å; V833-F835 HydrophobicContact CG1-CE1 3.66Å; V833-F835 HydrophobicContact CG1-CE2 3.72Å; V833-F835 HydrophobicContact CG1-CG 4.2Å; V833-F835 HydrophobicContact CG1-CZ 3.51Å; V833-F835 PolarHBondContact O-N 3.4Å; F835-N837 PolarHBondContact O-N 3.1Å
836	G	86.2	Confident	91.4	Very high	51 Å²	51	49.5 Å²	49.5	53%	0.526	31%	0.306	S	S	.	.	S	Bend	trans	72.1	-10.5	179	0	0	0	0	0	116.8	G834 V838	G834-G836 PolarHBondContact O-N 2.91Å; G836-V838 PolarHBondContact O-N 3.12Å
837	N	87.3	Confident	91.4	Very high	89 Å²	89	54 Å²	54	48%	0.476	33%	0.33	S	S	.	.	S	Bend	trans	-61.1	-25.2	176.5	-75.9	-37.4	0	0	0	114.2	R800 Y824 F835	R800-N837 PolarHBondContact NH1-O 3.44Å; R800-N837 VanDerWaalsContact NH1-O 3.11Å; Y824-N837 HydrophobicContact CE1-CB 4.04Å; Y824-N837 PolarHBondContact OH-ND2 3.32Å; F835-N837 PolarHBondContact O-N 3.1Å
838	V	90.2	Very high	91.5	Very high	23 Å²	23	53.6 Å²	53.6	14%	0.139	32%	0.323	C	S	.	.	S	Bend	trans	-129.3	128.4	168.8	-178.1	0	0	0	0	105.8	W778 W793 T821 Y824 F825 G836	W778-V838 HydrophobicContact CZ2-CG1 4.2Å; W793-V838 HydrophobicContact CB-CG1 4.31Å; W793-V838 HydrophobicContact CE3-CG1 4.19Å; T821-V838 HydrophobicContact CG2-CG2 3.52Å; Y824-V838 HydrophobicContact CD1-CG2 4.32Å; Y824-V838 HydrophobicContact CE1-CG2 4.44Å; F825-V838 HydrophobicContact CB-CB 4.13Å; F825-V838 HydrophobicContact CB-CG1 4.01Å; F825-V838 HydrophobicContact CD2-CB 3.93Å; F825-V838 HydrophobicContact CD2-CG1 3.86Å; F825-V838 WeakPolarHBondContact CD2-O 3.31Å; F825-V838 HydrophobicContact CG-CB 4.34Å; F825-V838 HydrophobicContact CG-CG1 4.02Å; G836-V838 PolarHBondContact O-N 3.12Å
839	S	89	Confident	91.5	Very high	46 Å²	46	53.8 Å²	53.8	32%	0.322	33%	0.326	S	S	.	.			trans	-128.5	154.7	-174.7	53.3	0	0	0	0	111.1	N841	S839-N841 PolarHBondContact OG-OD1 3.39Å
840	A	92	Very high	91.5	Very high	22 Å²	22	58 Å²	58	18%	0.182	35%	0.346	C	S	.	.			trans	-84.1	110.7	169.6	0	0	0	0	0	109.8	W778 E845 K846 A849	W778-A840 HydrophobicContact CH2-CB 4.17Å; A840-E845 HydrophobicContact CB-CB 3.77Å; A840-K846 HydrophobicContact CB-CB 4.48Å; A840-K846 HydrophobicContact CB-CG 3.88Å; A840-K846 WeakPolarHBondContact O-CE 3.31Å; A840-K846 WeakPolarHBondContact O-CG 3.45Å; A840-A849 HydrophobicContact CB-CB 3.87Å
841	N	90.7	Very high	91.7	Very high	46 Å²	46	61.5 Å²	61.5	25%	0.246	37%	0.369	C	S	.	.			trans	-102.4	-42.4	-174.2	-60.3	-15.4	0	0	0	110.9	I791 S839 E845 K846	I791-N841 HydrophobicContact CG2-CB 4.2Å; I791-N841 VanDerWaalsContact O-CB 3.29Å; I791-N841 WeakPolarHBondContact O-CB 3.35Å; I791-N841 PolarHBondContact O-ND2 3.38Å; S839-N841 PolarHBondContact OG-OD1 3.39Å; N841-E845 WeakPolarHBondContact CA-OE2 3.24Å; N841-E845 PolarHBondContact N-OE2 3.13Å; N841-K846 VanDerWaalsContact O-CE 3.27Å; N841-K846 WeakPolarHBondContact O-CE 3.47Å; N841-K846 PolarHBondContact O-NZ 3.05Å
842	T	90.9	Very high	91.8	Very high	16 Å²	16	59.2 Å²	59.2	10%	0.098	36%	0.355	C	S	.	.	S	Bend	trans	-81.4	168.7	178.4	76.3	0	0	0	0	112.1	E785 E845 K846	E785-T842 WeakPolarHBondContact OE1-CB 3.38Å; E785-T842 PolarHBondContact OE1-OG1 2.96Å; E785-T842 VanDerWaalsContact OE1-OG1 3.07Å; E785-T842 VanDerWaalsContact OE2-CB 3.31Å; E785-T842 WeakPolarHBondContact OE2-CB 3.25Å; E785-T842 VanDerWaalsContact OE2-CG2 3.29Å; E785-T842 WeakPolarHBondContact OE2-CG2 3.33Å; E785-T842 PolarHBondContact OE2-OG1 2.83Å; T842-E845 HydrophobicContact CG2-CG 4.46Å; T842-E845 PolarHBondContact N-OE2 3.47Å; T842-E845 VanDerWaalsContact OG1-CB 3.26Å; T842-E845 WeakPolarHBondContact OG1-CB 3.22Å; T842-E845 WeakPolarHBondContact OG1-CG 3.31Å; T842-E845 PolarHBondContact OG1-N 3.43Å; T842-E845 VanDerWaalsContact OG1-N 3.09Å; T842-K846 WeakPolarHBondContact O-CB 3.49Å; T842-K846 VanDerWaalsContact O-CD 3.27Å; T842-K846 WeakPolarHBondContact O-CD 3.46Å; T842-K846 WeakPolarHBondContact O-CG 3.37Å; T842-K846 PolarHBondContact O-N 3.38Å
843	T	91.4	Very high	91.9	Very high	103 Å²	103	60.3 Å²	60.3	63%	0.632	35%	0.352	S	S	*	.	H	α-helix	trans	-66.5	-40.1	176.7	-54.6	0	0	0	0	112.1	K846 I847	T843-K846 PolarHBondContact O-N 3Å; T843-I847 HydrophobicContact CG2-CD1 4.08Å; T843-I847 VanDerWaalsContact O-CG1 3.32Å; T843-I847 WeakPolarHBondContact O-CG1 3.38Å; T843-I847 PolarHBondContact O-N 2.94Å
844	N	90.4	Very high	91.9	Very high	81 Å²	81	62 Å²	62	43%	0.433	36%	0.358	S	S	.	.	H	α-helix	trans	-71.9	-42.2	-178.7	-58.6	-55.7	0	0	0	111.2	I781 E785 K846 I847 F848	I781-N844 HydrophobicContact CG2-CB 4.43Å; E785-N844 WeakPolarHBondContact OE1-CB 3.29Å; E785-N844 PolarHBondContact OE1-ND2 3.06Å; N844-K846 VanDerWaalsContact C-N 3.29Å; N844-K846 PolarHBondContact O-N 3.36Å; N844-I847 PolarHBondContact O-N 3.32Å; N844-F848 WeakPolarHBondContact O-CB 3.35Å; N844-F848 PolarHBondContact O-N 2.9Å
845	E	93.9	Very high	92.2	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-55.7	-44.1	170.3	-73.3	169.7	171.8	0	0	111.6	W778 I781 G792 W793 A840 N841 T842 F848 A849	W778-E845 HydrophobicContact CH2-CB 3.74Å; W778-E845 HydrophobicContact CH2-CG 3.71Å; W778-E845 HydrophobicContact CZ3-CB 3.76Å; W778-E845 HydrophobicContact CZ3-CG 3.8Å; I781-E845 HydrophobicContact CG2-CG 4.09Å; G792-E845 WeakPolarHBondContact CA-OE1 3.17Å; W793-E845 WeakPolarHBondContact CB-OE1 3.42Å; W793-E845 VanDerWaalsContact CD1-OE1 3.23Å; W793-E845 PolarHBondContact N-OE1 3.18Å; A840-E845 HydrophobicContact CB-CB 3.77Å; N841-E845 WeakPolarHBondContact CA-OE2 3.24Å; N841-E845 PolarHBondContact N-OE2 3.13Å; T842-E845 HydrophobicContact CG2-CG 4.46Å; T842-E845 PolarHBondContact N-OE2 3.47Å; T842-E845 VanDerWaalsContact OG1-CB 3.26Å; T842-E845 WeakPolarHBondContact OG1-CB 3.22Å; T842-E845 WeakPolarHBondContact OG1-CG 3.31Å; T842-E845 PolarHBondContact OG1-N 3.43Å; T842-E845 VanDerWaalsContact OG1-N 3.09Å; E845-F848 PolarHBondContact O-N 2.94Å; E845-A849 WeakPolarHBondContact O-CB 3.43Å; E845-A849 PolarHBondContact O-N 3.39Å
846	K	94.3	Very high	92.2	Very high	106 Å²	106	56.9 Å²	56.9	46%	0.461	32%	0.324	S	S	.	.	H	α-helix	trans	-66.3	-43.9	-179.1	-77.8	164.7	-179.9	156.2	0	112.3	A840 N841 T842 T843 N844 F848 A849 I850	A840-K846 HydrophobicContact CB-CB 4.48Å; A840-K846 HydrophobicContact CB-CG 3.88Å; A840-K846 WeakPolarHBondContact O-CE 3.31Å; A840-K846 WeakPolarHBondContact O-CG 3.45Å; N841-K846 VanDerWaalsContact O-CE 3.27Å; N841-K846 WeakPolarHBondContact O-CE 3.47Å; N841-K846 PolarHBondContact O-NZ 3.05Å; T842-K846 WeakPolarHBondContact O-CB 3.49Å; T842-K846 VanDerWaalsContact O-CD 3.27Å; T842-K846 WeakPolarHBondContact O-CD 3.46Å; T842-K846 WeakPolarHBondContact O-CG 3.37Å; T842-K846 PolarHBondContact O-N 3.38Å; T843-K846 PolarHBondContact O-N 3Å; N844-K846 VanDerWaalsContact C-N 3.29Å; N844-K846 PolarHBondContact O-N 3.36Å; K846-F848 VanDerWaalsContact C-N 3.33Å; K846-F848 PolarHBondContact O-N 2.86Å; K846-A849 PolarHBondContact O-N 3.25Å; K846-I850 WeakPolarHBondContact O-CG1 3.44Å; K846-I850 PolarHBondContact O-N 3.41Å
847	I	95.4	Very high	92.5	Very high	96 Å²	96	57.3 Å²	57.3	49%	0.492	32%	0.322	S	S	.	.	H	α-helix	trans	-58.7	-47.2	174.3	-69.6	164.6	0	0	0	110	T843 N844 A849 I850 C851	T843-I847 HydrophobicContact CG2-CD1 4.08Å; T843-I847 VanDerWaalsContact O-CG1 3.32Å; T843-I847 WeakPolarHBondContact O-CG1 3.38Å; T843-I847 PolarHBondContact O-N 2.94Å; N844-I847 PolarHBondContact O-N 3.32Å; I847-A849 PolarHBondContact O-N 3.33Å; I847-I850 PolarHBondContact O-N 2.91Å; I847-C851 PolarHBondContact O-N 3.21Å; I847-C851 VanDerWaalsContact O-N 3.07Å; I847-C851 PolarHBondContact O-SG 3.15Å; I847-C851 VanDerWaalsContact O-SG 3.34Å
848	F	94.9	Very high	92.7	Very high	30 Å²	30	58.6 Å²	58.6	13%	0.132	33%	0.328	C	S	.	.	H	α-helix	trans	-65.7	-38.5	179.3	-177.9	-101.5	0	0	0	113.1	C774 I777 W778 I781 N844 E845 K846 I850 C851 I852	C774-F848 HydrophobicContact CB-CZ 4.45Å; C774-F848 WeakPolarHBondContact O-CZ 3.39Å; I777-F848 HydrophobicContact CB-CE2 3.89Å; I777-F848 HydrophobicContact CB-CZ 3.85Å; I777-F848 HydrophobicContact CG2-CD2 4.09Å; I777-F848 HydrophobicContact CG2-CE2 3.36Å; I777-F848 HydrophobicContact CG2-CZ 3.76Å; W778-F848 HydrophobicContact CB-CE1 3.91Å; W778-F848 HydrophobicContact CB-CZ 4.5Å; W778-F848 HydrophobicContact CD2-CD1 4.46Å; W778-F848 HydrophobicContact CD2-CE1 4.35Å; W778-F848 AromaticContact CE3-CD1 3.41Å; W778-F848 HydrophobicContact CE3-CD1 3.41Å; W778-F848 VanDerWaalsContact CE3-CD1 3.41Å; W778-F848 AromaticContact CE3-CE1 3.68Å; W778-F848 HydrophobicContact CE3-CE1 3.68Å; W778-F848 HydrophobicContact CE3-CG 4.49Å; W778-F848 HydrophobicContact CG-CE1 4.5Å; W778-F848 AromaticContact CZ3-CD1 3.89Å; W778-F848 HydrophobicContact CZ3-CD1 3.89Å; I781-F848 HydrophobicContact CD1-CB 3.68Å; I781-F848 HydrophobicContact CD1-CD1 3.89Å; I781-F848 HydrophobicContact CD1-CD2 3.63Å; I781-F848 HydrophobicContact CD1-CE1 4.35Å; I781-F848 HydrophobicContact CD1-CE2 4.17Å; I781-F848 HydrophobicContact CD1-CG 3.45Å; I781-F848 VanDerWaalsContact CD1-CG 3.45Å; I781-F848 HydrophobicContact CD1-CZ 4.48Å; N844-F848 WeakPolarHBondContact O-CB 3.35Å; N844-F848 PolarHBondContact O-N 2.9Å; E845-F848 PolarHBondContact O-N 2.94Å; K846-F848 VanDerWaalsContact C-N 3.33Å; K846-F848 PolarHBondContact O-N 2.86Å; F848-I850 VanDerWaalsContact C-N 3.35Å; F848-I850 PolarHBondContact O-N 3.31Å; F848-C851 WeakPolarHBondContact O-CB 3.38Å; F848-C851 PolarHBondContact O-N 3.44Å; F848-I852 HydrophobicContact CD1-CD1 3.89Å; F848-I852 HydrophobicContact CD1-CG1 4.37Å; F848-I852 HydrophobicContact CE1-CD1 3.24Å; F848-I852 HydrophobicContact CE1-CG1 4.04Å; F848-I852 HydrophobicContact CE2-CD1 4.47Å; F848-I852 HydrophobicContact CZ-CD1 3.59Å; F848-I852 HydrophobicContact CZ-CG1 4.16Å; F848-I852 PolarHBondContact O-N 2.8Å
849	A	94.3	Very high	92.6	Very high	13 Å²	13	58.9 Å²	58.9	11%	0.107	33%	0.328	C	S	.	.	H	α-helix	trans	-62	-40.5	174.2	0	0	0	0	0	112.1	F825 A840 E845 K846 I847 I852 M853	F825-A849 HydrophobicContact CZ-CB 4.33Å; A840-A849 HydrophobicContact CB-CB 3.87Å; E845-A849 WeakPolarHBondContact O-CB 3.43Å; E845-A849 PolarHBondContact O-N 3.39Å; K846-A849 PolarHBondContact O-N 3.25Å; I847-A849 PolarHBondContact O-N 3.33Å; A849-I852 PolarHBondContact O-N 2.88Å; A849-M853 WeakPolarHBondContact O-CG 3.2Å; A849-M853 PolarHBondContact O-N 2.85Å
850	I	94.7	Very high	92.4	Very high	106 Å²	106	59.9 Å²	59.9	54%	0.544	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-44.7	173.2	-67.7	162.9	0	0	0	110.7	K846 I847 F848 I852 M853 L854	K846-I850 WeakPolarHBondContact O-CG1 3.44Å; K846-I850 PolarHBondContact O-N 3.41Å; I847-I850 PolarHBondContact O-N 2.91Å; F848-I850 VanDerWaalsContact C-N 3.35Å; F848-I850 PolarHBondContact O-N 3.31Å; I850-I852 PolarHBondContact O-N 3.48Å; I850-M853 HydrophobicContact CG1-CE 4.15Å; I850-M853 PolarHBondContact O-N 2.94Å; I850-L854 PolarHBondContact O-N 2.8Å; I850-L854 VanDerWaalsContact O-N 3.09Å
851	C	94.9	Very high	92.4	Very high	73 Å²	73	61.9 Å²	61.9	49%	0.493	34%	0.344	S	S	.	.	H	α-helix	trans	-60.3	-41.8	175.3	-64.8	0	0	0	0	112.6	I847 F848 L855	I847-C851 PolarHBondContact O-N 3.21Å; I847-C851 VanDerWaalsContact O-N 3.07Å; I847-C851 PolarHBondContact O-SG 3.15Å; I847-C851 VanDerWaalsContact O-SG 3.34Å; F848-C851 WeakPolarHBondContact O-CB 3.38Å; F848-C851 PolarHBondContact O-N 3.44Å; C851-L855 WeakPolarHBondContact O-CB 3.49Å; C851-L855 PolarHBondContact O-N 2.9Å
852	I	94	Very high	92.1	Very high	3 Å²	3	61.9 Å²	61.9	2%	0.015	35%	0.351	C	S	.	.	H	α-helix	trans	-67.2	-41	176.1	-70.9	-173.2	0	0	0	111.9	C774 T826 S829 L830 F848 A849 I850 L854 L855 G856	C774-I852 HydrophobicContact CB-CD1 3.77Å; C774-I852 HydrophobicContact CB-CG1 4.48Å; T826-I852 HydrophobicContact CG2-CD1 3.68Å; S829-I852 VanDerWaalsContact CB-CG2 3.46Å; L830-I852 HydrophobicContact CD2-CG2 3.91Å; L830-I852 HydrophobicContact CG-CG2 3.9Å; F848-I852 HydrophobicContact CD1-CD1 3.89Å; F848-I852 HydrophobicContact CD1-CG1 4.37Å; F848-I852 HydrophobicContact CE1-CD1 3.24Å; F848-I852 HydrophobicContact CE1-CG1 4.04Å; F848-I852 HydrophobicContact CE2-CD1 4.47Å; F848-I852 HydrophobicContact CZ-CD1 3.59Å; F848-I852 HydrophobicContact CZ-CG1 4.16Å; F848-I852 PolarHBondContact O-N 2.8Å; A849-I852 PolarHBondContact O-N 2.88Å; I850-I852 PolarHBondContact O-N 3.48Å; I852-L854 VanDerWaalsContact C-N 3.34Å; I852-L854 PolarHBondContact O-N 3.3Å; I852-L855 PolarHBondContact O-N 3.03Å; I852-G856 PolarHBondContact O-N 3.5Å
853	M	93.4	Very high	91.9	Very high	107 Å²	107	62.9 Å²	62.9	53%	0.527	36%	0.357	S	S	.	.	H	α-helix	trans	-62.8	-41.5	178.9	-73	-174.6	-66.3	0	0	111.8	A849 I850 G856 A857	A849-M853 WeakPolarHBondContact O-CG 3.2Å; A849-M853 PolarHBondContact O-N 2.85Å; I850-M853 HydrophobicContact CG1-CE 4.15Å; I850-M853 PolarHBondContact O-N 2.94Å; M853-G856 PolarHBondContact O-N 2.96Å; M853-A857 WeakPolarHBondContact O-CB 3.27Å; M853-A857 PolarHBondContact O-N 3.06Å
854	L	93.6	Very high	91.7	Very high	116 Å²	116	63.6 Å²	63.6	61%	0.607	35%	0.351	S	S	*	.	H	α-helix	trans	-64.5	-44.1	174.9	-176.1	64.7	0	0	0	111.9	I850 I852 L858	I850-L854 PolarHBondContact O-N 2.8Å; I850-L854 VanDerWaalsContact O-N 3.09Å; I852-L854 VanDerWaalsContact C-N 3.34Å; I852-L854 PolarHBondContact O-N 3.3Å; L854-L858 WeakPolarHBondContact O-CG 3.38Å; L854-L858 PolarHBondContact O-N 3.46Å
855	L	92.9	Very high	91.6	Very high	66 Å²	66	61.7 Å²	61.7	35%	0.346	35%	0.35	S	S	.	.	H	α-helix	trans	-63.4	-43.4	176.6	-179.5	59.2	0	0	0	111.7	V770 L830 C851 I852 L858 M859	V770-L855 HydrophobicContact CG1-CD2 3.77Å; V770-L855 HydrophobicContact CG1-CG 4.47Å; L830-L855 HydrophobicContact CD2-CB 4.45Å; L830-L855 HydrophobicContact CD2-CD2 4.4Å; L830-L855 HydrophobicContact CD2-CG 4.19Å; C851-L855 WeakPolarHBondContact O-CB 3.49Å; C851-L855 PolarHBondContact O-N 2.9Å; I852-L855 PolarHBondContact O-N 3.03Å; L855-L858 PolarHBondContact O-N 2.91Å; L855-M859 HydrophobicContact CD1-CG 4.17Å; L855-M859 HydrophobicContact CD1-SD 4.05Å; L855-M859 HydrophobicContact CG-CG 4.48Å; L855-M859 HydrophobicContact CG-SD 4.03Å; L855-M859 WeakPolarHBondContact O-CB 3.44Å; L855-M859 VanDerWaalsContact O-CG 3.29Å; L855-M859 WeakPolarHBondContact O-CG 3.36Å; L855-M859 PolarHBondContact O-N 3.37Å
856	G	92.6	Very high	91.1	Very high	2 Å²	2	64.6 Å²	64.6	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-59.3	-49.4	176.6	0	0	0	0	0	111.9	I852 M853 L858 M859 H860	I852-G856 PolarHBondContact O-N 3.5Å; M853-G856 PolarHBondContact O-N 2.96Å; G856-L858 VanDerWaalsContact C-N 3.34Å; G856-L858 PolarHBondContact O-N 3.39Å; G856-M859 PolarHBondContact O-N 3.15Å; G856-H860 WeakPolarHBondContact O-CB 3.49Å; G856-H860 PolarHBondContact O-N 2.75Å
857	A	92	Very high	90.7	Very high	59 Å²	59	61.5 Å²	61.5	49%	0.488	36%	0.356	S	S	.	.	H	α-helix	trans	-56.4	-45.4	176.5	0	0	0	0	0	112.4	M853 A861	M853-A857 WeakPolarHBondContact O-CB 3.27Å; M853-A857 PolarHBondContact O-N 3.06Å; A857-A861 WeakPolarHBondContact O-CB 3.49Å; A857-A861 PolarHBondContact O-N 3.25Å
858	L	90.5	Very high	90.4	Very high	116 Å²	116	60.3 Å²	60.3	61%	0.607	35%	0.353	S	S	*	.	H	α-helix	trans	-65.9	-42.9	177.5	-69	171.1	0	0	0	112.5	L854 L855 G856 A862	L854-L858 WeakPolarHBondContact O-CG 3.38Å; L854-L858 PolarHBondContact O-N 3.46Å; L855-L858 PolarHBondContact O-N 2.91Å; G856-L858 VanDerWaalsContact C-N 3.34Å; G856-L858 PolarHBondContact O-N 3.39Å; L858-A862 WeakPolarHBondContact O-CB 3.4Å; L858-A862 PolarHBondContact O-N 3.35Å
859	M	88.2	Confident	89.9	Confident	29 Å²	29	61.2 Å²	61.2	14%	0.143	37%	0.366	C	S	.	.	H	α-helix	trans	-68.4	-40.4	178.2	-71.3	-174.3	74.6	0	0	112.3	F767 V770 L830 L855 G856 A862 V863	F767-M859 HydrophobicContact CB-CE 4.31Å; F767-M859 HydrophobicContact CD2-CE 4.15Å; V770-M859 HydrophobicContact CB-CE 3.92Å; V770-M859 HydrophobicContact CB-SD 4.05Å; V770-M859 HydrophobicContact CG1-CE 4.27Å; V770-M859 HydrophobicContact CG1-SD 3.72Å; V770-M859 HydrophobicContact CG2-CE 3.91Å; V770-M859 HydrophobicContact CG2-SD 4.22Å; L830-M859 HydrophobicContact CD2-SD 4.49Å; L855-M859 HydrophobicContact CD1-CG 4.17Å; L855-M859 HydrophobicContact CD1-SD 4.05Å; L855-M859 HydrophobicContact CG-CG 4.48Å; L855-M859 HydrophobicContact CG-SD 4.03Å; L855-M859 WeakPolarHBondContact O-CB 3.44Å; L855-M859 VanDerWaalsContact O-CG 3.29Å; L855-M859 WeakPolarHBondContact O-CG 3.36Å; L855-M859 PolarHBondContact O-N 3.37Å; G856-M859 PolarHBondContact O-N 3.15Å; M859-A862 PolarHBondContact O-N 3.07Å; M859-V863 WeakPolarHBondContact O-CG2 3.45Å; M859-V863 PolarHBondContact O-N 2.76Å
860	H	86.2	Confident	89.3	Confident	68 Å²	68	61.7 Å²	61.7	32%	0.315	37%	0.367	S	S	.	.	H	α-helix	trans	-64.4	-44.8	178.1	-166.7	-148.8	0	0	0	111	G856 A862 V863 F864	G856-H860 WeakPolarHBondContact O-CB 3.49Å; G856-H860 PolarHBondContact O-N 2.75Å; H860-A862 PolarHBondContact O-N 2.89Å; H860-V863 PolarHBondContact O-N 3.09Å; H860-F864 AromaticContact CD2-CD2 3.93Å; H860-F864 AromaticContact CD2-CE2 3.75Å; H860-F864 AromaticContact CE1-CE2 3.69Å; H860-F864 AromaticContact NE2-CD2 3.93Å; H860-F864 AromaticContact NE2-CE2 3.28Å; H860-F864 VanDerWaalsContact NE2-CE2 3.28Å; H860-F864 WeakPolarHBondContact NE2-CE2 3.36Å; H860-F864 PolarHBondContact O-N 3.45Å
861	A	90.6	Very high	88.8	Confident	63 Å²	63	60.6 Å²	60.6	52%	0.521	36%	0.361	S	S	.	.	H	α-helix	trans	-60.9	-41.9	172.1	0	0	0	0	0	112.3	A857 G865	A857-A861 WeakPolarHBondContact O-CB 3.49Å; A857-A861 PolarHBondContact O-N 3.25Å; A861-G865 PolarHBondContact O-N 3.2Å
862	A	85	Confident	88.3	Confident	47 Å²	47	63.7 Å²	63.7	39%	0.388	37%	0.368	S	S	.	.	H	α-helix	trans	-65.7	-40.7	177	0	0	0	0	0	112.8	L858 M859 H860 N866	L858-A862 WeakPolarHBondContact O-CB 3.4Å; L858-A862 PolarHBondContact O-N 3.35Å; M859-A862 PolarHBondContact O-N 3.07Å; H860-A862 PolarHBondContact O-N 2.89Å; A862-N866 PolarHBondContact O-N 2.8Å; A862-N866 PolarHBondContact O-ND2 3.07Å
863	V	86	Confident	87.6	Confident	36 Å²	36	67.6 Å²	67.6	22%	0.218	38%	0.383	C	S	.	.	H	α-helix	trans	-64.7	-50.8	175.3	170.9	0	0	0	0	110.4	M859 H860 G865 N866 V867	M859-V863 WeakPolarHBondContact O-CG2 3.45Å; M859-V863 PolarHBondContact O-N 2.76Å; H860-V863 PolarHBondContact O-N 3.09Å; V863-G865 PolarHBondContact O-N 3.15Å; V863-N866 PolarHBondContact O-N 3.25Å; V863-V867 HydrophobicContact CG1-CG2 4.37Å; V863-V867 WeakPolarHBondContact O-CG2 3.42Å; V863-V867 PolarHBondContact O-N 3.47Å
864	F	87.4	Confident	86.7	Confident	119 Å²	119	68.9 Å²	68.9	52%	0.522	39%	0.389	S	S	.	.	H	α-helix	trans	-62.6	-42.8	179.6	-87.7	-52.9	0	0	0	112.9	H860 N866 V867 T868	H860-F864 AromaticContact CD2-CD2 3.93Å; H860-F864 AromaticContact CD2-CE2 3.75Å; H860-F864 AromaticContact CE1-CE2 3.69Å; H860-F864 AromaticContact NE2-CD2 3.93Å; H860-F864 AromaticContact NE2-CE2 3.28Å; H860-F864 VanDerWaalsContact NE2-CE2 3.28Å; H860-F864 WeakPolarHBondContact NE2-CE2 3.36Å; H860-F864 PolarHBondContact O-N 3.45Å; F864-N866 VanDerWaalsContact C-N 3.27Å; F864-N866 PolarHBondContact O-N 3.01Å; F864-V867 PolarHBondContact O-N 2.95Å; F864-V867 VanDerWaalsContact O-N 3.13Å; F864-T868 WeakPolarHBondContact O-CG2 3.38Å; F864-T868 PolarHBondContact O-N 3.31Å; F864-T868 PolarHBondContact O-OG1 3.11Å
865	G	88.4	Confident	86.3	Confident	40 Å²	40	68.6 Å²	68.6	41%	0.412	38%	0.381	S	S	.	.	H	α-helix	trans	-62	-31.9	177.1	0	0	0	0	0	113.7	A861 V863 T868 A869	A861-G865 PolarHBondContact O-N 3.2Å; V863-G865 PolarHBondContact O-N 3.15Å; G865-T868 PolarHBondContact O-OG1 2.72Å; G865-A869 WeakPolarHBondContact O-CB 3.3Å; G865-A869 PolarHBondContact O-N 2.82Å
866	N	83.7	Confident	85.8	Confident	62 Å²	62	67.8 Å²	67.8	33%	0.332	38%	0.384	S	S	.	.	H	α-helix	trans	-75.6	-41.8	171.2	-80.2	-84.4	0	0	0	111.8	L763 A862 V863 F864 T868 A869 I870	L763-N866 HydrophobicContact CD1-CB 3.49Å; L763-N866 VanDerWaalsContact CD1-CB 3.49Å; A862-N866 PolarHBondContact O-N 2.8Å; A862-N866 PolarHBondContact O-ND2 3.07Å; V863-N866 PolarHBondContact O-N 3.25Å; F864-N866 VanDerWaalsContact C-N 3.27Å; F864-N866 PolarHBondContact O-N 3.01Å; N866-T868 PolarHBondContact O-N 3.37Å; N866-A869 PolarHBondContact O-N 3.2Å; N866-I870 WeakPolarHBondContact O-CB 3.33Å; N866-I870 WeakPolarHBondContact O-CG1 3.25Å; N866-I870 PolarHBondContact O-N 3.09Å
867	V	86.1	Confident	85.2	Confident	41 Å²	41	73.3 Å²	73.3	25%	0.248	40%	0.404	C	S	.	.	H	α-helix	trans	-61.4	-43.4	178.3	169.4	0	0	0	0	111.7	L760 V863 F864 I870 I871	L760-V867 HydrophobicContact CD1-CG2 3.77Å; V863-V867 HydrophobicContact CG1-CG2 4.37Å; V863-V867 WeakPolarHBondContact O-CG2 3.42Å; V863-V867 PolarHBondContact O-N 3.47Å; F864-V867 PolarHBondContact O-N 2.95Å; F864-V867 VanDerWaalsContact O-N 3.13Å; V867-I870 PolarHBondContact O-N 3Å; V867-I871 HydrophobicContact CG1-CD1 3.85Å; V867-I871 VanDerWaalsContact O-CG1 3.3Å; V867-I871 WeakPolarHBondContact O-CG1 3.49Å; V867-I871 PolarHBondContact O-N 3.46Å
868	T	89	Confident	84.8	Confident	71 Å²	71	75.9 Å²	75.9	44%	0.436	40%	0.401	S	S	.	.	H	α-helix	trans	-65	-43.6	177	53.7	0	0	0	0	112	F864 G865 N866 I870 I871 Q872	F864-T868 WeakPolarHBondContact O-CG2 3.38Å; F864-T868 PolarHBondContact O-N 3.31Å; F864-T868 PolarHBondContact O-OG1 3.11Å; G865-T868 PolarHBondContact O-OG1 2.72Å; N866-T868 PolarHBondContact O-N 3.37Å; T868-I870 VanDerWaalsContact C-N 3.32Å; T868-I870 PolarHBondContact O-N 3.32Å; T868-I871 PolarHBondContact O-N 2.93Å; T868-Q872 WeakPolarHBondContact O-CB 3.4Å; T868-Q872 WeakPolarHBondContact O-CG 3.44Å; T868-Q872 PolarHBondContact O-N 3.21Å
869	A	83.9	Confident	84.6	Confident	49 Å²	49	74.1 Å²	74.1	41%	0.405	40%	0.395	S	S	.	.	H	α-helix	trans	-62.3	-37.2	175.1	0	0	0	0	0	112.7	G865 N866 R873	G865-A869 WeakPolarHBondContact O-CB 3.3Å; G865-A869 PolarHBondContact O-N 2.82Å; N866-A869 PolarHBondContact O-N 3.2Å; A869-R873 WeakPolarHBondContact O-CB 3.41Å; A869-R873 PolarHBondContact O-N 2.84Å
870	I	82.4	Confident	84.6	Confident	22 Å²	22	76.1 Å²	76.1	11%	0.113	41%	0.409	C	S	.	.	H	α-helix	trans	-64.2	-46.7	174.3	-71.5	169.3	0	0	0	110.7	S756 L760 N866 V867 T868 R873 M874	S756-I870 WeakPolarHBondContact O-CD1 3.47Å; L760-I870 HydrophobicContact CB-CD1 4.21Å; N866-I870 WeakPolarHBondContact O-CB 3.33Å; N866-I870 WeakPolarHBondContact O-CG1 3.25Å; N866-I870 PolarHBondContact O-N 3.09Å; V867-I870 PolarHBondContact O-N 3Å; T868-I870 VanDerWaalsContact C-N 3.32Å; T868-I870 PolarHBondContact O-N 3.32Å; I870-R873 PolarHBondContact O-N 3.47Å; I870-M874 HydrophobicContact CG2-SD 4Å; I870-M874 WeakPolarHBondContact O-CB 3.32Å; I870-M874 WeakPolarHBondContact O-CG 3.43Å; I870-M874 PolarHBondContact O-N 3.29Å
871	I	84.1	Confident	84.8	Confident	84 Å²	84	75.6 Å²	75.6	43%	0.431	41%	0.406	S	S	.	.	H	α-helix	trans	-60.8	-49.8	177	-69.5	166	0	0	0	110.2	V867 T868 R873 M874 Y875	V867-I871 HydrophobicContact CG1-CD1 3.85Å; V867-I871 VanDerWaalsContact O-CG1 3.3Å; V867-I871 WeakPolarHBondContact O-CG1 3.49Å; V867-I871 PolarHBondContact O-N 3.46Å; T868-I871 PolarHBondContact O-N 2.93Å; I871-R873 VanDerWaalsContact C-N 3.34Å; I871-R873 PolarHBondContact O-N 3.46Å; I871-M874 PolarHBondContact O-N 3.5Å; I871-M874 VanDerWaalsContact O-N 3.13Å; I871-Y875 HydrophobicContact CG2-CD2 3.84Å; I871-Y875 HydrophobicContact CG2-CE2 4.17Å; I871-Y875 WeakPolarHBondContact O-CD2 3.49Å; I871-Y875 PolarHBondContact O-N 3.02Å
872	Q	84.7	Confident	84.9	Confident	137 Å²	137	78 Å²	78	64%	0.64	41%	0.406	S	S	*	.	H	α-helix	trans	-55.2	-47.3	177.2	-73.8	171.8	-13.6	0	0	111.9	T868 M874 Y875 A876	T868-Q872 WeakPolarHBondContact O-CB 3.4Å; T868-Q872 WeakPolarHBondContact O-CG 3.44Å; T868-Q872 PolarHBondContact O-N 3.21Å; Q872-M874 PolarHBondContact O-N 3.15Å; Q872-Y875 PolarHBondContact O-N 3.21Å; Q872-A876 PolarHBondContact O-N 3.34Å
873	R	79.9	Confident	85.2	Confident	85 Å²	85	78.5 Å²	78.5	32%	0.321	41%	0.408	S	S	.	.	H	α-helix	trans	-65.6	-35.4	177.6	-178.7	170.6	165.2	-162.9	-7.3	113.2	Q754 A869 I870 I871 N1438 E1441	Q754-R873 PolarHBondContact O-NH1 2.88Å; Q754-R873 PolarHBondContact O-NH2 2.89Å; A869-R873 WeakPolarHBondContact O-CB 3.41Å; A869-R873 PolarHBondContact O-N 2.84Å; I870-R873 PolarHBondContact O-N 3.47Å; I871-R873 VanDerWaalsContact C-N 3.34Å; I871-R873 PolarHBondContact O-N 3.46Å; R873-N1438 PolarHBondContact NE-ND2 3.13Å; R873-E1441 IonicContact CZ-OE1 2.74Å; R873-E1441 IonicContact NE-OE1 3.91Å; R873-E1441 IonicContact NH2-OE1 3.01Å; R873-E1441 PolarHBondContact NH2-OE1 3.35Å
874	M	74.7	Confident	85.5	Confident	135 Å²	135	82 Å²	82	67%	0.665	42%	0.42	S	S	*	.	H	α-helix	trans	-68.9	-37.8	175.1	-75.5	178.4	63.8	0	0	112.5	I870 I871 Q872	I870-M874 HydrophobicContact CG2-SD 4Å; I870-M874 WeakPolarHBondContact O-CB 3.32Å; I870-M874 WeakPolarHBondContact O-CG 3.43Å; I870-M874 PolarHBondContact O-N 3.29Å; I871-M874 PolarHBondContact O-N 3.5Å; I871-M874 VanDerWaalsContact O-N 3.13Å; Q872-M874 PolarHBondContact O-N 3.15Å
875	Y	83.4	Confident	85.7	Confident	109 Å²	109	78 Å²	78	43%	0.427	41%	0.405	S	S	.	.	H	α-helix	trans	-86.8	-18.3	-177.7	-81.8	-85.4	0	0	0	114.5	I871 Q872 R877 R878 T879	I871-Y875 HydrophobicContact CG2-CD2 3.84Å; I871-Y875 HydrophobicContact CG2-CE2 4.17Å; I871-Y875 WeakPolarHBondContact O-CD2 3.49Å; I871-Y875 PolarHBondContact O-N 3.02Å; Q872-Y875 PolarHBondContact O-N 3.21Å; Y875-R877 VanDerWaalsContact C-N 3.3Å; Y875-R877 PolarHBondContact O-N 3.23Å; Y875-R878 CarbonylContact O-C 3.53Å; Y875-R878 WeakPolarHBondContact O-CA 3.37Å; Y875-R878 WeakPolarHBondContact O-CB 3.46Å; Y875-R878 PolarHBondContact O-N 3.28Å; Y875-T879 PolarHBondContact O-N 3.37Å; Y875-T879 PolarHBondContact O-OG1 2.76Å
876	A	83.2	Confident	85.9	Confident	49 Å²	49	80.5 Å²	80.5	41%	0.405	41%	0.406	S	S	.	.	H	α-helix	trans	-42.9	-47.8	-174.7	0	0	0	0	0	114.8	Q872 R878 T879 T880	Q872-A876 PolarHBondContact O-N 3.34Å; A876-R878 VanDerWaalsContact C-N 3.35Å; A876-R878 PolarHBondContact O-N 3.32Å; A876-T879 WeakPolarHBondContact O-CB 3.4Å; A876-T879 PolarHBondContact O-N 3.21Å; A876-T880 PolarHBondContact O-N 3.45Å; A876-T880 PolarHBondContact O-OG1 3.32Å
877	R	79.1	Confident	86.4	Confident	119 Å²	119	80.5 Å²	80.5	45%	0.449	41%	0.406	S	S	.	.	H	α-helix	trans	-70	-26.9	179.9	-162.4	-179.5	-167.1	133.3	6	113.9	Y875 T880 F881 R917	Y875-R877 VanDerWaalsContact C-N 3.3Å; Y875-R877 PolarHBondContact O-N 3.23Å; R877-T880 WeakPolarHBondContact CA-OG1 3.37Å; R877-T880 PolarHBondContact O-OG1 2.99Å; R877-F881 PolarHBondContact O-N 2.82Å; R877-R917 PolarHBondContact NE-O 2.92Å; R877-R917 PolarHBondContact NH2-O 3.01Å
878	R	83.8	Confident	86.8	Confident	112 Å²	112	80 Å²	80	42%	0.423	40%	0.401	S	S	.	.	H	α-helix	trans	-77.4	-38	170.9	-176.2	176.9	-75	-166.1	-2.8	110.3	Y875 A876 F881 Q882 H1263	Y875-R878 CarbonylContact O-C 3.53Å; Y875-R878 WeakPolarHBondContact O-CA 3.37Å; Y875-R878 WeakPolarHBondContact O-CB 3.46Å; Y875-R878 PolarHBondContact O-N 3.28Å; A876-R878 VanDerWaalsContact C-N 3.35Å; A876-R878 PolarHBondContact O-N 3.32Å; R878-F881 WeakPolarHBondContact O-CB 3.38Å; R878-F881 PolarHBondContact O-N 2.74Å; R878-Q882 HydrophobicContact CG-CG 4.4Å; R878-Q882 WeakPolarHBondContact O-CB 3.02Å; R878-Q882 WeakPolarHBondContact O-CG 3.48Å; R878-Q882 PolarHBondContact O-N 2.94Å; R878-H1263 PolarHBondContact NH1-NE2 3.22Å
879	T	87.9	Confident	87	Confident	79 Å²	79	81 Å²	81	49%	0.485	40%	0.4	S	S	.	.	H	α-helix	trans	-63.1	-42.7	174.6	-52.1	0	0	0	0	111.9	Y875 A876 F881 Q882 S883	Y875-T879 PolarHBondContact O-N 3.37Å; Y875-T879 PolarHBondContact O-OG1 2.76Å; A876-T879 WeakPolarHBondContact O-CB 3.4Å; A876-T879 PolarHBondContact O-N 3.21Å; T879-F881 PolarHBondContact O-N 3.45Å; T879-Q882 PolarHBondContact O-N 3.12Å; T879-S883 WeakPolarHBondContact O-CB 3.42Å; T879-S883 PolarHBondContact O-N 3.12Å
880	T	88.1	Confident	87.5	Confident	72 Å²	72	83.3 Å²	83.3	44%	0.442	40%	0.402	S	S	.	.	H	α-helix	trans	-64.5	-38	174.8	51.4	0	0	0	0	112.6	A876 R877 K884	A876-T880 PolarHBondContact O-N 3.45Å; A876-T880 PolarHBondContact O-OG1 3.32Å; R877-T880 WeakPolarHBondContact CA-OG1 3.37Å; R877-T880 PolarHBondContact O-OG1 2.99Å; T880-K884 WeakPolarHBondContact O-CG 3.45Å; T880-K884 PolarHBondContact O-N 2.94Å
881	F	90.1	Very high	88.1	Confident	56 Å²	56	87 Å²	87	25%	0.246	42%	0.418	C	S	.	.	H	α-helix	trans	-62.9	-50.3	172.2	175.2	-111.4	0	0	0	111.3	R877 R878 T879 S883 K884 V885 F909 W913	R877-F881 PolarHBondContact O-N 2.82Å; R878-F881 WeakPolarHBondContact O-CB 3.38Å; R878-F881 PolarHBondContact O-N 2.74Å; T879-F881 PolarHBondContact O-N 3.45Å; F881-S883 VanDerWaalsContact C-N 3.33Å; F881-S883 PolarHBondContact O-N 3.07Å; F881-K884 PolarHBondContact O-N 3.34Å; F881-K884 VanDerWaalsContact O-N 3.15Å; F881-V885 HydrophobicContact CD1-CG2 4.36Å; F881-V885 HydrophobicContact CD2-CG2 4.08Å; F881-V885 HydrophobicContact CE1-CG2 3.99Å; F881-V885 HydrophobicContact CE2-CG2 3.7Å; F881-V885 HydrophobicContact CG-CG2 4.42Å; F881-V885 HydrophobicContact CZ-CG2 3.65Å; F881-V885 WeakPolarHBondContact O-CG2 3.32Å; F881-V885 PolarHBondContact O-N 3.08Å; F881-F909 AromaticContact CD2-CE1 3.95Å; F881-F909 HydrophobicContact CD2-CE1 3.95Å; F881-F909 HydrophobicContact CE2-CD1 4.31Å; F881-F909 AromaticContact CE2-CE1 3.7Å; F881-F909 HydrophobicContact CE2-CE1 3.7Å; F881-W913 HydrophobicContact CB-CH2 4.31Å; F881-W913 HydrophobicContact CB-CZ2 3.65Å; F881-W913 HydrophobicContact CD2-CB 4.33Å; F881-W913 AromaticContact CD2-CD1 3.43Å; F881-W913 VanDerWaalsContact CD2-CD1 3.43Å; F881-W913 AromaticContact CD2-CD2 3.57Å; F881-W913 HydrophobicContact CD2-CD2 3.57Å; F881-W913 AromaticContact CD2-CE2 3.56Å; F881-W913 HydrophobicContact CD2-CE3 4.28Å; F881-W913 AromaticContact CD2-CG 3.53Å; F881-W913 HydrophobicContact CD2-CG 3.53Å; F881-W913 HydrophobicContact CD2-CZ2 4.28Å; F881-W913 AromaticContact CD2-NE1 3.45Å; F881-W913 HydrophobicContact CE2-CB 4.14Å; F881-W913 AromaticContact CE2-CD1 3.7Å; F881-W913 HydrophobicContact CE2-CD2 4.28Å; F881-W913 AromaticContact CE2-CG 3.77Å; F881-W913 HydrophobicContact CE2-CG 3.77Å; F881-W913 HydrophobicContact CG-CD2 4.46Å; F881-W913 HydrophobicContact CG-CZ2 4.41Å; F881-W913 AromaticContact CG-NE1 3.84Å
882	Q	91.7	Very high	88.5	Confident	113 Å²	113	83.5 Å²	83.5	53%	0.528	40%	0.4	S	S	.	.	H	α-helix	trans	-62.6	-38.4	-179.3	-73.9	175.6	-54.3	0	0	112.2	R878 T879 V885 Q886	R878-Q882 HydrophobicContact CG-CG 4.4Å; R878-Q882 WeakPolarHBondContact O-CB 3.02Å; R878-Q882 WeakPolarHBondContact O-CG 3.48Å; R878-Q882 PolarHBondContact O-N 2.94Å; T879-Q882 PolarHBondContact O-N 3.12Å; Q882-V885 PolarHBondContact O-N 2.95Å; Q882-Q886 WeakPolarHBondContact O-CB 3.38Å; Q882-Q886 PolarHBondContact O-N 3.23Å
883	S	91.9	Very high	88.9	Confident	59 Å²	59	84.3 Å²	84.3	41%	0.413	40%	0.403	S	S	.	.	H	α-helix	trans	-59.6	-52.4	170.6	-167	0	0	0	0	110.5	T879 F881 V885 Q886 D887	T879-S883 WeakPolarHBondContact O-CB 3.42Å; T879-S883 PolarHBondContact O-N 3.12Å; F881-S883 VanDerWaalsContact C-N 3.33Å; F881-S883 PolarHBondContact O-N 3.07Å; S883-V885 VanDerWaalsContact C-N 3.31Å; S883-V885 PolarHBondContact O-N 2.92Å; S883-Q886 CarbonylContact O-C 3.44Å; S883-Q886 WeakPolarHBondContact O-CA 3.35Å; S883-Q886 WeakPolarHBondContact O-CB 3.32Å; S883-Q886 PolarHBondContact O-N 3.33Å; S883-D887 PolarHBondContact O-N 3.25Å
884	K	92	Very high	89.6	Confident	110 Å²	110	85.4 Å²	85.4	48%	0.478	42%	0.42	S	S	.	.	H	α-helix	trans	-65.6	-30.3	-178.2	-70	-72.8	154.1	-144.4	0	113.9	T880 F881 D887 L888 F909	T880-K884 WeakPolarHBondContact O-CG 3.45Å; T880-K884 PolarHBondContact O-N 2.94Å; F881-K884 PolarHBondContact O-N 3.34Å; F881-K884 VanDerWaalsContact O-N 3.15Å; K884-D887 WeakPolarHBondContact CD-OD2 3.42Å; K884-D887 WeakPolarHBondContact CE-OD2 3.22Å; K884-D887 IonicContact NZ-OD2 2.67Å; K884-D887 PolarHBondContact NZ-OD2 2.89Å; K884-L888 VanDerWaalsContact O-CB 3.25Å; K884-L888 WeakPolarHBondContact O-CB 3.31Å; K884-L888 PolarHBondContact O-N 2.79Å; K884-F909 HydrophobicContact CB-CE1 4.49Å; K884-F909 HydrophobicContact CB-CE2 4.24Å; K884-F909 HydrophobicContact CB-CZ 3.62Å
885	V	90.9	Very high	90.6	Very high	34 Å²	34	86.4 Å²	86.4	21%	0.206	42%	0.417	C	S	.	.	H	α-helix	trans	-70.1	-34.6	170	173	0	0	0	0	111.6	F881 Q882 S883 K889 F909	F881-V885 HydrophobicContact CD1-CG2 4.36Å; F881-V885 HydrophobicContact CD2-CG2 4.08Å; F881-V885 HydrophobicContact CE1-CG2 3.99Å; F881-V885 HydrophobicContact CE2-CG2 3.7Å; F881-V885 HydrophobicContact CG-CG2 4.42Å; F881-V885 HydrophobicContact CZ-CG2 3.65Å; F881-V885 WeakPolarHBondContact O-CG2 3.32Å; F881-V885 PolarHBondContact O-N 3.08Å; Q882-V885 PolarHBondContact O-N 2.95Å; S883-V885 VanDerWaalsContact C-N 3.31Å; S883-V885 PolarHBondContact O-N 2.92Å; V885-K889 HydrophobicContact CG1-CD 4.35Å; V885-K889 VanDerWaalsContact O-CG 3.31Å; V885-K889 WeakPolarHBondContact O-CG 3.04Å; V885-K889 PolarHBondContact O-N 2.91Å; V885-F909 HydrophobicContact CG2-CD1 4.11Å; V885-F909 HydrophobicContact CG2-CE1 3.66Å
886	Q	93.6	Very high	91.1	Very high	93 Å²	93	91.8 Å²	91.8	44%	0.435	44%	0.437	S	S	.	.	H	α-helix	trans	-70	-48.9	174.5	-174.9	61.7	24.5	0	0	111	Q882 S883 L888 K889 E890	Q882-Q886 WeakPolarHBondContact O-CB 3.38Å; Q882-Q886 PolarHBondContact O-N 3.23Å; S883-Q886 CarbonylContact O-C 3.44Å; S883-Q886 WeakPolarHBondContact O-CA 3.35Å; S883-Q886 WeakPolarHBondContact O-CB 3.32Å; S883-Q886 PolarHBondContact O-N 3.33Å; Q886-L888 PolarHBondContact O-N 3.48Å; Q886-K889 PolarHBondContact O-N 3.42Å; Q886-E890 WeakPolarHBondContact CG-OE1 3.16Å; Q886-E890 PolarHBondContact NE2-OE1 3.02Å; Q886-E890 PolarHBondContact O-N 2.97Å
887	D	94.3	Very high	91.6	Very high	62 Å²	62	90.8 Å²	90.8	33%	0.332	42%	0.424	S	S	.	.	H	α-helix	trans	-51	-44.2	173.1	-53.6	-10.5	0	0	0	111	S883 K884 F891	S883-D887 PolarHBondContact O-N 3.25Å; K884-D887 WeakPolarHBondContact CD-OD2 3.42Å; K884-D887 WeakPolarHBondContact CE-OD2 3.22Å; K884-D887 IonicContact NZ-OD2 2.67Å; K884-D887 PolarHBondContact NZ-OD2 2.89Å; D887-F891 WeakPolarHBondContact O-CB 3.25Å; D887-F891 PolarHBondContact O-N 2.93Å
888	L	94.1	Very high	92.3	Very high	29 Å²	29	89 Å²	89	15%	0.152	43%	0.428	C	S	.	.	H	α-helix	trans	-66.1	-40.3	178.2	177.2	60.7	0	0	0	112.5	K884 Q886 F891 I892 M905 E906 F909	K884-L888 VanDerWaalsContact O-CB 3.25Å; K884-L888 WeakPolarHBondContact O-CB 3.31Å; K884-L888 PolarHBondContact O-N 2.79Å; Q886-L888 PolarHBondContact O-N 3.48Å; L888-F891 PolarHBondContact O-N 3.37Å; L888-I892 HydrophobicContact CD1-CD1 3.91Å; L888-I892 HydrophobicContact CD1-CG1 4.4Å; L888-I892 HydrophobicContact CG-CD1 3.84Å; L888-I892 WeakPolarHBondContact O-CB 3.31Å; L888-I892 VanDerWaalsContact O-CD1 3.31Å; L888-I892 WeakPolarHBondContact O-CD1 3.36Å; L888-I892 VanDerWaalsContact O-CG1 3.22Å; L888-I892 WeakPolarHBondContact O-CG1 3.49Å; L888-I892 PolarHBondContact O-N 3.19Å; L888-M905 HydrophobicContact CD1-CE 3.95Å; L888-E906 HydrophobicContact CD2-CG 4.47Å; L888-F909 HydrophobicContact CD2-CB 3.79Å; L888-F909 HydrophobicContact CD2-CD1 4.21Å; L888-F909 HydrophobicContact CD2-CD2 4.44Å; L888-F909 HydrophobicContact CD2-CG 3.88Å
889	K	93.1	Very high	92.7	Very high	93 Å²	93	93 Å²	93	40%	0.404	45%	0.448	S	S	.	.	H	α-helix	trans	-68.7	-43.9	177.5	-77.6	175.9	178.5	-171.6	0	112.2	V885 Q886 F891 I892 E893	V885-K889 HydrophobicContact CG1-CD 4.35Å; V885-K889 VanDerWaalsContact O-CG 3.31Å; V885-K889 WeakPolarHBondContact O-CG 3.04Å; V885-K889 PolarHBondContact O-N 2.91Å; Q886-K889 PolarHBondContact O-N 3.42Å; K889-F891 VanDerWaalsContact C-N 3.3Å; K889-F891 PolarHBondContact O-N 3.37Å; K889-I892 PolarHBondContact O-N 3.06Å; K889-E893 WeakPolarHBondContact O-CB 3.39Å; K889-E893 PolarHBondContact O-N 2.88Å
890	E	93.9	Very high	92.9	Very high	98 Å²	98	94.8 Å²	94.8	46%	0.458	46%	0.46	S	S	.	.	H	α-helix	trans	-61.3	-40.9	175.1	-70.8	174.3	-163.6	0	0	110.6	Q886 E893 V894	Q886-E890 WeakPolarHBondContact CG-OE1 3.16Å; Q886-E890 PolarHBondContact NE2-OE1 3.02Å; Q886-E890 PolarHBondContact O-N 2.97Å; E890-E893 PolarHBondContact O-N 3.4Å; E890-V894 VanDerWaalsContact O-CB 3.31Å; E890-V894 WeakPolarHBondContact O-CB 3.49Å; E890-V894 WeakPolarHBondContact O-CG2 3.47Å; E890-V894 PolarHBondContact O-N 2.92Å
891	F	95.1	Very high	93	Very high	100 Å²	100	95.3 Å²	95.3	44%	0.439	46%	0.459	S	S	.	.	H	α-helix	trans	-60	-47.5	171.8	-177.3	-92	0	0	0	112.7	D887 L888 K889 E893 Y895 I897 M905	D887-F891 WeakPolarHBondContact O-CB 3.25Å; D887-F891 PolarHBondContact O-N 2.93Å; L888-F891 PolarHBondContact O-N 3.37Å; K889-F891 VanDerWaalsContact C-N 3.3Å; K889-F891 PolarHBondContact O-N 3.37Å; F891-E893 VanDerWaalsContact C-N 3.3Å; F891-E893 PolarHBondContact O-N 3.04Å; F891-Y895 HydrophobicContact CD1-CD2 4.36Å; F891-Y895 AromaticContact CD2-CD2 3.63Å; F891-Y895 HydrophobicContact CD2-CD2 3.63Å; F891-Y895 AromaticContact CD2-CE2 3.55Å; F891-Y895 HydrophobicContact CD2-CE2 3.55Å; F891-Y895 HydrophobicContact CE1-CD2 4.3Å; F891-Y895 AromaticContact CE2-CD2 3.55Å; F891-Y895 HydrophobicContact CE2-CD2 3.55Å; F891-Y895 AromaticContact CE2-CE2 3.39Å; F891-Y895 HydrophobicContact CE2-CE2 3.39Å; F891-Y895 HydrophobicContact CG-CD2 4.04Å; F891-Y895 HydrophobicContact CG-CE2 4.39Å; F891-Y895 AromaticContact CZ-CD2 3.9Å; F891-Y895 HydrophobicContact CZ-CD2 3.9Å; F891-Y895 HydrophobicContact CZ-CE2 4.13Å; F891-Y895 WeakPolarHBondContact O-CD2 3.16Å; F891-Y895 PolarHBondContact O-N 2.72Å; F891-Y895 VanDerWaalsContact O-N 3.09Å; F891-I897 HydrophobicContact CD1-CD1 3.81Å; F891-I897 HydrophobicContact CE1-CD1 3.63Å; F891-M905 HydrophobicContact CD1-CE 4.11Å; F891-M905 HydrophobicContact CE1-CE 3.98Å
892	I	94.3	Very high	93.1	Very high	9 Å²	9	96.2 Å²	96.2	5%	0.046	46%	0.463	C	S	.	.	H	α-helix	trans	-60.7	-38.3	178	-76.1	160.4	0	0	0	112	L888 K889 R896 I897 K902 M905 E906	L888-I892 HydrophobicContact CD1-CD1 3.91Å; L888-I892 HydrophobicContact CD1-CG1 4.4Å; L888-I892 HydrophobicContact CG-CD1 3.84Å; L888-I892 WeakPolarHBondContact O-CB 3.31Å; L888-I892 VanDerWaalsContact O-CD1 3.31Å; L888-I892 WeakPolarHBondContact O-CD1 3.36Å; L888-I892 VanDerWaalsContact O-CG1 3.22Å; L888-I892 WeakPolarHBondContact O-CG1 3.49Å; L888-I892 PolarHBondContact O-N 3.19Å; K889-I892 PolarHBondContact O-N 3.06Å; I892-R896 PolarHBondContact O-N 2.95Å; I892-I897 HydrophobicContact CG1-CD1 4.11Å; I892-I897 HydrophobicContact CG2-CB 4.35Å; I892-I897 PolarHBondContact O-N 2.74Å; I892-K902 HydrophobicContact CD1-CG 4.24Å; I892-K902 HydrophobicContact CG2-CB 4.32Å; I892-K902 HydrophobicContact CG2-CD 3.72Å; I892-K902 HydrophobicContact CG2-CG 4Å; I892-M905 HydrophobicContact CG1-CE 4.46Å; I892-E906 HydrophobicContact CD1-CG 4.05Å
893	E	92.7	Very high	93.1	Very high	154 Å²	154	93.7 Å²	93.7	72%	0.72	46%	0.458	S	S	*	.	H	α-helix	trans	-74	-50.1	179.5	-173	171.5	171.4	0	0	112.1	K889 E890 F891 Y895 R896	K889-E893 WeakPolarHBondContact O-CB 3.39Å; K889-E893 PolarHBondContact O-N 2.88Å; E890-E893 PolarHBondContact O-N 3.4Å; F891-E893 VanDerWaalsContact C-N 3.3Å; F891-E893 PolarHBondContact O-N 3.04Å; E893-Y895 VanDerWaalsContact C-N 3.33Å; E893-Y895 PolarHBondContact O-N 3.01Å; E893-R896 PolarHBondContact O-N 3.32Å; E893-R896 VanDerWaalsContact O-N 3.1Å
894	V	94.7	Very high	93	Very high	109 Å²	109	96 Å²	96	66%	0.661	46%	0.458	S	S	*	.	H	α-helix	trans	-58.1	-43.2	179.2	166.7	0	0	0	0	111.8	E890	E890-V894 VanDerWaalsContact O-CB 3.31Å; E890-V894 WeakPolarHBondContact O-CB 3.49Å; E890-V894 WeakPolarHBondContact O-CG2 3.47Å; E890-V894 PolarHBondContact O-N 2.92Å
895	Y	95.3	Very high	93	Very high	155 Å²	155	93 Å²	93	61%	0.608	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	6.6	179.4	-66.3	-72.5	0	0	0	114.1	F891 E893 I897	F891-Y895 HydrophobicContact CD1-CD2 4.36Å; F891-Y895 AromaticContact CD2-CD2 3.63Å; F891-Y895 HydrophobicContact CD2-CD2 3.63Å; F891-Y895 AromaticContact CD2-CE2 3.55Å; F891-Y895 HydrophobicContact CD2-CE2 3.55Å; F891-Y895 HydrophobicContact CE1-CD2 4.3Å; F891-Y895 AromaticContact CE2-CD2 3.55Å; F891-Y895 HydrophobicContact CE2-CD2 3.55Å; F891-Y895 AromaticContact CE2-CE2 3.39Å; F891-Y895 HydrophobicContact CE2-CE2 3.39Å; F891-Y895 HydrophobicContact CG-CD2 4.04Å; F891-Y895 HydrophobicContact CG-CE2 4.39Å; F891-Y895 AromaticContact CZ-CD2 3.9Å; F891-Y895 HydrophobicContact CZ-CD2 3.9Å; F891-Y895 HydrophobicContact CZ-CE2 4.13Å; F891-Y895 WeakPolarHBondContact O-CD2 3.16Å; F891-Y895 PolarHBondContact O-N 2.72Å; F891-Y895 VanDerWaalsContact O-N 3.09Å; E893-Y895 VanDerWaalsContact C-N 3.33Å; E893-Y895 PolarHBondContact O-N 3.01Å; Y895-I897 VanDerWaalsContact C-N 3.29Å; Y895-I897 PolarHBondContact O-N 2.89Å
896	R	93.1	Very high	93	Very high	223 Å²	223	93.5 Å²	93.5	84%	0.842	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	45.3	178	-60.8	-176.2	175.3	-172.3	-1.8	113.7	I892 E893	I892-R896 PolarHBondContact O-N 2.95Å; E893-R896 PolarHBondContact O-N 3.32Å; E893-R896 VanDerWaalsContact O-N 3.1Å
897	I	93.6	Very high	92.7	Very high	28 Å²	28	92.8 Å²	92.8	14%	0.144	45%	0.445	C	S	.	.			trans	-64.8	131.6	-170.8	-61.3	-173.7	0	0	0	111	F891 I892 Y895 L901 M905	F891-I897 HydrophobicContact CD1-CD1 3.81Å; F891-I897 HydrophobicContact CE1-CD1 3.63Å; I892-I897 HydrophobicContact CG1-CD1 4.11Å; I892-I897 HydrophobicContact CG2-CB 4.35Å; I892-I897 PolarHBondContact O-N 2.74Å; Y895-I897 VanDerWaalsContact C-N 3.29Å; Y895-I897 PolarHBondContact O-N 2.89Å; I897-L901 HydrophobicContact CG2-CB 3.92Å; I897-L901 HydrophobicContact CG2-CD2 3.95Å; I897-L901 HydrophobicContact CG2-CG 3.83Å; I897-M905 HydrophobicContact CD1-CE 4.01Å; I897-M905 HydrophobicContact CD1-SD 3.9Å; I897-M905 HydrophobicContact CG2-SD 4.14Å
898	P	94.6	Very high	92.4	Very high	82 Å²	82	93.9 Å²	93.9	53%	0.532	45%	0.447	S	S	.	.			trans	-55.2	144.3	-178.8	-28.2	35.4	0	0	0	113.8	T900 L901 K902	P898-T900 PolarHBondContact O-N 3.17Å; P898-L901 PolarHBondContact O-N 3Å; P898-L901 VanDerWaalsContact O-N 3.08Å; P898-K902 WeakPolarHBondContact O-CB 3.24Å; P898-K902 PolarHBondContact O-N 2.81Å
899	K	92.1	Very high	92.2	Very high	194 Å²	194	94.9 Å²	94.9	84%	0.843	45%	0.45	S	S	*	.	H	α-helix	trans	-51.5	-35	-175.6	-68.8	-175.5	179	-180	0	113.9	S903	K899-S903 PolarHBondContact O-N 3.47Å; K899-S903 VanDerWaalsContact O-N 3.13Å
900	T	91	Very high	92	Very high	118 Å²	118	95.4 Å²	95.4	72%	0.724	45%	0.454	S	S	*	.	H	α-helix	trans	-67.3	-52.6	177.4	47.1	0	0	0	0	112.5	P898 K902 S903 R904	P898-T900 PolarHBondContact O-N 3.17Å; T900-K902 VanDerWaalsContact C-N 3.32Å; T900-K902 PolarHBondContact O-N 3.4Å; T900-S903 PolarHBondContact O-N 3.07Å; T900-R904 PolarHBondContact O-N 3.25Å
901	L	91.7	Very high	91.6	Very high	83 Å²	83	92.3 Å²	92.3	44%	0.435	44%	0.442	S	S	.	.	H	α-helix	trans	-66.4	-36	177	-178.5	55.9	0	0	0	111.3	I897 P898 R904 M905	I897-L901 HydrophobicContact CG2-CB 3.92Å; I897-L901 HydrophobicContact CG2-CD2 3.95Å; I897-L901 HydrophobicContact CG2-CG 3.83Å; P898-L901 PolarHBondContact O-N 3Å; P898-L901 VanDerWaalsContact O-N 3.08Å; L901-R904 PolarHBondContact O-N 3.04Å; L901-M905 HydrophobicContact CD1-CG 4.19Å; L901-M905 HydrophobicContact CD1-SD 4.34Å; L901-M905 HydrophobicContact CG-CG 4.39Å; L901-M905 HydrophobicContact CG-SD 4Å; L901-M905 WeakPolarHBondContact O-CB 3.3Å; L901-M905 VanDerWaalsContact O-CG 3.29Å; L901-M905 WeakPolarHBondContact O-CG 3.41Å; L901-M905 PolarHBondContact O-N 2.65Å
902	K	92.1	Very high	91.1	Very high	74 Å²	74	89.2 Å²	89.2	32%	0.322	43%	0.431	S	S	.	.	H	α-helix	trans	-53.2	-53.9	171.2	169.4	172.7	-171.7	170.7	0	111.8	I892 P898 T900 R904 M905 E906	I892-K902 HydrophobicContact CD1-CG 4.24Å; I892-K902 HydrophobicContact CG2-CB 4.32Å; I892-K902 HydrophobicContact CG2-CD 3.72Å; I892-K902 HydrophobicContact CG2-CG 4Å; P898-K902 WeakPolarHBondContact O-CB 3.24Å; P898-K902 PolarHBondContact O-N 2.81Å; T900-K902 VanDerWaalsContact C-N 3.32Å; T900-K902 PolarHBondContact O-N 3.4Å; K902-R904 PolarHBondContact O-N 3.22Å; K902-M905 PolarHBondContact O-N 3.12Å; K902-E906 WeakPolarHBondContact CE-OE1 3.4Å; K902-E906 VanDerWaalsContact CE-OE2 3.3Å; K902-E906 WeakPolarHBondContact CE-OE2 3.26Å; K902-E906 HydrophobicContact CG-CG 4.46Å; K902-E906 IonicContact NZ-OE1 2.69Å; K902-E906 PolarHBondContact O-N 3.49Å
903	S	91	Very high	90.8	Very high	60 Å²	60	91.6 Å²	91.6	42%	0.42	44%	0.44	S	S	.	.	H	α-helix	trans	-58.3	-51.1	-180	-161.9	0	0	0	0	110.1	K899 T900 M905 E906 D907	K899-S903 PolarHBondContact O-N 3.47Å; K899-S903 VanDerWaalsContact O-N 3.13Å; T900-S903 PolarHBondContact O-N 3.07Å; S903-M905 VanDerWaalsContact C-N 3.27Å; S903-M905 PolarHBondContact O-N 3.13Å; S903-E906 PolarHBondContact O-N 3.39Å; S903-D907 WeakPolarHBondContact O-CB 3.4Å; S903-D907 VanDerWaalsContact O-CG 3.25Å; S903-D907 PolarHBondContact O-N 3.22Å; S903-D907 PolarHBondContact OG-OD2 2.88Å
904	R	90.3	Very high	90.5	Very high	109 Å²	109	87.5 Å²	87.5	41%	0.411	43%	0.432	S	S	.	.	H	α-helix	trans	-54.1	-40.9	178.1	-175.1	177.5	171.3	-171.9	-3.4	112.6	T900 L901 K902 F908 E974	T900-R904 PolarHBondContact O-N 3.25Å; L901-R904 PolarHBondContact O-N 3.04Å; K902-R904 PolarHBondContact O-N 3.22Å; R904-F908 WeakPolarHBondContact O-CB 3.47Å; R904-F908 PolarHBondContact O-N 3.27Å; R904-E974 IonicContact CZ-OE1 3.22Å; R904-E974 IonicContact NE-OE1 2.8Å; R904-E974 PolarHBondContact NE-OE1 3.45Å; R904-E974 IonicContact NH2-OE1 2.73Å; R904-E974 PolarHBondContact NH2-OE1 2.84Å
905	M	91.3	Very high	89.8	Confident	46 Å²	46	86.7 Å²	86.7	23%	0.227	42%	0.423	C	S	.	.	H	α-helix	trans	-68.8	-43.8	176.1	-71.4	174.1	67.9	0	0	113	L888 F891 I892 I897 L901 K902 S903 F909	L888-M905 HydrophobicContact CD1-CE 3.95Å; F891-M905 HydrophobicContact CD1-CE 4.11Å; F891-M905 HydrophobicContact CE1-CE 3.98Å; I892-M905 HydrophobicContact CG1-CE 4.46Å; I897-M905 HydrophobicContact CD1-CE 4.01Å; I897-M905 HydrophobicContact CD1-SD 3.9Å; I897-M905 HydrophobicContact CG2-SD 4.14Å; L901-M905 HydrophobicContact CD1-CG 4.19Å; L901-M905 HydrophobicContact CD1-SD 4.34Å; L901-M905 HydrophobicContact CG-CG 4.39Å; L901-M905 HydrophobicContact CG-SD 4Å; L901-M905 WeakPolarHBondContact O-CB 3.3Å; L901-M905 VanDerWaalsContact O-CG 3.29Å; L901-M905 WeakPolarHBondContact O-CG 3.41Å; L901-M905 PolarHBondContact O-N 2.65Å; K902-M905 PolarHBondContact O-N 3.12Å; S903-M905 VanDerWaalsContact C-N 3.27Å; S903-M905 PolarHBondContact O-N 3.13Å; M905-F909 VanDerWaalsContact O-CB 3.31Å; M905-F909 WeakPolarHBondContact O-CB 3.46Å; M905-F909 PolarHBondContact O-N 3.01Å
906	E	90.5	Very high	89.2	Confident	45 Å²	45	82.7 Å²	82.7	21%	0.21	41%	0.412	C	S	.	.	H	α-helix	trans	-67.5	-37.8	177.7	-71.2	-177.5	156.7	0	0	111.6	L888 I892 K902 S903 Q910	L888-E906 HydrophobicContact CD2-CG 4.47Å; I892-E906 HydrophobicContact CD1-CG 4.05Å; K902-E906 WeakPolarHBondContact CE-OE1 3.4Å; K902-E906 VanDerWaalsContact CE-OE2 3.3Å; K902-E906 WeakPolarHBondContact CE-OE2 3.26Å; K902-E906 HydrophobicContact CG-CG 4.46Å; K902-E906 IonicContact NZ-OE1 2.69Å; K902-E906 PolarHBondContact O-N 3.49Å; S903-E906 PolarHBondContact O-N 3.39Å; E906-Q910 WeakPolarHBondContact O-CB 3.48Å; E906-Q910 WeakPolarHBondContact O-CG 3.4Å; E906-Q910 PolarHBondContact O-N 3.34Å; E906-Q910 PolarHBondContact O-NE2 2.97Å
907	D	88.1	Confident	88.5	Confident	77 Å²	77	78.1 Å²	78.1	41%	0.412	40%	0.395	S	S	.	.	H	α-helix	trans	-71.3	-45	177.1	-68.6	-46.2	0	0	0	111.8	S903 F909 Q910 T911	S903-D907 WeakPolarHBondContact O-CB 3.4Å; S903-D907 VanDerWaalsContact O-CG 3.25Å; S903-D907 PolarHBondContact O-N 3.22Å; S903-D907 PolarHBondContact OG-OD2 2.88Å; D907-F909 PolarHBondContact O-N 2.99Å; D907-Q910 PolarHBondContact O-N 3.26Å; D907-T911 WeakPolarHBondContact O-CB 3.44Å; D907-T911 WeakPolarHBondContact O-CG2 3.48Å; D907-T911 PolarHBondContact O-N 3.45Å; D907-T911 PolarHBondContact O-OG1 2.96Å
908	F	87.3	Confident	87.8	Confident	86 Å²	86	78.3 Å²	78.3	38%	0.377	40%	0.403	S	S	.	.	H	α-helix	trans	-60.7	-43.5	173.7	177.2	-92	0	0	0	111.6	R904 T911 T912	R904-F908 WeakPolarHBondContact O-CB 3.47Å; R904-F908 PolarHBondContact O-N 3.27Å; F908-T911 PolarHBondContact O-OG1 3.49Å; F908-T911 VanDerWaalsContact O-OG1 3.12Å; F908-T912 WeakPolarHBondContact O-CB 3.09Å; F908-T912 PolarHBondContact O-N 2.9Å; F908-T912 PolarHBondContact O-OG1 3.25Å
909	F	89.7	Confident	87.3	Confident	50 Å²	50	77 Å²	77	22%	0.219	39%	0.391	C	S	.	.	H	α-helix	trans	-65.4	-44.9	177.8	-176.7	-93.9	0	0	0	111.8	F881 K884 V885 L888 M905 D907 W913	F881-F909 AromaticContact CD2-CE1 3.95Å; F881-F909 HydrophobicContact CD2-CE1 3.95Å; F881-F909 HydrophobicContact CE2-CD1 4.31Å; F881-F909 AromaticContact CE2-CE1 3.7Å; F881-F909 HydrophobicContact CE2-CE1 3.7Å; K884-F909 HydrophobicContact CB-CE1 4.49Å; K884-F909 HydrophobicContact CB-CE2 4.24Å; K884-F909 HydrophobicContact CB-CZ 3.62Å; V885-F909 HydrophobicContact CG2-CD1 4.11Å; V885-F909 HydrophobicContact CG2-CE1 3.66Å; L888-F909 HydrophobicContact CD2-CB 3.79Å; L888-F909 HydrophobicContact CD2-CD1 4.21Å; L888-F909 HydrophobicContact CD2-CD2 4.44Å; L888-F909 HydrophobicContact CD2-CG 3.88Å; M905-F909 VanDerWaalsContact O-CB 3.31Å; M905-F909 WeakPolarHBondContact O-CB 3.46Å; M905-F909 PolarHBondContact O-N 3.01Å; D907-F909 PolarHBondContact O-N 2.99Å; F909-W913 HydrophobicContact CZ-CE3 4.1Å; F909-W913 VanDerWaalsContact O-CB 3.25Å; F909-W913 WeakPolarHBondContact O-CB 3.13Å; F909-W913 PolarHBondContact O-N 3.34Å
910	Q	88.9	Confident	86.8	Confident	104 Å²	104	71.8 Å²	71.8	49%	0.486	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-45	178.8	-77.3	174.6	87.1	0	0	112.6	E906 D907 W913 A914	E906-Q910 WeakPolarHBondContact O-CB 3.48Å; E906-Q910 WeakPolarHBondContact O-CG 3.4Å; E906-Q910 PolarHBondContact O-N 3.34Å; E906-Q910 PolarHBondContact O-NE2 2.97Å; D907-Q910 PolarHBondContact O-N 3.26Å; Q910-W913 PolarHBondContact O-N 3.08Å; Q910-A914 WeakPolarHBondContact O-CB 3.14Å; Q910-A914 PolarHBondContact O-N 2.92Å
911	T	86.4	Confident	86.4	Confident	32 Å²	32	69.3 Å²	69.3	20%	0.196	36%	0.357	C	S	.	.	H	α-helix	trans	-66.3	-46.6	178.2	50.6	0	0	0	0	111.7	D907 F908 W913 A914 I915 Y1048	D907-T911 WeakPolarHBondContact O-CB 3.44Å; D907-T911 WeakPolarHBondContact O-CG2 3.48Å; D907-T911 PolarHBondContact O-N 3.45Å; D907-T911 PolarHBondContact O-OG1 2.96Å; F908-T911 PolarHBondContact O-OG1 3.49Å; F908-T911 VanDerWaalsContact O-OG1 3.12Å; T911-W913 VanDerWaalsContact C-N 3.33Å; T911-W913 PolarHBondContact O-N 3.32Å; T911-A914 PolarHBondContact O-N 3.44Å; T911-A914 VanDerWaalsContact O-N 3.15Å; T911-I915 WeakPolarHBondContact O-CG1 3.26Å; T911-I915 PolarHBondContact O-N 3.12Å; T911-Y1048 HydrophobicContact CG2-CE1 4.27Å
912	T	84.7	Confident	86	Confident	36 Å²	36	68.5 Å²	68.5	22%	0.221	36%	0.357	C	S	.	.	H	α-helix	trans	-59.3	-42.9	175.2	-60.6	0	0	0	0	111.7	F908 I915 N916	F908-T912 WeakPolarHBondContact O-CB 3.09Å; F908-T912 PolarHBondContact O-N 2.9Å; F908-T912 PolarHBondContact O-OG1 3.25Å; T912-I915 PolarHBondContact O-N 2.84Å; T912-N916 WeakPolarHBondContact O-CB 3.38Å; T912-N916 PolarHBondContact O-N 3.31Å
913	W	87.5	Confident	85.6	Confident	59 Å²	59	71.2 Å²	71.2	22%	0.223	37%	0.371	C	S	.	.	H	α-helix	trans	-67.5	-36	176	-172.9	-86.4	0	0	0	112.5	F881 F909 Q910 T911 R917 G918	F881-W913 HydrophobicContact CB-CH2 4.31Å; F881-W913 HydrophobicContact CB-CZ2 3.65Å; F881-W913 HydrophobicContact CD2-CB 4.33Å; F881-W913 AromaticContact CD2-CD1 3.43Å; F881-W913 VanDerWaalsContact CD2-CD1 3.43Å; F881-W913 AromaticContact CD2-CD2 3.57Å; F881-W913 HydrophobicContact CD2-CD2 3.57Å; F881-W913 AromaticContact CD2-CE2 3.56Å; F881-W913 HydrophobicContact CD2-CE3 4.28Å; F881-W913 AromaticContact CD2-CG 3.53Å; F881-W913 HydrophobicContact CD2-CG 3.53Å; F881-W913 HydrophobicContact CD2-CZ2 4.28Å; F881-W913 AromaticContact CD2-NE1 3.45Å; F881-W913 HydrophobicContact CE2-CB 4.14Å; F881-W913 AromaticContact CE2-CD1 3.7Å; F881-W913 HydrophobicContact CE2-CD2 4.28Å; F881-W913 AromaticContact CE2-CG 3.77Å; F881-W913 HydrophobicContact CE2-CG 3.77Å; F881-W913 HydrophobicContact CG-CD2 4.46Å; F881-W913 HydrophobicContact CG-CZ2 4.41Å; F881-W913 AromaticContact CG-NE1 3.84Å; F909-W913 HydrophobicContact CZ-CE3 4.1Å; F909-W913 VanDerWaalsContact O-CB 3.25Å; F909-W913 WeakPolarHBondContact O-CB 3.13Å; F909-W913 PolarHBondContact O-N 3.34Å; Q910-W913 PolarHBondContact O-N 3.08Å; T911-W913 VanDerWaalsContact C-N 3.33Å; T911-W913 PolarHBondContact O-N 3.32Å; W913-R917 CarbonylContact O-C 3.48Å; W913-R917 WeakPolarHBondContact O-CA 3.43Å; W913-R917 PolarHBondContact O-N 2.98Å; W913-G918 PolarHBondContact O-N 3.17Å
914	A	85.9	Confident	85.4	Confident	68 Å²	68	70.1 Å²	70.1	56%	0.562	36%	0.361	S	S	*	.	H	α-helix	trans	-65.9	-41.1	176.6	0	0	0	0	0	112.4	Q910 T911	Q910-A914 WeakPolarHBondContact O-CB 3.14Å; Q910-A914 PolarHBondContact O-N 2.92Å; T911-A914 PolarHBondContact O-N 3.44Å; T911-A914 VanDerWaalsContact O-N 3.15Å
915	I	81.3	Confident	85.2	Confident	92 Å²	92	65.3 Å²	65.3	47%	0.472	34%	0.344	S	S	.	.	H	α-helix	trans	-71.8	-58.2	-179.9	-67.4	165.2	0	0	0	110.7	T911 T912 R917 F969	T911-I915 WeakPolarHBondContact O-CG1 3.26Å; T911-I915 PolarHBondContact O-N 3.12Å; T912-I915 PolarHBondContact O-N 2.84Å; I915-R917 PolarHBondContact O-N 3.2Å; I915-F969 HydrophobicContact CD1-CD1 4.09Å; I915-F969 HydrophobicContact CD1-CD2 3.97Å; I915-F969 HydrophobicContact CD1-CE1 3.56Å; I915-F969 HydrophobicContact CD1-CE2 3.43Å; I915-F969 VanDerWaalsContact CD1-CE2 3.43Å; I915-F969 HydrophobicContact CD1-CG 4.26Å; I915-F969 HydrophobicContact CD1-CZ 3.18Å
916	N	82.1	Confident	85	Confident	70 Å²	70	70.7 Å²	70.7	37%	0.374	37%	0.366	S	S	.	.	H	α-helix	trans	-74	-11.2	-178.7	-66.6	-23	0	0	0	112.6	T912 G918 I919	T912-N916 WeakPolarHBondContact O-CB 3.38Å; T912-N916 PolarHBondContact O-N 3.31Å; N916-G918 PolarHBondContact O-N 2.92Å; N916-G918 VanDerWaalsContact O-N 3.08Å; N916-I919 WeakPolarHBondContact O-CB 3.39Å; N916-I919 WeakPolarHBondContact O-CG1 3.34Å; N916-I919 PolarHBondContact O-N 2.72Å
917	R	79.2	Confident	84.9	Confident	128 Å²	128	73 Å²	73	48%	0.483	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	16.1	-172.4	-58.4	178.4	170.2	-148.4	-12	113.5	R877 W913 I915 R1449	R877-R917 PolarHBondContact NE-O 2.92Å; R877-R917 PolarHBondContact NH2-O 3.01Å; W913-R917 CarbonylContact O-C 3.48Å; W913-R917 WeakPolarHBondContact O-CA 3.43Å; W913-R917 PolarHBondContact O-N 2.98Å; I915-R917 PolarHBondContact O-N 3.2Å; R917-R1449 VanDerWaalsContact NH2-NH2 3.13Å
918	G	77.6	Confident	84.8	Confident	31 Å²	31	73 Å²	73	32%	0.32	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	43.8	-166.8	0	0	0	0	0	114	W913 N916	W913-G918 PolarHBondContact O-N 3.17Å; N916-G918 PolarHBondContact O-N 2.92Å; N916-G918 VanDerWaalsContact O-N 3.08Å
919	I	83.9	Confident	84.9	Confident	54 Å²	54	71.4 Å²	71.4	28%	0.277	37%	0.372	S	S	.	.			trans	-106	126.4	166.6	-56.5	174.2	0	0	0	107.9	N916 V924 I1442	N916-I919 WeakPolarHBondContact O-CB 3.39Å; N916-I919 WeakPolarHBondContact O-CG1 3.34Å; N916-I919 PolarHBondContact O-N 2.72Å; I919-V924 HydrophobicContact CG2-CG2 3.71Å; I919-I1442 HydrophobicContact CD1-CD1 4.22Å; I919-I1442 HydrophobicContact CD1-CG2 4.4Å
920	D	81.5	Confident	84.6	Confident	85 Å²	85	76.7 Å²	76.7	46%	0.455	40%	0.397	S	S	.	.			trans	-83.6	119.6	166.5	-174.7	58.9	0	0	0	110.3	P922 E923 V924	D920-P922 WeakPolarHBondContact OD1-CD 3.31Å; D920-P922 WeakPolarHBondContact OD2-CD 3.2Å; D920-E923 HydrophobicContact CB-CB 4.02Å; D920-E923 VanDerWaalsContact OD2-CB 3.32Å; D920-E923 WeakPolarHBondContact OD2-CB 3.19Å; D920-E923 PolarHBondContact OD2-N 3.36Å; D920-V924 WeakPolarHBondContact O-CG2 3.33Å; D920-V924 PolarHBondContact O-N 2.87Å
921	V	83.1	Confident	84.3	Confident	67 Å²	67	79.1 Å²	79.1	41%	0.406	41%	0.409	S	S	.	.	H	α-helix	trans	-71.3	-45.4	-174.6	178.1	0	0	0	0	111.9	E923 V924 L925	V921-E923 PolarHBondContact O-N 3.14Å; V921-V924 PolarHBondContact O-N 2.89Å; V921-L925 HydrophobicContact CG1-CD1 3.69Å; V921-L925 HydrophobicContact CG1-CG 4.21Å; V921-L925 WeakPolarHBondContact O-CG 3.5Å; V921-L925 PolarHBondContact O-N 2.92Å
922	P	83	Confident	84.4	Confident	65 Å²	65	79.7 Å²	79.7	42%	0.422	41%	0.41	S	S	.	.	H	α-helix	trans	-57.9	-40.2	173.4	-26.8	35.9	0	0	0	114.4	D920 L925 K926	D920-P922 WeakPolarHBondContact OD1-CD 3.31Å; D920-P922 WeakPolarHBondContact OD2-CD 3.2Å; P922-L925 PolarHBondContact O-N 3.17Å; P922-K926 WeakPolarHBondContact O-CD 3.34Å; P922-K926 VanDerWaalsContact O-CG 3.26Å; P922-K926 WeakPolarHBondContact O-CG 3.5Å; P922-K926 PolarHBondContact O-N 2.93Å
923	E	84.4	Confident	84.7	Confident	132 Å²	132	80 Å²	80	62%	0.617	41%	0.409	S	S	*	.	H	α-helix	trans	-60.7	-48.2	174.7	-173.4	175.3	-144.6	0	0	111.9	D920 V921 L925 K926	D920-E923 HydrophobicContact CB-CB 4.02Å; D920-E923 VanDerWaalsContact OD2-CB 3.32Å; D920-E923 WeakPolarHBondContact OD2-CB 3.19Å; D920-E923 PolarHBondContact OD2-N 3.36Å; V921-E923 PolarHBondContact O-N 3.14Å; E923-L925 VanDerWaalsContact C-N 3.33Å; E923-L925 PolarHBondContact O-N 2.89Å; E923-K926 PolarHBondContact O-N 3.33Å
924	V	86.8	Confident	84.6	Confident	36 Å²	36	77.2 Å²	77.2	22%	0.218	40%	0.399	C	S	.	.	H	α-helix	trans	-63.9	-37	179.2	172.2	0	0	0	0	112.3	I919 D920 V921 I927 Y928	I919-V924 HydrophobicContact CG2-CG2 3.71Å; D920-V924 WeakPolarHBondContact O-CG2 3.33Å; D920-V924 PolarHBondContact O-N 2.87Å; V921-V924 PolarHBondContact O-N 2.89Å; V924-I927 WeakPolarHBondContact O-CB 3.16Å; V924-Y928 HydrophobicContact CG1-CE2 4.31Å; V924-Y928 WeakPolarHBondContact O-CD2 3.43Å; V924-Y928 WeakPolarHBondContact O-CE2 3.37Å
925	L	86.6	Confident	84.8	Confident	9 Å²	9	76.7 Å²	76.7	5%	0.047	39%	0.386	C	S	.	.	H	α-helix	trans	-73.3	-32.4	-177	-69.6	175.5	0	0	0	113.3	V921 P922 E923 I927 Y928 Q933 I936 Y937 L940	V921-L925 HydrophobicContact CG1-CD1 3.69Å; V921-L925 HydrophobicContact CG1-CG 4.21Å; V921-L925 WeakPolarHBondContact O-CG 3.5Å; V921-L925 PolarHBondContact O-N 2.92Å; P922-L925 PolarHBondContact O-N 3.17Å; E923-L925 VanDerWaalsContact C-N 3.33Å; E923-L925 PolarHBondContact O-N 2.89Å; L925-I927 PolarHBondContact O-N 3.13Å; L925-Y928 PolarHBondContact O-N 3.24Å; L925-Q933 WeakPolarHBondContact O-CG 3.5Å; L925-Q933 PolarHBondContact O-NE2 3.41Å; L925-I936 HydrophobicContact CD2-CB 4.22Å; L925-I936 HydrophobicContact CD2-CD1 4.15Å; L925-I936 HydrophobicContact CD2-CG2 3.66Å; L925-Y937 HydrophobicContact CD1-CD1 4.5Å; L925-Y937 HydrophobicContact CD1-CD2 4.45Å; L925-Y937 HydrophobicContact CD1-CE1 3.85Å; L925-Y937 HydrophobicContact CD1-CE2 3.78Å; L925-Y937 VanDerWaalsContact CD1-CZ 3.44Å; L925-L940 HydrophobicContact CD1-CD1 4.49Å
926	K	86.8	Confident	85.3	Confident	159 Å²	159	75 Å²	75	69%	0.691	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-20	175.4	-74.2	162.5	-171.5	168.7	0	114.2	P922 E923 Y928	P922-K926 WeakPolarHBondContact O-CD 3.34Å; P922-K926 VanDerWaalsContact O-CG 3.26Å; P922-K926 WeakPolarHBondContact O-CG 3.5Å; P922-K926 PolarHBondContact O-N 2.93Å; E923-K926 PolarHBondContact O-N 3.33Å; K926-Y928 VanDerWaalsContact C-N 3.33Å
927	I	88	Confident	85.7	Confident	93 Å²	93	73.8 Å²	73.8	48%	0.477	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-22.4	-178.8	-55	166.4	0	0	0	111.8	V924 L925 L1439	V924-I927 WeakPolarHBondContact O-CB 3.16Å; L925-I927 PolarHBondContact O-N 3.13Å; I927-L1439 HydrophobicContact CD1-CD1 3.59Å; I927-L1439 HydrophobicContact CD1-CD2 3.56Å; I927-L1439 HydrophobicContact CD1-CG 4.21Å
928	Y	86.2	Confident	86.3	Confident	76 Å²	76	69.8 Å²	69.8	30%	0.298	36%	0.356	S	S	.	.	S	Bend	trans	-96.3	151.1	-178	-62.3	-87.7	0	0	0	111.6	V924 L925 K926 Q933 I936	V924-Y928 HydrophobicContact CG1-CE2 4.31Å; V924-Y928 WeakPolarHBondContact O-CD2 3.43Å; V924-Y928 WeakPolarHBondContact O-CE2 3.37Å; L925-Y928 PolarHBondContact O-N 3.24Å; K926-Y928 VanDerWaalsContact C-N 3.33Å; Y928-Q933 WeakPolarHBondContact O-CG 3.33Å; Y928-Q933 PolarHBondContact O-NE2 3.46Å; Y928-I936 HydrophobicContact CD1-CD1 4.43Å; Y928-I936 HydrophobicContact CD2-CD1 4.27Å; Y928-I936 HydrophobicContact CG-CD1 4.19Å
929	P	88.7	Confident	86.9	Confident	53 Å²	53	74 Å²	74	34%	0.344	37%	0.367	S	S	.	.			trans	-68.5	151.4	171	30.1	-35.8	0	0	0	111.7	E931 L932 Q933	P929-E931 VanDerWaalsContact C-N 3.27Å; P929-E931 PolarHBondContact O-N 2.91Å; P929-E931 VanDerWaalsContact O-N 3.1Å; P929-L932 HydrophobicContact CG-CB 4.23Å; P929-L932 HydrophobicContact CG-CD1 3.89Å; P929-L932 HydrophobicContact CG-CG 4.17Å; P929-L932 WeakPolarHBondContact O-CA 3.43Å; P929-L932 PolarHBondContact O-N 3.15Å; P929-Q933 PolarHBondContact O-N 2.89Å
930	E	84.7	Confident	87.1	Confident	161 Å²	161	75.6 Å²	75.6	75%	0.752	38%	0.376	S	S	*	.	H	α-helix	trans	-48.7	-39.8	-174.6	-66.2	169.4	-169.5	0	0	114.5	L932 Q933 G934	E930-L932 VanDerWaalsContact C-N 3.31Å; E930-L932 PolarHBondContact O-N 3.1Å; E930-Q933 PolarHBondContact O-N 3.16Å; E930-G934 PolarHBondContact O-N 3Å
931	E	81.6	Confident	87.6	Confident	156 Å²	156	71.8 Å²	71.8	73%	0.729	36%	0.355	S	S	*	.	H	α-helix	trans	-58.9	-42.9	177.4	-66.9	-172.9	166.8	0	0	112.4	P929 D935 K959	P929-E931 VanDerWaalsContact C-N 3.27Å; P929-E931 PolarHBondContact O-N 2.91Å; P929-E931 VanDerWaalsContact O-N 3.1Å; E931-D935 PolarHBondContact O-N 2.61Å; E931-D935 VanDerWaalsContact O-N 3.15Å; E931-K959 PolarHBondContact O-NZ 3.21Å
932	L	89.1	Confident	87.9	Confident	44 Å²	44	74.9 Å²	74.9	23%	0.23	36%	0.36	C	S	.	.	H	α-helix	trans	-78.3	-36.7	178	-71.5	178.2	0	0	0	111.6	F337 P929 E930 G934 D935 I936	F337-L932 HydrophobicContact CD2-CD1 4.47Å; F337-L932 HydrophobicContact CE2-CD1 3.51Å; F337-L932 HydrophobicContact CE2-CD2 4.28Å; F337-L932 HydrophobicContact CZ-CD1 3.87Å; F337-L932 HydrophobicContact CZ-CD2 3.83Å; P929-L932 HydrophobicContact CG-CB 4.23Å; P929-L932 HydrophobicContact CG-CD1 3.89Å; P929-L932 HydrophobicContact CG-CG 4.17Å; P929-L932 WeakPolarHBondContact O-CA 3.43Å; P929-L932 PolarHBondContact O-N 3.15Å; E930-L932 VanDerWaalsContact C-N 3.31Å; E930-L932 PolarHBondContact O-N 3.1Å; L932-G934 VanDerWaalsContact C-N 3.3Å; L932-G934 PolarHBondContact O-N 3.05Å; L932-D935 PolarHBondContact O-N 3.44Å; L932-I936 WeakPolarHBondContact O-CB 3.41Å; L932-I936 WeakPolarHBondContact O-CD1 3.45Å; L932-I936 WeakPolarHBondContact O-CG1 3.29Å; L932-I936 PolarHBondContact O-N 2.82Å
933	Q	89.8	Confident	88	Confident	43 Å²	43	75 Å²	75	20%	0.201	36%	0.355	C	S	.	.	H	α-helix	trans	-54.8	-50.5	169.4	-65.5	-179	12.9	0	0	109.8	L925 Y928 P929 E930 D935 I936 Y937	L925-Q933 WeakPolarHBondContact O-CG 3.5Å; L925-Q933 PolarHBondContact O-NE2 3.41Å; Y928-Q933 WeakPolarHBondContact O-CG 3.33Å; Y928-Q933 PolarHBondContact O-NE2 3.46Å; P929-Q933 PolarHBondContact O-N 2.89Å; E930-Q933 PolarHBondContact O-N 3.16Å; Q933-D935 PolarHBondContact O-N 3.39Å; Q933-I936 PolarHBondContact O-N 2.95Å; Q933-I936 VanDerWaalsContact O-N 3.11Å; Q933-Y937 HydrophobicContact CB-CD2 4.34Å; Q933-Y937 HydrophobicContact CB-CE2 4.45Å; Q933-Y937 WeakPolarHBondContact O-CB 3.49Å; Q933-Y937 WeakPolarHBondContact O-CD2 3.33Å; Q933-Y937 PolarHBondContact O-N 3.22Å
934	G	86.5	Confident	88.1	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-62.5	-35.7	179	0	0	0	0	0	114.3	E930 L932 L938	E930-G934 PolarHBondContact O-N 3Å; L932-G934 VanDerWaalsContact C-N 3.3Å; L932-G934 PolarHBondContact O-N 3.05Å; G934-L938 VanDerWaalsContact O-CB 3.25Å; G934-L938 WeakPolarHBondContact O-CB 3.47Å; G934-L938 PolarHBondContact O-N 3.21Å
935	D	89.8	Confident	88.2	Confident	56 Å²	56	68.1 Å²	68.1	30%	0.299	32%	0.321	S	S	.	.	H	α-helix	trans	-75.8	-26.5	173.1	-77.6	-39.1	0	0	0	113	E931 L932 Q933 H939 R955 K959	E931-D935 PolarHBondContact O-N 2.61Å; E931-D935 VanDerWaalsContact O-N 3.15Å; L932-D935 PolarHBondContact O-N 3.44Å; Q933-D935 PolarHBondContact O-N 3.39Å; D935-H939 PolarHBondContact O-N 3.41Å; D935-R955 IonicContact OD1-CZ 2.77Å; D935-R955 IonicContact OD1-NH2 2.74Å; D935-R955 PolarHBondContact OD1-NH2 3.35Å; D935-R955 IonicContact OD2-NH2 2.63Å; D935-R955 PolarHBondContact OD2-NH2 2.9Å; D935-K959 VanDerWaalsContact CG-CE 3.47Å; D935-K959 WeakPolarHBondContact OD1-CE 3.25Å; D935-K959 IonicContact OD1-NZ 3.63Å; D935-K959 PolarHBondContact OD1-NZ 3.13Å; D935-K959 IonicContact OD2-NZ 3.24Å; D935-K959 PolarHBondContact OD2-NZ 3.2Å
936	I	91.2	Very high	88.1	Confident	56 Å²	56	70.5 Å²	70.5	29%	0.287	35%	0.348	S	S	.	.	H	α-helix	trans	-73.2	-47.1	171.1	-66.4	160.6	0	0	0	110.5	L925 Y928 L932 Q933 L938 H939 L940	L925-I936 HydrophobicContact CD2-CB 4.22Å; L925-I936 HydrophobicContact CD2-CD1 4.15Å; L925-I936 HydrophobicContact CD2-CG2 3.66Å; Y928-I936 HydrophobicContact CD1-CD1 4.43Å; Y928-I936 HydrophobicContact CD2-CD1 4.27Å; Y928-I936 HydrophobicContact CG-CD1 4.19Å; L932-I936 WeakPolarHBondContact O-CB 3.41Å; L932-I936 WeakPolarHBondContact O-CD1 3.45Å; L932-I936 WeakPolarHBondContact O-CG1 3.29Å; L932-I936 PolarHBondContact O-N 2.82Å; Q933-I936 PolarHBondContact O-N 2.95Å; Q933-I936 VanDerWaalsContact O-N 3.11Å; I936-L938 VanDerWaalsContact C-N 3.28Å; I936-L938 PolarHBondContact O-N 3.13Å; I936-H939 CarbonylContact O-C 3.57Å; I936-H939 WeakPolarHBondContact O-CA 3.34Å; I936-H939 WeakPolarHBondContact O-CB 3.33Å; I936-H939 PolarHBondContact O-N 3.27Å; I936-L940 HydrophobicContact CG2-CD1 4.03Å; I936-L940 HydrophobicContact CG2-CG 4.25Å; I936-L940 WeakPolarHBondContact O-CG 3.4Å; I936-L940 PolarHBondContact O-N 3.34Å
937	Y	91.6	Very high	88	Confident	46 Å²	46	64.4 Å²	64.4	18%	0.18	32%	0.323	C	S	.	.	H	α-helix	trans	-58.3	-39.5	174.2	-85.2	-66.6	0	0	0	111.9	L925 Q933 H939 L940 N941 A962 I963	L925-Y937 HydrophobicContact CD1-CD1 4.5Å; L925-Y937 HydrophobicContact CD1-CD2 4.45Å; L925-Y937 HydrophobicContact CD1-CE1 3.85Å; L925-Y937 HydrophobicContact CD1-CE2 3.78Å; L925-Y937 VanDerWaalsContact CD1-CZ 3.44Å; Q933-Y937 HydrophobicContact CB-CD2 4.34Å; Q933-Y937 HydrophobicContact CB-CE2 4.45Å; Q933-Y937 WeakPolarHBondContact O-CB 3.49Å; Q933-Y937 WeakPolarHBondContact O-CD2 3.33Å; Q933-Y937 PolarHBondContact O-N 3.22Å; Y937-H939 PolarHBondContact O-N 3.17Å; Y937-L940 PolarHBondContact O-N 3.03Å; Y937-N941 WeakPolarHBondContact O-CB 3.27Å; Y937-N941 PolarHBondContact O-N 3.01Å; Y937-N941 PolarHBondContact O-ND2 2.95Å; Y937-A962 WeakPolarHBondContact CB-O 3.44Å; Y937-A962 WeakPolarHBondContact CD1-O 3.37Å; Y937-I963 HydrophobicContact CD2-CB 4.36Å; Y937-I963 HydrophobicContact CD2-CG1 3.88Å; Y937-I963 HydrophobicContact CE2-CG2 4.49Å; Y937-I963 HydrophobicContact CG-CG1 4.37Å
938	L	90.7	Very high	87.8	Confident	43 Å²	43	67.5 Å²	67.5	23%	0.225	33%	0.333	C	S	.	.	H	α-helix	trans	-61.6	-30.8	172.7	-172.2	70	0	0	0	112.4	G934 I936 R942 L945 L958	G934-L938 VanDerWaalsContact O-CB 3.25Å; G934-L938 WeakPolarHBondContact O-CB 3.47Å; G934-L938 PolarHBondContact O-N 3.21Å; I936-L938 VanDerWaalsContact C-N 3.28Å; I936-L938 PolarHBondContact O-N 3.13Å; L938-R942 PolarHBondContact O-N 3.02Å; L938-L945 HydrophobicContact CD1-CD1 3.9Å; L938-L958 HydrophobicContact CD1-CB 4.06Å
939	H	91	Very high	87.6	Confident	119 Å²	119	64.4 Å²	64.4	55%	0.551	32%	0.322	S	S	*	.	H	α-helix	trans	-80.3	-38.3	174.9	-169.2	80.7	0	0	0	113.2	D935 I936 Y937 R942	D935-H939 PolarHBondContact O-N 3.41Å; I936-H939 CarbonylContact O-C 3.57Å; I936-H939 WeakPolarHBondContact O-CA 3.34Å; I936-H939 WeakPolarHBondContact O-CB 3.33Å; I936-H939 PolarHBondContact O-N 3.27Å; Y937-H939 PolarHBondContact O-N 3.17Å; H939-R942 WeakPolarHBondContact O-CB 3.43Å; H939-R942 WeakPolarHBondContact O-CD 3.28Å; H939-R942 VanDerWaalsContact O-CG 3.26Å; H939-R942 WeakPolarHBondContact O-CG 3.48Å
940	L	88.7	Confident	87.5	Confident	89 Å²	89	62.2 Å²	62.2	47%	0.466	31%	0.307	S	S	.	.	H	α-helix	trans	-65.8	-45.4	176.8	-68.8	172.4	0	0	0	111.1	L925 I936 Y937 R942	L925-L940 HydrophobicContact CD1-CD1 4.49Å; I936-L940 HydrophobicContact CG2-CD1 4.03Å; I936-L940 HydrophobicContact CG2-CG 4.25Å; I936-L940 WeakPolarHBondContact O-CG 3.4Å; I936-L940 PolarHBondContact O-N 3.34Å; Y937-L940 PolarHBondContact O-N 3.03Å; L940-R942 VanDerWaalsContact C-N 3.28Å; L940-R942 PolarHBondContact O-N 2.79Å
941	N	90.7	Very high	87.5	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.021	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	13.5	-178.4	-63.3	-54.2	0	0	0	113.4	Y937 E943 V944 L945 A962 F965 H1052	Y937-N941 WeakPolarHBondContact O-CB 3.27Å; Y937-N941 PolarHBondContact O-N 3.01Å; Y937-N941 PolarHBondContact O-ND2 2.95Å; N941-E943 PolarHBondContact O-N 3.46Å; N941-E943 VanDerWaalsContact O-N 3.12Å; N941-V944 PolarHBondContact O-N 3.45Å; N941-L945 HydrophobicContact CB-CD1 3.77Å; N941-L945 HydrophobicContact CB-CG 4.16Å; N941-L945 WeakPolarHBondContact O-CB 3.41Å; N941-L945 WeakPolarHBondContact O-CG 3.14Å; N941-L945 PolarHBondContact O-N 3.07Å; N941-A962 PolarHBondContact ND2-O 3.38Å; N941-F965 HydrophobicContact CB-CB 4.43Å; N941-F965 WeakPolarHBondContact ND2-CB 3.49Å; N941-H1052 PolarHBondContact OD1-CE1 3.46Å; N941-H1052 VanDerWaalsContact OD1-CE1 3.28Å; N941-H1052 PolarHBondContact OD1-ND1 2.99Å
942	R	89.5	Confident	87.6	Confident	133 Å²	133	58.9 Å²	58.9	50%	0.502	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.8	-172	73.4	-176.4	-170.4	-168.6	0.2	114.9	L938 H939 L940 G946	L938-R942 PolarHBondContact O-N 3.02Å; H939-R942 WeakPolarHBondContact O-CB 3.43Å; H939-R942 WeakPolarHBondContact O-CD 3.28Å; H939-R942 VanDerWaalsContact O-CG 3.26Å; H939-R942 WeakPolarHBondContact O-CG 3.48Å; L940-R942 VanDerWaalsContact C-N 3.28Å; L940-R942 PolarHBondContact O-N 2.79Å; R942-G946 PolarHBondContact O-N 3.46Å
943	E	85.7	Confident	87.4	Confident	68 Å²	68	57.2 Å²	57.2	32%	0.318	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-39.8	-175.8	-56.2	-161.1	-172	0	0	109.9	N941 K1008	N941-E943 PolarHBondContact O-N 3.46Å; N941-E943 VanDerWaalsContact O-N 3.12Å; E943-K1008 IonicContact OE2-NZ 2.86Å; E943-K1008 PolarHBondContact OE2-NZ 2.87Å
944	V	87.5	Confident	87.4	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.012	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-46.6	169.4	-178.7	0	0	0	0	111.6	N941 G946 L947 F950 F965 F988 S990 H1052	N941-V944 PolarHBondContact O-N 3.45Å; V944-G946 PolarHBondContact O-N 3.45Å; V944-L947 HydrophobicContact CG1-CD1 4.38Å; V944-L947 VanDerWaalsContact O-CB 3.31Å; V944-L947 WeakPolarHBondContact O-CB 3.24Å; V944-L947 WeakPolarHBondContact O-CG 3.31Å; V944-L947 PolarHBondContact O-N 3.01Å; V944-L947 VanDerWaalsContact O-N 3.08Å; V944-F950 HydrophobicContact CG1-CE2 3.92Å; V944-F950 WeakPolarHBondContact O-CD2 3.5Å; V944-F965 HydrophobicContact CG1-CE1 4.18Å; V944-F965 HydrophobicContact CG1-CE2 4.39Å; V944-F965 HydrophobicContact CG1-CZ 3.89Å; V944-F988 HydrophobicContact CG1-CB 4.01Å; V944-F988 HydrophobicContact CG1-CD1 3.64Å; V944-F988 HydrophobicContact CG1-CD2 4.21Å; V944-F988 HydrophobicContact CG1-CE1 4.09Å; V944-F988 HydrophobicContact CG1-CG 3.7Å; V944-F988 HydrophobicContact CG2-CB 3.93Å; V944-S990 WeakPolarHBondContact CG2-OG 3.29Å; V944-H1052 HydrophobicContact CG2-CB 3.78Å
945	L	88.1	Confident	87.4	Confident	20 Å²	20	66 Å²	66	11%	0.105	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-3.3	-179.7	-62.4	173.8	0	0	0	113.4	L938 N941 F950 L958 L961 A962 F965	L938-L945 HydrophobicContact CD1-CD1 3.9Å; N941-L945 HydrophobicContact CB-CD1 3.77Å; N941-L945 HydrophobicContact CB-CG 4.16Å; N941-L945 WeakPolarHBondContact O-CB 3.41Å; N941-L945 WeakPolarHBondContact O-CG 3.14Å; N941-L945 PolarHBondContact O-N 3.07Å; L945-F950 HydrophobicContact CD2-CD1 4.15Å; L945-F950 HydrophobicContact CD2-CD2 4.4Å; L945-F950 HydrophobicContact CD2-CE1 4.45Å; L945-F950 HydrophobicContact CD2-CG 4.13Å; L945-L958 HydrophobicContact CD2-CD2 4.08Å; L945-L961 HydrophobicContact CD2-CB 4.48Å; L945-A962 HydrophobicContact CD1-CB 3.69Å; L945-F965 HydrophobicContact CD2-CD2 4.25Å; L945-F965 HydrophobicContact CD2-CE2 3.82Å
946	G	84.9	Confident	87.2	Confident	60 Å²	60	68.3 Å²	68.3	62%	0.619	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-8	168.8	0	0	0	0	0	114	R942 V944	R942-G946 PolarHBondContact O-N 3.46Å; V944-G946 PolarHBondContact O-N 3.45Å
947	L	84.9	Confident	87.2	Confident	30 Å²	30	65.7 Å²	65.7	16%	0.157	32%	0.32	C	S	.	.	S	Bend	trans	-66.7	144.1	175.7	-59.4	172.6	0	0	0	110.5	V944 V949 F950 F988 N1009	V944-L947 HydrophobicContact CG1-CD1 4.38Å; V944-L947 VanDerWaalsContact O-CB 3.31Å; V944-L947 WeakPolarHBondContact O-CB 3.24Å; V944-L947 WeakPolarHBondContact O-CG 3.31Å; V944-L947 PolarHBondContact O-N 3.01Å; V944-L947 VanDerWaalsContact O-N 3.08Å; L947-V949 PolarHBondContact O-N 3.47Å; L947-F950 HydrophobicContact CB-CD2 4.26Å; L947-F950 PolarHBondContact O-N 2.79Å; L947-F988 HydrophobicContact CD1-CD1 4.03Å; L947-F988 HydrophobicContact CD1-CE1 4.49Å; L947-N1009 HydrophobicContact CD2-CB 3.67Å
948	K	83.3	Confident	87.2	Confident	159 Å²	159	65 Å²	65	69%	0.691	32%	0.319	S	S	*	.	H	α-helix	trans	-50	-35.2	-177.1	-63.4	175.4	-176.4	169.5	0	113.6	F950 E951	K948-F950 PolarHBondContact O-N 3.06Å; K948-E951 WeakPolarHBondContact O-CB 3.39Å; K948-E951 PolarHBondContact O-N 2.79Å; K948-E951 VanDerWaalsContact O-N 3.08Å
949	V	81.6	Confident	87.2	Confident	11 Å²	11	64.9 Å²	64.9	7%	0.067	32%	0.316	C	S	.	.	H	α-helix	trans	-50.2	-37.8	175	-178.3	0	0	0	0	112.1	L947 W1011 F1069 L1073 Y1076	L947-V949 PolarHBondContact O-N 3.47Å; V949-W1011 HydrophobicContact CG1-CH2 3.9Å; V949-W1011 HydrophobicContact CG1-CZ3 4.38Å; V949-W1011 HydrophobicContact CG2-CH2 4.04Å; V949-W1011 HydrophobicContact CG2-CZ2 3.92Å; V949-F1069 WeakPolarHBondContact O-CE2 3.45Å; V949-L1073 HydrophobicContact CG1-CD1 3.31Å; V949-Y1076 HydrophobicContact CG1-CD2 4.42Å; V949-Y1076 HydrophobicContact CG2-CG 4.32Å
950	F	86.7	Confident	87.1	Confident	6 Å²	6	61 Å²	61	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-95.7	-5.9	-177.7	-59.8	-73.2	0	0	0	114.3	V944 L945 L947 K948 K952 A953 L958 L961 F965 F988 F1069	V944-F950 HydrophobicContact CG1-CE2 3.92Å; V944-F950 WeakPolarHBondContact O-CD2 3.5Å; L945-F950 HydrophobicContact CD2-CD1 4.15Å; L945-F950 HydrophobicContact CD2-CD2 4.4Å; L945-F950 HydrophobicContact CD2-CE1 4.45Å; L945-F950 HydrophobicContact CD2-CG 4.13Å; L947-F950 HydrophobicContact CB-CD2 4.26Å; L947-F950 PolarHBondContact O-N 2.79Å; K948-F950 PolarHBondContact O-N 3.06Å; F950-K952 PolarHBondContact O-N 3.03Å; F950-A953 VanDerWaalsContact O-CB 3.29Å; F950-A953 WeakPolarHBondContact O-CB 3.44Å; F950-A953 PolarHBondContact O-N 3.21Å; F950-L958 HydrophobicContact CB-CD2 4Å; F950-L961 HydrophobicContact CD1-CD1 3.95Å; F950-L961 HydrophobicContact CE1-CD1 3.88Å; F950-F965 HydrophobicContact CZ-CE2 4.37Å; F950-F965 HydrophobicContact CZ-CZ 4.06Å; F950-F988 AromaticContact CE2-CE1 3.93Å; F950-F988 HydrophobicContact CE2-CE1 3.93Å; F950-F988 HydrophobicContact CE2-CZ 4.29Å; F950-F988 HydrophobicContact CZ-CE1 4.04Å; F950-F988 AromaticContact CZ-CZ 3.93Å; F950-F988 HydrophobicContact CZ-CZ 3.93Å; F950-F1069 HydrophobicContact CD1-CE1 4.33Å; F950-F1069 AromaticContact CD1-CZ 3.71Å; F950-F1069 HydrophobicContact CD1-CZ 3.71Å; F950-F1069 HydrophobicContact CE1-CE1 4.44Å; F950-F1069 HydrophobicContact CE1-CZ 4.11Å
951	E	84.3	Confident	87.3	Confident	139 Å²	139	56.8 Å²	56.8	65%	0.65	28%	0.281	S	S	*	.	H	α-helix	trans	-60.1	-32.6	-177.4	-172	178.7	-175	0	0	112.6	K948	K948-E951 WeakPolarHBondContact O-CB 3.39Å; K948-E951 PolarHBondContact O-N 2.79Å; K948-E951 VanDerWaalsContact O-N 3.08Å
952	K	83.2	Confident	87.3	Confident	108 Å²	108	56.6 Å²	56.6	47%	0.47	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-12.6	178.1	-60.6	175.3	-177	165.6	0	113.6	F950 N954 E1072 Y1076	F950-K952 PolarHBondContact O-N 3.03Å; K952-N954 PolarHBondContact O-N 3.42Å; K952-E1072 WeakPolarHBondContact CB-OE2 3.2Å; K952-E1072 HydrophobicContact CD-CG 4.35Å; K952-Y1076 HydrophobicContact CD-CE2 4.31Å; K952-Y1076 WeakPolarHBondContact CE-OH 3.44Å; K952-Y1076 PolarHBondContact NZ-OH 3.23Å
953	A	86.7	Confident	87.3	Confident	10 Å²	10	53.7 Å²	53.7	8%	0.083	27%	0.273	C	S	.	.	S	Bend	trans	-72.1	129.6	-175.5	0	0	0	0	0	111.7	F950 L958 F1069	F950-A953 VanDerWaalsContact O-CB 3.29Å; F950-A953 WeakPolarHBondContact O-CB 3.44Å; F950-A953 PolarHBondContact O-N 3.21Å; A953-L958 HydrophobicContact CB-CD2 3.76Å; A953-L958 HydrophobicContact CB-CG 3.84Å; A953-F1069 HydrophobicContact CB-CD2 3.89Å; A953-F1069 HydrophobicContact CB-CE2 3.77Å; A953-F1069 HydrophobicContact CB-CG 4.35Å; A953-F1069 HydrophobicContact CB-CZ 4.12Å
954	N	88.2	Confident	87.5	Confident	91 Å²	91	53 Å²	53	49%	0.487	27%	0.272	S	S	.	.			trans	-61.4	148.2	172.2	176.7	39.3	0	0	0	111	K952 D956 C957 L958	K952-N954 PolarHBondContact O-N 3.42Å; N954-D956 PolarHBondContact ND2-OD2 2.68Å; N954-D956 PolarHBondContact O-N 2.84Å; N954-C957 WeakPolarHBondContact O-CA 3.15Å; N954-C957 WeakPolarHBondContact O-CB 3.42Å; N954-C957 PolarHBondContact O-N 3.23Å; N954-L958 PolarHBondContact O-N 3.46Å
955	R	87.7	Confident	87.7	Confident	137 Å²	137	53.1 Å²	53.1	52%	0.517	27%	0.272	S	S	.	.	H	α-helix	trans	-53.5	-33.9	-176.9	-173.1	176.7	178.7	-156.2	-4.3	113.5	D935 L958 K959	D935-R955 IonicContact OD1-CZ 2.77Å; D935-R955 IonicContact OD1-NH2 2.74Å; D935-R955 PolarHBondContact OD1-NH2 3.35Å; D935-R955 IonicContact OD2-NH2 2.63Å; D935-R955 PolarHBondContact OD2-NH2 2.9Å; R955-L958 PolarHBondContact O-N 3.31Å; R955-K959 PolarHBondContact O-N 2.96Å
956	D	85.9	Confident	87.8	Confident	103 Å²	103	56.5 Å²	56.5	55%	0.551	29%	0.286	S	S	*	.	H	α-helix	trans	-64.6	-43.3	176.5	-49.6	-39.9	0	0	0	111.3	N954 K959 S960	N954-D956 PolarHBondContact ND2-OD2 2.68Å; N954-D956 PolarHBondContact O-N 2.84Å; D956-K959 PolarHBondContact O-N 3.4Å; D956-S960 PolarHBondContact O-N 2.86Å; D956-S960 PolarHBondContact O-OG 3.4Å
957	C	90.8	Very high	87.9	Confident	2 Å²	2	59 Å²	59	1%	0.014	28%	0.284	C	S	.	.	H	α-helix	trans	-67.7	-42.5	176	-176.5	0	0	0	0	111.2	N954 K959 S960 L961 H1066	N954-C957 WeakPolarHBondContact O-CA 3.15Å; N954-C957 WeakPolarHBondContact O-CB 3.42Å; N954-C957 PolarHBondContact O-N 3.23Å; C957-K959 VanDerWaalsContact C-N 3.31Å; C957-K959 PolarHBondContact O-N 2.74Å; C957-S960 PolarHBondContact O-N 2.86Å; C957-L961 WeakPolarHBondContact O-CB 3.37Å; C957-L961 WeakPolarHBondContact O-CG 3.28Å; C957-L961 PolarHBondContact O-N 3.24Å; C957-H1066 HydrophobicContact CB-CB 4.49Å; C957-H1066 VanDerWaalsContact SG-CD2 3.54Å
958	L	92	Very high	88	Confident	32 Å²	32	59.8 Å²	59.8	17%	0.168	29%	0.291	C	S	.	.	H	α-helix	trans	-57.5	-41.1	173.1	-70.2	172.9	0	0	0	112	L938 L945 F950 A953 N954 R955 A962	L938-L958 HydrophobicContact CD1-CB 4.06Å; L945-L958 HydrophobicContact CD2-CD2 4.08Å; F950-L958 HydrophobicContact CB-CD2 4Å; A953-L958 HydrophobicContact CB-CD2 3.76Å; A953-L958 HydrophobicContact CB-CG 3.84Å; N954-L958 PolarHBondContact O-N 3.46Å; R955-L958 PolarHBondContact O-N 3.31Å; L958-A962 WeakPolarHBondContact O-CB 3.3Å; L958-A962 PolarHBondContact O-N 2.98Å
959	K	89.2	Confident	88.2	Confident	39 Å²	39	54 Å²	54	17%	0.17	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-45.6	174.1	-79.3	-160.1	173.2	-160.7	0	112.3	E931 D935 R955 D956 C957 L961 A962 I963	E931-K959 PolarHBondContact O-NZ 3.21Å; D935-K959 VanDerWaalsContact CG-CE 3.47Å; D935-K959 WeakPolarHBondContact OD1-CE 3.25Å; D935-K959 IonicContact OD1-NZ 3.63Å; D935-K959 PolarHBondContact OD1-NZ 3.13Å; D935-K959 IonicContact OD2-NZ 3.24Å; D935-K959 PolarHBondContact OD2-NZ 3.2Å; R955-K959 PolarHBondContact O-N 2.96Å; D956-K959 PolarHBondContact O-N 3.4Å; C957-K959 VanDerWaalsContact C-N 3.31Å; C957-K959 PolarHBondContact O-N 2.74Å; K959-L961 VanDerWaalsContact C-N 3.32Å; K959-L961 PolarHBondContact O-N 3.38Å; K959-A962 PolarHBondContact O-N 2.97Å; K959-I963 WeakPolarHBondContact O-CG1 3.31Å; K959-I963 PolarHBondContact O-N 3.32Å
960	S	89.5	Confident	88.5	Confident	38 Å²	38	53.9 Å²	53.9	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-39.4	177.8	-62.8	0	0	0	0	112.7	D956 C957 N964	D956-S960 PolarHBondContact O-N 2.86Å; D956-S960 PolarHBondContact O-OG 3.4Å; C957-S960 PolarHBondContact O-N 2.86Å; S960-N964 PolarHBondContact O-ND2 2.93Å
961	L	92	Very high	88.6	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-66.8	-49.4	172.2	-69.5	166.3	0	0	0	111	L945 F950 C957 K959 I963 N964 F965 I1054 L1059 I1062 F1069	L945-L961 HydrophobicContact CD2-CB 4.48Å; F950-L961 HydrophobicContact CD1-CD1 3.95Å; F950-L961 HydrophobicContact CE1-CD1 3.88Å; C957-L961 WeakPolarHBondContact O-CB 3.37Å; C957-L961 WeakPolarHBondContact O-CG 3.28Å; C957-L961 PolarHBondContact O-N 3.24Å; K959-L961 VanDerWaalsContact C-N 3.32Å; K959-L961 PolarHBondContact O-N 3.38Å; L961-I963 VanDerWaalsContact C-N 3.3Å; L961-I963 PolarHBondContact O-N 3.42Å; L961-N964 PolarHBondContact O-N 3.48Å; L961-F965 HydrophobicContact CB-CD2 4.27Å; L961-F965 HydrophobicContact CB-CE2 4.09Å; L961-F965 VanDerWaalsContact O-CD2 3.29Å; L961-F965 WeakPolarHBondContact O-CD2 3.38Å; L961-F965 PolarHBondContact O-N 3.11Å; L961-I1054 HydrophobicContact CD2-CD1 3.95Å; L961-L1059 HydrophobicContact CD2-CD1 3.84Å; L961-I1062 HydrophobicContact CD2-CD1 4.19Å; L961-I1062 HydrophobicContact CD2-CG2 3.99Å; L961-I1062 HydrophobicContact CG-CG2 4.14Å; L961-F1069 HydrophobicContact CD1-CE1 3.95Å
962	A	92.1	Very high	88.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.7	-38.3	-176.6	0	0	0	0	0	113.6	Y937 N941 L945 L958 K959 N964	Y937-A962 WeakPolarHBondContact CB-O 3.44Å; Y937-A962 WeakPolarHBondContact CD1-O 3.37Å; N941-A962 PolarHBondContact ND2-O 3.38Å; L945-A962 HydrophobicContact CD1-CB 3.69Å; L958-A962 WeakPolarHBondContact O-CB 3.3Å; L958-A962 PolarHBondContact O-N 2.98Å; K959-A962 PolarHBondContact O-N 2.97Å; A962-N964 VanDerWaalsContact C-N 3.28Å; A962-N964 PolarHBondContact O-N 3.37Å
963	I	88.8	Confident	89.1	Confident	72 Å²	72	47.6 Å²	47.6	37%	0.369	26%	0.255	S	S	.	.	H	α-helix	trans	-68.8	-28.7	179	-68	164.3	0	0	0	111.7	Y937 K959 L961	Y937-I963 HydrophobicContact CD2-CB 4.36Å; Y937-I963 HydrophobicContact CD2-CG1 3.88Å; Y937-I963 HydrophobicContact CE2-CG2 4.49Å; Y937-I963 HydrophobicContact CG-CG1 4.37Å; K959-I963 WeakPolarHBondContact O-CG1 3.31Å; K959-I963 PolarHBondContact O-N 3.32Å; L961-I963 VanDerWaalsContact C-N 3.3Å; L961-I963 PolarHBondContact O-N 3.42Å
964	N	90.3	Very high	89.2	Confident	53 Å²	53	48 Å²	48	28%	0.283	26%	0.255	S	S	.	.	H	α-helix	trans	-96.8	-13.6	-177.6	-69.8	-70.8	0	0	0	113.8	S960 L961 A962 K966 I1054 T1058 I1062	S960-N964 PolarHBondContact O-ND2 2.93Å; L961-N964 PolarHBondContact O-N 3.48Å; A962-N964 VanDerWaalsContact C-N 3.28Å; A962-N964 PolarHBondContact O-N 3.37Å; N964-K966 PolarHBondContact O-N 2.92Å; N964-I1054 HydrophobicContact CB-CD1 4.13Å; N964-I1054 HydrophobicContact CB-CG1 4.4Å; N964-T1058 HydrophobicContact CB-CG2 3.96Å; N964-T1058 WeakPolarHBondContact OD1-CG2 3.44Å; N964-I1062 HydrophobicContact CB-CD1 4.26Å
965	F	91.1	Very high	89.3	Confident	5 Å²	5	47.2 Å²	47.2	2%	0.022	25%	0.246	C	C	.	.			trans	-67.9	123.3	168.4	-89.8	-62.7	0	0	0	111.4	N941 V944 L945 F950 L961 F988 H1052 Y1053 I1054	N941-F965 HydrophobicContact CB-CB 4.43Å; N941-F965 WeakPolarHBondContact ND2-CB 3.49Å; V944-F965 HydrophobicContact CG1-CE1 4.18Å; V944-F965 HydrophobicContact CG1-CE2 4.39Å; V944-F965 HydrophobicContact CG1-CZ 3.89Å; L945-F965 HydrophobicContact CD2-CD2 4.25Å; L945-F965 HydrophobicContact CD2-CE2 3.82Å; F950-F965 HydrophobicContact CZ-CE2 4.37Å; F950-F965 HydrophobicContact CZ-CZ 4.06Å; L961-F965 HydrophobicContact CB-CD2 4.27Å; L961-F965 HydrophobicContact CB-CE2 4.09Å; L961-F965 VanDerWaalsContact O-CD2 3.29Å; L961-F965 WeakPolarHBondContact O-CD2 3.38Å; L961-F965 PolarHBondContact O-N 3.11Å; F965-F988 AromaticContact CE1-CD2 3.67Å; F965-F988 HydrophobicContact CE1-CD2 3.67Å; F965-F988 AromaticContact CE1-CE2 3.57Å; F965-F988 HydrophobicContact CE1-CE2 3.57Å; F965-F988 HydrophobicContact CE1-CZ 4.4Å; F965-F988 HydrophobicContact CZ-CD2 4.21Å; F965-F988 AromaticContact CZ-CE2 3.79Å; F965-F988 HydrophobicContact CZ-CE2 3.79Å; F965-F988 HydrophobicContact CZ-CZ 4.18Å; F965-H1052 HydrophobicContact CD1-CB 4.32Å; F965-Y1053 WeakPolarHBondContact CA-O 3.3Å; F965-I1054 HydrophobicContact CD1-CB 4.02Å; F965-I1054 HydrophobicContact CE1-CB 3.95Å; F965-I1054 HydrophobicContact CE1-CG2 4.01Å; F965-I1054 HydrophobicContact CZ-CG2 4.41Å
966	K	90.1	Very high	89.4	Confident	90 Å²	90	42.5 Å²	42.5	39%	0.391	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	138.9	178.7	-65.5	162.7	-170	167.2	0	109.6	N964 H1052 Y1053 D1055	N964-K966 PolarHBondContact O-N 2.92Å; K966-H1052 CarbonylContact O-C 3.59Å; K966-H1052 WeakPolarHBondContact O-CA 3.29Å; K966-Y1053 HydrophobicContact CB-CD1 4.03Å; K966-Y1053 HydrophobicContact CB-CD2 4.44Å; K966-Y1053 HydrophobicContact CB-CE1 3.6Å; K966-Y1053 HydrophobicContact CB-CE2 4.05Å; K966-Y1053 HydrophobicContact CB-CG 4.45Å; K966-Y1053 HydrophobicContact CD-CE1 4.39Å; K966-Y1053 HydrophobicContact CD-CE2 3.61Å; K966-Y1053 WeakPolarHBondContact CD-OH 3.49Å; K966-Y1053 HydrophobicContact CG-CE2 4.42Å; K966-Y1053 PolarHBondContact N-O 2.9Å; K966-Y1053 PolarHBondContact O-N 3.09Å; K966-D1055 IonicContact NZ-OD2 3.3Å; K966-D1055 PolarHBondContact NZ-OD2 2.35Å
967	L	87.4	Confident	89.7	Confident	112 Å²	112	37.9 Å²	37.9	59%	0.586	21%	0.206	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	146.7	174.9	-175	67.2	0	0	0	110.3	L1051 H1052	L967-L1051 CarbonylContact C-O 3.58Å; L967-H1052 WeakPolarHBondContact CD1-NE2 3.47Å
968	T	87.2	Confident	89.7	Confident	48 Å²	48	41.8 Å²	41.8	29%	0.294	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	151.2	174.1	-71	0	0	0	0	109.1	L1051 Y1053	T968-L1051 PolarHBondContact N-O 3.46Å; T968-L1051 PolarHBondContact O-N 3.04Å; T968-L1051 VanDerWaalsContact O-O 3.09Å; T968-Y1053 VanDerWaalsContact OG1-CE1 3.31Å; T968-Y1053 WeakPolarHBondContact OG1-CE1 3.41Å
969	F	87	Confident	89.5	Confident	37 Å²	37	44.1 Å²	44.1	16%	0.162	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	136	-175.9	176.3	-104.6	0	0	0	109.1	I915 T971 Y1048 C1049	I915-F969 HydrophobicContact CD1-CD1 4.09Å; I915-F969 HydrophobicContact CD1-CD2 3.97Å; I915-F969 HydrophobicContact CD1-CE1 3.56Å; I915-F969 HydrophobicContact CD1-CE2 3.43Å; I915-F969 VanDerWaalsContact CD1-CE2 3.43Å; I915-F969 HydrophobicContact CD1-CG 4.26Å; I915-F969 HydrophobicContact CD1-CZ 3.18Å; F969-T971 HydrophobicContact CD1-CG2 4.38Å; F969-T971 HydrophobicContact CE1-CG2 3.71Å; F969-T971 HydrophobicContact CZ-CG2 4.46Å; F969-Y1048 HydrophobicContact CE1-CD1 4.11Å; F969-Y1048 HydrophobicContact CE2-CD1 4.15Å; F969-Y1048 HydrophobicContact CE2-CG 4.46Å; F969-Y1048 AromaticContact CZ-CD1 3.38Å; F969-Y1048 HydrophobicContact CZ-CD1 3.38Å; F969-Y1048 HydrophobicContact CZ-CE1 4.19Å; F969-Y1048 HydrophobicContact CZ-CG 4.07Å; F969-C1049 WeakPolarHBondContact CA-O 3.22Å
970	C	88.2	Confident	89.2	Confident	8 Å²	8	44.1 Å²	44.1	5%	0.054	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	139.9	175.8	-59.2	0	0	0	0	109.9	Y1048 C1049	C970-Y1048 WeakPolarHBondContact O-CA 3.45Å; C970-C1049 HydrophobicContact CB-CB 4.39Å; C970-C1049 PolarHBondContact N-O 3.02Å; C970-C1049 VanDerWaalsContact N-O 3.13Å; C970-C1049 PolarHBondContact O-N 2.88Å
971	T	88.5	Confident	89.1	Confident	16 Å²	16	45.9 Å²	45.9	10%	0.098	26%	0.257	C	S	.	.			trans	-93.1	153.9	173.1	65.8	0	0	0	0	111.2	F969 G973 E974 S1045 Y1048	F969-T971 HydrophobicContact CD1-CG2 4.38Å; F969-T971 HydrophobicContact CE1-CG2 3.71Å; F969-T971 HydrophobicContact CZ-CG2 4.46Å; T971-G973 PolarHBondContact O-N 3.1Å; T971-E974 WeakPolarHBondContact CB-OE2 3.34Å; T971-E974 PolarHBondContact N-OE2 3.11Å; T971-E974 VanDerWaalsContact O-CB 3.3Å; T971-E974 WeakPolarHBondContact O-CB 3.5Å; T971-E974 VanDerWaalsContact O-CG 3.3Å; T971-E974 WeakPolarHBondContact O-CG 3.48Å; T971-E974 PolarHBondContact O-N 3.37Å; T971-E974 VanDerWaalsContact O-N 3.1Å; T971-E974 WeakPolarHBondContact OG1-CG 3.43Å; T971-E974 PolarHBondContact OG1-OE2 3.08Å; T971-S1045 PolarHBondContact O-OG 2.89Å; T971-Y1048 HydrophobicContact CG2-CD1 4.16Å; T971-Y1048 HydrophobicContact CG2-CE1 3.93Å
972	P	90	Very high	88.8	Confident	65 Å²	65	49.6 Å²	49.6	42%	0.422	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	133.1	-175.1	-23.8	29.3	0	0	0	113.6	E974 Y1048	P972-E974 VanDerWaalsContact C-N 3.35Å; P972-Y1048 VanDerWaalsContact CD-CD1 3.49Å; P972-Y1048 VanDerWaalsContact CD-CE1 3.42Å; P972-Y1048 HydrophobicContact CG-CD1 4.34Å; P972-Y1048 HydrophobicContact CG-CD2 4.26Å; P972-Y1048 HydrophobicContact CG-CE1 4.29Å; P972-Y1048 HydrophobicContact CG-CE2 4.18Å; P972-Y1048 HydrophobicContact CG-CG 4.34Å
973	G	87.6	Confident	88.3	Confident	40 Å²	40	50.1 Å²	50.1	41%	0.412	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	-4	-178	0	0	0	0	0	114.5	T971 S1045	T971-G973 PolarHBondContact O-N 3.1Å; G973-S1045 WeakPolarHBondContact CA-O 3.39Å; G973-S1045 PolarHBondContact N-O 3.1Å
974	E	88.9	Confident	88	Confident	20 Å²	20	54.7 Å²	54.7	9%	0.093	29%	0.292	C	S	.	.			trans	-79.7	128.7	177.8	-66	-164.6	98.9	0	0	112.4	R904 T971 P972 S1045	R904-E974 IonicContact CZ-OE1 3.22Å; R904-E974 IonicContact NE-OE1 2.8Å; R904-E974 PolarHBondContact NE-OE1 3.45Å; R904-E974 IonicContact NH2-OE1 2.73Å; R904-E974 PolarHBondContact NH2-OE1 2.84Å; T971-E974 WeakPolarHBondContact CB-OE2 3.34Å; T971-E974 PolarHBondContact N-OE2 3.11Å; T971-E974 VanDerWaalsContact O-CB 3.3Å; T971-E974 WeakPolarHBondContact O-CB 3.5Å; T971-E974 VanDerWaalsContact O-CG 3.3Å; T971-E974 WeakPolarHBondContact O-CG 3.48Å; T971-E974 PolarHBondContact O-N 3.37Å; T971-E974 VanDerWaalsContact O-N 3.1Å; T971-E974 WeakPolarHBondContact OG1-CG 3.43Å; T971-E974 PolarHBondContact OG1-OE2 3.08Å; P972-E974 VanDerWaalsContact C-N 3.35Å; E974-S1045 PolarHBondContact N-OG 3.4Å; E974-S1045 PolarHBondContact O-N 2.98Å; E974-S1045 PolarHBondContact O-OG 2.85Å
975	Y	90.5	Very high	87.9	Confident	73 Å²	73	56.3 Å²	56.3	29%	0.286	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	134.8	164.2	-62.8	-97.9	0	0	0	110.2	H978 L997 D1042 V1043 K1044	Y975-H978 WeakPolarHBondContact CB-CE1 3.37Å; Y975-H978 AromaticContact CD1-CE1 3.58Å; Y975-H978 AromaticContact CD1-ND1 3.8Å; Y975-H978 AromaticContact CD2-CE1 3.9Å; Y975-H978 AromaticContact CG-CE1 3.34Å; Y975-L997 HydrophobicContact CE1-CD1 4.13Å; Y975-D1042 HydrophobicContact CD1-CB 4.15Å; Y975-D1042 WeakPolarHBondContact CD1-OD2 3.43Å; Y975-D1042 HydrophobicContact CE1-CB 4.14Å; Y975-D1042 WeakPolarHBondContact CE1-OD2 3.28Å; Y975-V1043 CarbonylContact C-O 3.47Å; Y975-V1043 WeakPolarHBondContact CA-O 3.45Å; Y975-K1044 HydrophobicContact CD1-CB 3.9Å; Y975-K1044 HydrophobicContact CD1-CD 4.1Å; Y975-K1044 HydrophobicContact CD2-CD 3.95Å; Y975-K1044 HydrophobicContact CE1-CB 4.06Å; Y975-K1044 HydrophobicContact CE1-CD 3.68Å; Y975-K1044 HydrophobicContact CE1-CG 4.49Å; Y975-K1044 HydrophobicContact CE2-CD 3.5Å; Y975-K1044 VanDerWaalsContact CE2-CD 3.5Å; Y975-K1044 HydrophobicContact CG-CB 4.3Å; Y975-K1044 HydrophobicContact CG-CD 4.23Å
976	L	90.7	Very high	87.8	Confident	38 Å²	38	56.4 Å²	56.4	20%	0.199	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-33.2	176.5	177.4	74.6	0	0	0	111.8	Y987 F1012 V1043 L1051	L976-Y987 HydrophobicContact CD1-CE1 4.22Å; L976-Y987 HydrophobicContact CD2-CD1 4.13Å; L976-Y987 HydrophobicContact CD2-CD2 4.48Å; L976-Y987 HydrophobicContact CD2-CE1 4.14Å; L976-Y987 HydrophobicContact CD2-CE2 4.45Å; L976-Y987 HydrophobicContact CD2-CG 4.32Å; L976-Y987 HydrophobicContact CG-CE1 4.47Å; L976-F1012 HydrophobicContact CD2-CE2 3.88Å; L976-F1012 HydrophobicContact CD2-CZ 3.57Å; L976-V1043 PolarHBondContact N-O 3.3Å; L976-L1051 HydrophobicContact CD1-CD1 3.99Å; L976-L1051 HydrophobicContact CD2-CD1 3.52Å; L976-L1051 HydrophobicContact CG-CD1 4.34Å
977	I	90.8	Very high	87.9	Confident	6 Å²	6	53 Å²	53	3%	0.031	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	135.1	-179.1	-55	177.7	0	0	0	105.9	D981 L983 Y987 F1012 D1042 V1043 I1085	I977-D981 HydrophobicContact CG2-CB 4.07Å; I977-L983 HydrophobicContact CD1-CD2 3.98Å; I977-L983 HydrophobicContact CG2-CD2 4.04Å; I977-Y987 HydrophobicContact CD1-CD2 4.15Å; I977-Y987 HydrophobicContact CD1-CE2 3.86Å; I977-Y987 HydrophobicContact CG1-CE2 4.37Å; I977-F1012 HydrophobicContact CD1-CD2 4.41Å; I977-F1012 HydrophobicContact CD1-CE2 3.97Å; I977-D1042 CarbonylContact O-C 3.54Å; I977-D1042 WeakPolarHBondContact O-CA 3.39Å; I977-V1043 HydrophobicContact CB-CB 4.14Å; I977-V1043 HydrophobicContact CB-CG2 4.15Å; I977-V1043 HydrophobicContact CD1-CG2 4.21Å; I977-V1043 HydrophobicContact CG1-CB 4.47Å; I977-V1043 PolarHBondContact O-N 3.03Å; I977-I1085 HydrophobicContact CD1-CD1 3.79Å
978	H	90.8	Very high	88.1	Confident	84 Å²	84	48 Å²	48	39%	0.389	25%	0.253	S	S	.	.			trans	-105.1	160.6	167.7	-71.3	-67.8	0	0	0	110.9	Y975 G980 D981 S1039 D1042	Y975-H978 WeakPolarHBondContact CB-CE1 3.37Å; Y975-H978 AromaticContact CD1-CE1 3.58Å; Y975-H978 AromaticContact CD1-ND1 3.8Å; Y975-H978 AromaticContact CD2-CE1 3.9Å; Y975-H978 AromaticContact CG-CE1 3.34Å; H978-G980 PolarHBondContact O-N 3.21Å; H978-D981 PolarHBondContact N-OD2 2.87Å; H978-D981 VanDerWaalsContact O-CB 3.3Å; H978-D981 WeakPolarHBondContact O-CB 3.5Å; H978-D981 PolarHBondContact O-N 2.89Å; H978-S1039 PolarHBondContact O-OG 2.98Å; H978-D1042 WeakPolarHBondContact CA-OD1 3.28Å; H978-D1042 IonicContact CE1-OD2 3.61Å; H978-D1042 IonicContact CG-OD2 2.66Å; H978-D1042 IonicContact ND1-OD1 3.11Å; H978-D1042 IonicContact ND1-OD2 2.71Å; H978-D1042 PolarHBondContact ND1-OD2 3.21Å
979	T	87.9	Confident	88.3	Confident	81 Å²	81	45.8 Å²	45.8	50%	0.497	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	132.1	169	41.8	0	0	0	0	111.6	D981 R1040 D1042	T979-D981 VanDerWaalsContact C-N 3.33Å; T979-D981 PolarHBondContact O-N 3.37Å; T979-R1040 VanDerWaalsContact CG2-O 3.3Å; T979-R1040 WeakPolarHBondContact CG2-O 3.38Å; T979-D1042 WeakPolarHBondContact CG2-OD1 3.41Å; T979-D1042 PolarHBondContact N-OD1 3.12Å; T979-D1042 PolarHBondContact OG1-OD1 3.19Å; T979-D1042 VanDerWaalsContact OG1-OD1 3.12Å
980	G	84.4	Confident	88.3	Confident	40 Å²	40	44.2 Å²	44.2	41%	0.412	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	-11.4	-177.9	0	0	0	0	0	116.4	H978 S1039	H978-G980 PolarHBondContact O-N 3.21Å; G980-S1039 PolarHBondContact N-O 3.41Å; G980-S1039 PolarHBondContact N-OG 3.02Å
981	D	87.2	Confident	88.5	Confident	74 Å²	74	46.8 Å²	46.8	40%	0.396	25%	0.247	S	C	.	.			trans	-56.9	145	175.1	-89	-27.8	0	0	0	112.7	I977 H978 T979 L983 R1038 S1039	I977-D981 HydrophobicContact CG2-CB 4.07Å; H978-D981 PolarHBondContact N-OD2 2.87Å; H978-D981 VanDerWaalsContact O-CB 3.3Å; H978-D981 WeakPolarHBondContact O-CB 3.5Å; H978-D981 PolarHBondContact O-N 2.89Å; T979-D981 VanDerWaalsContact C-N 3.33Å; T979-D981 PolarHBondContact O-N 3.37Å; D981-L983 PolarHBondContact O-N 3.31Å; D981-R1038 CarbonylContact O-C 3.53Å; D981-R1038 VanDerWaalsContact O-CA 3.28Å; D981-R1038 WeakPolarHBondContact O-CA 3.45Å; D981-S1039 PolarHBondContact N-OG 3.48Å; D981-S1039 PolarHBondContact O-N 2.93Å; D981-S1039 PolarHBondContact O-OG 3.08Å
982	I	84.7	Confident	88.6	Confident	79 Å²	79	47.3 Å²	47.3	41%	0.405	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-79.1	109.1	179.5	-55.3	175.2	0	0	0	110.2	R984 I1036 I1037	I982-R984 HydrophobicContact CG2-CG 3.96Å; I982-R984 PolarHBondContact O-N 2.93Å; I982-I1036 HydrophobicContact CD1-CG2 3.97Å; I982-I1036 HydrophobicContact CG1-CG2 3.94Å; I982-I1036 HydrophobicContact CG2-CG2 3.84Å; I982-I1037 CarbonylContact C-O 3.55Å; I982-I1037 WeakPolarHBondContact CA-O 3.29Å
983	L	82.5	Confident	88.8	Confident	12 Å²	12	46 Å²	46	6%	0.063	25%	0.248	C	C	.	.			trans	-73.3	96.3	-178.9	-66.5	179.6	0	0	0	111.3	I977 D981 A1014 I1037 I1085	I977-L983 HydrophobicContact CD1-CD2 3.98Å; I977-L983 HydrophobicContact CG2-CD2 4.04Å; D981-L983 PolarHBondContact O-N 3.31Å; L983-A1014 HydrophobicContact CB-CB 4.45Å; L983-A1014 HydrophobicContact CD1-CB 3.87Å; L983-I1037 HydrophobicContact CB-CB 4.39Å; L983-I1037 HydrophobicContact CB-CG2 4.21Å; L983-I1037 HydrophobicContact CD1-CG2 4.13Å; L983-I1037 PolarHBondContact N-O 3.15Å; L983-I1085 HydrophobicContact CD1-CB 3.81Å; L983-I1085 HydrophobicContact CD1-CD1 4.07Å; L983-I1085 HydrophobicContact CD1-CG1 4.49Å; L983-I1085 HydrophobicContact CD1-CG2 4.2Å; L983-I1085 HydrophobicContact CD2-CD1 3.95Å
984	R	82.2	Confident	89.1	Confident	168 Å²	168	44.2 Å²	44.2	63%	0.634	23%	0.228	S	C	*	.			trans	-104.7	1.3	176.8	-61.1	-172	179	-169.9	-1	114.3	I982 D1055 L1056	I982-R984 HydrophobicContact CG2-CG 3.96Å; I982-R984 PolarHBondContact O-N 2.93Å; R984-D1055 CarbonylContact O-C 3.58Å; R984-D1055 WeakPolarHBondContact O-CA 3.31Å; R984-L1056 PolarHBondContact O-N 3.25Å
985	R	88.7	Confident	89.4	Confident	87 Å²	87	44.4 Å²	44.4	33%	0.328	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	146.6	-168.7	-71.7	169.7	-179.1	165.9	2.2	111.9	Y987 Y1053 I1054 D1055	R985-Y987 HydrophobicContact CB-CD2 4.27Å; R985-Y987 HydrophobicContact CB-CE2 3.74Å; R985-Y987 WeakPolarHBondContact CD-OH 3.42Å; R985-Y1053 HydrophobicContact CB-CD2 4.37Å; R985-Y1053 VanDerWaalsContact CD-CD2 3.42Å; R985-Y1053 HydrophobicContact CG-CD2 3.74Å; R985-Y1053 HydrophobicContact CG-CE2 4.16Å; R985-I1054 WeakPolarHBondContact CA-O 3.28Å; R985-D1055 VanDerWaalsContact CG-OD1 3.27Å; R985-D1055 WeakPolarHBondContact CG-OD1 3.36Å; R985-D1055 IonicContact CZ-OD1 3.56Å; R985-D1055 IonicContact NE-OD1 3.17Å; R985-D1055 PolarHBondContact NE-OD1 3.36Å; R985-D1055 IonicContact NH2-OD1 3.37Å
986	L	88.4	Confident	89.4	Confident	7 Å²	7	40.9 Å²	40.9	4%	0.037	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	126.7	165	-177	66.1	0	0	0	108	F988 W1011 Y1053 I1054 L1056 L1059	L986-F988 HydrophobicContact CB-CE2 4.48Å; L986-F988 HydrophobicContact CD2-CE2 3.81Å; L986-F988 HydrophobicContact CD2-CZ 3.73Å; L986-F988 HydrophobicContact CG-CE2 3.79Å; L986-F988 HydrophobicContact CG-CZ 4.11Å; L986-W1011 HydrophobicContact CD1-CE3 4.42Å; L986-W1011 HydrophobicContact CD2-CE3 4.04Å; L986-W1011 HydrophobicContact CD2-CZ3 4.15Å; L986-W1011 HydrophobicContact CG-CE3 4.5Å; L986-Y1053 VanDerWaalsContact O-CA 3.29Å; L986-Y1053 WeakPolarHBondContact O-CA 3.17Å; L986-I1054 HydrophobicContact CB-CG2 4.22Å; L986-I1054 PolarHBondContact N-O 3.34Å; L986-I1054 PolarHBondContact O-N 2.89Å; L986-I1054 VanDerWaalsContact O-N 3.1Å; L986-L1056 HydrophobicContact CB-CD2 4.04Å; L986-L1059 HydrophobicContact CD2-CD2 4Å
987	Y	91.6	Very high	89.5	Confident	19 Å²	19	39.6 Å²	39.6	8%	0.075	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	144.9	-176.1	-68.2	-84.3	0	0	0	111.6	L976 I977 R985 W1011 F1012 H1052 Y1053	L976-Y987 HydrophobicContact CD1-CE1 4.22Å; L976-Y987 HydrophobicContact CD2-CD1 4.13Å; L976-Y987 HydrophobicContact CD2-CD2 4.48Å; L976-Y987 HydrophobicContact CD2-CE1 4.14Å; L976-Y987 HydrophobicContact CD2-CE2 4.45Å; L976-Y987 HydrophobicContact CD2-CG 4.32Å; L976-Y987 HydrophobicContact CG-CE1 4.47Å; I977-Y987 HydrophobicContact CD1-CD2 4.15Å; I977-Y987 HydrophobicContact CD1-CE2 3.86Å; I977-Y987 HydrophobicContact CG1-CE2 4.37Å; R985-Y987 HydrophobicContact CB-CD2 4.27Å; R985-Y987 HydrophobicContact CB-CE2 3.74Å; R985-Y987 WeakPolarHBondContact CD-OH 3.42Å; Y987-W1011 CarbonylContact O-C 3.51Å; Y987-W1011 VanDerWaalsContact O-CA 3.23Å; Y987-W1011 WeakPolarHBondContact O-CA 3.25Å; Y987-W1011 WeakPolarHBondContact O-CB 3.39Å; Y987-F1012 VanDerWaalsContact CB-CE1 3.41Å; Y987-F1012 VanDerWaalsContact CB-CZ 3.41Å; Y987-F1012 AromaticContact CD2-CE2 4Å; Y987-F1012 HydrophobicContact CD2-CE2 4Å; Y987-F1012 HydrophobicContact CD2-CZ 4.23Å; Y987-F1012 HydrophobicContact CG-CE1 4.38Å; Y987-F1012 HydrophobicContact CG-CE2 4.14Å; Y987-F1012 AromaticContact CG-CZ 3.9Å; Y987-F1012 HydrophobicContact CG-CZ 3.9Å; Y987-F1012 PolarHBondContact N-O 2.4Å; Y987-F1012 PolarHBondContact O-N 3.06Å; Y987-H1052 CarbonylContact C-O 3.47Å; Y987-H1052 WeakPolarHBondContact CA-O 3.4Å; Y987-Y1053 VanDerWaalsContact CD1-CB 3.5Å; Y987-Y1053 HydrophobicContact CD1-CG 4.4Å; Y987-Y1053 HydrophobicContact CE1-CD1 4.26Å; Y987-Y1053 HydrophobicContact CE1-CG 4.09Å
988	F	91.4	Very high	89.3	Confident	5 Å²	5	41.8 Å²	41.8	2%	0.022	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	125.2	178.8	-62.6	-101.8	0	0	0	109.3	V944 L947 F950 F965 L986 S990 W1011 H1052 I1054	V944-F988 HydrophobicContact CG1-CB 4.01Å; V944-F988 HydrophobicContact CG1-CD1 3.64Å; V944-F988 HydrophobicContact CG1-CD2 4.21Å; V944-F988 HydrophobicContact CG1-CE1 4.09Å; V944-F988 HydrophobicContact CG1-CG 3.7Å; V944-F988 HydrophobicContact CG2-CB 3.93Å; L947-F988 HydrophobicContact CD1-CD1 4.03Å; L947-F988 HydrophobicContact CD1-CE1 4.49Å; F950-F988 AromaticContact CE2-CE1 3.93Å; F950-F988 HydrophobicContact CE2-CE1 3.93Å; F950-F988 HydrophobicContact CE2-CZ 4.29Å; F950-F988 HydrophobicContact CZ-CE1 4.04Å; F950-F988 AromaticContact CZ-CZ 3.93Å; F950-F988 HydrophobicContact CZ-CZ 3.93Å; F965-F988 AromaticContact CE1-CD2 3.67Å; F965-F988 HydrophobicContact CE1-CD2 3.67Å; F965-F988 AromaticContact CE1-CE2 3.57Å; F965-F988 HydrophobicContact CE1-CE2 3.57Å; F965-F988 HydrophobicContact CE1-CZ 4.4Å; F965-F988 HydrophobicContact CZ-CD2 4.21Å; F965-F988 AromaticContact CZ-CE2 3.79Å; F965-F988 HydrophobicContact CZ-CE2 3.79Å; F965-F988 HydrophobicContact CZ-CZ 4.18Å; L986-F988 HydrophobicContact CB-CE2 4.48Å; L986-F988 HydrophobicContact CD2-CE2 3.81Å; L986-F988 HydrophobicContact CD2-CZ 3.73Å; L986-F988 HydrophobicContact CG-CE2 3.79Å; L986-F988 HydrophobicContact CG-CZ 4.11Å; F988-S990 PolarHBondContact O-N 3.5Å; F988-W1011 HydrophobicContact CD1-CB 3.64Å; F988-W1011 HydrophobicContact CD1-CD2 4.49Å; F988-W1011 HydrophobicContact CD1-CE3 4.22Å; F988-W1011 HydrophobicContact CD1-CG 4.34Å; F988-W1011 HydrophobicContact CE1-CB 3.95Å; F988-W1011 AromaticContact CE1-CD2 3.94Å; F988-W1011 HydrophobicContact CE1-CD2 3.94Å; F988-W1011 AromaticContact CE1-CE3 3.31Å; F988-W1011 HydrophobicContact CE1-CE3 3.31Å; F988-W1011 HydrophobicContact CE1-CG 4.25Å; F988-W1011 HydrophobicContact CE1-CZ3 4.02Å; F988-W1011 HydrophobicContact CG-CB 4.18Å; F988-W1011 AromaticContact CZ-CE3 3.55Å; F988-W1011 HydrophobicContact CZ-CE3 3.55Å; F988-W1011 HydrophobicContact CZ-CZ3 4.07Å; F988-H1052 HydrophobicContact CB-CB 4.47Å; F988-H1052 PolarHBondContact N-O 2.98Å; F988-H1052 PolarHBondContact O-N 3.42Å; F988-I1054 HydrophobicContact CE2-CG2 4.47Å
989	V	92	Very high	89	Confident	2 Å²	2	44 Å²	44	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	102.5	-177.3	-174	0	0	0	0	109.4	L994 L1006 G1007 N1009 D1010 F1012 L1051	V989-L994 HydrophobicContact CB-CD1 4.45Å; V989-L994 HydrophobicContact CG1-CD1 3.87Å; V989-L994 HydrophobicContact CG2-CD1 3.67Å; V989-L1006 HydrophobicContact CG2-CB 4.39Å; V989-G1007 VanDerWaalsContact CB-O 3.24Å; V989-G1007 WeakPolarHBondContact CB-O 3.39Å; V989-G1007 VanDerWaalsContact CG1-O 3.24Å; V989-G1007 WeakPolarHBondContact CG1-O 3.46Å; V989-N1009 PolarHBondContact O-N 3.35Å; V989-D1010 PolarHBondContact N-O 3.43Å; V989-F1012 HydrophobicContact CG2-CD1 4.15Å; V989-F1012 HydrophobicContact CG2-CE1 3.72Å; V989-L1051 HydrophobicContact CB-CD2 4.23Å; V989-L1051 HydrophobicContact CG1-CD2 4.23Å; V989-L1051 HydrophobicContact CG2-CD2 3.9Å
990	S	88.2	Confident	88.8	Confident	5 Å²	5	46.7 Å²	46.7	4%	0.035	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-39.3	177.9	-75.8	0	0	0	0	112.5	V944 F988 K1008 D1050 H1052	V944-S990 WeakPolarHBondContact CG2-OG 3.29Å; F988-S990 PolarHBondContact O-N 3.5Å; S990-K1008 WeakPolarHBondContact O-CD 3.42Å; S990-K1008 WeakPolarHBondContact O-CE 3.46Å; S990-K1008 VanDerWaalsContact O-CG 3.27Å; S990-K1008 WeakPolarHBondContact O-CG 3.46Å; S990-K1008 PolarHBondContact O-NZ 3.31Å; S990-D1050 PolarHBondContact N-O 2.92Å; S990-H1052 PolarHBondContact OG-CD2 2.76Å; S990-H1052 PolarHBondContact OG-NE2 3.34Å
991	N	90.6	Very high	88.9	Confident	62 Å²	62	51.8 Å²	51.8	33%	0.332	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	159.5	169.9	-61.9	-59.6	0	0	0	110.2	K1008 C1049 D1050	N991-K1008 PolarHBondContact OD1-NZ 2.88Å; N991-C1049 CarbonylContact O-C 3.1Å; N991-C1049 VanDerWaalsContact O-CA 3.29Å; N991-C1049 WeakPolarHBondContact O-CA 3.5Å; N991-D1050 HydrophobicContact CB-CB 4.12Å; N991-D1050 WeakPolarHBondContact CB-OD2 3.35Å; N991-D1050 PolarHBondContact N-O 3.37Å; N991-D1050 PolarHBondContact ND2-OD2 2.95Å; N991-D1050 PolarHBondContact O-N 3.48Å
992	G	91.8	Very high	89	Confident	27 Å²	27	51.9 Å²	51.9	28%	0.278	27%	0.266	S	S	.	.	S	Bend	trans	95.3	-164.6	-179.5	0	0	0	0	0	113.1	T1047 Y1048	G992-T1047 WeakPolarHBondContact CA-OG1 3.35Å; G992-Y1048 WeakPolarHBondContact CA-O 3.35Å
993	S	93.8	Very high	89.1	Confident	38 Å²	38	51.6 Å²	51.6	27%	0.266	27%	0.268	S	S	.	.			trans	-149.7	142.5	176.2	55.5	0	0	0	0	111.8	L1006 L1046 T1047 C1049	S993-L1006 CarbonylContact C-O 3.59Å; S993-L1006 WeakPolarHBondContact CA-O 3.18Å; S993-L1046 WeakPolarHBondContact O-CB 3.15Å; S993-L1046 PolarHBondContact O-N 3.14Å; S993-T1047 PolarHBondContact N-OG1 2.79Å; S993-T1047 PolarHBondContact O-N 3.35Å; S993-C1049 PolarHBondContact N-SG 3.26Å; S993-C1049 PolarHBondContact O-SG 2.9Å; S993-C1049 VanDerWaalsContact O-SG 3.35Å
994	L	94.2	Very high	89.3	Confident	1 Å²	1	52 Å²	52	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	154.1	178	-57.4	92.7	0	0	0	110.4	V989 L1005 L1006 F1012 V1043 K1044 C1049 L1051	V989-L994 HydrophobicContact CB-CD1 4.45Å; V989-L994 HydrophobicContact CG1-CD1 3.87Å; V989-L994 HydrophobicContact CG2-CD1 3.67Å; L994-L1005 CarbonylContact O-C 3.58Å; L994-L1005 WeakPolarHBondContact O-CA 3.45Å; L994-L1006 HydrophobicContact CB-CB 4.34Å; L994-L1006 PolarHBondContact N-O 3.48Å; L994-L1006 PolarHBondContact O-N 2.95Å; L994-F1012 HydrophobicContact CD2-CZ 4.5Å; L994-V1043 HydrophobicContact CB-CG1 4.35Å; L994-V1043 HydrophobicContact CD2-CG1 3.94Å; L994-K1044 CarbonylContact C-O 3.47Å; L994-K1044 VanDerWaalsContact CA-O 3.22Å; L994-K1044 WeakPolarHBondContact CA-O 3.03Å; L994-K1044 VanDerWaalsContact CB-O 3.32Å; L994-K1044 WeakPolarHBondContact CB-O 3.28Å; L994-C1049 HydrophobicContact CD1-CB 4.36Å; L994-L1051 HydrophobicContact CD1-CD2 3.99Å; L994-L1051 HydrophobicContact CD2-CD1 4.34Å
995	E	94.2	Very high	89.8	Confident	24 Å²	24	49.7 Å²	49.7	11%	0.112	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	142.5	168	62.9	-168.9	167.8	0	0	109.9	L997 V1002 L1005 K1044 L1046	E995-L997 HydrophobicContact CG-CD1 4.27Å; E995-L997 HydrophobicContact CG-CG 4.26Å; E995-V1002 HydrophobicContact CB-CG1 4.26Å; E995-L1005 HydrophobicContact CB-CD2 3.82Å; E995-K1044 HydrophobicContact CG-CB 3.97Å; E995-K1044 HydrophobicContact CG-CG 4.25Å; E995-K1044 PolarHBondContact N-O 3.23Å; E995-K1044 PolarHBondContact O-N 3.26Å; E995-K1044 WeakPolarHBondContact OE1-CE 3.37Å; E995-K1044 IonicContact OE1-NZ 3.06Å; E995-K1044 PolarHBondContact OE1-NZ 3.36Å; E995-L1046 HydrophobicContact CB-CD1 4.22Å; E995-L1046 HydrophobicContact CB-CG 4.26Å; E995-L1046 HydrophobicContact CG-CD2 4.21Å; E995-L1046 HydrophobicContact CG-CG 4.23Å
996	V	92.3	Very high	90	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	126.3	173.1	-175.3	0	0	0	0	107.7	V1002 V1003 A1004 L1006 C1041 D1042 V1043 F1083	V996-V1002 CarbonylContact O-C 3.49Å; V996-V1002 WeakPolarHBondContact O-CA 3.48Å; V996-V1003 PolarHBondContact O-N 3.34Å; V996-A1004 HydrophobicContact CB-CB 4.08Å; V996-A1004 HydrophobicContact CG2-CB 4.12Å; V996-A1004 PolarHBondContact N-O 3.42Å; V996-A1004 PolarHBondContact O-N 3.46Å; V996-L1006 HydrophobicContact CG2-CD1 3.64Å; V996-L1006 HydrophobicContact CG2-CG 4.05Å; V996-C1041 HydrophobicContact CG1-CB 3.47Å; V996-C1041 VanDerWaalsContact CG1-CB 3.47Å; V996-D1042 CarbonylContact C-O 3.57Å; V996-D1042 WeakPolarHBondContact CA-O 3.49Å; V996-V1043 HydrophobicContact CG1-CG2 4.36Å; V996-V1043 HydrophobicContact CG2-CG2 4.31Å; V996-F1083 HydrophobicContact CG1-CD1 4.06Å; V996-F1083 HydrophobicContact CG1-CE1 3.65Å; V996-F1083 HydrophobicContact CG1-CZ 4.06Å; V996-F1083 HydrophobicContact CG2-CD1 4.46Å
997	L	91.1	Very high	90.1	Very high	10 Å²	10	46.4 Å²	46.4	5%	0.052	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.7	-168.7	-65.8	163	0	0	0	110.3	Y975 E995 E1001 V1002 C1041 D1042 K1044	Y975-L997 HydrophobicContact CE1-CD1 4.13Å; E995-L997 HydrophobicContact CG-CD1 4.27Å; E995-L997 HydrophobicContact CG-CG 4.26Å; L997-E1001 CarbonylContact C-O 3.54Å; L997-E1001 VanDerWaalsContact CA-O 3.32Å; L997-E1001 WeakPolarHBondContact CA-O 3.41Å; L997-V1002 HydrophobicContact CD2-CB 4.48Å; L997-V1002 HydrophobicContact CD2-CG2 3.67Å; L997-C1041 CarbonylContact O-C 3.54Å; L997-C1041 WeakPolarHBondContact O-CA 3.38Å; L997-C1041 WeakPolarHBondContact O-CB 3.34Å; L997-D1042 HydrophobicContact CB-CB 4.01Å; L997-D1042 PolarHBondContact N-O 2.95Å; L997-D1042 PolarHBondContact O-N 3.36Å; L997-K1044 HydrophobicContact CD1-CB 4.11Å; L997-K1044 HydrophobicContact CD1-CD 4.34Å
998	E	87.3	Confident	90	Very high	52 Å²	52	50 Å²	50	24%	0.243	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	120.4	168.2	-174	172.9	170.6	0	0	107.7	D1000 E1001 V1003 R1040	E998-D1000 VanDerWaalsContact C-N 3.25Å; E998-D1000 PolarHBondContact O-N 3.2Å; E998-E1001 PolarHBondContact N-O 3.14Å; E998-E1001 PolarHBondContact O-N 3.03Å; E998-V1003 HydrophobicContact CB-CG2 3.45Å; E998-V1003 VanDerWaalsContact CB-CG2 3.45Å; E998-R1040 VanDerWaalsContact CD-NE 3.3Å; E998-R1040 IonicContact OE1-CZ 3.79Å; E998-R1040 IonicContact OE1-NE 3.32Å; E998-R1040 PolarHBondContact OE1-NE 3.26Å; E998-R1040 IonicContact OE1-NH2 3.28Å; E998-R1040 PolarHBondContact OE1-NH2 2.79Å; E998-R1040 IonicContact OE2-NE 3.19Å; E998-R1040 PolarHBondContact OE2-NE 3.27Å
999	T	84.9	Confident	89.7	Confident	131 Å²	131	53.6 Å²	53.6	80%	0.804	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	46.5	-174.2	49.1	0	0	0	0	113.1	E1001	T999-E1001 PolarHBondContact O-N 3.01Å
1000	D	82.7	Confident	89.5	Confident	137 Å²	137	56 Å²	56	73%	0.733	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	0.8	-173.7	-69.8	-44.8	0	0	0	117.1	E998	E998-D1000 VanDerWaalsContact C-N 3.25Å; E998-D1000 PolarHBondContact O-N 3.2Å
1001	E	87.8	Confident	89.5	Confident	148 Å²	148	56.3 Å²	56.3	69%	0.692	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	135.9	169.8	-61.5	-155.8	149.2	0	0	111.8	L997 E998 T999 V1003	L997-E1001 CarbonylContact C-O 3.54Å; L997-E1001 VanDerWaalsContact CA-O 3.32Å; L997-E1001 WeakPolarHBondContact CA-O 3.41Å; E998-E1001 PolarHBondContact N-O 3.14Å; E998-E1001 PolarHBondContact O-N 3.03Å; T999-E1001 PolarHBondContact O-N 3.01Å; E1001-V1003 PolarHBondContact O-N 2.96Å; E1001-V1003 VanDerWaalsContact O-N 3.15Å
1002	V	88.7	Confident	89.4	Confident	76 Å²	76	53.3 Å²	53.3	46%	0.461	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	102.4	177.2	179.9	0	0	0	0	110.1	E995 V996 L997 L1005	E995-V1002 HydrophobicContact CB-CG1 4.26Å; V996-V1002 CarbonylContact O-C 3.49Å; V996-V1002 WeakPolarHBondContact O-CA 3.48Å; L997-V1002 HydrophobicContact CD2-CB 4.48Å; L997-V1002 HydrophobicContact CD2-CG2 3.67Å; V1002-L1005 HydrophobicContact CG1-CD2 3.87Å; V1002-L1005 HydrophobicContact CG1-CG 4.16Å
1003	V	86.8	Confident	88.9	Confident	73 Å²	73	52 Å²	52	44%	0.442	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-40.2	177.9	-173.8	0	0	0	0	111.4	V996 E998 E1001 F1083	V996-V1003 PolarHBondContact O-N 3.34Å; E998-V1003 HydrophobicContact CB-CG2 3.45Å; E998-V1003 VanDerWaalsContact CB-CG2 3.45Å; E1001-V1003 PolarHBondContact O-N 2.96Å; E1001-V1003 VanDerWaalsContact O-N 3.15Å; V1003-F1083 HydrophobicContact CB-CZ 4.48Å; V1003-F1083 HydrophobicContact CG1-CE2 3.78Å; V1003-F1083 HydrophobicContact CG1-CZ 3.92Å
1004	A	87.8	Confident	88	Confident	20 Å²	20	50.4 Å²	50.4	17%	0.165	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	156.2	-178.3	0	0	0	0	0	112.9	V996 F1083	V996-A1004 HydrophobicContact CB-CB 4.08Å; V996-A1004 HydrophobicContact CG2-CB 4.12Å; V996-A1004 PolarHBondContact N-O 3.42Å; V996-A1004 PolarHBondContact O-N 3.46Å; A1004-F1083 HydrophobicContact CB-CD2 3.64Å; A1004-F1083 HydrophobicContact CB-CE2 3.94Å; A1004-F1083 HydrophobicContact CB-CG 4.28Å
1005	L	91.7	Very high	86.6	Confident	119 Å²	119	52.5 Å²	52.5	62%	0.623	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	120.3	170	-67.8	175.6	0	0	0	108.4	L994 E995 V1002 L1046	L994-L1005 CarbonylContact O-C 3.58Å; L994-L1005 WeakPolarHBondContact O-CA 3.45Å; E995-L1005 HydrophobicContact CB-CD2 3.82Å; V1002-L1005 HydrophobicContact CG1-CD2 3.87Å; V1002-L1005 HydrophobicContact CG1-CG 4.16Å; L1005-L1046 HydrophobicContact CD2-CD1 3.85Å
1006	L	91.8	Very high	85	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	122.9	-178.8	-60.8	167.4	0	0	0	109	V989 S993 L994 V996 D1010 F1012 F1083	V989-L1006 HydrophobicContact CG2-CB 4.39Å; S993-L1006 CarbonylContact C-O 3.59Å; S993-L1006 WeakPolarHBondContact CA-O 3.18Å; L994-L1006 HydrophobicContact CB-CB 4.34Å; L994-L1006 PolarHBondContact N-O 3.48Å; L994-L1006 PolarHBondContact O-N 2.95Å; V996-L1006 HydrophobicContact CG2-CD1 3.64Å; V996-L1006 HydrophobicContact CG2-CG 4.05Å; L1006-D1010 HydrophobicContact CB-CB 4.3Å; L1006-D1010 HydrophobicContact CD2-CB 4.1Å; L1006-F1012 HydrophobicContact CD1-CB 3.94Å; L1006-F1012 HydrophobicContact CD1-CD1 3.65Å; L1006-F1012 HydrophobicContact CD1-CD2 4.07Å; L1006-F1012 HydrophobicContact CD1-CE1 4.12Å; L1006-F1012 HydrophobicContact CD1-CG 3.62Å; L1006-F1012 HydrophobicContact CD2-CB 4.43Å; L1006-F1083 HydrophobicContact CD2-CB 4.08Å
1007	G	91.1	Very high	83.3	Confident	23 Å²	23	58.9 Å²	58.9	24%	0.237	32%	0.315	C	S	.	.			trans	-110.6	-167.6	-179.5	0	0	0	0	0	113.6	V989 N1009 D1010	V989-G1007 VanDerWaalsContact CB-O 3.24Å; V989-G1007 WeakPolarHBondContact CB-O 3.39Å; V989-G1007 VanDerWaalsContact CG1-O 3.24Å; V989-G1007 WeakPolarHBondContact CG1-O 3.46Å; G1007-N1009 PolarHBondContact O-N 2.76Å; G1007-D1010 WeakPolarHBondContact CA-OD2 3.39Å; G1007-D1010 PolarHBondContact N-OD2 2.86Å; G1007-D1010 WeakPolarHBondContact O-CB 3.15Å; G1007-D1010 PolarHBondContact O-N 3.05Å
1008	K	89	Confident	81.4	Confident	93 Å²	93	60.7 Å²	60.7	40%	0.404	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	133.3	175	172.7	166.1	-173.1	91.7	0	110.7	E943 S990 N991 D1010	E943-K1008 IonicContact OE2-NZ 2.86Å; E943-K1008 PolarHBondContact OE2-NZ 2.87Å; S990-K1008 WeakPolarHBondContact O-CD 3.42Å; S990-K1008 WeakPolarHBondContact O-CE 3.46Å; S990-K1008 VanDerWaalsContact O-CG 3.27Å; S990-K1008 WeakPolarHBondContact O-CG 3.46Å; S990-K1008 PolarHBondContact O-NZ 3.31Å; N991-K1008 PolarHBondContact OD1-NZ 2.88Å; K1008-D1010 VanDerWaalsContact C-N 3.33Å
1009	N	84.9	Confident	79.4	Confident	82 Å²	82	63 Å²	63	44%	0.439	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	0.2	-176.6	-57.4	-8.1	0	0	0	115.6	L947 V989 G1007	L947-N1009 HydrophobicContact CD2-CB 3.67Å; V989-N1009 PolarHBondContact O-N 3.35Å; G1007-N1009 PolarHBondContact O-N 2.76Å
1010	D	88.9	Confident	77.2	Confident	51 Å²	51	64.8 Å²	64.8	27%	0.273	34%	0.341	S	S	.	.			trans	-76	157.7	173.2	-74.2	-53.3	0	0	0	112.8	V989 L1006 G1007 K1008 S1082	V989-D1010 PolarHBondContact N-O 3.43Å; L1006-D1010 HydrophobicContact CB-CB 4.3Å; L1006-D1010 HydrophobicContact CD2-CB 4.1Å; G1007-D1010 WeakPolarHBondContact CA-OD2 3.39Å; G1007-D1010 PolarHBondContact N-OD2 2.86Å; G1007-D1010 WeakPolarHBondContact O-CB 3.15Å; G1007-D1010 PolarHBondContact O-N 3.05Å; K1008-D1010 VanDerWaalsContact C-N 3.33Å; D1010-S1082 WeakPolarHBondContact CA-OG 3.04Å; D1010-S1082 WeakPolarHBondContact CB-OG 3.48Å; D1010-S1082 VanDerWaalsContact OD1-CB 3.25Å; D1010-S1082 WeakPolarHBondContact OD1-CB 3.3Å; D1010-S1082 PolarHBondContact OD1-OG 2.9Å
1011	W	87.2	Confident	75	Confident	12 Å²	12	63.2 Å²	63.2	5%	0.045	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	141.7	-178.6	63.8	-35.4	0	0	0	111.8	V949 L986 Y987 F988 L1073 L1077 D1080 L1081 S1082	V949-W1011 HydrophobicContact CG1-CH2 3.9Å; V949-W1011 HydrophobicContact CG1-CZ3 4.38Å; V949-W1011 HydrophobicContact CG2-CH2 4.04Å; V949-W1011 HydrophobicContact CG2-CZ2 3.92Å; L986-W1011 HydrophobicContact CD1-CE3 4.42Å; L986-W1011 HydrophobicContact CD2-CE3 4.04Å; L986-W1011 HydrophobicContact CD2-CZ3 4.15Å; L986-W1011 HydrophobicContact CG-CE3 4.5Å; Y987-W1011 CarbonylContact O-C 3.51Å; Y987-W1011 VanDerWaalsContact O-CA 3.23Å; Y987-W1011 WeakPolarHBondContact O-CA 3.25Å; Y987-W1011 WeakPolarHBondContact O-CB 3.39Å; F988-W1011 HydrophobicContact CD1-CB 3.64Å; F988-W1011 HydrophobicContact CD1-CD2 4.49Å; F988-W1011 HydrophobicContact CD1-CE3 4.22Å; F988-W1011 HydrophobicContact CD1-CG 4.34Å; F988-W1011 HydrophobicContact CE1-CB 3.95Å; F988-W1011 AromaticContact CE1-CD2 3.94Å; F988-W1011 HydrophobicContact CE1-CD2 3.94Å; F988-W1011 AromaticContact CE1-CE3 3.31Å; F988-W1011 HydrophobicContact CE1-CE3 3.31Å; F988-W1011 HydrophobicContact CE1-CG 4.25Å; F988-W1011 HydrophobicContact CE1-CZ3 4.02Å; F988-W1011 HydrophobicContact CG-CB 4.18Å; F988-W1011 AromaticContact CZ-CE3 3.55Å; F988-W1011 HydrophobicContact CZ-CE3 3.55Å; F988-W1011 HydrophobicContact CZ-CZ3 4.07Å; W1011-L1073 HydrophobicContact CH2-CD1 3.94Å; W1011-L1073 HydrophobicContact CZ3-CD1 4.07Å; W1011-L1077 HydrophobicContact CE3-CD2 4.1Å; W1011-L1077 HydrophobicContact CH2-CD2 3.38Å; W1011-L1077 HydrophobicContact CH2-CG 3.64Å; W1011-L1077 HydrophobicContact CZ2-CD2 3.97Å; W1011-L1077 HydrophobicContact CZ2-CG 4.41Å; W1011-L1077 HydrophobicContact CZ3-CD2 3.45Å; W1011-L1077 VanDerWaalsContact CZ3-CD2 3.45Å; W1011-L1077 HydrophobicContact CZ3-CG 4.02Å; W1011-D1080 PolarHBondContact NE1-O 3.31Å; W1011-L1081 HydrophobicContact CD2-CD1 4.23Å; W1011-L1081 HydrophobicContact CG-CD1 4.32Å; W1011-S1082 PolarHBondContact N-OG 3.01Å; W1011-S1082 VanDerWaalsContact O-CB 3.31Å; W1011-S1082 WeakPolarHBondContact O-CB 3.44Å; W1011-S1082 PolarHBondContact O-N 3.48Å
1012	F	88.6	Confident	72.4	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	151.4	-168	65.3	-75.4	0	0	0	111.7	L976 I977 Y987 V989 L994 L1006 V1043 F1083 I1085	L976-F1012 HydrophobicContact CD2-CE2 3.88Å; L976-F1012 HydrophobicContact CD2-CZ 3.57Å; I977-F1012 HydrophobicContact CD1-CD2 4.41Å; I977-F1012 HydrophobicContact CD1-CE2 3.97Å; Y987-F1012 VanDerWaalsContact CB-CE1 3.41Å; Y987-F1012 VanDerWaalsContact CB-CZ 3.41Å; Y987-F1012 AromaticContact CD2-CE2 4Å; Y987-F1012 HydrophobicContact CD2-CE2 4Å; Y987-F1012 HydrophobicContact CD2-CZ 4.23Å; Y987-F1012 HydrophobicContact CG-CE1 4.38Å; Y987-F1012 HydrophobicContact CG-CE2 4.14Å; Y987-F1012 AromaticContact CG-CZ 3.9Å; Y987-F1012 HydrophobicContact CG-CZ 3.9Å; Y987-F1012 PolarHBondContact N-O 2.4Å; Y987-F1012 PolarHBondContact O-N 3.06Å; V989-F1012 HydrophobicContact CG2-CD1 4.15Å; V989-F1012 HydrophobicContact CG2-CE1 3.72Å; L994-F1012 HydrophobicContact CD2-CZ 4.5Å; L1006-F1012 HydrophobicContact CD1-CB 3.94Å; L1006-F1012 HydrophobicContact CD1-CD1 3.65Å; L1006-F1012 HydrophobicContact CD1-CD2 4.07Å; L1006-F1012 HydrophobicContact CD1-CE1 4.12Å; L1006-F1012 HydrophobicContact CD1-CG 3.62Å; L1006-F1012 HydrophobicContact CD2-CB 4.43Å; F1012-V1043 HydrophobicContact CD2-CG1 4.43Å; F1012-V1043 HydrophobicContact CD2-CG2 4.43Å; F1012-V1043 HydrophobicContact CE2-CB 4.46Å; F1012-V1043 HydrophobicContact CE2-CG1 3.81Å; F1012-V1043 HydrophobicContact CE2-CG2 4.32Å; F1012-V1043 HydrophobicContact CZ-CG1 4.26Å; F1012-F1083 WeakPolarHBondContact CA-O 3.13Å; F1012-F1083 HydrophobicContact CB-CB 4.46Å; F1012-I1085 HydrophobicContact CD2-CD1 4.01Å
1013	G	82.7	Confident	69.6	Low	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.1	-147.8	-175.3	0	0	0	0	0	111.1	I1085	G1013-I1085 WeakPolarHBondContact O-CG1 3.34Å; G1013-I1085 PolarHBondContact O-N 3.03Å
1014	A	74.3	Confident	67	Low	3 Å²	3	67.7 Å²	67.7	3%	0.025	38%	0.375	C	S	.	.			trans	-134.1	150.8	168.6	0	0	0	0	0	110.2	L983 I1037 Q1086	L983-A1014 HydrophobicContact CB-CB 4.45Å; L983-A1014 HydrophobicContact CD1-CB 3.87Å; A1014-I1037 HydrophobicContact CB-CD1 3.91Å; A1014-I1037 HydrophobicContact CB-CG2 3.68Å; A1014-Q1086 HydrophobicContact CB-CB 4.4Å
1015	F	65.3	Low	64.2	Low	46 Å²	46	73.7 Å²	73.7	20%	0.202	41%	0.41	C	S	.	.			trans	-90.5	143.2	178.8	-176.2	-119.6	0	0	0	111.8	E1017 K1074 L1077 Y1078	F1015-E1017 HydrophobicContact CD1-CG 3.96Å; F1015-E1017 HydrophobicContact CE1-CG 4.05Å; F1015-K1074 HydrophobicContact CE1-CD 4.45Å; F1015-K1074 HydrophobicContact CE1-CG 4.24Å; F1015-K1074 HydrophobicContact CZ-CB 4.41Å; F1015-K1074 HydrophobicContact CZ-CD 4.2Å; F1015-K1074 HydrophobicContact CZ-CG 3.84Å; F1015-L1077 HydrophobicContact CD2-CB 4.37Å; F1015-L1077 HydrophobicContact CD2-CD1 3.66Å; F1015-L1077 HydrophobicContact CE2-CD1 3.74Å; F1015-Y1078 HydrophobicContact CD1-CE2 4.42Å; F1015-Y1078 HydrophobicContact CE1-CE2 4.02Å; F1015-Y1078 AromaticContact CE1-CZ 3.95Å; F1015-Y1078 WeakPolarHBondContact CE1-OH 3.38Å
1016	L	60	Low	61.5	Low	25 Å²	25	74.4 Å²	74.4	13%	0.131	42%	0.42	C	S	.	.			trans	-103	101.1	176.3	-160.8	77.8	0	0	0	109.4	T1018 F1034 P1035 I1037	L1016-T1018 HydrophobicContact CB-CG2 4.31Å; L1016-T1018 HydrophobicContact CD2-CG2 3.68Å; L1016-T1018 HydrophobicContact CG-CG2 3.94Å; L1016-T1018 PolarHBondContact O-N 2.74Å; L1016-F1034 HydrophobicContact CD2-CD1 3.9Å; L1016-F1034 HydrophobicContact CD2-CE1 3.93Å; L1016-P1035 HydrophobicContact CD1-CG 3.62Å; L1016-I1037 HydrophobicContact CD1-CD1 4.24Å
1017	E	57.3	Low	58.5	Low	133 Å²	133	80.1 Å²	80.1	62%	0.621	45%	0.45	S	S	*	.			trans	-66.5	99.8	173.7	-62.9	-153.5	138.8	0	0	110	F1015 D1019 Y1078	F1015-E1017 HydrophobicContact CD1-CG 3.96Å; F1015-E1017 HydrophobicContact CE1-CG 4.05Å; E1017-D1019 VanDerWaalsContact C-N 3.33Å; E1017-D1019 PolarHBondContact O-N 3.15Å; E1017-Y1078 PolarHBondContact OE1-OH 3.48Å
1018	T	50.4	Low	55.7	Low	48 Å²	48	86 Å²	86	29%	0.294	48%	0.477	S	S	.	.			trans	-97.9	32.5	-169.7	40.5	0	0	0	0	113.2	L1016 K1070	L1016-T1018 HydrophobicContact CB-CG2 4.31Å; L1016-T1018 HydrophobicContact CD2-CG2 3.68Å; L1016-T1018 HydrophobicContact CG-CG2 3.94Å; L1016-T1018 PolarHBondContact O-N 2.74Å; T1018-K1070 WeakPolarHBondContact OG1-CE 3.38Å; T1018-K1070 PolarHBondContact OG1-NZ 2.91Å
1019	D	45	Very low	53.2	Low	101 Å²	101	88.2 Å²	88.2	54%	0.54	50%	0.497	S	S	.	.			trans	-115.9	22.2	-172.9	-61.3	-44.2	0	0	0	113.4	E1017 P1021 K1074	E1017-D1019 VanDerWaalsContact C-N 3.33Å; E1017-D1019 PolarHBondContact O-N 3.15Å; D1019-P1021 WeakPolarHBondContact O-CD 3.49Å; D1019-K1074 IonicContact OD2-NZ 3.25Å; D1019-K1074 PolarHBondContact OD2-NZ 3.44Å
1020	M	39.9	Very low	50.7	Low	167 Å²	167	88.9 Å²	88.9	82%	0.823	51%	0.508	S	S	*	.			trans	-72.5	116.9	168.3	-79.7	-66	-71.7	0	0	110.8
1021	P	35.8	Very low	47.9	Very low	104 Å²	104	91.3 Å²	91.3	68%	0.675	53%	0.529	S	S	*	.			trans	-78.3	133.8	-179.8	31.6	-33.8	0	0	0	111.5	D1019 N1023	D1019-P1021 WeakPolarHBondContact O-CD 3.49Å; P1021-N1023 PolarHBondContact O-N 3.37Å
1022	I	33.4	Very low	45.5	Very low	167 Å²	167	96 Å²	96	86%	0.856	56%	0.564	S	S	*	*	S	Bend	trans	-72.1	-7.3	-177.9	-68.4	172.7	0	0	0	113.1	G1024	I1022-G1024 PolarHBondContact O-N 3.5Å
1023	N	28.9	Very low	43.3	Very low	161 Å²	161	101.4 Å²	101.4	86%	0.861	60%	0.597	S	S	*	*			trans	-92.5	76	-177.1	-69.1	5.2	0	0	0	112.2	P1021	P1021-N1023 PolarHBondContact O-N 3.37Å
1024	G	32.2	Very low	41.8	Very low	63 Å²	63	106.1 Å²	106.1	65%	0.649	62%	0.618	S	S	*	*			trans	-148.3	114	171.1	0	0	0	0	0	111.3	I1022 T1026	I1022-G1024 PolarHBondContact O-N 3.5Å; G1024-T1026 PolarHBondContact O-N 2.93Å
1025	T	28.8	Very low	41.2	Very low	146 Å²	146	110.2 Å²	110.2	90%	0.896	64%	0.644	S	S	*	*			trans	-90.1	96.2	-168.8	49.6	0	0	0	0	113.6
1026	T	35.9	Very low	41.3	Very low	135 Å²	135	113.3 Å²	113.3	83%	0.828	66%	0.662	S	S	*	*			trans	-143.8	143.9	152.7	42.3	0	0	0	0	110.6	G1024	G1024-T1026 PolarHBondContact O-N 2.93Å
1027	N	29.8	Very low	41.9	Very low	122 Å²	122	112.8 Å²	112.8	65%	0.652	66%	0.659	S	S	*	*			trans	-71.5	161.4	-166	-53.6	-37.2	0	0	0	114.3
1028	N	30.5	Very low	43.1	Very low	148 Å²	148	113.5 Å²	113.5	79%	0.791	66%	0.656	S	S	*	*			trans	68.6	51.6	154.9	-58	-3.1	0	0	0	119.1
1029	V	36.5	Very low	44.8	Very low	138 Å²	138	111.6 Å²	111.6	84%	0.836	64%	0.644	S	S	*	*			trans	-128.9	134.5	146.6	-176.9	0	0	0	0	109.2
1030	S	32.7	Very low	46.5	Very low	96 Å²	96	111.9 Å²	111.9	67%	0.671	64%	0.638	S	S	*	*			trans	-75.4	144.6	-178.3	42.9	0	0	0	0	113
1031	S	29.8	Very low	48.7	Very low	102 Å²	102	104 Å²	104	71%	0.713	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-24.9	140	169.8	51.2	0	0	0	0	118.6
1032	S	36.7	Very low	51.3	Low	110 Å²	110	100 Å²	100	77%	0.769	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.8	12	149.3	74.3	0	0	0	0	120.5	F1034	S1032-F1034 PolarHBondContact O-N 3.48Å
1033	T	44.3	Very low	54.2	Low	115 Å²	115	92.1 Å²	92.1	71%	0.706	53%	0.531	S	S	*	.			trans	-67.3	104.7	173.8	-49.1	0	0	0	0	112.3
1034	F	50.9	Low	57.2	Low	99 Å²	99	86.6 Å²	86.6	43%	0.434	50%	0.5	S	S	.	.			trans	-61	137.3	164	-81.7	-99.8	0	0	0	109.8	L1016 S1032 I1036 V1057	L1016-F1034 HydrophobicContact CD2-CD1 3.9Å; L1016-F1034 HydrophobicContact CD2-CE1 3.93Å; S1032-F1034 PolarHBondContact O-N 3.48Å; F1034-I1036 PolarHBondContact O-N 3.44Å; F1034-V1057 HydrophobicContact CD1-CG2 4.26Å; F1034-V1057 HydrophobicContact CD2-CG2 4.47Å; F1034-V1057 HydrophobicContact CE1-CB 4.39Å; F1034-V1057 HydrophobicContact CE1-CG2 3.93Å; F1034-V1057 HydrophobicContact CE2-CG1 4.16Å; F1034-V1057 HydrophobicContact CE2-CG2 4.15Å; F1034-V1057 HydrophobicContact CZ-CB 4.15Å; F1034-V1057 HydrophobicContact CZ-CG1 3.79Å; F1034-V1057 HydrophobicContact CZ-CG2 3.88Å
1035	P	61	Low	60.2	Low	88 Å²	88	83.7 Å²	83.7	57%	0.571	47%	0.469	S	S	*	.			trans	-63.2	132.4	177.6	27.1	-34.5	0	0	0	110.5	L1016 I1037	L1016-P1035 HydrophobicContact CD1-CG 3.62Å; P1035-I1037 PolarHBondContact O-N 2.71Å; P1035-I1037 VanDerWaalsContact O-N 3.12Å
1036	I	67.6	Low	63.2	Low	112 Å²	112	80.4 Å²	80.4	57%	0.574	45%	0.446	S	S	*	.			trans	-83.7	90.3	-176.7	-57.2	178.9	0	0	0	108.6	I982 F1034	I982-I1036 HydrophobicContact CD1-CG2 3.97Å; I982-I1036 HydrophobicContact CG1-CG2 3.94Å; I982-I1036 HydrophobicContact CG2-CG2 3.84Å; F1034-I1036 PolarHBondContact O-N 3.44Å
1037	I	72.5	Confident	65.9	Low	14 Å²	14	76.6 Å²	76.6	7%	0.072	42%	0.423	C	S	.	.			trans	-74.3	132.2	171.9	-55.3	173.3	0	0	0	109.1	I982 L983 A1014 L1016 P1035 Q1086	I982-I1037 CarbonylContact C-O 3.55Å; I982-I1037 WeakPolarHBondContact CA-O 3.29Å; L983-I1037 HydrophobicContact CB-CB 4.39Å; L983-I1037 HydrophobicContact CB-CG2 4.21Å; L983-I1037 HydrophobicContact CD1-CG2 4.13Å; L983-I1037 PolarHBondContact N-O 3.15Å; A1014-I1037 HydrophobicContact CB-CD1 3.91Å; A1014-I1037 HydrophobicContact CB-CG2 3.68Å; L1016-I1037 HydrophobicContact CD1-CD1 4.24Å; P1035-I1037 PolarHBondContact O-N 2.71Å; P1035-I1037 VanDerWaalsContact O-N 3.12Å; I1037-Q1086 HydrophobicContact CG2-CB 4.42Å; I1037-Q1086 HydrophobicContact CG2-CG 4.11Å
1038	R	82.1	Confident	68.8	Low	148 Å²	148	77 Å²	77	56%	0.558	42%	0.416	S	S	*	.	B	Isolated β-bridge	trans	-107.8	149.1	171.3	-66.2	-178.2	-179.3	159.5	-2	110.6	D981	D981-R1038 CarbonylContact O-C 3.53Å; D981-R1038 VanDerWaalsContact O-CA 3.28Å; D981-R1038 WeakPolarHBondContact O-CA 3.45Å
1039	S	85.4	Confident	71.7	Confident	7 Å²	7	70 Å²	70	5%	0.049	38%	0.378	C	S	.	.			trans	-71.2	136.6	170.2	43.7	0	0	0	0	112.3	H978 G980 D981	H978-S1039 PolarHBondContact O-OG 2.98Å; G980-S1039 PolarHBondContact N-O 3.41Å; G980-S1039 PolarHBondContact N-OG 3.02Å; D981-S1039 PolarHBondContact N-OG 3.48Å; D981-S1039 PolarHBondContact O-N 2.93Å; D981-S1039 PolarHBondContact O-OG 3.08Å
1040	R	81.9	Confident	74.3	Confident	107 Å²	107	66 Å²	66	40%	0.404	35%	0.352	S	S	.	.	S	Bend	trans	-82.2	-26	167.6	-176.8	-179.3	176.6	124.3	13.6	113.4	T979 E998 I1085 E1087 G1088	T979-R1040 VanDerWaalsContact CG2-O 3.3Å; T979-R1040 WeakPolarHBondContact CG2-O 3.38Å; E998-R1040 VanDerWaalsContact CD-NE 3.3Å; E998-R1040 IonicContact OE1-CZ 3.79Å; E998-R1040 IonicContact OE1-NE 3.32Å; E998-R1040 PolarHBondContact OE1-NE 3.26Å; E998-R1040 IonicContact OE1-NH2 3.28Å; E998-R1040 PolarHBondContact OE1-NH2 2.79Å; E998-R1040 IonicContact OE2-NE 3.19Å; E998-R1040 PolarHBondContact OE2-NE 3.27Å; R1040-I1085 VanDerWaalsContact CB-O 3.27Å; R1040-I1085 WeakPolarHBondContact CB-O 3.4Å; R1040-I1085 PolarHBondContact N-O 3.21Å; R1040-E1087 PolarHBondContact NH1-O 3.48Å; R1040-G1088 PolarHBondContact NH1-O 2.86Å
1041	C	86.3	Confident	77.1	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.007	32%	0.32	C	S	.	.	S	Bend	trans	-127.5	151	-170	-47.4	0	0	0	0	111.8	V996 L997 I1085	V996-C1041 HydrophobicContact CG1-CB 3.47Å; V996-C1041 VanDerWaalsContact CG1-CB 3.47Å; L997-C1041 CarbonylContact O-C 3.54Å; L997-C1041 WeakPolarHBondContact O-CA 3.38Å; L997-C1041 WeakPolarHBondContact O-CB 3.34Å; C1041-I1085 HydrophobicContact CB-CG2 4.28Å
1042	D	91	Very high	80.1	Confident	22 Å²	22	57.2 Å²	57.2	12%	0.118	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	148.1	163.5	-93.6	49.6	0	0	0	109.6	Y975 I977 H978 T979 V996 L997	Y975-D1042 HydrophobicContact CD1-CB 4.15Å; Y975-D1042 WeakPolarHBondContact CD1-OD2 3.43Å; Y975-D1042 HydrophobicContact CE1-CB 4.14Å; Y975-D1042 WeakPolarHBondContact CE1-OD2 3.28Å; I977-D1042 CarbonylContact O-C 3.54Å; I977-D1042 WeakPolarHBondContact O-CA 3.39Å; H978-D1042 WeakPolarHBondContact CA-OD1 3.28Å; H978-D1042 IonicContact CE1-OD2 3.61Å; H978-D1042 IonicContact CG-OD2 2.66Å; H978-D1042 IonicContact ND1-OD1 3.11Å; H978-D1042 IonicContact ND1-OD2 2.71Å; H978-D1042 PolarHBondContact ND1-OD2 3.21Å; T979-D1042 WeakPolarHBondContact CG2-OD1 3.41Å; T979-D1042 PolarHBondContact N-OD1 3.12Å; T979-D1042 PolarHBondContact OG1-OD1 3.19Å; T979-D1042 VanDerWaalsContact OG1-OD1 3.12Å; V996-D1042 CarbonylContact C-O 3.57Å; V996-D1042 WeakPolarHBondContact CA-O 3.49Å; L997-D1042 HydrophobicContact CB-CB 4.01Å; L997-D1042 PolarHBondContact N-O 2.95Å; L997-D1042 PolarHBondContact O-N 3.36Å
1043	V	92.6	Very high	82.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	117.8	174.1	-175.5	0	0	0	0	109.5	Y975 L976 I977 L994 V996 F1012	Y975-V1043 CarbonylContact C-O 3.47Å; Y975-V1043 WeakPolarHBondContact CA-O 3.45Å; L976-V1043 PolarHBondContact N-O 3.3Å; I977-V1043 HydrophobicContact CB-CB 4.14Å; I977-V1043 HydrophobicContact CB-CG2 4.15Å; I977-V1043 HydrophobicContact CD1-CG2 4.21Å; I977-V1043 HydrophobicContact CG1-CB 4.47Å; I977-V1043 PolarHBondContact O-N 3.03Å; L994-V1043 HydrophobicContact CB-CG1 4.35Å; L994-V1043 HydrophobicContact CD2-CG1 3.94Å; V996-V1043 HydrophobicContact CG1-CG2 4.36Å; V996-V1043 HydrophobicContact CG2-CG2 4.31Å; F1012-V1043 HydrophobicContact CD2-CG1 4.43Å; F1012-V1043 HydrophobicContact CD2-CG2 4.43Å; F1012-V1043 HydrophobicContact CE2-CB 4.46Å; F1012-V1043 HydrophobicContact CE2-CG1 3.81Å; F1012-V1043 HydrophobicContact CE2-CG2 4.32Å; F1012-V1043 HydrophobicContact CZ-CG1 4.26Å
1044	K	93.5	Very high	85	Confident	46 Å²	46	47.8 Å²	47.8	20%	0.2	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	142.1	-171.7	169.8	154.8	145.7	-96.1	0	111.6	Y975 L994 E995 L997	Y975-K1044 HydrophobicContact CD1-CB 3.9Å; Y975-K1044 HydrophobicContact CD1-CD 4.1Å; Y975-K1044 HydrophobicContact CD2-CD 3.95Å; Y975-K1044 HydrophobicContact CE1-CB 4.06Å; Y975-K1044 HydrophobicContact CE1-CD 3.68Å; Y975-K1044 HydrophobicContact CE1-CG 4.49Å; Y975-K1044 HydrophobicContact CE2-CD 3.5Å; Y975-K1044 VanDerWaalsContact CE2-CD 3.5Å; Y975-K1044 HydrophobicContact CG-CB 4.3Å; Y975-K1044 HydrophobicContact CG-CD 4.23Å; L994-K1044 CarbonylContact C-O 3.47Å; L994-K1044 VanDerWaalsContact CA-O 3.22Å; L994-K1044 WeakPolarHBondContact CA-O 3.03Å; L994-K1044 VanDerWaalsContact CB-O 3.32Å; L994-K1044 WeakPolarHBondContact CB-O 3.28Å; E995-K1044 HydrophobicContact CG-CB 3.97Å; E995-K1044 HydrophobicContact CG-CG 4.25Å; E995-K1044 PolarHBondContact N-O 3.23Å; E995-K1044 PolarHBondContact O-N 3.26Å; E995-K1044 WeakPolarHBondContact OE1-CE 3.37Å; E995-K1044 IonicContact OE1-NZ 3.06Å; E995-K1044 PolarHBondContact OE1-NZ 3.36Å; L997-K1044 HydrophobicContact CD1-CB 4.11Å; L997-K1044 HydrophobicContact CD1-CD 4.34Å
1045	S	93.8	Very high	86.8	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	131.7	-178.3	50.5	0	0	0	0	111.9	T971 G973 E974	T971-S1045 PolarHBondContact O-OG 2.89Å; G973-S1045 WeakPolarHBondContact CA-O 3.39Å; G973-S1045 PolarHBondContact N-O 3.1Å; E974-S1045 PolarHBondContact N-OG 3.4Å; E974-S1045 PolarHBondContact O-N 2.98Å; E974-S1045 PolarHBondContact O-OG 2.85Å
1046	L	92.9	Very high	87.9	Confident	77 Å²	77	41.3 Å²	41.3	40%	0.403	19%	0.189	S	C	.	.	S	Bend	trans	-91.1	-27.3	177.2	-70.6	171.9	0	0	0	112.4	S993 E995 L1005	S993-L1046 WeakPolarHBondContact O-CB 3.15Å; S993-L1046 PolarHBondContact O-N 3.14Å; E995-L1046 HydrophobicContact CB-CD1 4.22Å; E995-L1046 HydrophobicContact CB-CG 4.26Å; E995-L1046 HydrophobicContact CG-CD2 4.21Å; E995-L1046 HydrophobicContact CG-CG 4.23Å; L1005-L1046 HydrophobicContact CD2-CD1 3.85Å
1047	T	92.8	Very high	88.7	Confident	55 Å²	55	38.8 Å²	38.8	34%	0.337	18%	0.179	S	C	.	.	S	Bend	trans	-127.9	178	177.2	65.1	0	0	0	0	110.1	G992 S993 C1049	G992-T1047 WeakPolarHBondContact CA-OG1 3.35Å; S993-T1047 PolarHBondContact N-OG1 2.79Å; S993-T1047 PolarHBondContact O-N 3.35Å; T1047-C1049 PolarHBondContact O-N 3.03Å; T1047-C1049 PolarHBondContact O-SG 3.3Å
1048	Y	90	Very high	89.4	Confident	131 Å²	131	39.8 Å²	39.8	51%	0.514	19%	0.186	S	C	.	.			trans	-54.9	128.2	155.5	-62	-70.3	0	0	0	108.7	T911 F969 C970 T971 P972 G992	T911-Y1048 HydrophobicContact CG2-CE1 4.27Å; F969-Y1048 HydrophobicContact CE1-CD1 4.11Å; F969-Y1048 HydrophobicContact CE2-CD1 4.15Å; F969-Y1048 HydrophobicContact CE2-CG 4.46Å; F969-Y1048 AromaticContact CZ-CD1 3.38Å; F969-Y1048 HydrophobicContact CZ-CD1 3.38Å; F969-Y1048 HydrophobicContact CZ-CE1 4.19Å; F969-Y1048 HydrophobicContact CZ-CG 4.07Å; C970-Y1048 WeakPolarHBondContact O-CA 3.45Å; T971-Y1048 HydrophobicContact CG2-CD1 4.16Å; T971-Y1048 HydrophobicContact CG2-CE1 3.93Å; P972-Y1048 VanDerWaalsContact CD-CD1 3.49Å; P972-Y1048 VanDerWaalsContact CD-CE1 3.42Å; P972-Y1048 HydrophobicContact CG-CD1 4.34Å; P972-Y1048 HydrophobicContact CG-CD2 4.26Å; P972-Y1048 HydrophobicContact CG-CE1 4.29Å; P972-Y1048 HydrophobicContact CG-CE2 4.18Å; P972-Y1048 HydrophobicContact CG-CG 4.34Å; G992-Y1048 WeakPolarHBondContact CA-O 3.35Å
1049	C	90.8	Very high	89.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.2	-175.6	-62.8	0	0	0	0	111.3	F969 C970 N991 S993 L994 T1047 L1051	F969-C1049 WeakPolarHBondContact CA-O 3.22Å; C970-C1049 HydrophobicContact CB-CB 4.39Å; C970-C1049 PolarHBondContact N-O 3.02Å; C970-C1049 VanDerWaalsContact N-O 3.13Å; C970-C1049 PolarHBondContact O-N 2.88Å; N991-C1049 CarbonylContact O-C 3.1Å; N991-C1049 VanDerWaalsContact O-CA 3.29Å; N991-C1049 WeakPolarHBondContact O-CA 3.5Å; S993-C1049 PolarHBondContact N-SG 3.26Å; S993-C1049 PolarHBondContact O-SG 2.9Å; S993-C1049 VanDerWaalsContact O-SG 3.35Å; L994-C1049 HydrophobicContact CD1-CB 4.36Å; T1047-C1049 PolarHBondContact O-N 3.03Å; T1047-C1049 PolarHBondContact O-SG 3.3Å; C1049-L1051 HydrophobicContact CB-CD2 4.32Å; C1049-L1051 HydrophobicContact CB-CG 4.34Å
1050	D	90.6	Very high	89.6	Confident	54 Å²	54	33.8 Å²	33.8	29%	0.289	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	109.7	171.5	-62.4	-35.5	0	0	0	108.3	S990 N991	S990-D1050 PolarHBondContact N-O 2.92Å; N991-D1050 HydrophobicContact CB-CB 4.12Å; N991-D1050 WeakPolarHBondContact CB-OD2 3.35Å; N991-D1050 PolarHBondContact N-O 3.37Å; N991-D1050 PolarHBondContact ND2-OD2 2.95Å; N991-D1050 PolarHBondContact O-N 3.48Å
1051	L	92	Very high	89.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	131.1	-175.8	-59.7	-177.2	0	0	0	110.9	L967 T968 L976 V989 L994 C1049	L967-L1051 CarbonylContact C-O 3.58Å; T968-L1051 PolarHBondContact N-O 3.46Å; T968-L1051 PolarHBondContact O-N 3.04Å; T968-L1051 VanDerWaalsContact O-O 3.09Å; L976-L1051 HydrophobicContact CD1-CD1 3.99Å; L976-L1051 HydrophobicContact CD2-CD1 3.52Å; L976-L1051 HydrophobicContact CG-CD1 4.34Å; V989-L1051 HydrophobicContact CB-CD2 4.23Å; V989-L1051 HydrophobicContact CG1-CD2 4.23Å; V989-L1051 HydrophobicContact CG2-CD2 3.9Å; L994-L1051 HydrophobicContact CD1-CD2 3.99Å; L994-L1051 HydrophobicContact CD2-CD1 4.34Å; C1049-L1051 HydrophobicContact CB-CD2 4.32Å; C1049-L1051 HydrophobicContact CB-CG 4.34Å
1052	H	92.6	Very high	89.8	Confident	14 Å²	14	33.9 Å²	33.9	7%	0.065	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	141.2	167.4	-65.1	-118.9	0	0	0	108.6	N941 V944 F965 K966 L967 Y987 F988 S990	N941-H1052 PolarHBondContact OD1-CE1 3.46Å; N941-H1052 VanDerWaalsContact OD1-CE1 3.28Å; N941-H1052 PolarHBondContact OD1-ND1 2.99Å; V944-H1052 HydrophobicContact CG2-CB 3.78Å; F965-H1052 HydrophobicContact CD1-CB 4.32Å; K966-H1052 CarbonylContact O-C 3.59Å; K966-H1052 WeakPolarHBondContact O-CA 3.29Å; L967-H1052 WeakPolarHBondContact CD1-NE2 3.47Å; Y987-H1052 CarbonylContact C-O 3.47Å; Y987-H1052 WeakPolarHBondContact CA-O 3.4Å; F988-H1052 HydrophobicContact CB-CB 4.47Å; F988-H1052 PolarHBondContact N-O 2.98Å; F988-H1052 PolarHBondContact O-N 3.42Å; S990-H1052 PolarHBondContact OG-CD2 2.76Å; S990-H1052 PolarHBondContact OG-NE2 3.34Å
1053	Y	92.1	Very high	89.6	Confident	27 Å²	27	33.6 Å²	33.6	11%	0.106	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	155.5	175.5	77	-95.2	0	0	0	112.5	F965 K966 T968 R985 L986 Y987	F965-Y1053 WeakPolarHBondContact CA-O 3.3Å; K966-Y1053 HydrophobicContact CB-CD1 4.03Å; K966-Y1053 HydrophobicContact CB-CD2 4.44Å; K966-Y1053 HydrophobicContact CB-CE1 3.6Å; K966-Y1053 HydrophobicContact CB-CE2 4.05Å; K966-Y1053 HydrophobicContact CB-CG 4.45Å; K966-Y1053 HydrophobicContact CD-CE1 4.39Å; K966-Y1053 HydrophobicContact CD-CE2 3.61Å; K966-Y1053 WeakPolarHBondContact CD-OH 3.49Å; K966-Y1053 HydrophobicContact CG-CE2 4.42Å; K966-Y1053 PolarHBondContact N-O 2.9Å; K966-Y1053 PolarHBondContact O-N 3.09Å; T968-Y1053 VanDerWaalsContact OG1-CE1 3.31Å; T968-Y1053 WeakPolarHBondContact OG1-CE1 3.41Å; R985-Y1053 HydrophobicContact CB-CD2 4.37Å; R985-Y1053 VanDerWaalsContact CD-CD2 3.42Å; R985-Y1053 HydrophobicContact CG-CD2 3.74Å; R985-Y1053 HydrophobicContact CG-CE2 4.16Å; L986-Y1053 VanDerWaalsContact O-CA 3.29Å; L986-Y1053 WeakPolarHBondContact O-CA 3.17Å; Y987-Y1053 VanDerWaalsContact CD1-CB 3.5Å; Y987-Y1053 HydrophobicContact CD1-CG 4.4Å; Y987-Y1053 HydrophobicContact CE1-CD1 4.26Å; Y987-Y1053 HydrophobicContact CE1-CG 4.09Å
1054	I	92	Very high	89.3	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	135.7	168.9	-168.4	164.1	0	0	0	109	L961 N964 F965 R985 L986 F988 L1059 I1062	L961-I1054 HydrophobicContact CD2-CD1 3.95Å; N964-I1054 HydrophobicContact CB-CD1 4.13Å; N964-I1054 HydrophobicContact CB-CG1 4.4Å; F965-I1054 HydrophobicContact CD1-CB 4.02Å; F965-I1054 HydrophobicContact CE1-CB 3.95Å; F965-I1054 HydrophobicContact CE1-CG2 4.01Å; F965-I1054 HydrophobicContact CZ-CG2 4.41Å; R985-I1054 WeakPolarHBondContact CA-O 3.28Å; L986-I1054 HydrophobicContact CB-CG2 4.22Å; L986-I1054 PolarHBondContact N-O 3.34Å; L986-I1054 PolarHBondContact O-N 2.89Å; L986-I1054 VanDerWaalsContact O-N 3.1Å; F988-I1054 HydrophobicContact CE2-CG2 4.47Å; I1054-L1059 HydrophobicContact CD1-CB 4.31Å; I1054-L1059 HydrophobicContact CD1-CD1 4.29Å; I1054-L1059 HydrophobicContact CG1-CB 4.31Å; I1054-L1059 HydrophobicContact CG2-CB 4.35Å; I1054-L1059 HydrophobicContact CG2-CD2 4.14Å; I1054-I1062 HydrophobicContact CD1-CD1 4.29Å
1055	D	89.4	Confident	89	Confident	31 Å²	31	42 Å²	42	17%	0.166	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130.4	178.2	-57.5	-71.6	0	0	0	109.5	K966 R984 R985 V1057 T1058 L1059	K966-D1055 IonicContact NZ-OD2 3.3Å; K966-D1055 PolarHBondContact NZ-OD2 2.35Å; R984-D1055 CarbonylContact O-C 3.58Å; R984-D1055 WeakPolarHBondContact O-CA 3.31Å; R985-D1055 VanDerWaalsContact CG-OD1 3.27Å; R985-D1055 WeakPolarHBondContact CG-OD1 3.36Å; R985-D1055 IonicContact CZ-OD1 3.56Å; R985-D1055 IonicContact NE-OD1 3.17Å; R985-D1055 PolarHBondContact NE-OD1 3.36Å; R985-D1055 IonicContact NH2-OD1 3.37Å; D1055-V1057 VanDerWaalsContact C-N 3.26Å; D1055-V1057 PolarHBondContact O-N 3.03Å; D1055-T1058 PolarHBondContact O-N 3.23Å; D1055-T1058 VanDerWaalsContact O-N 3.09Å; D1055-L1059 PolarHBondContact O-N 2.86Å
1056	L	84.4	Confident	88.7	Confident	19 Å²	19	44 Å²	44	10%	0.099	22%	0.221	C	C	.	.	H	α-helix	trans	-61.5	-31.1	-168.6	-71.9	172.5	0	0	0	113.5	R984 L986 L1059 S1060	R984-L1056 PolarHBondContact O-N 3.25Å; L986-L1056 HydrophobicContact CB-CD2 4.04Å; L1056-L1059 HydrophobicContact CD2-CD2 4.36Å; L1056-S1060 WeakPolarHBondContact O-CB 3.45Å; L1056-S1060 PolarHBondContact O-N 3.19Å
1057	V	84.2	Confident	88.4	Confident	59 Å²	59	44.5 Å²	44.5	36%	0.358	23%	0.229	S	C	.	.	H	α-helix	trans	-58.8	-54.8	173.5	177	0	0	0	0	110.1	F1034 D1055 L1059 S1060 E1061	F1034-V1057 HydrophobicContact CD1-CG2 4.26Å; F1034-V1057 HydrophobicContact CD2-CG2 4.47Å; F1034-V1057 HydrophobicContact CE1-CB 4.39Å; F1034-V1057 HydrophobicContact CE1-CG2 3.93Å; F1034-V1057 HydrophobicContact CE2-CG1 4.16Å; F1034-V1057 HydrophobicContact CE2-CG2 4.15Å; F1034-V1057 HydrophobicContact CZ-CB 4.15Å; F1034-V1057 HydrophobicContact CZ-CG1 3.79Å; F1034-V1057 HydrophobicContact CZ-CG2 3.88Å; D1055-V1057 VanDerWaalsContact C-N 3.26Å; D1055-V1057 PolarHBondContact O-N 3.03Å; V1057-L1059 PolarHBondContact O-N 3.35Å; V1057-S1060 WeakPolarHBondContact O-CB 3.33Å; V1057-S1060 PolarHBondContact O-N 3.49Å; V1057-E1061 WeakPolarHBondContact O-CG 3.38Å; V1057-E1061 PolarHBondContact O-N 3.28Å
1058	T	86.5	Confident	88	Confident	35 Å²	35	52.4 Å²	52.4	22%	0.215	25%	0.252	C	S	.	.	H	α-helix	trans	-68.1	-34.6	-179.1	-49.8	0	0	0	0	112	N964 D1055 E1061 I1062	N964-T1058 HydrophobicContact CB-CG2 3.96Å; N964-T1058 WeakPolarHBondContact OD1-CG2 3.44Å; D1055-T1058 PolarHBondContact O-N 3.23Å; D1055-T1058 VanDerWaalsContact O-N 3.09Å; T1058-E1061 PolarHBondContact O-N 2.73Å; T1058-I1062 HydrophobicContact CG2-CD1 4.17Å; T1058-I1062 WeakPolarHBondContact O-CD1 3.38Å; T1058-I1062 VanDerWaalsContact O-CG1 3.26Å; T1058-I1062 WeakPolarHBondContact O-CG1 3.47Å; T1058-I1062 PolarHBondContact O-N 3.08Å
1059	L	88.1	Confident	87.8	Confident	13 Å²	13	46.6 Å²	46.6	7%	0.068	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-47.9	170.6	179.3	59.8	0	0	0	110.8	L961 L986 I1054 D1055 L1056 V1057 E1061 I1062 L1063 L1073	L961-L1059 HydrophobicContact CD2-CD1 3.84Å; L986-L1059 HydrophobicContact CD2-CD2 4Å; I1054-L1059 HydrophobicContact CD1-CB 4.31Å; I1054-L1059 HydrophobicContact CD1-CD1 4.29Å; I1054-L1059 HydrophobicContact CG1-CB 4.31Å; I1054-L1059 HydrophobicContact CG2-CB 4.35Å; I1054-L1059 HydrophobicContact CG2-CD2 4.14Å; D1055-L1059 PolarHBondContact O-N 2.86Å; L1056-L1059 HydrophobicContact CD2-CD2 4.36Å; V1057-L1059 PolarHBondContact O-N 3.35Å; L1059-E1061 VanDerWaalsContact C-N 3.34Å; L1059-E1061 PolarHBondContact O-N 3.34Å; L1059-I1062 PolarHBondContact O-N 3.23Å; L1059-L1063 HydrophobicContact CD1-CD1 3.91Å; L1059-L1063 HydrophobicContact CD1-CD2 4.36Å; L1059-L1063 HydrophobicContact CD1-CG 3.95Å; L1059-L1063 HydrophobicContact CG-CD1 3.81Å; L1059-L1063 HydrophobicContact CG-CG 4.28Å; L1059-L1063 WeakPolarHBondContact O-CB 3.23Å; L1059-L1063 WeakPolarHBondContact O-CG 3.3Å; L1059-L1063 PolarHBondContact O-N 3.45Å; L1059-L1073 HydrophobicContact CD1-CD2 4.41Å
1060	S	84.3	Confident	87.6	Confident	16 Å²	16	48.4 Å²	48.4	11%	0.112	24%	0.238	C	C	.	.	H	α-helix	trans	-57.2	-44.8	176.4	-173.2	0	0	0	0	112	L1056 V1057 I1062 L1063 N1064	L1056-S1060 WeakPolarHBondContact O-CB 3.45Å; L1056-S1060 PolarHBondContact O-N 3.19Å; V1057-S1060 WeakPolarHBondContact O-CB 3.33Å; V1057-S1060 PolarHBondContact O-N 3.49Å; S1060-I1062 PolarHBondContact O-N 3.06Å; S1060-L1063 PolarHBondContact O-N 3.4Å; S1060-N1064 WeakPolarHBondContact O-CB 3.28Å; S1060-N1064 PolarHBondContact O-N 3.27Å; S1060-N1064 PolarHBondContact O-ND2 3.05Å; S1060-N1064 PolarHBondContact OG-ND2 3.5Å
1061	E	85.8	Confident	87.2	Confident	105 Å²	105	48.9 Å²	48.9	49%	0.491	25%	0.249	S	C	.	.	H	α-helix	trans	-57.8	-47.1	175.2	-70.5	170.7	-175.6	0	0	112.9	V1057 T1058 L1059 N1064 Q1065	V1057-E1061 WeakPolarHBondContact O-CG 3.38Å; V1057-E1061 PolarHBondContact O-N 3.28Å; T1058-E1061 PolarHBondContact O-N 2.73Å; L1059-E1061 VanDerWaalsContact C-N 3.34Å; L1059-E1061 PolarHBondContact O-N 3.34Å; E1061-N1064 PolarHBondContact O-N 3.11Å; E1061-Q1065 WeakPolarHBondContact O-CG 3.15Å; E1061-Q1065 PolarHBondContact O-N 3.12Å
1062	I	87.1	Confident	86.8	Confident	6 Å²	6	52 Å²	52	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-65.3	-41.1	178.5	-65.1	162.4	0	0	0	111	L961 N964 I1054 T1058 L1059 S1060 Q1065 H1066	L961-I1062 HydrophobicContact CD2-CD1 4.19Å; L961-I1062 HydrophobicContact CD2-CG2 3.99Å; L961-I1062 HydrophobicContact CG-CG2 4.14Å; N964-I1062 HydrophobicContact CB-CD1 4.26Å; I1054-I1062 HydrophobicContact CD1-CD1 4.29Å; T1058-I1062 HydrophobicContact CG2-CD1 4.17Å; T1058-I1062 WeakPolarHBondContact O-CD1 3.38Å; T1058-I1062 VanDerWaalsContact O-CG1 3.26Å; T1058-I1062 WeakPolarHBondContact O-CG1 3.47Å; T1058-I1062 PolarHBondContact O-N 3.08Å; L1059-I1062 PolarHBondContact O-N 3.23Å; S1060-I1062 PolarHBondContact O-N 3.06Å; I1062-Q1065 WeakPolarHBondContact O-CB 3.34Å; I1062-Q1065 PolarHBondContact O-N 2.93Å; I1062-H1066 PolarHBondContact O-CD2 3.31Å; I1062-H1066 PolarHBondContact O-N 3.04Å
1063	L	86.8	Confident	86.3	Confident	16 Å²	16	51.5 Å²	51.5	8%	0.084	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-36.7	179.4	-67	176	0	0	0	112.2	L1059 S1060 Q1065 H1066 F1069 K1070 L1073	L1059-L1063 HydrophobicContact CD1-CD1 3.91Å; L1059-L1063 HydrophobicContact CD1-CD2 4.36Å; L1059-L1063 HydrophobicContact CD1-CG 3.95Å; L1059-L1063 HydrophobicContact CG-CD1 3.81Å; L1059-L1063 HydrophobicContact CG-CG 4.28Å; L1059-L1063 WeakPolarHBondContact O-CB 3.23Å; L1059-L1063 WeakPolarHBondContact O-CG 3.3Å; L1059-L1063 PolarHBondContact O-N 3.45Å; S1060-L1063 PolarHBondContact O-N 3.4Å; L1063-Q1065 VanDerWaalsContact C-N 3.26Å; L1063-Q1065 PolarHBondContact O-N 2.85Å; L1063-H1066 CarbonylContact O-C 3.52Å; L1063-H1066 PolarHBondContact O-N 3.37Å; L1063-F1069 HydrophobicContact CD2-CD1 3.69Å; L1063-F1069 HydrophobicContact CD2-CE1 4.05Å; L1063-K1070 HydrophobicContact CB-CB 3.96Å; L1063-K1070 HydrophobicContact CB-CD 4.18Å; L1063-K1070 HydrophobicContact CB-CG 3.94Å; L1063-L1073 HydrophobicContact CD1-CD2 3.76Å; L1063-L1073 HydrophobicContact CD2-CD2 3.62Å; L1063-L1073 HydrophobicContact CG-CD2 4.28Å
1064	N	86.5	Confident	85.7	Confident	89 Å²	89	53 Å²	53	48%	0.476	27%	0.268	S	S	.	.	H	α-helix	trans	-67.2	-27.2	174.1	-66.2	-29.3	0	0	0	112	S1060 E1061 K1070	S1060-N1064 WeakPolarHBondContact O-CB 3.28Å; S1060-N1064 PolarHBondContact O-N 3.27Å; S1060-N1064 PolarHBondContact O-ND2 3.05Å; S1060-N1064 PolarHBondContact OG-ND2 3.5Å; E1061-N1064 PolarHBondContact O-N 3.11Å; N1064-K1070 PolarHBondContact OD1-NZ 3.47Å
1065	Q	86.6	Confident	85	Confident	133 Å²	133	55.2 Å²	55.2	62%	0.621	28%	0.284	S	S	*	.	H	α-helix	trans	-76	-25.8	169.2	-66	173.6	39.3	0	0	113.2	E1061 I1062 L1063 P1067	E1061-Q1065 WeakPolarHBondContact O-CG 3.15Å; E1061-Q1065 PolarHBondContact O-N 3.12Å; I1062-Q1065 WeakPolarHBondContact O-CB 3.34Å; I1062-Q1065 PolarHBondContact O-N 2.93Å; L1063-Q1065 VanDerWaalsContact C-N 3.26Å; L1063-Q1065 PolarHBondContact O-N 2.85Å; Q1065-P1067 VanDerWaalsContact C-CD 3.41Å; Q1065-P1067 WeakPolarHBondContact O-CD 3.48Å
1066	H	87.6	Confident	84.4	Confident	44 Å²	44	55.7 Å²	55.7	20%	0.204	28%	0.284	C	S	.	.	S	Bend	trans	-121.2	62.7	-178.5	-65.6	-65.4	0	0	0	112.8	C957 I1062 L1063 R1068 F1069 K1070	C957-H1066 HydrophobicContact CB-CB 4.49Å; C957-H1066 VanDerWaalsContact SG-CD2 3.54Å; I1062-H1066 PolarHBondContact O-CD2 3.31Å; I1062-H1066 PolarHBondContact O-N 3.04Å; L1063-H1066 CarbonylContact O-C 3.52Å; L1063-H1066 PolarHBondContact O-N 3.37Å; H1066-R1068 VanDerWaalsContact C-N 3.25Å; H1066-R1068 PolarHBondContact O-N 3Å; H1066-F1069 HydrophobicContact CB-CB 4.29Å; H1066-F1069 WeakPolarHBondContact O-CA 3.31Å; H1066-F1069 PolarHBondContact O-N 2.86Å; H1066-K1070 PolarHBondContact O-N 2.93Å
1067	P	85.4	Confident	83.9	Confident	87 Å²	87	55.6 Å²	55.6	57%	0.565	28%	0.283	S	S	*	.	H	α-helix	trans	-62.4	-22.5	-167.8	22.9	-35	0	0	0	115.5	Q1065 A1071	Q1065-P1067 VanDerWaalsContact C-CD 3.41Å; Q1065-P1067 WeakPolarHBondContact O-CD 3.48Å; P1067-A1071 PolarHBondContact O-N 3.3Å
1068	R	84.5	Confident	83.1	Confident	221 Å²	221	59 Å²	59	83%	0.834	29%	0.29	S	S	*	.	H	α-helix	trans	-64.9	-48	170.5	-71.1	-173.8	177.2	-172.2	-4.1	111.4	H1066 K1070 A1071 E1072	H1066-R1068 VanDerWaalsContact C-N 3.25Å; H1066-R1068 PolarHBondContact O-N 3Å; R1068-K1070 VanDerWaalsContact C-N 3.32Å; R1068-A1071 PolarHBondContact O-N 3.17Å; R1068-E1072 PolarHBondContact O-N 3.13Å
1069	F	87.4	Confident	82.2	Confident	9 Å²	9	64.2 Å²	64.2	4%	0.039	31%	0.312	C	S	.	.	H	α-helix	trans	-69.9	-30.6	177.3	-173.3	-113	0	0	0	111.5	V949 F950 A953 L961 L1063 H1066 A1071 E1072 L1073	V949-F1069 WeakPolarHBondContact O-CE2 3.45Å; F950-F1069 HydrophobicContact CD1-CE1 4.33Å; F950-F1069 AromaticContact CD1-CZ 3.71Å; F950-F1069 HydrophobicContact CD1-CZ 3.71Å; F950-F1069 HydrophobicContact CE1-CE1 4.44Å; F950-F1069 HydrophobicContact CE1-CZ 4.11Å; A953-F1069 HydrophobicContact CB-CD2 3.89Å; A953-F1069 HydrophobicContact CB-CE2 3.77Å; A953-F1069 HydrophobicContact CB-CG 4.35Å; A953-F1069 HydrophobicContact CB-CZ 4.12Å; L961-F1069 HydrophobicContact CD1-CE1 3.95Å; L1063-F1069 HydrophobicContact CD2-CD1 3.69Å; L1063-F1069 HydrophobicContact CD2-CE1 4.05Å; H1066-F1069 HydrophobicContact CB-CB 4.29Å; H1066-F1069 WeakPolarHBondContact O-CA 3.31Å; H1066-F1069 PolarHBondContact O-N 2.86Å; F1069-A1071 VanDerWaalsContact C-N 3.34Å; F1069-A1071 PolarHBondContact O-N 2.92Å; F1069-E1072 PolarHBondContact O-N 3.34Å; F1069-L1073 HydrophobicContact CE1-CB 4.32Å; F1069-L1073 HydrophobicContact CE1-CD2 4.12Å; F1069-L1073 HydrophobicContact CZ-CB 4.31Å; F1069-L1073 WeakPolarHBondContact O-CB 3.45Å; F1069-L1073 PolarHBondContact O-N 3.34Å
1070	K	85.9	Confident	81.1	Confident	38 Å²	38	67.9 Å²	67.9	17%	0.165	33%	0.332	C	S	.	.	H	α-helix	trans	-56.1	-45.9	170.1	-172.4	175.7	-178.3	-177.1	0	112.4	T1018 L1063 N1064 H1066 R1068 K1074	T1018-K1070 WeakPolarHBondContact OG1-CE 3.38Å; T1018-K1070 PolarHBondContact OG1-NZ 2.91Å; L1063-K1070 HydrophobicContact CB-CB 3.96Å; L1063-K1070 HydrophobicContact CB-CD 4.18Å; L1063-K1070 HydrophobicContact CB-CG 3.94Å; N1064-K1070 PolarHBondContact OD1-NZ 3.47Å; H1066-K1070 PolarHBondContact O-N 2.93Å; R1068-K1070 VanDerWaalsContact C-N 3.32Å; K1070-K1074 VanDerWaalsContact O-CB 3.24Å; K1070-K1074 WeakPolarHBondContact O-CB 3.25Å; K1070-K1074 PolarHBondContact O-N 2.99Å
1071	A	82	Confident	80.2	Confident	63 Å²	63	68.7 Å²	68.7	52%	0.521	34%	0.335	S	S	.	.	H	α-helix	trans	-66.2	-45.2	178.4	0	0	0	0	0	112	P1067 R1068 F1069 K1074 S1075	P1067-A1071 PolarHBondContact O-N 3.3Å; R1068-A1071 PolarHBondContact O-N 3.17Å; F1069-A1071 VanDerWaalsContact C-N 3.34Å; F1069-A1071 PolarHBondContact O-N 2.92Å; A1071-K1074 PolarHBondContact O-N 2.87Å; A1071-S1075 PolarHBondContact O-N 3.28Å; A1071-S1075 PolarHBondContact O-OG 3.47Å
1072	E	82.6	Confident	79.4	Confident	65 Å²	65	65.8 Å²	65.8	30%	0.304	33%	0.326	S	S	.	.	H	α-helix	trans	-65.1	-44.3	179.5	-66.9	173.8	147.5	0	0	112.3	K952 R1068 F1069 K1074 S1075 Y1076	K952-E1072 WeakPolarHBondContact CB-OE2 3.2Å; K952-E1072 HydrophobicContact CD-CG 4.35Å; R1068-E1072 PolarHBondContact O-N 3.13Å; F1069-E1072 PolarHBondContact O-N 3.34Å; E1072-K1074 VanDerWaalsContact C-N 3.34Å; E1072-S1075 WeakPolarHBondContact CA-OG 3.48Å; E1072-S1075 PolarHBondContact O-N 3.38Å; E1072-S1075 PolarHBondContact O-OG 2.96Å; E1072-Y1076 WeakPolarHBondContact O-CD2 3.46Å; E1072-Y1076 PolarHBondContact O-N 2.98Å
1073	L	83.8	Confident	78.7	Confident	4 Å²	4	67 Å²	67	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-66.2	-35.7	175	-178.2	64.4	0	0	0	111.6	V949 W1011 L1059 L1063 F1069 Y1076 L1077	V949-L1073 HydrophobicContact CG1-CD1 3.31Å; W1011-L1073 HydrophobicContact CH2-CD1 3.94Å; W1011-L1073 HydrophobicContact CZ3-CD1 4.07Å; L1059-L1073 HydrophobicContact CD1-CD2 4.41Å; L1063-L1073 HydrophobicContact CD1-CD2 3.76Å; L1063-L1073 HydrophobicContact CD2-CD2 3.62Å; L1063-L1073 HydrophobicContact CG-CD2 4.28Å; F1069-L1073 HydrophobicContact CE1-CB 4.32Å; F1069-L1073 HydrophobicContact CE1-CD2 4.12Å; F1069-L1073 HydrophobicContact CZ-CB 4.31Å; F1069-L1073 WeakPolarHBondContact O-CB 3.45Å; F1069-L1073 PolarHBondContact O-N 3.34Å; L1073-Y1076 PolarHBondContact O-N 3.23Å; L1073-L1077 HydrophobicContact CD1-CD1 4.12Å; L1073-L1077 HydrophobicContact CD1-CG 4.32Å; L1073-L1077 HydrophobicContact CD2-CD1 4.42Å; L1073-L1077 HydrophobicContact CG-CD1 3.81Å; L1073-L1077 HydrophobicContact CG-CG 4.45Å; L1073-L1077 WeakPolarHBondContact O-CB 3.43Å; L1073-L1077 WeakPolarHBondContact O-CG 3.46Å; L1073-L1077 PolarHBondContact O-N 3.09Å
1074	K	79.3	Confident	78.3	Confident	59 Å²	59	67.9 Å²	67.9	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-58.9	-49	172.6	-174.3	172.4	-175.6	-176	0	110.2	F1015 D1019 K1070 A1071 E1072 L1077 Y1078	F1015-K1074 HydrophobicContact CE1-CD 4.45Å; F1015-K1074 HydrophobicContact CE1-CG 4.24Å; F1015-K1074 HydrophobicContact CZ-CB 4.41Å; F1015-K1074 HydrophobicContact CZ-CD 4.2Å; F1015-K1074 HydrophobicContact CZ-CG 3.84Å; D1019-K1074 IonicContact OD2-NZ 3.25Å; D1019-K1074 PolarHBondContact OD2-NZ 3.44Å; K1070-K1074 VanDerWaalsContact O-CB 3.24Å; K1070-K1074 WeakPolarHBondContact O-CB 3.25Å; K1070-K1074 PolarHBondContact O-N 2.99Å; A1071-K1074 PolarHBondContact O-N 2.87Å; E1072-K1074 VanDerWaalsContact C-N 3.34Å; K1074-L1077 PolarHBondContact O-N 2.84Å; K1074-Y1078 HydrophobicContact CD-CE2 4.19Å; K1074-Y1078 VanDerWaalsContact CE-CE2 3.45Å; K1074-Y1078 VanDerWaalsContact CE-OH 3.31Å; K1074-Y1078 WeakPolarHBondContact CE-OH 3.41Å; K1074-Y1078 HydrophobicContact CG-CD2 4.17Å; K1074-Y1078 HydrophobicContact CG-CE2 3.6Å; K1074-Y1078 WeakPolarHBondContact O-CD2 3.48Å; K1074-Y1078 PolarHBondContact O-N 3.49Å
1075	S	77	Confident	77.8	Confident	48 Å²	48	63.7 Å²	63.7	34%	0.336	31%	0.314	S	S	.	.	H	α-helix	trans	-58.6	-48.6	174.6	36.2	0	0	0	0	113	A1071 E1072 L1077 Y1078 E1079	A1071-S1075 PolarHBondContact O-N 3.28Å; A1071-S1075 PolarHBondContact O-OG 3.47Å; E1072-S1075 WeakPolarHBondContact CA-OG 3.48Å; E1072-S1075 PolarHBondContact O-N 3.38Å; E1072-S1075 PolarHBondContact O-OG 2.96Å; S1075-L1077 PolarHBondContact O-N 3.35Å; S1075-Y1078 PolarHBondContact O-N 3.21Å; S1075-Y1078 VanDerWaalsContact O-N 3.15Å; S1075-E1079 WeakPolarHBondContact O-CB 3.44Å; S1075-E1079 WeakPolarHBondContact O-CG 3.43Å; S1075-E1079 PolarHBondContact O-N 2.92Å
1076	Y	76.2	Confident	77	Confident	41 Å²	41	60.4 Å²	60.4	16%	0.161	30%	0.299	C	S	.	.	H	α-helix	trans	-61.7	-25.5	178	-76.9	-61.8	0	0	0	113.7	V949 K952 E1072 L1073 D1080	V949-Y1076 HydrophobicContact CG1-CD2 4.42Å; V949-Y1076 HydrophobicContact CG2-CG 4.32Å; K952-Y1076 HydrophobicContact CD-CE2 4.31Å; K952-Y1076 WeakPolarHBondContact CE-OH 3.44Å; K952-Y1076 PolarHBondContact NZ-OH 3.23Å; E1072-Y1076 WeakPolarHBondContact O-CD2 3.46Å; E1072-Y1076 PolarHBondContact O-N 2.98Å; L1073-Y1076 PolarHBondContact O-N 3.23Å; Y1076-D1080 WeakPolarHBondContact O-CA 3.35Å; Y1076-D1080 WeakPolarHBondContact O-CB 3.37Å; Y1076-D1080 PolarHBondContact O-N 2.9Å
1077	L	73.6	Confident	75.7	Confident	16 Å²	16	64.5 Å²	64.5	8%	0.084	32%	0.318	C	S	.	.	H	α-helix	trans	-80.1	-21.4	177.5	-80.1	164.1	0	0	0	114.4	W1011 F1015 L1073 K1074 S1075 L1081	W1011-L1077 HydrophobicContact CE3-CD2 4.1Å; W1011-L1077 HydrophobicContact CH2-CD2 3.38Å; W1011-L1077 HydrophobicContact CH2-CG 3.64Å; W1011-L1077 HydrophobicContact CZ2-CD2 3.97Å; W1011-L1077 HydrophobicContact CZ2-CG 4.41Å; W1011-L1077 HydrophobicContact CZ3-CD2 3.45Å; W1011-L1077 VanDerWaalsContact CZ3-CD2 3.45Å; W1011-L1077 HydrophobicContact CZ3-CG 4.02Å; F1015-L1077 HydrophobicContact CD2-CB 4.37Å; F1015-L1077 HydrophobicContact CD2-CD1 3.66Å; F1015-L1077 HydrophobicContact CE2-CD1 3.74Å; L1073-L1077 HydrophobicContact CD1-CD1 4.12Å; L1073-L1077 HydrophobicContact CD1-CG 4.32Å; L1073-L1077 HydrophobicContact CD2-CD1 4.42Å; L1073-L1077 HydrophobicContact CG-CD1 3.81Å; L1073-L1077 HydrophobicContact CG-CG 4.45Å; L1073-L1077 WeakPolarHBondContact O-CB 3.43Å; L1073-L1077 WeakPolarHBondContact O-CG 3.46Å; L1073-L1077 PolarHBondContact O-N 3.09Å; K1074-L1077 PolarHBondContact O-N 2.84Å; S1075-L1077 PolarHBondContact O-N 3.35Å; L1077-L1081 HydrophobicContact CD2-CD1 4.14Å; L1077-L1081 HydrophobicContact CD2-CD2 4.49Å; L1077-L1081 WeakPolarHBondContact O-CB 3.33Å
1078	Y	68.2	Low	73.8	Confident	130 Å²	130	63.1 Å²	63.1	51%	0.51	32%	0.32	S	S	.	.	H	α-helix	trans	-91.6	-17.2	167.6	-63.6	-86.2	0	0	0	112.7	F1015 E1017 K1074 S1075	F1015-Y1078 HydrophobicContact CD1-CE2 4.42Å; F1015-Y1078 HydrophobicContact CE1-CE2 4.02Å; F1015-Y1078 AromaticContact CE1-CZ 3.95Å; F1015-Y1078 WeakPolarHBondContact CE1-OH 3.38Å; E1017-Y1078 PolarHBondContact OE1-OH 3.48Å; K1074-Y1078 HydrophobicContact CD-CE2 4.19Å; K1074-Y1078 VanDerWaalsContact CE-CE2 3.45Å; K1074-Y1078 VanDerWaalsContact CE-OH 3.31Å; K1074-Y1078 WeakPolarHBondContact CE-OH 3.41Å; K1074-Y1078 HydrophobicContact CG-CD2 4.17Å; K1074-Y1078 HydrophobicContact CG-CE2 3.6Å; K1074-Y1078 WeakPolarHBondContact O-CD2 3.48Å; K1074-Y1078 PolarHBondContact O-N 3.49Å; S1075-Y1078 PolarHBondContact O-N 3.21Å; S1075-Y1078 VanDerWaalsContact O-N 3.15Å
1079	E	66.8	Low	71.9	Confident	145 Å²	145	56.3 Å²	56.3	68%	0.678	30%	0.302	S	S	*	.	H	α-helix	trans	-97.2	-42.3	-177.9	-70.5	175	-168	0	0	113.8	S1075	S1075-E1079 WeakPolarHBondContact O-CB 3.44Å; S1075-E1079 WeakPolarHBondContact O-CG 3.43Å; S1075-E1079 PolarHBondContact O-N 2.92Å
1080	D	65.2	Low	69.4	Low	90 Å²	90	64 Å²	64	48%	0.481	34%	0.338	S	S	.	.	S	Bend	trans	-125.4	10.9	-164.2	-84.8	-31.8	0	0	0	114.2	W1011 Y1076 S1082	W1011-D1080 PolarHBondContact NE1-O 3.31Å; Y1076-D1080 WeakPolarHBondContact O-CA 3.35Å; Y1076-D1080 WeakPolarHBondContact O-CB 3.37Å; Y1076-D1080 PolarHBondContact O-N 2.9Å; D1080-S1082 PolarHBondContact O-N 3.28Å
1081	L	66	Low	66.7	Low	33 Å²	33	68.9 Å²	68.9	17%	0.173	37%	0.366	C	S	.	.			trans	-70.9	114	179.9	178.3	60.5	0	0	0	111.5	W1011 L1077 F1083 N1084	W1011-L1081 HydrophobicContact CD2-CD1 4.23Å; W1011-L1081 HydrophobicContact CG-CD1 4.32Å; L1077-L1081 HydrophobicContact CD2-CD1 4.14Å; L1077-L1081 HydrophobicContact CD2-CD2 4.49Å; L1077-L1081 WeakPolarHBondContact O-CB 3.33Å; L1081-F1083 VanDerWaalsContact C-N 3.3Å; L1081-F1083 PolarHBondContact O-N 3.45Å; L1081-N1084 HydrophobicContact CD2-CB 3.88Å
1082	S	68.2	Low	64.3	Low	44 Å²	44	75.9 Å²	75.9	31%	0.308	38%	0.381	S	S	.	.	S	Bend	trans	-61.5	-33.8	-171.2	-50.4	0	0	0	0	114.3	D1010 W1011 D1080	D1010-S1082 WeakPolarHBondContact CA-OG 3.04Å; D1010-S1082 WeakPolarHBondContact CB-OG 3.48Å; D1010-S1082 VanDerWaalsContact OD1-CB 3.25Å; D1010-S1082 WeakPolarHBondContact OD1-CB 3.3Å; D1010-S1082 PolarHBondContact OD1-OG 2.9Å; W1011-S1082 PolarHBondContact N-OG 3.01Å; W1011-S1082 VanDerWaalsContact O-CB 3.31Å; W1011-S1082 WeakPolarHBondContact O-CB 3.44Å; W1011-S1082 PolarHBondContact O-N 3.48Å; D1080-S1082 PolarHBondContact O-N 3.28Å
1083	F	73.9	Confident	61.9	Low	33 Å²	33	81.6 Å²	81.6	15%	0.145	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	126.6	168.5	-164.8	-98.8	0	0	0	111.9	V996 V1003 A1004 L1006 F1012 L1081 I1085	V996-F1083 HydrophobicContact CG1-CD1 4.06Å; V996-F1083 HydrophobicContact CG1-CE1 3.65Å; V996-F1083 HydrophobicContact CG1-CZ 4.06Å; V996-F1083 HydrophobicContact CG2-CD1 4.46Å; V1003-F1083 HydrophobicContact CB-CZ 4.48Å; V1003-F1083 HydrophobicContact CG1-CE2 3.78Å; V1003-F1083 HydrophobicContact CG1-CZ 3.92Å; A1004-F1083 HydrophobicContact CB-CD2 3.64Å; A1004-F1083 HydrophobicContact CB-CE2 3.94Å; A1004-F1083 HydrophobicContact CB-CG 4.28Å; L1006-F1083 HydrophobicContact CD2-CB 4.08Å; F1012-F1083 WeakPolarHBondContact CA-O 3.13Å; F1012-F1083 HydrophobicContact CB-CB 4.46Å; L1081-F1083 VanDerWaalsContact C-N 3.3Å; L1081-F1083 PolarHBondContact O-N 3.45Å; F1083-I1085 HydrophobicContact CD1-CG1 4.2Å
1084	N	77.1	Confident	59.2	Low	33 Å²	33	85.6 Å²	85.6	18%	0.176	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	111.3	171.7	-174.8	-1.4	0	0	0	109.9	L1081 Q1086 E1087	L1081-N1084 HydrophobicContact CD2-CB 3.88Å; N1084-Q1086 PolarHBondContact O-N 3.07Å; N1084-Q1086 PolarHBondContact OD1-N 3.28Å; N1084-Q1086 VanDerWaalsContact OD1-N 3.14Å; N1084-E1087 HydrophobicContact CB-CB 4.18Å; N1084-E1087 HydrophobicContact CB-CG 3.94Å; N1084-E1087 PolarHBondContact O-N 2.91Å; N1084-E1087 VanDerWaalsContact O-N 3.16Å
1085	I	76.9	Confident	56.7	Low	1 Å²	1	89.7 Å²	89.7	1%	0.005	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	2.1	-176.4	-39	165.6	0	0	0	111.8	I977 L983 F1012 G1013 R1040 C1041 F1083	I977-I1085 HydrophobicContact CD1-CD1 3.79Å; L983-I1085 HydrophobicContact CD1-CB 3.81Å; L983-I1085 HydrophobicContact CD1-CD1 4.07Å; L983-I1085 HydrophobicContact CD1-CG1 4.49Å; L983-I1085 HydrophobicContact CD1-CG2 4.2Å; L983-I1085 HydrophobicContact CD2-CD1 3.95Å; F1012-I1085 HydrophobicContact CD2-CD1 4.01Å; G1013-I1085 WeakPolarHBondContact O-CG1 3.34Å; G1013-I1085 PolarHBondContact O-N 3.03Å; R1040-I1085 VanDerWaalsContact CB-O 3.27Å; R1040-I1085 WeakPolarHBondContact CB-O 3.4Å; R1040-I1085 PolarHBondContact N-O 3.21Å; C1041-I1085 HydrophobicContact CB-CG2 4.28Å; F1083-I1085 HydrophobicContact CD1-CG1 4.2Å
1086	Q	70	Confident	54.5	Low	65 Å²	65	94 Å²	94	30%	0.304	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	6.8	177	-156	-168.1	-23.6	0	0	113.3	A1014 I1037 N1084 V1089	A1014-Q1086 HydrophobicContact CB-CB 4.4Å; I1037-Q1086 HydrophobicContact CG2-CB 4.42Å; I1037-Q1086 HydrophobicContact CG2-CG 4.11Å; N1084-Q1086 PolarHBondContact O-N 3.07Å; N1084-Q1086 PolarHBondContact OD1-N 3.28Å; N1084-Q1086 VanDerWaalsContact OD1-N 3.14Å; Q1086-V1089 HydrophobicContact CG-CB 4.43Å; Q1086-V1089 HydrophobicContact CG-CG2 4.01Å; Q1086-V1089 VanDerWaalsContact O-CG2 3.31Å; Q1086-V1089 WeakPolarHBondContact O-CG2 3.39Å
1087	E	60	Low	52.2	Low	129 Å²	129	98.3 Å²	98.3	60%	0.603	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	144.1	-179.7	-109	165.1	-177.9	0	0	112.7	R1040 N1084	R1040-E1087 PolarHBondContact NH1-O 3.48Å; N1084-E1087 HydrophobicContact CB-CB 4.18Å; N1084-E1087 HydrophobicContact CB-CG 3.94Å; N1084-E1087 PolarHBondContact O-N 2.91Å; N1084-E1087 VanDerWaalsContact O-N 3.16Å
1088	G	46.3	Very low	50.1	Low	59 Å²	59	104.9 Å²	104.9	61%	0.608	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	25.4	-175.3	0	0	0	0	0	115.9	R1040	R1040-G1088 PolarHBondContact NH1-O 2.86Å
1089	V	43.4	Very low	48.1	Very low	78 Å²	78	104.4 Å²	104.4	47%	0.473	56%	0.559	S	S	.	*			trans	-95.5	4.7	174.3	173.1	0	0	0	0	113.1	Q1086 N1091	Q1086-V1089 HydrophobicContact CG-CB 4.43Å; Q1086-V1089 HydrophobicContact CG-CG2 4.01Å; Q1086-V1089 VanDerWaalsContact O-CG2 3.31Å; Q1086-V1089 WeakPolarHBondContact O-CG2 3.39Å; V1089-N1091 PolarHBondContact O-N 3.48Å
1090	E	35.3	Very low	46.3	Very low	169 Å²	169	103.3 Å²	103.3	79%	0.79	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	130.8	175.4	-63.3	-170.1	163	0	0	112.1
1091	N	29.4	Very low	44.4	Very low	141 Å²	141	104.4 Å²	104.4	75%	0.754	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.4	33.6	173.9	-47.2	-70.1	0	0	0	119.3	V1089	V1089-N1091 PolarHBondContact O-N 3.48Å
1092	Y	32.2	Very low	42.6	Very low	210 Å²	210	107.4 Å²	107.4	82%	0.824	60%	0.604	S	S	*	*			trans	-121.4	11.2	161.1	-81.1	-78.7	0	0	0	115.9	S1094	Y1092-S1094 PolarHBondContact O-N 3.46Å; Y1092-S1094 VanDerWaalsContact O-N 3.13Å
1093	L	30.6	Very low	40.8	Very low	186 Å²	186	113.3 Å²	113.3	97%	0.974	63%	0.63	S	S	*	*			trans	-84.9	60.7	163.4	-96.1	83.2	0	0	0	111.7
1094	S	28.9	Very low	38.5	Very low	87 Å²	87	117.5 Å²	117.5	61%	0.608	66%	0.659	S	S	*	*	S	Bend	trans	-148.1	105.5	162.5	61.5	0	0	0	0	110.5	Y1092	Y1092-S1094 PolarHBondContact O-N 3.46Å; Y1092-S1094 VanDerWaalsContact O-N 3.13Å
1095	N	26.8	Very low	36.1	Very low	146 Å²	146	123 Å²	123	78%	0.781	69%	0.688	S	S	*	*	S	Bend	trans	80.3	155.4	177.2	-48.9	-27.4	0	0	0	117.2
1096	D	30.6	Very low	33.7	Very low	137 Å²	137	131 Å²	131	73%	0.733	73%	0.725	S	S	*	*			trans	63.5	82.2	164.6	-58.8	-1.7	0	0	0	117.9
1097	V	27.3	Very low	31.5	Very low	133 Å²	133	135.3 Å²	135.3	81%	0.806	75%	0.749	S	S	*	*			trans	-65.5	127.8	160.7	173.4	0	0	0	0	110.5
1098	I	28.8	Very low	29.8	Very low	154 Å²	154	133.1 Å²	133.1	79%	0.79	75%	0.753	S	S	*	*			trans	-153.7	134.4	144.4	-95.4	138	0	0	0	108.6	V1100	I1098-V1100 HydrophobicContact CG2-CG2 4.37Å
1099	T	26.5	Very low	29	Very low	120 Å²	120	137.8 Å²	137.8	74%	0.736	76%	0.764	S	S	*	*			trans	-130.9	119.9	174	53.7	0	0	0	0	110.3
1100	V	28.5	Very low	28.3	Very low	122 Å²	122	141 Å²	141	74%	0.739	78%	0.779	S	S	*	*			trans	-131.1	136.3	170.6	-172.3	0	0	0	0	108.7	I1098	I1098-V1100 HydrophobicContact CG2-CG2 4.37Å
1101	P	26.2	Very low	27.9	Very low	113 Å²	113	140.4 Å²	140.4	73%	0.734	78%	0.776	S	S	*	*			trans	-102.9	151.2	-171.4	37.8	-34.6	0	0	0	115.4
1102	A	28.3	Very low	27.8	Very low	96 Å²	96	140.9 Å²	140.9	79%	0.793	77%	0.771	S	S	*	*			trans	20.2	123.1	151.5	0	0	0	0	0	121.2
1103	I	29.7	Very low	27.6	Very low	167 Å²	167	136.8 Å²	136.8	86%	0.856	76%	0.763	S	S	*	*			trans	-154.8	162.5	145.5	-108.5	155.6	0	0	0	112.1
1104	T	25.3	Very low	27.4	Very low	121 Å²	121	138.8 Å²	138.8	74%	0.742	76%	0.758	S	S	*	*			trans	-33	119.8	168.1	68.7	0	0	0	0	126.9
1105	L	26.2	Very low	27.2	Very low	150 Å²	150	142.8 Å²	142.8	79%	0.785	77%	0.767	S	S	*	*			trans	63.6	166.9	149.6	-64.2	152.9	0	0	0	115.7
1106	Q	26.8	Very low	27.2	Very low	168 Å²	168	139.3 Å²	139.3	79%	0.785	77%	0.766	S	S	*	*			cis	-146.7	169.8	9	-149.4	160.3	23.1	0	0	112.9
1107	L	24.2	Very low	27	Very low	156 Å²	156	138.3 Å²	138.3	82%	0.817	77%	0.77	S	S	*	*			trans	-45.7	148.6	-176	-70.4	147	0	0	0	119.7
1108	A	25.4	Very low	26.9	Very low	82 Å²	82	140.5 Å²	140.5	68%	0.678	77%	0.771	S	S	*	*			trans	64.7	119.9	139.1	0	0	0	0	0	121.4
1109	N	28.8	Very low	26.9	Very low	157 Å²	157	139.5 Å²	139.5	84%	0.84	77%	0.772	S	S	*	*				-168.7	167.8	104.6	-92	-11.3	0	0	0	112
1110	D	29.4	Very low	26.9	Very low	147 Å²	147	141.6 Å²	141.6	79%	0.786	77%	0.771	S	S	*	*			trans	-75.8	157	-162.2	-50.4	-67.7	0	0	0	116.6
1111	E	26.1	Very low	26.7	Very low	156 Å²	156	143 Å²	143	73%	0.729	77%	0.774	S	S	*	*			trans	17.1	111.3	141.1	-70.5	-170.9	-177.8	0	0	117.5
1112	K	27.2	Very low	26.7	Very low	151 Å²	151	144.1 Å²	144.1	66%	0.657	77%	0.774	S	S	*	*				178.7	152.4	77.1	-106.4	155.5	-171.1	97.4	0	115.4
1113	D	28	Very low	26.7	Very low	123 Å²	123	145.7 Å²	145.7	66%	0.658	77%	0.773	S	S	*	*			trans	64	146.3	143.5	-51.2	-23.9	0	0	0	123.9
1114	W	27	Very low	26.5	Very low	228 Å²	228	144.7 Å²	144.7	86%	0.864	77%	0.768	S	S	*	*			trans	87.1	136	160.1	-62.8	106.8	0	0	0	121.4
1115	E	23.9	Very low	26.5	Very low	171 Å²	171	145.4 Å²	145.4	80%	0.799	77%	0.767	S	S	*	*			trans	-91.5	148.2	-162.8	-55.7	163.1	109.9	0	0	113.1
1116	G	26.4	Very low	26.5	Very low	74 Å²	74	145.4 Å²	145.4	76%	0.763	77%	0.768	S	S	*	*			trans	72.6	106.3	135.1	0	0	0	0	0	119.7
1117	S	26.9	Very low	26.7	Very low	116 Å²	116	142.6 Å²	142.6	81%	0.811	76%	0.762	S	S	*	*				-172.6	138.6	110.9	36.1	0	0	0	0	112.4
1118	E	24.9	Very low	26.8	Very low	178 Å²	178	144.9 Å²	144.9	83%	0.832	77%	0.769	S	S	*	*			trans	-82.2	136.5	166.5	-61.5	-177	133.1	0	0	110.5
1119	T	29.2	Very low	26.9	Very low	133 Å²	133	145.3 Å²	145.3	82%	0.816	77%	0.767	S	S	*	*			trans	-128.4	100.9	161.7	46.3	0	0	0	0	110.4
1120	K	25.7	Very low	26.8	Very low	165 Å²	165	145.3 Å²	145.3	72%	0.717	77%	0.766	S	S	*	*			trans	-61.6	140.5	167.3	-60	-173.6	177.4	-162.5	0	109.6
1121	L	24.5	Very low	26.8	Very low	152 Å²	152	147.6 Å²	147.6	80%	0.796	77%	0.769	S	S	*	*			trans	-151.9	134.8	150.8	-140	74.5	0	0	0	113.3
1122	N	27.6	Very low	27	Very low	135 Å²	135	145.6 Å²	145.6	72%	0.722	77%	0.77	S	S	*	*			trans	52.9	107.3	158.4	-62.3	-7.2	0	0	0	120.4	I1124	N1122-I1124 PolarHBondContact O-N 2.98Å
1123	V	26.5	Very low	27	Very low	129 Å²	129	143.6 Å²	143.6	78%	0.782	77%	0.772	S	S	*	*			trans	-55.9	128.6	148.9	176	0	0	0	0	109.6
1124	I	26.4	Very low	27	Very low	147 Å²	147	147 Å²	147	75%	0.754	78%	0.781	S	S	*	*			trans	-123.9	127.5	153.7	-64.3	179.6	0	0	0	105.6	N1122	N1122-I1124 PolarHBondContact O-N 2.98Å
1125	N	25.2	Very low	27.3	Very low	135 Å²	135	145.2 Å²	145.2	72%	0.722	78%	0.78	S	S	*	*			trans	-74.8	126.2	169.3	-43.3	-62.8	0	0	0	106.8
1126	D	26.6	Very low	27.6	Very low	150 Å²	150	143.5 Å²	143.5	80%	0.802	78%	0.781	S	S	*	*			trans	163.6	75.6	155.3	-83.5	-20.3	0	0	0	110.9
1127	V	29.9	Very low	27.8	Very low	110 Å²	110	146.6 Å²	146.6	67%	0.667	77%	0.773	S	S	*	*			trans	-143	73.6	170.2	-165.8	0	0	0	0	111.8	L1130	V1127-L1130 HydrophobicContact CG1-CD1 3.94Å
1128	E	26.9	Very low	28.2	Very low	203 Å²	203	144.8 Å²	144.8	95%	0.949	76%	0.755	S	S	*	*			trans	-92.1	17.9	165.1	-157.5	163.9	-150.4	0	0	111.5
1129	S	27.7	Very low	28.7	Very low	92 Å²	92	144.7 Å²	144.7	64%	0.643	76%	0.76	S	S	*	*			trans	-132.6	34	-147.7	49.2	0	0	0	0	115.6
1130	L	26.7	Very low	29	Very low	156 Å²	156	146.8 Å²	146.8	82%	0.817	76%	0.757	S	S	*	*			trans	-133.7	93.4	174.5	-96.5	145.1	0	0	0	112.7	V1127	V1127-L1130 HydrophobicContact CG1-CD1 3.94Å
1131	K	29.9	Very low	29.2	Very low	195 Å²	195	141.7 Å²	141.7	85%	0.848	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-96.8	142.9	168.3	-73.2	165.6	-175.6	148.6	0	109.8
1132	P	30.2	Very low	29.6	Very low	115 Å²	115	143.4 Å²	143.4	75%	0.747	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-66.1	148.1	179.5	27.6	-35	0	0	0	111.9
1133	P	27.9	Very low	29.7	Very low	109 Å²	109	142 Å²	142	71%	0.708	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-66.1	136.4	-173.4	26.3	-34.9	0	0	0	112.4
1134	K	28	Very low	29.7	Very low	195 Å²	195	141.3 Å²	141.3	85%	0.848	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-89.5	122.5	171.3	-74.1	178.1	179.4	169.9	0	110.1	V1136	K1134-V1136 PolarHBondContact O-N 3.3Å
1135	F	32.6	Very low	29.9	Very low	189 Å²	189	139.8 Å²	139.8	83%	0.829	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-67.5	118.5	165.2	-66.7	-86.7	0	0	0	109.9	F1137	F1135-F1137 HydrophobicContact CB-CE2 4.36Å
1136	V	28.9	Very low	29.9	Very low	136 Å²	136	141.4 Å²	141.4	82%	0.824	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-103.9	124.4	168.7	-178.9	0	0	0	0	107.6	K1134	K1134-V1136 PolarHBondContact O-N 3.3Å
1137	F	31	Very low	30.2	Very low	139 Å²	139	140.1 Å²	140.1	61%	0.61	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-94.3	145.4	171	-68.6	-90.8	0	0	0	109.2	F1135	F1135-F1137 HydrophobicContact CB-CE2 4.36Å
1138	D	34.9	Very low	30.2	Very low	78 Å²	78	140.9 Å²	140.9	42%	0.417	76%	0.761	S	S	.	*	P	Polyproline II helix	trans	-72.3	164.7	166	85.5	-26.3	0	0	0	110.9	K1140 G1141 R1142	D1138-K1140 PolarHBondContact O-N 2.88Å; D1138-K1140 VanDerWaalsContact OD1-C 3.24Å; D1138-K1140 WeakPolarHBondContact OD1-CA 3.19Å; D1138-K1140 PolarHBondContact OD1-N 3.45Å; D1138-K1140 VanDerWaalsContact OD1-N 3.1Å; D1138-G1141 PolarHBondContact O-N 3.04Å; D1138-G1141 PolarHBondContact OD1-N 2.95Å; D1138-R1142 PolarHBondContact OD1-N 2.85Å
1139	N	36.4	Very low	30.3	Very low	175 Å²	175	138.4 Å²	138.4	94%	0.936	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	12.3	177.7	-72.3	-19.8	0	0	0	113.7
1140	K	34.5	Very low	30.7	Very low	177 Å²	177	137.5 Å²	137.5	77%	0.77	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.4	6.1	177	-62.7	-177.5	178.5	177.1	0	113.3	D1138	D1138-K1140 PolarHBondContact O-N 2.88Å; D1138-K1140 VanDerWaalsContact OD1-C 3.24Å; D1138-K1140 WeakPolarHBondContact OD1-CA 3.19Å; D1138-K1140 PolarHBondContact OD1-N 3.45Å; D1138-K1140 VanDerWaalsContact OD1-N 3.1Å
1141	G	31.7	Very low	30.9	Very low	58 Å²	58	138.4 Å²	138.4	60%	0.598	73%	0.732	S	S	*	*			trans	72.2	28.6	172.9	0	0	0	0	0	115.5	D1138	D1138-G1141 PolarHBondContact O-N 3.04Å; D1138-G1141 PolarHBondContact OD1-N 2.95Å
1142	R	31.7	Very low	31.3	Very low	189 Å²	189	138.2 Å²	138.2	71%	0.713	73%	0.734	S	S	*	*			trans	-107.5	149.4	178.7	-60.7	-175.1	-176.1	-172.7	1.2	111.7	D1138	D1138-R1142 PolarHBondContact OD1-N 2.85Å
1143	S	29.2	Very low	31.7	Very low	105 Å²	105	135.5 Å²	135.5	73%	0.734	72%	0.718	S	S	*	*			trans	-122.8	114.5	-176.3	56.8	0	0	0	0	111.6
1144	C	28	Very low	31.9	Very low	115 Å²	115	132.8 Å²	132.8	78%	0.777	71%	0.71	S	S	*	*			trans	-141.4	136.6	177.7	-71.8	0	0	0	0	112.1
1145	S	29.3	Very low	32	Very low	115 Å²	115	128.8 Å²	128.8	80%	0.804	70%	0.697	S	S	*	*			trans	55.1	136.4	156.6	48.6	0	0	0	0	120.2
1146	L	27	Very low	31.9	Very low	169 Å²	169	125.4 Å²	125.4	89%	0.885	69%	0.687	S	S	*	*			trans	-82.8	135.5	178.5	-146.5	77.7	0	0	0	111.3
1147	T	30.9	Very low	32	Very low	122 Å²	122	125.7 Å²	125.7	75%	0.748	68%	0.683	S	S	*	*			trans	-139.5	145.5	161.9	51.2	0	0	0	0	109.9
1148	T	31	Very low	31.9	Very low	127 Å²	127	124.6 Å²	124.6	78%	0.779	69%	0.689	S	S	*	*			trans	-105.4	139.8	177.5	46	0	0	0	0	110.3
1149	Y	28.9	Very low	31.6	Very low	151 Å²	151	132 Å²	132	59%	0.592	71%	0.713	S	S	*	*			trans	-98.6	132.5	175.4	-170.5	-99.9	0	0	0	109.1	E1151 L1156	Y1149-E1151 HydrophobicContact CD1-CG 3.92Å; Y1149-E1151 HydrophobicContact CE1-CG 4.09Å; Y1149-L1156 HydrophobicContact CD2-CD2 3.92Å; Y1149-L1156 HydrophobicContact CD2-CG 4.14Å; Y1149-L1156 HydrophobicContact CE2-CG 4.33Å
1150	D	35.6	Very low	31.3	Very low	73 Å²	73	127.5 Å²	127.5	39%	0.39	70%	0.7	S	S	.	*			trans	-99.3	121.3	172.1	170.8	28.4	0	0	0	109.2	E1152 S1153	D1150-E1152 PolarHBondContact OD1-N 2.96Å; D1150-S1153 WeakPolarHBondContact OD2-CB 3.4Å; D1150-S1153 PolarHBondContact OD2-N 3.41Å; D1150-S1153 VanDerWaalsContact OD2-N 3.16Å; D1150-S1153 PolarHBondContact OD2-OG 2.79Å
1151	E	32.3	Very low	30.9	Very low	175 Å²	175	126.5 Å²	126.5	82%	0.818	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-15	-177.6	-65.6	-170.3	155.6	0	0	112.8	Y1149	Y1149-E1151 HydrophobicContact CD1-CG 3.92Å; Y1149-E1151 HydrophobicContact CE1-CG 4.09Å
1152	E	36.8	Very low	30.7	Very low	190 Å²	190	131.4 Å²	131.4	89%	0.888	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-36.5	-178.7	-63.8	-159.6	139.4	0	0	114	D1150	D1150-E1152 PolarHBondContact OD1-N 2.96Å
1153	S	40.2	Very low	30.2	Very low	59 Å²	59	133 Å²	133	41%	0.413	72%	0.722	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.9	-20.4	179.4	68.1	0	0	0	0	114.9	D1150 L1155	D1150-S1153 WeakPolarHBondContact OD2-CB 3.4Å; D1150-S1153 PolarHBondContact OD2-N 3.41Å; D1150-S1153 VanDerWaalsContact OD2-N 3.16Å; D1150-S1153 PolarHBondContact OD2-OG 2.79Å; S1153-L1155 PolarHBondContact O-N 3.3Å; S1153-L1155 VanDerWaalsContact O-N 3.16Å
1154	G	30.2	Very low	30	Very low	52 Å²	52	132.8 Å²	132.8	54%	0.536	72%	0.721	S	S	.	*			trans	65.1	10.3	-176.8	0	0	0	0	0	115.1
1155	L	31.1	Very low	29.8	Very low	110 Å²	110	134.3 Å²	134.3	58%	0.576	72%	0.721	S	S	*	*			trans	-110.1	132.2	-179	-104.7	98.6	0	0	0	112.3	S1153 I1157	S1153-L1155 PolarHBondContact O-N 3.3Å; S1153-L1155 VanDerWaalsContact O-N 3.16Å; L1155-I1157 PolarHBondContact O-N 3.4Å
1156	L	30.1	Very low	29.6	Very low	119 Å²	119	133.4 Å²	133.4	62%	0.623	71%	0.714	S	S	*	*			trans	-86.2	104	168.1	-82.7	164.7	0	0	0	109.9	Y1149 P1158	Y1149-L1156 HydrophobicContact CD2-CD2 3.92Å; Y1149-L1156 HydrophobicContact CD2-CG 4.14Å; Y1149-L1156 HydrophobicContact CE2-CG 4.33Å; L1156-P1158 WeakPolarHBondContact O-CD 3.34Å
1157	I	31.5	Very low	29.4	Very low	142 Å²	142	133.6 Å²	133.6	73%	0.728	71%	0.711	S	S	*	*			trans	-91	116.5	176.2	-55.6	177.9	0	0	0	109.4	L1155	L1155-I1157 PolarHBondContact O-N 3.4Å
1158	P	28.5	Very low	29.1	Very low	115 Å²	115	134.7 Å²	134.7	75%	0.747	71%	0.71	S	S	*	*			trans	-82.8	121.7	177.5	31.9	-31.9	0	0	0	110.9	L1156 A1160	L1156-P1158 WeakPolarHBondContact O-CD 3.34Å; P1158-A1160 PolarHBondContact O-N 2.62Å
1159	Y	28.7	Very low	28.8	Very low	233 Å²	233	132.8 Å²	132.8	91%	0.914	71%	0.708	S	S	*	*			trans	-82.6	113.8	171.8	-143.3	-82.1	0	0	0	110.2
1160	A	30.3	Very low	28.6	Very low	81 Å²	81	132.9 Å²	132.9	67%	0.669	72%	0.717	S	S	*	*			trans	-79.2	155.3	176	0	0	0	0	0	111.4	P1158	P1158-A1160 PolarHBondContact O-N 2.62Å
1161	N	25.5	Very low	28.2	Very low	157 Å²	157	135.3 Å²	135.3	84%	0.84	73%	0.734	S	S	*	*			trans	-61.6	146.9	163.9	-69.8	-55.4	0	0	0	109.6
1162	D	27.2	Very low	27.9	Very low	160 Å²	160	136.4 Å²	136.4	86%	0.856	74%	0.736	S	S	*	*				-142.8	166	125.5	-133.5	-34.2	0	0	0	112.5
1163	R	23.1	Very low	27.6	Very low	223 Å²	223	132 Å²	132	84%	0.842	72%	0.724	S	S	*	*			trans	-100.6	170.4	-172.2	-76	173.5	163.1	170.8	-6.1	112.5
1164	S	24.3	Very low	27	Very low	101 Å²	101	136.9 Å²	136.9	71%	0.706	75%	0.745	S	S	*	*			trans	89.4	119.6	152.6	78.3	0	0	0	0	119
1165	N	23.9	Very low	26.9	Very low	147 Å²	147	138.7 Å²	138.7	79%	0.786	75%	0.749	S	S	*	*				65.6	141.1	126.7	-56.8	-0	0	0	0	122.7
1166	S	24.3	Very low	26.7	Very low	95 Å²	95	139.1 Å²	139.1	66%	0.664	76%	0.757	S	S	*	*			trans	68	105.1	141.6	52.1	0	0	0	0	122.1
1167	E	22.7	Very low	26.5	Very low	174 Å²	174	144.6 Å²	144.6	81%	0.813	77%	0.769	S	S	*	*				77.2	159.4	121.4	-63.6	-175.9	133.1	0	0	122.2
1168	I	24.2	Very low	26.3	Very low	144 Å²	144	144.1 Å²	144.1	74%	0.738	77%	0.773	S	S	*	*			trans	62.9	98.1	169.1	-53.7	124.2	0	0	0	114.8
1169	A	24.6	Very low	26.1	Very low	88 Å²	88	147.9 Å²	147.9	73%	0.727	78%	0.778	S	S	*	*			cis	70.7	129.7	48.9	0	0	0	0	0	115.6
1170	I	26	Very low	26.1	Very low	153 Å²	153	142.8 Å²	142.8	79%	0.785	77%	0.773	S	S	*	*			trans	170.4	121	141.5	-88.5	154.7	0	0	0	113
1171	T	25.8	Very low	25.9	Very low	123 Å²	123	145 Å²	145	76%	0.755	78%	0.779	S	S	*	*			trans	25.9	126.6	157.7	63.4	0	0	0	0	123.2
1172	K	26.4	Very low	25.9	Very low	198 Å²	198	144.3 Å²	144.3	86%	0.861	77%	0.773	S	S	*	*				56.2	158.9	61	-100.7	-179.3	-176.8	177.6	0	115.8
1173	P	31.5	Very low	25.8	Very low	97 Å²	97	143.3 Å²	143.3	63%	0.63	77%	0.773	S	S	*	*			cis	-149.8	179.5	-7	40.2	-18.6	0	0	0	120.2
1174	L	27.1	Very low	26	Very low	163 Å²	163	135.8 Å²	135.8	85%	0.853	77%	0.765	S	S	*	*			trans	63.6	161.2	144.6	-95.3	72.7	0	0	0	122.2
1175	S	28.1	Very low	26.2	Very low	89 Å²	89	138.3 Å²	138.3	62%	0.622	77%	0.769	S	S	*	*			cis	-168.4	168.8	-9.3	59.2	0	0	0	0	117.7
1176	T	26.9	Very low	26.3	Very low	120 Å²	120	137.7 Å²	137.7	74%	0.736	77%	0.766	S	S	*	*			trans	79.6	124.7	141.1	40.3	0	0	0	0	127.9
1177	R	26.1	Very low	26.5	Very low	233 Å²	233	140.4 Å²	140.4	88%	0.879	77%	0.768	S	S	*	*			trans	63.3	158.6	141.8	-74.9	-175.2	168.1	178.1	-3.3	120.1
1178	T	27	Very low	26.8	Very low	133 Å²	133	139.4 Å²	139.4	82%	0.816	77%	0.767	S	S	*	*			cis	-154.3	178	6.6	-9.8	0	0	0	0	112.7
1179	K	25.4	Very low	26.8	Very low	194 Å²	194	135.5 Å²	135.5	84%	0.843	76%	0.762	S	S	*	*			trans	-108.1	153.6	175.3	-78	-173.6	177.3	-180	0	114.2
1180	P	28.4	Very low	27	Very low	125 Å²	125	143.4 Å²	143.4	81%	0.812	77%	0.773	S	S	*	*				-132.1	-149.4	127.9	37	-24.7	0	0	0	114
1181	T	25.2	Very low	26.9	Very low	128 Å²	128	142.9 Å²	142.9	79%	0.785	77%	0.767	S	S	*	*			trans	-158	179.5	-155.7	-25.5	0	0	0	0	114.4
1182	I	25.8	Very low	26.9	Very low	142 Å²	142	147.3 Å²	147.3	73%	0.728	78%	0.777	S	S	*	*			trans	102.1	123.9	149.3	-75	159.5	0	0	0	121.9
1183	T	25.6	Very low	26.8	Very low	139 Å²	139	147.6 Å²	147.6	85%	0.853	77%	0.772	S	S	*	*			trans	60.3	149.9	162.2	47	0	0	0	0	121.9
1184	G	26.8	Very low	26.5	Very low	66 Å²	66	147.3 Å²	147.3	68%	0.68	77%	0.773	S	S	*	*			cis	164.9	179.6	-8.6	0	0	0	0	0	115.6
1185	I	28.4	Very low	26.7	Very low	154 Å²	154	145.2 Å²	145.2	79%	0.79	77%	0.769	S	S	*	*			trans	85.5	105.1	156.3	-57.2	176.4	0	0	0	120.6
1186	N	26.3	Very low	26.6	Very low	134 Å²	134	145.6 Å²	145.6	72%	0.717	77%	0.772	S	S	*	*				55.1	157.9	128.1	-60.4	-7.5	0	0	0	122.9
1187	Q	29	Very low	26.6	Very low	151 Å²	151	147.8 Å²	147.8	71%	0.706	78%	0.778	S	S	*	*			cis	-167.2	167.8	1.8	-126.5	172.4	6.7	0	0	114.4
1188	I	27.4	Very low	26.5	Very low	153 Å²	153	141.6 Å²	141.6	79%	0.785	77%	0.77	S	S	*	*			trans	67.3	145	156.3	-61.6	154.7	0	0	0	116.4
1189	G	25.9	Very low	26.6	Very low	62 Å²	62	141.4 Å²	141.4	64%	0.639	77%	0.769	S	S	*	*			cis	175.7	150.3	-3.9	0	0	0	0	0	107.6
1190	W	27.6	Very low	26.4	Very low	254 Å²	254	140.8 Å²	140.8	96%	0.962	77%	0.766	S	S	*	*				-161.5	174.5	58.4	-88	82.7	0	0	0	112
1191	Q	23.5	Very low	26.3	Very low	142 Å²	142	145.7 Å²	145.7	66%	0.664	77%	0.77	S	S	*	*			trans	-110.2	160.1	-174.7	-62.3	-177.8	-14.1	0	0	114.9
1192	F	27.1	Very low	26.3	Very low	216 Å²	216	146.4 Å²	146.4	95%	0.947	77%	0.769	S	S	*	*			trans	-145.5	169.5	133	-108.8	-77.4	0	0	0	111.1
1193	R	24.1	Very low	26.2	Very low	204 Å²	204	144.1 Å²	144.1	77%	0.77	77%	0.765	S	S	*	*			trans	-123.9	146.8	-149.1	-79.7	-173.5	178.3	-169.2	0.3	118.4
1194	S	25.3	Very low	26.1	Very low	91 Å²	91	145.8 Å²	145.8	64%	0.636	76%	0.763	S	S	*	*			trans	-0.3	151.1	137.8	67.7	0	0	0	0	120.1
1195	P	30.2	Very low	25.9	Very low	120 Å²	120	153.5 Å²	153.5	78%	0.779	77%	0.773	S	S	*	*				-138.1	161.9	56.5	35.1	-16.3	0	0	0	116
1196	S	26.5	Very low	25.7	Very low	97 Å²	97	151 Å²	151	68%	0.678	77%	0.767	S	S	*	*			cis	98.1	105	12.7	83.6	0	0	0	0	118.4
1197	L	27.1	Very low	25.5	Very low	166 Å²	166	156.5 Å²	156.5	87%	0.869	78%	0.778	S	S	*	*			trans	-164.6	108.2	153.3	-121.7	70.6	0	0	0	104.8
1198	S	24.6	Very low	25.2	Very low	102 Å²	102	160.4 Å²	160.4	71%	0.713	79%	0.786	S	S	*	*				63.6	139.2	80.5	87.2	0	0	0	0	114.4
1199	T	27.6	Very low	25	Very low	129 Å²	129	161 Å²	161	79%	0.791	79%	0.79	S	S	*	*			cis	-140.5	154.4	19.9	45.1	0	0	0	0	115.3
1200	K	22.3	Very low	24.9	Very low	181 Å²	181	166.6 Å²	166.6	79%	0.787	80%	0.799	S	S	*	*			trans	-51.6	147.4	167.7	-53.7	166.9	176.6	177.8	0	114.7
1201	Y	26.7	Very low	24.9	Very low	228 Å²	228	158.9 Å²	158.9	89%	0.894	78%	0.784	S	S	*	*				-165.3	107.5	129.7	-87.3	-71.1	0	0	0	105.5
1202	L	24	Very low	25.1	Very low	144 Å²	144	158.2 Å²	158.2	75%	0.754	79%	0.79	S	S	*	*				75.2	107.4	54.5	-150.3	104.2	0	0	0	114.6
1203	S	23.4	Very low	25.2	Very low	93 Å²	93	153.3 Å²	153.3	65%	0.65	77%	0.774	S	S	*	*			trans	89	141.9	147	81.9	0	0	0	0	122
1204	H	24.5	Very low	25.3	Very low	175 Å²	175	148.1 Å²	148.1	81%	0.81	76%	0.756	S	S	*	*			trans	64.6	112.1	154.3	-66.2	-62.2	0	0	0	122.4
1205	Y	22.7	Very low	25.4	Very low	228 Å²	228	148 Å²	148	89%	0.894	75%	0.748	S	S	*	*			trans	-31.9	141.6	135.6	-85.9	-86.5	0	0	0	112.6
1206	P	24.1	Very low	25.3	Very low	101 Å²	101	146.1 Å²	146.1	66%	0.656	73%	0.734	S	S	*	*				-149.1	168.1	92.2	39.7	-24.4	0	0	0	116.1	R1208	P1206-R1208 PolarHBondContact O-N 3.1Å
1207	R	21.5	Very low	25.3	Very low	250 Å²	250	146.1 Å²	146.1	94%	0.943	73%	0.73	S	S	*	*			trans	-53.9	130.7	160.2	-64	176	176.8	177.1	-2.1	110
1208	R	23.2	Very low	25.2	Very low	233 Å²	233	147.5 Å²	147.5	88%	0.879	73%	0.729	S	S	*	*			trans	-132.7	106	162.5	-92.7	-170	175.3	179.1	0.5	112.8	P1206	P1206-R1208 PolarHBondContact O-N 3.1Å
1209	L	22.4	Very low	25.2	Very low	165 Å²	165	152.1 Å²	152.1	86%	0.864	73%	0.731	S	S	*	*			trans	-86.8	165	152.2	-112.7	152.9	0	0	0	108.4
1210	Q	25.2	Very low	25.1	Very low	179 Å²	179	155.5 Å²	155.5	84%	0.836	73%	0.729	S	S	*	*			trans	79.4	141.9	178.8	-54.3	-177.4	6.7	0	0	115.7
1211	S	26.8	Very low	25.1	Very low	92 Å²	92	155.7 Å²	155.7	64%	0.643	73%	0.73	S	S	*	*			cis	-168.8	172.3	-10.7	48.3	0	0	0	0	113.3
1212	T	27.8	Very low	25	Very low	128 Å²	128	152.9 Å²	152.9	79%	0.785	72%	0.723	S	S	*	*			trans	77.5	134.3	168.4	68.3	0	0	0	0	116.3
1213	D	28.2	Very low	25.1	Very low	114 Å²	114	152.2 Å²	152.2	61%	0.61	72%	0.719	S	S	*	*	S	Bend	cis	-122.4	153.9	6.7	-89.6	-18.3	0	0	0	111.1
1214	K	28	Very low	25.1	Very low	94 Å²	94	154.3 Å²	154.3	41%	0.409	72%	0.723	S	S	.	*			cis	-161.3	127.7	-3.7	-113.2	165.6	176.2	82.3	0	110.2
1215	I	26.6	Very low	25	Very low	89 Å²	89	154.9 Å²	154.9	46%	0.456	72%	0.723	S	S	.	*			trans	61.2	137.7	134.8	-57.6	173.3	0	0	0	117.9	E372 F373	E372-I1215 WeakPolarHBondContact CA-O 3.24Å; E372-I1215 WeakPolarHBondContact CB-O 3.3Å; E372-I1215 HydrophobicContact CG-CG2 4.13Å; E372-I1215 WeakPolarHBondContact CG-O 3.08Å; E372-I1215 WeakPolarHBondContact OE1-CG2 3.36Å; F373-I1215 VanDerWaalsContact CD2-O 3.25Å; F373-I1215 WeakPolarHBondContact CD2-O 3.48Å; F373-I1215 WeakPolarHBondContact CE2-O 3.45Å
1216	V	27.9	Very low	25.2	Very low	81 Å²	81	149.1 Å²	149.1	49%	0.491	72%	0.716	S	S	.	*			cis	-141.2	127.5	-14.1	118	0	0	0	0	109.6	E372 F373	E372-V1216 PolarHBondContact OE2-N 3.43Å; F373-V1216 VanDerWaalsContact CE2-N 3.29Å
1217	T	25.8	Very low	25.4	Very low	97 Å²	97	148.8 Å²	148.8	60%	0.595	72%	0.716	S	S	*	*				64.5	114	86.1	-34.2	0	0	0	0	118.9
1218	K	26.6	Very low	25.6	Very low	194 Å²	194	146.2 Å²	146.2	84%	0.843	71%	0.711	S	S	*	*			trans	129.3	148.2	146.6	-75.9	171.9	-176.1	171.2	0	113.3
1219	R	24.9	Very low	25.8	Very low	200 Å²	200	140.3 Å²	140.3	76%	0.755	71%	0.706	S	S	*	*			cis	-177.8	151.1	-34.7	-126.3	-176.2	-179.6	-179.5	1.5	107.5
1220	R	24.1	Very low	26.1	Very low	199 Å²	199	138.1 Å²	138.1	75%	0.751	70%	0.704	S	S	*	*			trans	67.4	112.2	150.1	-75.8	-174.6	171.2	178.8	-4.7	121
1221	F	23.4	Very low	26.1	Very low	185 Å²	185	132.6 Å²	132.6	81%	0.811	70%	0.695	S	S	*	*				68.9	159.7	115.7	-95.6	-89.6	0	0	0	122.9
1222	F	24.8	Very low	26	Very low	169 Å²	169	134.4 Å²	134.4	74%	0.741	71%	0.707	S	S	*	*			trans	74	102.8	163.2	-97.7	-99.6	0	0	0	120.1
1223	L	24.2	Very low	26	Very low	130 Å²	130	133 Å²	133	68%	0.681	70%	0.702	S	S	*	*				35.6	130.8	129.7	-62.5	-178.8	0	0	0	121.7
1224	L	23.4	Very low	26	Very low	138 Å²	138	132.7 Å²	132.7	72%	0.723	71%	0.709	S	S	*	*			trans	65.8	120.9	136.4	-69.1	167.2	0	0	0	120.6
1225	K	24	Very low	26	Very low	187 Å²	187	134.9 Å²	134.9	81%	0.813	73%	0.725	S	S	*	*			trans	73.2	131	141.2	-72.2	179.1	175.4	175.2	0	120.7
1226	S	25.3	Very low	26.1	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	74%	0.742	S	S	*	*			trans	88	150	134.3	-166	0	0	0	0	119.7
1227	S	29	Very low	26	Very low	95 Å²	95	140.7 Å²	140.7	66%	0.664	75%	0.753	S	S	*	*			trans	53.8	104.4	157	28.4	0	0	0	0	117.5
1228	K	26.2	Very low	26.1	Very low	195 Å²	195	143.1 Å²	143.1	85%	0.848	76%	0.761	S	S	*	*				65.2	131	74.1	-74	-174.7	173.6	176.7	0	114.6
1229	S	27.1	Very low	26.1	Very low	110 Å²	110	138.5 Å²	138.5	77%	0.769	75%	0.75	S	S	*	*			trans	65.2	157.5	156.5	30.2	0	0	0	0	118.1
1230	S	27.9	Very low	26.2	Very low	118 Å²	118	136 Å²	136	83%	0.825	75%	0.747	S	S	*	*			cis	-179.4	150.6	-31.2	52	0	0	0	0	109.5
1231	G	26.1	Very low	26.4	Very low	63 Å²	63	134.4 Å²	134.4	65%	0.649	75%	0.745	S	S	*	*			trans	108.1	145.4	175.7	0	0	0	0	0	111.8
1232	C	25.2	Very low	26.6	Very low	130 Å²	130	130.2 Å²	130.2	88%	0.878	74%	0.738	S	S	*	*			cis	102.6	144.2	47.3	-81.8	0	0	0	0	109.7
1233	S	26.5	Very low	26.8	Very low	98 Å²	98	130.1 Å²	130.1	69%	0.685	74%	0.738	S	S	*	*			cis	-175.8	133.9	-14.7	46.3	0	0	0	0	109.6
1234	S	30	Very low	27	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	74%	0.735	S	S	*	*			trans	172.1	152.7	155.8	32.8	0	0	0	0	109.7
1235	N	27.1	Very low	27.1	Very low	141 Å²	141	130 Å²	130	75%	0.754	73%	0.734	S	S	*	*			cis	-158.1	167.7	-18.1	-102.1	-11.7	0	0	0	107.6
1236	I	29.5	Very low	27.4	Very low	157 Å²	157	131.2 Å²	131.2	81%	0.805	74%	0.739	S	S	*	*			trans	69.6	121.9	170.6	-55.1	149.4	0	0	0	114.6
1237	D	25	Very low	27.5	Very low	135 Å²	135	131.4 Å²	131.4	72%	0.722	74%	0.741	S	S	*	*			cis	-160.8	173.5	-23.6	-134.1	-50.6	0	0	0	111.2
1238	L	28.5	Very low	27.4	Very low	147 Å²	147	132.7 Å²	132.7	77%	0.77	75%	0.747	S	S	*	*			trans	58.6	120.9	165.2	-61.8	167.6	0	0	0	118.8
1239	T	26.3	Very low	27.5	Very low	98 Å²	98	129.5 Å²	129.5	60%	0.601	75%	0.746	S	S	*	*			cis	-167.1	134.5	-23.3	1.6	0	0	0	0	108.8
1240	Q	26.8	Very low	27.4	Very low	148 Å²	148	129.2 Å²	129.2	69%	0.692	74%	0.744	S	S	*	*			trans	64.8	139.6	156.6	-56.5	-175.8	45.7	0	0	117.9
1241	K	29.1	Very low	27.4	Very low	165 Å²	165	131.1 Å²	131.1	72%	0.717	75%	0.745	S	S	*	*			cis	-160	136.9	0.2	-121.2	165.2	-174.7	156.6	0	110.8
1242	S	26.5	Very low	27.4	Very low	96 Å²	96	139.4 Å²	139.4	67%	0.671	76%	0.759	S	S	*	*			trans	30.8	146.5	137.5	60.8	0	0	0	0	121.7
1243	K	28.6	Very low	27.4	Very low	168 Å²	168	142 Å²	142	73%	0.73	76%	0.755	S	S	*	*			cis	-173.7	170.8	4.7	-112.4	-179.7	-177.1	-70.1	0	107
1244	E	29.6	Very low	27.3	Very low	132 Å²	132	143 Å²	143	62%	0.617	76%	0.759	S	S	*	*			cis	-147.7	157.6	-0.9	-170.5	79.8	-73.7	0	0	108.9
1245	N	25.6	Very low	27.1	Very low	133 Å²	133	145 Å²	145	71%	0.711	76%	0.76	S	S	*	*			trans	-63.6	154	173.9	-54.5	-71.1	0	0	0	117.8
1246	K	29.2	Very low	27	Very low	212 Å²	212	146 Å²	146	92%	0.922	76%	0.76	S	S	*	*				-169	155.5	114.4	-100.6	151.8	-172.4	167.9	0	113.6
1247	S	27.4	Very low	26.9	Very low	111 Å²	111	144.7 Å²	144.7	78%	0.776	75%	0.753	S	S	*	*			trans	-117.9	162.9	-160.7	47.1	0	0	0	0	114.6
1248	P	27.6	Very low	26.8	Very low	122 Å²	122	144.1 Å²	144.1	79%	0.792	75%	0.75	S	S	*	*			trans	-91.6	166	-176.5	37.5	-37	0	0	0	113.9
1249	P	27.2	Very low	26.8	Very low	127 Å²	127	143.1 Å²	143.1	83%	0.825	74%	0.742	S	S	*	*			trans	-123.2	162.4	155.1	38.2	-27.1	0	0	0	113.4
1250	S	25.9	Very low	26.7	Very low	105 Å²	105	144.3 Å²	144.3	73%	0.734	75%	0.749	S	S	*	*			trans	-76.1	154.1	-180	53.4	0	0	0	0	114.8
1251	N	27.9	Very low	26.6	Very low	158 Å²	158	145.7 Å²	145.7	85%	0.845	76%	0.757	S	S	*	*				-160.3	130.4	129.5	-103.1	-15.4	0	0	0	110.7
1252	Y	26.3	Very low	26.4	Very low	236 Å²	236	142 Å²	142	93%	0.925	75%	0.752	S	S	*	*			trans	-72.6	130.4	165.2	-94.5	-113.3	0	0	0	109.1
1253	K	25.4	Very low	26.5	Very low	185 Å²	185	143.4 Å²	143.4	80%	0.804	75%	0.748	S	S	*	*			trans	-129.1	156	156.9	-90.1	-166.5	169.8	-165.5	0	107.1
1254	P	24	Very low	26.4	Very low	120 Å²	120	145.7 Å²	145.7	78%	0.779	76%	0.758	S	S	*	*			trans	-55.4	143.6	173.2	25.5	-34.9	0	0	0	109.9	E1256	P1254-E1256 PolarHBondContact O-N 3.13Å
1255	I	25.6	Very low	26.3	Very low	150 Å²	150	146.4 Å²	146.4	77%	0.769	76%	0.764	S	S	*	*			trans	-75.6	94.8	-178.1	-53.9	179.8	0	0	0	108.4	I1257	I1255-I1257 HydrophobicContact CG2-CG1 3.7Å; I1255-I1257 PolarHBondContact O-N 3.43Å
1256	E	24.7	Very low	26.3	Very low	162 Å²	162	149.1 Å²	149.1	76%	0.757	77%	0.771	S	S	*	*			trans	-59.6	91.1	157	-70.4	179.3	159	0	0	108.4	P1254 N1258	P1254-E1256 PolarHBondContact O-N 3.13Å; E1256-N1258 PolarHBondContact O-N 2.86Å; E1256-N1258 PolarHBondContact O-ND2 3.38Å
1257	I	27.8	Very low	26.3	Very low	129 Å²	129	145.7 Å²	145.7	66%	0.662	77%	0.768	S	S	*	*			trans	-70.5	86.4	168.2	-58.6	-177.9	0	0	0	107	I1255 E1259	I1255-I1257 HydrophobicContact CG2-CG1 3.7Å; I1255-I1257 PolarHBondContact O-N 3.43Å; I1257-E1259 HydrophobicContact CG2-CG 4.07Å; I1257-E1259 PolarHBondContact O-N 2.99Å
1258	N	23.9	Very low	26.2	Very low	123 Å²	123	145.4 Å²	145.4	66%	0.658	76%	0.764	S	S	*	*			trans	-66.6	71.3	168.1	-82.9	-75.6	0	0	0	110	E1256 T1260	E1256-N1258 PolarHBondContact O-N 2.86Å; E1256-N1258 PolarHBondContact O-ND2 3.38Å; N1258-T1260 VanDerWaalsContact C-N 3.33Å; N1258-T1260 PolarHBondContact O-N 3.3Å; N1258-T1260 VanDerWaalsContact O-N 3.09Å
1259	E	27.9	Very low	26.2	Very low	125 Å²	125	146.5 Å²	146.5	58%	0.584	76%	0.763	S	S	*	*			trans	-75.5	90.1	162.7	-94.8	-173.1	-139.7	0	0	108.8	I1257 M1261 R1449	I1257-E1259 HydrophobicContact CG2-CG 4.07Å; I1257-E1259 PolarHBondContact O-N 2.99Å; E1259-M1261 PolarHBondContact O-N 3.22Å; E1259-R1449 IonicContact OE1-CZ 2.66Å; E1259-R1449 IonicContact OE1-NE 2.9Å; E1259-R1449 IonicContact OE1-NH2 3.85Å; E1259-R1449 PolarHBondContact OE1-NH2 2.72Å; E1259-R1449 IonicContact OE2-CZ 3.85Å; E1259-R1449 IonicContact OE2-NE 2.67Å; E1259-R1449 IonicContact OE2-NH2 3.82Å; E1259-R1449 PolarHBondContact OE2-NH2 2.9Å
1260	T	24.7	Very low	26.3	Very low	123 Å²	123	144.8 Å²	144.8	76%	0.755	75%	0.752	S	S	*	*			trans	-69.4	84.7	-178.1	51.4	0	0	0	0	112.6	N1258	N1258-T1260 VanDerWaalsContact C-N 3.33Å; N1258-T1260 PolarHBondContact O-N 3.3Å; N1258-T1260 VanDerWaalsContact O-N 3.09Å
1261	M	24.8	Very low	26.3	Very low	177 Å²	177	149.1 Å²	149.1	87%	0.872	76%	0.758	S	S	*	*			trans	-147.4	71.5	154.6	-86.2	-139	171.4	0	0	112.1	E1259	E1259-M1261 PolarHBondContact O-N 3.22Å
1262	S	24.7	Very low	26.3	Very low	87 Å²	87	147.2 Å²	147.2	61%	0.608	76%	0.757	S	S	*	*	S	Bend	trans	-150.7	143.4	158.7	78.3	0	0	0	0	111.3
1263	H	28.3	Very low	26.2	Very low	126 Å²	126	146 Å²	146	58%	0.583	76%	0.757	S	S	*	*			trans	55.4	92.7	166.5	-56.1	-75.5	0	0	0	118.4	R878	R878-H1263 PolarHBondContact NH1-NE2 3.22Å
1264	K	25.7	Very low	26.3	Very low	217 Å²	217	142.6 Å²	142.6	94%	0.943	76%	0.756	S	S	*	*			trans	-131	93.1	136.4	-86.6	-161.2	173.2	-172.6	0	110.4
1265	I	27.3	Very low	26.5	Very low	146 Å²	146	142.6 Å²	142.6	75%	0.749	76%	0.756	S	S	*	*			trans	-105.2	136.2	158.3	-70.3	176.8	0	0	0	106.2
1266	F	25.4	Very low	26.6	Very low	191 Å²	191	144.4 Å²	144.4	84%	0.838	76%	0.758	S	S	*	*			trans	3.2	108.6	170.4	-73.9	-96	0	0	0	119.1
1267	T	29.8	Very low	27.1	Very low	140 Å²	140	143.9 Å²	143.9	86%	0.859	76%	0.756	S	S	*	*			trans	-134.3	116.7	132.9	44.8	0	0	0	0	109.9
1268	C	24.6	Very low	27.2	Very low	104 Å²	104	143.4 Å²	143.4	70%	0.703	75%	0.754	S	S	*	*			trans	-77.1	161.2	150.5	-57.4	0	0	0	0	106.9
1269	N	27.8	Very low	27.5	Very low	146 Å²	146	147.1 Å²	147.1	78%	0.781	76%	0.759	S	S	*	*			cis	-160.9	-168.5	8	-138.3	-7.9	0	0	0	106.1
1270	P	30.6	Very low	27.6	Very low	90 Å²	90	149.8 Å²	149.8	58%	0.584	76%	0.764	S	S	*	*			cis	-121.7	178.2	-39.7	23.2	-1.3	0	0	0	112.6
1271	K	25.9	Very low	27.9	Very low	196 Å²	196	151.1 Å²	151.1	85%	0.852	76%	0.761	S	S	*	*			trans	31	120.9	143.9	-57.5	164.3	-173.2	177.4	0	117.5
1272	S	27.8	Very low	28.3	Very low	119 Å²	119	148.2 Å²	148.2	83%	0.832	75%	0.754	S	S	*	*				-175.5	151.2	52.6	47	0	0	0	0	112.7
1273	F	24.8	Very low	28.5	Very low	210 Å²	210	152.5 Å²	152.5	92%	0.921	77%	0.766	S	S	*	*			trans	-115.6	136	167.7	-129.5	-95.6	0	0	0	107.5
1274	S	26.5	Very low	28.8	Very low	113 Å²	113	150.9 Å²	150.9	79%	0.79	77%	0.767	S	S	*	*			trans	-140.8	129	167.4	66.8	0	0	0	0	110.7
1275	P	28.5	Very low	29.1	Very low	120 Å²	120	146.8 Å²	146.8	78%	0.779	76%	0.761	S	S	*	*			trans	-105.9	144.6	-174.9	37.6	-32.8	0	0	0	113.7
1276	K	27.9	Very low	29.3	Very low	188 Å²	188	146.3 Å²	146.3	82%	0.817	76%	0.764	S	S	*	*			trans	-142.3	144.3	157.8	-60.1	-174.3	178.5	176.7	0	106.7
1277	H	34	Very low	29.5	Very low	152 Å²	152	143.4 Å²	143.4	70%	0.704	75%	0.753	S	S	*	*			cis	-158.6	152.8	37.8	-115.3	-68.5	0	0	0	114.1
1278	N	30.9	Very low	29.6	Very low	118 Å²	118	140.6 Å²	140.6	63%	0.631	74%	0.744	S	S	*	*			trans	89.1	126.1	135	-77.2	-15.9	0	0	0	124.4
1279	R	30.4	Very low	29.9	Very low	201 Å²	201	145.1 Å²	145.1	76%	0.758	75%	0.746	S	S	*	*			trans	81.1	132.6	146.9	-68.1	170.7	-176	-169.2	1.3	116.8
1280	R	29.4	Very low	30	Very low	182 Å²	182	145.4 Å²	145.4	69%	0.687	75%	0.748	S	S	*	*			cis	-168.5	153.5	-1.3	-133.1	170.3	-175.7	-169.1	1.3	112.2
1281	H	32.2	Very low	30	Very low	150 Å²	150	145.6 Å²	145.6	69%	0.694	75%	0.752	S	S	*	*			trans	66.9	145.7	166.1	-55.6	-64.1	0	0	0	116.4
1282	T	31.7	Very low	30.3	Very low	117 Å²	117	144.1 Å²	144.1	72%	0.718	75%	0.748	S	S	*	*			cis	-158.8	120.1	-5.1	7.4	0	0	0	0	109
1283	M	29.8	Very low	30.3	Very low	176 Å²	176	142.4 Å²	142.4	87%	0.867	74%	0.736	S	S	*	*				103.7	162	103.6	-119	-164.4	166.4	0	0	113.6
1284	P	34.4	Very low	30.7	Very low	93 Å²	93	140.9 Å²	140.9	60%	0.604	73%	0.729	S	S	*	*				-135.3	-154.5	-94	47.1	-31.2	0	0	0	115.8
1285	T	31.8	Very low	30.8	Very low	131 Å²	131	140.2 Å²	140.2	80%	0.804	72%	0.724	S	S	*	*			trans	86.1	131.3	178.6	72.4	0	0	0	0	115.1
1286	V	31	Very low	30.9	Very low	136 Å²	136	140 Å²	140	82%	0.824	72%	0.72	S	S	*	*			cis	-161.8	148.3	-16.9	108.2	0	0	0	0	107.6
1287	E	29.9	Very low	30.9	Very low	129 Å²	129	136.1 Å²	136.1	60%	0.603	72%	0.718	S	S	*	*			cis	-143	-49.3	-7	-167.3	-147.7	-75	0	0	113.4	R1289	E1287-R1289 IonicContact OE1-CZ 3.53Å; E1287-R1289 IonicContact OE1-NE 3.41Å; E1287-R1289 IonicContact OE1-NH2 3.5Å; E1287-R1289 PolarHBondContact OE1-NH2 3.08Å; E1287-R1289 VanDerWaalsContact OE2-CG 3.32Å; E1287-R1289 WeakPolarHBondContact OE2-CG 3.16Å; E1287-R1289 IonicContact OE2-CZ 2.73Å; E1287-R1289 IonicContact OE2-NE 2.8Å; E1287-R1289 PolarHBondContact OE2-NE 2.79Å; E1287-R1289 IonicContact OE2-NH2 3.76Å; E1287-R1289 PolarHBondContact OE2-NH2 3.42Å
1288	A	32.4	Very low	30.8	Very low	82 Å²	82	133.9 Å²	133.9	68%	0.678	72%	0.719	S	S	*	*				-125.7	160	-113.6	0	0	0	0	0	112.4
1289	R	29.9	Very low	30.6	Very low	198 Å²	198	133.5 Å²	133.5	75%	0.747	73%	0.726	S	S	*	*			cis	-157	-171	-12.4	-113	172.5	-160.3	-168.8	7.2	111.8	E1287	E1287-R1289 IonicContact OE1-CZ 3.53Å; E1287-R1289 IonicContact OE1-NE 3.41Å; E1287-R1289 IonicContact OE1-NH2 3.5Å; E1287-R1289 PolarHBondContact OE1-NH2 3.08Å; E1287-R1289 VanDerWaalsContact OE2-CG 3.32Å; E1287-R1289 WeakPolarHBondContact OE2-CG 3.16Å; E1287-R1289 IonicContact OE2-CZ 2.73Å; E1287-R1289 IonicContact OE2-NE 2.8Å; E1287-R1289 PolarHBondContact OE2-NE 2.79Å; E1287-R1289 IonicContact OE2-NH2 3.76Å; E1287-R1289 PolarHBondContact OE2-NH2 3.42Å
1290	N	31.3	Very low	30.5	Very low	153 Å²	153	129.3 Å²	129.3	82%	0.818	72%	0.722	S	S	*	*			trans	-64.7	159	-176.7	-59.2	-1.6	0	0	0	115.2
1291	S	29.4	Very low	30.3	Very low	94 Å²	94	128.1 Å²	128.1	66%	0.657	73%	0.726	S	S	*	*			cis	-165.2	-165.7	-13.2	51.2	0	0	0	0	108
1292	E	32	Very low	30.1	Very low	165 Å²	165	127.8 Å²	127.8	77%	0.771	73%	0.729	S	S	*	*			cis	-158.2	-78.4	9.4	-154.1	158.7	-72.2	0	0	118.2
1293	S	28.4	Very low	29.9	Very low	83 Å²	83	130.8 Å²	130.8	58%	0.58	73%	0.733	S	S	*	*			trans	-158.4	169.2	-153.1	70.8	0	0	0	0	112.6
1294	K	32.8	Very low	29.7	Very low	177 Å²	177	132.3 Å²	132.3	77%	0.77	73%	0.73	S	S	*	*			cis	-151.7	143.7	29.2	-109.8	143.3	-173.2	170.4	0	109.4
1295	S	29	Very low	29.2	Very low	99 Å²	99	137.8 Å²	137.8	69%	0.692	74%	0.739	S	S	*	*				67	150.4	97	94.3	0	0	0	0	115.8
1296	T	30.4	Very low	28.8	Very low	115 Å²	115	142.4 Å²	142.4	71%	0.706	74%	0.741	S	S	*	*			cis	-168.1	156.6	8.6	-9.6	0	0	0	0	113.1
1297	S	29	Very low	28.5	Very low	108 Å²	108	140.6 Å²	140.6	76%	0.755	74%	0.735	S	S	*	*			trans	57.2	162	148.5	56.6	0	0	0	0	121.2
1298	S	30.3	Very low	28.3	Very low	104 Å²	104	140.8 Å²	140.8	73%	0.727	74%	0.74	S	S	*	*			cis	-162.3	144.5	-7.8	28.3	0	0	0	0	108.8
1299	S	27.2	Very low	28	Very low	111 Å²	111	143.9 Å²	143.9	78%	0.776	74%	0.744	S	S	*	*				59.8	140.6	87.4	-111	0	0	0	0	115.6
1300	V	27.6	Very low	27.9	Very low	112 Å²	112	142.1 Å²	142.1	68%	0.679	74%	0.744	S	S	*	*			cis	-167.7	161.2	0.9	85	0	0	0	0	113
1301	M	25.5	Very low	27.7	Very low	157 Å²	157	140.9 Å²	140.9	77%	0.773	74%	0.742	S	S	*	*			trans	65.1	164.7	162.8	-73.3	-176.7	-168.5	0	0	118.2
1302	N	28.3	Very low	27.4	Very low	143 Å²	143	142.5 Å²	142.5	77%	0.765	74%	0.743	S	S	*	*			cis	-142.6	176.9	4	-139.3	-25.2	0	0	0	113.9
1303	K	26.8	Very low	27.1	Very low	181 Å²	181	141.6 Å²	141.6	79%	0.787	74%	0.744	S	S	*	*			trans	-90	155.3	176.9	-59.3	170.4	179.2	170.1	0	113
1304	Y	26	Very low	26.9	Very low	208 Å²	208	143.8 Å²	143.8	82%	0.816	75%	0.754	S	S	*	*				-170.2	-172.1	118.3	-112.9	-73.4	0	0	0	113.6
1305	R	24.7	Very low	26.5	Very low	208 Å²	208	146.2 Å²	146.2	79%	0.785	76%	0.759	S	S	*	*			trans	-24.4	145.1	-176.9	-77.1	147.8	178.3	160.9	-3.4	118
1306	R	23.7	Very low	26.4	Very low	227 Å²	227	149.2 Å²	149.2	86%	0.857	77%	0.765	S	S	*	*			cis	88.3	124.1	36.8	-170.8	-165.5	-153	-166.8	7	112.6
1307	S	23.4	Very low	26.1	Very low	98 Å²	98	151 Å²	151	69%	0.685	76%	0.763	S	S	*	*			trans	65.9	153.4	-177.2	76.2	0	0	0	0	113.4
1308	D	27.1	Very low	26.2	Very low	134 Å²	134	151 Å²	151	72%	0.717	76%	0.763	S	S	*	*			cis	-143.3	-175.3	22.5	-91.8	-67.7	0	0	0	114.5
1309	L	26.5	Very low	26	Very low	146 Å²	146	152 Å²	152	76%	0.764	76%	0.761	S	S	*	*			trans	8.8	133.1	163	-81	58.4	0	0	0	120.7
1310	H	26.1	Very low	26.3	Very low	162 Å²	162	155.9 Å²	155.9	75%	0.75	77%	0.766	S	S	*	*				82	151.3	70	-124.4	-74.4	0	0	0	114.8
1311	T	27.7	Very low	26.2	Very low	126 Å²	126	154.9 Å²	154.9	77%	0.773	76%	0.764	S	S	*	*			trans	69.5	157.4	-173.4	68.5	0	0	0	0	115.7
1312	D	23.9	Very low	26.3	Very low	128 Å²	128	153.2 Å²	153.2	68%	0.684	77%	0.768	S	S	*	*			cis	174	140.4	-49.8	-92.5	-38.2	0	0	0	106
1313	D	24.7	Very low	26.3	Very low	146 Å²	146	149.3 Å²	149.3	78%	0.781	76%	0.762	S	S	*	*			trans	61.3	163.5	160.7	-66.6	-25.9	0	0	0	123.9
1314	T	24.8	Very low	26.3	Very low	129 Å²	129	147.1 Å²	147.1	79%	0.791	76%	0.764	S	S	*	*			trans	75.8	102.3	166.8	59.7	0	0	0	0	121.3
1315	W	25.1	Very low	26.4	Very low	229 Å²	229	145.8 Å²	145.8	87%	0.867	76%	0.764	S	S	*	*				1.4	134.5	127.8	-64.2	71	0	0	0	118.8
1316	I	25.7	Very low	26.7	Very low	162 Å²	162	140.5 Å²	140.5	83%	0.831	76%	0.76	S	S	*	*			trans	-157.7	142.5	130.5	-101	148.3	0	0	0	108.9
1317	F	25.2	Very low	26.8	Very low	151 Å²	151	136.8 Å²	136.8	66%	0.662	76%	0.757	S	S	*	*			trans	-111.7	134.7	171.6	-120.5	-82.1	0	0	0	108.4
1318	S	30.7	Very low	27.2	Very low	108 Å²	108	140 Å²	140	76%	0.755	77%	0.766	S	S	*	*			trans	-148.5	121	165.1	47.4	0	0	0	0	110.8
1319	N	26.3	Very low	27.2	Very low	127 Å²	127	142.1 Å²	142.1	68%	0.679	77%	0.772	S	S	*	*			trans	-79.1	151.7	167.9	-66.8	-50.2	0	0	0	109.2
1320	H	31.9	Very low	27.2	Very low	192 Å²	192	142.3 Å²	142.3	89%	0.889	77%	0.773	S	S	*	*			trans	-154.1	165.9	134.1	-110.9	-67.7	0	0	0	112.3
1321	S	27.2	Very low	27.2	Very low	91 Å²	91	139.9 Å²	139.9	64%	0.636	77%	0.773	S	S	*	*			trans	-115.2	171.4	-148	50	0	0	0	0	114.9
1322	S	26.2	Very low	27.1	Very low	122 Å²	122	138.9 Å²	138.9	85%	0.853	77%	0.771	S	S	*	*			trans	82.7	151.7	144.4	67	0	0	0	0	121.5
1323	G	29.2	Very low	27.4	Very low	61 Å²	61	137.8 Å²	137.8	63%	0.629	77%	0.774	S	S	*	*			trans	109.1	104.1	-179.2	0	0	0	0	0	112.5
1324	T	26.8	Very low	27.4	Very low	135 Å²	135	136.5 Å²	136.5	83%	0.828	78%	0.776	S	S	*	*				63.8	133.4	56.9	74.6	0	0	0	0	113.4
1325	Q	28.2	Very low	27.5	Very low	179 Å²	179	137.7 Å²	137.7	84%	0.836	78%	0.776	S	S	*	*			cis	-160.3	-164.2	2.9	-136.2	172.1	-11.5	0	0	111.6
1326	S	30.8	Very low	27.6	Very low	98 Å²	98	132.2 Å²	132.2	69%	0.685	77%	0.768	S	S	*	*			trans	67.1	101.7	162.6	63.4	0	0	0	0	121.5
1327	N	26.4	Very low	27.6	Very low	148 Å²	148	129.4 Å²	129.4	79%	0.791	76%	0.763	S	S	*	*				39.4	127.2	116.4	-50.3	8.8	0	0	0	120.9
1328	D	31.3	Very low	27.8	Very low	165 Å²	165	126.9 Å²	126.9	88%	0.882	77%	0.77	S	S	*	*				-165.3	161.5	98.6	-97.9	-9.5	0	0	0	111.8
1329	E	26.2	Very low	27.5	Very low	179 Å²	179	130.7 Å²	130.7	84%	0.836	78%	0.775	S	S	*	*			trans	-104.8	142.1	-168.5	-62.6	-177.1	117.6	0	0	114.1
1330	L	27.4	Very low	27.3	Very low	150 Å²	150	131 Å²	131	79%	0.785	79%	0.786	S	S	*	*				168.5	139.2	109.5	-108.6	102.8	0	0	0	113.3
1331	C	25.1	Very low	27.1	Very low	111 Å²	111	129.1 Å²	129.1	75%	0.75	78%	0.782	S	S	*	*			trans	35.8	131.3	144.6	-68.7	0	0	0	0	121.2
1332	S	26.1	Very low	26.9	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	79%	0.789	S	S	*	*			cis	-176.6	174.3	17.6	49.9	0	0	0	0	113.4
1333	S	29.4	Very low	26.9	Very low	105 Å²	105	135.1 Å²	135.1	73%	0.734	79%	0.791	S	S	*	*			trans	76.5	72.4	165	67.8	0	0	0	0	120.1
1334	S	26	Very low	26.6	Very low	118 Å²	118	138.6 Å²	138.6	83%	0.825	80%	0.795	S	S	*	*			trans	53.6	108.8	134.4	60.3	0	0	0	0	120.5
1335	I	26	Very low	26.5	Very low	155 Å²	155	142.7 Å²	142.7	80%	0.795	80%	0.797	S	S	*	*			trans	-148.8	157.6	168.3	-142.8	172.1	0	0	0	110.3
1336	T	27.8	Very low	26.5	Very low	114 Å²	114	138 Å²	138	70%	0.699	80%	0.796	S	S	*	*			trans	55.3	119.5	164	52	0	0	0	0	122.6
1337	S	25.6	Very low	26.2	Very low	103 Å²	103	143 Å²	143	72%	0.72	81%	0.805	S	S	*	*				14.1	139.5	127.3	61	0	0	0	0	123
1338	A	28.9	Very low	26.2	Very low	98 Å²	98	142.4 Å²	142.4	81%	0.81	81%	0.807	S	S	*	*			trans	66.8	109	139.7	0	0	0	0	0	119.4
1339	Q	25.9	Very low	25.9	Very low	187 Å²	187	141.7 Å²	141.7	87%	0.874	80%	0.802	S	S	*	*			trans	-131	139.4	155.5	-74.8	-177.8	-44.7	0	0	109.7
1340	C	21.4	Very low	26.1	Very low	135 Å²	135	140.3 Å²	140.3	91%	0.912	80%	0.8	S	S	*	*			trans	-79.3	132.7	163.4	-63.5	0	0	0	0	108.8
1341	L	27.7	Very low	26	Very low	152 Å²	152	137.9 Å²	137.9	80%	0.796	80%	0.796	S	S	*	*			trans	-127.1	117.3	162.3	-94.2	167.5	0	0	0	108.6
1342	S	22.4	Very low	26.2	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	79%	0.793	S	S	*	*			trans	-73.7	123.6	170.1	52	0	0	0	0	109.5
1343	Y	27	Very low	26.3	Very low	227 Å²	227	141 Å²	141	89%	0.89	80%	0.798	S	S	*	*			trans	-125	151.6	157.3	-107.7	-90.7	0	0	0	110.2
1344	N	22.9	Very low	26.1	Very low	133 Å²	133	141.1 Å²	141.1	71%	0.711	80%	0.798	S	S	*	*			trans	-131.8	161.7	-156.4	-160.7	-0.3	0	0	0	110.6
1345	Y	25	Very low	26.2	Very low	222 Å²	222	143.2 Å²	143.2	87%	0.871	80%	0.799	S	S	*	*			trans	68.3	139.7	-178	-72	-96.5	0	0	0	117.6
1346	G	27.5	Very low	26.2	Very low	79 Å²	79	139.9 Å²	139.9	81%	0.814	79%	0.79	S	S	*	*			trans	159.2	52.4	178.9	0	0	0	0	0	114.8
1347	K	24.1	Very low	26.2	Very low	204 Å²	204	142 Å²	142	89%	0.887	80%	0.795	S	S	*	*			trans	-73.5	139.1	173.3	-78.7	-175.5	176.4	179.6	0	111
1348	T	27.4	Very low	26.4	Very low	136 Å²	136	141.5 Å²	141.5	83%	0.834	79%	0.79	S	S	*	*			trans	154.9	156.8	139.9	38	0	0	0	0	109.8
1349	L	25.1	Very low	26.2	Very low	149 Å²	149	143.3 Å²	143.3	78%	0.78	79%	0.786	S	S	*	*			cis	-162.6	176.4	-38.1	-159.4	115.4	0	0	0	107.8
1350	L	28.9	Very low	26.4	Very low	150 Å²	150	141.3 Å²	141.3	79%	0.785	79%	0.786	S	S	*	*			trans	100.1	90	-177.8	-59.7	158.5	0	0	0	112
1351	S	26.3	Very low	26.6	Very low	99 Å²	99	140.2 Å²	140.2	69%	0.692	77%	0.771	S	S	*	*				67.7	131.1	72	77.1	0	0	0	0	112.7
1352	S	29.2	Very low	26.5	Very low	100 Å²	100	141.5 Å²	141.5	70%	0.699	77%	0.77	S	S	*	*			cis	-154.7	173.8	16.6	58.6	0	0	0	0	109.8
1353	Q	28.2	Very low	26.9	Very low	182 Å²	182	142 Å²	142	85%	0.85	77%	0.769	S	S	*	*			cis	-149.9	168.7	-2	-138.4	152.6	-13.5	0	0	110.9
1354	C	25.2	Very low	26.9	Very low	108 Å²	108	138.1 Å²	138.1	73%	0.73	76%	0.764	S	S	*	*			trans	-92.5	158.5	-164	-46.9	0	0	0	0	115.5
1355	L	26.8	Very low	27.1	Very low	162 Å²	162	139.1 Å²	139.1	85%	0.848	77%	0.769	S	S	*	*				-172.6	106.3	128.8	-99.4	132	0	0	0	106.6
1356	S	26.3	Very low	27.3	Very low	86 Å²	86	135.8 Å²	135.8	60%	0.601	77%	0.772	S	S	*	*				64	133.8	61.8	82.3	0	0	0	0	112.1
1357	I	27.9	Very low	27.3	Very low	157 Å²	157	138.8 Å²	138.8	81%	0.805	77%	0.765	S	S	*	*			cis	-178.5	171.9	24.5	-125.6	165.6	0	0	0	106.7
1358	P	30.5	Very low	27.3	Very low	94 Å²	94	135.1 Å²	135.1	61%	0.61	76%	0.762	S	S	*	*			cis	-139.1	-177.8	-25.8	44.9	-27.4	0	0	0	116.2
1359	N	25.6	Very low	27.3	Very low	135 Å²	135	136.9 Å²	136.9	72%	0.722	76%	0.761	S	S	*	*			trans	36.4	128.5	142	-55.6	-6.6	0	0	0	124.7
1360	V	29.4	Very low	27.3	Very low	146 Å²	146	139 Å²	139	89%	0.885	77%	0.769	S	S	*	*				-144.1	148.5	107.5	-180	0	0	0	0	108.9
1361	N	25.2	Very low	27.1	Very low	112 Å²	112	137.6 Å²	137.6	60%	0.599	77%	0.766	S	S	*	*			trans	-94.8	164	-177.5	-52.3	-31.3	0	0	0	111.5
1362	F	26.2	Very low	27.1	Very low	178 Å²	178	138.6 Å²	138.6	78%	0.781	77%	0.77	S	S	*	*				179.9	165.5	56.5	-118.7	-57.7	0	0	0	113.3
1363	T	30.3	Very low	27	Very low	123 Å²	123	141.5 Å²	141.5	76%	0.755	78%	0.776	S	S	*	*			trans	65.7	119.1	154.4	49.7	0	0	0	0	121
1364	D	26.6	Very low	26.8	Very low	146 Å²	146	141 Å²	141	78%	0.781	77%	0.771	S	S	*	*			trans	-75.9	154.6	168.6	-49.1	-95.5	0	0	0	113.9
1365	N	27.3	Very low	26.8	Very low	154 Å²	154	141.7 Å²	141.7	82%	0.824	77%	0.774	S	S	*	*				169	99.2	124.5	-91.9	-55	0	0	0	112.7
1366	T	29.1	Very low	26.7	Very low	151 Å²	151	140.5 Å²	140.5	93%	0.926	77%	0.767	S	S	*	*			trans	179.5	163.1	139.2	21.6	0	0	0	0	111.2
1367	Q	27.8	Very low	26.6	Very low	142 Å²	142	142.3 Å²	142.3	66%	0.664	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-84.2	148.5	-165.4	-66.5	176.7	-23.6	0	0	114.6
1368	P	25.2	Very low	26.4	Very low	127 Å²	127	140 Å²	140	83%	0.825	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-80.7	126.8	177.8	31.8	-34	0	0	0	112.8
1369	Q	26.4	Very low	26.2	Very low	174 Å²	174	141.2 Å²	141.2	81%	0.813	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-75.8	144.2	162.1	-72.7	-172.5	-11.8	0	0	110.8	V1371	Q1369-V1371 PolarHBondContact O-N 3.36Å
1370	M	24.1	Very low	26.1	Very low	194 Å²	194	142.1 Å²	142.1	96%	0.956	78%	0.784	S	S	*	*			trans	-72.6	96.9	-177.4	-66.2	-174.1	-174.7	0	0	112.5
1371	V	26.3	Very low	26	Very low	119 Å²	119	143.1 Å²	143.1	72%	0.721	78%	0.779	S	S	*	*			trans	-72.4	132	163.5	179.6	0	0	0	0	109	Q1369 I1373	Q1369-V1371 PolarHBondContact O-N 3.36Å; V1371-I1373 PolarHBondContact O-N 3.4Å; V1371-I1373 VanDerWaalsContact O-N 3.14Å
1372	P	26.5	Very low	26	Very low	120 Å²	120	143.5 Å²	143.5	78%	0.779	79%	0.786	S	S	*	*			trans	-65.1	116	176.2	25.8	-33.6	0	0	0	110.6	K1374	P1372-K1374 PolarHBondContact O-N 3.09Å
1373	I	26	Very low	25.9	Very low	161 Å²	161	140.5 Å²	140.5	83%	0.826	78%	0.782	S	S	*	*			trans	-62.7	124.9	-173.4	-62.9	171.8	0	0	0	110.8	V1371 P1375	V1371-I1373 PolarHBondContact O-N 3.4Å; V1371-I1373 VanDerWaalsContact O-N 3.14Å; I1373-P1375 WeakPolarHBondContact O-CD 3.35Å
1374	K	25.1	Very low	25.8	Very low	171 Å²	171	142.2 Å²	142.2	74%	0.743	78%	0.781	S	S	*	*			trans	-64.8	126.4	170	-69.8	178.7	179.1	175.7	0	109.5	P1372 I1376	P1372-K1374 PolarHBondContact O-N 3.09Å; K1374-I1376 VanDerWaalsContact C-N 3.31Å; K1374-I1376 HydrophobicContact CB-CG1 4.24Å; K1374-I1376 PolarHBondContact O-N 3.4Å
1375	P	25	Very low	25.7	Very low	123 Å²	123	144.1 Å²	144.1	80%	0.799	78%	0.783	S	S	*	*			trans	-73.3	87.1	168.2	30.3	-33.1	0	0	0	109.6	I1373 C1377	I1373-P1375 WeakPolarHBondContact O-CD 3.35Å; P1375-C1377 PolarHBondContact O-N 3.01Å; P1375-C1377 VanDerWaalsContact O-N 3.15Å
1376	I	24.6	Very low	25.7	Very low	137 Å²	137	143.6 Å²	143.6	70%	0.703	78%	0.78	S	S	*	*			trans	-76.3	96.4	170.6	-60.4	178.9	0	0	0	107.9	K1374 V1378	K1374-I1376 VanDerWaalsContact C-N 3.31Å; K1374-I1376 HydrophobicContact CB-CG1 4.24Å; K1374-I1376 PolarHBondContact O-N 3.4Å; I1376-V1378 HydrophobicContact CG2-CG2 4.01Å; I1376-V1378 PolarHBondContact O-N 3.34Å; I1376-V1378 VanDerWaalsContact O-N 3.1Å
1377	C	24.3	Very low	25.5	Very low	124 Å²	124	140.6 Å²	140.6	84%	0.838	77%	0.765	S	S	*	*			trans	-77.5	86.9	167.9	-72.7	0	0	0	0	110.2	P1375	P1375-C1377 PolarHBondContact O-N 3.01Å; P1375-C1377 VanDerWaalsContact O-N 3.15Å
1378	V	23.5	Very low	25.3	Very low	110 Å²	110	140.9 Å²	140.9	67%	0.667	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-74.8	119.5	158.6	165.9	0	0	0	0	108.5	I1376 M1380	I1376-V1378 HydrophobicContact CG2-CG2 4.01Å; I1376-V1378 PolarHBondContact O-N 3.34Å; I1376-V1378 VanDerWaalsContact O-N 3.1Å; V1378-M1380 HydrophobicContact CG1-CB 4.09Å
1379	S	25.2	Very low	25.2	Very low	119 Å²	119	141 Å²	141	83%	0.832	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-95	122.6	152.2	55.5	0	0	0	0	107.9
1380	M	24.3	Very low	25	Very low	153 Å²	153	137.6 Å²	137.6	75%	0.754	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-100.9	173.2	-170	-156.8	173	76	0	0	112.2	V1378	V1378-M1380 HydrophobicContact CG1-CB 4.09Å
1381	Q	27.1	Very low	25	Very low	168 Å²	168	134.9 Å²	134.9	79%	0.785	75%	0.748	S	S	*	*			trans	84.6	133.5	165.1	-63.6	-179.6	-32.8	0	0	117.9
1382	V	24.9	Very low	24.9	Very low	120 Å²	120	135.4 Å²	135.4	73%	0.727	75%	0.745	S	S	*	*			cis	-163.2	172.3	-18.8	98.8	0	0	0	0	110.4
1383	T	25	Very low	24.7	Very low	114 Å²	114	136.3 Å²	136.3	70%	0.699	74%	0.743	S	S	*	*			trans	71.2	139	-179.2	66.6	0	0	0	0	117.1
1384	Q	27.2	Very low	24.6	Very low	159 Å²	159	134.6 Å²	134.6	74%	0.743	74%	0.741	S	S	*	*			cis	-151.6	139.2	-19.7	-131.8	162.9	-21.9	0	0	113.4
1385	F	25	Very low	24.5	Very low	186 Å²	186	133.2 Å²	133.2	82%	0.816	74%	0.74	S	S	*	*			trans	-18.1	128.1	159.3	-88.4	-102.2	0	0	0	120.3
1386	N	26.2	Very low	24.4	Very low	144 Å²	144	131.3 Å²	131.3	77%	0.77	73%	0.73	S	S	*	*				171.2	148.9	108	-89.7	-15.3	0	0	0	110.3
1387	S	25.6	Very low	24.3	Very low	87 Å²	87	130.8 Å²	130.8	61%	0.608	73%	0.733	S	S	*	*			cis	-168.7	153.7	-12.5	49.5	0	0	0	0	110.1
1388	L	23.7	Very low	24.2	Very low	148 Å²	148	129.3 Å²	129.3	78%	0.775	72%	0.724	S	S	*	*			trans	36.4	137.4	134.4	-60.4	170.6	0	0	0	120.1
1389	N	23.2	Very low	24.2	Very low	131 Å²	131	131 Å²	131	70%	0.701	73%	0.73	S	S	*	*			cis	-166.8	-168.9	-7.8	-138	12.7	0	0	0	110.4
1390	C	23.1	Very low	24.1	Very low	101 Å²	101	131.7 Å²	131.7	68%	0.682	72%	0.723	S	S	*	*			trans	-2.2	154.3	142.7	-59.9	0	0	0	0	119.6
1391	D	24.4	Very low	24.1	Very low	138 Å²	138	129.2 Å²	129.2	74%	0.738	72%	0.719	S	S	*	*			cis	178.7	-172.6	-15.9	-156.2	-28.3	0	0	0	105.3
1392	I	23.1	Very low	23.9	Very low	130 Å²	130	128.1 Å²	128.1	67%	0.667	72%	0.718	S	S	*	*			trans	64.7	118.9	154.8	-65	161.3	0	0	0	117.3
1393	N	23	Very low	23.8	Very low	138 Å²	138	131.1 Å²	131.1	74%	0.738	72%	0.718	S	S	*	*			trans	26.5	122.9	147.3	-51	-20.6	0	0	0	119.7
1394	T	23.2	Very low	23.8	Very low	126 Å²	126	131 Å²	131	77%	0.773	72%	0.717	S	S	*	*				-170	153.2	112.1	18.8	0	0	0	0	114.3
1395	I	23.2	Very low	23.8	Very low	142 Å²	142	128 Å²	128	73%	0.728	71%	0.712	S	S	*	*			trans	54.8	79.8	141	-61.2	164.1	0	0	0	117.4
1396	S	22.3	Very low	23.6	Very low	83 Å²	83	126.2 Å²	126.2	58%	0.58	71%	0.71	S	S	*	*				34.9	139.2	108.4	67.4	0	0	0	0	122.1
1397	T	22.9	Very low	23.6	Very low	125 Å²	125	126.2 Å²	126.2	77%	0.767	72%	0.716	S	S	*	*			trans	74.8	155.4	135.7	50.7	0	0	0	0	121.8
1398	S	23.1	Very low	23.6	Very low	94 Å²	94	127 Å²	127	66%	0.657	72%	0.721	S	S	*	*			trans	78.6	108.5	162.4	73.6	0	0	0	0	115.2
1399	N	23.4	Very low	23.8	Very low	146 Å²	146	125 Å²	125	78%	0.781	72%	0.717	S	S	*	*				88.1	152.7	72.9	-68.8	-10.2	0	0	0	110.2
1400	L	23.1	Very low	23.8	Very low	133 Å²	133	124.2 Å²	124.2	70%	0.696	72%	0.717	S	S	*	*			cis	-135.1	133	14.5	-149.4	67.1	0	0	0	106	L1402	L1400-L1402 HydrophobicContact CD2-CD1 4.31Å; L1400-L1402 HydrophobicContact CD2-CG 4.47Å
1401	C	24.4	Very low	23.8	Very low	100 Å²	100	126 Å²	126	68%	0.676	72%	0.72	S	S	*	*				41.9	128.4	77.8	-76.5	0	0	0	0	114.7
1402	L	21.8	Very low	23.7	Very low	145 Å²	145	124.3 Å²	124.3	76%	0.759	72%	0.719	S	S	*	*				-175.9	108.6	129.9	-96.2	164.6	0	0	0	108.7	L1400	L1400-L1402 HydrophobicContact CD2-CD1 4.31Å; L1400-L1402 HydrophobicContact CD2-CG 4.47Å
1403	Y	22.2	Very low	23.7	Very low	184 Å²	184	125.2 Å²	125.2	72%	0.722	72%	0.723	S	S	*	*				37.6	135.9	113.7	-80.9	-109	0	0	0	117.9
1404	T	25.8	Very low	23.7	Very low	111 Å²	111	128 Å²	128	68%	0.681	72%	0.723	S	S	*	*			cis	178.3	-168	2.1	13.4	0	0	0	0	106.2
1405	P	26.4	Very low	23.6	Very low	97 Å²	97	127.1 Å²	127.1	63%	0.63	72%	0.723	S	S	*	*			cis	-127.6	-176.3	-36.9	32.7	-14.5	0	0	0	111.8
1406	N	22.2	Very low	23.4	Very low	147 Å²	147	125.9 Å²	125.9	79%	0.786	73%	0.726	S	S	*	*			trans	17.1	118.4	140.9	-51.3	1	0	0	0	118.8
1407	T	26.3	Very low	23.5	Very low	144 Å²	144	129 Å²	129	88%	0.883	74%	0.741	S	S	*	*				-158.3	106.1	124.4	3.2	0	0	0	0	111.5
1408	S	25	Very low	23.5	Very low	104 Å²	104	129.5 Å²	129.5	73%	0.727	74%	0.739	S	S	*	*			trans	-71	179.5	146.6	60.7	0	0	0	0	108.5
1409	P	27.9	Very low	23.4	Very low	105 Å²	105	131.8 Å²	131.8	68%	0.682	74%	0.744	S	S	*	*			cis	-148.6	-160.8	16.4	42.8	-20.4	0	0	0	115.7
1410	V	23.5	Very low	23.4	Very low	115 Å²	115	135.1 Å²	135.1	70%	0.697	75%	0.747	S	S	*	*			trans	72.9	118	145.7	159.7	0	0	0	0	118.6
1411	N	22.2	Very low	23.4	Very low	139 Å²	139	132.8 Å²	132.8	74%	0.743	74%	0.735	S	S	*	*			trans	33.6	123	138.7	-43.1	-21.3	0	0	0	117.1
1412	S	23	Very low	23.4	Very low	103 Å²	103	131.5 Å²	131.5	72%	0.72	72%	0.719	S	S	*	*				175.2	159.3	66.5	45.3	0	0	0	0	113.1
1413	I	22.9	Very low	23.5	Very low	148 Å²	148	130.5 Å²	130.5	76%	0.759	72%	0.715	S	S	*	*			trans	47.5	96	142.3	-57.9	163.8	0	0	0	117.5
1414	W	22.1	Very low	23.6	Very low	196 Å²	196	127.4 Å²	127.4	74%	0.742	70%	0.702	S	S	*	*			trans	78.8	131.5	140.6	-76.9	37.4	0	0	0	121.7
1415	S	21.8	Very low	23.6	Very low	109 Å²	109	129.5 Å²	129.5	76%	0.762	70%	0.698	S	S	*	*			trans	61.7	75.1	150.8	56.7	0	0	0	0	119.5
1416	C	20	Very low	23.5	Very low	116 Å²	116	131.1 Å²	131.1	78%	0.784	71%	0.707	S	S	*	*			trans	-162.6	125.5	145.7	-129.5	0	0	0	0	112.8
1417	T	24.2	Very low	23.6	Very low	148 Å²	148	130.2 Å²	130.2	91%	0.908	70%	0.701	S	S	*	*			trans	-144.3	87.5	166	38	0	0	0	0	110.9
1418	N	21.4	Very low	23.5	Very low	135 Å²	135	127.6 Å²	127.6	72%	0.722	69%	0.688	S	S	*	*			trans	-83.4	140.9	164	-79	-22.2	0	0	0	110.5
1419	D	21.4	Very low	23.5	Very low	142 Å²	142	129 Å²	129	76%	0.759	69%	0.688	S	S	*	*			trans	59	-172.3	155.3	-64.4	-51.9	0	0	0	119.1
1420	Y	23.8	Very low	23.3	Very low	216 Å²	216	134.5 Å²	134.5	85%	0.847	70%	0.695	S	S	*	*			trans	66.8	59.1	174.8	-64.5	-84.1	0	0	0	118.6
1421	N	23.1	Very low	23.3	Very low	84 Å²	84	134.5 Å²	134.5	45%	0.449	70%	0.695	S	S	.	*				19.3	151	103.1	-162.8	19.9	0	0	0	119.6	N315 P316	N315-N1421 PolarHBondContact OD1-ND2 3.4Å; P316-N1421 WeakPolarHBondContact CD-ND2 3.47Å
1422	H	24.8	Very low	23.4	Very low	73 Å²	73	138.4 Å²	138.4	34%	0.338	70%	0.701	S	S	.	*			trans	69.2	116.2	176	-78.9	-88.1	0	0	0	116.4	H314	H314-H1422 AromaticContact CE1-CD2 3.7Å; H314-H1422 AromaticContact CE1-CE1 3.54Å; H314-H1422 AromaticContact CE1-NE2 3.19Å; H314-H1422 PolarHBondContact CE1-NE2 3.05Å; H314-H1422 AromaticContact ND1-CE1 3.98Å; H314-H1422 AromaticContact ND1-NE2 3.32Å; H314-H1422 PolarHBondContact ND1-NE2 3.36Å
1423	N	24.2	Very low	23.4	Very low	124 Å²	124	140.1 Å²	140.1	66%	0.663	70%	0.697	S	S	*	*				-168.9	176.4	54.7	-86.9	-59.8	0	0	0	111.3
1424	R	24.4	Very low	23.6	Very low	119 Å²	119	138.4 Å²	138.4	45%	0.449	69%	0.693	S	S	.	*			cis	159	159.5	-23.9	-170	172.2	177.4	-175.2	1	107.2
1425	Y	24.6	Very low	23.6	Very low	156 Å²	156	133.2 Å²	133.2	61%	0.612	68%	0.677	S	S	*	*			trans	73.7	154.4	175	-45.8	-67.3	0	0	0	115.6	L1427	Y1425-L1427 HydrophobicContact CD1-CD1 3.6Å; Y1425-L1427 HydrophobicContact CE1-CD1 4.25Å
1426	T	25.2	Very low	23.8	Very low	131 Å²	131	130.9 Å²	130.9	80%	0.804	67%	0.67	S	S	*	*			cis	-96.5	142.2	2	40.2	0	0	0	0	112.6
1427	L	23.9	Very low	24	Very low	127 Å²	127	129.8 Å²	129.8	67%	0.665	66%	0.664	S	S	*	*				62.5	133.9	75.2	-97	77.7	0	0	0	113.7	Y1425	Y1425-L1427 HydrophobicContact CD1-CD1 3.6Å; Y1425-L1427 HydrophobicContact CE1-CD1 4.25Å
1428	S	24.7	Very low	24.2	Very low	89 Å²	89	125.3 Å²	125.3	62%	0.622	63%	0.634	S	S	*	*			cis	-160.2	145.1	4.1	66.2	0	0	0	0	115.4
1429	N	23.5	Very low	24.7	Very low	134 Å²	134	124.5 Å²	124.5	72%	0.717	63%	0.629	S	S	*	*				64	139.2	129.9	-66.9	-9.8	0	0	0	124.3
1430	R	24.4	Very low	25.1	Very low	221 Å²	221	122.7 Å²	122.7	83%	0.834	62%	0.62	S	S	*	*			trans	89.3	107	145.6	-75.7	162	-171.4	-174.9	2	120.2
1431	V	23.3	Very low	25.6	Very low	114 Å²	114	116.1 Å²	116.1	69%	0.691	60%	0.597	S	S	*	*				47.1	114.2	116.5	-179.8	0	0	0	0	117
1432	Y	24.5	Very low	26.3	Very low	221 Å²	221	115.1 Å²	115.1	87%	0.867	59%	0.591	S	S	*	*				-151	118.4	123.9	-91.4	-60.1	0	0	0	111.8	V1434	Y1432-V1434 PolarHBondContact O-N 2.89Å
1433	H	23.2	Very low	26.8	Very low	140 Å²	140	117 Å²	117	65%	0.648	60%	0.603	S	S	*	*			trans	-91.9	90.2	172.8	-159.4	-97.6	0	0	0	108.9	N191	N191-H1433 PolarHBondContact ND2-ND1 2.69Å; N191-H1433 PolarHBondContact OD1-CE1 3.35Å
1434	V	25.9	Very low	27.4	Very low	111 Å²	111	114 Å²	114	67%	0.673	59%	0.587	S	S	*	*			trans	-122	109	-179.3	179.3	0	0	0	0	110.4	Y1432 G1436	Y1432-V1434 PolarHBondContact O-N 2.89Å; V1434-G1436 PolarHBondContact O-N 3.46Å
1435	Q	24.1	Very low	28	Very low	88 Å²	88	111.9 Å²	111.9	41%	0.411	59%	0.587	S	S	.	*			trans	-73.2	81.4	165.6	-64.9	143.7	-48.1	0	0	108.5	H187 N191	H187-Q1435 PolarHBondContact ND1-NE2 2.98Å; H187-Q1435 VanDerWaalsContact ND1-NE2 3.1Å; H187-Q1435 PolarHBondContact O-NE2 2.88Å; H187-Q1435 VanDerWaalsContact O-NE2 3.13Å; H187-Q1435 PolarHBondContact O-OE1 2.81Å; N191-Q1435 PolarHBondContact ND2-OE1 3.01Å; N191-Q1435 PolarHBondContact OD1-NE2 2.82Å; N191-Q1435 PolarHBondContact OD1-OE1 3.33Å
1436	G	24.5	Very low	28.5	Very low	59 Å²	59	109.1 Å²	109.1	61%	0.608	58%	0.583	S	S	*	*			trans	-107.2	119.1	-174.6	0	0	0	0	0	113.1	V1434	V1434-G1436 PolarHBondContact O-N 3.46Å
1437	S	24.8	Very low	29.2	Very low	94 Å²	94	107.2 Å²	107.2	66%	0.657	57%	0.565	S	S	*	*			trans	-61.8	149.2	163.1	53.1	0	0	0	0	111.6
1438	N	28.8	Very low	29.9	Very low	53 Å²	53	103.4 Å²	103.4	28%	0.283	55%	0.545	S	S	.	.			trans	132.7	26.2	148.6	-62.4	-8.2	0	0	0	119.2	R873 N1440 E1441	R873-N1438 PolarHBondContact NE-ND2 3.13Å; N1438-N1440 PolarHBondContact O-N 2.65Å; N1438-E1441 HydrophobicContact CB-CB 4.33Å; N1438-E1441 HydrophobicContact CB-CG 3.83Å; N1438-E1441 VanDerWaalsContact CB-OE2 3.31Å; N1438-E1441 WeakPolarHBondContact CB-OE2 3.32Å; N1438-E1441 VanDerWaalsContact CG-CD 3.4Å; N1438-E1441 PolarHBondContact ND2-OE1 3.34Å; N1438-E1441 VanDerWaalsContact ND2-OE1 3.1Å; N1438-E1441 PolarHBondContact ND2-OE2 3.13Å; N1438-E1441 WeakPolarHBondContact O-CB 3.26Å; N1438-E1441 PolarHBondContact O-N 3.12Å
1439	L	30.4	Very low	30.5	Very low	118 Å²	118	103.5 Å²	103.5	62%	0.618	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	1.1	169.2	-92.5	151.5	0	0	0	115.8	I927	I927-L1439 HydrophobicContact CD1-CD1 3.59Å; I927-L1439 HydrophobicContact CD1-CD2 3.56Å; I927-L1439 HydrophobicContact CD1-CG 4.21Å
1440	N	31.6	Very low	31.4	Very low	104 Å²	104	100.8 Å²	100.8	56%	0.556	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-25.6	161.6	-75.9	-8.1	0	0	0	112.5	N1438 I1442 L1444	N1438-N1440 PolarHBondContact O-N 2.65Å; N1440-I1442 PolarHBondContact O-N 3.29Å; N1440-L1444 WeakPolarHBondContact O-CB 3.33Å; N1440-L1444 PolarHBondContact O-N 3.22Å; N1440-L1444 VanDerWaalsContact O-N 3.1Å
1441	E	33.4	Very low	32.3	Very low	78 Å²	78	93.2 Å²	93.2	36%	0.364	49%	0.493	S	S	.	.	H	α-helix	trans	-71.1	-27	-163	-74.8	-175.2	160.7	0	0	114.5	R873 N1438 T1445	R873-E1441 IonicContact CZ-OE1 2.74Å; R873-E1441 IonicContact NE-OE1 3.91Å; R873-E1441 IonicContact NH2-OE1 3.01Å; R873-E1441 PolarHBondContact NH2-OE1 3.35Å; N1438-E1441 HydrophobicContact CB-CB 4.33Å; N1438-E1441 HydrophobicContact CB-CG 3.83Å; N1438-E1441 VanDerWaalsContact CB-OE2 3.31Å; N1438-E1441 WeakPolarHBondContact CB-OE2 3.32Å; N1438-E1441 VanDerWaalsContact CG-CD 3.4Å; N1438-E1441 PolarHBondContact ND2-OE1 3.34Å; N1438-E1441 VanDerWaalsContact ND2-OE1 3.1Å; N1438-E1441 PolarHBondContact ND2-OE2 3.13Å; N1438-E1441 WeakPolarHBondContact O-CB 3.26Å; N1438-E1441 PolarHBondContact O-N 3.12Å; E1441-T1445 WeakPolarHBondContact O-CB 3.48Å; E1441-T1445 WeakPolarHBondContact O-CG2 3.41Å; E1441-T1445 PolarHBondContact O-N 3.02Å; E1441-T1445 PolarHBondContact O-OG1 2.94Å
1442	I	37.4	Very low	33.2	Very low	64 Å²	64	91.9 Å²	91.9	33%	0.328	48%	0.482	S	S	.	.	H	α-helix	trans	-78.5	-43.1	-173.8	-60.8	176.1	0	0	0	112.7	I919 N1440 T1445	I919-I1442 HydrophobicContact CD1-CD1 4.22Å; I919-I1442 HydrophobicContact CD1-CG2 4.4Å; N1440-I1442 PolarHBondContact O-N 3.29Å; I1442-T1445 PolarHBondContact O-OG1 3.1Å; I1442-T1445 VanDerWaalsContact O-OG1 3.07Å
1443	N	35.4	Very low	34	Very low	112 Å²	112	86.5 Å²	86.5	60%	0.599	47%	0.469	S	S	*	.	H	α-helix	trans	-76.8	-34.3	172	-85.7	-38	0	0	0	111.7	N1446 E1447	N1443-N1446 PolarHBondContact O-N 2.76Å; N1443-E1447 PolarHBondContact O-N 3.15Å
1444	L	37.6	Very low	34.9	Very low	61 Å²	61	84 Å²	84	32%	0.319	45%	0.454	S	S	.	.	H	α-helix	trans	-70.3	-29.7	176.1	-161	71.4	0	0	0	111.9	N1440 N1446 E1447 L1448	N1440-L1444 WeakPolarHBondContact O-CB 3.33Å; N1440-L1444 PolarHBondContact O-N 3.22Å; N1440-L1444 VanDerWaalsContact O-N 3.1Å; L1444-N1446 VanDerWaalsContact C-N 3.34Å; L1444-N1446 PolarHBondContact O-N 3.11Å; L1444-E1447 PolarHBondContact O-N 2.58Å; L1444-L1448 HydrophobicContact CB-CD1 4.46Å; L1444-L1448 HydrophobicContact CD2-CD1 4Å; L1444-L1448 HydrophobicContact CG-CD1 3.73Å; L1444-L1448 HydrophobicContact CG-CG 4.08Å; L1444-L1448 WeakPolarHBondContact O-CA 3.3Å; L1444-L1448 WeakPolarHBondContact O-CB 3.45Å; L1444-L1448 WeakPolarHBondContact O-CD1 3.49Å; L1444-L1448 WeakPolarHBondContact O-CG 3.13Å; L1444-L1448 PolarHBondContact O-N 3.07Å
1445	T	35.8	Very low	35.8	Very low	75 Å²	75	83 Å²	83	46%	0.46	44%	0.443	S	S	.	.	H	α-helix	trans	-67.9	-29.6	174.7	41.8	0	0	0	0	113.4	E1441 I1442 L1448 R1449	E1441-T1445 WeakPolarHBondContact O-CB 3.48Å; E1441-T1445 WeakPolarHBondContact O-CG2 3.41Å; E1441-T1445 PolarHBondContact O-N 3.02Å; E1441-T1445 PolarHBondContact O-OG1 2.94Å; I1442-T1445 PolarHBondContact O-OG1 3.1Å; I1442-T1445 VanDerWaalsContact O-OG1 3.07Å; T1445-L1448 PolarHBondContact O-N 2.73Å; T1445-R1449 PolarHBondContact O-N 2.9Å
1446	N	36.6	Very low	36.8	Very low	97 Å²	97	83.8 Å²	83.8	52%	0.519	45%	0.447	S	S	.	.	H	α-helix	trans	-75.6	-39.4	173.5	-79.6	-35.8	0	0	0	112.4	N1443 L1444 L1448 N1450	N1443-N1446 PolarHBondContact O-N 2.76Å; L1444-N1446 VanDerWaalsContact C-N 3.34Å; L1444-N1446 PolarHBondContact O-N 3.11Å; N1446-L1448 VanDerWaalsContact C-N 3.33Å; N1446-N1450 PolarHBondContact O-N 3.36Å
1447	E	39	Very low	37.5	Very low	92 Å²	92	84.8 Å²	84.8	43%	0.43	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-39.9	166.9	-82.5	-78.2	125.2	0	0	111.3	N1443 L1444 N1450 L1451	N1443-E1447 PolarHBondContact O-N 3.15Å; L1444-E1447 PolarHBondContact O-N 2.58Å; E1447-N1450 CarbonylContact O-C 3.46Å; E1447-N1450 WeakPolarHBondContact O-CB 3.17Å; E1447-N1450 PolarHBondContact O-N 3.04Å; E1447-L1451 WeakPolarHBondContact O-CB 3.42Å; E1447-L1451 PolarHBondContact O-N 3.34Å
1448	L	38.9	Very low	38.5	Very low	47 Å²	47	84.6 Å²	84.6	25%	0.246	44%	0.435	C	S	.	.	H	α-helix	trans	-73.5	-29.9	180	-74.2	165.9	0	0	0	113.6	Y755 L1444 T1445 N1446 N1450 L1451 N1452	Y755-L1448 HydrophobicContact CE1-CD1 3.88Å; Y755-L1448 HydrophobicContact CE1-CD2 4.22Å; L1444-L1448 HydrophobicContact CB-CD1 4.46Å; L1444-L1448 HydrophobicContact CD2-CD1 4Å; L1444-L1448 HydrophobicContact CG-CD1 3.73Å; L1444-L1448 HydrophobicContact CG-CG 4.08Å; L1444-L1448 WeakPolarHBondContact O-CA 3.3Å; L1444-L1448 WeakPolarHBondContact O-CB 3.45Å; L1444-L1448 WeakPolarHBondContact O-CD1 3.49Å; L1444-L1448 WeakPolarHBondContact O-CG 3.13Å; L1444-L1448 PolarHBondContact O-N 3.07Å; T1445-L1448 PolarHBondContact O-N 2.73Å; N1446-L1448 VanDerWaalsContact C-N 3.33Å; L1448-N1450 VanDerWaalsContact C-N 3.31Å; L1448-L1451 CarbonylContact O-C 3.44Å; L1448-L1451 PolarHBondContact O-N 2.85Å; L1448-N1452 WeakPolarHBondContact O-CB 3.32Å; L1448-N1452 PolarHBondContact O-N 2.95Å
1449	R	37.4	Very low	39.2	Very low	90 Å²	90	88 Å²	88	34%	0.34	45%	0.449	S	S	.	.	H	α-helix	trans	-62.6	-42.2	166.6	-117.8	179.8	-174.4	172.3	-0.9	110.3	R917 E1259 T1445 L1451 N1453	R917-R1449 VanDerWaalsContact NH2-NH2 3.13Å; E1259-R1449 IonicContact OE1-CZ 2.66Å; E1259-R1449 IonicContact OE1-NE 2.9Å; E1259-R1449 IonicContact OE1-NH2 3.85Å; E1259-R1449 PolarHBondContact OE1-NH2 2.72Å; E1259-R1449 IonicContact OE2-CZ 3.85Å; E1259-R1449 IonicContact OE2-NE 2.67Å; E1259-R1449 IonicContact OE2-NH2 3.82Å; E1259-R1449 PolarHBondContact OE2-NH2 2.9Å; T1445-R1449 PolarHBondContact O-N 2.9Å; R1449-L1451 VanDerWaalsContact C-N 3.29Å; R1449-L1451 PolarHBondContact O-N 3.41Å; R1449-N1453 WeakPolarHBondContact O-CB 3.37Å; R1449-N1453 PolarHBondContact O-N 2.7Å; R1449-N1453 VanDerWaalsContact O-N 3.1Å; R1449-N1453 PolarHBondContact O-OD1 2.76Å; R1449-N1453 VanDerWaalsContact O-OD1 3.11Å
1450	N	41.4	Very low	40.1	Very low	78 Å²	78	87.6 Å²	87.6	42%	0.417	45%	0.447	S	S	.	.	H	α-helix	trans	-73.2	-20.2	177.7	-148.4	-25.5	0	0	0	112.7	Q348 N1446 E1447 L1448 R1454	Q348-N1450 PolarHBondContact NE2-OD1 2.89Å; Q348-N1450 VanDerWaalsContact NE2-OD1 3.15Å; N1446-N1450 PolarHBondContact O-N 3.36Å; E1447-N1450 CarbonylContact O-C 3.46Å; E1447-N1450 WeakPolarHBondContact O-CB 3.17Å; E1447-N1450 PolarHBondContact O-N 3.04Å; L1448-N1450 VanDerWaalsContact C-N 3.31Å; N1450-R1454 WeakPolarHBondContact O-CD 3.29Å; N1450-R1454 WeakPolarHBondContact O-CG 3.48Å
1451	L	43.9	Very low	40.9	Very low	62 Å²	62	89.3 Å²	89.3	33%	0.325	45%	0.451	S	S	.	.	H	α-helix	trans	-88.2	-38.8	170.7	-87.4	159.6	0	0	0	112.9	E1447 L1448 R1449 R1454 L1455	E1447-L1451 WeakPolarHBondContact O-CB 3.42Å; E1447-L1451 PolarHBondContact O-N 3.34Å; L1448-L1451 CarbonylContact O-C 3.44Å; L1448-L1451 PolarHBondContact O-N 2.85Å; R1449-L1451 VanDerWaalsContact C-N 3.29Å; R1449-L1451 PolarHBondContact O-N 3.41Å; L1451-R1454 CarbonylContact O-C 3.55Å; L1451-R1454 WeakPolarHBondContact O-CA 3.19Å; L1451-R1454 WeakPolarHBondContact O-CB 3.43Å; L1451-R1454 PolarHBondContact O-N 2.91Å; L1451-L1455 HydrophobicContact CD2-CD1 4.38Å; L1451-L1455 PolarHBondContact O-N 2.81Å
1452	N	41.6	Very low	41.5	Very low	85 Å²	85	91.5 Å²	91.5	46%	0.455	46%	0.46	S	S	.	.	H	α-helix	trans	-59.9	-49.6	173.7	-101.9	28.7	0	0	0	110.4	L1448 R1454 L1455 E1456	L1448-N1452 WeakPolarHBondContact O-CB 3.32Å; L1448-N1452 PolarHBondContact O-N 2.95Å; N1452-R1454 PolarHBondContact O-N 3.33Å; N1452-L1455 PolarHBondContact O-N 2.95Å; N1452-E1456 PolarHBondContact O-N 3.45Å
1453	N	41.7	Very low	42.4	Very low	109 Å²	109	92.4 Å²	92.4	58%	0.583	47%	0.468	S	S	*	.	H	α-helix	trans	-62.4	-5.8	175.5	-62.8	15.2	0	0	0	113.1	R1449	R1449-N1453 WeakPolarHBondContact O-CB 3.37Å; R1449-N1453 PolarHBondContact O-N 2.7Å; R1449-N1453 VanDerWaalsContact O-N 3.1Å; R1449-N1453 PolarHBondContact O-OD1 2.76Å; R1449-N1453 VanDerWaalsContact O-OD1 3.11Å
1454	R	43.2	Very low	43.2	Very low	88 Å²	88	93.5 Å²	93.5	33%	0.332	47%	0.468	S	S	.	.	H	α-helix	trans	-110.4	-28	171.5	-66.1	177.5	68.9	175.2	-2.5	113	N1450 L1451 N1452 C1457 I1458	N1450-R1454 WeakPolarHBondContact O-CD 3.29Å; N1450-R1454 WeakPolarHBondContact O-CG 3.48Å; L1451-R1454 CarbonylContact O-C 3.55Å; L1451-R1454 WeakPolarHBondContact O-CA 3.19Å; L1451-R1454 WeakPolarHBondContact O-CB 3.43Å; L1451-R1454 PolarHBondContact O-N 2.91Å; N1452-R1454 PolarHBondContact O-N 3.33Å; R1454-C1457 WeakPolarHBondContact O-CB 3.31Å; R1454-C1457 PolarHBondContact O-N 3.19Å; R1454-I1458 WeakPolarHBondContact O-CD1 3.44Å; R1454-I1458 VanDerWaalsContact O-CG1 3.24Å; R1454-I1458 WeakPolarHBondContact O-CG1 3.4Å; R1454-I1458 PolarHBondContact O-N 3.43Å
1455	L	44	Very low	43.8	Very low	88 Å²	88	94.7 Å²	94.7	46%	0.461	47%	0.474	S	S	.	.	H	α-helix	trans	-72.9	-47.3	172.4	-105.4	77.5	0	0	0	110.3	L1451 N1452 C1457 I1458 E1459	L1451-L1455 HydrophobicContact CD2-CD1 4.38Å; L1451-L1455 PolarHBondContact O-N 2.81Å; N1452-L1455 PolarHBondContact O-N 2.95Å; L1455-C1457 PolarHBondContact O-N 3.28Å; L1455-C1457 VanDerWaalsContact O-N 3.16Å; L1455-I1458 CarbonylContact O-C 3.54Å; L1455-I1458 WeakPolarHBondContact O-CA 3.43Å; L1455-I1458 WeakPolarHBondContact O-CB 3.38Å; L1455-I1458 PolarHBondContact O-N 3.4Å; L1455-E1459 PolarHBondContact O-N 2.95Å
1456	E	44.6	Very low	44.4	Very low	106 Å²	106	97.2 Å²	97.2	50%	0.495	48%	0.479	S	S	.	.	H	α-helix	trans	-54.5	-36	169.9	-70.1	-176	149.6	0	0	111.2	N1452 L1460	N1452-E1456 PolarHBondContact O-N 3.45Å; E1456-L1460 VanDerWaalsContact O-CB 3.25Å; E1456-L1460 WeakPolarHBondContact O-CB 3.18Å; E1456-L1460 PolarHBondContact O-N 2.94Å
1457	C	39	Very low	45	Very low	79 Å²	79	99 Å²	99	53%	0.534	48%	0.482	S	S	.	.	H	α-helix	trans	-72.1	-29.5	176.7	-149.9	0	0	0	0	112.4	R1454 L1455 Q1461	R1454-C1457 WeakPolarHBondContact O-CB 3.31Å; R1454-C1457 PolarHBondContact O-N 3.19Å; L1455-C1457 PolarHBondContact O-N 3.28Å; L1455-C1457 VanDerWaalsContact O-N 3.16Å; C1457-Q1461 WeakPolarHBondContact O-CG 3.45Å; C1457-Q1461 PolarHBondContact O-N 2.88Å
1458	I	46.9	Very low	45.2	Very low	90 Å²	90	99.8 Å²	99.8	46%	0.462	49%	0.489	S	S	.	.	H	α-helix	trans	-80.8	-37.7	174.1	-73.1	164.7	0	0	0	110.8	R1454 L1455 Q1461 F1462	R1454-I1458 WeakPolarHBondContact O-CD1 3.44Å; R1454-I1458 VanDerWaalsContact O-CG1 3.24Å; R1454-I1458 WeakPolarHBondContact O-CG1 3.4Å; R1454-I1458 PolarHBondContact O-N 3.43Å; L1455-I1458 CarbonylContact O-C 3.54Å; L1455-I1458 WeakPolarHBondContact O-CA 3.43Å; L1455-I1458 WeakPolarHBondContact O-CB 3.38Å; L1455-I1458 PolarHBondContact O-N 3.4Å; I1458-Q1461 CarbonylContact O-C 3.49Å; I1458-Q1461 WeakPolarHBondContact O-CA 3.15Å; I1458-Q1461 WeakPolarHBondContact O-CB 3.31Å; I1458-Q1461 PolarHBondContact O-N 2.74Å; I1458-Q1461 VanDerWaalsContact O-N 3.11Å; I1458-F1462 HydrophobicContact CG2-CD2 3.75Å; I1458-F1462 HydrophobicContact CG2-CE2 4.04Å; I1458-F1462 WeakPolarHBondContact O-CD2 3.41Å; I1458-F1462 PolarHBondContact O-N 3.14Å
1459	E	43	Very low	45.6	Very low	126 Å²	126	101.6 Å²	101.6	59%	0.589	50%	0.498	S	S	*	.	H	α-helix	trans	-64.1	-45.3	169.9	-70.9	-172.1	136.7	0	0	110.5	L1455 Q1461 F1462 T1463	L1455-E1459 PolarHBondContact O-N 2.95Å; E1459-Q1461 PolarHBondContact O-N 3.22Å; E1459-Q1461 VanDerWaalsContact O-N 3.15Å; E1459-F1462 CarbonylContact O-C 3.6Å; E1459-F1462 PolarHBondContact O-N 2.71Å; E1459-F1462 VanDerWaalsContact O-N 3.09Å; E1459-T1463 WeakPolarHBondContact O-CB 3.48Å; E1459-T1463 PolarHBondContact O-N 3.42Å; E1459-T1463 PolarHBondContact O-OG1 2.81Å
1460	L	49.3	Very low	46.1	Very low	108 Å²	108	102.9 Å²	102.9	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-62.8	-19.3	171.2	-88.8	159.4	0	0	0	113.7	E1456 K1464	E1456-L1460 VanDerWaalsContact O-CB 3.25Å; E1456-L1460 WeakPolarHBondContact O-CB 3.18Å; E1456-L1460 PolarHBondContact O-N 2.94Å; L1460-K1464 VanDerWaalsContact O-CB 3.31Å; L1460-K1464 WeakPolarHBondContact O-CB 3.49Å; L1460-K1464 VanDerWaalsContact O-CD 3.32Å; L1460-K1464 WeakPolarHBondContact O-CD 3.27Å; L1460-K1464 WeakPolarHBondContact O-CG 3.27Å
1461	Q	48.3	Very low	46.2	Very low	140 Å²	140	103.2 Å²	103.2	65%	0.654	52%	0.516	S	S	*	.	H	α-helix	trans	-82.3	-46.2	167.9	-66.4	-99.7	-86.9	0	0	111.1	C1457 I1458 E1459 K1464 L1465	C1457-Q1461 WeakPolarHBondContact O-CG 3.45Å; C1457-Q1461 PolarHBondContact O-N 2.88Å; I1458-Q1461 CarbonylContact O-C 3.49Å; I1458-Q1461 WeakPolarHBondContact O-CA 3.15Å; I1458-Q1461 WeakPolarHBondContact O-CB 3.31Å; I1458-Q1461 PolarHBondContact O-N 2.74Å; I1458-Q1461 VanDerWaalsContact O-N 3.11Å; E1459-Q1461 PolarHBondContact O-N 3.22Å; E1459-Q1461 VanDerWaalsContact O-N 3.15Å; Q1461-K1464 CarbonylContact O-C 3.56Å; Q1461-K1464 PolarHBondContact O-N 3.4Å; Q1461-L1465 WeakPolarHBondContact O-CB 3.21Å; Q1461-L1465 PolarHBondContact O-N 3.12Å
1462	F	46.5	Very low	46.2	Very low	124 Å²	124	108.4 Å²	108.4	54%	0.544	54%	0.536	S	S	.	.	H	α-helix	trans	-69.2	-43.6	-179.1	-94.8	-81.1	0	0	0	113	I1458 E1459 K1464 L1465 F1466	I1458-F1462 HydrophobicContact CG2-CD2 3.75Å; I1458-F1462 HydrophobicContact CG2-CE2 4.04Å; I1458-F1462 WeakPolarHBondContact O-CD2 3.41Å; I1458-F1462 PolarHBondContact O-N 3.14Å; E1459-F1462 CarbonylContact O-C 3.6Å; E1459-F1462 PolarHBondContact O-N 2.71Å; E1459-F1462 VanDerWaalsContact O-N 3.09Å; F1462-K1464 VanDerWaalsContact C-N 3.27Å; F1462-K1464 PolarHBondContact O-N 3.34Å; F1462-L1465 CarbonylContact O-C 3.59Å; F1462-L1465 WeakPolarHBondContact O-CA 3.44Å; F1462-L1465 WeakPolarHBondContact O-CB 3.32Å; F1462-L1465 PolarHBondContact O-N 2.72Å; F1462-F1466 WeakPolarHBondContact O-CB 3.25Å; F1462-F1466 PolarHBondContact O-N 2.68Å
1463	T	57	Low	46	Very low	83 Å²	83	111.7 Å²	111.7	51%	0.509	55%	0.549	S	S	.	.	H	α-helix	trans	-66.4	-29.5	174	-50.7	0	0	0	0	111.5	E1459 K1467	E1459-T1463 WeakPolarHBondContact O-CB 3.48Å; E1459-T1463 PolarHBondContact O-N 3.42Å; E1459-T1463 PolarHBondContact O-OG1 2.81Å; T1463-K1467 WeakPolarHBondContact O-CB 3.41Å; T1463-K1467 WeakPolarHBondContact O-CG 3.2Å; T1463-K1467 PolarHBondContact O-N 3.3Å; T1463-K1467 VanDerWaalsContact O-N 3.13Å
1464	K	51.5	Low	45.4	Very low	135 Å²	135	116.1 Å²	116.1	59%	0.587	56%	0.563	S	S	*	*	H	α-helix	trans	-73.2	-35.3	168.1	-78.8	-177.4	-179.1	-178.6	0	112.5	L1460 Q1461 F1462 L1468	L1460-K1464 VanDerWaalsContact O-CB 3.31Å; L1460-K1464 WeakPolarHBondContact O-CB 3.49Å; L1460-K1464 VanDerWaalsContact O-CD 3.32Å; L1460-K1464 WeakPolarHBondContact O-CD 3.27Å; L1460-K1464 WeakPolarHBondContact O-CG 3.27Å; Q1461-K1464 CarbonylContact O-C 3.56Å; Q1461-K1464 PolarHBondContact O-N 3.4Å; F1462-K1464 VanDerWaalsContact C-N 3.27Å; F1462-K1464 PolarHBondContact O-N 3.34Å; K1464-L1468 WeakPolarHBondContact O-CB 3.38Å; K1464-L1468 PolarHBondContact O-N 2.88Å
1465	L	50.4	Low	44.8	Very low	87 Å²	87	122.8 Å²	122.8	46%	0.455	60%	0.604	S	S	.	*	H	α-helix	trans	-70.1	-44.6	177	-165.4	73.9	0	0	0	111.3	Q1461 F1462 L1468 I1469	Q1461-L1465 WeakPolarHBondContact O-CB 3.21Å; Q1461-L1465 PolarHBondContact O-N 3.12Å; F1462-L1465 CarbonylContact O-C 3.59Å; F1462-L1465 WeakPolarHBondContact O-CA 3.44Å; F1462-L1465 WeakPolarHBondContact O-CB 3.32Å; F1462-L1465 PolarHBondContact O-N 2.72Å; L1465-L1468 CarbonylContact O-C 3.55Å; L1465-L1468 WeakPolarHBondContact O-CA 3.31Å; L1465-L1468 WeakPolarHBondContact O-CB 3.25Å; L1465-L1468 PolarHBondContact O-N 3.41Å; L1465-I1469 HydrophobicContact CG-CD1 4.12Å; L1465-I1469 VanDerWaalsContact O-CG1 3.29Å; L1465-I1469 WeakPolarHBondContact O-CG1 3.39Å; L1465-I1469 PolarHBondContact O-N 2.73Å
1466	F	47.3	Very low	44.8	Very low	127 Å²	127	124.5 Å²	124.5	56%	0.557	61%	0.611	S	S	*	*	H	α-helix	trans	-58.8	-48.7	173.2	-118.2	-91	0	0	0	110.5	F1462 L1468 I1469 E1470	F1462-F1466 WeakPolarHBondContact O-CB 3.25Å; F1462-F1466 PolarHBondContact O-N 2.68Å; F1466-L1468 PolarHBondContact O-N 3.19Å; F1466-I1469 CarbonylContact O-C 3.56Å; F1466-I1469 WeakPolarHBondContact O-CA 3.29Å; F1466-I1469 PolarHBondContact O-N 3.14Å; F1466-E1470 WeakPolarHBondContact O-CG 3.49Å; F1466-E1470 PolarHBondContact O-N 3.05Å
1467	K	49.4	Very low	44.8	Very low	136 Å²	136	125.5 Å²	125.5	59%	0.591	62%	0.617	S	S	*	*	H	α-helix	trans	-63.9	-23.5	173.2	-72.5	-172.8	175	-167	0	113.9	T1463 S1471	T1463-K1467 WeakPolarHBondContact O-CB 3.41Å; T1463-K1467 WeakPolarHBondContact O-CG 3.2Å; T1463-K1467 PolarHBondContact O-N 3.3Å; T1463-K1467 VanDerWaalsContact O-N 3.13Å; K1467-S1471 VanDerWaalsContact O-CB 3.28Å; K1467-S1471 WeakPolarHBondContact O-CB 3.32Å; K1467-S1471 PolarHBondContact O-N 2.91Å; K1467-S1471 PolarHBondContact O-OG 2.87Å
1468	L	43.3	Very low	45.1	Very low	108 Å²	108	128.1 Å²	128.1	57%	0.565	62%	0.622	S	S	*	*	H	α-helix	trans	-78.8	-21.4	170.8	-123.8	82.2	0	0	0	113.7	K1464 L1465 F1466	K1464-L1468 WeakPolarHBondContact O-CB 3.38Å; K1464-L1468 PolarHBondContact O-N 2.88Å; L1465-L1468 CarbonylContact O-C 3.55Å; L1465-L1468 WeakPolarHBondContact O-CA 3.31Å; L1465-L1468 WeakPolarHBondContact O-CB 3.25Å; L1465-L1468 PolarHBondContact O-N 3.41Å; F1466-L1468 PolarHBondContact O-N 3.19Å
1469	I	48.7	Very low	45	Very low	84 Å²	84	130.3 Å²	130.3	43%	0.431	63%	0.631	S	S	.	*	H	α-helix	trans	-87.6	-47.7	177.6	-69.9	162.2	0	0	0	109.2	L1465 F1466 S1471 K1472 Q1473	L1465-I1469 HydrophobicContact CG-CD1 4.12Å; L1465-I1469 VanDerWaalsContact O-CG1 3.29Å; L1465-I1469 WeakPolarHBondContact O-CG1 3.39Å; L1465-I1469 PolarHBondContact O-N 2.73Å; F1466-I1469 CarbonylContact O-C 3.56Å; F1466-I1469 WeakPolarHBondContact O-CA 3.29Å; F1466-I1469 PolarHBondContact O-N 3.14Å; I1469-S1471 VanDerWaalsContact C-N 3.32Å; I1469-S1471 PolarHBondContact O-N 3.47Å; I1469-K1472 CarbonylContact O-C 3.55Å; I1469-K1472 WeakPolarHBondContact O-CA 3.45Å; I1469-K1472 PolarHBondContact O-N 2.8Å; I1469-Q1473 PolarHBondContact O-N 3.06Å
1470	E	46.7	Very low	45.2	Very low	117 Å²	117	130.6 Å²	130.6	55%	0.547	63%	0.634	S	S	.	*	H	α-helix	trans	-57.3	-42.2	172.6	-68.1	174.7	138.8	0	0	111.7	F1466 K1472 Q1473	F1466-E1470 WeakPolarHBondContact O-CG 3.49Å; F1466-E1470 PolarHBondContact O-N 3.05Å; E1470-K1472 PolarHBondContact O-N 2.82Å; E1470-K1472 VanDerWaalsContact O-N 3.14Å; E1470-Q1473 PolarHBondContact O-N 3.09Å
1471	S	43.4	Very low	44.9	Very low	85 Å²	85	132.1 Å²	132.1	59%	0.594	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	9.4	175.1	60.2	0	0	0	0	114.9	K1467 I1469	K1467-S1471 VanDerWaalsContact O-CB 3.28Å; K1467-S1471 WeakPolarHBondContact O-CB 3.32Å; K1467-S1471 PolarHBondContact O-N 2.91Å; K1467-S1471 PolarHBondContact O-OG 2.87Å; I1469-S1471 VanDerWaalsContact C-N 3.32Å; I1469-S1471 PolarHBondContact O-N 3.47Å
1472	K	44	Very low	44.6	Very low	172 Å²	172	131.5 Å²	131.5	75%	0.748	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.6	15.7	174.6	-77.6	-160.8	168.3	-159.2	0	114.6	I1469 E1470	I1469-K1472 CarbonylContact O-C 3.55Å; I1469-K1472 WeakPolarHBondContact O-CA 3.45Å; I1469-K1472 PolarHBondContact O-N 2.8Å; E1470-K1472 PolarHBondContact O-N 2.82Å; E1470-K1472 VanDerWaalsContact O-N 3.14Å
1473	Q	38.8	Very low	44.5	Very low	153 Å²	153	132.1 Å²	132.1	72%	0.715	65%	0.645	S	S	*	*	S	Bend	trans	-118.1	35.2	168.1	-63.3	-166.6	-91.8	0	0	112.2	I1469 E1470	I1469-Q1473 PolarHBondContact O-N 3.06Å; E1470-Q1473 PolarHBondContact O-N 3.09Å
1474	F	28.3	Very low	43.5	Very low	202 Å²	202	136.2 Å²	136.2	89%	0.886	66%	0.656	S	S	*	*			trans	-117.8	41.9	172.5	-120.4	-83.9	0	0	0	111.5
1475	L	29.8	Very low	42.7	Very low	228 Å²	228	136.3 Å²	136.3	100%	1.194	66%	0.662	S	S	*	*			trans	-161.6	0	166.7	-115.2	169.3	0	0	0	107.9

Retrieved 1,475 of 1,475 residues in 1280.2 ms (Link to these results)

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